A0A077Z5T2_TRITR Loading...

Cohesin subunit SA 1

AlphaFold DB , UniProt , Accession A0A077Z5T2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,106 aa.

						>A0A077Z5T2_TRITR|A0A077Z5T2
MTDSPSNSSPARPMRLAKQGAIESISSFIGAKSRSPSNTSSRISDRDSKRSLANSSSESVAKRGRLSSVRGRPRGRPPRQPSAPVDTTASLFSLVRDGKASLVQVADDWIENYMSDREVAVMDLLQYFISSCGCKGVVSLDMIQSSDFILLVRRMTEDFDEESVDYPLILTGSHWRRFRQNFCDFITTLVRQCQYSIIYDQYMMDSVISLLTHLADSHARAFRHTATLAAMKMVTALAEIAVRLDQSLSSVTQQFENERSRQRKSNQRLEALQQKKQEYTENKDEIVNMIEYLFQCVFVQRYKDVVPDIRCICVTELGVWMLSYPEHFLVDARLKYIGWTLYDKVGEVRMKCLKTLLPLYEEEQFTSNLKMFTPKFKTRLLSMVLDREPENGVLAIKILMKIYKQADSDSLPLHIECDTIYACVYAAHRGLALTAGEFFLLDLTSATGRKRKVDVRNVLFKLVDFHIRSNIHTHTAFLVDALFESCDYVRNWSAMTDLLLLESSEENRALDERGESTLIDIMAFSVKQASTGEPPAGRTVSKKYITQREHRQWLEDQERITEHFAMTLPQLLHKFVVNTQDVINLLTIAQYFHMNVYAASVYSNPLESLLKCIEELFAKHTDEEVLANCSKTYECLCSGQLPVHVRSVVTRSKIIDSTVLKFREDMQNFNANLGKVDDEDFASTLASLRRVEALYQCHDLSKWKIWDMAFPLIRNSDAYARPIDHNLVVLATRTCFWILLWDLLAIENGNLEEEAISSLKQRLGELVTCCRTMILSNMGEVAGTAYLVLCDLLLIFGWTVGQEIAELKTLIFIVKPDLEDELQAFLGKWVFCSDQTDIDRNDPDQIEILRKRRSFLASYSKLIVWSVLSIRSATEVFKNYAEYYNDYGEIIKMTIAKCREKDKIACARSMTDALCSLYQKLCGNVPPEERADNLAPVRELIRRFGTSMGTDLIRCRELVVMINRCGIIFASQRDGPDLPNIHFLEVLSETCNKLLPQDKKLVLQYLNEAFGFIEANDDDRFRPLVMFKEVLSLGDEEQRTTAAASTLVSNNDSTMQSSAGKRPRNDDSAGTPRSVSLSTLTGAGGREINPLLEVDEMLEDEGDQSL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.6	Very low	29.7	Very low	231 Å²	231	118.4 Å²	118.4	100%	1.138	72%	0.721	S	S	*	*				0	85	0	-81.4	-175.9	164.8	0	0	108
2	T	30.2	Very low	30.3	Very low	136 Å²	136	116.2 Å²	116.2	83%	0.834	69%	0.689	S	S	*	*			trans	151.4	90.9	168.4	39.7	0	0	0	0	104.2
3	D	28.9	Very low	30.4	Very low	159 Å²	159	107.4 Å²	107.4	85%	0.85	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-79.2	136.9	-174	-57.8	-51.4	0	0	0	110.6
4	S	24.4	Very low	31.2	Very low	114 Å²	114	101.5 Å²	101.5	80%	0.797	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-88.2	125.6	174.6	-55.1	0	0	0	0	109.3
5	P	29	Very low	31.7	Very low	123 Å²	123	101.7 Å²	101.7	80%	0.799	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-72.4	134.6	173.5	29.9	-32.7	0	0	0	110
6	S	27.3	Very low	32	Very low	107 Å²	107	100.6 Å²	100.6	75%	0.748	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-70.5	130.8	177.5	47.1	0	0	0	0	111.7	S8	S6-S8 PolarHBondContact O-N 2.87Å
7	N	26.3	Very low	32.2	Very low	151 Å²	151	95.2 Å²	95.2	81%	0.807	55%	0.548	S	S	*	.			trans	-68	97.7	165.5	-84.9	-20.8	0	0	0	109.5
8	S	27.6	Very low	32.3	Very low	94 Å²	94	92 Å²	92	66%	0.657	53%	0.527	S	S	*	.			trans	-83.9	125	164.3	44.4	0	0	0	0	110	S6	S6-S8 PolarHBondContact O-N 2.87Å
9	S	29.9	Very low	32.4	Very low	83 Å²	83	90.6 Å²	90.6	58%	0.58	52%	0.515	S	S	*	.			trans	-77.6	123.2	173.5	-175.2	0	0	0	0	109.7	A11	S9-A11 VanDerWaalsContact C-N 3.26Å; S9-A11 PolarHBondContact O-N 3.06Å
10	P	29.3	Very low	32.2	Very low	82 Å²	82	86.6 Å²	86.6	53%	0.532	50%	0.495	S	S	.	.			trans	-82.2	70.8	-176.5	34.1	-35	0	0	0	110.2
11	A	44.8	Very low	32.1	Very low	22 Å²	22	85.1 Å²	85.1	18%	0.182	49%	0.493	C	S	.	.			trans	-110.4	-42.7	-160.1	0	0	0	0	0	116.1	S9 R15	S9-A11 VanDerWaalsContact C-N 3.26Å; S9-A11 PolarHBondContact O-N 3.06Å; A11-R15 HydrophobicContact CB-CG 4.29Å; A11-R15 WeakPolarHBondContact O-CA 3.48Å; A11-R15 WeakPolarHBondContact O-CB 3.32Å; A11-R15 WeakPolarHBondContact O-CG 3.48Å; A11-R15 PolarHBondContact O-N 3.22Å
12	R	37.1	Very low	32.3	Very low	92 Å²	92	75.8 Å²	75.8	35%	0.347	45%	0.448	S	S	.	.	H	α-helix	trans	-67.3	-50.1	-152.9	-150.2	178.4	-170.4	-145	4.1	116.7	R15 L16 E803	R12-R15 PolarHBondContact O-N 3.41Å; R12-L16 HydrophobicContact CG-CD1 4.39Å; R12-L16 WeakPolarHBondContact O-CB 3.49Å; R12-L16 WeakPolarHBondContact O-CG 3.33Å; R12-L16 PolarHBondContact O-N 3.38Å; R12-E803 WeakPolarHBondContact CD-OE2 3.48Å; R12-E803 IonicContact CZ-OE1 2.7Å; R12-E803 IonicContact CZ-OE2 3.17Å; R12-E803 VanDerWaalsContact CZ-OE2 3.25Å; R12-E803 IonicContact NE-OE1 3.54Å; R12-E803 IonicContact NE-OE2 2.68Å; R12-E803 IonicContact NH1-OE1 2.72Å; R12-E803 PolarHBondContact NH1-OE1 3.01Å; R12-E803 VanDerWaalsContact NH1-OE1 3.14Å; R12-E803 IonicContact NH1-OE2 3.37Å; R12-E803 PolarHBondContact NH1-OE2 3.31Å; R12-E803 IonicContact NH2-OE1 3.53Å; R12-E803 PolarHBondContact NH2-OE1 2.92Å
13	P	31.5	Very low	32.4	Very low	2 Å²	2	73.2 Å²	73.2	1%	0.013	43%	0.426	C	S	.	.	H	α-helix	trans	-73	-41.4	-179.1	-20.2	35.5	0	0	0	112.4	L16 A17 L743 L744 E747	P13-L16 PolarHBondContact O-N 3.41Å; P13-A17 WeakPolarHBondContact O-CB 3.19Å; P13-A17 PolarHBondContact O-N 3.35Å; P13-L743 HydrophobicContact CB-CD2 4.09Å; P13-L743 HydrophobicContact CB-CG 4.29Å; P13-L743 HydrophobicContact CG-CD2 4.41Å; P13-L743 HydrophobicContact CG-CG 4.21Å; P13-L744 HydrophobicContact CG-CB 4.34Å; P13-L744 HydrophobicContact CG-CD1 4.24Å; P13-E747 WeakPolarHBondContact CD-OE2 3.37Å; P13-E747 HydrophobicContact CG-CG 4.32Å; P13-E747 WeakPolarHBondContact CG-OE2 3.38Å
14	M	41.4	Very low	32.6	Very low	25 Å²	25	66.2 Å²	66.2	12%	0.123	39%	0.39	C	S	.	.	H	α-helix	trans	-67.7	-34.8	174.7	-79.9	-176.1	78.4	0	0	111.7	K18 W741 L744	M14-K18 WeakPolarHBondContact O-CA 3.46Å; M14-K18 WeakPolarHBondContact O-CB 3.27Å; M14-K18 VanDerWaalsContact O-CG 3.25Å; M14-K18 WeakPolarHBondContact O-CG 3.35Å; M14-K18 PolarHBondContact O-N 2.75Å; M14-W741 HydrophobicContact CE-CH2 3.92Å; M14-W741 HydrophobicContact CE-CZ2 3.74Å; M14-W741 HydrophobicContact SD-CE3 4.45Å; M14-W741 HydrophobicContact SD-CH2 3.45Å; M14-W741 WeakPolarHBondContact SD-CH2 3.44Å; M14-W741 HydrophobicContact SD-CZ2 3.69Å; M14-W741 HydrophobicContact SD-CZ3 3.86Å; M14-L744 HydrophobicContact CG-CD2 4.06Å; M14-L744 HydrophobicContact SD-CD2 3.7Å
15	R	39.8	Very low	33	Very low	104 Å²	104	63.2 Å²	63.2	39%	0.392	36%	0.364	S	S	.	.	H	α-helix	trans	-66.1	-41.6	168.7	-84.6	-168.7	173.5	169.3	-6.6	111.1	A11 R12 Q19	A11-R15 HydrophobicContact CB-CG 4.29Å; A11-R15 WeakPolarHBondContact O-CA 3.48Å; A11-R15 WeakPolarHBondContact O-CB 3.32Å; A11-R15 WeakPolarHBondContact O-CG 3.48Å; A11-R15 PolarHBondContact O-N 3.22Å; R12-R15 PolarHBondContact O-N 3.41Å; R15-Q19 WeakPolarHBondContact O-CA 3.32Å; R15-Q19 WeakPolarHBondContact O-CB 3.22Å; R15-Q19 WeakPolarHBondContact O-CG 3.28Å; R15-Q19 PolarHBondContact O-N 3.17Å; R15-Q19 PolarHBondContact O-OE1 2.88Å
16	L	35.7	Very low	33	Very low	84 Å²	84	60.9 Å²	60.9	44%	0.44	35%	0.351	S	S	.	.	H	α-helix	trans	-67.8	-36.1	177.7	-78.1	166.2	0	0	0	113.3	R12 P13 G20	R12-L16 HydrophobicContact CG-CD1 4.39Å; R12-L16 WeakPolarHBondContact O-CB 3.49Å; R12-L16 WeakPolarHBondContact O-CG 3.33Å; R12-L16 PolarHBondContact O-N 3.38Å; P13-L16 PolarHBondContact O-N 3.41Å; L16-G20 VanDerWaalsContact O-CA 3.29Å; L16-G20 WeakPolarHBondContact O-CA 3.46Å; L16-G20 PolarHBondContact O-N 3.41Å
17	A	35.1	Very low	33.2	Very low	10 Å²	10	59.1 Å²	59.1	8%	0.083	34%	0.339	C	S	.	.	H	α-helix	trans	-73	-47.7	173.2	0	0	0	0	0	112	P13 G20 A21 L740 I795	P13-A17 WeakPolarHBondContact O-CB 3.19Å; P13-A17 PolarHBondContact O-N 3.35Å; A17-G20 PolarHBondContact O-N 3.42Å; A17-A21 PolarHBondContact O-N 2.92Å; A17-A21 VanDerWaalsContact O-N 3.08Å; A17-L740 HydrophobicContact CB-CD1 3.48Å; A17-L740 VanDerWaalsContact CB-CD1 3.48Å; A17-L740 HydrophobicContact CB-CD2 4.45Å; A17-I795 HydrophobicContact CB-CD1 4.01Å
18	K	35.3	Very low	33.4	Very low	37 Å²	37	54.9 Å²	54.9	16%	0.161	31%	0.313	C	S	.	.	H	α-helix	trans	-66.5	-45.3	177.3	-67.4	-171.5	-179.8	-179.1	0	110.9	M14 G20 A21 I22 E634 V1094	M14-K18 WeakPolarHBondContact O-CA 3.46Å; M14-K18 WeakPolarHBondContact O-CB 3.27Å; M14-K18 VanDerWaalsContact O-CG 3.25Å; M14-K18 WeakPolarHBondContact O-CG 3.35Å; M14-K18 PolarHBondContact O-N 2.75Å; K18-G20 PolarHBondContact O-N 3.3Å; K18-A21 PolarHBondContact O-N 2.97Å; K18-I22 HydrophobicContact CB-CD1 3.88Å; K18-I22 WeakPolarHBondContact O-CA 3.49Å; K18-I22 WeakPolarHBondContact O-CB 3.43Å; K18-I22 WeakPolarHBondContact O-CD1 3.49Å; K18-I22 WeakPolarHBondContact O-CG1 3.41Å; K18-I22 PolarHBondContact O-N 2.99Å; K18-E634 IonicContact NZ-OE1 2.8Å; K18-E634 PolarHBondContact NZ-OE1 2.81Å; K18-V1094 HydrophobicContact CD-CG2 3.75Å
19	Q	33.1	Very low	33.6	Very low	65 Å²	65	53.7 Å²	53.7	30%	0.304	30%	0.299	S	S	.	.	H	α-helix	trans	-64.1	-36.8	170.3	-70	173.5	-85.3	0	0	112	R15 A21 I22 E23	R15-Q19 WeakPolarHBondContact O-CA 3.32Å; R15-Q19 WeakPolarHBondContact O-CB 3.22Å; R15-Q19 WeakPolarHBondContact O-CG 3.28Å; R15-Q19 PolarHBondContact O-N 3.17Å; R15-Q19 PolarHBondContact O-OE1 2.88Å; Q19-A21 PolarHBondContact O-N 2.85Å; Q19-I22 PolarHBondContact O-N 3.22Å; Q19-E23 HydrophobicContact CB-CG 3.87Å; Q19-E23 HydrophobicContact CG-CG 4.21Å; Q19-E23 PolarHBondContact NE2-OE1 2.96Å; Q19-E23 VanDerWaalsContact O-CB 3.24Å; Q19-E23 WeakPolarHBondContact O-CB 3.48Å; Q19-E23 PolarHBondContact O-N 3.23Å
20	G	29.5	Very low	33.6	Very low	10 Å²	10	52.8 Å²	52.8	10%	0.103	30%	0.303	C	S	.	.	H	α-helix	trans	-52.9	-38.6	172.6	0	0	0	0	0	112.8	L16 A17 K18 S24 K861	L16-G20 VanDerWaalsContact O-CA 3.29Å; L16-G20 WeakPolarHBondContact O-CA 3.46Å; L16-G20 PolarHBondContact O-N 3.41Å; A17-G20 PolarHBondContact O-N 3.42Å; K18-G20 PolarHBondContact O-N 3.3Å; G20-S24 WeakPolarHBondContact O-CB 3.43Å; G20-K861 PolarHBondContact O-NZ 3.3Å
21	A	30	Very low	33.4	Very low	57 Å²	57	52.8 Å²	52.8	47%	0.471	31%	0.309	S	S	.	.	H	α-helix	trans	-86.1	-44.4	173.1	0	0	0	0	0	114	A17 K18 Q19 S24	A17-A21 PolarHBondContact O-N 2.92Å; A17-A21 VanDerWaalsContact O-N 3.08Å; K18-A21 PolarHBondContact O-N 2.97Å; Q19-A21 PolarHBondContact O-N 2.85Å; A21-S24 WeakPolarHBondContact O-CB 3.35Å
22	I	31.2	Very low	32.6	Very low	35 Å²	35	61.2 Å²	61.2	18%	0.179	34%	0.342	C	S	.	.	H	α-helix	trans	-76.8	-42.8	-170.5	-67.3	167.3	0	0	0	112.5	K18 Q19 S24 S26 L1092 V1094	K18-I22 HydrophobicContact CB-CD1 3.88Å; K18-I22 WeakPolarHBondContact O-CA 3.49Å; K18-I22 WeakPolarHBondContact O-CB 3.43Å; K18-I22 WeakPolarHBondContact O-CD1 3.49Å; K18-I22 WeakPolarHBondContact O-CG1 3.41Å; K18-I22 PolarHBondContact O-N 2.99Å; Q19-I22 PolarHBondContact O-N 3.22Å; I22-S24 PolarHBondContact O-N 3.16Å; I22-S26 PolarHBondContact O-OG 2.92Å; I22-L1092 HydrophobicContact CB-CD2 4.24Å; I22-L1092 HydrophobicContact CG1-CD2 3.64Å; I22-V1094 HydrophobicContact CD1-CG2 4.25Å
23	E	32.7	Very low	32.1	Very low	81 Å²	81	62.1 Å²	62.1	38%	0.379	36%	0.362	S	S	.	.	H	α-helix	trans	-74.5	-18.6	177.5	-61.3	-172.3	168	0	0	112.4	Q19 I25 S27	Q19-E23 HydrophobicContact CB-CG 3.87Å; Q19-E23 HydrophobicContact CG-CG 4.21Å; Q19-E23 PolarHBondContact NE2-OE1 2.96Å; Q19-E23 VanDerWaalsContact O-CB 3.24Å; Q19-E23 WeakPolarHBondContact O-CB 3.48Å; Q19-E23 PolarHBondContact O-N 3.23Å; E23-I25 PolarHBondContact O-N 3.46Å; E23-S27 PolarHBondContact O-OG 2.68Å; E23-S27 VanDerWaalsContact O-OG 3.1Å
24	S	33.9	Very low	31.9	Very low	13 Å²	13	72.4 Å²	72.4	9%	0.091	40%	0.401	C	S	.	.	H	α-helix	trans	-62.8	-11.7	-176.1	-153.4	0	0	0	0	114.4	G20 A21 I22 K861	G20-S24 WeakPolarHBondContact O-CB 3.43Å; A21-S24 WeakPolarHBondContact O-CB 3.35Å; I22-S24 PolarHBondContact O-N 3.16Å; S24-K861 WeakPolarHBondContact OG-CE 3.49Å; S24-K861 PolarHBondContact OG-NZ 3.35Å
25	I	32	Very low	31.1	Very low	51 Å²	51	75.1 Å²	75.1	26%	0.262	42%	0.422	S	S	.	.	H	α-helix	trans	-132.6	-35.3	-178	-57.4	-178.1	0	0	0	112.5	E23 I29 R850	E23-I25 PolarHBondContact O-N 3.46Å; I25-I29 HydrophobicContact CG2-CD1 4.23Å; I25-I29 WeakPolarHBondContact O-CD1 3.49Å; I25-I29 WeakPolarHBondContact O-CG1 3.38Å; I25-R850 HydrophobicContact CD1-CG 4.37Å
26	S	29.1	Very low	30.3	Very low	74 Å²	74	76.1 Å²	76.1	52%	0.517	44%	0.442	S	S	.	.	H	α-helix	trans	-83.4	-45.4	-172.4	70.1	0	0	0	0	114	I22	I22-S26 PolarHBondContact O-OG 2.92Å
27	S	31.3	Very low	29.9	Very low	70 Å²	70	76.1 Å²	76.1	49%	0.49	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-33.2	-177.5	69.7	0	0	0	0	112.7	E23 I29	E23-S27 PolarHBondContact O-OG 2.68Å; E23-S27 VanDerWaalsContact O-OG 3.1Å; S27-I29 VanDerWaalsContact C-N 3.31Å; S27-I29 PolarHBondContact O-N 3.43Å
28	F	30.6	Very low	29.5	Very low	62 Å²	62	82.7 Å²	82.7	27%	0.272	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-17.7	-179.1	-104.7	-103.3	0	0	0	115.1	M893	F28-M893 HydrophobicContact CD1-CB 4.4Å; F28-M893 HydrophobicContact CD1-CG 4.3Å; F28-M893 HydrophobicContact CE1-CB 3.82Å; F28-M893 HydrophobicContact CE1-CG 3.56Å; F28-M893 HydrophobicContact CZ-CG 3.8Å
29	I	32.1	Very low	29.2	Very low	69 Å²	69	86.2 Å²	86.2	35%	0.354	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-2.1	-172.1	-56.2	179.9	0	0	0	112.4	I25 S27	I25-I29 HydrophobicContact CG2-CD1 4.23Å; I25-I29 WeakPolarHBondContact O-CD1 3.49Å; I25-I29 WeakPolarHBondContact O-CG1 3.38Å; S27-I29 VanDerWaalsContact C-N 3.31Å; S27-I29 PolarHBondContact O-N 3.43Å
30	G	29	Very low	29	Very low	64 Å²	64	88.8 Å²	88.8	66%	0.66	53%	0.533	S	S	*	.			trans	-83.2	-15.2	-176.8	0	0	0	0	0	116.6	K32	G30-K32 PolarHBondContact O-N 3.42Å; G30-K32 VanDerWaalsContact O-N 3.1Å
31	A	26.6	Very low	28.9	Very low	82 Å²	82	92.6 Å²	92.6	68%	0.678	56%	0.558	S	S	*	*			trans	-89.2	69.6	-167.4	0	0	0	0	0	114.3	S33	A31-S33 PolarHBondContact O-N 3.32Å
32	K	28.4	Very low	28.8	Very low	198 Å²	198	101.6 Å²	101.6	86%	0.861	58%	0.58	S	S	*	*			trans	-56.3	132.9	158.1	-85.9	-175.8	176.9	176.6	0	108.9	G30 R34	G30-K32 PolarHBondContact O-N 3.42Å; G30-K32 VanDerWaalsContact O-N 3.1Å; K32-R34 PolarHBondContact O-N 3.02Å
33	S	25.6	Very low	28.7	Very low	111 Å²	111	105.3 Å²	105.3	78%	0.776	60%	0.599	S	S	*	*			trans	-60.6	104.4	-177.1	53.6	0	0	0	0	111.4	A31 S35	A31-S33 PolarHBondContact O-N 3.32Å; S33-S35 PolarHBondContact O-N 3.37Å; S33-S35 VanDerWaalsContact O-N 3.13Å
34	R	26.5	Very low	28.5	Very low	218 Å²	218	105.9 Å²	105.9	82%	0.823	61%	0.612	S	S	*	*			trans	-73.3	97.2	169.5	-77.4	-178.1	168.4	177.4	-3.2	109.7	K32	K32-R34 PolarHBondContact O-N 3.02Å
35	S	24.7	Very low	28.2	Very low	82 Å²	82	112.6 Å²	112.6	57%	0.573	65%	0.647	S	S	*	*			trans	-68.2	136	146.8	45.6	0	0	0	0	108.3	S33 S37	S33-S35 PolarHBondContact O-N 3.37Å; S33-S35 VanDerWaalsContact O-N 3.13Å; S35-S37 PolarHBondContact O-N 3.48Å; S35-S37 VanDerWaalsContact O-N 3.07Å
36	P	24.8	Very low	28.1	Very low	125 Å²	125	121.1 Å²	121.1	81%	0.812	68%	0.676	S	S	*	*			trans	-86.6	66.1	-173.1	34.5	-36.1	0	0	0	112.7	N38	P36-N38 PolarHBondContact O-N 2.89Å
37	S	26.9	Very low	28.2	Very low	85 Å²	85	125.5 Å²	125.5	59%	0.594	69%	0.693	S	S	*	*			trans	-85.5	83.6	171.2	53.6	0	0	0	0	111.8	S35 T39	S35-S37 PolarHBondContact O-N 3.48Å; S35-S37 VanDerWaalsContact O-N 3.07Å; S37-T39 PolarHBondContact O-N 2.69Å
38	N	26.8	Very low	28	Very low	148 Å²	148	127.3 Å²	127.3	79%	0.791	71%	0.706	S	S	*	*			trans	-67	105.9	171.8	-96.2	-42	0	0	0	111.8	P36	P36-N38 PolarHBondContact O-N 2.89Å
39	T	27.4	Very low	28.1	Very low	110 Å²	110	134.5 Å²	134.5	68%	0.675	74%	0.737	S	S	*	*			trans	-172	66.5	143.8	24.2	0	0	0	0	112.8	S37 S41	S37-T39 PolarHBondContact O-N 2.69Å; T39-S41 PolarHBondContact O-N 2.99Å
40	S	28.9	Very low	27.9	Very low	119 Å²	119	143 Å²	143	83%	0.832	77%	0.765	S	S	*	*			trans	-82.3	109.4	157.7	-176.8	0	0	0	0	109.1	R42	S40-R42 PolarHBondContact O-N 3.39Å
41	S	28.9	Very low	28.1	Very low	91 Å²	91	145.6 Å²	145.6	64%	0.636	77%	0.773	S	S	*	*			trans	-66.9	109.9	169.7	55.1	0	0	0	0	109.1	T39 I43	T39-S41 PolarHBondContact O-N 2.99Å; S41-I43 VanDerWaalsContact C-N 3.27Å; S41-I43 PolarHBondContact O-N 3.09Å
42	R	27.1	Very low	28.3	Very low	246 Å²	246	149.8 Å²	149.8	93%	0.928	78%	0.783	S	S	*	*			trans	-61.1	93.3	161.5	-74.1	-177.7	176.3	177.5	-2	108.2	S40 S44	S40-R42 PolarHBondContact O-N 3.39Å; R42-S44 PolarHBondContact O-N 3.17Å
43	I	29.1	Very low	28.6	Very low	113 Å²	113	145.2 Å²	145.2	58%	0.579	78%	0.782	S	S	*	*			trans	-72.5	103.7	160	-63.4	176.8	0	0	0	104.7	S41 D45	S41-I43 VanDerWaalsContact C-N 3.27Å; S41-I43 PolarHBondContact O-N 3.09Å; I43-D45 PolarHBondContact O-N 3.37Å
44	S	29.3	Very low	28.7	Very low	93 Å²	93	148 Å²	148	65%	0.65	79%	0.789	S	S	*	*			trans	-81.3	101.9	171.2	54	0	0	0	0	108.2	R42 R46	R42-S44 PolarHBondContact O-N 3.17Å; S44-R46 PolarHBondContact O-N 3.2Å
45	D	28.2	Very low	29.2	Very low	154 Å²	154	143.6 Å²	143.6	82%	0.824	79%	0.791	S	S	*	*			trans	-62.4	103.2	162	-67.1	-33.6	0	0	0	107.6	I43	I43-D45 PolarHBondContact O-N 3.37Å
46	R	28.6	Very low	29.4	Very low	229 Å²	229	145.2 Å²	145.2	86%	0.864	80%	0.802	S	S	*	*			trans	-116.8	78.8	169.7	-102.2	-169	170	-169.9	-2.9	108.4	S44	S44-R46 PolarHBondContact O-N 3.2Å
47	D	31.2	Very low	29.8	Very low	166 Å²	166	144.5 Å²	144.5	89%	0.888	80%	0.8	S	S	*	*			trans	-64.4	142.9	171.5	-144.5	-18.1	0	0	0	110.5
48	S	28.2	Very low	30.2	Very low	109 Å²	109	148.7 Å²	148.7	76%	0.762	81%	0.81	S	S	*	*			trans	-97.7	115.4	-162.2	-72.7	0	0	0	0	113
49	K	32.6	Very low	30.7	Very low	212 Å²	212	146.3 Å²	146.3	92%	0.922	81%	0.805	S	S	*	*			trans	-129.4	124.6	158.7	-81.8	-174.9	177.6	170.7	0	112.5
50	R	28.2	Very low	31	Very low	248 Å²	248	147.7 Å²	147.7	94%	0.936	81%	0.813	S	S	*	*			trans	-69.6	140.4	178.7	-68.3	167.4	163.8	166.2	-6.6	112
51	S	32.3	Very low	31.2	Very low	119 Å²	119	146.1 Å²	146.1	83%	0.832	81%	0.808	S	S	*	*			trans	-151.3	142.9	136.8	61.5	0	0	0	0	110.2
52	L	30.7	Very low	31.5	Very low	170 Å²	170	151.9 Å²	151.9	89%	0.89	82%	0.821	S	S	*	*			trans	-91	145.1	-179.9	-58.8	91.4	0	0	0	110.6
53	A	34	Very low	31.8	Very low	101 Å²	101	152.1 Å²	152.1	84%	0.835	82%	0.822	S	S	*	*			trans	-170.9	132.5	136.3	0	0	0	0	0	111.3
54	N	29.2	Very low	32	Very low	171 Å²	171	150.6 Å²	150.6	91%	0.914	83%	0.834	S	S	*	*			trans	-81	142.7	166.6	-85.2	-20.4	0	0	0	110.8
55	S	35.5	Very low	32.2	Very low	125 Å²	125	157.6 Å²	157.6	87%	0.874	85%	0.847	S	S	*	*			trans	-158.3	154.7	136.9	58.8	0	0	0	0	110.6
56	S	30.5	Very low	32.6	Very low	116 Å²	116	158.9 Å²	158.9	81%	0.811	85%	0.852	S	S	*	*			trans	-141.3	121.3	-163.1	56.3	0	0	0	0	113.4
57	S	33.1	Very low	32.9	Very low	109 Å²	109	153.4 Å²	153.4	76%	0.762	85%	0.849	S	S	*	*			trans	-169.9	156.7	161.9	52.9	0	0	0	0	106.8
58	E	35.2	Very low	33.2	Very low	173 Å²	173	151.2 Å²	151.2	81%	0.808	85%	0.847	S	S	*	*			cis	-161.7	164.8	17.4	-142.8	155.6	-147.1	0	0	112
59	S	37	Very low	33.6	Very low	98 Å²	98	152.1 Å²	152.1	69%	0.685	85%	0.848	S	S	*	*			trans	22.5	125.5	157.8	57.6	0	0	0	0	121.7
60	V	33.3	Very low	33.6	Very low	140 Å²	140	153.5 Å²	153.5	85%	0.848	85%	0.847	S	S	*	*				82.9	98.8	50.9	-179.2	0	0	0	0	116.8
61	A	33.5	Very low	34	Very low	86 Å²	86	145.5 Å²	145.5	71%	0.711	84%	0.842	S	S	*	*			trans	63.1	131.7	140.2	0	0	0	0	0	123.8
62	K	35.6	Very low	34.1	Very low	212 Å²	212	150.8 Å²	150.8	92%	0.922	84%	0.843	S	S	*	*				-166.3	157.3	104.5	-103	165.2	-174	173	0	114.2
63	R	32.1	Very low	34.5	Very low	251 Å²	251	148.6 Å²	148.6	95%	0.947	84%	0.839	S	S	*	*			trans	-91.2	153.6	-177.5	-72.7	171.9	166	163.5	-4.8	112.6
64	G	34.5	Very low	34.5	Very low	81 Å²	81	155.1 Å²	155.1	84%	0.835	84%	0.842	S	S	*	*			trans	-138.8	134.6	153.9	0	0	0	0	0	110
65	R	32.5	Very low	34.9	Very low	240 Å²	240	150.8 Å²	150.8	91%	0.906	84%	0.838	S	S	*	*			trans	-146.5	124.1	-172.1	-171.5	-165.2	-158.7	-168.3	8.3	110
66	L	37.6	Very low	34.9	Very low	180 Å²	180	155 Å²	155	94%	0.942	84%	0.835	S	S	*	*			trans	-141.2	156.4	166.7	-83.4	175.7	0	0	0	110.9
67	S	33.4	Very low	35.6	Very low	115 Å²	115	154.8 Å²	154.8	80%	0.804	83%	0.831	S	S	*	*			trans	-148.5	131.7	-160.1	54.3	0	0	0	0	113.8
68	S	37.8	Very low	35.9	Very low	120 Å²	120	155.8 Å²	155.8	84%	0.839	84%	0.835	S	S	*	*			trans	-173.8	153.6	173.1	-172	0	0	0	0	110.7
69	V	36.1	Very low	35.9	Very low	128 Å²	128	157.5 Å²	157.5	78%	0.776	83%	0.834	S	S	*	*			cis	-152.2	157.6	-48.3	114.7	0	0	0	0	110.9
70	R	34.5	Very low	36	Very low	240 Å²	240	161.9 Å²	161.9	91%	0.906	84%	0.843	S	S	*	*			trans	-1.7	139.7	167.1	-60.6	172.7	169.7	170.8	-4.4	122.3
71	G	34.9	Very low	36.2	Very low	80 Å²	80	161.2 Å²	161.2	83%	0.825	84%	0.842	S	S	*	*			trans	177.6	116.3	148.7	0	0	0	0	0	115.4
72	R	34.9	Very low	36.3	Very low	231 Å²	231	162.6 Å²	162.6	87%	0.872	85%	0.847	S	S	*	*			trans	-157.3	142.5	173.4	-130.2	-174.5	-171.6	-171.3	3.8	109.9
73	P	38.8	Very low	36.1	Very low	124 Å²	124	157 Å²	157	81%	0.805	84%	0.84	S	S	*	*				-144.6	136.1	110.4	35.1	-19.6	0	0	0	112.9
74	R	35.1	Very low	36.1	Very low	237 Å²	237	151 Å²	151	89%	0.894	83%	0.833	S	S	*	*				68	102.4	74.2	-109.4	-171.3	-176.7	175.5	2.8	115.6
75	G	37.1	Very low	36.1	Very low	81 Å²	81	153.2 Å²	153.2	84%	0.835	83%	0.83	S	S	*	*			trans	-138.3	143	153	0	0	0	0	0	109
76	R	36.1	Very low	36.2	Very low	214 Å²	214	147.4 Å²	147.4	81%	0.808	82%	0.817	S	S	*	*			trans	-155.7	128	-175.6	-162.2	-158.4	-174.6	174.2	5.6	111.6
77	P	43.7	Very low	36.7	Very low	110 Å²	110	143.9 Å²	143.9	71%	0.714	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-82	169.1	164.2	-7.6	26.2	0	0	0	112.4
78	P	39.3	Very low	37.6	Very low	130 Å²	130	143.3 Å²	143.3	84%	0.844	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-85.4	166.4	-157.5	32.9	-36.5	0	0	0	116.6
79	R	35.2	Very low	39	Very low	210 Å²	210	140.7 Å²	140.7	79%	0.792	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-69.4	145.3	176.3	-75.4	167.1	152.3	165	-10	112.7
80	Q	39.1	Very low	41.5	Very low	190 Å²	190	136.4 Å²	136.4	89%	0.888	76%	0.757	S	S	*	*				-112.5	150	128.3	-74.3	-172.6	-7.3	0	0	108.7
81	P	38.2	Very low	44.2	Very low	126 Å²	126	125.2 Å²	125.2	82%	0.818	71%	0.714	S	S	*	*			trans	-105.2	114.2	-174.1	35.8	-26.9	0	0	0	113.4
82	S	36.1	Very low	47	Very low	115 Å²	115	122.7 Å²	122.7	80%	0.804	68%	0.681	S	S	*	*			trans	-123	144	148	52.2	0	0	0	0	107.7
83	A	31.2	Very low	49.7	Very low	94 Å²	94	112.4 Å²	112.4	78%	0.777	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-68.4	133	-171.4	0	0	0	0	0	111.1	V85	A83-V85 PolarHBondContact O-N 2.86Å
84	P	31.5	Very low	52.3	Low	124 Å²	124	109.8 Å²	109.8	81%	0.805	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-73.9	116.2	172.4	30.1	-31.3	0	0	0	109.2
85	V	35.1	Very low	55.1	Low	128 Å²	128	98.5 Å²	98.5	78%	0.776	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-61.9	138.4	163.7	179.4	0	0	0	0	108.1	A83 T87	A83-V85 PolarHBondContact O-N 2.86Å; V85-T87 VanDerWaalsContact C-N 3.32Å; V85-T87 PolarHBondContact O-N 3.43Å
86	D	34.4	Very low	57.7	Low	119 Å²	119	97.6 Å²	97.6	64%	0.636	55%	0.552	S	S	*	*			trans	-76.2	81	-171.5	-142.3	-25.3	0	0	0	111.1	T88 A89	D86-T88 PolarHBondContact O-N 3.48Å; D86-T88 PolarHBondContact OD1-OG1 2.88Å; D86-A89 PolarHBondContact O-N 2.95Å
87	T	47.3	Very low	60.2	Low	106 Å²	106	89.8 Å²	89.8	65%	0.65	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-12.3	-173.5	49.3	0	0	0	0	114.7	V85 A89 S90 S93	V85-T87 VanDerWaalsContact C-N 3.32Å; V85-T87 PolarHBondContact O-N 3.43Å; T87-A89 VanDerWaalsContact C-N 3.31Å; T87-S90 PolarHBondContact O-OG 2.92Å; T87-S93 PolarHBondContact O-OG 2.98Å
88	T	52	Low	62.3	Low	102 Å²	102	86 Å²	86	63%	0.626	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-24	173.5	61.2	0	0	0	0	113.5	D86	D86-T88 PolarHBondContact O-N 3.48Å; D86-T88 PolarHBondContact OD1-OG1 2.88Å
89	A	68.5	Low	64.6	Low	66 Å²	66	88.1 Å²	88.1	55%	0.545	50%	0.503	S	S	.	.	S	Bend	trans	-94.3	-10	-176.5	0	0	0	0	0	114.8	D86 T87	D86-A89 PolarHBondContact O-N 2.95Å; T87-A89 VanDerWaalsContact C-N 3.31Å
90	S	87.2	Confident	66.9	Low	38 Å²	38	80 Å²	80	27%	0.266	48%	0.481	S	S	.	.	S	Bend	trans	-62.7	144.5	-178.5	63.7	0	0	0	0	112.9	T87 F92 S93 L94	T87-S90 PolarHBondContact O-OG 2.92Å; S90-F92 PolarHBondContact O-N 3.38Å; S90-S93 WeakPolarHBondContact O-CA 3.42Å; S90-S93 WeakPolarHBondContact O-CB 3.39Å; S90-S93 PolarHBondContact O-N 3.07Å; S90-S93 WeakPolarHBondContact OG-CB 3.27Å; S90-S93 PolarHBondContact OG-N 3.14Å; S90-S93 PolarHBondContact OG-OG 3.48Å; S90-L94 PolarHBondContact O-N 2.93Å
91	L	92.6	Very high	69.5	Low	4 Å²	4	74.2 Å²	74.2	2%	0.021	46%	0.462	C	S	.	.	H	α-helix	trans	-55.3	-36.4	179.1	-173.9	60.1	0	0	0	112.8	L94 V95 V105 D123 L124 Y127 F185	L91-L94 PolarHBondContact O-N 2.98Å; L91-V95 HydrophobicContact CD1-CG2 4.31Å; L91-V95 WeakPolarHBondContact O-CG2 3.44Å; L91-V95 PolarHBondContact O-N 2.9Å; L91-V105 HydrophobicContact CD1-CG1 3.43Å; L91-V105 VanDerWaalsContact CD1-CG1 3.43Å; L91-D123 WeakPolarHBondContact CB-OD2 3.45Å; L91-L124 HydrophobicContact CD2-CD1 3.94Å; L91-Y127 HydrophobicContact CB-CD2 4.37Å; L91-Y127 HydrophobicContact CD2-CD1 4.47Å; L91-Y127 HydrophobicContact CD2-CD2 4.35Å; L91-Y127 HydrophobicContact CD2-CG 3.99Å; L91-Y127 HydrophobicContact CG-CD2 3.96Å; L91-Y127 HydrophobicContact CG-CG 4.1Å; L91-F185 HydrophobicContact CD1-CE1 4.25Å; L91-F185 HydrophobicContact CD1-CE2 4.05Å; L91-F185 HydrophobicContact CD1-CZ 3.68Å; L91-F185 HydrophobicContact CD2-CE1 3.88Å; L91-F185 HydrophobicContact CD2-CZ 3.83Å; L91-F185 HydrophobicContact CG-CE1 4.25Å; L91-F185 HydrophobicContact CG-CZ 4.14Å
92	F	93.6	Very high	72.2	Confident	28 Å²	28	69.5 Å²	69.5	12%	0.123	43%	0.429	C	S	.	.	H	α-helix	trans	-61.1	-47.4	172.6	175.1	-102	0	0	0	112.6	S90 L94 R96 Y127 P167 F178	S90-F92 PolarHBondContact O-N 3.38Å; F92-L94 VanDerWaalsContact C-N 3.34Å; F92-L94 PolarHBondContact O-N 2.91Å; F92-R96 WeakPolarHBondContact O-CB 3.45Å; F92-R96 PolarHBondContact O-N 3.5Å; F92-Y127 HydrophobicContact CB-CD2 4.22Å; F92-P167 HydrophobicContact CE2-CB 4.45Å; F92-P167 HydrophobicContact CE2-CG 4.35Å; F92-P167 HydrophobicContact CZ-CG 4.19Å; F92-F178 HydrophobicContact CD2-CE2 4.07Å; F92-F178 AromaticContact CD2-CZ 3.87Å; F92-F178 HydrophobicContact CD2-CZ 3.87Å; F92-F178 HydrophobicContact CE2-CE1 4.04Å; F92-F178 AromaticContact CE2-CE2 3.94Å; F92-F178 HydrophobicContact CE2-CE2 3.94Å; F92-F178 AromaticContact CE2-CZ 3.49Å; F92-F178 HydrophobicContact CE2-CZ 3.49Å; F92-F178 VanDerWaalsContact CE2-CZ 3.49Å
93	S	92.2	Very high	75	Confident	15 Å²	15	67 Å²	67	11%	0.105	41%	0.409	C	S	.	.	H	α-helix	trans	-61.4	-41.3	175.7	-77.7	0	0	0	0	111.9	T87 S90 D97	T87-S93 PolarHBondContact O-OG 2.98Å; S90-S93 WeakPolarHBondContact O-CA 3.42Å; S90-S93 WeakPolarHBondContact O-CB 3.39Å; S90-S93 PolarHBondContact O-N 3.07Å; S90-S93 WeakPolarHBondContact OG-CB 3.27Å; S90-S93 PolarHBondContact OG-N 3.14Å; S90-S93 PolarHBondContact OG-OG 3.48Å; S93-D97 VanDerWaalsContact O-CB 3.28Å; S93-D97 WeakPolarHBondContact O-CB 3.41Å; S93-D97 PolarHBondContact O-N 2.69Å
94	L	93.1	Very high	78	Confident	69 Å²	69	67.4 Å²	67.4	36%	0.361	40%	0.395	S	S	.	.	H	α-helix	trans	-63.8	-51	-180	-67.3	174.1	0	0	0	112.3	S90 L91 F92 R96 G98 V105	S90-L94 PolarHBondContact O-N 2.93Å; L91-L94 PolarHBondContact O-N 2.98Å; F92-L94 VanDerWaalsContact C-N 3.34Å; F92-L94 PolarHBondContact O-N 2.91Å; L94-R96 VanDerWaalsContact C-N 3.35Å; L94-R96 PolarHBondContact O-N 3.15Å; L94-G98 PolarHBondContact O-N 3.32Å; L94-V105 HydrophobicContact CB-CG1 4.37Å; L94-V105 HydrophobicContact CD1-CG1 4.45Å
95	V	93.9	Very high	81.1	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-66.6	-36.6	179.8	177.4	0	0	0	0	111.4	L91 L102 V105 Y127 F178 N181 F185	L91-V95 HydrophobicContact CD1-CG2 4.31Å; L91-V95 WeakPolarHBondContact O-CG2 3.44Å; L91-V95 PolarHBondContact O-N 2.9Å; V95-L102 HydrophobicContact CG1-CD2 4.42Å; V95-L102 HydrophobicContact CG2-CD2 4.48Å; V95-V105 HydrophobicContact CG2-CG1 4.42Å; V95-Y127 HydrophobicContact CB-CE2 4.03Å; V95-Y127 HydrophobicContact CG1-CE2 4.24Å; V95-Y127 HydrophobicContact CG2-CE2 3.94Å; V95-F178 HydrophobicContact CG1-CD2 4.39Å; V95-F178 HydrophobicContact CG1-CE2 4.26Å; V95-N181 HydrophobicContact CG1-CB 3.73Å; V95-N181 WeakPolarHBondContact O-CB 3.33Å; V95-N181 PolarHBondContact O-ND2 2.71Å; V95-F185 HydrophobicContact CG1-CB 4.21Å; V95-F185 HydrophobicContact CG2-CB 4.18Å; V95-F185 HydrophobicContact CG2-CD1 4.17Å; V95-F185 HydrophobicContact CG2-CD2 4.03Å; V95-F185 HydrophobicContact CG2-CG 3.83Å
96	R	91.8	Very high	83.9	Confident	61 Å²	61	55.7 Å²	55.7	23%	0.23	32%	0.321	C	S	.	.	H	α-helix	trans	-68.4	-49.7	177.5	-173.9	-160.3	70.2	-150.9	-11	112.9	F92 L94 G98 W175 F178	F92-R96 WeakPolarHBondContact O-CB 3.45Å; F92-R96 PolarHBondContact O-N 3.5Å; L94-R96 VanDerWaalsContact C-N 3.35Å; L94-R96 PolarHBondContact O-N 3.15Å; R96-G98 VanDerWaalsContact C-N 3.28Å; R96-G98 PolarHBondContact O-N 3.03Å; R96-W175 HydrophobicContact CG-CZ3 4.26Å; R96-F178 HydrophobicContact CB-CD2 3.74Å; R96-F178 HydrophobicContact CB-CE2 4.23Å; R96-F178 HydrophobicContact CB-CG 4.35Å; R96-F178 HydrophobicContact CG-CB 4.27Å; R96-F178 HydrophobicContact CG-CD2 4.12Å; R96-F178 HydrophobicContact CG-CG 4.22Å
97	D	88.9	Confident	86.9	Confident	51 Å²	51	52.7 Å²	52.7	27%	0.273	31%	0.305	S	S	.	.	H	α-helix	trans	-68.6	-29.8	-179.5	-80	31	0	0	0	111.8	S93 K99	S93-D97 VanDerWaalsContact O-CB 3.28Å; S93-D97 WeakPolarHBondContact O-CB 3.41Å; S93-D97 PolarHBondContact O-N 2.69Å; D97-K99 VanDerWaalsContact C-N 3.31Å; D97-K99 HydrophobicContact CB-CD 4.09Å; D97-K99 HydrophobicContact CB-CG 4.23Å; D97-K99 PolarHBondContact O-N 3.26Å; D97-K99 WeakPolarHBondContact OD2-CE 3.44Å; D97-K99 IonicContact OD2-NZ 3.71Å; D97-K99 PolarHBondContact OD2-NZ 2.96Å
98	G	86.5	Confident	89.1	Confident	30 Å²	30	50.9 Å²	50.9	31%	0.309	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.9	33.2	172.7	0	0	0	0	0	114.1	L94 R96	L94-G98 PolarHBondContact O-N 3.32Å; R96-G98 VanDerWaalsContact C-N 3.28Å; R96-G98 PolarHBondContact O-N 3.03Å
99	K	87.1	Confident	91.2	Very high	174 Å²	174	46.4 Å²	46.4	76%	0.757	26%	0.263	S	S	*	.			trans	-85.9	-26.8	-177	-69.9	165.9	-178.3	155.2	0	113.6	D97	D97-K99 VanDerWaalsContact C-N 3.31Å; D97-K99 HydrophobicContact CB-CD 4.09Å; D97-K99 HydrophobicContact CB-CG 4.23Å; D97-K99 PolarHBondContact O-N 3.26Å; D97-K99 WeakPolarHBondContact OD2-CE 3.44Å; D97-K99 IonicContact OD2-NZ 3.71Å; D97-K99 PolarHBondContact OD2-NZ 2.96Å
100	A	85.5	Confident	92.5	Very high	40 Å²	40	44.1 Å²	44.1	33%	0.331	24%	0.242	S	C	.	.	S	Bend	trans	-105.4	162.5	176.6	0	0	0	0	0	110.7	V105	A100-V105 HydrophobicContact CB-CG2 3.86Å
101	S	93	Very high	92.9	Very high	69 Å²	69	48.5 Å²	48.5	48%	0.483	26%	0.258	S	S	.	.			trans	-65.8	135.7	170	179.2	0	0	0	0	109.7	V103 Q104 V105	S101-V103 PolarHBondContact O-N 3.04Å; S101-V103 PolarHBondContact OG-N 3.19Å; S101-Q104 WeakPolarHBondContact O-CB 3.29Å; S101-Q104 PolarHBondContact O-N 3.41Å; S101-V105 WeakPolarHBondContact O-CG2 3.46Å; S101-V105 PolarHBondContact O-N 3.23Å
102	L	94.2	Very high	93	Very high	26 Å²	26	53 Å²	53	14%	0.136	28%	0.282	C	S	.	.	H	α-helix	trans	-63.3	-23.6	176.7	-60.8	178.8	0	0	0	112.6	V95 A106 N181 D184 F185	V95-L102 HydrophobicContact CG1-CD2 4.42Å; V95-L102 HydrophobicContact CG2-CD2 4.48Å; L102-A106 WeakPolarHBondContact O-CB 3.48Å; L102-A106 PolarHBondContact O-N 3Å; L102-N181 HydrophobicContact CD1-CB 4.24Å; L102-N181 HydrophobicContact CD2-CB 4.43Å; L102-D184 HydrophobicContact CD1-CB 3.61Å; L102-F185 HydrophobicContact CD2-CB 4.39Å
103	V	95.5	Very high	93.1	Very high	64 Å²	64	51.8 Å²	51.8	39%	0.388	28%	0.277	S	S	.	.	H	α-helix	trans	-65.5	-48.8	170.6	-177.4	0	0	0	0	110	S101 V105 A106 D107 T188	S101-V103 PolarHBondContact O-N 3.04Å; S101-V103 PolarHBondContact OG-N 3.19Å; V103-V105 PolarHBondContact O-N 3.43Å; V103-A106 WeakPolarHBondContact O-CB 3.17Å; V103-A106 PolarHBondContact O-N 2.9Å; V103-A106 VanDerWaalsContact O-N 3.15Å; V103-D107 PolarHBondContact O-N 2.75Å; V103-T188 HydrophobicContact CB-CG2 4.39Å; V103-T188 HydrophobicContact CG2-CG2 3.95Å
104	Q	94.9	Very high	93.2	Very high	102 Å²	102	57.3 Å²	57.3	48%	0.477	30%	0.302	S	S	.	.	H	α-helix	trans	-61.4	-44.1	176.9	-175.1	-174.5	-7.3	0	0	111.4	S101 A106 D107 D108	S101-Q104 WeakPolarHBondContact O-CB 3.29Å; S101-Q104 PolarHBondContact O-N 3.41Å; Q104-A106 PolarHBondContact O-N 3Å; Q104-D107 PolarHBondContact O-N 3.12Å; Q104-D108 WeakPolarHBondContact O-CB 3.39Å; Q104-D108 PolarHBondContact O-N 3.04Å
105	V	95.1	Very high	93.2	Very high	5 Å²	5	59.1 Å²	59.1	3%	0.03	32%	0.321	C	S	.	.	H	α-helix	trans	-62.7	-32.8	177.6	179.6	0	0	0	0	111.8	L91 L94 V95 A100 S101 V103 W109 F185	L91-V105 HydrophobicContact CD1-CG1 3.43Å; L91-V105 VanDerWaalsContact CD1-CG1 3.43Å; L94-V105 HydrophobicContact CB-CG1 4.37Å; L94-V105 HydrophobicContact CD1-CG1 4.45Å; V95-V105 HydrophobicContact CG2-CG1 4.42Å; A100-V105 HydrophobicContact CB-CG2 3.86Å; S101-V105 WeakPolarHBondContact O-CG2 3.46Å; S101-V105 PolarHBondContact O-N 3.23Å; V103-V105 PolarHBondContact O-N 3.43Å; V105-W109 WeakPolarHBondContact O-CB 3.37Å; V105-W109 PolarHBondContact O-N 3.44Å; V105-F185 HydrophobicContact CB-CE2 4.41Å; V105-F185 HydrophobicContact CG1-CD2 4.33Å; V105-F185 HydrophobicContact CG1-CE2 3.88Å
106	A	95.6	Very high	93.2	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-73.2	-41.7	173.4	0	0	0	0	0	112.2	L102 V103 Q104 W109 I110 F185 T188 L189 Q192	L102-A106 WeakPolarHBondContact O-CB 3.48Å; L102-A106 PolarHBondContact O-N 3Å; V103-A106 WeakPolarHBondContact O-CB 3.17Å; V103-A106 PolarHBondContact O-N 2.9Å; V103-A106 VanDerWaalsContact O-N 3.15Å; Q104-A106 PolarHBondContact O-N 3Å; A106-W109 PolarHBondContact O-N 3.2Å; A106-I110 WeakPolarHBondContact O-CB 3.46Å; A106-I110 VanDerWaalsContact O-CG1 3.26Å; A106-I110 WeakPolarHBondContact O-CG1 3.48Å; A106-I110 PolarHBondContact O-N 3.2Å; A106-F185 HydrophobicContact CB-CE2 4.2Å; A106-T188 HydrophobicContact CB-CG2 4.19Å; A106-L189 HydrophobicContact CB-CB 4.4Å; A106-L189 HydrophobicContact CB-CD1 4.29Å; A106-Q192 HydrophobicContact CB-CG 4.39Å
107	D	95.7	Very high	93.4	Very high	57 Å²	57	66 Å²	66	31%	0.305	35%	0.353	S	S	.	.	H	α-helix	trans	-64.9	-45.7	177.6	-63.9	-21.8	0	0	0	111.1	V103 Q104 W109 I110 E111 Q192	V103-D107 PolarHBondContact O-N 2.75Å; Q104-D107 PolarHBondContact O-N 3.12Å; D107-W109 VanDerWaalsContact C-N 3.29Å; D107-W109 PolarHBondContact O-N 3.28Å; D107-I110 WeakPolarHBondContact O-CB 3.49Å; D107-I110 PolarHBondContact O-N 3.21Å; D107-I110 VanDerWaalsContact O-N 3.08Å; D107-E111 PolarHBondContact O-N 3.36Å; D107-Q192 PolarHBondContact OD1-NE2 3.42Å
108	D	94.6	Very high	93.6	Very high	68 Å²	68	66.9 Å²	66.9	36%	0.364	36%	0.355	S	S	.	.	H	α-helix	trans	-58	-39.9	174	-64.5	-17.9	0	0	0	111	Q104 N112	Q104-D108 WeakPolarHBondContact O-CB 3.39Å; Q104-D108 PolarHBondContact O-N 3.04Å; D108-N112 PolarHBondContact O-N 3.3Å; D108-N112 PolarHBondContact O-ND2 2.9Å
109	W	95.8	Very high	93.9	Very high	8 Å²	8	68.6 Å²	68.6	3%	0.03	36%	0.36	C	S	.	.	H	α-helix	trans	-69.9	-37.2	174.9	-176	90.8	0	0	0	112.3	V105 A106 D107 N112 Y113 A120 L124 L189 M203	V105-W109 WeakPolarHBondContact O-CB 3.37Å; V105-W109 PolarHBondContact O-N 3.44Å; A106-W109 PolarHBondContact O-N 3.2Å; D107-W109 VanDerWaalsContact C-N 3.29Å; D107-W109 PolarHBondContact O-N 3.28Å; W109-N112 WeakPolarHBondContact O-CB 3.3Å; W109-N112 PolarHBondContact O-N 2.84Å; W109-Y113 AromaticContact CH2-CD2 3.6Å; W109-Y113 HydrophobicContact CH2-CD2 3.6Å; W109-Y113 HydrophobicContact CH2-CE2 4.32Å; W109-Y113 AromaticContact CH2-CG 3.98Å; W109-Y113 HydrophobicContact CH2-CG 3.98Å; W109-Y113 HydrophobicContact CZ2-CD2 4.11Å; W109-Y113 HydrophobicContact CZ3-CD2 4.2Å; W109-Y113 HydrophobicContact CZ3-CG 4.1Å; W109-Y113 PolarHBondContact O-N 2.9Å; W109-A120 HydrophobicContact CZ2-CB 4.07Å; W109-A120 WeakPolarHBondContact CZ2-O 3.46Å; W109-A120 PolarHBondContact NE1-O 2.88Å; W109-L124 HydrophobicContact CH2-CD2 3.97Å; W109-L124 HydrophobicContact CZ2-CB 3.81Å; W109-L124 HydrophobicContact CZ2-CD2 3.62Å; W109-L124 HydrophobicContact CZ2-CG 4.3Å; W109-L189 HydrophobicContact CD2-CD1 4.27Å; W109-L189 HydrophobicContact CE3-CD1 3.5Å; W109-L189 VanDerWaalsContact CE3-CD1 3.5Å; W109-L189 HydrophobicContact CE3-CD2 4.47Å; W109-L189 HydrophobicContact CZ3-CD1 3.89Å; W109-M203 HydrophobicContact CH2-CE 3.83Å; W109-M203 HydrophobicContact CH2-CG 3.78Å; W109-M203 HydrophobicContact CZ3-CE 3.97Å; W109-M203 HydrophobicContact CZ3-CG 4.4Å
110	I	95.8	Very high	94.3	Very high	18 Å²	18	60.5 Å²	60.5	9%	0.092	33%	0.325	C	S	.	.	H	α-helix	trans	-64.8	-41.1	176	-76.5	166.8	0	0	0	111.2	A106 D107 N112 Y113 M114 L189 Q192 I197	A106-I110 WeakPolarHBondContact O-CB 3.46Å; A106-I110 VanDerWaalsContact O-CG1 3.26Å; A106-I110 WeakPolarHBondContact O-CG1 3.48Å; A106-I110 PolarHBondContact O-N 3.2Å; D107-I110 WeakPolarHBondContact O-CB 3.49Å; D107-I110 PolarHBondContact O-N 3.21Å; D107-I110 VanDerWaalsContact O-N 3.08Å; I110-N112 VanDerWaalsContact C-N 3.34Å; I110-N112 PolarHBondContact O-N 3.47Å; I110-Y113 PolarHBondContact O-N 3.09Å; I110-M114 HydrophobicContact CG2-CE 3.83Å; I110-M114 WeakPolarHBondContact O-CG 3.28Å; I110-M114 PolarHBondContact O-N 3.46Å; I110-L189 HydrophobicContact CD1-CD1 4.42Å; I110-L189 HydrophobicContact CG1-CD1 4.27Å; I110-Q192 HydrophobicContact CD1-CB 3.43Å; I110-Q192 VanDerWaalsContact CD1-CB 3.43Å; I110-I197 HydrophobicContact CB-CD1 4.43Å; I110-I197 HydrophobicContact CG1-CD1 4.17Å; I110-I197 HydrophobicContact CG2-CD1 3.79Å
111	E	95.2	Very high	94.7	Very high	130 Å²	130	58.6 Å²	58.6	61%	0.607	31%	0.31	S	S	*	.	H	α-helix	trans	-62.5	-40.4	173.9	-71.5	-172.5	-179	0	0	111.9	D107 M114 S115	D107-E111 PolarHBondContact O-N 3.36Å; E111-M114 PolarHBondContact O-N 2.81Å; E111-S115 PolarHBondContact O-N 3.39Å; E111-S115 PolarHBondContact O-OG 3.4Å
112	N	94.2	Very high	94.8	Very high	99 Å²	99	57.8 Å²	57.8	53%	0.529	30%	0.299	S	S	.	.	H	α-helix	trans	-63.3	-43	172.3	-72.9	-48.6	0	0	0	111.6	D108 W109 I110 M114 S115 D116 A120	D108-N112 PolarHBondContact O-N 3.3Å; D108-N112 PolarHBondContact O-ND2 2.9Å; W109-N112 WeakPolarHBondContact O-CB 3.3Å; W109-N112 PolarHBondContact O-N 2.84Å; I110-N112 VanDerWaalsContact C-N 3.34Å; I110-N112 PolarHBondContact O-N 3.47Å; N112-M114 VanDerWaalsContact C-N 3.35Å; N112-M114 PolarHBondContact O-N 2.88Å; N112-S115 WeakPolarHBondContact O-CA 3.23Å; N112-S115 WeakPolarHBondContact O-CB 3.23Å; N112-S115 PolarHBondContact O-N 2.76Å; N112-D116 PolarHBondContact O-N 3.3Å; N112-A120 HydrophobicContact CB-CB 4.42Å
113	Y	96.2	Very high	94.8	Very high	2 Å²	2	59.1 Å²	59.1	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-63.8	-36.4	176.8	-175.1	-93.9	0	0	0	113	W109 I110 S115 R117 A120 V121 I197 D200 Y202 M203	W109-Y113 AromaticContact CH2-CD2 3.6Å; W109-Y113 HydrophobicContact CH2-CD2 3.6Å; W109-Y113 HydrophobicContact CH2-CE2 4.32Å; W109-Y113 AromaticContact CH2-CG 3.98Å; W109-Y113 HydrophobicContact CH2-CG 3.98Å; W109-Y113 HydrophobicContact CZ2-CD2 4.11Å; W109-Y113 HydrophobicContact CZ3-CD2 4.2Å; W109-Y113 HydrophobicContact CZ3-CG 4.1Å; W109-Y113 PolarHBondContact O-N 2.9Å; I110-Y113 PolarHBondContact O-N 3.09Å; Y113-S115 PolarHBondContact O-N 3.24Å; Y113-R117 HydrophobicContact CD1-CG 4.23Å; Y113-R117 HydrophobicContact CD2-CB 4.21Å; Y113-R117 HydrophobicContact CD2-CG 4.23Å; Y113-R117 HydrophobicContact CE1-CG 3.9Å; Y113-R117 HydrophobicContact CE2-CB 3.8Å; Y113-R117 HydrophobicContact CE2-CG 3.88Å; Y113-R117 HydrophobicContact CG-CG 4.39Å; Y113-R117 WeakPolarHBondContact O-CG 3.33Å; Y113-A120 VanDerWaalsContact CA-CB 3.44Å; Y113-A120 HydrophobicContact CD2-CB 3.94Å; Y113-A120 HydrophobicContact CG-CB 4.36Å; Y113-V121 HydrophobicContact CD2-CG2 4.24Å; Y113-V121 HydrophobicContact CE2-CG2 3.77Å; Y113-I197 HydrophobicContact CD1-CD1 3.74Å; Y113-I197 HydrophobicContact CD1-CG1 3.93Å; Y113-I197 HydrophobicContact CD1-CG2 3.93Å; Y113-I197 HydrophobicContact CE1-CB 4.34Å; Y113-I197 HydrophobicContact CE1-CD1 4.29Å; Y113-I197 HydrophobicContact CE1-CG1 3.96Å; Y113-I197 HydrophobicContact CE1-CG2 3.57Å; Y113-D200 VanDerWaalsContact CE1-OD2 3.31Å; Y113-D200 WeakPolarHBondContact CE1-OD2 3.34Å; Y113-D200 VanDerWaalsContact CZ-OD2 3.32Å; Y113-D200 VanDerWaalsContact OH-CG 3.28Å; Y113-D200 PolarHBondContact OH-OD1 3.24Å; Y113-D200 PolarHBondContact OH-OD2 3.35Å; Y113-Y202 HydrophobicContact CE2-CD1 4.27Å; Y113-Y202 WeakPolarHBondContact OH-CD1 3.5Å; Y113-M203 HydrophobicContact CE2-CB 4.04Å; Y113-M203 HydrophobicContact CE2-CG 4.3Å
114	M	94	Very high	94.9	Very high	130 Å²	130	56.2 Å²	56.2	64%	0.64	29%	0.288	S	S	*	.	H	α-helix	trans	-68.2	-21.8	172.6	-69.7	-170.9	-173.7	0	0	113.1	I110 E111 N112 I197	I110-M114 HydrophobicContact CG2-CE 3.83Å; I110-M114 WeakPolarHBondContact O-CG 3.28Å; I110-M114 PolarHBondContact O-N 3.46Å; E111-M114 PolarHBondContact O-N 2.81Å; N112-M114 VanDerWaalsContact C-N 3.35Å; N112-M114 PolarHBondContact O-N 2.88Å; M114-I197 HydrophobicContact CE-CD1 4.24Å
115	S	94.7	Very high	94.9	Very high	107 Å²	107	51.3 Å²	51.3	75%	0.748	27%	0.265	S	S	*	.	H	α-helix	trans	-90.8	-48.1	-179.7	-56.6	0	0	0	0	112.7	E111 N112 Y113	E111-S115 PolarHBondContact O-N 3.39Å; E111-S115 PolarHBondContact O-OG 3.4Å; N112-S115 WeakPolarHBondContact O-CA 3.23Å; N112-S115 WeakPolarHBondContact O-CB 3.23Å; N112-S115 PolarHBondContact O-N 2.76Å; Y113-S115 PolarHBondContact O-N 3.24Å
116	D	94.1	Very high	94.9	Very high	79 Å²	79	52.7 Å²	52.7	42%	0.422	27%	0.272	S	S	.	.			trans	-147.4	106.5	175.7	-172.5	-35.8	0	0	0	109.7	N112 E118 V119 A120	N112-D116 PolarHBondContact O-N 3.3Å; D116-E118 PolarHBondContact OD1-N 2.92Å; D116-V119 HydrophobicContact CB-CB 4.2Å; D116-V119 HydrophobicContact CB-CG2 4.39Å; D116-V119 PolarHBondContact OD1-N 3.25Å; D116-V119 WeakPolarHBondContact OD2-CG2 3.24Å; D116-A120 WeakPolarHBondContact O-CB 3.29Å; D116-A120 PolarHBondContact O-N 3.46Å; D116-A120 VanDerWaalsContact O-N 3.12Å
117	R	94.2	Very high	95	Very high	127 Å²	127	52.8 Å²	52.8	48%	0.479	27%	0.272	S	S	.	.	H	α-helix	trans	-68.4	-36.3	-176.6	-64.7	-177.1	-174.9	-159.3	1.7	112.8	Y113 V121 D200 Y202	Y113-R117 HydrophobicContact CD1-CG 4.23Å; Y113-R117 HydrophobicContact CD2-CB 4.21Å; Y113-R117 HydrophobicContact CD2-CG 4.23Å; Y113-R117 HydrophobicContact CE1-CG 3.9Å; Y113-R117 HydrophobicContact CE2-CB 3.8Å; Y113-R117 HydrophobicContact CE2-CG 3.88Å; Y113-R117 HydrophobicContact CG-CG 4.39Å; Y113-R117 WeakPolarHBondContact O-CG 3.33Å; R117-V121 WeakPolarHBondContact O-CB 3.47Å; R117-V121 VanDerWaalsContact O-CG2 3.28Å; R117-V121 WeakPolarHBondContact O-CG2 3.36Å; R117-V121 PolarHBondContact O-N 3.03Å; R117-D200 IonicContact CZ-OD2 3.57Å; R117-D200 IonicContact NH1-OD2 3.57Å; R117-D200 PolarHBondContact NH1-OD2 3.49Å; R117-Y202 HydrophobicContact CB-CD1 4.22Å; R117-Y202 HydrophobicContact CB-CE1 4Å
118	E	93.5	Very high	95.1	Very high	69 Å²	69	50.3 Å²	50.3	32%	0.322	26%	0.258	S	S	.	.	H	α-helix	trans	-71	-43.7	-176.5	-59	-163.9	158.8	0	0	110.3	D116 M122 L140 Q144	D116-E118 PolarHBondContact OD1-N 2.92Å; E118-M122 WeakPolarHBondContact O-CB 3.49Å; E118-M122 PolarHBondContact O-N 3.22Å; E118-L140 HydrophobicContact CB-CD1 3.89Å; E118-L140 HydrophobicContact CB-CG 4.37Å; E118-Q144 PolarHBondContact OE2-NE2 2.84Å
119	V	93.4	Very high	95.1	Very high	67 Å²	67	47 Å²	47	41%	0.406	24%	0.241	S	C	.	.	H	α-helix	trans	-67.6	-41.2	178.2	175.9	0	0	0	0	111.6	D116 M122 D123 L140	D116-V119 HydrophobicContact CB-CB 4.2Å; D116-V119 HydrophobicContact CB-CG2 4.39Å; D116-V119 PolarHBondContact OD1-N 3.25Å; D116-V119 WeakPolarHBondContact OD2-CG2 3.24Å; V119-M122 WeakPolarHBondContact O-CB 3.15Å; V119-M122 PolarHBondContact O-N 2.89Å; V119-D123 PolarHBondContact O-N 3.05Å; V119-D123 VanDerWaalsContact O-N 3.1Å; V119-L140 HydrophobicContact CG2-CD1 4.12Å
120	A	94.5	Very high	95	Very high	4 Å²	4	47.8 Å²	47.8	3%	0.033	25%	0.247	C	C	.	.	H	α-helix	trans	-66.5	-41.5	177.5	0	0	0	0	0	112.5	W109 N112 Y113 D116 M122 D123 L124	W109-A120 HydrophobicContact CZ2-CB 4.07Å; W109-A120 WeakPolarHBondContact CZ2-O 3.46Å; W109-A120 PolarHBondContact NE1-O 2.88Å; N112-A120 HydrophobicContact CB-CB 4.42Å; Y113-A120 VanDerWaalsContact CA-CB 3.44Å; Y113-A120 HydrophobicContact CD2-CB 3.94Å; Y113-A120 HydrophobicContact CG-CB 4.36Å; D116-A120 WeakPolarHBondContact O-CB 3.29Å; D116-A120 PolarHBondContact O-N 3.46Å; D116-A120 VanDerWaalsContact O-N 3.12Å; A120-M122 VanDerWaalsContact C-N 3.33Å; A120-D123 PolarHBondContact O-N 3.26Å; A120-L124 PolarHBondContact O-N 3.19Å; A120-L124 VanDerWaalsContact O-N 3.12Å
121	V	95.1	Very high	95	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.1	-42.4	172.1	169.7	0	0	0	0	110.4	Y113 R117 D123 L124 L125 I143 Y202	Y113-V121 HydrophobicContact CD2-CG2 4.24Å; Y113-V121 HydrophobicContact CE2-CG2 3.77Å; R117-V121 WeakPolarHBondContact O-CB 3.47Å; R117-V121 VanDerWaalsContact O-CG2 3.28Å; R117-V121 WeakPolarHBondContact O-CG2 3.36Å; R117-V121 PolarHBondContact O-N 3.03Å; V121-D123 PolarHBondContact O-N 3.45Å; V121-L124 PolarHBondContact O-N 2.88Å; V121-L124 VanDerWaalsContact O-N 3.11Å; V121-L125 HydrophobicContact CG1-CD1 3.95Å; V121-L125 HydrophobicContact CG1-CD2 4.48Å; V121-L125 HydrophobicContact CG1-CG 3.95Å; V121-L125 WeakPolarHBondContact O-CG 3.15Å; V121-L125 PolarHBondContact O-N 2.96Å; V121-I143 HydrophobicContact CG1-CG2 4.5Å; V121-Y202 HydrophobicContact CB-CE1 4.45Å; V121-Y202 HydrophobicContact CG2-CD1 4.18Å; V121-Y202 HydrophobicContact CG2-CE1 3.81Å
122	M	94.8	Very high	94.9	Very high	52 Å²	52	40.8 Å²	40.8	26%	0.256	21%	0.214	S	C	.	.	H	α-helix	trans	-55.9	-46.4	176.9	-170.3	-173.1	68.2	0	0	113.1	E118 V119 A120 L124 L125 Q126 V138 L140 I143	E118-M122 WeakPolarHBondContact O-CB 3.49Å; E118-M122 PolarHBondContact O-N 3.22Å; V119-M122 WeakPolarHBondContact O-CB 3.15Å; V119-M122 PolarHBondContact O-N 2.89Å; A120-M122 VanDerWaalsContact C-N 3.33Å; M122-L124 VanDerWaalsContact C-N 3.35Å; M122-L124 PolarHBondContact O-N 3.49Å; M122-L125 PolarHBondContact O-N 3.25Å; M122-Q126 VanDerWaalsContact O-CB 3.3Å; M122-Q126 WeakPolarHBondContact O-CB 3.25Å; M122-Q126 PolarHBondContact O-N 3.23Å; M122-V138 HydrophobicContact CG-CG1 4.25Å; M122-L140 HydrophobicContact CB-CD1 4.48Å; M122-L140 HydrophobicContact SD-CB 4.46Å; M122-L140 HydrophobicContact SD-CD1 4.08Å; M122-I143 VanDerWaalsContact CA-CD1 3.41Å; M122-I143 HydrophobicContact CB-CD1 3.44Å; M122-I143 VanDerWaalsContact CB-CD1 3.44Å; M122-I143 HydrophobicContact CG-CD1 3.75Å
123	D	94.8	Very high	94.8	Very high	54 Å²	54	37.5 Å²	37.5	29%	0.289	20%	0.204	S	C	.	.	H	α-helix	trans	-66.4	-35.3	177.1	-172.2	46.7	0	0	0	112.2	L91 V119 A120 V121 Q126 Y127	L91-D123 WeakPolarHBondContact CB-OD2 3.45Å; V119-D123 PolarHBondContact O-N 3.05Å; V119-D123 VanDerWaalsContact O-N 3.1Å; A120-D123 PolarHBondContact O-N 3.26Å; V121-D123 PolarHBondContact O-N 3.45Å; D123-Q126 PolarHBondContact O-N 3Å; D123-Y127 WeakPolarHBondContact O-CB 3.18Å; D123-Y127 PolarHBondContact O-N 3.12Å
124	L	96.2	Very high	94.5	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-69.8	-40.1	175.7	-174.4	61.6	0	0	0	112.9	L91 W109 A120 V121 M122 Y127 F128 F185 L189 M203 V207	L91-L124 HydrophobicContact CD2-CD1 3.94Å; W109-L124 HydrophobicContact CH2-CD2 3.97Å; W109-L124 HydrophobicContact CZ2-CB 3.81Å; W109-L124 HydrophobicContact CZ2-CD2 3.62Å; W109-L124 HydrophobicContact CZ2-CG 4.3Å; A120-L124 PolarHBondContact O-N 3.19Å; A120-L124 VanDerWaalsContact O-N 3.12Å; V121-L124 PolarHBondContact O-N 2.88Å; V121-L124 VanDerWaalsContact O-N 3.11Å; M122-L124 VanDerWaalsContact C-N 3.35Å; M122-L124 PolarHBondContact O-N 3.49Å; L124-Y127 HydrophobicContact CD1-CD1 4.17Å; L124-Y127 WeakPolarHBondContact O-CB 3.39Å; L124-Y127 PolarHBondContact O-N 3.3Å; L124-F128 HydrophobicContact CD1-CE2 4.01Å; L124-F128 HydrophobicContact CD1-CZ 4.49Å; L124-F128 HydrophobicContact CG-CE2 3.96Å; L124-F128 WeakPolarHBondContact O-CD2 3.32Å; L124-F128 PolarHBondContact O-N 3.04Å; L124-F185 HydrophobicContact CD1-CE1 4.2Å; L124-L189 HydrophobicContact CD1-CD2 3.8Å; L124-L189 HydrophobicContact CD2-CD2 3.93Å; L124-M203 HydrophobicContact CD2-CE 3.7Å; L124-V207 HydrophobicContact CD2-CG2 3.66Å; L124-V207 HydrophobicContact CG-CG2 4.26Å
125	L	96.2	Very high	94.2	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66.2	-43	173.2	-62	-172.8	0	0	0	110.4	V121 M122 Y127 F128 I129 V138 I143 F148 V207 L210	V121-L125 HydrophobicContact CG1-CD1 3.95Å; V121-L125 HydrophobicContact CG1-CD2 4.48Å; V121-L125 HydrophobicContact CG1-CG 3.95Å; V121-L125 WeakPolarHBondContact O-CG 3.15Å; V121-L125 PolarHBondContact O-N 2.96Å; M122-L125 PolarHBondContact O-N 3.25Å; L125-Y127 VanDerWaalsContact C-N 3.27Å; L125-Y127 PolarHBondContact O-N 3.16Å; L125-F128 PolarHBondContact O-N 3.14Å; L125-I129 WeakPolarHBondContact O-CG1 3.24Å; L125-I129 PolarHBondContact O-N 3.29Å; L125-I129 VanDerWaalsContact O-N 3.1Å; L125-V138 HydrophobicContact CB-CG1 4.43Å; L125-I143 HydrophobicContact CD1-CD1 4.08Å; L125-I143 HydrophobicContact CD1-CG1 4Å; L125-F148 HydrophobicContact CD1-CE1 3.9Å; L125-V207 HydrophobicContact CD2-CG2 4.14Å; L125-L210 HydrophobicContact CB-CD2 3.85Å; L125-L210 HydrophobicContact CD2-CB 3.94Å; L125-L210 HydrophobicContact CD2-CD2 3.55Å; L125-L210 HydrophobicContact CD2-CG 4.35Å; L125-L210 HydrophobicContact CG-CD2 4.15Å
126	Q	95.6	Very high	93.9	Very high	34 Å²	34	33.9 Å²	33.9	16%	0.159	17%	0.173	C	C	.	.	H	α-helix	trans	-60.1	-36.6	173.9	-175.1	61.2	45.4	0	0	112	M122 D123 I129 S130 G136	M122-Q126 VanDerWaalsContact O-CB 3.3Å; M122-Q126 WeakPolarHBondContact O-CB 3.25Å; M122-Q126 PolarHBondContact O-N 3.23Å; D123-Q126 PolarHBondContact O-N 3Å; Q126-I129 PolarHBondContact O-N 2.89Å; Q126-S130 PolarHBondContact NE2-OG 3.13Å; Q126-S130 VanDerWaalsContact O-CB 3.26Å; Q126-S130 WeakPolarHBondContact O-CB 3.45Å; Q126-S130 PolarHBondContact O-N 2.8Å; Q126-S130 PolarHBondContact O-OG 3.17Å; Q126-G136 PolarHBondContact NE2-O 2.86Å
127	Y	96.6	Very high	93.8	Very high	1 Å²	1	34.9 Å²	34.9	0%	0.004	18%	0.182	C	C	.	.	H	α-helix	trans	-59.6	-44.4	174.5	162	-100.3	0	0	0	112.3	L91 F92 V95 D123 L124 L125 S131 F182 F185	L91-Y127 HydrophobicContact CB-CD2 4.37Å; L91-Y127 HydrophobicContact CD2-CD1 4.47Å; L91-Y127 HydrophobicContact CD2-CD2 4.35Å; L91-Y127 HydrophobicContact CD2-CG 3.99Å; L91-Y127 HydrophobicContact CG-CD2 3.96Å; L91-Y127 HydrophobicContact CG-CG 4.1Å; F92-Y127 HydrophobicContact CB-CD2 4.22Å; V95-Y127 HydrophobicContact CB-CE2 4.03Å; V95-Y127 HydrophobicContact CG1-CE2 4.24Å; V95-Y127 HydrophobicContact CG2-CE2 3.94Å; D123-Y127 WeakPolarHBondContact O-CB 3.18Å; D123-Y127 PolarHBondContact O-N 3.12Å; L124-Y127 HydrophobicContact CD1-CD1 4.17Å; L124-Y127 WeakPolarHBondContact O-CB 3.39Å; L124-Y127 PolarHBondContact O-N 3.3Å; L125-Y127 VanDerWaalsContact C-N 3.27Å; L125-Y127 PolarHBondContact O-N 3.16Å; Y127-S131 VanDerWaalsContact O-CB 3.28Å; Y127-S131 WeakPolarHBondContact O-CB 3.2Å; Y127-S131 PolarHBondContact O-N 2.53Å; Y127-S131 PolarHBondContact O-OG 3.05Å; Y127-F182 HydrophobicContact CE1-CD2 4.12Å; Y127-F182 HydrophobicContact CE1-CE2 4.03Å; Y127-F182 HydrophobicContact CE2-CD2 4.41Å; Y127-F182 AromaticContact CZ-CD2 3.66Å; Y127-F182 WeakPolarHBondContact OH-CA 3.49Å; Y127-F182 WeakPolarHBondContact OH-CD2 3.3Å; Y127-F185 HydrophobicContact CD1-CE1 4.45Å; Y127-F185 AromaticContact CE1-CD1 3.86Å; Y127-F185 HydrophobicContact CE1-CD1 3.86Å; Y127-F185 HydrophobicContact CE1-CE1 4.08Å; Y127-F185 HydrophobicContact CE2-CD1 4.43Å; Y127-F185 AromaticContact CZ-CD1 3.71Å
128	F	97	Very high	93.7	Very high	5 Å²	5	29 Å²	29	2%	0.022	16%	0.16	C	C	.	.	H	α-helix	trans	-66.2	-43.9	176.3	-70	-62.9	0	0	0	112.2	L124 L125 S131 C132 F182 I186 V207 L210 L211 A229	L124-F128 HydrophobicContact CD1-CE2 4.01Å; L124-F128 HydrophobicContact CD1-CZ 4.49Å; L124-F128 HydrophobicContact CG-CE2 3.96Å; L124-F128 WeakPolarHBondContact O-CD2 3.32Å; L124-F128 PolarHBondContact O-N 3.04Å; L125-F128 PolarHBondContact O-N 3.14Å; F128-S131 PolarHBondContact O-N 3.19Å; F128-C132 PolarHBondContact O-N 3.02Å; F128-C132 PolarHBondContact O-SG 3.41Å; F128-F182 HydrophobicContact CD1-CE2 4.23Å; F128-F182 HydrophobicContact CD1-CZ 4.24Å; F128-F182 HydrophobicContact CE1-CE2 4.47Å; F128-F182 HydrophobicContact CE1-CZ 4.38Å; F128-I186 HydrophobicContact CE1-CD1 3.76Å; F128-I186 HydrophobicContact CE1-CG1 4.05Å; F128-I186 HydrophobicContact CZ-CD1 4.43Å; F128-I186 HydrophobicContact CZ-CG1 4.29Å; F128-V207 HydrophobicContact CD2-CG1 4.32Å; F128-V207 HydrophobicContact CE2-CG1 3.53Å; F128-V207 HydrophobicContact CE2-CG2 4.4Å; F128-V207 HydrophobicContact CZ-CG1 4.03Å; F128-L210 HydrophobicContact CB-CD2 4.25Å; F128-L211 HydrophobicContact CD1-CD2 3.98Å; F128-L211 HydrophobicContact CD2-CD2 4.46Å; F128-L211 HydrophobicContact CE1-CD2 4.29Å; F128-L211 HydrophobicContact CG-CD2 4.08Å; F128-A229 HydrophobicContact CD1-CB 4.03Å; F128-A229 HydrophobicContact CE1-CB 3.66Å
129	I	95.1	Very high	93.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.6	-46.7	175.8	-66.7	-58.5	0	0	0	111.5	L125 Q126 S131 C132 C134 V138 M155 L210 L214	L125-I129 WeakPolarHBondContact O-CG1 3.24Å; L125-I129 PolarHBondContact O-N 3.29Å; L125-I129 VanDerWaalsContact O-N 3.1Å; Q126-I129 PolarHBondContact O-N 2.89Å; I129-S131 VanDerWaalsContact C-N 3.31Å; I129-S131 PolarHBondContact O-N 3.04Å; I129-C132 VanDerWaalsContact O-CB 3.27Å; I129-C132 WeakPolarHBondContact O-CB 3.37Å; I129-C132 PolarHBondContact O-N 2.9Å; I129-C132 VanDerWaalsContact O-N 3.1Å; I129-C134 HydrophobicContact CG2-CB 3.63Å; I129-C134 WeakPolarHBondContact O-CB 3.4Å; I129-C134 PolarHBondContact O-N 3.39Å; I129-V138 HydrophobicContact CG1-CG2 3.98Å; I129-M155 HydrophobicContact CD1-CB 4.07Å; I129-M155 HydrophobicContact CD1-CG 3.8Å; I129-M155 HydrophobicContact CG1-CG 4.21Å; I129-M155 HydrophobicContact CG1-SD 4.45Å; I129-M155 HydrophobicContact CG2-CG 4.3Å; I129-M155 HydrophobicContact CG2-SD 3.8Å; I129-L210 HydrophobicContact CD1-CD1 4.4Å; I129-L214 HydrophobicContact CD1-CD1 3.98Å; I129-L214 HydrophobicContact CD1-CD2 3.88Å; I129-L214 HydrophobicContact CD1-CG 4.48Å
130	S	94.2	Very high	93.4	Very high	24 Å²	24	27.1 Å²	27.1	17%	0.168	15%	0.153	C	C	.	.	H	α-helix	trans	-66	-34.3	178.3	-51.4	0	0	0	0	111.9	Q126 C132 G133	Q126-S130 PolarHBondContact NE2-OG 3.13Å; Q126-S130 VanDerWaalsContact O-CB 3.26Å; Q126-S130 WeakPolarHBondContact O-CB 3.45Å; Q126-S130 PolarHBondContact O-N 2.8Å; Q126-S130 PolarHBondContact O-OG 3.17Å; S130-C132 PolarHBondContact O-N 3.45Å; S130-G133 PolarHBondContact O-N 3Å
131	S	95.3	Very high	93.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.7	-23	174.6	-60.9	0	0	0	0	113.1	Y127 F128 I129 G133 F182	Y127-S131 VanDerWaalsContact O-CB 3.28Å; Y127-S131 WeakPolarHBondContact O-CB 3.2Å; Y127-S131 PolarHBondContact O-N 2.53Å; Y127-S131 PolarHBondContact O-OG 3.05Å; F128-S131 PolarHBondContact O-N 3.19Å; I129-S131 VanDerWaalsContact C-N 3.31Å; I129-S131 PolarHBondContact O-N 3.04Å; S131-G133 PolarHBondContact O-N 3.12Å; S131-F182 VanDerWaalsContact CB-CE2 3.46Å; S131-F182 WeakPolarHBondContact OG-CE2 3.31Å
132	C	93.8	Very high	92.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-7.4	169.1	-57.1	0	0	0	0	113.5	F128 I129 S130 C134 F159 Y166 A221 F222 T225	F128-C132 PolarHBondContact O-N 3.02Å; F128-C132 PolarHBondContact O-SG 3.41Å; I129-C132 VanDerWaalsContact O-CB 3.27Å; I129-C132 WeakPolarHBondContact O-CB 3.37Å; I129-C132 PolarHBondContact O-N 2.9Å; I129-C132 VanDerWaalsContact O-N 3.1Å; S130-C132 PolarHBondContact O-N 3.45Å; C132-C134 VanDerWaalsContact C-N 3.31Å; C132-F159 WeakPolarHBondContact O-CE2 3.39Å; C132-Y166 VanDerWaalsContact O-CB 3.3Å; C132-Y166 WeakPolarHBondContact O-CB 3.38Å; C132-A221 WeakPolarHBondContact O-CB 3.38Å; C132-F222 HydrophobicContact CB-CD1 3.52Å; C132-F222 HydrophobicContact CB-CE1 3.72Å; C132-T225 WeakPolarHBondContact SG-CB 3.44Å; C132-T225 VanDerWaalsContact SG-CG2 3.55Å
133	G	91.1	Very high	92.6	Very high	31 Å²	31	31 Å²	31	32%	0.32	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.5	5.1	-171.8	0	0	0	0	0	114.5	S130 S131	S130-G133 PolarHBondContact O-N 3Å; S131-G133 PolarHBondContact O-N 3.12Å
134	C	91.1	Very high	92.3	Very high	8 Å²	8	33.7 Å²	33.7	5%	0.054	19%	0.185	C	C	.	.			trans	-68	141.7	175.4	-172.5	0	0	0	0	110.7	I129 C132 G136 M155 F159 F222	I129-C134 HydrophobicContact CG2-CB 3.63Å; I129-C134 WeakPolarHBondContact O-CB 3.4Å; I129-C134 PolarHBondContact O-N 3.39Å; C132-C134 VanDerWaalsContact C-N 3.31Å; C134-G136 PolarHBondContact SG-N 3.22Å; C134-M155 PolarHBondContact SG-O 2.85Å; C134-F159 HydrophobicContact CB-CD2 3.69Å; C134-F159 HydrophobicContact CB-CE2 4.08Å; C134-F222 HydrophobicContact CB-CE1 4.01Å; C134-F222 HydrophobicContact CB-CZ 4.27Å
135	K	87.1	Confident	91.9	Very high	152 Å²	152	36.5 Å²	36.5	66%	0.661	20%	0.204	S	C	*	.			trans	-94.7	-8.2	176	-62.1	165.8	-168.7	153.1	0	112.3	D160	K135-D160 IonicContact NZ-OD2 3.17Å; K135-D160 PolarHBondContact NZ-OD2 3.41Å
136	G	88.4	Confident	91.4	Very high	3 Å²	3	40.7 Å²	40.7	3%	0.031	23%	0.234	C	C	.	.			trans	-60.6	151	175.8	0	0	0	0	0	112.8	Q126 C134	Q126-G136 PolarHBondContact NE2-O 2.86Å; C134-G136 PolarHBondContact SG-N 3.22Å
137	V	92	Very high	91.2	Very high	100 Å²	100	42.4 Å²	42.4	61%	0.606	24%	0.244	S	C	*	.			trans	-119.3	116.8	-175.1	-177.8	0	0	0	0	109.9	S139 M142	V137-S139 PolarHBondContact O-N 2.84Å; V137-M142 VanDerWaalsContact O-CE 3.31Å; V137-M142 WeakPolarHBondContact O-CE 3.28Å
138	V	92.2	Very high	91	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.024	25%	0.247	C	C	.	.			trans	-68.4	124.7	172	-175.6	0	0	0	0	108.5	M122 L125 I129 I143 L151 M155	M122-V138 HydrophobicContact CG-CG1 4.25Å; L125-V138 HydrophobicContact CB-CG1 4.43Å; I129-V138 HydrophobicContact CG1-CG2 3.98Å; V138-I143 HydrophobicContact CG1-CD1 4.02Å; V138-I143 HydrophobicContact CG1-CG1 4.07Å; V138-L151 HydrophobicContact CG1-CD1 4.21Å; V138-M155 HydrophobicContact CG2-CE 4.19Å; V138-M155 HydrophobicContact CG2-SD 4.37Å
139	S	91	Very high	90.7	Very high	42 Å²	42	46.9 Å²	46.9	29%	0.294	27%	0.266	S	S	.	.			trans	-109.7	153.1	175.3	61.5	0	0	0	0	111.3	V137 D141 M142	V137-S139 PolarHBondContact O-N 2.84Å; S139-D141 PolarHBondContact O-N 2.85Å; S139-D141 VanDerWaalsContact O-N 3.13Å; S139-M142 WeakPolarHBondContact O-CB 3.49Å; S139-M142 PolarHBondContact O-N 2.99Å; S139-M142 WeakPolarHBondContact OG-CE 3.31Å
140	L	90.1	Very high	90.6	Very high	54 Å²	54	51.6 Å²	51.6	28%	0.283	29%	0.291	S	S	.	.	H	α-helix	trans	-49.8	-41.6	-179.2	-143.8	80.7	0	0	0	113.1	E118 V119 M122 M142 I143 Q144	E118-L140 HydrophobicContact CB-CD1 3.89Å; E118-L140 HydrophobicContact CB-CG 4.37Å; V119-L140 HydrophobicContact CG2-CD1 4.12Å; M122-L140 HydrophobicContact CB-CD1 4.48Å; M122-L140 HydrophobicContact SD-CB 4.46Å; M122-L140 HydrophobicContact SD-CD1 4.08Å; L140-M142 VanDerWaalsContact C-N 3.29Å; L140-M142 PolarHBondContact O-N 3.41Å; L140-I143 WeakPolarHBondContact O-CB 3.4Å; L140-I143 PolarHBondContact O-N 3.18Å; L140-Q144 WeakPolarHBondContact O-CG 3.33Å; L140-Q144 PolarHBondContact O-N 3.49Å
141	D	90.1	Very high	90.5	Very high	116 Å²	116	50.6 Å²	50.6	62%	0.62	28%	0.284	S	S	*	.	H	α-helix	trans	-54.9	-37.5	175.4	179.7	74.7	0	0	0	113.6	S139 I143 S145	S139-D141 PolarHBondContact O-N 2.85Å; S139-D141 VanDerWaalsContact O-N 3.13Å; D141-I143 VanDerWaalsContact C-N 3.3Å; D141-I143 PolarHBondContact O-N 3.02Å; D141-S145 WeakPolarHBondContact O-CB 3.39Å; D141-S145 PolarHBondContact O-N 3.18Å
142	M	89.1	Confident	90.3	Very high	15 Å²	15	51.1 Å²	51.1	7%	0.074	29%	0.287	C	S	.	.	H	α-helix	trans	-67.3	-34.3	176.6	-56.9	-176.8	-155.8	0	0	111.3	V137 S139 L140 S145 L151 M155	V137-M142 VanDerWaalsContact O-CE 3.31Å; V137-M142 WeakPolarHBondContact O-CE 3.28Å; S139-M142 WeakPolarHBondContact O-CB 3.49Å; S139-M142 PolarHBondContact O-N 2.99Å; S139-M142 WeakPolarHBondContact OG-CE 3.31Å; L140-M142 VanDerWaalsContact C-N 3.29Å; L140-M142 PolarHBondContact O-N 3.41Å; M142-S145 PolarHBondContact O-OG 3.33Å; M142-L151 HydrophobicContact CB-CD1 4.12Å; M142-L151 HydrophobicContact CB-CG 4.28Å; M142-L151 HydrophobicContact SD-CG 4.22Å; M142-M155 HydrophobicContact CE-CE 3.91Å; M142-M155 HydrophobicContact SD-CE 3.69Å
143	I	87.5	Confident	90.2	Very high	7 Å²	7	58.7 Å²	58.7	4%	0.036	32%	0.316	C	S	.	.	H	α-helix	trans	-76.8	-45.8	-179.7	-58.9	170.7	0	0	0	109.7	V121 M122 L125 V138 L140 D141 S145 S146	V121-I143 HydrophobicContact CG1-CG2 4.5Å; M122-I143 VanDerWaalsContact CA-CD1 3.41Å; M122-I143 HydrophobicContact CB-CD1 3.44Å; M122-I143 VanDerWaalsContact CB-CD1 3.44Å; M122-I143 HydrophobicContact CG-CD1 3.75Å; L125-I143 HydrophobicContact CD1-CD1 4.08Å; L125-I143 HydrophobicContact CD1-CG1 4Å; V138-I143 HydrophobicContact CG1-CD1 4.02Å; V138-I143 HydrophobicContact CG1-CG1 4.07Å; L140-I143 WeakPolarHBondContact O-CB 3.4Å; L140-I143 PolarHBondContact O-N 3.18Å; D141-I143 VanDerWaalsContact C-N 3.3Å; D141-I143 PolarHBondContact O-N 3.02Å; I143-S145 PolarHBondContact O-N 2.63Å; I143-S146 PolarHBondContact O-N 3.46Å
144	Q	88.2	Confident	90.1	Very high	109 Å²	109	63 Å²	63	51%	0.509	32%	0.322	S	S	.	.	H	α-helix	trans	-60.8	-29.3	175.7	-69.7	178.5	-12.9	0	0	112.3	E118 L140 S146	E118-Q144 PolarHBondContact OE2-NE2 2.84Å; L140-Q144 WeakPolarHBondContact O-CG 3.33Å; L140-Q144 PolarHBondContact O-N 3.49Å; Q144-S146 PolarHBondContact O-N 3.43Å
145	S	88.2	Confident	90.2	Very high	61 Å²	61	62.6 Å²	62.6	43%	0.427	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-22.4	172.9	83.7	0	0	0	0	114.3	D141 M142 I143 D147	D141-S145 WeakPolarHBondContact O-CB 3.39Å; D141-S145 PolarHBondContact O-N 3.18Å; M142-S145 PolarHBondContact O-OG 3.33Å; I143-S145 PolarHBondContact O-N 2.63Å; S145-D147 PolarHBondContact O-N 3.24Å; S145-D147 PolarHBondContact OG-N 2.89Å; S145-D147 VanDerWaalsContact OG-N 3.15Å
146	S	85.8	Confident	90.2	Very high	88 Å²	88	57.2 Å²	57.2	62%	0.615	30%	0.299	S	S	*	.			trans	55	6.3	-168.5	-57.3	0	0	0	0	115.9	I143 Q144 F148	I143-S146 PolarHBondContact O-N 3.46Å; Q144-S146 PolarHBondContact O-N 3.43Å; S146-F148 WeakPolarHBondContact O-CD2 3.26Å; S146-F148 PolarHBondContact O-N 3.46Å
147	D	91.7	Very high	90.1	Very high	70 Å²	70	64.5 Å²	64.5	37%	0.374	33%	0.333	S	S	.	.			trans	-89.7	81.2	178.9	-169.1	-14.8	0	0	0	111.2	S145 I149 L150 L151	S145-D147 PolarHBondContact O-N 3.24Å; S145-D147 PolarHBondContact OG-N 2.89Å; S145-D147 VanDerWaalsContact OG-N 3.15Å; D147-I149 PolarHBondContact O-N 2.86Å; D147-I149 WeakPolarHBondContact OD1-CA 3.43Å; D147-I149 WeakPolarHBondContact OD1-CB 3.19Å; D147-I149 PolarHBondContact OD1-N 3.39Å; D147-L150 HydrophobicContact CB-CB 4.01Å; D147-L150 VanDerWaalsContact CG-CB 3.45Å; D147-L150 PolarHBondContact O-N 3.43Å; D147-L150 PolarHBondContact OD1-N 2.63Å; D147-L150 WeakPolarHBondContact OD2-CB 3.49Å; D147-L151 PolarHBondContact O-N 2.93Å
148	F	92.3	Very high	89.7	Confident	18 Å²	18	63.4 Å²	63.4	8%	0.079	32%	0.323	C	S	.	.	H	α-helix	trans	-64.9	-19.3	175.9	-70.1	-91.5	0	0	0	113.4	L125 S146 L151 V152 S206 S209 L210	L125-F148 HydrophobicContact CD1-CE1 3.9Å; S146-F148 WeakPolarHBondContact O-CD2 3.26Å; S146-F148 PolarHBondContact O-N 3.46Å; F148-L151 HydrophobicContact CD1-CD1 4.29Å; F148-V152 WeakPolarHBondContact O-CG2 3.4Å; F148-V152 PolarHBondContact O-N 2.91Å; F148-S206 VanDerWaalsContact CE1-O 3.24Å; F148-S206 WeakPolarHBondContact CE1-O 3.24Å; F148-S209 WeakPolarHBondContact CB-OG 3.26Å; F148-S209 WeakPolarHBondContact CD2-OG 3.35Å; F148-S209 VanDerWaalsContact CG-OG 3.25Å; F148-S209 WeakPolarHBondContact CG-OG 3.26Å; F148-L210 HydrophobicContact CD1-CB 3.91Å; F148-L210 HydrophobicContact CD1-CD1 4.43Å; F148-L210 HydrophobicContact CE1-CB 4.12Å
149	I	91	Very high	89.3	Confident	82 Å²	82	64.5 Å²	64.5	42%	0.421	33%	0.328	S	S	.	.	H	α-helix	trans	-71.1	-47.3	173.9	-58.3	169	0	0	0	109.1	D147 V152 R153 H213	D147-I149 PolarHBondContact O-N 2.86Å; D147-I149 WeakPolarHBondContact OD1-CA 3.43Å; D147-I149 WeakPolarHBondContact OD1-CB 3.19Å; D147-I149 PolarHBondContact OD1-N 3.39Å; I149-V152 PolarHBondContact O-N 3.26Å; I149-R153 WeakPolarHBondContact O-CB 3.28Å; I149-R153 WeakPolarHBondContact O-CG 3.48Å; I149-R153 PolarHBondContact O-N 3.14Å; I149-H213 WeakPolarHBondContact CG1-NE2 3.31Å
150	L	91.8	Very high	88.6	Confident	99 Å²	99	65.9 Å²	65.9	52%	0.518	33%	0.332	S	S	.	.	H	α-helix	trans	-64	-40.9	175.8	-176.1	62.5	0	0	0	111.7	D147 R153 R154	D147-L150 HydrophobicContact CB-CB 4.01Å; D147-L150 VanDerWaalsContact CG-CB 3.45Å; D147-L150 PolarHBondContact O-N 3.43Å; D147-L150 PolarHBondContact OD1-N 2.63Å; D147-L150 WeakPolarHBondContact OD2-CB 3.49Å; L150-R153 PolarHBondContact O-N 2.72Å; L150-R154 WeakPolarHBondContact O-CB 3.45Å; L150-R154 PolarHBondContact O-N 3.45Å
151	L	92.2	Very high	87.4	Confident	3 Å²	3	70.8 Å²	70.8	2%	0.016	35%	0.353	C	S	.	.	H	α-helix	trans	-56.7	-53.8	173.8	-170.1	166.8	0	0	0	110.7	V138 M142 D147 F148 R153 R154 M155 L210	V138-L151 HydrophobicContact CG1-CD1 4.21Å; M142-L151 HydrophobicContact CB-CD1 4.12Å; M142-L151 HydrophobicContact CB-CG 4.28Å; M142-L151 HydrophobicContact SD-CG 4.22Å; D147-L151 PolarHBondContact O-N 2.93Å; F148-L151 HydrophobicContact CD1-CD1 4.29Å; L151-R153 VanDerWaalsContact C-N 3.34Å; L151-R153 PolarHBondContact O-N 3Å; L151-R154 PolarHBondContact O-N 3.21Å; L151-M155 HydrophobicContact CD2-CG 3.82Å; L151-M155 WeakPolarHBondContact O-CG 3.5Å; L151-M155 PolarHBondContact O-N 2.92Å; L151-L210 HydrophobicContact CD2-CD1 3.71Å
152	V	92.2	Very high	86	Confident	11 Å²	11	73.9 Å²	73.9	7%	0.067	36%	0.364	C	S	.	.	H	α-helix	trans	-65.1	-35.8	-179.3	170.2	0	0	0	0	112.2	F148 I149 M155 T156 L210 H213 L214	F148-V152 WeakPolarHBondContact O-CG2 3.4Å; F148-V152 PolarHBondContact O-N 2.91Å; I149-V152 PolarHBondContact O-N 3.26Å; V152-M155 PolarHBondContact O-N 2.68Å; V152-T156 PolarHBondContact O-N 3.3Å; V152-T156 PolarHBondContact O-OG1 3.07Å; V152-L210 HydrophobicContact CG2-CD1 3.84Å; V152-H213 HydrophobicContact CB-CB 4.33Å; V152-H213 HydrophobicContact CG2-CB 3.76Å; V152-L214 HydrophobicContact CG1-CD2 4.04Å; V152-L214 HydrophobicContact CG2-CD2 3.82Å; V152-L214 HydrophobicContact CG2-CG 3.93Å
153	R	90.2	Very high	85	Confident	160 Å²	160	75.6 Å²	75.6	60%	0.604	38%	0.378	S	S	*	.	H	α-helix	trans	-59.2	-50	172.6	-77.5	175.2	177	-178.3	0.5	111.6	I149 L150 L151 M155 T156 E157	I149-R153 WeakPolarHBondContact O-CB 3.28Å; I149-R153 WeakPolarHBondContact O-CG 3.48Å; I149-R153 PolarHBondContact O-N 3.14Å; L150-R153 PolarHBondContact O-N 2.72Å; L151-R153 VanDerWaalsContact C-N 3.34Å; L151-R153 PolarHBondContact O-N 3Å; R153-M155 PolarHBondContact O-N 3.05Å; R153-T156 CarbonylContact O-C 3.6Å; R153-T156 WeakPolarHBondContact O-CA 3.3Å; R153-T156 VanDerWaalsContact O-CB 3.27Å; R153-T156 WeakPolarHBondContact O-CB 3.32Å; R153-T156 PolarHBondContact O-N 2.86Å; R153-E157 PolarHBondContact O-N 3.46Å
154	R	90.9	Very high	84.5	Confident	121 Å²	121	80 Å²	80	46%	0.457	41%	0.405	S	S	.	.	H	α-helix	trans	-62	-40.5	177.6	-172.1	172	179.3	169.1	-0.1	112.7	L150 L151 T156 E157 D158	L150-R154 WeakPolarHBondContact O-CB 3.45Å; L150-R154 PolarHBondContact O-N 3.45Å; L151-R154 PolarHBondContact O-N 3.21Å; R154-T156 PolarHBondContact O-N 3.49Å; R154-E157 WeakPolarHBondContact O-CB 3.33Å; R154-E157 PolarHBondContact O-N 3.17Å; R154-D158 PolarHBondContact O-N 3.06Å
155	M	92.5	Very high	84.4	Confident	0 Å²	0	78.5 Å²	78.5	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-67.3	-21.8	173.7	-62.8	-60	133.6	0	0	113.1	I129 C134 V138 M142 L151 V152 R153 F159 F222	I129-M155 HydrophobicContact CD1-CB 4.07Å; I129-M155 HydrophobicContact CD1-CG 3.8Å; I129-M155 HydrophobicContact CG1-CG 4.21Å; I129-M155 HydrophobicContact CG1-SD 4.45Å; I129-M155 HydrophobicContact CG2-CG 4.3Å; I129-M155 HydrophobicContact CG2-SD 3.8Å; C134-M155 PolarHBondContact SG-O 2.85Å; V138-M155 HydrophobicContact CG2-CE 4.19Å; V138-M155 HydrophobicContact CG2-SD 4.37Å; M142-M155 HydrophobicContact CE-CE 3.91Å; M142-M155 HydrophobicContact SD-CE 3.69Å; L151-M155 HydrophobicContact CD2-CG 3.82Å; L151-M155 WeakPolarHBondContact O-CG 3.5Å; L151-M155 PolarHBondContact O-N 2.92Å; V152-M155 PolarHBondContact O-N 2.68Å; R153-M155 PolarHBondContact O-N 3.05Å; M155-F159 PolarHBondContact O-N 3.37Å; M155-F222 HydrophobicContact CB-CZ 4.41Å; M155-F222 WeakPolarHBondContact O-CZ 3.28Å
156	T	87.3	Confident	84.5	Confident	38 Å²	38	75.9 Å²	75.9	23%	0.233	38%	0.381	C	S	.	.	H	α-helix	trans	-78.1	-38.4	171.9	-48.5	0	0	0	0	110.9	V152 R153 R154 D158 F159 F222	V152-T156 PolarHBondContact O-N 3.3Å; V152-T156 PolarHBondContact O-OG1 3.07Å; R153-T156 CarbonylContact O-C 3.6Å; R153-T156 WeakPolarHBondContact O-CA 3.3Å; R153-T156 VanDerWaalsContact O-CB 3.27Å; R153-T156 WeakPolarHBondContact O-CB 3.32Å; R153-T156 PolarHBondContact O-N 2.86Å; R154-T156 PolarHBondContact O-N 3.49Å; T156-D158 VanDerWaalsContact C-N 3.34Å; T156-F159 VanDerWaalsContact O-CB 3.26Å; T156-F159 WeakPolarHBondContact O-CB 3.49Å; T156-F159 PolarHBondContact O-N 3.41Å; T156-F222 WeakPolarHBondContact OG1-CE2 3.42Å
157	E	86.4	Confident	84.8	Confident	156 Å²	156	72.2 Å²	72.2	73%	0.729	36%	0.355	S	S	*	.	H	α-helix	trans	-63.8	-37.2	172.9	-67.3	167.1	-168.7	0	0	112.2	R153 R154 F159	R153-E157 PolarHBondContact O-N 3.46Å; R154-E157 WeakPolarHBondContact O-CB 3.33Å; R154-E157 PolarHBondContact O-N 3.17Å; E157-F159 PolarHBondContact O-N 2.92Å
158	D	82.8	Confident	84.9	Confident	77 Å²	77	69.1 Å²	69.1	41%	0.412	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	3.8	172.2	-72.5	-29.2	0	0	0	113.3	R154 T156	R154-D158 PolarHBondContact O-N 3.06Å; T156-D158 VanDerWaalsContact C-N 3.34Å
159	F	83.9	Confident	84.8	Confident	28 Å²	28	70.4 Å²	70.4	12%	0.123	35%	0.346	C	S	.	.	S	Bend	trans	-90	133.8	179	-158.4	-96.5	0	0	0	112.1	C132 C134 M155 T156 E157 E161 A221 F222	C132-F159 WeakPolarHBondContact O-CE2 3.39Å; C134-F159 HydrophobicContact CB-CD2 3.69Å; C134-F159 HydrophobicContact CB-CE2 4.08Å; M155-F159 PolarHBondContact O-N 3.37Å; T156-F159 VanDerWaalsContact O-CB 3.26Å; T156-F159 WeakPolarHBondContact O-CB 3.49Å; T156-F159 PolarHBondContact O-N 3.41Å; E157-F159 PolarHBondContact O-N 2.92Å; F159-E161 PolarHBondContact O-N 3.35Å; F159-E161 VanDerWaalsContact O-N 3.1Å; F159-A221 HydrophobicContact CE1-CB 4.28Å; F159-A221 HydrophobicContact CE2-CB 4.11Å; F159-A221 HydrophobicContact CZ-CB 3.53Å; F159-F222 HydrophobicContact CB-CZ 4.04Å; F159-F222 HydrophobicContact CD2-CD1 4.44Å; F159-F222 AromaticContact CD2-CE1 3.37Å; F159-F222 HydrophobicContact CD2-CE1 3.37Å; F159-F222 AromaticContact CD2-CZ 3.47Å; F159-F222 HydrophobicContact CD2-CZ 3.47Å; F159-F222 VanDerWaalsContact CD2-CZ 3.47Å; F159-F222 HydrophobicContact CE2-CD1 4.39Å; F159-F222 AromaticContact CE2-CE1 3.62Å; F159-F222 HydrophobicContact CE2-CE1 3.62Å; F159-F222 HydrophobicContact CE2-CZ 4.19Å; F159-F222 HydrophobicContact CG-CE1 4.18Å; F159-F222 AromaticContact CG-CZ 3.92Å; F159-F222 HydrophobicContact CG-CZ 3.92Å
160	D	75.8	Confident	84.9	Confident	70 Å²	70	68.8 Å²	68.8	37%	0.374	34%	0.338	S	S	.	.			trans	-81.3	86.3	177.5	-164.3	-19.3	0	0	0	109.2	K135 E162 S163	K135-D160 IonicContact NZ-OD2 3.17Å; K135-D160 PolarHBondContact NZ-OD2 3.41Å; D160-E162 PolarHBondContact O-N 3.43Å; D160-E162 VanDerWaalsContact O-N 3.15Å; D160-S163 WeakPolarHBondContact O-CB 3.25Å; D160-S163 PolarHBondContact O-N 2.97Å
161	E	66.1	Low	84.7	Confident	157 Å²	157	69.8 Å²	69.8	73%	0.734	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-21.7	-176.5	-69.2	-159.3	148.4	0	0	113.7	F159 S163	F159-E161 PolarHBondContact O-N 3.35Å; F159-E161 VanDerWaalsContact O-N 3.1Å; E161-S163 VanDerWaalsContact C-N 3.25Å; E161-S163 PolarHBondContact O-N 3.37Å
162	E	61	Low	84.5	Confident	181 Å²	181	71.2 Å²	71.2	85%	0.846	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-20.7	173.9	-61.1	-170.2	176.5	0	0	112.4	D160 V164	D160-E162 PolarHBondContact O-N 3.43Å; D160-E162 VanDerWaalsContact O-N 3.15Å; E162-V164 PolarHBondContact O-N 2.77Å; E162-V164 VanDerWaalsContact O-N 3.07Å
163	S	68.1	Low	84.4	Confident	52 Å²	52	75.1 Å²	75.1	36%	0.364	39%	0.391	S	S	.	.			trans	-78.2	91.7	177	-168.7	0	0	0	0	111.5	D160 E161 D165	D160-S163 WeakPolarHBondContact O-CB 3.25Å; D160-S163 PolarHBondContact O-N 2.97Å; E161-S163 VanDerWaalsContact C-N 3.25Å; E161-S163 PolarHBondContact O-N 3.37Å; S163-D165 PolarHBondContact O-N 3.02Å; S163-D165 PolarHBondContact OG-O 3.31Å
164	V	76	Confident	84.4	Confident	99 Å²	99	71.1 Å²	71.1	60%	0.6	38%	0.379	S	S	*	.			trans	-59.8	-30.6	170.9	-174.5	0	0	0	0	111.8	E162	E162-V164 PolarHBondContact O-N 2.77Å; E162-V164 VanDerWaalsContact O-N 3.07Å
165	D	85.6	Confident	84.5	Confident	78 Å²	78	68.6 Å²	68.6	42%	0.417	37%	0.37	S	S	.	.			trans	-87.9	142.5	-179.1	-78.9	-32.2	0	0	0	113.3	S163 L170	S163-D165 PolarHBondContact O-N 3.02Å; S163-D165 PolarHBondContact OG-O 3.31Å; D165-L170 HydrophobicContact CB-CD2 3.77Å; D165-L170 HydrophobicContact CB-CG 4.48Å
166	Y	91.3	Very high	84.4	Confident	6 Å²	6	75.8 Å²	75.8	2%	0.024	40%	0.397	C	S	.	.			trans	-147.5	158.9	172.5	56.8	-86.4	0	0	0	111.4	C132 L168 I169 L170 R220 A221 H224	C132-Y166 VanDerWaalsContact O-CB 3.3Å; C132-Y166 WeakPolarHBondContact O-CB 3.38Å; Y166-L168 HydrophobicContact CD2-CB 4.39Å; Y166-L168 HydrophobicContact CE2-CB 4.32Å; Y166-L168 PolarHBondContact O-N 3.1Å; Y166-I169 HydrophobicContact CD1-CD1 3.62Å; Y166-I169 HydrophobicContact CD1-CG1 3.79Å; Y166-I169 HydrophobicContact CD2-CG1 4.17Å; Y166-I169 HydrophobicContact CE1-CD1 3.33Å; Y166-I169 HydrophobicContact CE1-CG1 3.71Å; Y166-I169 HydrophobicContact CE1-CG2 4.24Å; Y166-I169 HydrophobicContact CE2-CB 4.48Å; Y166-I169 HydrophobicContact CE2-CG1 4.08Å; Y166-I169 HydrophobicContact CE2-CG2 3.79Å; Y166-I169 HydrophobicContact CG-CD1 4.35Å; Y166-I169 HydrophobicContact CG-CG1 4.01Å; Y166-I169 VanDerWaalsContact O-CG1 3.31Å; Y166-I169 WeakPolarHBondContact O-CG1 3.23Å; Y166-I169 PolarHBondContact O-N 3.36Å; Y166-I169 WeakPolarHBondContact OH-CG2 3.28Å; Y166-L170 PolarHBondContact O-N 3.46Å; Y166-R220 HydrophobicContact CE1-CG 4.19Å; Y166-A221 HydrophobicContact CD1-CB 3.6Å; Y166-A221 HydrophobicContact CD2-CB 4.11Å; Y166-A221 HydrophobicContact CE1-CB 4.09Å; Y166-A221 HydrophobicContact CG-CB 3.62Å; Y166-H224 HydrophobicContact CE2-CB 4.06Å; Y166-H224 AromaticContact CE2-CG 3.94Å; Y166-H224 AromaticContact CE2-ND1 3.59Å; Y166-H224 AromaticContact CZ-CG 3.98Å; Y166-H224 VanDerWaalsContact OH-CB 3.24Å; Y166-H224 WeakPolarHBondContact OH-CB 3.4Å
167	P	92.1	Very high	84.7	Confident	10 Å²	10	81 Å²	81	7%	0.065	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-29.1	-164.8	-34.8	39.1	0	0	0	118	F92 W175 F178	F92-P167 HydrophobicContact CE2-CB 4.45Å; F92-P167 HydrophobicContact CE2-CG 4.35Å; F92-P167 HydrophobicContact CZ-CG 4.19Å; P167-W175 HydrophobicContact CB-CE3 4.21Å; P167-W175 HydrophobicContact CB-CZ3 3.84Å; P167-W175 HydrophobicContact CG-CZ3 4.38Å; P167-F178 HydrophobicContact CB-CD1 3.97Å; P167-F178 HydrophobicContact CB-CE1 3.54Å
168	L	93.2	Very high	85.1	Confident	5 Å²	5	73.6 Å²	73.6	3%	0.026	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-14	-177.7	-65.1	179.6	0	0	0	115	Y166 F178 R179 F182 T225 L228	Y166-L168 HydrophobicContact CD2-CB 4.39Å; Y166-L168 HydrophobicContact CE2-CB 4.32Å; Y166-L168 PolarHBondContact O-N 3.1Å; L168-F178 HydrophobicContact CD2-CD1 4.19Å; L168-F178 HydrophobicContact CD2-CE1 3.79Å; L168-F178 HydrophobicContact CG-CE1 4.45Å; L168-R179 HydrophobicContact CD2-CB 4.03Å; L168-R179 HydrophobicContact CD2-CG 4.13Å; L168-F182 HydrophobicContact CD1-CD1 4.38Å; L168-F182 HydrophobicContact CD1-CE1 4.11Å; L168-F182 HydrophobicContact CD1-CZ 4.37Å; L168-F182 HydrophobicContact CD2-CB 4.25Å; L168-F182 HydrophobicContact CD2-CD1 4.13Å; L168-F182 HydrophobicContact CD2-CG 4.08Å; L168-T225 HydrophobicContact CD1-CG2 3.77Å; L168-L228 HydrophobicContact CD1-CD2 3.89Å
169	I	91.5	Very high	85.7	Confident	46 Å²	46	75 Å²	75	24%	0.236	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-14.3	175.9	60.5	162.5	0	0	0	113.5	Y166 T171	Y166-I169 HydrophobicContact CD1-CD1 3.62Å; Y166-I169 HydrophobicContact CD1-CG1 3.79Å; Y166-I169 HydrophobicContact CD2-CG1 4.17Å; Y166-I169 HydrophobicContact CE1-CD1 3.33Å; Y166-I169 HydrophobicContact CE1-CG1 3.71Å; Y166-I169 HydrophobicContact CE1-CG2 4.24Å; Y166-I169 HydrophobicContact CE2-CB 4.48Å; Y166-I169 HydrophobicContact CE2-CG1 4.08Å; Y166-I169 HydrophobicContact CE2-CG2 3.79Å; Y166-I169 HydrophobicContact CG-CD1 4.35Å; Y166-I169 HydrophobicContact CG-CG1 4.01Å; Y166-I169 VanDerWaalsContact O-CG1 3.31Å; Y166-I169 WeakPolarHBondContact O-CG1 3.23Å; Y166-I169 PolarHBondContact O-N 3.36Å; Y166-I169 WeakPolarHBondContact OH-CG2 3.28Å; I169-T171 PolarHBondContact O-N 3.43Å
170	L	91.5	Very high	86.2	Confident	47 Å²	47	78.7 Å²	78.7	25%	0.246	40%	0.395	C	S	.	.			trans	-55.8	133.5	177.2	-77.5	174.9	0	0	0	112.3	D165 Y166 W175	D165-L170 HydrophobicContact CB-CD2 3.77Å; D165-L170 HydrophobicContact CB-CG 4.48Å; Y166-L170 PolarHBondContact O-N 3.46Å; L170-W175 HydrophobicContact CB-CB 3.9Å; L170-W175 HydrophobicContact CB-CD2 4Å; L170-W175 HydrophobicContact CB-CG 3.57Å; L170-W175 HydrophobicContact CD1-CD2 3.84Å; L170-W175 HydrophobicContact CD1-CE3 4.33Å; L170-W175 HydrophobicContact CD1-CG 4.27Å; L170-W175 HydrophobicContact CD1-CH2 4.25Å; L170-W175 HydrophobicContact CD1-CZ2 3.73Å; L170-W175 VanDerWaalsContact O-CB 3.23Å; L170-W175 WeakPolarHBondContact O-CB 3.28Å
171	T	89.1	Confident	87.2	Confident	121 Å²	121	76.4 Å²	76.4	74%	0.742	38%	0.383	S	S	*	.			trans	-79.8	159.5	178.4	65.4	0	0	0	0	111.8	I169	I169-T171 PolarHBondContact O-N 3.43Å
172	G	87.3	Confident	88.7	Confident	32 Å²	32	69 Å²	69	33%	0.33	35%	0.348	S	S	.	.	S	Bend	trans	120.4	168	-177.2	0	0	0	0	0	113.6	R176	G172-R176 WeakPolarHBondContact O-CB 3.4Å; G172-R176 WeakPolarHBondContact O-CG 3.43Å; G172-R176 PolarHBondContact O-N 2.91Å; G172-R176 PolarHBondContact O-NE 3.16Å
173	S	89.8	Confident	90.5	Very high	93 Å²	93	60.8 Å²	60.8	65%	0.65	31%	0.311	S	S	*	.	H	α-helix	trans	-74.6	-39.6	-179.8	51.5	0	0	0	0	112.5	R177	S173-R177 PolarHBondContact O-N 3.38Å
174	H	90.1	Very high	91.8	Very high	76 Å²	76	61.2 Å²	61.2	35%	0.352	31%	0.309	S	S	.	.	H	α-helix	trans	-62.8	-50.5	177.6	177.6	-97	0	0	0	112.2	R177 F178	H174-R177 WeakPolarHBondContact O-CB 3.36Å; H174-R177 PolarHBondContact O-N 2.87Å; H174-R177 VanDerWaalsContact O-N 3.14Å; H174-F178 PolarHBondContact O-N 2.84Å
175	W	92.8	Very high	92.8	Very high	68 Å²	68	56.5 Å²	56.5	26%	0.258	28%	0.28	S	S	.	.	H	α-helix	trans	-68.4	-35.7	179.9	-64.8	118.4	0	0	0	113.3	R96 P167 L170 R177 F178 R179	R96-W175 HydrophobicContact CG-CZ3 4.26Å; P167-W175 HydrophobicContact CB-CE3 4.21Å; P167-W175 HydrophobicContact CB-CZ3 3.84Å; P167-W175 HydrophobicContact CG-CZ3 4.38Å; L170-W175 HydrophobicContact CB-CB 3.9Å; L170-W175 HydrophobicContact CB-CD2 4Å; L170-W175 HydrophobicContact CB-CG 3.57Å; L170-W175 HydrophobicContact CD1-CD2 3.84Å; L170-W175 HydrophobicContact CD1-CE3 4.33Å; L170-W175 HydrophobicContact CD1-CG 4.27Å; L170-W175 HydrophobicContact CD1-CH2 4.25Å; L170-W175 HydrophobicContact CD1-CZ2 3.73Å; L170-W175 VanDerWaalsContact O-CB 3.23Å; L170-W175 WeakPolarHBondContact O-CB 3.28Å; W175-R177 VanDerWaalsContact C-N 3.32Å; W175-R177 PolarHBondContact O-N 2.75Å; W175-F178 HydrophobicContact CE3-CB 4.34Å; W175-F178 HydrophobicContact CE3-CD1 4.1Å; W175-F178 HydrophobicContact CE3-CG 4.48Å; W175-F178 HydrophobicContact CZ3-CD1 4.31Å; W175-F178 PolarHBondContact O-N 2.74Å; W175-R179 PolarHBondContact O-N 3.25Å
176	R	91.3	Very high	93.4	Very high	152 Å²	152	53 Å²	53	57%	0.574	26%	0.261	S	S	*	.	H	α-helix	trans	-60.9	-39.2	168.7	-79.7	-177.6	-73.1	161.1	-11	112.7	G172 Q180	G172-R176 WeakPolarHBondContact O-CB 3.4Å; G172-R176 WeakPolarHBondContact O-CG 3.43Å; G172-R176 PolarHBondContact O-N 2.91Å; G172-R176 PolarHBondContact O-NE 3.16Å; R176-Q180 PolarHBondContact O-N 3.25Å
177	R	92.9	Very high	93.6	Very high	148 Å²	148	53.2 Å²	53.2	56%	0.558	26%	0.263	S	S	*	.	H	α-helix	trans	-65.6	-44.4	172.8	-174.3	-175.6	-65.6	166.2	-1.7	111.2	S173 H174 W175 R179 Q180 N181	S173-R177 PolarHBondContact O-N 3.38Å; H174-R177 WeakPolarHBondContact O-CB 3.36Å; H174-R177 PolarHBondContact O-N 2.87Å; H174-R177 VanDerWaalsContact O-N 3.14Å; W175-R177 VanDerWaalsContact C-N 3.32Å; W175-R177 PolarHBondContact O-N 2.75Å; R177-R179 PolarHBondContact O-N 2.98Å; R177-Q180 PolarHBondContact O-N 3.39Å; R177-N181 WeakPolarHBondContact O-CB 3.38Å; R177-N181 VanDerWaalsContact O-CG 3.26Å; R177-N181 PolarHBondContact O-N 3.24Å; R177-N181 PolarHBondContact O-OD1 3.12Å
178	F	95.4	Very high	93.9	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-57.8	-45.6	175.4	170.4	-112.3	0	0	0	112	F92 V95 R96 P167 L168 H174 W175 Q180 N181 F182	F92-F178 HydrophobicContact CD2-CE2 4.07Å; F92-F178 AromaticContact CD2-CZ 3.87Å; F92-F178 HydrophobicContact CD2-CZ 3.87Å; F92-F178 HydrophobicContact CE2-CE1 4.04Å; F92-F178 AromaticContact CE2-CE2 3.94Å; F92-F178 HydrophobicContact CE2-CE2 3.94Å; F92-F178 AromaticContact CE2-CZ 3.49Å; F92-F178 HydrophobicContact CE2-CZ 3.49Å; F92-F178 VanDerWaalsContact CE2-CZ 3.49Å; V95-F178 HydrophobicContact CG1-CD2 4.39Å; V95-F178 HydrophobicContact CG1-CE2 4.26Å; R96-F178 HydrophobicContact CB-CD2 3.74Å; R96-F178 HydrophobicContact CB-CE2 4.23Å; R96-F178 HydrophobicContact CB-CG 4.35Å; R96-F178 HydrophobicContact CG-CB 4.27Å; R96-F178 HydrophobicContact CG-CD2 4.12Å; R96-F178 HydrophobicContact CG-CG 4.22Å; P167-F178 HydrophobicContact CB-CD1 3.97Å; P167-F178 HydrophobicContact CB-CE1 3.54Å; L168-F178 HydrophobicContact CD2-CD1 4.19Å; L168-F178 HydrophobicContact CD2-CE1 3.79Å; L168-F178 HydrophobicContact CG-CE1 4.45Å; H174-F178 PolarHBondContact O-N 2.84Å; W175-F178 HydrophobicContact CE3-CB 4.34Å; W175-F178 HydrophobicContact CE3-CD1 4.1Å; W175-F178 HydrophobicContact CE3-CG 4.48Å; W175-F178 HydrophobicContact CZ3-CD1 4.31Å; W175-F178 PolarHBondContact O-N 2.74Å; F178-Q180 VanDerWaalsContact C-N 3.3Å; F178-Q180 PolarHBondContact O-N 3.32Å; F178-N181 PolarHBondContact O-N 3.01Å; F178-F182 HydrophobicContact CE2-CB 4.4Å; F178-F182 HydrophobicContact CZ-CB 4.39Å; F178-F182 HydrophobicContact CZ-CD2 4.13Å; F178-F182 VanDerWaalsContact O-CB 3.28Å; F178-F182 WeakPolarHBondContact O-CB 3.17Å; F178-F182 PolarHBondContact O-N 2.96Å
179	R	95.3	Very high	94	Very high	107 Å²	107	53.9 Å²	53.9	40%	0.404	27%	0.267	S	S	.	.	H	α-helix	trans	-58.4	-40.1	176.3	177.4	175.7	175.9	-176.5	1.2	112.8	L168 W175 R177 C183	L168-R179 HydrophobicContact CD2-CB 4.03Å; L168-R179 HydrophobicContact CD2-CG 4.13Å; W175-R179 PolarHBondContact O-N 3.25Å; R177-R179 PolarHBondContact O-N 2.98Å; R179-C183 PolarHBondContact O-N 2.94Å; R179-C183 PolarHBondContact O-SG 2.84Å
180	Q	95.1	Very high	94.3	Very high	104 Å²	104	51.8 Å²	51.8	49%	0.486	26%	0.257	S	S	.	.	H	α-helix	trans	-66.2	-52.9	174.3	-175.3	60	45.2	0	0	111	R176 R177 F178 F182 C183 D184	R176-Q180 PolarHBondContact O-N 3.25Å; R177-Q180 PolarHBondContact O-N 3.39Å; F178-Q180 VanDerWaalsContact C-N 3.3Å; F178-Q180 PolarHBondContact O-N 3.32Å; Q180-F182 PolarHBondContact O-N 3.35Å; Q180-C183 WeakPolarHBondContact O-CB 3.37Å; Q180-C183 PolarHBondContact O-N 3.44Å; Q180-D184 WeakPolarHBondContact CG-OD2 3.5Å; Q180-D184 PolarHBondContact NE2-OD1 3.12Å; Q180-D184 PolarHBondContact NE2-OD2 3.38Å; Q180-D184 PolarHBondContact O-N 3.5Å
181	N	96.6	Very high	94.5	Very high	23 Å²	23	53.7 Å²	53.7	12%	0.123	26%	0.261	C	S	.	.	H	α-helix	trans	-56.9	-34.9	178	-68.9	6	0	0	0	112.6	V95 L102 R177 F178 F185	V95-N181 HydrophobicContact CG1-CB 3.73Å; V95-N181 WeakPolarHBondContact O-CB 3.33Å; V95-N181 PolarHBondContact O-ND2 2.71Å; L102-N181 HydrophobicContact CD1-CB 4.24Å; L102-N181 HydrophobicContact CD2-CB 4.43Å; R177-N181 WeakPolarHBondContact O-CB 3.38Å; R177-N181 VanDerWaalsContact O-CG 3.26Å; R177-N181 PolarHBondContact O-N 3.24Å; R177-N181 PolarHBondContact O-OD1 3.12Å; F178-N181 PolarHBondContact O-N 3.01Å; N181-F185 WeakPolarHBondContact O-CB 3.39Å; N181-F185 PolarHBondContact O-N 2.88Å
182	F	97.4	Very high	94.7	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.5	-46.8	175.1	175.5	-91	0	0	0	111.5	Y127 F128 S131 L168 F178 Q180 I186 T225 L228 A229	Y127-F182 HydrophobicContact CE1-CD2 4.12Å; Y127-F182 HydrophobicContact CE1-CE2 4.03Å; Y127-F182 HydrophobicContact CE2-CD2 4.41Å; Y127-F182 AromaticContact CZ-CD2 3.66Å; Y127-F182 WeakPolarHBondContact OH-CA 3.49Å; Y127-F182 WeakPolarHBondContact OH-CD2 3.3Å; F128-F182 HydrophobicContact CD1-CE2 4.23Å; F128-F182 HydrophobicContact CD1-CZ 4.24Å; F128-F182 HydrophobicContact CE1-CE2 4.47Å; F128-F182 HydrophobicContact CE1-CZ 4.38Å; S131-F182 VanDerWaalsContact CB-CE2 3.46Å; S131-F182 WeakPolarHBondContact OG-CE2 3.31Å; L168-F182 HydrophobicContact CD1-CD1 4.38Å; L168-F182 HydrophobicContact CD1-CE1 4.11Å; L168-F182 HydrophobicContact CD1-CZ 4.37Å; L168-F182 HydrophobicContact CD2-CB 4.25Å; L168-F182 HydrophobicContact CD2-CD1 4.13Å; L168-F182 HydrophobicContact CD2-CG 4.08Å; F178-F182 HydrophobicContact CE2-CB 4.4Å; F178-F182 HydrophobicContact CZ-CB 4.39Å; F178-F182 HydrophobicContact CZ-CD2 4.13Å; F178-F182 VanDerWaalsContact O-CB 3.28Å; F178-F182 WeakPolarHBondContact O-CB 3.17Å; F178-F182 PolarHBondContact O-N 2.96Å; Q180-F182 PolarHBondContact O-N 3.35Å; F182-I186 HydrophobicContact CD1-CD1 3.96Å; F182-I186 HydrophobicContact CE1-CD1 3.62Å; F182-I186 HydrophobicContact CE2-CD1 4.24Å; F182-I186 HydrophobicContact CG-CD1 4.42Å; F182-I186 HydrophobicContact CZ-CD1 3.78Å; F182-I186 WeakPolarHBondContact O-CD1 3.49Å; F182-I186 VanDerWaalsContact O-CG1 3.28Å; F182-I186 WeakPolarHBondContact O-CG1 3.42Å; F182-I186 PolarHBondContact O-N 3.47Å; F182-T225 HydrophobicContact CE2-CG2 4.23Å; F182-T225 HydrophobicContact CZ-CG2 3.8Å; F182-L228 HydrophobicContact CD1-CD2 4.02Å; F182-L228 HydrophobicContact CD1-CG 4.46Å; F182-L228 HydrophobicContact CE1-CB 4.43Å; F182-L228 HydrophobicContact CE1-CD2 4.03Å; F182-L228 HydrophobicContact CE1-CG 4.16Å; F182-A229 HydrophobicContact CE1-CB 4.21Å; F182-A229 HydrophobicContact CZ-CB 3.97Å
183	C	97.3	Very high	95.2	Very high	10 Å²	10	50.2 Å²	50.2	7%	0.068	23%	0.227	C	C	.	.	H	α-helix	trans	-65.9	-43.8	177	-62.3	0	0	0	0	111.7	R179 Q180 T187 K232	R179-C183 PolarHBondContact O-N 2.94Å; R179-C183 PolarHBondContact O-SG 2.84Å; Q180-C183 WeakPolarHBondContact O-CB 3.37Å; Q180-C183 PolarHBondContact O-N 3.44Å; C183-T187 WeakPolarHBondContact O-CB 3.32Å; C183-T187 PolarHBondContact O-N 3.38Å; C183-T187 PolarHBondContact O-OG1 3.1Å; C183-K232 HydrophobicContact CB-CD 3.92Å; C183-K232 HydrophobicContact CB-CG 4.01Å
184	D	96.6	Very high	95.3	Very high	61 Å²	61	46.9 Å²	46.9	33%	0.326	20%	0.201	S	C	.	.	H	α-helix	trans	-71.8	-35.1	-177.1	-66.1	-21.4	0	0	0	111.8	L102 Q180 T187 T188	L102-D184 HydrophobicContact CD1-CB 3.61Å; Q180-D184 WeakPolarHBondContact CG-OD2 3.5Å; Q180-D184 PolarHBondContact NE2-OD1 3.12Å; Q180-D184 PolarHBondContact NE2-OD2 3.38Å; Q180-D184 PolarHBondContact O-N 3.5Å; D184-T187 PolarHBondContact O-N 3.34Å; D184-T188 VanDerWaalsContact O-CB 3.24Å; D184-T188 WeakPolarHBondContact O-CB 3.3Å; D184-T188 PolarHBondContact O-N 3.43Å; D184-T188 PolarHBondContact O-OG1 3.11Å
185	F	97.5	Very high	95.4	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.6	-49.5	176.2	175.2	-104.8	0	0	0	111.5	L91 V95 L102 V105 A106 L124 Y127 N181 T187 T188 L189	L91-F185 HydrophobicContact CD1-CE1 4.25Å; L91-F185 HydrophobicContact CD1-CE2 4.05Å; L91-F185 HydrophobicContact CD1-CZ 3.68Å; L91-F185 HydrophobicContact CD2-CE1 3.88Å; L91-F185 HydrophobicContact CD2-CZ 3.83Å; L91-F185 HydrophobicContact CG-CE1 4.25Å; L91-F185 HydrophobicContact CG-CZ 4.14Å; V95-F185 HydrophobicContact CG1-CB 4.21Å; V95-F185 HydrophobicContact CG2-CB 4.18Å; V95-F185 HydrophobicContact CG2-CD1 4.17Å; V95-F185 HydrophobicContact CG2-CD2 4.03Å; V95-F185 HydrophobicContact CG2-CG 3.83Å; L102-F185 HydrophobicContact CD2-CB 4.39Å; V105-F185 HydrophobicContact CB-CE2 4.41Å; V105-F185 HydrophobicContact CG1-CD2 4.33Å; V105-F185 HydrophobicContact CG1-CE2 3.88Å; A106-F185 HydrophobicContact CB-CE2 4.2Å; L124-F185 HydrophobicContact CD1-CE1 4.2Å; Y127-F185 HydrophobicContact CD1-CE1 4.45Å; Y127-F185 AromaticContact CE1-CD1 3.86Å; Y127-F185 HydrophobicContact CE1-CD1 3.86Å; Y127-F185 HydrophobicContact CE1-CE1 4.08Å; Y127-F185 HydrophobicContact CE2-CD1 4.43Å; Y127-F185 AromaticContact CZ-CD1 3.71Å; N181-F185 WeakPolarHBondContact O-CB 3.39Å; N181-F185 PolarHBondContact O-N 2.88Å; F185-T187 VanDerWaalsContact C-N 3.29Å; F185-T187 PolarHBondContact O-N 3Å; F185-T188 PolarHBondContact O-N 2.88Å; F185-T188 VanDerWaalsContact O-N 3.15Å; F185-L189 HydrophobicContact CE1-CD2 4.07Å; F185-L189 HydrophobicContact CZ-CB 4.37Å; F185-L189 HydrophobicContact CZ-CD2 3.99Å; F185-L189 WeakPolarHBondContact O-CB 3.45Å; F185-L189 PolarHBondContact O-N 3.5Å
186	I	97.2	Very high	95.4	Very high	3 Å²	3	52.2 Å²	52.2	2%	0.015	23%	0.23	C	C	.	.	H	α-helix	trans	-56.9	-46.6	176.5	-64.9	165.4	0	0	0	110.3	F128 F182 T188 V190 A229 K232 M233	F128-I186 HydrophobicContact CE1-CD1 3.76Å; F128-I186 HydrophobicContact CE1-CG1 4.05Å; F128-I186 HydrophobicContact CZ-CD1 4.43Å; F128-I186 HydrophobicContact CZ-CG1 4.29Å; F182-I186 HydrophobicContact CD1-CD1 3.96Å; F182-I186 HydrophobicContact CE1-CD1 3.62Å; F182-I186 HydrophobicContact CE2-CD1 4.24Å; F182-I186 HydrophobicContact CG-CD1 4.42Å; F182-I186 HydrophobicContact CZ-CD1 3.78Å; F182-I186 WeakPolarHBondContact O-CD1 3.49Å; F182-I186 VanDerWaalsContact O-CG1 3.28Å; F182-I186 WeakPolarHBondContact O-CG1 3.42Å; F182-I186 PolarHBondContact O-N 3.47Å; I186-T188 VanDerWaalsContact C-N 3.34Å; I186-T188 PolarHBondContact O-N 3.29Å; I186-V190 WeakPolarHBondContact O-CG2 3.45Å; I186-V190 PolarHBondContact O-N 2.93Å; I186-V190 VanDerWaalsContact O-N 3.13Å; I186-A229 HydrophobicContact CD1-CB 3.76Å; I186-K232 HydrophobicContact CG2-CB 4.24Å; I186-M233 HydrophobicContact CG2-CB 4.36Å
187	T	96.7	Very high	95.5	Very high	12 Å²	12	45.5 Å²	45.5	7%	0.074	21%	0.206	C	C	.	.	H	α-helix	trans	-63.9	-39.9	179.3	-49.6	0	0	0	0	111.6	C183 D184 F185 R191 A236	C183-T187 WeakPolarHBondContact O-CB 3.32Å; C183-T187 PolarHBondContact O-N 3.38Å; C183-T187 PolarHBondContact O-OG1 3.1Å; D184-T187 PolarHBondContact O-N 3.34Å; F185-T187 VanDerWaalsContact C-N 3.29Å; F185-T187 PolarHBondContact O-N 3Å; T187-R191 VanDerWaalsContact CG2-CZ 3.49Å; T187-R191 WeakPolarHBondContact O-CB 3.32Å; T187-R191 WeakPolarHBondContact O-CD 3.26Å; T187-R191 WeakPolarHBondContact O-CG 3.08Å; T187-R191 PolarHBondContact O-N 3.08Å; T187-A236 HydrophobicContact CG2-CB 4.08Å
188	T	96.8	Very high	95.6	Very high	22 Å²	22	38.7 Å²	38.7	14%	0.135	18%	0.18	C	C	.	.	H	α-helix	trans	-69.9	-46.7	179.2	-58	0	0	0	0	111.5	V103 A106 D184 F185 I186 V190 R191 Q192	V103-T188 HydrophobicContact CB-CG2 4.39Å; V103-T188 HydrophobicContact CG2-CG2 3.95Å; A106-T188 HydrophobicContact CB-CG2 4.19Å; D184-T188 VanDerWaalsContact O-CB 3.24Å; D184-T188 WeakPolarHBondContact O-CB 3.3Å; D184-T188 PolarHBondContact O-N 3.43Å; D184-T188 PolarHBondContact O-OG1 3.11Å; F185-T188 PolarHBondContact O-N 2.88Å; F185-T188 VanDerWaalsContact O-N 3.15Å; I186-T188 VanDerWaalsContact C-N 3.34Å; I186-T188 PolarHBondContact O-N 3.29Å; T188-V190 PolarHBondContact O-N 2.88Å; T188-R191 PolarHBondContact O-N 3.31Å; T188-Q192 HydrophobicContact CG2-CG 4.29Å; T188-Q192 WeakPolarHBondContact O-CG 3.42Å; T188-Q192 PolarHBondContact O-N 3.21Å
189	L	97	Very high	95.6	Very high	6 Å²	6	41 Å²	41	3%	0.031	19%	0.189	C	C	.	.	H	α-helix	trans	-58.4	-50.6	179.2	177.2	60.7	0	0	0	111.6	A106 W109 I110 L124 F185 R191 Q192 C193 M203	A106-L189 HydrophobicContact CB-CB 4.4Å; A106-L189 HydrophobicContact CB-CD1 4.29Å; W109-L189 HydrophobicContact CD2-CD1 4.27Å; W109-L189 HydrophobicContact CE3-CD1 3.5Å; W109-L189 VanDerWaalsContact CE3-CD1 3.5Å; W109-L189 HydrophobicContact CE3-CD2 4.47Å; W109-L189 HydrophobicContact CZ3-CD1 3.89Å; I110-L189 HydrophobicContact CD1-CD1 4.42Å; I110-L189 HydrophobicContact CG1-CD1 4.27Å; L124-L189 HydrophobicContact CD1-CD2 3.8Å; L124-L189 HydrophobicContact CD2-CD2 3.93Å; F185-L189 HydrophobicContact CE1-CD2 4.07Å; F185-L189 HydrophobicContact CZ-CB 4.37Å; F185-L189 HydrophobicContact CZ-CD2 3.99Å; F185-L189 WeakPolarHBondContact O-CB 3.45Å; F185-L189 PolarHBondContact O-N 3.5Å; L189-R191 VanDerWaalsContact C-N 3.3Å; L189-R191 PolarHBondContact O-N 2.89Å; L189-Q192 PolarHBondContact O-N 2.89Å; L189-C193 PolarHBondContact O-N 2.97Å; L189-C193 PolarHBondContact O-SG 3.2Å; L189-C193 VanDerWaalsContact O-SG 3.34Å; L189-M203 HydrophobicContact CD2-CE 3.85Å; L189-M203 HydrophobicContact CG-CE 4.04Å
190	V	96.9	Very high	95.5	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.018	18%	0.181	C	C	.	.	H	α-helix	trans	-61	-38.9	177.9	174	0	0	0	0	111.3	I186 T188 Q194 I198 M233 A236 L237 I240	I186-V190 WeakPolarHBondContact O-CG2 3.45Å; I186-V190 PolarHBondContact O-N 2.93Å; I186-V190 VanDerWaalsContact O-N 3.13Å; T188-V190 PolarHBondContact O-N 2.88Å; V190-Q194 PolarHBondContact O-N 3.2Å; V190-I198 HydrophobicContact CG1-CD1 3.78Å; V190-M233 HydrophobicContact CG2-CE 4.32Å; V190-M233 HydrophobicContact CG2-CG 4.42Å; V190-A236 HydrophobicContact CB-CB 3.78Å; V190-A236 HydrophobicContact CG1-CB 3.61Å; V190-L237 HydrophobicContact CG1-CD2 4.37Å; V190-L237 HydrophobicContact CG1-CG 4.46Å; V190-I240 HydrophobicContact CG1-CD1 3.82Å
191	R	95	Very high	95.4	Very high	87 Å²	87	39.6 Å²	39.6	33%	0.328	19%	0.189	S	C	.	.	H	α-helix	trans	-66.9	-40.2	174.2	-74.6	171.5	-179.8	160.8	1.1	113	T187 T188 L189 C193 Q194 E239	T187-R191 VanDerWaalsContact CG2-CZ 3.49Å; T187-R191 WeakPolarHBondContact O-CB 3.32Å; T187-R191 WeakPolarHBondContact O-CD 3.26Å; T187-R191 WeakPolarHBondContact O-CG 3.08Å; T187-R191 PolarHBondContact O-N 3.08Å; T188-R191 PolarHBondContact O-N 3.31Å; L189-R191 VanDerWaalsContact C-N 3.3Å; L189-R191 PolarHBondContact O-N 2.89Å; R191-C193 VanDerWaalsContact C-N 3.33Å; R191-Q194 VanDerWaalsContact O-CB 3.3Å; R191-Q194 WeakPolarHBondContact O-CB 3.33Å; R191-Q194 VanDerWaalsContact O-CD 3.28Å; R191-Q194 WeakPolarHBondContact O-CG 3.41Å; R191-Q194 PolarHBondContact O-N 3.27Å; R191-Q194 PolarHBondContact O-NE2 3.19Å; R191-E239 IonicContact CZ-OE1 3.24Å; R191-E239 IonicContact CZ-OE2 2.74Å; R191-E239 IonicContact NE-OE2 2.67Å; R191-E239 PolarHBondContact NE-OE2 2.92Å; R191-E239 IonicContact NH2-OE1 2.71Å; R191-E239 PolarHBondContact NH2-OE1 2.92Å; R191-E239 IonicContact NH2-OE2 3.74Å; R191-E239 PolarHBondContact NH2-OE2 3.12Å
192	Q	94.9	Very high	95.3	Very high	79 Å²	79	41.5 Å²	41.5	37%	0.369	20%	0.195	S	C	.	.	H	α-helix	trans	-68.9	-34.3	178.5	-67.1	-64.7	81	0	0	111.3	A106 D107 I110 T188 L189 Q194	A106-Q192 HydrophobicContact CB-CG 4.39Å; D107-Q192 PolarHBondContact OD1-NE2 3.42Å; I110-Q192 HydrophobicContact CD1-CB 3.43Å; I110-Q192 VanDerWaalsContact CD1-CB 3.43Å; T188-Q192 HydrophobicContact CG2-CG 4.29Å; T188-Q192 WeakPolarHBondContact O-CG 3.42Å; T188-Q192 PolarHBondContact O-N 3.21Å; L189-Q192 PolarHBondContact O-N 2.89Å; Q192-Q194 VanDerWaalsContact C-N 3.27Å; Q192-Q194 PolarHBondContact O-N 2.8Å
193	C	95.8	Very high	95.2	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.007	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-7.2	175.7	-67.4	0	0	0	0	115.3	L189 R191 Y195 S196 I197 I198	L189-C193 PolarHBondContact O-N 2.97Å; L189-C193 PolarHBondContact O-SG 3.2Å; L189-C193 VanDerWaalsContact O-SG 3.34Å; R191-C193 VanDerWaalsContact C-N 3.33Å; C193-Y195 PolarHBondContact O-N 3.03Å; C193-S196 PolarHBondContact O-N 3.33Å; C193-I197 HydrophobicContact CB-CB 3.96Å; C193-I197 HydrophobicContact CB-CG2 4.24Å; C193-I197 PolarHBondContact O-N 3.08Å; C193-I198 HydrophobicContact CB-CB 4.34Å; C193-I198 PolarHBondContact O-N 2.94Å
194	Q	93.5	Very high	95.1	Very high	22 Å²	22	41.3 Å²	41.3	10%	0.103	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-11.2	-163.7	80.3	-172.1	-70.3	0	0	116.9	V190 R191 Q192 Y199 I240 R243	V190-Q194 PolarHBondContact O-N 3.2Å; R191-Q194 VanDerWaalsContact O-CB 3.3Å; R191-Q194 WeakPolarHBondContact O-CB 3.33Å; R191-Q194 VanDerWaalsContact O-CD 3.28Å; R191-Q194 WeakPolarHBondContact O-CG 3.41Å; R191-Q194 PolarHBondContact O-N 3.27Å; R191-Q194 PolarHBondContact O-NE2 3.19Å; Q192-Q194 VanDerWaalsContact C-N 3.27Å; Q192-Q194 PolarHBondContact O-N 2.8Å; Q194-Y199 WeakPolarHBondContact O-CE2 3.47Å; Q194-Y199 PolarHBondContact O-OH 2.93Å; Q194-I240 HydrophobicContact CB-CD1 3.63Å; Q194-I240 HydrophobicContact CB-CG1 3.87Å; Q194-I240 HydrophobicContact CB-CG2 4.38Å; Q194-R243 VanDerWaalsContact OE1-CZ 3.25Å
195	Y	91.3	Very high	95.1	Very high	188 Å²	188	42.5 Å²	42.5	74%	0.737	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-7.4	-175.4	-58.4	-65.2	0	0	0	114	C193	C193-Y195 PolarHBondContact O-N 3.03Å
196	S	92.3	Very high	94.9	Very high	69 Å²	69	43 Å²	43	48%	0.483	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-157.3	-70.7	-177	54.8	0	0	0	0	112.9	C193 I198 Y199	C193-S196 PolarHBondContact O-N 3.33Å; S196-I198 PolarHBondContact O-N 3.4Å; S196-I198 VanDerWaalsContact O-N 3.14Å; S196-Y199 PolarHBondContact O-N 2.97Å
197	I	94.8	Very high	94.9	Very high	11 Å²	11	42.9 Å²	42.9	6%	0.056	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-57.6	-34.3	-170.9	-67.9	167.1	0	0	0	112.1	I110 Y113 M114 C193 Y199 D200 M203	I110-I197 HydrophobicContact CB-CD1 4.43Å; I110-I197 HydrophobicContact CG1-CD1 4.17Å; I110-I197 HydrophobicContact CG2-CD1 3.79Å; Y113-I197 HydrophobicContact CD1-CD1 3.74Å; Y113-I197 HydrophobicContact CD1-CG1 3.93Å; Y113-I197 HydrophobicContact CD1-CG2 3.93Å; Y113-I197 HydrophobicContact CE1-CB 4.34Å; Y113-I197 HydrophobicContact CE1-CD1 4.29Å; Y113-I197 HydrophobicContact CE1-CG1 3.96Å; Y113-I197 HydrophobicContact CE1-CG2 3.57Å; M114-I197 HydrophobicContact CE-CD1 4.24Å; C193-I197 HydrophobicContact CB-CB 3.96Å; C193-I197 HydrophobicContact CB-CG2 4.24Å; C193-I197 PolarHBondContact O-N 3.08Å; I197-Y199 PolarHBondContact O-N 3.16Å; I197-Y199 VanDerWaalsContact O-N 3.16Å; I197-D200 PolarHBondContact O-N 3.17Å; I197-M203 HydrophobicContact CG2-CB 3.88Å; I197-M203 HydrophobicContact CG2-CG 3.96Å
198	I	95.3	Very high	94.9	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.021	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-64.5	-20	-178.8	-154	168.1	0	0	0	113.9	V190 C193 S196 M204 L237 I240 I286 M289	V190-I198 HydrophobicContact CG1-CD1 3.78Å; C193-I198 HydrophobicContact CB-CB 4.34Å; C193-I198 PolarHBondContact O-N 2.94Å; S196-I198 PolarHBondContact O-N 3.4Å; S196-I198 VanDerWaalsContact O-N 3.14Å; I198-M204 HydrophobicContact CD1-SD 4.47Å; I198-M204 HydrophobicContact CG1-CG 3.64Å; I198-M204 HydrophobicContact CG1-SD 3.99Å; I198-L237 HydrophobicContact CD1-CD2 3.72Å; I198-I240 HydrophobicContact CD1-CD1 3.66Å; I198-I286 HydrophobicContact CD1-CD1 3.69Å; I198-I286 HydrophobicContact CG1-CD1 4.15Å; I198-I286 HydrophobicContact CG2-CD1 4.3Å; I198-M289 HydrophobicContact CG1-CE 4.41Å; I198-M289 WeakPolarHBondContact O-CE 3.17Å
199	Y	94.7	Very high	94.9	Very high	48 Å²	48	43.2 Å²	43.2	19%	0.188	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-104.3	9.3	-178.8	-47.2	-73.2	0	0	0	113.1	Q194 S196 I197 Q201 N282 I286	Q194-Y199 WeakPolarHBondContact O-CE2 3.47Å; Q194-Y199 PolarHBondContact O-OH 2.93Å; S196-Y199 PolarHBondContact O-N 2.97Å; I197-Y199 PolarHBondContact O-N 3.16Å; I197-Y199 VanDerWaalsContact O-N 3.16Å; Y199-Q201 VanDerWaalsContact C-N 3.3Å; Y199-Q201 PolarHBondContact O-N 3.35Å; Y199-N282 HydrophobicContact CD1-CB 4.27Å; Y199-N282 HydrophobicContact CE1-CB 3.57Å; Y199-I286 HydrophobicContact CE1-CD1 4.06Å; Y199-I286 HydrophobicContact CE1-CG1 3.87Å
200	D	93.9	Very high	94.8	Very high	42 Å²	42	42.9 Å²	42.9	23%	0.225	20%	0.203	C	C	.	.	S	Bend	trans	-86.2	4.3	-171.9	84.3	-5.7	0	0	0	115.6	Y113 R117 I197 Y202 M203	Y113-D200 VanDerWaalsContact CE1-OD2 3.31Å; Y113-D200 WeakPolarHBondContact CE1-OD2 3.34Å; Y113-D200 VanDerWaalsContact CZ-OD2 3.32Å; Y113-D200 VanDerWaalsContact OH-CG 3.28Å; Y113-D200 PolarHBondContact OH-OD1 3.24Å; Y113-D200 PolarHBondContact OH-OD2 3.35Å; R117-D200 IonicContact CZ-OD2 3.57Å; R117-D200 IonicContact NH1-OD2 3.57Å; R117-D200 PolarHBondContact NH1-OD2 3.49Å; I197-D200 PolarHBondContact O-N 3.17Å; D200-Y202 PolarHBondContact O-N 3.35Å; D200-Y202 PolarHBondContact OD1-N 3.28Å; D200-M203 PolarHBondContact OD1-N 3.37Å; D200-M203 VanDerWaalsContact OD1-N 3.12Å
201	Q	92.7	Very high	94.9	Very high	140 Å²	140	42.8 Å²	42.8	65%	0.654	20%	0.202	S	C	*	.	S	Bend	trans	55.1	29.4	178.7	-59.9	-179.2	-15.8	0	0	113.8	Y199	Y199-Q201 VanDerWaalsContact C-N 3.3Å; Y199-Q201 PolarHBondContact O-N 3.35Å
202	Y	94.6	Very high	95	Very high	64 Å²	64	39.7 Å²	39.7	25%	0.251	19%	0.193	S	C	.	.	S	Bend	trans	-134.9	-53.3	177.6	-171.5	-109	0	0	0	113.3	Y113 R117 V121 D200 S206	Y113-Y202 HydrophobicContact CE2-CD1 4.27Å; Y113-Y202 WeakPolarHBondContact OH-CD1 3.5Å; R117-Y202 HydrophobicContact CB-CD1 4.22Å; R117-Y202 HydrophobicContact CB-CE1 4Å; V121-Y202 HydrophobicContact CB-CE1 4.45Å; V121-Y202 HydrophobicContact CG2-CD1 4.18Å; V121-Y202 HydrophobicContact CG2-CE1 3.81Å; D200-Y202 PolarHBondContact O-N 3.35Å; D200-Y202 PolarHBondContact OD1-N 3.28Å; Y202-S206 WeakPolarHBondContact O-CB 3.33Å; Y202-S206 PolarHBondContact O-N 2.96Å; Y202-S206 PolarHBondContact O-OG 2.84Å
203	M	94.8	Very high	95.1	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-64.6	-54.6	-175.2	-176.3	-82.7	-168.2	0	0	111.9	W109 Y113 L124 L189 I197 D200 V207	W109-M203 HydrophobicContact CH2-CE 3.83Å; W109-M203 HydrophobicContact CH2-CG 3.78Å; W109-M203 HydrophobicContact CZ3-CE 3.97Å; W109-M203 HydrophobicContact CZ3-CG 4.4Å; Y113-M203 HydrophobicContact CE2-CB 4.04Å; Y113-M203 HydrophobicContact CE2-CG 4.3Å; L124-M203 HydrophobicContact CD2-CE 3.7Å; L189-M203 HydrophobicContact CD2-CE 3.85Å; L189-M203 HydrophobicContact CG-CE 4.04Å; I197-M203 HydrophobicContact CG2-CB 3.88Å; I197-M203 HydrophobicContact CG2-CG 3.96Å; D200-M203 PolarHBondContact OD1-N 3.37Å; D200-M203 VanDerWaalsContact OD1-N 3.12Å; M203-V207 WeakPolarHBondContact O-CG2 3.44Å; M203-V207 PolarHBondContact O-N 3.43Å
204	M	95.8	Very high	95.1	Very high	4 Å²	4	38.8 Å²	38.8	2%	0.02	19%	0.189	C	C	.	.	H	α-helix	trans	-67.7	-44.2	-177.1	-70.2	-62.8	-63.9	0	0	111.4	I198 S206 V207 I208 M233 L237 M289	I198-M204 HydrophobicContact CD1-SD 4.47Å; I198-M204 HydrophobicContact CG1-CG 3.64Å; I198-M204 HydrophobicContact CG1-SD 3.99Å; M204-S206 VanDerWaalsContact C-N 3.34Å; M204-S206 PolarHBondContact O-N 3.32Å; M204-V207 PolarHBondContact O-N 2.9Å; M204-V207 VanDerWaalsContact O-N 3.16Å; M204-I208 HydrophobicContact CB-CD1 4.28Å; M204-I208 HydrophobicContact CE-CD1 4.09Å; M204-I208 HydrophobicContact CE-CG1 4.45Å; M204-I208 VanDerWaalsContact O-CB 3.28Å; M204-I208 WeakPolarHBondContact O-CB 3.23Å; M204-I208 VanDerWaalsContact O-CG1 3.23Å; M204-I208 WeakPolarHBondContact O-CG1 3.32Å; M204-I208 PolarHBondContact O-N 2.99Å; M204-M233 HydrophobicContact CE-CE 4.18Å; M204-M233 HydrophobicContact CE-CG 3.85Å; M204-M233 HydrophobicContact CE-SD 3.51Å; M204-M233 VanDerWaalsContact CE-SD 3.51Å; M204-M233 HydrophobicContact SD-CE 4.49Å; M204-L237 HydrophobicContact CE-CD1 4.17Å; M204-L237 HydrophobicContact CE-CD2 4.13Å; M204-L237 HydrophobicContact CE-CG 4.47Å; M204-M289 HydrophobicContact CB-SD 3.95Å; M204-M289 HydrophobicContact CE-SD 3.79Å; M204-M289 HydrophobicContact CG-SD 3.95Å
205	D	94.9	Very high	95.3	Very high	86 Å²	86	37.9 Å²	37.9	46%	0.46	19%	0.185	S	C	.	.	H	α-helix	trans	-58.7	-44.2	-179.7	-70.2	19	0	0	0	112.1	V207 S209	D205-V207 PolarHBondContact O-N 3.33Å; D205-S209 WeakPolarHBondContact O-CB 3.34Å; D205-S209 PolarHBondContact O-N 3.49Å
206	S	95.1	Very high	95.4	Very high	10 Å²	10	33.9 Å²	33.9	7%	0.07	18%	0.176	C	C	.	.	H	α-helix	trans	-61.8	-43.9	176.3	-61.4	0	0	0	0	112.2	F148 Y202 M204 L210	F148-S206 VanDerWaalsContact CE1-O 3.24Å; F148-S206 WeakPolarHBondContact CE1-O 3.24Å; Y202-S206 WeakPolarHBondContact O-CB 3.33Å; Y202-S206 PolarHBondContact O-N 2.96Å; Y202-S206 PolarHBondContact O-OG 2.84Å; M204-S206 VanDerWaalsContact C-N 3.34Å; M204-S206 PolarHBondContact O-N 3.32Å; S206-L210 PolarHBondContact O-N 3.36Å; S206-L210 VanDerWaalsContact O-N 3.1Å
207	V	96.4	Very high	95.4	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.006	16%	0.158	C	C	.	.	H	α-helix	trans	-73.3	-44.9	-179.6	177.7	0	0	0	0	111.4	L124 L125 F128 M203 M204 D205 S209 L210 L211 M233	L124-V207 HydrophobicContact CD2-CG2 3.66Å; L124-V207 HydrophobicContact CG-CG2 4.26Å; L125-V207 HydrophobicContact CD2-CG2 4.14Å; F128-V207 HydrophobicContact CD2-CG1 4.32Å; F128-V207 HydrophobicContact CE2-CG1 3.53Å; F128-V207 HydrophobicContact CE2-CG2 4.4Å; F128-V207 HydrophobicContact CZ-CG1 4.03Å; M203-V207 WeakPolarHBondContact O-CG2 3.44Å; M203-V207 PolarHBondContact O-N 3.43Å; M204-V207 PolarHBondContact O-N 2.9Å; M204-V207 VanDerWaalsContact O-N 3.16Å; D205-V207 PolarHBondContact O-N 3.33Å; V207-S209 VanDerWaalsContact C-N 3.3Å; V207-S209 PolarHBondContact O-N 2.7Å; V207-L210 PolarHBondContact O-N 2.91Å; V207-L211 HydrophobicContact CG1-CD1 3.76Å; V207-L211 HydrophobicContact CG1-CG 4.08Å; V207-L211 WeakPolarHBondContact O-CB 3.15Å; V207-L211 VanDerWaalsContact O-CG 3.25Å; V207-L211 WeakPolarHBondContact O-CG 3.48Å; V207-L211 PolarHBondContact O-N 3.34Å; V207-M233 HydrophobicContact CB-CE 4.4Å; V207-M233 HydrophobicContact CG1-CE 3.53Å; V207-M233 HydrophobicContact CG1-SD 4.45Å
208	I	96.7	Very high	95.2	Very high	12 Å²	12	39.6 Å²	39.6	6%	0.062	20%	0.197	C	C	.	.	H	α-helix	trans	-60.1	-42.5	176.8	-71	173.9	0	0	0	110.1	M204 T212 M233 M289 Y292 L293	M204-I208 HydrophobicContact CB-CD1 4.28Å; M204-I208 HydrophobicContact CE-CD1 4.09Å; M204-I208 HydrophobicContact CE-CG1 4.45Å; M204-I208 VanDerWaalsContact O-CB 3.28Å; M204-I208 WeakPolarHBondContact O-CB 3.23Å; M204-I208 VanDerWaalsContact O-CG1 3.23Å; M204-I208 WeakPolarHBondContact O-CG1 3.32Å; M204-I208 PolarHBondContact O-N 2.99Å; I208-T212 VanDerWaalsContact O-CB 3.28Å; I208-T212 WeakPolarHBondContact O-CB 3.3Å; I208-T212 PolarHBondContact O-N 3.4Å; I208-T212 PolarHBondContact O-OG1 3.19Å; I208-M233 HydrophobicContact CG1-SD 3.99Å; I208-M289 HydrophobicContact CD1-CB 4.18Å; I208-M289 HydrophobicContact CD1-CG 4.05Å; I208-M289 HydrophobicContact CD1-SD 4.36Å; I208-Y292 HydrophobicContact CG2-CD1 3.59Å; I208-Y292 HydrophobicContact CG2-CE1 3.59Å; I208-L293 HydrophobicContact CB-CD2 4.46Å; I208-L293 HydrophobicContact CD1-CD1 4.3Å; I208-L293 HydrophobicContact CD1-CG 4.42Å; I208-L293 HydrophobicContact CG1-CD1 4.2Å; I208-L293 HydrophobicContact CG1-CD2 4.14Å; I208-L293 HydrophobicContact CG1-CG 4.27Å; I208-L293 HydrophobicContact CG2-CD2 3.95Å; I208-L293 HydrophobicContact CG2-CG 4.38Å
209	S	95.9	Very high	94.9	Very high	28 Å²	28	40.1 Å²	40.1	20%	0.196	20%	0.201	C	C	.	.	H	α-helix	trans	-62.2	-50.5	175.8	-172.3	0	0	0	0	111.5	F148 D205 V207 L211 T212 H213	F148-S209 WeakPolarHBondContact CB-OG 3.26Å; F148-S209 WeakPolarHBondContact CD2-OG 3.35Å; F148-S209 VanDerWaalsContact CG-OG 3.25Å; F148-S209 WeakPolarHBondContact CG-OG 3.26Å; D205-S209 WeakPolarHBondContact O-CB 3.34Å; D205-S209 PolarHBondContact O-N 3.49Å; V207-S209 VanDerWaalsContact C-N 3.3Å; V207-S209 PolarHBondContact O-N 2.7Å; S209-L211 PolarHBondContact O-N 3.4Å; S209-T212 PolarHBondContact O-N 2.95Å; S209-H213 PolarHBondContact O-N 2.88Å; S209-H213 VanDerWaalsContact O-N 3.14Å; S209-H213 PolarHBondContact O-ND1 3.37Å
210	L	96.4	Very high	94.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.2	-49.8	176.5	179.4	66.7	0	0	0	111.9	L125 F128 I129 F148 L151 V152 S206 V207 T212 H213 L214	L125-L210 HydrophobicContact CB-CD2 3.85Å; L125-L210 HydrophobicContact CD2-CB 3.94Å; L125-L210 HydrophobicContact CD2-CD2 3.55Å; L125-L210 HydrophobicContact CD2-CG 4.35Å; L125-L210 HydrophobicContact CG-CD2 4.15Å; F128-L210 HydrophobicContact CB-CD2 4.25Å; I129-L210 HydrophobicContact CD1-CD1 4.4Å; F148-L210 HydrophobicContact CD1-CB 3.91Å; F148-L210 HydrophobicContact CD1-CD1 4.43Å; F148-L210 HydrophobicContact CE1-CB 4.12Å; L151-L210 HydrophobicContact CD2-CD1 3.71Å; V152-L210 HydrophobicContact CG2-CD1 3.84Å; S206-L210 PolarHBondContact O-N 3.36Å; S206-L210 VanDerWaalsContact O-N 3.1Å; V207-L210 PolarHBondContact O-N 2.91Å; L210-T212 VanDerWaalsContact C-N 3.3Å; L210-T212 PolarHBondContact O-N 3.39Å; L210-H213 PolarHBondContact O-N 3.04Å; L210-L214 HydrophobicContact CD1-CD1 3.96Å; L210-L214 HydrophobicContact CD1-CG 4.05Å; L210-L214 HydrophobicContact CD2-CD1 4.14Å; L210-L214 HydrophobicContact CG-CD1 3.72Å; L210-L214 HydrophobicContact CG-CG 4.21Å; L210-L214 WeakPolarHBondContact O-CB 3.27Å; L210-L214 WeakPolarHBondContact O-CG 3.48Å; L210-L214 PolarHBondContact O-N 3.16Å
211	L	97.4	Very high	94.8	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-63.8	-36.1	-177.2	-68.6	-178.7	0	0	0	112	F128 V207 S209 A215 A226 A229 M233	F128-L211 HydrophobicContact CD1-CD2 3.98Å; F128-L211 HydrophobicContact CD2-CD2 4.46Å; F128-L211 HydrophobicContact CE1-CD2 4.29Å; F128-L211 HydrophobicContact CG-CD2 4.08Å; V207-L211 HydrophobicContact CG1-CD1 3.76Å; V207-L211 HydrophobicContact CG1-CG 4.08Å; V207-L211 WeakPolarHBondContact O-CB 3.15Å; V207-L211 VanDerWaalsContact O-CG 3.25Å; V207-L211 WeakPolarHBondContact O-CG 3.48Å; V207-L211 PolarHBondContact O-N 3.34Å; S209-L211 PolarHBondContact O-N 3.4Å; L211-A215 WeakPolarHBondContact O-CB 3.48Å; L211-A215 PolarHBondContact O-N 3.34Å; L211-A226 HydrophobicContact CD2-CB 4.06Å; L211-A229 HydrophobicContact CD1-CB 3.89Å; L211-A229 HydrophobicContact CD2-CB 3.72Å; L211-A229 HydrophobicContact CG-CB 4.49Å; L211-M233 HydrophobicContact CD1-CE 4.27Å; L211-M233 HydrophobicContact CD1-SD 4.42Å
212	T	97.4	Very high	94.9	Very high	22 Å²	22	34 Å²	34	14%	0.135	17%	0.17	C	C	.	.	H	α-helix	trans	-64.4	-46.6	176.1	-59.8	0	0	0	0	111.2	I208 S209 L210 A215 D216 C296	I208-T212 VanDerWaalsContact O-CB 3.28Å; I208-T212 WeakPolarHBondContact O-CB 3.3Å; I208-T212 PolarHBondContact O-N 3.4Å; I208-T212 PolarHBondContact O-OG1 3.19Å; S209-T212 PolarHBondContact O-N 2.95Å; L210-T212 VanDerWaalsContact C-N 3.3Å; L210-T212 PolarHBondContact O-N 3.39Å; T212-A215 PolarHBondContact O-N 3.08Å; T212-D216 PolarHBondContact O-N 3.31Å; T212-C296 HydrophobicContact CG2-CB 3.9Å
213	H	96.5	Very high	94.9	Very high	60 Å²	60	32 Å²	32	28%	0.278	16%	0.162	S	C	.	.	H	α-helix	trans	-70.2	-37.5	179.4	-66.7	101.8	0	0	0	112.9	I149 V152 S209 L210 A215 D216 S217	I149-H213 WeakPolarHBondContact CG1-NE2 3.31Å; V152-H213 HydrophobicContact CB-CB 4.33Å; V152-H213 HydrophobicContact CG2-CB 3.76Å; S209-H213 PolarHBondContact O-N 2.88Å; S209-H213 VanDerWaalsContact O-N 3.14Å; S209-H213 PolarHBondContact O-ND1 3.37Å; L210-H213 PolarHBondContact O-N 3.04Å; H213-A215 VanDerWaalsContact C-N 3.34Å; H213-D216 PolarHBondContact O-N 2.98Å; H213-S217 PolarHBondContact O-N 2.96Å
214	L	96.5	Very high	95	Very high	1 Å²	1	32 Å²	32	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-65.7	-35.9	172	-71.6	173.9	0	0	0	112.2	I129 V152 L210 D216 S217 F222 R223 A226	I129-L214 HydrophobicContact CD1-CD1 3.98Å; I129-L214 HydrophobicContact CD1-CD2 3.88Å; I129-L214 HydrophobicContact CD1-CG 4.48Å; V152-L214 HydrophobicContact CG1-CD2 4.04Å; V152-L214 HydrophobicContact CG2-CD2 3.82Å; V152-L214 HydrophobicContact CG2-CG 3.93Å; L210-L214 HydrophobicContact CD1-CD1 3.96Å; L210-L214 HydrophobicContact CD1-CG 4.05Å; L210-L214 HydrophobicContact CD2-CD1 4.14Å; L210-L214 HydrophobicContact CG-CD1 3.72Å; L210-L214 HydrophobicContact CG-CG 4.21Å; L210-L214 WeakPolarHBondContact O-CB 3.27Å; L210-L214 WeakPolarHBondContact O-CG 3.48Å; L210-L214 PolarHBondContact O-N 3.16Å; L214-D216 PolarHBondContact O-N 3.42Å; L214-S217 WeakPolarHBondContact O-CB 3.37Å; L214-S217 PolarHBondContact O-N 3.32Å; L214-F222 HydrophobicContact CB-CB 4.3Å; L214-F222 HydrophobicContact CD2-CB 3.93Å; L214-F222 HydrophobicContact CD2-CD1 4.21Å; L214-F222 HydrophobicContact CD2-CD2 3.76Å; L214-F222 HydrophobicContact CD2-CE2 4.33Å; L214-F222 HydrophobicContact CD2-CG 3.71Å; L214-F222 CarbonylContact O-C 3.39Å; L214-R223 PolarHBondContact O-N 3.42Å; L214-A226 HydrophobicContact CB-CB 3.45Å; L214-A226 VanDerWaalsContact CB-CB 3.45Å; L214-A226 HydrophobicContact CD1-CB 4.41Å
215	A	97	Very high	95	Very high	3 Å²	3	31.9 Å²	31.9	3%	0.025	16%	0.161	C	C	.	.	H	α-helix	trans	-67.1	-22.7	177.4	0	0	0	0	0	113.5	L211 T212 H213 R223 A226 V297 R301	L211-A215 WeakPolarHBondContact O-CB 3.48Å; L211-A215 PolarHBondContact O-N 3.34Å; T212-A215 PolarHBondContact O-N 3.08Å; H213-A215 VanDerWaalsContact C-N 3.34Å; A215-R223 VanDerWaalsContact O-CD 3.29Å; A215-R223 WeakPolarHBondContact O-CD 3.5Å; A215-R223 VanDerWaalsContact O-CG 3.31Å; A215-R223 WeakPolarHBondContact O-CG 3.43Å; A215-A226 HydrophobicContact CB-CB 4.25Å; A215-V297 HydrophobicContact CB-CG1 3.88Å; A215-V297 HydrophobicContact CB-CG2 4.24Å; A215-R301 VanDerWaalsContact O-CD 3.29Å; A215-R301 WeakPolarHBondContact O-CD 3.4Å; A215-R301 PolarHBondContact O-NE 3.25Å
216	D	94.7	Very high	95.2	Very high	104 Å²	104	27.8 Å²	27.8	56%	0.556	14%	0.14	S	C	*	.	H	α-helix	trans	-95.8	-8.6	177.3	-150.7	45.5	0	0	0	114.4	T212 H213 L214 R301	T212-D216 PolarHBondContact O-N 3.31Å; H213-D216 PolarHBondContact O-N 2.98Å; L214-D216 PolarHBondContact O-N 3.42Å; D216-R301 IonicContact OD1-CZ 3.93Å; D216-R301 IonicContact OD1-NH2 2.86Å; D216-R301 PolarHBondContact OD1-NH2 3.2Å
217	S	92.2	Very high	95.3	Very high	15 Å²	15	27.3 Å²	27.3	11%	0.105	14%	0.136	C	C	.	.	S	Bend	trans	-58.7	151.3	179.9	179.5	0	0	0	0	113.8	H213 L214 A219 R223	H213-S217 PolarHBondContact O-N 2.96Å; L214-S217 WeakPolarHBondContact O-CB 3.37Å; L214-S217 PolarHBondContact O-N 3.32Å; S217-A219 VanDerWaalsContact C-N 3.26Å; S217-A219 PolarHBondContact O-N 3.43Å; S217-A219 PolarHBondContact OG-N 3.21Å; S217-R223 WeakPolarHBondContact O-CD 3.45Å; S217-R223 WeakPolarHBondContact O-CG 3.46Å; S217-R223 PolarHBondContact O-NH1 2.67Å
218	H	89.9	Confident	95.4	Very high	185 Å²	185	27.6 Å²	27.6	86%	0.856	14%	0.138	S	C	*	.	S	Bend	trans	-69.4	-21.9	171.4	-66.8	-65.2	0	0	0	113.3	R220 R223	H218-R220 PolarHBondContact O-N 2.97Å; H218-R223 PolarHBondContact O-NH1 2.81Å
219	A	89.7	Confident	95.5	Very high	15 Å²	15	27 Å²	27	12%	0.124	14%	0.135	C	C	.	.			trans	-70.2	122.2	177.4	0	0	0	0	0	112.2	S217 A221 F222 R223	S217-A219 VanDerWaalsContact C-N 3.26Å; S217-A219 PolarHBondContact O-N 3.43Å; S217-A219 PolarHBondContact OG-N 3.21Å; A219-A221 VanDerWaalsContact C-N 3.29Å; A219-A221 PolarHBondContact O-N 3.37Å; A219-F222 HydrophobicContact CB-CB 4.24Å; A219-F222 HydrophobicContact CB-CD2 3.85Å; A219-F222 HydrophobicContact CB-CE2 4.35Å; A219-F222 HydrophobicContact CB-CG 4Å; A219-F222 PolarHBondContact O-N 3.45Å; A219-R223 PolarHBondContact O-N 3.13Å; A219-R223 VanDerWaalsContact O-N 3.12Å
220	R	92.3	Very high	95.6	Very high	95 Å²	95	25.7 Å²	25.7	36%	0.358	13%	0.125	S	C	.	.	H	α-helix	trans	-57.5	-41.6	178.6	174.8	177.1	179.9	-175.2	3.3	112.1	Y166 H218 F222 R223 H224 V306 D308	Y166-R220 HydrophobicContact CE1-CG 4.19Å; H218-R220 PolarHBondContact O-N 2.97Å; R220-F222 VanDerWaalsContact C-N 3.32Å; R220-F222 PolarHBondContact O-N 3.21Å; R220-R223 PolarHBondContact O-N 3.39Å; R220-H224 VanDerWaalsContact O-CB 3.27Å; R220-H224 WeakPolarHBondContact O-CB 3.34Å; R220-H224 PolarHBondContact O-N 3.18Å; R220-V306 HydrophobicContact CG-CG2 4.13Å; R220-D308 IonicContact CZ-OD2 3.64Å; R220-D308 IonicContact NH2-OD2 2.66Å; R220-D308 PolarHBondContact NH2-OD2 2.96Å
221	A	93.7	Very high	95.7	Very high	5 Å²	5	25.7 Å²	25.7	4%	0.041	13%	0.125	C	C	.	.	H	α-helix	trans	-60	-42.4	-178.7	0	0	0	0	0	112	C132 F159 Y166 A219 T225	C132-A221 WeakPolarHBondContact O-CB 3.38Å; F159-A221 HydrophobicContact CE1-CB 4.28Å; F159-A221 HydrophobicContact CE2-CB 4.11Å; F159-A221 HydrophobicContact CZ-CB 3.53Å; Y166-A221 HydrophobicContact CD1-CB 3.6Å; Y166-A221 HydrophobicContact CD2-CB 4.11Å; Y166-A221 HydrophobicContact CE1-CB 4.09Å; Y166-A221 HydrophobicContact CG-CB 3.62Å; A219-A221 VanDerWaalsContact C-N 3.29Å; A219-A221 PolarHBondContact O-N 3.37Å; A221-T225 WeakPolarHBondContact O-CB 3.48Å; A221-T225 PolarHBondContact O-N 3.19Å; A221-T225 VanDerWaalsContact O-N 3.1Å; A221-T225 PolarHBondContact O-OG1 3.36Å
222	F	94.9	Very high	95.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-67.2	-52.7	176.9	-64.7	-6.7	0	0	0	110.8	C132 C134 M155 T156 F159 L214 A219 R220 H224 T225 A226	C132-F222 HydrophobicContact CB-CD1 3.52Å; C132-F222 HydrophobicContact CB-CE1 3.72Å; C134-F222 HydrophobicContact CB-CE1 4.01Å; C134-F222 HydrophobicContact CB-CZ 4.27Å; M155-F222 HydrophobicContact CB-CZ 4.41Å; M155-F222 WeakPolarHBondContact O-CZ 3.28Å; T156-F222 WeakPolarHBondContact OG1-CE2 3.42Å; F159-F222 HydrophobicContact CB-CZ 4.04Å; F159-F222 HydrophobicContact CD2-CD1 4.44Å; F159-F222 AromaticContact CD2-CE1 3.37Å; F159-F222 HydrophobicContact CD2-CE1 3.37Å; F159-F222 AromaticContact CD2-CZ 3.47Å; F159-F222 HydrophobicContact CD2-CZ 3.47Å; F159-F222 VanDerWaalsContact CD2-CZ 3.47Å; F159-F222 HydrophobicContact CE2-CD1 4.39Å; F159-F222 AromaticContact CE2-CE1 3.62Å; F159-F222 HydrophobicContact CE2-CE1 3.62Å; F159-F222 HydrophobicContact CE2-CZ 4.19Å; F159-F222 HydrophobicContact CG-CE1 4.18Å; F159-F222 AromaticContact CG-CZ 3.92Å; F159-F222 HydrophobicContact CG-CZ 3.92Å; L214-F222 HydrophobicContact CB-CB 4.3Å; L214-F222 HydrophobicContact CD2-CB 3.93Å; L214-F222 HydrophobicContact CD2-CD1 4.21Å; L214-F222 HydrophobicContact CD2-CD2 3.76Å; L214-F222 HydrophobicContact CD2-CE2 4.33Å; L214-F222 HydrophobicContact CD2-CG 3.71Å; L214-F222 CarbonylContact O-C 3.39Å; A219-F222 HydrophobicContact CB-CB 4.24Å; A219-F222 HydrophobicContact CB-CD2 3.85Å; A219-F222 HydrophobicContact CB-CE2 4.35Å; A219-F222 HydrophobicContact CB-CG 4Å; A219-F222 PolarHBondContact O-N 3.45Å; R220-F222 VanDerWaalsContact C-N 3.32Å; R220-F222 PolarHBondContact O-N 3.21Å; F222-H224 PolarHBondContact O-N 3.49Å; F222-T225 PolarHBondContact O-N 2.75Å; F222-A226 WeakPolarHBondContact O-CB 3.41Å; F222-A226 PolarHBondContact O-N 2.99Å
223	R	95.4	Very high	95.7	Very high	23 Å²	23	26.5 Å²	26.5	9%	0.087	13%	0.127	C	C	.	.	H	α-helix	trans	-57.9	-46.9	179.8	-64.1	-154.3	-58	-68.7	-3.4	113	L214 A215 S217 H218 A219 R220 T227 D304 I309	L214-R223 PolarHBondContact O-N 3.42Å; A215-R223 VanDerWaalsContact O-CD 3.29Å; A215-R223 WeakPolarHBondContact O-CD 3.5Å; A215-R223 VanDerWaalsContact O-CG 3.31Å; A215-R223 WeakPolarHBondContact O-CG 3.43Å; S217-R223 WeakPolarHBondContact O-CD 3.45Å; S217-R223 WeakPolarHBondContact O-CG 3.46Å; S217-R223 PolarHBondContact O-NH1 2.67Å; H218-R223 PolarHBondContact O-NH1 2.81Å; A219-R223 PolarHBondContact O-N 3.13Å; A219-R223 VanDerWaalsContact O-N 3.12Å; R220-R223 PolarHBondContact O-N 3.39Å; R223-T227 WeakPolarHBondContact O-CB 3.34Å; R223-T227 PolarHBondContact O-N 3.1Å; R223-T227 PolarHBondContact O-OG1 3.18Å; R223-D304 WeakPolarHBondContact CD-OD2 3.43Å; R223-D304 IonicContact CZ-OD2 3.68Å; R223-D304 IonicContact NE-OD1 2.9Å; R223-D304 IonicContact NE-OD2 3.06Å; R223-D304 PolarHBondContact NE-OD2 3.1Å; R223-D304 IonicContact NH2-OD1 3.17Å; R223-D304 PolarHBondContact NH2-OD1 2.71Å; R223-D304 IonicContact NH2-OD2 3Å; R223-I309 HydrophobicContact CB-CD1 3.84Å
224	H	96.2	Very high	95.8	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.009	11%	0.114	C	C	.	.	H	α-helix	trans	-65.7	-47.6	-177.2	178.3	-81.1	0	0	0	111.8	Y166 R220 F222 L228 I309 I312	Y166-H224 HydrophobicContact CE2-CB 4.06Å; Y166-H224 AromaticContact CE2-CG 3.94Å; Y166-H224 AromaticContact CE2-ND1 3.59Å; Y166-H224 AromaticContact CZ-CG 3.98Å; Y166-H224 VanDerWaalsContact OH-CB 3.24Å; Y166-H224 WeakPolarHBondContact OH-CB 3.4Å; R220-H224 VanDerWaalsContact O-CB 3.27Å; R220-H224 WeakPolarHBondContact O-CB 3.34Å; R220-H224 PolarHBondContact O-N 3.18Å; F222-H224 PolarHBondContact O-N 3.49Å; H224-L228 WeakPolarHBondContact O-CB 3.46Å; H224-L228 PolarHBondContact O-N 2.86Å; H224-I309 HydrophobicContact CB-CD1 3.99Å; H224-I309 HydrophobicContact CB-CG1 4.02Å; H224-I312 WeakPolarHBondContact NE2-CD1 3.31Å
225	T	97	Very high	95.8	Very high	1 Å²	1	24 Å²	24	1%	0.006	12%	0.116	C	C	.	.	H	α-helix	trans	-66.2	-46.3	-179	-54.8	0	0	0	0	111.3	C132 L168 F182 A221 F222 L228 A229	C132-T225 WeakPolarHBondContact SG-CB 3.44Å; C132-T225 VanDerWaalsContact SG-CG2 3.55Å; L168-T225 HydrophobicContact CD1-CG2 3.77Å; F182-T225 HydrophobicContact CE2-CG2 4.23Å; F182-T225 HydrophobicContact CZ-CG2 3.8Å; A221-T225 WeakPolarHBondContact O-CB 3.48Å; A221-T225 PolarHBondContact O-N 3.19Å; A221-T225 VanDerWaalsContact O-N 3.1Å; A221-T225 PolarHBondContact O-OG1 3.36Å; F222-T225 PolarHBondContact O-N 2.75Å; T225-L228 PolarHBondContact O-N 2.81Å; T225-A229 WeakPolarHBondContact O-CB 3.14Å; T225-A229 PolarHBondContact O-N 3.3Å
226	A	97.7	Very high	95.9	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.008	12%	0.115	C	C	.	.	H	α-helix	trans	-69.6	-37.6	-179.8	0	0	0	0	0	112.7	L211 L214 A215 F222 A229 A230	L211-A226 HydrophobicContact CD2-CB 4.06Å; L214-A226 HydrophobicContact CB-CB 3.45Å; L214-A226 VanDerWaalsContact CB-CB 3.45Å; L214-A226 HydrophobicContact CD1-CB 4.41Å; A215-A226 HydrophobicContact CB-CB 4.25Å; F222-A226 WeakPolarHBondContact O-CB 3.41Å; F222-A226 PolarHBondContact O-N 2.99Å; A226-A229 PolarHBondContact O-N 3.36Å; A226-A230 VanDerWaalsContact O-CB 3.23Å; A226-A230 WeakPolarHBondContact O-CB 3.19Å; A226-A230 PolarHBondContact O-N 3.35Å
227	T	98.3	Very high	96	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-61.1	-48	172	-56	0	0	0	0	110.3	R223 A229 A230 M231 V297 R301 I309 I312	R223-T227 WeakPolarHBondContact O-CB 3.34Å; R223-T227 PolarHBondContact O-N 3.1Å; R223-T227 PolarHBondContact O-OG1 3.18Å; T227-A229 VanDerWaalsContact C-N 3.34Å; T227-A229 PolarHBondContact O-N 2.85Å; T227-A230 PolarHBondContact O-N 3.45Å; T227-M231 HydrophobicContact CG2-CE 4.35Å; T227-M231 HydrophobicContact CG2-CG 4.13Å; T227-M231 HydrophobicContact CG2-SD 4.46Å; T227-M231 VanDerWaalsContact O-CG 3.25Å; T227-M231 WeakPolarHBondContact O-CG 3.39Å; T227-M231 PolarHBondContact O-N 2.73Å; T227-V297 HydrophobicContact CG2-CG1 4.39Å; T227-R301 HydrophobicContact CG2-CB 3.95Å; T227-R301 HydrophobicContact CG2-CG 4.43Å; T227-R301 WeakPolarHBondContact OG1-CG 3.33Å; T227-I309 HydrophobicContact CG2-CG2 4Å; T227-I312 HydrophobicContact CG2-CG2 4.29Å
228	L	98	Very high	96.2	Very high	6 Å²	6	18.2 Å²	18.2	3%	0.031	8%	0.084	C	C	.	.	H	α-helix	trans	-59.1	-44.7	178.3	-176.6	62.1	0	0	0	112.1	L168 F182 H224 T225 K232 I312	L168-L228 HydrophobicContact CD1-CD2 3.89Å; F182-L228 HydrophobicContact CD1-CD2 4.02Å; F182-L228 HydrophobicContact CD1-CG 4.46Å; F182-L228 HydrophobicContact CE1-CB 4.43Å; F182-L228 HydrophobicContact CE1-CD2 4.03Å; F182-L228 HydrophobicContact CE1-CG 4.16Å; H224-L228 WeakPolarHBondContact O-CB 3.46Å; H224-L228 PolarHBondContact O-N 2.86Å; T225-L228 PolarHBondContact O-N 2.81Å; L228-K232 HydrophobicContact CD1-CG 4.49Å; L228-K232 WeakPolarHBondContact O-CG 3.41Å; L228-K232 PolarHBondContact O-N 3.31Å; L228-I312 HydrophobicContact CB-CD1 4.26Å; L228-I312 HydrophobicContact CD1-CD1 4.27Å; L228-I312 HydrophobicContact CD1-CG1 4.27Å; L228-I312 HydrophobicContact CD1-CG2 4.04Å
229	A	98.2	Very high	96.5	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-62	-49.6	177.2	0	0	0	0	0	112.2	F128 F182 I186 L211 T225 A226 T227 M231 K232 M233	F128-A229 HydrophobicContact CD1-CB 4.03Å; F128-A229 HydrophobicContact CE1-CB 3.66Å; F182-A229 HydrophobicContact CE1-CB 4.21Å; F182-A229 HydrophobicContact CZ-CB 3.97Å; I186-A229 HydrophobicContact CD1-CB 3.76Å; L211-A229 HydrophobicContact CD1-CB 3.89Å; L211-A229 HydrophobicContact CD2-CB 3.72Å; L211-A229 HydrophobicContact CG-CB 4.49Å; T225-A229 WeakPolarHBondContact O-CB 3.14Å; T225-A229 PolarHBondContact O-N 3.3Å; A226-A229 PolarHBondContact O-N 3.36Å; T227-A229 VanDerWaalsContact C-N 3.34Å; T227-A229 PolarHBondContact O-N 2.85Å; A229-M231 PolarHBondContact O-N 2.86Å; A229-K232 PolarHBondContact O-N 3.23Å; A229-M233 WeakPolarHBondContact O-CB 3.4Å; A229-M233 PolarHBondContact O-N 3.35Å
230	A	98.3	Very high	96.9	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-60.6	-42.9	178.5	0	0	0	0	0	112	A226 T227 K232 M233 V234 L293 V297	A226-A230 VanDerWaalsContact O-CB 3.23Å; A226-A230 WeakPolarHBondContact O-CB 3.19Å; A226-A230 PolarHBondContact O-N 3.35Å; T227-A230 PolarHBondContact O-N 3.45Å; A230-K232 PolarHBondContact O-N 3.15Å; A230-M233 WeakPolarHBondContact O-CB 3.26Å; A230-M233 PolarHBondContact O-N 3.06Å; A230-V234 WeakPolarHBondContact O-CG2 3.39Å; A230-V234 PolarHBondContact O-N 3.31Å; A230-L293 HydrophobicContact CB-CD2 4.2Å; A230-V297 HydrophobicContact CB-CB 4.26Å; A230-V297 HydrophobicContact CB-CG1 3.93Å; A230-V297 HydrophobicContact CB-CG2 4.12Å
231	M	97.9	Very high	97.1	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-65.8	-40.5	177.9	-58.8	-50.8	83.1	0	0	111.4	T227 A229 M233 V234 T235 V297 F298 I312 E316 W320	T227-M231 HydrophobicContact CG2-CE 4.35Å; T227-M231 HydrophobicContact CG2-CG 4.13Å; T227-M231 HydrophobicContact CG2-SD 4.46Å; T227-M231 VanDerWaalsContact O-CG 3.25Å; T227-M231 WeakPolarHBondContact O-CG 3.39Å; T227-M231 PolarHBondContact O-N 2.73Å; A229-M231 PolarHBondContact O-N 2.86Å; M231-M233 VanDerWaalsContact C-N 3.33Å; M231-V234 PolarHBondContact O-N 3.18Å; M231-T235 PolarHBondContact O-N 3.06Å; M231-T235 PolarHBondContact O-OG1 2.91Å; M231-T235 VanDerWaalsContact O-OG1 3.07Å; M231-V297 HydrophobicContact CE-CB 4.11Å; M231-V297 HydrophobicContact CE-CG1 3.71Å; M231-F298 HydrophobicContact CE-CB 4.14Å; M231-F298 HydrophobicContact SD-CB 4.14Å; M231-F298 HydrophobicContact SD-CD2 3.91Å; M231-I312 HydrophobicContact CB-CG2 4.43Å; M231-I312 HydrophobicContact CG-CG2 3.82Å; M231-E316 HydrophobicContact CB-CB 3.79Å; M231-E316 HydrophobicContact CB-CG 3.63Å; M231-E316 HydrophobicContact CG-CB 4.26Å; M231-E316 HydrophobicContact CG-CG 4.26Å; M231-W320 HydrophobicContact CB-CZ2 4.03Å; M231-W320 HydrophobicContact CE-CH2 4.44Å; M231-W320 HydrophobicContact CG-CZ2 4.49Å; M231-W320 HydrophobicContact SD-CH2 3.56Å; M231-W320 VanDerWaalsContact SD-CH2 3.56Å; M231-W320 HydrophobicContact SD-CZ2 3.99Å
232	K	97.9	Very high	97.2	Very high	36 Å²	36	7.8 Å²	7.8	16%	0.157	4%	0.038	C	C	.	.	H	α-helix	trans	-67.3	-33.5	176.1	-72	-68.9	169.5	-153.1	0	112.9	C183 I186 L228 A229 A230 T235 A236 E316	C183-K232 HydrophobicContact CB-CD 3.92Å; C183-K232 HydrophobicContact CB-CG 4.01Å; I186-K232 HydrophobicContact CG2-CB 4.24Å; L228-K232 HydrophobicContact CD1-CG 4.49Å; L228-K232 WeakPolarHBondContact O-CG 3.41Å; L228-K232 PolarHBondContact O-N 3.31Å; A229-K232 PolarHBondContact O-N 3.23Å; A230-K232 PolarHBondContact O-N 3.15Å; K232-T235 WeakPolarHBondContact O-CB 3.36Å; K232-T235 PolarHBondContact O-N 3.16Å; K232-A236 PolarHBondContact O-N 2.81Å; K232-E316 WeakPolarHBondContact CE-OE1 3.35Å; K232-E316 WeakPolarHBondContact CE-OE2 3.37Å; K232-E316 IonicContact NZ-OE1 3.94Å; K232-E316 PolarHBondContact NZ-OE1 3.06Å; K232-E316 IonicContact NZ-OE2 3.24Å; K232-E316 PolarHBondContact NZ-OE2 3.3Å
233	M	97.5	Very high	97.2	Very high	4 Å²	4	11.2 Å²	11.2	2%	0.02	5%	0.051	C	C	.	.	H	α-helix	trans	-63.5	-46.4	171.2	-176.7	168.5	-74.4	0	0	111.3	I186 V190 M204 V207 I208 L211 A229 A230 M231 T235 A236 L237 L293	I186-M233 HydrophobicContact CG2-CB 4.36Å; V190-M233 HydrophobicContact CG2-CE 4.32Å; V190-M233 HydrophobicContact CG2-CG 4.42Å; M204-M233 HydrophobicContact CE-CE 4.18Å; M204-M233 HydrophobicContact CE-CG 3.85Å; M204-M233 HydrophobicContact CE-SD 3.51Å; M204-M233 VanDerWaalsContact CE-SD 3.51Å; M204-M233 HydrophobicContact SD-CE 4.49Å; V207-M233 HydrophobicContact CB-CE 4.4Å; V207-M233 HydrophobicContact CG1-CE 3.53Å; V207-M233 HydrophobicContact CG1-SD 4.45Å; I208-M233 HydrophobicContact CG1-SD 3.99Å; L211-M233 HydrophobicContact CD1-CE 4.27Å; L211-M233 HydrophobicContact CD1-SD 4.42Å; A229-M233 WeakPolarHBondContact O-CB 3.4Å; A229-M233 PolarHBondContact O-N 3.35Å; A230-M233 WeakPolarHBondContact O-CB 3.26Å; A230-M233 PolarHBondContact O-N 3.06Å; M231-M233 VanDerWaalsContact C-N 3.33Å; M233-T235 VanDerWaalsContact C-N 3.33Å; M233-T235 PolarHBondContact O-N 3.13Å; M233-A236 PolarHBondContact O-N 3.3Å; M233-L237 HydrophobicContact CG-CD1 4.02Å; M233-L237 HydrophobicContact CG-CG 4.48Å; M233-L237 WeakPolarHBondContact O-CB 3.4Å; M233-L237 VanDerWaalsContact O-CG 3.28Å; M233-L237 WeakPolarHBondContact O-CG 3.36Å; M233-L237 PolarHBondContact O-N 3.41Å; M233-L293 HydrophobicContact CB-CD1 4.35Å; M233-L293 HydrophobicContact CG-CD1 3.93Å; M233-L293 HydrophobicContact SD-CD1 4.01Å
234	V	98	Very high	97.2	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-60.2	-41	172.7	175	0	0	0	0	111.5	A230 M231 A236 L237 A238 I290 L293 W320 F328	A230-V234 WeakPolarHBondContact O-CG2 3.39Å; A230-V234 PolarHBondContact O-N 3.31Å; M231-V234 PolarHBondContact O-N 3.18Å; V234-A236 VanDerWaalsContact C-N 3.34Å; V234-A236 PolarHBondContact O-N 3.49Å; V234-L237 PolarHBondContact O-N 3.12Å; V234-A238 WeakPolarHBondContact O-CB 3.31Å; V234-A238 PolarHBondContact O-N 2.86Å; V234-I290 HydrophobicContact CG1-CG2 4.16Å; V234-L293 HydrophobicContact CG2-CB 3.51Å; V234-L293 HydrophobicContact CG2-CD1 3.75Å; V234-L293 HydrophobicContact CG2-CG 4.28Å; V234-W320 HydrophobicContact CB-CH2 4.2Å; V234-W320 HydrophobicContact CB-CZ2 3.61Å; V234-W320 HydrophobicContact CG1-CD2 3.88Å; V234-W320 VanDerWaalsContact CG1-CE2 3.48Å; V234-W320 HydrophobicContact CG1-CE3 4.25Å; V234-W320 HydrophobicContact CG1-CG 4.49Å; V234-W320 HydrophobicContact CG1-CH2 3.93Å; V234-W320 HydrophobicContact CG1-CZ2 3.53Å; V234-W320 HydrophobicContact CG1-CZ3 4.28Å; V234-W320 HydrophobicContact CG2-CZ2 4.42Å; V234-F328 HydrophobicContact CG1-CZ 4.1Å
235	T	97.8	Very high	97.1	Very high	9 Å²	9	12.3 Å²	12.3	6%	0.055	6%	0.059	C	C	.	.	H	α-helix	trans	-57.4	-46.1	174.5	-59.7	0	0	0	0	111.5	M231 K232 M233 E239 E316 V319 W320	M231-T235 PolarHBondContact O-N 3.06Å; M231-T235 PolarHBondContact O-OG1 2.91Å; M231-T235 VanDerWaalsContact O-OG1 3.07Å; K232-T235 WeakPolarHBondContact O-CB 3.36Å; K232-T235 PolarHBondContact O-N 3.16Å; M233-T235 VanDerWaalsContact C-N 3.33Å; M233-T235 PolarHBondContact O-N 3.13Å; T235-E239 WeakPolarHBondContact O-CG 3.45Å; T235-E239 PolarHBondContact O-N 2.77Å; T235-E316 PolarHBondContact OG1-OE2 3.17Å; T235-V319 HydrophobicContact CG2-CG1 4Å; T235-W320 PolarHBondContact OG1-NE1 3.15Å
236	A	97.6	Very high	97	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-68.1	-40.7	178	0	0	0	0	0	113.2	T187 V190 K232 M233 V234 E239 I240	T187-A236 HydrophobicContact CG2-CB 4.08Å; V190-A236 HydrophobicContact CB-CB 3.78Å; V190-A236 HydrophobicContact CG1-CB 3.61Å; K232-A236 PolarHBondContact O-N 2.81Å; M233-A236 PolarHBondContact O-N 3.3Å; V234-A236 VanDerWaalsContact C-N 3.34Å; V234-A236 PolarHBondContact O-N 3.49Å; A236-E239 PolarHBondContact O-N 2.88Å; A236-I240 WeakPolarHBondContact O-CG1 3.49Å; A236-I240 PolarHBondContact O-N 3Å; A236-I240 VanDerWaalsContact O-N 3.16Å
237	L	97.5	Very high	96.8	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-63.2	-43.5	175.6	-71.8	167.9	0	0	0	111.7	V190 I198 M204 M233 V234 E239 I240 A241 I286 M289 I290 L293	V190-L237 HydrophobicContact CG1-CD2 4.37Å; V190-L237 HydrophobicContact CG1-CG 4.46Å; I198-L237 HydrophobicContact CD1-CD2 3.72Å; M204-L237 HydrophobicContact CE-CD1 4.17Å; M204-L237 HydrophobicContact CE-CD2 4.13Å; M204-L237 HydrophobicContact CE-CG 4.47Å; M233-L237 HydrophobicContact CG-CD1 4.02Å; M233-L237 HydrophobicContact CG-CG 4.48Å; M233-L237 WeakPolarHBondContact O-CB 3.4Å; M233-L237 VanDerWaalsContact O-CG 3.28Å; M233-L237 WeakPolarHBondContact O-CG 3.36Å; M233-L237 PolarHBondContact O-N 3.41Å; V234-L237 PolarHBondContact O-N 3.12Å; L237-E239 VanDerWaalsContact C-N 3.3Å; L237-E239 PolarHBondContact O-N 2.9Å; L237-I240 WeakPolarHBondContact O-CA 3.41Å; L237-I240 WeakPolarHBondContact O-CB 3.3Å; L237-I240 PolarHBondContact O-N 3.39Å; L237-A241 PolarHBondContact O-N 3.49Å; L237-I286 HydrophobicContact CB-CG2 4.13Å; L237-I286 HydrophobicContact CD2-CD1 3.6Å; L237-I286 HydrophobicContact CD2-CG2 4.14Å; L237-I286 VanDerWaalsContact O-CG2 3.3Å; L237-I286 WeakPolarHBondContact O-CG2 3.15Å; L237-M289 HydrophobicContact CD1-CB 3.87Å; L237-M289 HydrophobicContact CD2-SD 3.97Å; L237-I290 HydrophobicContact CB-CD1 3.9Å; L237-I290 HydrophobicContact CB-CG1 3.59Å; L237-I290 HydrophobicContact CD1-CG1 4.23Å; L237-L293 HydrophobicContact CD1-CD1 4.05Å
238	A	96.9	Very high	96.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-61.2	-38.4	178.4	0	0	0	0	0	111.9	V234 A241 V242 I290 F328	V234-A238 WeakPolarHBondContact O-CB 3.31Å; V234-A238 PolarHBondContact O-N 2.86Å; A238-A241 PolarHBondContact O-N 3.44Å; A238-V242 WeakPolarHBondContact O-CG2 3.25Å; A238-V242 PolarHBondContact O-N 2.95Å; A238-I290 HydrophobicContact CB-CD1 4.35Å; A238-F328 HydrophobicContact CB-CE2 4.29Å
239	E	96.4	Very high	96.5	Very high	47 Å²	47	25.1 Å²	25.1	22%	0.22	13%	0.133	C	C	.	.	H	α-helix	trans	-67.3	-33.8	172.8	-66.2	176.1	-173.3	0	0	113.5	R191 T235 A236 L237 R243	R191-E239 IonicContact CZ-OE1 3.24Å; R191-E239 IonicContact CZ-OE2 2.74Å; R191-E239 IonicContact NE-OE2 2.67Å; R191-E239 PolarHBondContact NE-OE2 2.92Å; R191-E239 IonicContact NH2-OE1 2.71Å; R191-E239 PolarHBondContact NH2-OE1 2.92Å; R191-E239 IonicContact NH2-OE2 3.74Å; R191-E239 PolarHBondContact NH2-OE2 3.12Å; T235-E239 WeakPolarHBondContact O-CG 3.45Å; T235-E239 PolarHBondContact O-N 2.77Å; A236-E239 PolarHBondContact O-N 2.88Å; L237-E239 VanDerWaalsContact C-N 3.3Å; L237-E239 PolarHBondContact O-N 2.9Å; E239-R243 WeakPolarHBondContact O-CG 3.49Å; E239-R243 PolarHBondContact O-N 2.81Å; E239-R243 VanDerWaalsContact O-N 3.08Å; E239-R243 PolarHBondContact O-NH1 3.41Å; E239-R243 IonicContact OE2-NH1 3.64Å
240	I	96.7	Very high	96.4	Very high	1 Å²	1	28 Å²	28	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-66.1	-45.7	172.9	-66.2	166.2	0	0	0	109.3	V190 Q194 I198 A236 L237 V242 R243 L244 I286	V190-I240 HydrophobicContact CG1-CD1 3.82Å; Q194-I240 HydrophobicContact CB-CD1 3.63Å; Q194-I240 HydrophobicContact CB-CG1 3.87Å; Q194-I240 HydrophobicContact CB-CG2 4.38Å; I198-I240 HydrophobicContact CD1-CD1 3.66Å; A236-I240 WeakPolarHBondContact O-CG1 3.49Å; A236-I240 PolarHBondContact O-N 3Å; A236-I240 VanDerWaalsContact O-N 3.16Å; L237-I240 WeakPolarHBondContact O-CA 3.41Å; L237-I240 WeakPolarHBondContact O-CB 3.3Å; L237-I240 PolarHBondContact O-N 3.39Å; I240-V242 VanDerWaalsContact C-N 3.34Å; I240-V242 PolarHBondContact O-N 2.9Å; I240-R243 PolarHBondContact O-N 3.42Å; I240-R243 VanDerWaalsContact O-N 3.12Å; I240-L244 HydrophobicContact CG2-CD1 3.88Å; I240-L244 HydrophobicContact CG2-CG 4.29Å; I240-L244 WeakPolarHBondContact O-CG 3.36Å; I240-L244 PolarHBondContact O-N 2.98Å; I240-I286 HydrophobicContact CB-CG2 4.49Å; I240-I286 HydrophobicContact CG2-CD1 3.98Å; I240-I286 HydrophobicContact CG2-CG1 4.05Å; I240-I286 HydrophobicContact CG2-CG2 4.48Å
241	A	96.6	Very high	96.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-56.6	-45.5	175.8	0	0	0	0	0	112	L237 A238 R243 L244 D245 I286 I290 Y324	L237-A241 PolarHBondContact O-N 3.49Å; A238-A241 PolarHBondContact O-N 3.44Å; A241-R243 PolarHBondContact O-N 2.88Å; A241-L244 PolarHBondContact O-N 3.45Å; A241-D245 PolarHBondContact O-N 3.38Å; A241-I286 HydrophobicContact CB-CG2 3.97Å; A241-I290 HydrophobicContact CB-CD1 4.39Å; A241-Y324 HydrophobicContact CB-CD1 4.44Å; A241-Y324 HydrophobicContact CB-CE1 3.82Å
242	V	96.2	Very high	95.9	Very high	33 Å²	33	29.7 Å²	29.7	20%	0.2	16%	0.163	C	C	.	.	H	α-helix	trans	-62.5	-39.4	175.6	171.4	0	0	0	0	112.2	A238 I240 D245 Q246 Y324	A238-V242 WeakPolarHBondContact O-CG2 3.25Å; A238-V242 PolarHBondContact O-N 2.95Å; I240-V242 VanDerWaalsContact C-N 3.34Å; I240-V242 PolarHBondContact O-N 2.9Å; V242-D245 PolarHBondContact O-N 3.42Å; V242-Q246 VanDerWaalsContact O-CG 3.3Å; V242-Q246 WeakPolarHBondContact O-CG 3.39Å; V242-Q246 PolarHBondContact O-N 2.89Å; V242-Y324 HydrophobicContact CG2-CD1 4.48Å; V242-Y324 HydrophobicContact CG2-CD2 3.44Å; V242-Y324 VanDerWaalsContact CG2-CD2 3.44Å; V242-Y324 HydrophobicContact CG2-CE2 4.03Å; V242-Y324 HydrophobicContact CG2-CG 3.69Å
243	R	95.4	Very high	95.7	Very high	73 Å²	73	32.8 Å²	32.8	28%	0.275	18%	0.178	S	C	.	.	H	α-helix	trans	-68.3	-36.3	174.5	-74.7	-169.5	-64.3	-83.1	2.5	112.5	Q194 E239 I240 A241 S247	Q194-R243 VanDerWaalsContact OE1-CZ 3.25Å; E239-R243 WeakPolarHBondContact O-CG 3.49Å; E239-R243 PolarHBondContact O-N 2.81Å; E239-R243 VanDerWaalsContact O-N 3.08Å; E239-R243 PolarHBondContact O-NH1 3.41Å; E239-R243 IonicContact OE2-NH1 3.64Å; I240-R243 PolarHBondContact O-N 3.42Å; I240-R243 VanDerWaalsContact O-N 3.12Å; A241-R243 PolarHBondContact O-N 2.88Å; R243-S247 WeakPolarHBondContact O-CB 3.26Å; R243-S247 PolarHBondContact O-N 2.79Å; R243-S247 PolarHBondContact O-OG 2.85Å
244	L	95.5	Very high	95.4	Very high	15 Å²	15	36.4 Å²	36.4	8%	0.079	20%	0.195	C	C	.	.	H	α-helix	trans	-66.5	-42.2	173.9	-72.2	169.6	0	0	0	110.9	I240 A241 Q246 S247 L248 Y279 N282 K283 I286	I240-L244 HydrophobicContact CG2-CD1 3.88Å; I240-L244 HydrophobicContact CG2-CG 4.29Å; I240-L244 WeakPolarHBondContact O-CG 3.36Å; I240-L244 PolarHBondContact O-N 2.98Å; A241-L244 PolarHBondContact O-N 3.45Å; L244-Q246 PolarHBondContact O-N 2.89Å; L244-S247 CarbonylContact O-C 3.59Å; L244-S247 PolarHBondContact O-N 3.2Å; L244-S247 VanDerWaalsContact O-N 3.17Å; L244-L248 VanDerWaalsContact O-CB 3.23Å; L244-L248 WeakPolarHBondContact O-CB 3.41Å; L244-L248 PolarHBondContact O-N 3.34Å; L244-Y279 HydrophobicContact CD2-CD1 4.32Å; L244-N282 HydrophobicContact CD1-CB 4.18Å; L244-N282 HydrophobicContact CD2-CB 4.24Å; L244-K283 HydrophobicContact CB-CB 4.25Å; L244-K283 HydrophobicContact CD1-CB 4.29Å; L244-I286 HydrophobicContact CD1-CG1 4.09Å
245	D	94.4	Very high	94.9	Very high	33 Å²	33	38.1 Å²	38.1	18%	0.176	20%	0.203	C	C	.	.	H	α-helix	trans	-60.3	-45.4	174.7	-91.2	-40	0	0	0	112.6	A241 V242 S247 L248 S249 K283 Y324	A241-D245 PolarHBondContact O-N 3.38Å; V242-D245 PolarHBondContact O-N 3.42Å; D245-S247 VanDerWaalsContact C-N 3.3Å; D245-S247 PolarHBondContact O-N 2.63Å; D245-L248 PolarHBondContact O-N 3.4Å; D245-S249 WeakPolarHBondContact O-CB 3.28Å; D245-S249 PolarHBondContact O-N 3.4Å; D245-K283 WeakPolarHBondContact OD1-CD 3.47Å; D245-K283 VanDerWaalsContact OD1-CE 3.31Å; D245-K283 WeakPolarHBondContact OD1-CE 3.49Å; D245-K283 IonicContact OD1-NZ 3.76Å; D245-K283 PolarHBondContact OD1-NZ 3.08Å; D245-K283 WeakPolarHBondContact OD2-CE 3.48Å; D245-K283 IonicContact OD2-NZ 2.71Å; D245-K283 PolarHBondContact OD2-NZ 2.93Å; D245-Y324 WeakPolarHBondContact OD2-CE2 3.22Å; D245-Y324 PolarHBondContact OD2-OH 3.03Å
246	Q	94.5	Very high	94.5	Very high	125 Å²	125	42.5 Å²	42.5	58%	0.584	22%	0.222	S	C	*	.	H	α-helix	trans	-60.6	-40.4	174	-70.3	170.2	8.1	0	0	111.9	V242 L244 S250	V242-Q246 VanDerWaalsContact O-CG 3.3Å; V242-Q246 WeakPolarHBondContact O-CG 3.39Å; V242-Q246 PolarHBondContact O-N 2.89Å; L244-Q246 PolarHBondContact O-N 2.89Å; Q246-S250 WeakPolarHBondContact O-CB 3.33Å; Q246-S250 PolarHBondContact O-N 3.45Å
247	S	94.2	Very high	94	Very high	45 Å²	45	45.9 Å²	45.9	32%	0.315	24%	0.241	S	C	.	.	H	α-helix	trans	-70.1	-41.6	178.8	-58.4	0	0	0	0	112.1	R243 L244 D245 S250 V251	R243-S247 WeakPolarHBondContact O-CB 3.26Å; R243-S247 PolarHBondContact O-N 2.79Å; R243-S247 PolarHBondContact O-OG 2.85Å; L244-S247 CarbonylContact O-C 3.59Å; L244-S247 PolarHBondContact O-N 3.2Å; L244-S247 VanDerWaalsContact O-N 3.17Å; D245-S247 VanDerWaalsContact C-N 3.3Å; D245-S247 PolarHBondContact O-N 2.63Å; S247-S250 PolarHBondContact O-N 3.07Å; S247-V251 WeakPolarHBondContact O-CB 3.42Å; S247-V251 WeakPolarHBondContact O-CG2 3.45Å; S247-V251 PolarHBondContact O-N 2.93Å
248	L	94.7	Very high	93.5	Very high	25 Å²	25	47.3 Å²	47.3	13%	0.131	25%	0.247	C	C	.	.	H	α-helix	trans	-66.1	-39.9	177.7	-176.9	64	0	0	0	111.8	L244 D245 T252 K276 T280	L244-L248 VanDerWaalsContact O-CB 3.23Å; L244-L248 WeakPolarHBondContact O-CB 3.41Å; L244-L248 PolarHBondContact O-N 3.34Å; D245-L248 PolarHBondContact O-N 3.4Å; L248-T252 VanDerWaalsContact O-CB 3.23Å; L248-T252 WeakPolarHBondContact O-CB 3.35Å; L248-T252 PolarHBondContact O-N 2.83Å; L248-T252 PolarHBondContact O-OG1 3.3Å; L248-K276 HydrophobicContact CD1-CG 3.74Å; L248-K276 WeakPolarHBondContact CD1-O 3.15Å; L248-T280 WeakPolarHBondContact CD1-OG1 3.36Å
249	S	94.7	Very high	92.8	Very high	82 Å²	82	55.5 Å²	55.5	57%	0.573	28%	0.278	S	S	*	.	H	α-helix	trans	-62.1	-49.2	171.9	-178.9	0	0	0	0	111.3	D245 V251 T252 Q253	D245-S249 WeakPolarHBondContact O-CB 3.28Å; D245-S249 PolarHBondContact O-N 3.4Å; S249-V251 PolarHBondContact O-N 3.35Å; S249-T252 PolarHBondContact O-N 3.42Å; S249-Q253 PolarHBondContact O-N 3.12Å
250	S	94.9	Very high	92.1	Very high	61 Å²	61	57.4 Å²	57.4	43%	0.427	30%	0.296	S	S	.	.	H	α-helix	trans	-59.8	-45.4	176.7	-178.6	0	0	0	0	113.1	Q246 S247 Q253 Q254	Q246-S250 WeakPolarHBondContact O-CB 3.33Å; Q246-S250 PolarHBondContact O-N 3.45Å; S247-S250 PolarHBondContact O-N 3.07Å; S250-Q253 PolarHBondContact O-N 3.33Å; S250-Q254 VanDerWaalsContact O-CG 3.29Å; S250-Q254 WeakPolarHBondContact O-CG 3.41Å; S250-Q254 PolarHBondContact O-N 3.27Å; S250-Q254 PolarHBondContact O-NE2 2.94Å; S250-Q254 PolarHBondContact OG-NE2 3.39Å
251	V	94	Very high	91.1	Very high	10 Å²	10	65 Å²	65	6%	0.061	33%	0.325	C	S	.	.	H	α-helix	trans	-67.8	-38.2	177	171.3	0	0	0	0	111.4	S247 S249 Q254 F255 L272 K275 K276 Y279	S247-V251 WeakPolarHBondContact O-CB 3.42Å; S247-V251 WeakPolarHBondContact O-CG2 3.45Å; S247-V251 PolarHBondContact O-N 2.93Å; S249-V251 PolarHBondContact O-N 3.35Å; V251-Q254 PolarHBondContact O-N 3.41Å; V251-F255 WeakPolarHBondContact O-CB 3.29Å; V251-F255 PolarHBondContact O-N 2.87Å; V251-L272 HydrophobicContact CG1-CD2 4.23Å; V251-L272 WeakPolarHBondContact CG1-O 3.47Å; V251-K275 HydrophobicContact CG1-CB 4.24Å; V251-K276 HydrophobicContact CG1-CB 3.97Å; V251-Y279 HydrophobicContact CG2-CD2 3.99Å; V251-Y279 HydrophobicContact CG2-CE2 3.7Å
252	T	93.4	Very high	89.3	Confident	25 Å²	25	73.8 Å²	73.8	15%	0.153	37%	0.366	C	S	.	.	H	α-helix	trans	-62.6	-46.3	175.5	-65.5	0	0	0	0	111.3	L248 S249 Q254 F255 E256 K276	L248-T252 VanDerWaalsContact O-CB 3.23Å; L248-T252 WeakPolarHBondContact O-CB 3.35Å; L248-T252 PolarHBondContact O-N 2.83Å; L248-T252 PolarHBondContact O-OG1 3.3Å; S249-T252 PolarHBondContact O-N 3.42Å; T252-Q254 VanDerWaalsContact C-N 3.32Å; T252-Q254 PolarHBondContact O-N 3.35Å; T252-F255 WeakPolarHBondContact O-CB 3.49Å; T252-F255 PolarHBondContact O-N 3.43Å; T252-E256 WeakPolarHBondContact O-CG 3.07Å; T252-E256 PolarHBondContact O-N 3.35Å; T252-K276 VanDerWaalsContact OG1-CE 3.28Å; T252-K276 WeakPolarHBondContact OG1-CE 3.49Å; T252-K276 PolarHBondContact OG1-NZ 3.36Å
253	Q	92.9	Very high	87.5	Confident	101 Å²	101	82.9 Å²	82.9	47%	0.472	40%	0.397	S	S	.	.	H	α-helix	trans	-62.1	-38.9	175.9	-173	65.1	76.5	0	0	112.1	S249 S250 N257	S249-Q253 PolarHBondContact O-N 3.12Å; S250-Q253 PolarHBondContact O-N 3.33Å; Q253-N257 PolarHBondContact NE2-OD1 3.12Å; Q253-N257 VanDerWaalsContact NE2-OD1 3.12Å; Q253-N257 VanDerWaalsContact O-CB 3.24Å; Q253-N257 WeakPolarHBondContact O-CB 2.97Å; Q253-N257 PolarHBondContact O-N 2.96Å; Q253-N257 PolarHBondContact O-ND2 3.25Å
254	Q	90.2	Very high	85.6	Confident	80 Å²	80	89.7 Å²	89.7	37%	0.374	43%	0.428	S	S	.	.	H	α-helix	trans	-65.1	-41.7	174.7	-73.9	175.8	58.1	0	0	112.3	S250 V251 T252 N257 E258 L272	S250-Q254 VanDerWaalsContact O-CG 3.29Å; S250-Q254 WeakPolarHBondContact O-CG 3.41Å; S250-Q254 PolarHBondContact O-N 3.27Å; S250-Q254 PolarHBondContact O-NE2 2.94Å; S250-Q254 PolarHBondContact OG-NE2 3.39Å; V251-Q254 PolarHBondContact O-N 3.41Å; T252-Q254 VanDerWaalsContact C-N 3.32Å; T252-Q254 PolarHBondContact O-N 3.35Å; Q254-N257 PolarHBondContact O-N 2.86Å; Q254-E258 WeakPolarHBondContact O-CB 3.49Å; Q254-E258 PolarHBondContact O-N 3.07Å; Q254-L272 HydrophobicContact CB-CD1 4.25Å; Q254-L272 HydrophobicContact CB-CD2 4.04Å
255	F	88.7	Confident	84	Confident	35 Å²	35	91 Å²	91	15%	0.154	44%	0.439	C	S	.	.	H	α-helix	trans	-62.7	-46.7	176.6	178.2	-96.3	0	0	0	111.6	V251 T252 E258 R259 L269 L272 Q273	V251-F255 WeakPolarHBondContact O-CB 3.29Å; V251-F255 PolarHBondContact O-N 2.87Å; T252-F255 WeakPolarHBondContact O-CB 3.49Å; T252-F255 PolarHBondContact O-N 3.43Å; F255-E258 PolarHBondContact O-N 3Å; F255-R259 WeakPolarHBondContact O-CB 3.31Å; F255-R259 PolarHBondContact O-N 2.73Å; F255-L269 HydrophobicContact CD2-CD2 3.91Å; F255-L269 HydrophobicContact CE2-CD2 3.88Å; F255-L272 HydrophobicContact CB-CB 4.33Å; F255-L272 HydrophobicContact CD2-CB 4.1Å; F255-Q273 HydrophobicContact CD2-CB 4.42Å; F255-Q273 HydrophobicContact CE2-CB 3.96Å
256	E	88.9	Confident	83.2	Confident	101 Å²	101	95 Å²	95	47%	0.472	46%	0.46	S	S	.	.	H	α-helix	trans	-64.2	-43.5	176.7	-71.5	178.6	-176.5	0	0	112.3	T252 E258 R259 S260	T252-E256 WeakPolarHBondContact O-CG 3.07Å; T252-E256 PolarHBondContact O-N 3.35Å; E256-E258 PolarHBondContact O-N 3.03Å; E256-R259 PolarHBondContact O-N 2.86Å; E256-S260 WeakPolarHBondContact O-CB 3.45Å; E256-S260 PolarHBondContact O-N 3.39Å
257	N	87.9	Confident	82.6	Confident	72 Å²	72	97 Å²	97	39%	0.385	47%	0.469	S	S	.	.	H	α-helix	trans	-60.3	-45.2	176.6	-74.7	-15.3	0	0	0	111.7	Q253 Q254 S260 R261	Q253-N257 PolarHBondContact NE2-OD1 3.12Å; Q253-N257 VanDerWaalsContact NE2-OD1 3.12Å; Q253-N257 VanDerWaalsContact O-CB 3.24Å; Q253-N257 WeakPolarHBondContact O-CB 2.97Å; Q253-N257 PolarHBondContact O-N 2.96Å; Q253-N257 PolarHBondContact O-ND2 3.25Å; Q254-N257 PolarHBondContact O-N 2.86Å; N257-S260 PolarHBondContact O-N 3.06Å; N257-S260 PolarHBondContact O-OG 3.34Å; N257-R261 WeakPolarHBondContact O-CG 3.17Å
258	E	85.4	Confident	82.2	Confident	29 Å²	29	100.4 Å²	100.4	14%	0.136	48%	0.476	C	S	.	.	H	α-helix	trans	-74.2	-33.8	180	-153	77.9	152.4	0	0	112	Q254 F255 E256 S260 R261 R268 L269 L272	Q254-E258 WeakPolarHBondContact O-CB 3.49Å; Q254-E258 PolarHBondContact O-N 3.07Å; F255-E258 PolarHBondContact O-N 3Å; E256-E258 PolarHBondContact O-N 3.03Å; E258-S260 VanDerWaalsContact C-N 3.3Å; E258-S260 PolarHBondContact O-N 3.2Å; E258-R261 PolarHBondContact O-N 2.82Å; E258-R261 WeakPolarHBondContact OE2-CD 3.25Å; E258-R261 IonicContact OE2-NH1 3.14Å; E258-R261 PolarHBondContact OE2-NH1 3.1Å; E258-R261 VanDerWaalsContact OE2-NH1 3.14Å; E258-R268 VanDerWaalsContact CD-NH1 3.35Å; E258-R268 VanDerWaalsContact OE1-CD 3.29Å; E258-R268 WeakPolarHBondContact OE1-CD 3.29Å; E258-R268 IonicContact OE1-CZ 2.84Å; E258-R268 IonicContact OE1-NE 2.84Å; E258-R268 IonicContact OE1-NH1 2.79Å; E258-R268 PolarHBondContact OE1-NH1 2.73Å; E258-R268 IonicContact OE2-NH1 2.76Å; E258-L269 HydrophobicContact CB-CD2 4.2Å; E258-L272 HydrophobicContact CB-CD1 4.49Å
259	R	83.3	Confident	81.8	Confident	173 Å²	173	101.2 Å²	101.2	65%	0.653	48%	0.48	S	S	*	.	H	α-helix	trans	-61.2	-37.9	172.3	179.1	179.6	171.7	-175.2	-2.3	111.6	F255 E256 R261 L269	F255-R259 WeakPolarHBondContact O-CB 3.31Å; F255-R259 PolarHBondContact O-N 2.73Å; E256-R259 PolarHBondContact O-N 2.86Å; R259-R261 VanDerWaalsContact C-N 3.25Å; R259-R261 PolarHBondContact O-N 3.1Å; R259-L269 HydrophobicContact CB-CD2 4.09Å
260	S	81.9	Confident	81.5	Confident	86 Å²	86	103.1 Å²	103.1	60%	0.601	48%	0.48	S	S	*	.	H	α-helix	trans	-65.8	-25.3	177.5	80.6	0	0	0	0	113.6	E256 N257 E258 Q262	E256-S260 WeakPolarHBondContact O-CB 3.45Å; E256-S260 PolarHBondContact O-N 3.39Å; N257-S260 PolarHBondContact O-N 3.06Å; N257-S260 PolarHBondContact O-OG 3.34Å; E258-S260 VanDerWaalsContact C-N 3.3Å; E258-S260 PolarHBondContact O-N 3.2Å; S260-Q262 PolarHBondContact O-N 3.2Å
261	R	75.6	Confident	81.3	Confident	162 Å²	162	102.6 Å²	102.6	61%	0.611	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-7	-170.5	-75.2	168.1	170.4	-177	-5.1	115.2	N257 E258 R259 R263	N257-R261 WeakPolarHBondContact O-CG 3.17Å; E258-R261 PolarHBondContact O-N 2.82Å; E258-R261 WeakPolarHBondContact OE2-CD 3.25Å; E258-R261 IonicContact OE2-NH1 3.14Å; E258-R261 PolarHBondContact OE2-NH1 3.1Å; E258-R261 VanDerWaalsContact OE2-NH1 3.14Å; R259-R261 VanDerWaalsContact C-N 3.25Å; R259-R261 PolarHBondContact O-N 3.1Å; R261-R263 PolarHBondContact O-N 3.3Å
262	Q	59.6	Low	81.2	Confident	184 Å²	184	102.8 Å²	102.8	86%	0.86	48%	0.479	S	S	*	.			trans	48	14.2	170	-70.5	-164.4	-10.2	0	0	118.1	S260	S260-Q262 PolarHBondContact O-N 3.2Å
263	R	56.6	Low	81.1	Confident	223 Å²	223	105.5 Å²	105.5	84%	0.842	49%	0.49	S	S	*	.	S	Bend	trans	-134.3	103.2	-171.8	-71.9	-177.5	170.3	176.7	-2.5	113.2	R261 S265	R261-R263 PolarHBondContact O-N 3.3Å; R263-S265 PolarHBondContact O-N 3.29Å
264	K	55.6	Low	81.1	Confident	216 Å²	216	107.5 Å²	107.5	94%	0.939	50%	0.5	S	S	*	.	S	Bend	trans	71.3	12.3	150.9	-59.1	-173.4	172.8	-174.3	0	120.2
265	S	63.2	Low	81.3	Confident	43 Å²	43	108.5 Å²	108.5	30%	0.301	50%	0.503	S	S	.	.			trans	-122.2	53.1	-175.9	-151.8	0	0	0	0	115.2	R263 Q267 R268 L269	R263-S265 PolarHBondContact O-N 3.29Å; S265-Q267 VanDerWaalsContact C-N 3.35Å; S265-Q267 PolarHBondContact O-N 3.15Å; S265-R268 PolarHBondContact O-N 2.73Å; S265-R268 VanDerWaalsContact OG-CB 3.22Å; S265-R268 WeakPolarHBondContact OG-CB 3.17Å; S265-L269 PolarHBondContact O-N 2.84Å; S265-L269 VanDerWaalsContact O-N 3.16Å
266	N	76.9	Confident	81.5	Confident	116 Å²	116	109.6 Å²	109.6	62%	0.62	51%	0.508	S	S	*	.	H	α-helix	trans	-57	-45	177.9	-79.5	23.3	0	0	0	112.5	R268 L269 E270	N266-R268 PolarHBondContact O-N 3.18Å; N266-L269 WeakPolarHBondContact O-CB 3.46Å; N266-L269 PolarHBondContact O-N 3.36Å; N266-E270 WeakPolarHBondContact O-CG 3.47Å; N266-E270 PolarHBondContact O-N 3.46Å
267	Q	82.6	Confident	81.8	Confident	167 Å²	167	109 Å²	109	78%	0.78	51%	0.505	S	S	*	.	H	α-helix	trans	-57.8	-35.7	179.2	-70.7	178.4	-15.5	0	0	113	S265 A271	S265-Q267 VanDerWaalsContact C-N 3.35Å; S265-Q267 PolarHBondContact O-N 3.15Å; Q267-A271 WeakPolarHBondContact O-CB 3.46Å; Q267-A271 PolarHBondContact O-N 3.36Å
268	R	84.9	Confident	82.1	Confident	118 Å²	118	109.7 Å²	109.7	45%	0.445	51%	0.506	S	S	.	.	H	α-helix	trans	-74.9	-36.4	177.2	-168.1	-177.2	-178.2	-174.2	6.3	111.9	E258 S265 N266 L272	E258-R268 VanDerWaalsContact CD-NH1 3.35Å; E258-R268 VanDerWaalsContact OE1-CD 3.29Å; E258-R268 WeakPolarHBondContact OE1-CD 3.29Å; E258-R268 IonicContact OE1-CZ 2.84Å; E258-R268 IonicContact OE1-NE 2.84Å; E258-R268 IonicContact OE1-NH1 2.79Å; E258-R268 PolarHBondContact OE1-NH1 2.73Å; E258-R268 IonicContact OE2-NH1 2.76Å; S265-R268 PolarHBondContact O-N 2.73Å; S265-R268 VanDerWaalsContact OG-CB 3.22Å; S265-R268 WeakPolarHBondContact OG-CB 3.17Å; N266-R268 PolarHBondContact O-N 3.18Å; R268-L272 HydrophobicContact CG-CD1 4.18Å; R268-L272 WeakPolarHBondContact O-CB 3.47Å; R268-L272 VanDerWaalsContact O-CG 3.27Å; R268-L272 WeakPolarHBondContact O-CG 3.4Å; R268-L272 PolarHBondContact O-N 3.42Å
269	L	85.9	Confident	82.5	Confident	42 Å²	42	110.9 Å²	110.9	22%	0.22	51%	0.509	C	S	.	.	H	α-helix	trans	-65	-42.9	173.8	-80.5	165	0	0	0	111.5	F255 E258 R259 S265 N266 L272 Q273	F255-L269 HydrophobicContact CD2-CD2 3.91Å; F255-L269 HydrophobicContact CE2-CD2 3.88Å; E258-L269 HydrophobicContact CB-CD2 4.2Å; R259-L269 HydrophobicContact CB-CD2 4.09Å; S265-L269 PolarHBondContact O-N 2.84Å; S265-L269 VanDerWaalsContact O-N 3.16Å; N266-L269 WeakPolarHBondContact O-CB 3.46Å; N266-L269 PolarHBondContact O-N 3.36Å; L269-L272 PolarHBondContact O-N 2.92Å; L269-Q273 WeakPolarHBondContact O-CB 3.46Å; L269-Q273 PolarHBondContact O-N 3.06Å
270	E	88.8	Confident	83.1	Confident	122 Å²	122	104.5 Å²	104.5	57%	0.57	49%	0.489	S	S	*	.	H	α-helix	trans	-61.8	-47.8	173.8	-73.4	163.8	-169.9	0	0	111.2	N266 L272 Q273 Q274	N266-E270 WeakPolarHBondContact O-CG 3.47Å; N266-E270 PolarHBondContact O-N 3.46Å; E270-L272 PolarHBondContact O-N 3.26Å; E270-Q273 PolarHBondContact O-N 2.93Å; E270-Q274 WeakPolarHBondContact O-CB 3.44Å; E270-Q274 PolarHBondContact O-N 2.67Å
271	A	91	Very high	83.7	Confident	49 Å²	49	105.5 Å²	105.5	41%	0.405	49%	0.485	S	S	.	.	H	α-helix	trans	-63.5	-36.6	177.1	0	0	0	0	0	113.4	Q267 K275	Q267-A271 WeakPolarHBondContact O-CB 3.46Å; Q267-A271 PolarHBondContact O-N 3.36Å; A271-K275 WeakPolarHBondContact O-CG 3.26Å; A271-K275 PolarHBondContact O-N 2.95Å
272	L	91.6	Very high	84.7	Confident	14 Å²	14	99.3 Å²	99.3	7%	0.073	46%	0.464	C	S	.	.	H	α-helix	trans	-70.6	-38.2	174.1	-75.4	169.6	0	0	0	111.8	V251 Q254 F255 E258 R268 L269 E270 K275 K276	V251-L272 HydrophobicContact CG1-CD2 4.23Å; V251-L272 WeakPolarHBondContact CG1-O 3.47Å; Q254-L272 HydrophobicContact CB-CD1 4.25Å; Q254-L272 HydrophobicContact CB-CD2 4.04Å; F255-L272 HydrophobicContact CB-CB 4.33Å; F255-L272 HydrophobicContact CD2-CB 4.1Å; E258-L272 HydrophobicContact CB-CD1 4.49Å; R268-L272 HydrophobicContact CG-CD1 4.18Å; R268-L272 WeakPolarHBondContact O-CB 3.47Å; R268-L272 VanDerWaalsContact O-CG 3.27Å; R268-L272 WeakPolarHBondContact O-CG 3.4Å; R268-L272 PolarHBondContact O-N 3.42Å; L269-L272 PolarHBondContact O-N 2.92Å; E270-L272 PolarHBondContact O-N 3.26Å; L272-K275 PolarHBondContact O-N 3.17Å; L272-K276 WeakPolarHBondContact O-CB 3.28Å; L272-K276 PolarHBondContact O-N 3.02Å
273	Q	91.9	Very high	86.3	Confident	82 Å²	82	92.5 Å²	92.5	38%	0.383	43%	0.431	S	S	.	.	H	α-helix	trans	-65.6	-41	174.8	-177.2	61.2	31	0	0	111.4	F255 L269 E270 K276 Q277	F255-Q273 HydrophobicContact CD2-CB 4.42Å; F255-Q273 HydrophobicContact CE2-CB 3.96Å; L269-Q273 WeakPolarHBondContact O-CB 3.46Å; L269-Q273 PolarHBondContact O-N 3.06Å; E270-Q273 PolarHBondContact O-N 2.93Å; Q273-K276 WeakPolarHBondContact O-CB 3.27Å; Q273-K276 PolarHBondContact O-N 2.69Å; Q273-Q277 PolarHBondContact O-N 2.81Å
274	Q	93.7	Very high	88.2	Confident	143 Å²	143	86 Å²	86	67%	0.668	41%	0.414	S	S	*	.	H	α-helix	trans	-62.3	-48.1	175.5	-172.6	176.8	10.3	0	0	111.2	E270 K276 Q277 E278	E270-Q274 WeakPolarHBondContact O-CB 3.44Å; E270-Q274 PolarHBondContact O-N 2.67Å; Q274-K276 VanDerWaalsContact C-N 3.3Å; Q274-K276 PolarHBondContact O-N 3.39Å; Q274-Q277 WeakPolarHBondContact O-CB 3.43Å; Q274-Q277 PolarHBondContact O-N 3.44Å; Q274-Q277 VanDerWaalsContact O-N 3.17Å; Q274-E278 WeakPolarHBondContact O-CB 3.46Å; Q274-E278 PolarHBondContact O-N 3.02Å
275	K	93.5	Very high	90.1	Very high	101 Å²	101	78.8 Å²	78.8	44%	0.439	38%	0.383	S	S	.	.	H	α-helix	trans	-62.1	-35.1	174.6	-75.8	-170	173.9	-160.1	0	113.4	V251 A271 L272 Q277 Y279	V251-K275 HydrophobicContact CG1-CB 4.24Å; A271-K275 WeakPolarHBondContact O-CG 3.26Å; A271-K275 PolarHBondContact O-N 2.95Å; L272-K275 PolarHBondContact O-N 3.17Å; K275-Q277 VanDerWaalsContact C-N 3.35Å; K275-Y279 WeakPolarHBondContact O-CB 3.38Å; K275-Y279 PolarHBondContact O-N 3.4Å
276	K	93.1	Very high	91.7	Very high	59 Å²	59	76.7 Å²	76.7	26%	0.257	37%	0.369	S	S	.	.	H	α-helix	trans	-63.8	-43.4	174.7	-175.9	173.9	174.7	155.1	0	110.8	L248 V251 T252 L272 Q273 Q274 T280	L248-K276 HydrophobicContact CD1-CG 3.74Å; L248-K276 WeakPolarHBondContact CD1-O 3.15Å; V251-K276 HydrophobicContact CG1-CB 3.97Å; T252-K276 VanDerWaalsContact OG1-CE 3.28Å; T252-K276 WeakPolarHBondContact OG1-CE 3.49Å; T252-K276 PolarHBondContact OG1-NZ 3.36Å; L272-K276 WeakPolarHBondContact O-CB 3.28Å; L272-K276 PolarHBondContact O-N 3.02Å; Q273-K276 WeakPolarHBondContact O-CB 3.27Å; Q273-K276 PolarHBondContact O-N 2.69Å; Q274-K276 VanDerWaalsContact C-N 3.3Å; Q274-K276 PolarHBondContact O-N 3.39Å; K276-T280 WeakPolarHBondContact O-CB 3.11Å; K276-T280 PolarHBondContact O-N 3.25Å; K276-T280 VanDerWaalsContact O-N 3.09Å; K276-T280 PolarHBondContact O-OG1 2.85Å
277	Q	95.3	Very high	92.7	Very high	89 Å²	89	72.5 Å²	72.5	42%	0.416	35%	0.347	S	S	.	.	H	α-helix	trans	-64.2	-50.3	176.8	-171.3	62.6	28.1	0	0	111	Q273 Q274 K275 Y279 T280 E281	Q273-Q277 PolarHBondContact O-N 2.81Å; Q274-Q277 WeakPolarHBondContact O-CB 3.43Å; Q274-Q277 PolarHBondContact O-N 3.44Å; Q274-Q277 VanDerWaalsContact O-N 3.17Å; K275-Q277 VanDerWaalsContact C-N 3.35Å; Q277-Y279 PolarHBondContact O-N 2.98Å; Q277-T280 WeakPolarHBondContact O-CA 3.48Å; Q277-T280 WeakPolarHBondContact O-CB 3.24Å; Q277-T280 PolarHBondContact O-N 3.28Å; Q277-E281 HydrophobicContact CG-CG 4.5Å; Q277-E281 VanDerWaalsContact CG-OE1 3.32Å; Q277-E281 WeakPolarHBondContact CG-OE1 3.49Å; Q277-E281 PolarHBondContact NE2-OE1 3.29Å; Q277-E281 PolarHBondContact O-N 2.98Å
278	E	93.4	Very high	93.4	Very high	85 Å²	85	69.2 Å²	69.2	40%	0.397	34%	0.335	S	S	.	.	H	α-helix	trans	-53.3	-48.6	176.4	-176.4	-168.3	160.3	0	0	112.2	Q274 T280 E281 N282	Q274-E278 WeakPolarHBondContact O-CB 3.46Å; Q274-E278 PolarHBondContact O-N 3.02Å; E278-T280 VanDerWaalsContact C-N 3.29Å; E278-T280 PolarHBondContact O-N 3.01Å; E278-E281 PolarHBondContact O-N 2.98Å; E278-N282 VanDerWaalsContact O-CB 3.27Å; E278-N282 WeakPolarHBondContact O-CB 3.28Å; E278-N282 PolarHBondContact O-N 3.08Å; E278-N282 PolarHBondContact O-ND2 3.2Å
279	Y	94.5	Very high	94	Very high	54 Å²	54	64.1 Å²	64.1	21%	0.212	32%	0.316	C	S	.	.	H	α-helix	trans	-70.6	-21.9	177.3	-66.8	-15.4	0	0	0	114	L244 V251 K275 Q277 K283	L244-Y279 HydrophobicContact CD2-CD1 4.32Å; V251-Y279 HydrophobicContact CG2-CD2 3.99Å; V251-Y279 HydrophobicContact CG2-CE2 3.7Å; K275-Y279 WeakPolarHBondContact O-CB 3.38Å; K275-Y279 PolarHBondContact O-N 3.4Å; Q277-Y279 PolarHBondContact O-N 2.98Å; Y279-K283 VanDerWaalsContact O-CB 3.28Å; Y279-K283 WeakPolarHBondContact O-CB 3.46Å; Y279-K283 PolarHBondContact O-N 2.93Å
280	T	95.5	Very high	94.5	Very high	39 Å²	39	62.1 Å²	62.1	24%	0.239	31%	0.306	C	S	.	.	H	α-helix	trans	-76.2	-50.4	173.3	-52.8	0	0	0	0	109.8	L248 K276 Q277 E278 N282 K283 D284	L248-T280 WeakPolarHBondContact CD1-OG1 3.36Å; K276-T280 WeakPolarHBondContact O-CB 3.11Å; K276-T280 PolarHBondContact O-N 3.25Å; K276-T280 VanDerWaalsContact O-N 3.09Å; K276-T280 PolarHBondContact O-OG1 2.85Å; Q277-T280 WeakPolarHBondContact O-CA 3.48Å; Q277-T280 WeakPolarHBondContact O-CB 3.24Å; Q277-T280 PolarHBondContact O-N 3.28Å; E278-T280 VanDerWaalsContact C-N 3.29Å; E278-T280 PolarHBondContact O-N 3.01Å; T280-N282 PolarHBondContact O-N 2.86Å; T280-K283 WeakPolarHBondContact O-CB 3.44Å; T280-K283 PolarHBondContact O-N 3.41Å; T280-K283 VanDerWaalsContact O-N 3.09Å; T280-D284 PolarHBondContact O-N 3.35Å
281	E	95.4	Very high	95	Very high	107 Å²	107	59.4 Å²	59.4	50%	0.5	29%	0.293	S	S	.	.	H	α-helix	trans	-59.7	-46.3	177.8	-70	169.8	-178.6	0	0	111.7	Q277 E278 K283 D284 E285	Q277-E281 HydrophobicContact CG-CG 4.5Å; Q277-E281 VanDerWaalsContact CG-OE1 3.32Å; Q277-E281 WeakPolarHBondContact CG-OE1 3.49Å; Q277-E281 PolarHBondContact NE2-OE1 3.29Å; Q277-E281 PolarHBondContact O-N 2.98Å; E278-E281 PolarHBondContact O-N 2.98Å; E281-K283 VanDerWaalsContact C-N 3.29Å; E281-K283 PolarHBondContact O-N 2.92Å; E281-D284 PolarHBondContact O-N 2.92Å; E281-E285 PolarHBondContact O-N 3.08Å
282	N	95.2	Very high	95.3	Very high	32 Å²	32	62.7 Å²	62.7	17%	0.171	30%	0.296	C	S	.	.	H	α-helix	trans	-62	-35.7	175	-71.2	-6.1	0	0	0	112.3	Y199 L244 E278 T280 I286	Y199-N282 HydrophobicContact CD1-CB 4.27Å; Y199-N282 HydrophobicContact CE1-CB 3.57Å; L244-N282 HydrophobicContact CD1-CB 4.18Å; L244-N282 HydrophobicContact CD2-CB 4.24Å; E278-N282 VanDerWaalsContact O-CB 3.27Å; E278-N282 WeakPolarHBondContact O-CB 3.28Å; E278-N282 PolarHBondContact O-N 3.08Å; E278-N282 PolarHBondContact O-ND2 3.2Å; T280-N282 PolarHBondContact O-N 2.86Å; N282-I286 WeakPolarHBondContact O-CG1 3.43Å; N282-I286 PolarHBondContact O-N 3.18Å
283	K	94.9	Very high	95.6	Very high	42 Å²	42	62 Å²	62	18%	0.183	29%	0.292	C	S	.	.	H	α-helix	trans	-68.9	-48.1	176.7	-177.8	-168.8	170	-179.3	0	110.6	L244 D245 Y279 T280 E281 E285 I286 V287 Y324	L244-K283 HydrophobicContact CB-CB 4.25Å; L244-K283 HydrophobicContact CD1-CB 4.29Å; D245-K283 WeakPolarHBondContact OD1-CD 3.47Å; D245-K283 VanDerWaalsContact OD1-CE 3.31Å; D245-K283 WeakPolarHBondContact OD1-CE 3.49Å; D245-K283 IonicContact OD1-NZ 3.76Å; D245-K283 PolarHBondContact OD1-NZ 3.08Å; D245-K283 WeakPolarHBondContact OD2-CE 3.48Å; D245-K283 IonicContact OD2-NZ 2.71Å; D245-K283 PolarHBondContact OD2-NZ 2.93Å; Y279-K283 VanDerWaalsContact O-CB 3.28Å; Y279-K283 WeakPolarHBondContact O-CB 3.46Å; Y279-K283 PolarHBondContact O-N 2.93Å; T280-K283 WeakPolarHBondContact O-CB 3.44Å; T280-K283 PolarHBondContact O-N 3.41Å; T280-K283 VanDerWaalsContact O-N 3.09Å; E281-K283 VanDerWaalsContact C-N 3.29Å; E281-K283 PolarHBondContact O-N 2.92Å; K283-E285 VanDerWaalsContact C-N 3.26Å; K283-E285 PolarHBondContact O-N 3.34Å; K283-I286 PolarHBondContact O-N 3.11Å; K283-V287 HydrophobicContact CG-CG2 4.26Å; K283-V287 WeakPolarHBondContact O-CG2 3.22Å; K283-V287 PolarHBondContact O-N 3.08Å; K283-Y324 VanDerWaalsContact CE-OH 3.24Å; K283-Y324 WeakPolarHBondContact CE-OH 3.28Å; K283-Y324 PolarHBondContact NZ-OH 3.18Å
284	D	96.1	Very high	95.9	Very high	87 Å²	87	58.5 Å²	58.5	47%	0.465	28%	0.276	S	S	.	.	H	α-helix	trans	-58.9	-41	-178.8	-70	-18.6	0	0	0	110.4	T280 E281 V287 N288	T280-D284 PolarHBondContact O-N 3.35Å; E281-D284 PolarHBondContact O-N 2.92Å; D284-V287 PolarHBondContact O-N 2.86Å; D284-N288 WeakPolarHBondContact O-CB 3.47Å; D284-N288 PolarHBondContact O-N 3.13Å; D284-N288 PolarHBondContact O-ND2 3.21Å
285	E	95.7	Very high	96	Very high	63 Å²	63	57 Å²	57	29%	0.294	27%	0.268	S	S	.	.	H	α-helix	trans	-65.2	-42.9	176.5	-165.8	66.3	175.5	0	0	113.3	E281 K283 V287 N288 M289	E281-E285 PolarHBondContact O-N 3.08Å; K283-E285 VanDerWaalsContact C-N 3.26Å; K283-E285 PolarHBondContact O-N 3.34Å; E285-V287 VanDerWaalsContact C-N 3.33Å; E285-V287 PolarHBondContact O-N 3.16Å; E285-N288 WeakPolarHBondContact O-CB 3.42Å; E285-N288 PolarHBondContact O-N 3.16Å; E285-M289 HydrophobicContact CG-CE 3.85Å; E285-M289 WeakPolarHBondContact O-CG 3.4Å; E285-M289 PolarHBondContact O-N 3.05Å
286	I	96.8	Very high	96.2	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.8	-39.7	174.8	-66.3	-73.4	0	0	0	111	I198 Y199 L237 I240 A241 L244 N282 K283 M289 I290	I198-I286 HydrophobicContact CD1-CD1 3.69Å; I198-I286 HydrophobicContact CG1-CD1 4.15Å; I198-I286 HydrophobicContact CG2-CD1 4.3Å; Y199-I286 HydrophobicContact CE1-CD1 4.06Å; Y199-I286 HydrophobicContact CE1-CG1 3.87Å; L237-I286 HydrophobicContact CB-CG2 4.13Å; L237-I286 HydrophobicContact CD2-CD1 3.6Å; L237-I286 HydrophobicContact CD2-CG2 4.14Å; L237-I286 VanDerWaalsContact O-CG2 3.3Å; L237-I286 WeakPolarHBondContact O-CG2 3.15Å; I240-I286 HydrophobicContact CB-CG2 4.49Å; I240-I286 HydrophobicContact CG2-CD1 3.98Å; I240-I286 HydrophobicContact CG2-CG1 4.05Å; I240-I286 HydrophobicContact CG2-CG2 4.48Å; A241-I286 HydrophobicContact CB-CG2 3.97Å; L244-I286 HydrophobicContact CD1-CG1 4.09Å; N282-I286 WeakPolarHBondContact O-CG1 3.43Å; N282-I286 PolarHBondContact O-N 3.18Å; K283-I286 PolarHBondContact O-N 3.11Å; I286-M289 HydrophobicContact CD1-CE 4.11Å; I286-M289 PolarHBondContact O-N 3.06Å; I286-I290 HydrophobicContact CG2-CD1 4.04Å; I286-I290 VanDerWaalsContact O-CG1 3.28Å; I286-I290 WeakPolarHBondContact O-CG1 3.39Å; I286-I290 PolarHBondContact O-N 3.06Å
287	V	96.7	Very high	96.4	Very high	27 Å²	27	51.3 Å²	51.3	16%	0.164	25%	0.249	C	C	.	.	H	α-helix	trans	-68	-36.8	176.3	173.3	0	0	0	0	111.4	K283 D284 E285 I290 E291	K283-V287 HydrophobicContact CG-CG2 4.26Å; K283-V287 WeakPolarHBondContact O-CG2 3.22Å; K283-V287 PolarHBondContact O-N 3.08Å; D284-V287 PolarHBondContact O-N 2.86Å; E285-V287 VanDerWaalsContact C-N 3.33Å; E285-V287 PolarHBondContact O-N 3.16Å; V287-I290 PolarHBondContact O-N 3.05Å; V287-E291 HydrophobicContact CG1-CG 4.4Å; V287-E291 PolarHBondContact O-N 3.4Å
288	N	97.2	Very high	96.6	Very high	98 Å²	98	47.1 Å²	47.1	52%	0.524	23%	0.229	S	C	.	.	H	α-helix	trans	-60.3	-46.7	173.1	-69.6	-28	0	0	0	111.4	D284 E285 I290 E291 Y292	D284-N288 WeakPolarHBondContact O-CB 3.47Å; D284-N288 PolarHBondContact O-N 3.13Å; D284-N288 PolarHBondContact O-ND2 3.21Å; E285-N288 WeakPolarHBondContact O-CB 3.42Å; E285-N288 PolarHBondContact O-N 3.16Å; N288-I290 VanDerWaalsContact C-N 3.33Å; N288-I290 PolarHBondContact O-N 2.67Å; N288-E291 PolarHBondContact O-N 2.74Å; N288-Y292 VanDerWaalsContact O-CB 3.3Å; N288-Y292 WeakPolarHBondContact O-CB 3.3Å; N288-Y292 PolarHBondContact O-N 2.98Å
289	M	97.4	Very high	96.8	Very high	12 Å²	12	44 Å²	44	6%	0.059	22%	0.216	C	C	.	.	H	α-helix	trans	-60.3	-41.1	174.6	-67.4	-178.6	-130.3	0	0	112.3	I198 M204 I208 L237 E285 I286 L293	I198-M289 HydrophobicContact CG1-CE 4.41Å; I198-M289 WeakPolarHBondContact O-CE 3.17Å; M204-M289 HydrophobicContact CB-SD 3.95Å; M204-M289 HydrophobicContact CE-SD 3.79Å; M204-M289 HydrophobicContact CG-SD 3.95Å; I208-M289 HydrophobicContact CD1-CB 4.18Å; I208-M289 HydrophobicContact CD1-CG 4.05Å; I208-M289 HydrophobicContact CD1-SD 4.36Å; L237-M289 HydrophobicContact CD1-CB 3.87Å; L237-M289 HydrophobicContact CD2-SD 3.97Å; E285-M289 HydrophobicContact CG-CE 3.85Å; E285-M289 WeakPolarHBondContact O-CG 3.4Å; E285-M289 PolarHBondContact O-N 3.05Å; I286-M289 HydrophobicContact CD1-CE 4.11Å; I286-M289 PolarHBondContact O-N 3.06Å; M289-L293 WeakPolarHBondContact O-CB 3.3Å; M289-L293 WeakPolarHBondContact O-CG 3.5Å; M289-L293 PolarHBondContact O-N 3.19Å
290	I	97.7	Very high	96.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.3	-53.4	177.5	-72.5	166.2	0	0	0	111.1	V234 L237 A238 A241 I286 V287 N288 Y292 L293 F294 F328	V234-I290 HydrophobicContact CG1-CG2 4.16Å; L237-I290 HydrophobicContact CB-CD1 3.9Å; L237-I290 HydrophobicContact CB-CG1 3.59Å; L237-I290 HydrophobicContact CD1-CG1 4.23Å; A238-I290 HydrophobicContact CB-CD1 4.35Å; A241-I290 HydrophobicContact CB-CD1 4.39Å; I286-I290 HydrophobicContact CG2-CD1 4.04Å; I286-I290 VanDerWaalsContact O-CG1 3.28Å; I286-I290 WeakPolarHBondContact O-CG1 3.39Å; I286-I290 PolarHBondContact O-N 3.06Å; V287-I290 PolarHBondContact O-N 3.05Å; N288-I290 VanDerWaalsContact C-N 3.33Å; N288-I290 PolarHBondContact O-N 2.67Å; I290-Y292 VanDerWaalsContact C-N 3.31Å; I290-Y292 PolarHBondContact O-N 3.44Å; I290-L293 PolarHBondContact O-N 2.92Å; I290-F294 VanDerWaalsContact O-CB 3.26Å; I290-F294 WeakPolarHBondContact O-CB 3.27Å; I290-F294 PolarHBondContact O-N 3.31Å; I290-F328 HydrophobicContact CG2-CE2 4.27Å; I290-F328 HydrophobicContact CG2-CZ 3.61Å
291	E	97.7	Very high	97	Very high	65 Å²	65	44.5 Å²	44.5	30%	0.304	22%	0.216	S	C	.	.	H	α-helix	trans	-66.7	-33.4	-178.1	-70.6	-85.9	-150.4	0	0	111.3	V287 N288 F294 Q295 H327 R333	V287-E291 HydrophobicContact CG1-CG 4.4Å; V287-E291 PolarHBondContact O-N 3.4Å; N288-E291 PolarHBondContact O-N 2.74Å; E291-F294 PolarHBondContact O-N 3.03Å; E291-Q295 VanDerWaalsContact O-CB 3.26Å; E291-Q295 WeakPolarHBondContact O-CB 3.47Å; E291-Q295 PolarHBondContact O-N 3.09Å; E291-H327 IonicContact OE1-CE1 3.74Å; E291-H327 PolarHBondContact OE1-CE1 3.42Å; E291-H327 IonicContact OE1-NE2 3.66Å; E291-H327 PolarHBondContact OE1-NE2 3.3Å; E291-R333 IonicContact OE1-CZ 3.75Å; E291-R333 IonicContact OE1-NH2 2.78Å; E291-R333 PolarHBondContact OE1-NH2 3.23Å; E291-R333 IonicContact OE2-NH2 2.71Å; E291-R333 PolarHBondContact OE2-NH2 3.06Å
292	Y	97.6	Very high	97	Very high	117 Å²	117	41.1 Å²	41.1	46%	0.459	20%	0.199	S	C	.	.	H	α-helix	trans	-63.4	-53.2	172.7	-173.2	-87.4	0	0	0	111.9	I208 N288 I290 F294 Q295 C296	I208-Y292 HydrophobicContact CG2-CD1 3.59Å; I208-Y292 HydrophobicContact CG2-CE1 3.59Å; N288-Y292 VanDerWaalsContact O-CB 3.3Å; N288-Y292 WeakPolarHBondContact O-CB 3.3Å; N288-Y292 PolarHBondContact O-N 2.98Å; I290-Y292 VanDerWaalsContact C-N 3.31Å; I290-Y292 PolarHBondContact O-N 3.44Å; Y292-F294 VanDerWaalsContact C-N 3.26Å; Y292-F294 PolarHBondContact O-N 3.34Å; Y292-Q295 PolarHBondContact O-N 3.48Å; Y292-C296 HydrophobicContact CD1-CB 4.41Å; Y292-C296 HydrophobicContact CE1-CB 4.12Å; Y292-C296 VanDerWaalsContact CZ-SG 3.6Å; Y292-C296 VanDerWaalsContact O-CB 3.26Å; Y292-C296 WeakPolarHBondContact O-CB 3.38Å; Y292-C296 PolarHBondContact O-N 3.22Å; Y292-C296 PolarHBondContact O-SG 3.26Å
293	L	97.8	Very high	97.1	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.7	-35.1	176.8	-76.7	172.4	0	0	0	112.1	I208 A230 M233 V234 L237 M289 I290 V297 F298	I208-L293 HydrophobicContact CB-CD2 4.46Å; I208-L293 HydrophobicContact CD1-CD1 4.3Å; I208-L293 HydrophobicContact CD1-CG 4.42Å; I208-L293 HydrophobicContact CG1-CD1 4.2Å; I208-L293 HydrophobicContact CG1-CD2 4.14Å; I208-L293 HydrophobicContact CG1-CG 4.27Å; I208-L293 HydrophobicContact CG2-CD2 3.95Å; I208-L293 HydrophobicContact CG2-CG 4.38Å; A230-L293 HydrophobicContact CB-CD2 4.2Å; M233-L293 HydrophobicContact CB-CD1 4.35Å; M233-L293 HydrophobicContact CG-CD1 3.93Å; M233-L293 HydrophobicContact SD-CD1 4.01Å; V234-L293 HydrophobicContact CG2-CB 3.51Å; V234-L293 HydrophobicContact CG2-CD1 3.75Å; V234-L293 HydrophobicContact CG2-CG 4.28Å; L237-L293 HydrophobicContact CD1-CD1 4.05Å; M289-L293 WeakPolarHBondContact O-CB 3.3Å; M289-L293 WeakPolarHBondContact O-CG 3.5Å; M289-L293 PolarHBondContact O-N 3.19Å; I290-L293 PolarHBondContact O-N 2.92Å; L293-V297 HydrophobicContact CD2-CG2 4.28Å; L293-V297 WeakPolarHBondContact O-CA 3.5Å; L293-V297 WeakPolarHBondContact O-CB 3.47Å; L293-V297 PolarHBondContact O-N 3Å; L293-F298 PolarHBondContact O-N 3.01Å
294	F	97.9	Very high	97.3	Very high	8 Å²	8	43.2 Å²	43.2	4%	0.035	21%	0.207	C	C	.	.	I	π-helix	trans	-63.6	-50.4	174.7	-170.6	-92.7	0	0	0	111.4	I290 E291 Y292 F298 V299 L317 W320 F328 R333 Y336	I290-F294 VanDerWaalsContact O-CB 3.26Å; I290-F294 WeakPolarHBondContact O-CB 3.27Å; I290-F294 PolarHBondContact O-N 3.31Å; E291-F294 PolarHBondContact O-N 3.03Å; Y292-F294 VanDerWaalsContact C-N 3.26Å; Y292-F294 PolarHBondContact O-N 3.34Å; F294-F298 HydrophobicContact CD2-CB 4.07Å; F294-F298 AromaticContact CD2-CD1 3.89Å; F294-F298 HydrophobicContact CD2-CD1 3.89Å; F294-F298 AromaticContact CD2-CG 3.98Å; F294-F298 HydrophobicContact CD2-CG 3.98Å; F294-F298 HydrophobicContact CE1-CD1 4.1Å; F294-F298 HydrophobicContact CE2-CB 4.41Å; F294-F298 AromaticContact CE2-CD1 3.39Å; F294-F298 HydrophobicContact CE2-CD1 3.39Å; F294-F298 HydrophobicContact CE2-CD2 4.46Å; F294-F298 AromaticContact CE2-CE1 3.75Å; F294-F298 HydrophobicContact CE2-CE1 3.75Å; F294-F298 AromaticContact CE2-CG 3.83Å; F294-F298 HydrophobicContact CE2-CG 3.83Å; F294-F298 HydrophobicContact CE2-CZ 4.43Å; F294-F298 HydrophobicContact CG-CB 4.42Å; F294-F298 HydrophobicContact CG-CD1 4.42Å; F294-F298 AromaticContact CZ-CD1 3.5Å; F294-F298 HydrophobicContact CZ-CD1 3.5Å; F294-F298 AromaticContact CZ-CE1 3.68Å; F294-F298 HydrophobicContact CZ-CE1 3.68Å; F294-F298 HydrophobicContact CZ-CG 4.39Å; F294-F298 WeakPolarHBondContact O-CA 3.32Å; F294-F298 WeakPolarHBondContact O-CB 3.35Å; F294-F298 PolarHBondContact O-N 3.26Å; F294-F298 VanDerWaalsContact O-N 3.17Å; F294-V299 HydrophobicContact CD1-CG2 3.99Å; F294-V299 HydrophobicContact CE1-CG2 3.82Å; F294-V299 WeakPolarHBondContact O-CG2 3.36Å; F294-V299 PolarHBondContact O-N 3.28Å; F294-L317 HydrophobicContact CE2-CD1 4.23Å; F294-W320 HydrophobicContact CD2-CE3 4.46Å; F294-W320 AromaticContact CD2-CZ3 3.8Å; F294-W320 HydrophobicContact CD2-CZ3 3.8Å; F294-W320 AromaticContact CE2-CZ3 3.99Å; F294-W320 HydrophobicContact CE2-CZ3 3.99Å; F294-F328 HydrophobicContact CD2-CE1 4.16Å; F294-F328 HydrophobicContact CE2-CE1 4.37Å; F294-R333 HydrophobicContact CE1-CG 4.37Å; F294-R333 HydrophobicContact CE2-CG 4.31Å; F294-R333 HydrophobicContact CZ-CG 3.78Å; F294-Y336 AromaticContact CE1-CE2 3.87Å; F294-Y336 HydrophobicContact CE1-CE2 3.87Å; F294-Y336 HydrophobicContact CZ-CD2 4.02Å; F294-Y336 AromaticContact CZ-CE2 3.6Å; F294-Y336 HydrophobicContact CZ-CE2 3.6Å
295	Q	97.3	Very high	97.3	Very high	111 Å²	111	45 Å²	45	52%	0.519	22%	0.22	S	C	.	.	I	π-helix	trans	-72.3	-39.4	-176.7	-177.2	61.3	12.7	0	0	113	E291 Y292	E291-Q295 VanDerWaalsContact O-CB 3.26Å; E291-Q295 WeakPolarHBondContact O-CB 3.47Å; E291-Q295 PolarHBondContact O-N 3.09Å; Y292-Q295 PolarHBondContact O-N 3.48Å
296	C	97	Very high	97.2	Very high	42 Å²	42	42.7 Å²	42.7	28%	0.284	21%	0.21	S	C	.	.	I	π-helix	trans	-83.7	-38.8	-176.1	-66.7	0	0	0	0	112.9	T212 Y292	T212-C296 HydrophobicContact CG2-CB 3.9Å; Y292-C296 HydrophobicContact CD1-CB 4.41Å; Y292-C296 HydrophobicContact CE1-CB 4.12Å; Y292-C296 VanDerWaalsContact CZ-SG 3.6Å; Y292-C296 VanDerWaalsContact O-CB 3.26Å; Y292-C296 WeakPolarHBondContact O-CB 3.38Å; Y292-C296 PolarHBondContact O-N 3.22Å; Y292-C296 PolarHBondContact O-SG 3.26Å
297	V	98	Very high	97.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.222	C	C	.	.	I	π-helix	trans	-103.2	-61.6	-178.3	-173.5	0	0	0	0	111.8	A215 T227 A230 M231 L293 V299 Q300 R301	A215-V297 HydrophobicContact CB-CG1 3.88Å; A215-V297 HydrophobicContact CB-CG2 4.24Å; T227-V297 HydrophobicContact CG2-CG1 4.39Å; A230-V297 HydrophobicContact CB-CB 4.26Å; A230-V297 HydrophobicContact CB-CG1 3.93Å; A230-V297 HydrophobicContact CB-CG2 4.12Å; M231-V297 HydrophobicContact CE-CB 4.11Å; M231-V297 HydrophobicContact CE-CG1 3.71Å; L293-V297 HydrophobicContact CD2-CG2 4.28Å; L293-V297 WeakPolarHBondContact O-CA 3.5Å; L293-V297 WeakPolarHBondContact O-CB 3.47Å; L293-V297 PolarHBondContact O-N 3Å; V297-V299 PolarHBondContact O-N 3.2Å; V297-Q300 PolarHBondContact O-N 3.48Å; V297-R301 HydrophobicContact CG1-CG 4.17Å; V297-R301 WeakPolarHBondContact O-CB 3.49Å; V297-R301 WeakPolarHBondContact O-CG 3.3Å; V297-R301 PolarHBondContact O-N 3.44Å
298	F	98.3	Very high	97.2	Very high	1 Å²	1	45.3 Å²	45.3	0%	0.004	23%	0.226	C	C	.	.	I	π-helix	trans	-59.7	-49.1	-171.5	172.7	-83.7	0	0	0	112.4	M231 L293 F294 Q300 R301 Y302 C313 L317 W320 Y336	M231-F298 HydrophobicContact CE-CB 4.14Å; M231-F298 HydrophobicContact SD-CB 4.14Å; M231-F298 HydrophobicContact SD-CD2 3.91Å; L293-F298 PolarHBondContact O-N 3.01Å; F294-F298 HydrophobicContact CD2-CB 4.07Å; F294-F298 AromaticContact CD2-CD1 3.89Å; F294-F298 HydrophobicContact CD2-CD1 3.89Å; F294-F298 AromaticContact CD2-CG 3.98Å; F294-F298 HydrophobicContact CD2-CG 3.98Å; F294-F298 HydrophobicContact CE1-CD1 4.1Å; F294-F298 HydrophobicContact CE2-CB 4.41Å; F294-F298 AromaticContact CE2-CD1 3.39Å; F294-F298 HydrophobicContact CE2-CD1 3.39Å; F294-F298 HydrophobicContact CE2-CD2 4.46Å; F294-F298 AromaticContact CE2-CE1 3.75Å; F294-F298 HydrophobicContact CE2-CE1 3.75Å; F294-F298 AromaticContact CE2-CG 3.83Å; F294-F298 HydrophobicContact CE2-CG 3.83Å; F294-F298 HydrophobicContact CE2-CZ 4.43Å; F294-F298 HydrophobicContact CG-CB 4.42Å; F294-F298 HydrophobicContact CG-CD1 4.42Å; F294-F298 AromaticContact CZ-CD1 3.5Å; F294-F298 HydrophobicContact CZ-CD1 3.5Å; F294-F298 AromaticContact CZ-CE1 3.68Å; F294-F298 HydrophobicContact CZ-CE1 3.68Å; F294-F298 HydrophobicContact CZ-CG 4.39Å; F294-F298 WeakPolarHBondContact O-CA 3.32Å; F294-F298 WeakPolarHBondContact O-CB 3.35Å; F294-F298 PolarHBondContact O-N 3.26Å; F294-F298 VanDerWaalsContact O-N 3.17Å; F298-Q300 PolarHBondContact O-N 3.04Å; F298-Q300 VanDerWaalsContact O-N 3.16Å; F298-R301 PolarHBondContact O-N 3.21Å; F298-R301 VanDerWaalsContact O-N 3.12Å; F298-Y302 HydrophobicContact CE1-CD1 4.43Å; F298-Y302 HydrophobicContact CE1-CG 4.38Å; F298-Y302 HydrophobicContact CZ-CG 4.42Å; F298-Y302 WeakPolarHBondContact O-CD1 3.27Å; F298-Y302 PolarHBondContact O-N 3.03Å; F298-C313 HydrophobicContact CD2-CB 3.86Å; F298-C313 HydrophobicContact CE2-CB 3.71Å; F298-C313 WeakPolarHBondContact CE2-O 3.47Å; F298-L317 HydrophobicContact CE1-CD2 4.46Å; F298-L317 HydrophobicContact CE2-CB 3.91Å; F298-L317 HydrophobicContact CE2-CD2 4.14Å; F298-L317 HydrophobicContact CZ-CB 4.29Å; F298-L317 HydrophobicContact CZ-CD2 3.64Å; F298-L317 HydrophobicContact CZ-CG 4.42Å; F298-W320 HydrophobicContact CD2-CH2 4.09Å; F298-W320 AromaticContact CD2-CZ3 3.98Å; F298-W320 HydrophobicContact CD2-CZ3 3.98Å; F298-W320 HydrophobicContact CE2-CZ3 4.48Å; F298-W320 HydrophobicContact CG-CZ3 4.39Å; F298-Y336 HydrophobicContact CE1-CD1 4.28Å; F298-Y336 AromaticContact CE1-CD2 3.68Å; F298-Y336 HydrophobicContact CE1-CD2 3.68Å; F298-Y336 HydrophobicContact CE1-CE2 4.09Å; F298-Y336 AromaticContact CE1-CG 3.81Å; F298-Y336 HydrophobicContact CE1-CG 3.81Å; F298-Y336 HydrophobicContact CZ-CD2 4.3Å; F298-Y336 HydrophobicContact CZ-CG 4.22Å
299	V	97.5	Very high	97.2	Very high	19 Å²	19	40.7 Å²	40.7	12%	0.115	20%	0.201	C	C	.	.	H	α-helix	trans	-63.7	-22.1	-177.5	171.7	0	0	0	0	112.9	F294 V297 Y302 K303	F294-V299 HydrophobicContact CD1-CG2 3.99Å; F294-V299 HydrophobicContact CE1-CG2 3.82Å; F294-V299 WeakPolarHBondContact O-CG2 3.36Å; F294-V299 PolarHBondContact O-N 3.28Å; V297-V299 PolarHBondContact O-N 3.2Å; V299-Y302 WeakPolarHBondContact O-CD1 3.24Å; V299-Y302 VanDerWaalsContact O-CE1 3.26Å; V299-Y302 WeakPolarHBondContact O-CE1 3.21Å; V299-K303 VanDerWaalsContact O-CE 3.3Å; V299-K303 WeakPolarHBondContact O-CE 3.32Å; V299-K303 PolarHBondContact O-NZ 2.64Å
300	Q	96.3	Very high	97.3	Very high	71 Å²	71	41.2 Å²	41.2	33%	0.332	20%	0.202	S	C	.	.	H	α-helix	trans	-88.8	-37.4	172.5	-53.6	-52	-14.8	0	0	112.9	V297 F298 K303	V297-Q300 PolarHBondContact O-N 3.48Å; F298-Q300 PolarHBondContact O-N 3.04Å; F298-Q300 VanDerWaalsContact O-N 3.16Å; Q300-K303 WeakPolarHBondContact O-CE 3.3Å; Q300-K303 VanDerWaalsContact O-CG 3.25Å; Q300-K303 WeakPolarHBondContact O-CG 3.45Å
301	R	97.5	Very high	97.3	Very high	33 Å²	33	41.5 Å²	41.5	13%	0.125	20%	0.204	C	C	.	.	H	α-helix	trans	-94.7	-18.3	-168.7	-59.3	-61.4	127.1	-157	6.9	115.3	A215 D216 T227 V297 F298 K303 D304 I309 C313	A215-R301 VanDerWaalsContact O-CD 3.29Å; A215-R301 WeakPolarHBondContact O-CD 3.4Å; A215-R301 PolarHBondContact O-NE 3.25Å; D216-R301 IonicContact OD1-CZ 3.93Å; D216-R301 IonicContact OD1-NH2 2.86Å; D216-R301 PolarHBondContact OD1-NH2 3.2Å; T227-R301 HydrophobicContact CG2-CB 3.95Å; T227-R301 HydrophobicContact CG2-CG 4.43Å; T227-R301 WeakPolarHBondContact OG1-CG 3.33Å; V297-R301 HydrophobicContact CG1-CG 4.17Å; V297-R301 WeakPolarHBondContact O-CB 3.49Å; V297-R301 WeakPolarHBondContact O-CG 3.3Å; V297-R301 PolarHBondContact O-N 3.44Å; F298-R301 PolarHBondContact O-N 3.21Å; F298-R301 VanDerWaalsContact O-N 3.12Å; R301-K303 PolarHBondContact O-N 2.76Å; R301-D304 IonicContact CZ-OD2 3.95Å; R301-D304 IonicContact NH1-OD2 2.78Å; R301-D304 PolarHBondContact NH1-OD2 3.15Å; R301-D304 WeakPolarHBondContact O-CB 3.28Å; R301-D304 PolarHBondContact O-N 3.46Å; R301-I309 HydrophobicContact CB-CG2 3.87Å; R301-C313 VanDerWaalsContact C-SG 3.58Å
302	Y	97.4	Very high	97.3	Very high	36 Å²	36	38.9 Å²	38.9	14%	0.141	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-21	173.1	89.6	-84.6	0	0	0	113.3	F298 V299 R310 Y336	F298-Y302 HydrophobicContact CE1-CD1 4.43Å; F298-Y302 HydrophobicContact CE1-CG 4.38Å; F298-Y302 HydrophobicContact CZ-CG 4.42Å; F298-Y302 WeakPolarHBondContact O-CD1 3.27Å; F298-Y302 PolarHBondContact O-N 3.03Å; V299-Y302 WeakPolarHBondContact O-CD1 3.24Å; V299-Y302 VanDerWaalsContact O-CE1 3.26Å; V299-Y302 WeakPolarHBondContact O-CE1 3.21Å; Y302-R310 VanDerWaalsContact O-CD 3.3Å; Y302-R310 WeakPolarHBondContact O-CD 3.28Å; Y302-R310 VanDerWaalsContact O-CG 3.27Å; Y302-R310 WeakPolarHBondContact O-CG 3.46Å; Y302-Y336 HydrophobicContact CD1-CD1 4.21Å; Y302-Y336 HydrophobicContact CD1-CE1 4.46Å; Y302-Y336 HydrophobicContact CD2-CD1 4.2Å; Y302-Y336 AromaticContact CE1-CD1 3.83Å; Y302-Y336 HydrophobicContact CE1-CD1 3.83Å; Y302-Y336 AromaticContact CE1-CE1 3.88Å; Y302-Y336 HydrophobicContact CE1-CE1 3.88Å; Y302-Y336 AromaticContact CE2-CD1 3.84Å; Y302-Y336 HydrophobicContact CE2-CD1 3.84Å; Y302-Y336 HydrophobicContact CG-CD1 4.38Å; Y302-Y336 AromaticContact CZ-CD1 3.64Å; Y302-Y336 AromaticContact CZ-CE1 3.97Å
303	K	96.8	Very high	97.4	Very high	112 Å²	112	33.3 Å²	33.3	49%	0.487	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	16.3	179.5	62.8	-178.5	180	-166.9	0	113	V299 Q300 R301	V299-K303 VanDerWaalsContact O-CE 3.3Å; V299-K303 WeakPolarHBondContact O-CE 3.32Å; V299-K303 PolarHBondContact O-NZ 2.64Å; Q300-K303 WeakPolarHBondContact O-CE 3.3Å; Q300-K303 VanDerWaalsContact O-CG 3.25Å; Q300-K303 WeakPolarHBondContact O-CG 3.45Å; R301-K303 PolarHBondContact O-N 2.76Å
304	D	97.8	Very high	97.4	Very high	6 Å²	6	33.5 Å²	33.5	3%	0.032	17%	0.171	C	C	.	.			trans	-57.9	152.6	178.8	-162.4	-72	0	0	0	111.4	R223 R301 V306 I309 R310	R223-D304 WeakPolarHBondContact CD-OD2 3.43Å; R223-D304 IonicContact CZ-OD2 3.68Å; R223-D304 IonicContact NE-OD1 2.9Å; R223-D304 IonicContact NE-OD2 3.06Å; R223-D304 PolarHBondContact NE-OD2 3.1Å; R223-D304 IonicContact NH2-OD1 3.17Å; R223-D304 PolarHBondContact NH2-OD1 2.71Å; R223-D304 IonicContact NH2-OD2 3Å; R301-D304 IonicContact CZ-OD2 3.95Å; R301-D304 IonicContact NH1-OD2 2.78Å; R301-D304 PolarHBondContact NH1-OD2 3.15Å; R301-D304 WeakPolarHBondContact O-CB 3.28Å; R301-D304 PolarHBondContact O-N 3.46Å; D304-V306 PolarHBondContact O-N 2.93Å; D304-V306 PolarHBondContact OD1-N 3.49Å; D304-I309 HydrophobicContact CB-CB 4Å; D304-I309 HydrophobicContact CB-CG2 3.78Å; D304-R310 WeakPolarHBondContact O-CD 3.14Å; D304-R310 VanDerWaalsContact O-CG 3.32Å; D304-R310 WeakPolarHBondContact O-CG 3.46Å; D304-R310 PolarHBondContact O-NH1 2.9Å
305	V	96.1	Very high	97.4	Very high	123 Å²	123	35.2 Å²	35.2	75%	0.745	18%	0.182	S	C	*	.	S	Bend	trans	-62.2	-30.8	175.8	-62.3	0	0	0	0	112.2	P307 R310	V305-P307 WeakPolarHBondContact O-CD 3.45Å; V305-R310 PolarHBondContact O-NH1 3.06Å
306	V	94.8	Very high	97.4	Very high	15 Å²	15	30.6 Å²	30.6	9%	0.091	16%	0.161	C	C	.	.	S	Bend	trans	-80.1	119.8	179.9	-177.8	0	0	0	0	111	R220 D304 D308 I309 R310	R220-V306 HydrophobicContact CG-CG2 4.13Å; D304-V306 PolarHBondContact O-N 2.93Å; D304-V306 PolarHBondContact OD1-N 3.49Å; V306-D308 VanDerWaalsContact C-N 3.34Å; V306-D308 HydrophobicContact CG1-CB 4.18Å; V306-D308 PolarHBondContact O-N 3.22Å; V306-I309 HydrophobicContact CB-CB 4.39Å; V306-I309 HydrophobicContact CB-CD1 3.92Å; V306-I309 HydrophobicContact CB-CG1 3.95Å; V306-I309 HydrophobicContact CG1-CD1 4.33Å; V306-I309 HydrophobicContact CG1-CG1 4.01Å; V306-I309 HydrophobicContact CG2-CD1 4.28Å; V306-I309 PolarHBondContact O-N 3.35Å; V306-R310 PolarHBondContact O-N 2.84Å
307	P	97.2	Very high	97.4	Very high	36 Å²	36	28.7 Å²	28.7	23%	0.234	15%	0.148	C	C	.	.	H	α-helix	trans	-58.9	-39.5	-178.6	-25.5	36.2	0	0	0	113.9	V305 I309 R310 C311 V345 V348	V305-P307 WeakPolarHBondContact O-CD 3.45Å; P307-I309 PolarHBondContact O-N 2.94Å; P307-R310 WeakPolarHBondContact O-CB 3.09Å; P307-R310 PolarHBondContact O-N 3.47Å; P307-R310 VanDerWaalsContact O-N 3.09Å; P307-C311 PolarHBondContact O-N 3.04Å; P307-V345 HydrophobicContact CB-CB 4.42Å; P307-V345 HydrophobicContact CB-CG1 4.1Å; P307-V345 HydrophobicContact CB-CG2 4.32Å; P307-V345 HydrophobicContact CG-CG1 4.37Å; P307-V345 HydrophobicContact CG-CG2 3.89Å; P307-V348 HydrophobicContact CB-CG2 3.88Å
308	D	96	Very high	97.4	Very high	47 Å²	47	28.9 Å²	28.9	25%	0.251	15%	0.15	S	C	.	.	H	α-helix	trans	-57.5	-38.3	-179.9	-41.9	-31.3	0	0	0	112.4	R220 V306 C311 I312	R220-D308 IonicContact CZ-OD2 3.64Å; R220-D308 IonicContact NH2-OD2 2.66Å; R220-D308 PolarHBondContact NH2-OD2 2.96Å; V306-D308 VanDerWaalsContact C-N 3.34Å; V306-D308 HydrophobicContact CG1-CB 4.18Å; V306-D308 PolarHBondContact O-N 3.22Å; D308-C311 WeakPolarHBondContact O-CB 3.46Å; D308-C311 PolarHBondContact O-N 3.48Å; D308-I312 VanDerWaalsContact O-CG1 3.3Å; D308-I312 WeakPolarHBondContact O-CG1 3.36Å; D308-I312 PolarHBondContact O-N 3.21Å
309	I	98	Very high	97.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-69	-42.2	179.1	-59.9	-175.6	0	0	0	109.8	R223 H224 T227 R301 D304 V306 P307 I312 C313	R223-I309 HydrophobicContact CB-CD1 3.84Å; H224-I309 HydrophobicContact CB-CD1 3.99Å; H224-I309 HydrophobicContact CB-CG1 4.02Å; T227-I309 HydrophobicContact CG2-CG2 4Å; R301-I309 HydrophobicContact CB-CG2 3.87Å; D304-I309 HydrophobicContact CB-CB 4Å; D304-I309 HydrophobicContact CB-CG2 3.78Å; V306-I309 HydrophobicContact CB-CB 4.39Å; V306-I309 HydrophobicContact CB-CD1 3.92Å; V306-I309 HydrophobicContact CB-CG1 3.95Å; V306-I309 HydrophobicContact CG1-CD1 4.33Å; V306-I309 HydrophobicContact CG1-CG1 4.01Å; V306-I309 HydrophobicContact CG2-CD1 4.28Å; V306-I309 PolarHBondContact O-N 3.35Å; P307-I309 PolarHBondContact O-N 2.94Å; I309-I312 PolarHBondContact O-N 2.84Å; I309-C313 PolarHBondContact O-N 2.78Å; I309-C313 PolarHBondContact O-SG 3.25Å
310	R	98.5	Very high	97.3	Very high	24 Å²	24	30.6 Å²	30.6	9%	0.091	16%	0.161	C	C	.	.	H	α-helix	trans	-62.8	-42.5	173.2	-54.9	-159.3	-63.9	-79.3	5.3	111.4	Y302 D304 V305 V306 P307 I312 C313 V314 D343 V348	Y302-R310 VanDerWaalsContact O-CD 3.3Å; Y302-R310 WeakPolarHBondContact O-CD 3.28Å; Y302-R310 VanDerWaalsContact O-CG 3.27Å; Y302-R310 WeakPolarHBondContact O-CG 3.46Å; D304-R310 WeakPolarHBondContact O-CD 3.14Å; D304-R310 VanDerWaalsContact O-CG 3.32Å; D304-R310 WeakPolarHBondContact O-CG 3.46Å; D304-R310 PolarHBondContact O-NH1 2.9Å; V305-R310 PolarHBondContact O-NH1 3.06Å; V306-R310 PolarHBondContact O-N 2.84Å; P307-R310 WeakPolarHBondContact O-CB 3.09Å; P307-R310 PolarHBondContact O-N 3.47Å; P307-R310 VanDerWaalsContact O-N 3.09Å; R310-I312 PolarHBondContact O-N 3Å; R310-C313 PolarHBondContact O-N 3.29Å; R310-V314 WeakPolarHBondContact O-CG2 3.47Å; R310-V314 PolarHBondContact O-N 3.17Å; R310-D343 IonicContact CZ-OD1 3.74Å; R310-D343 IonicContact CZ-OD2 2.74Å; R310-D343 VanDerWaalsContact CZ-OD2 3.25Å; R310-D343 IonicContact NE-OD2 2.69Å; R310-D343 PolarHBondContact NE-OD2 3.29Å; R310-D343 VanDerWaalsContact NH2-CG 3.34Å; R310-D343 IonicContact NH2-OD1 2.99Å; R310-D343 PolarHBondContact NH2-OD1 3.44Å; R310-D343 IonicContact NH2-OD2 3Å; R310-D343 PolarHBondContact NH2-OD2 2.92Å; R310-V348 HydrophobicContact CB-CG1 3.95Å; R310-V348 HydrophobicContact CB-CG2 4.4Å
311	C	98.2	Very high	97.4	Very high	6 Å²	6	27.2 Å²	27.2	4%	0.041	15%	0.145	C	C	.	.	H	α-helix	trans	-58.4	-43.9	173.9	-79.2	0	0	0	0	112.5	P307 D308 T315 K351	P307-C311 PolarHBondContact O-N 3.04Å; D308-C311 WeakPolarHBondContact O-CB 3.46Å; D308-C311 PolarHBondContact O-N 3.48Å; C311-T315 VanDerWaalsContact O-CB 3.31Å; C311-T315 WeakPolarHBondContact O-CB 3.5Å; C311-T315 PolarHBondContact O-N 2.87Å; C311-T315 PolarHBondContact O-OG1 2.87Å; C311-K351 HydrophobicContact CB-CG 3.9Å
312	I	97.9	Very high	97.3	Very high	10 Å²	10	29 Å²	29	5%	0.051	16%	0.156	C	C	.	.	H	α-helix	trans	-59.7	-52.6	175.5	-73.8	161.6	0	0	0	110.1	H224 T227 L228 M231 D308 I309 R310 V314 T315 E316	H224-I312 WeakPolarHBondContact NE2-CD1 3.31Å; T227-I312 HydrophobicContact CG2-CG2 4.29Å; L228-I312 HydrophobicContact CB-CD1 4.26Å; L228-I312 HydrophobicContact CD1-CD1 4.27Å; L228-I312 HydrophobicContact CD1-CG1 4.27Å; L228-I312 HydrophobicContact CD1-CG2 4.04Å; M231-I312 HydrophobicContact CB-CG2 4.43Å; M231-I312 HydrophobicContact CG-CG2 3.82Å; D308-I312 VanDerWaalsContact O-CG1 3.3Å; D308-I312 WeakPolarHBondContact O-CG1 3.36Å; D308-I312 PolarHBondContact O-N 3.21Å; I309-I312 PolarHBondContact O-N 2.84Å; R310-I312 PolarHBondContact O-N 3Å; I312-V314 PolarHBondContact O-N 3.33Å; I312-T315 PolarHBondContact O-N 3.13Å; I312-E316 WeakPolarHBondContact O-CG 3.27Å; I312-E316 PolarHBondContact O-N 3.33Å
313	C	98.4	Very high	97.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-57.5	-50.4	-179.1	-63.9	0	0	0	0	112	F298 R301 I309 R310 T315 E316 L317	F298-C313 HydrophobicContact CD2-CB 3.86Å; F298-C313 HydrophobicContact CE2-CB 3.71Å; F298-C313 WeakPolarHBondContact CE2-O 3.47Å; R301-C313 VanDerWaalsContact C-SG 3.58Å; I309-C313 PolarHBondContact O-N 2.78Å; I309-C313 PolarHBondContact O-SG 3.25Å; R310-C313 PolarHBondContact O-N 3.29Å; C313-T315 VanDerWaalsContact C-N 3.34Å; C313-T315 PolarHBondContact O-N 3.01Å; C313-E316 PolarHBondContact O-N 3.22Å; C313-L317 WeakPolarHBondContact O-CB 3.48Å; C313-L317 PolarHBondContact O-N 3Å
314	V	97.9	Very high	97.1	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.018	14%	0.144	C	C	.	.	H	α-helix	trans	-63.4	-39.5	-179.9	172.7	0	0	0	0	112	R310 I312 G318 T340 K351 C352 T355	R310-V314 WeakPolarHBondContact O-CG2 3.47Å; R310-V314 PolarHBondContact O-N 3.17Å; I312-V314 PolarHBondContact O-N 3.33Å; V314-G318 PolarHBondContact O-N 2.95Å; V314-T340 HydrophobicContact CG2-CG2 3.9Å; V314-K351 HydrophobicContact CB-CB 4.4Å; V314-K351 HydrophobicContact CG1-CB 4.01Å; V314-C352 HydrophobicContact CG1-CB 4.39Å; V314-T355 PolarHBondContact O-OG1 3.13Å
315	T	97.9	Very high	97	Very high	44 Å²	44	26.2 Å²	26.2	27%	0.27	15%	0.154	S	C	.	.	H	α-helix	trans	-64.7	-48.8	179.7	-55.5	0	0	0	0	111.1	C311 I312 C313 G318 V319	C311-T315 VanDerWaalsContact O-CB 3.31Å; C311-T315 WeakPolarHBondContact O-CB 3.5Å; C311-T315 PolarHBondContact O-N 2.87Å; C311-T315 PolarHBondContact O-OG1 2.87Å; I312-T315 PolarHBondContact O-N 3.13Å; C313-T315 VanDerWaalsContact C-N 3.34Å; C313-T315 PolarHBondContact O-N 3.01Å; T315-G318 PolarHBondContact O-N 3Å; T315-V319 PolarHBondContact O-N 3.07Å
316	E	97.7	Very high	96.9	Very high	15 Å²	15	27.9 Å²	27.9	7%	0.07	15%	0.153	C	C	.	.	H	α-helix	trans	-72.3	-34.7	-176.7	-60.3	-67.7	130.2	0	0	111.7	M231 K232 T235 I312 C313 G318 V319 W320	M231-E316 HydrophobicContact CB-CB 3.79Å; M231-E316 HydrophobicContact CB-CG 3.63Å; M231-E316 HydrophobicContact CG-CB 4.26Å; M231-E316 HydrophobicContact CG-CG 4.26Å; K232-E316 WeakPolarHBondContact CE-OE1 3.35Å; K232-E316 WeakPolarHBondContact CE-OE2 3.37Å; K232-E316 IonicContact NZ-OE1 3.94Å; K232-E316 PolarHBondContact NZ-OE1 3.06Å; K232-E316 IonicContact NZ-OE2 3.24Å; K232-E316 PolarHBondContact NZ-OE2 3.3Å; T235-E316 PolarHBondContact OG1-OE2 3.17Å; I312-E316 WeakPolarHBondContact O-CG 3.27Å; I312-E316 PolarHBondContact O-N 3.33Å; C313-E316 PolarHBondContact O-N 3.22Å; E316-G318 PolarHBondContact O-N 2.87Å; E316-V319 WeakPolarHBondContact O-CB 3.36Å; E316-V319 PolarHBondContact O-N 2.83Å; E316-W320 HydrophobicContact CB-CZ2 3.84Å; E316-W320 VanDerWaalsContact O-CD1 3.23Å; E316-W320 PolarHBondContact O-N 3.22Å; E316-W320 PolarHBondContact O-NE1 3.3Å
317	L	98	Very high	96.9	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-56.7	-37.2	169.6	-179.8	60.9	0	0	0	112.2	F294 F298 C313 W320 M321 F328 R333 I337	F294-L317 HydrophobicContact CE2-CD1 4.23Å; F298-L317 HydrophobicContact CE1-CD2 4.46Å; F298-L317 HydrophobicContact CE2-CB 3.91Å; F298-L317 HydrophobicContact CE2-CD2 4.14Å; F298-L317 HydrophobicContact CZ-CB 4.29Å; F298-L317 HydrophobicContact CZ-CD2 3.64Å; F298-L317 HydrophobicContact CZ-CG 4.42Å; C313-L317 WeakPolarHBondContact O-CB 3.48Å; C313-L317 PolarHBondContact O-N 3Å; L317-W320 HydrophobicContact CB-CE3 4.26Å; L317-W320 HydrophobicContact CB-CZ3 4.43Å; L317-W320 HydrophobicContact CD1-CE3 3.75Å; L317-W320 HydrophobicContact CD1-CZ3 4.21Å; L317-W320 PolarHBondContact O-N 3.31Å; L317-M321 HydrophobicContact CD1-CE 3.86Å; L317-M321 HydrophobicContact CD2-CE 3.98Å; L317-M321 HydrophobicContact CG-CE 3.81Å; L317-M321 HydrophobicContact CG-SD 4.34Å; L317-M321 WeakPolarHBondContact O-CG 3.31Å; L317-M321 PolarHBondContact O-N 3.06Å; L317-F328 HydrophobicContact CD1-CD1 4.12Å; L317-R333 HydrophobicContact CD1-CB 4.49Å; L317-I337 HydrophobicContact CD2-CD1 4.15Å; L317-I337 HydrophobicContact CD2-CG1 3.93Å; L317-I337 HydrophobicContact CG-CD1 4.42Å
318	G	96.7	Very high	96.9	Very high	4 Å²	4	26.9 Å²	26.9	4%	0.041	14%	0.144	C	C	.	.	H	α-helix	trans	-64	-41.7	173.4	0	0	0	0	0	113.7	V314 T315 E316 W320 M321 L322	V314-G318 PolarHBondContact O-N 2.95Å; T315-G318 PolarHBondContact O-N 3Å; E316-G318 PolarHBondContact O-N 2.87Å; G318-W320 VanDerWaalsContact C-N 3.34Å; G318-M321 PolarHBondContact O-N 3.25Å; G318-L322 WeakPolarHBondContact O-CG 3.44Å; G318-L322 PolarHBondContact O-N 2.69Å
319	V	97	Very high	96.9	Very high	57 Å²	57	24.6 Å²	24.6	35%	0.345	13%	0.132	S	C	.	.	H	α-helix	trans	-60.3	-45.7	173.9	178	0	0	0	0	110.2	T235 T315 E316 M321 L322 S323	T235-V319 HydrophobicContact CG2-CG1 4Å; T315-V319 PolarHBondContact O-N 3.07Å; E316-V319 WeakPolarHBondContact O-CB 3.36Å; E316-V319 PolarHBondContact O-N 2.83Å; V319-M321 PolarHBondContact O-N 3.32Å; V319-L322 PolarHBondContact O-N 2.94Å; V319-S323 WeakPolarHBondContact O-CB 3.38Å; V319-S323 PolarHBondContact O-N 3.18Å; V319-S323 PolarHBondContact O-OG 3.34Å; V319-S323 VanDerWaalsContact O-OG 3.12Å
320	W	97.8	Very high	96.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-66.3	-37	-179.7	-49.1	-26.2	0	0	0	113.2	M231 V234 T235 F294 F298 E316 L317 G318 L322 S323 Y324 F328	M231-W320 HydrophobicContact CB-CZ2 4.03Å; M231-W320 HydrophobicContact CE-CH2 4.44Å; M231-W320 HydrophobicContact CG-CZ2 4.49Å; M231-W320 HydrophobicContact SD-CH2 3.56Å; M231-W320 VanDerWaalsContact SD-CH2 3.56Å; M231-W320 HydrophobicContact SD-CZ2 3.99Å; V234-W320 HydrophobicContact CB-CH2 4.2Å; V234-W320 HydrophobicContact CB-CZ2 3.61Å; V234-W320 HydrophobicContact CG1-CD2 3.88Å; V234-W320 VanDerWaalsContact CG1-CE2 3.48Å; V234-W320 HydrophobicContact CG1-CE3 4.25Å; V234-W320 HydrophobicContact CG1-CG 4.49Å; V234-W320 HydrophobicContact CG1-CH2 3.93Å; V234-W320 HydrophobicContact CG1-CZ2 3.53Å; V234-W320 HydrophobicContact CG1-CZ3 4.28Å; V234-W320 HydrophobicContact CG2-CZ2 4.42Å; T235-W320 PolarHBondContact OG1-NE1 3.15Å; F294-W320 HydrophobicContact CD2-CE3 4.46Å; F294-W320 AromaticContact CD2-CZ3 3.8Å; F294-W320 HydrophobicContact CD2-CZ3 3.8Å; F294-W320 AromaticContact CE2-CZ3 3.99Å; F294-W320 HydrophobicContact CE2-CZ3 3.99Å; F298-W320 HydrophobicContact CD2-CH2 4.09Å; F298-W320 AromaticContact CD2-CZ3 3.98Å; F298-W320 HydrophobicContact CD2-CZ3 3.98Å; F298-W320 HydrophobicContact CE2-CZ3 4.48Å; F298-W320 HydrophobicContact CG-CZ3 4.39Å; E316-W320 HydrophobicContact CB-CZ2 3.84Å; E316-W320 VanDerWaalsContact O-CD1 3.23Å; E316-W320 PolarHBondContact O-N 3.22Å; E316-W320 PolarHBondContact O-NE1 3.3Å; L317-W320 HydrophobicContact CB-CE3 4.26Å; L317-W320 HydrophobicContact CB-CZ3 4.43Å; L317-W320 HydrophobicContact CD1-CE3 3.75Å; L317-W320 HydrophobicContact CD1-CZ3 4.21Å; L317-W320 PolarHBondContact O-N 3.31Å; G318-W320 VanDerWaalsContact C-N 3.34Å; W320-L322 VanDerWaalsContact C-N 3.28Å; W320-L322 PolarHBondContact O-N 3.13Å; W320-S323 PolarHBondContact O-N 3.29Å; W320-Y324 CarbonylContact O-C 3.6Å; W320-Y324 PolarHBondContact O-N 2.92Å; W320-F328 HydrophobicContact CB-CB 4.19Å; W320-F328 HydrophobicContact CB-CD1 3.85Å; W320-F328 HydrophobicContact CB-CD2 3.6Å; W320-F328 HydrophobicContact CB-CE1 4.06Å; W320-F328 HydrophobicContact CB-CE2 3.8Å; W320-F328 HydrophobicContact CB-CG 3.61Å; W320-F328 HydrophobicContact CB-CZ 4.01Å; W320-F328 HydrophobicContact CD2-CD1 4.46Å; W320-F328 AromaticContact CD2-CE1 3.99Å; W320-F328 HydrophobicContact CD2-CE1 3.99Å; W320-F328 HydrophobicContact CD2-CZ 4.11Å; W320-F328 AromaticContact CE3-CD1 3.85Å; W320-F328 HydrophobicContact CE3-CD1 3.85Å; W320-F328 AromaticContact CE3-CE1 3.39Å; W320-F328 HydrophobicContact CE3-CE1 3.39Å; W320-F328 AromaticContact CE3-CZ 3.94Å; W320-F328 HydrophobicContact CE3-CZ 3.94Å; W320-F328 HydrophobicContact CG-CE1 4.3Å; W320-F328 HydrophobicContact CG-CE2 4.31Å; W320-F328 HydrophobicContact CG-CZ 4.16Å; W320-F328 HydrophobicContact CZ3-CE1 4.15Å
321	M	97.1	Very high	96.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.2	-32.3	174.9	-78.4	177.5	178.2	0	0	113	L317 G318 V319 P325 F328 L329 R333 L334 I337 L359	L317-M321 HydrophobicContact CD1-CE 3.86Å; L317-M321 HydrophobicContact CD2-CE 3.98Å; L317-M321 HydrophobicContact CG-CE 3.81Å; L317-M321 HydrophobicContact CG-SD 4.34Å; L317-M321 WeakPolarHBondContact O-CG 3.31Å; L317-M321 PolarHBondContact O-N 3.06Å; G318-M321 PolarHBondContact O-N 3.25Å; V319-M321 PolarHBondContact O-N 3.32Å; M321-P325 WeakPolarHBondContact O-CA 3.12Å; M321-P325 WeakPolarHBondContact O-CB 3.4Å; M321-F328 WeakPolarHBondContact CE-O 3.31Å; M321-F328 HydrophobicContact CG-CB 4Å; M321-L329 HydrophobicContact CB-CD1 4.18Å; M321-L329 HydrophobicContact CG-CD1 4.19Å; M321-L329 HydrophobicContact SD-CD1 4.15Å; M321-R333 HydrophobicContact CE-CB 3.95Å; M321-L334 HydrophobicContact CE-CB 4.42Å; M321-L334 HydrophobicContact CE-CD2 3.9Å; M321-L334 HydrophobicContact CE-CG 3.95Å; M321-L334 HydrophobicContact SD-CD2 3.81Å; M321-L334 HydrophobicContact SD-CG 4.41Å; M321-I337 HydrophobicContact CE-CD1 3.8Å; M321-I337 HydrophobicContact SD-CD1 3.47Å; M321-I337 WeakPolarHBondContact SD-CD1 3.46Å; M321-L359 HydrophobicContact CB-CD1 4.44Å; M321-L359 HydrophobicContact CB-CD2 4.15Å; M321-L359 HydrophobicContact SD-CD1 4.06Å
322	L	95.7	Very high	96.5	Very high	71 Å²	71	31.9 Å²	31.9	37%	0.372	18%	0.181	S	C	.	.	H	α-helix	trans	-81.8	-38.2	175.6	-69.7	168.7	0	0	0	112.5	G318 V319 W320 P358 L359 F365	G318-L322 WeakPolarHBondContact O-CG 3.44Å; G318-L322 PolarHBondContact O-N 2.69Å; V319-L322 PolarHBondContact O-N 2.94Å; W320-L322 VanDerWaalsContact C-N 3.28Å; W320-L322 PolarHBondContact O-N 3.13Å; L322-P358 HydrophobicContact CD1-CB 4Å; L322-P358 HydrophobicContact CD1-CG 4.5Å; L322-P358 HydrophobicContact CD2-CB 4.09Å; L322-L359 HydrophobicContact CD2-CD2 3.67Å; L322-L359 HydrophobicContact CG-CD2 4.09Å; L322-F365 HydrophobicContact CD2-CE2 3.85Å
323	S	94.6	Very high	96.4	Very high	45 Å²	45	33.5 Å²	33.5	32%	0.315	19%	0.187	S	C	.	.	H	α-helix	trans	-84.7	-33.3	-174.9	67.2	0	0	0	0	114.2	V319 W320	V319-S323 WeakPolarHBondContact O-CB 3.38Å; V319-S323 PolarHBondContact O-N 3.18Å; V319-S323 PolarHBondContact O-OG 3.34Å; V319-S323 VanDerWaalsContact O-OG 3.12Å; W320-S323 PolarHBondContact O-N 3.29Å
324	Y	96.2	Very high	96.3	Very high	13 Å²	13	33.6 Å²	33.6	5%	0.051	19%	0.187	C	C	.	.			trans	-136.7	65.2	178.7	-166.1	-156.3	0	0	0	111.7	A241 V242 D245 K283 W320 E326 H327 F328	A241-Y324 HydrophobicContact CB-CD1 4.44Å; A241-Y324 HydrophobicContact CB-CE1 3.82Å; V242-Y324 HydrophobicContact CG2-CD1 4.48Å; V242-Y324 HydrophobicContact CG2-CD2 3.44Å; V242-Y324 VanDerWaalsContact CG2-CD2 3.44Å; V242-Y324 HydrophobicContact CG2-CE2 4.03Å; V242-Y324 HydrophobicContact CG2-CG 3.69Å; D245-Y324 WeakPolarHBondContact OD2-CE2 3.22Å; D245-Y324 PolarHBondContact OD2-OH 3.03Å; K283-Y324 VanDerWaalsContact CE-OH 3.24Å; K283-Y324 WeakPolarHBondContact CE-OH 3.28Å; K283-Y324 PolarHBondContact NZ-OH 3.18Å; W320-Y324 CarbonylContact O-C 3.6Å; W320-Y324 PolarHBondContact O-N 2.92Å; Y324-E326 VanDerWaalsContact C-N 3.3Å; Y324-E326 PolarHBondContact O-N 3.03Å; Y324-H327 HydrophobicContact CD1-CB 3.59Å; Y324-H327 HydrophobicContact CE1-CB 3.62Å; Y324-H327 HydrophobicContact CG-CB 4.1Å; Y324-H327 PolarHBondContact O-N 3.24Å; Y324-F328 HydrophobicContact CD1-CD2 4.33Å; Y324-F328 HydrophobicContact CD1-CE2 4.27Å; Y324-F328 PolarHBondContact O-N 3.25Å; Y324-F328 VanDerWaalsContact O-N 3.08Å
325	P	95.7	Very high	96.2	Very high	36 Å²	36	36.4 Å²	36.4	23%	0.234	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-32.6	-172.6	22.7	-34	0	0	0	113.8	M321 H327 L329 F365	M321-P325 WeakPolarHBondContact O-CA 3.12Å; M321-P325 WeakPolarHBondContact O-CB 3.4Å; P325-H327 PolarHBondContact O-N 3.33Å; P325-L329 HydrophobicContact CB-CB 3.84Å; P325-L329 HydrophobicContact CB-CD2 4.14Å; P325-L329 WeakPolarHBondContact O-CA 3.42Å; P325-L329 VanDerWaalsContact O-CB 3.28Å; P325-L329 WeakPolarHBondContact O-CB 3.41Å; P325-L329 PolarHBondContact O-N 2.83Å; P325-F365 HydrophobicContact CB-CE1 3.82Å; P325-F365 HydrophobicContact CB-CZ 4.48Å; P325-F365 HydrophobicContact CG-CE1 4.01Å
326	E	93.3	Very high	96.2	Very high	159 Å²	159	35.3 Å²	35.3	74%	0.743	19%	0.19	S	C	*	.	H	α-helix	trans	-58.3	-31.8	179.1	-62.4	-174	169.7	0	0	112.9	Y324	Y324-E326 VanDerWaalsContact C-N 3.3Å; Y324-E326 PolarHBondContact O-N 3.03Å
327	H	95.3	Very high	96.2	Very high	28 Å²	28	34.6 Å²	34.6	13%	0.13	19%	0.187	C	C	.	.	H	α-helix	trans	-96.9	-43.1	179.8	-172	87.2	0	0	0	112.5	E291 Y324 P325 R333	E291-H327 IonicContact OE1-CE1 3.74Å; E291-H327 PolarHBondContact OE1-CE1 3.42Å; E291-H327 IonicContact OE1-NE2 3.66Å; E291-H327 PolarHBondContact OE1-NE2 3.3Å; Y324-H327 HydrophobicContact CD1-CB 3.59Å; Y324-H327 HydrophobicContact CE1-CB 3.62Å; Y324-H327 HydrophobicContact CG-CB 4.1Å; Y324-H327 PolarHBondContact O-N 3.24Å; P325-H327 PolarHBondContact O-N 3.33Å; H327-R333 PolarHBondContact O-NH1 2.68Å
328	F	97.2	Very high	96.2	Very high	1 Å²	1	34.5 Å²	34.5	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-98.1	-28.8	-171.5	-73	-80	0	0	0	115.3	V234 A238 I290 F294 L317 W320 M321 Y324 V330 R333	V234-F328 HydrophobicContact CG1-CZ 4.1Å; A238-F328 HydrophobicContact CB-CE2 4.29Å; I290-F328 HydrophobicContact CG2-CE2 4.27Å; I290-F328 HydrophobicContact CG2-CZ 3.61Å; F294-F328 HydrophobicContact CD2-CE1 4.16Å; F294-F328 HydrophobicContact CE2-CE1 4.37Å; L317-F328 HydrophobicContact CD1-CD1 4.12Å; W320-F328 HydrophobicContact CB-CB 4.19Å; W320-F328 HydrophobicContact CB-CD1 3.85Å; W320-F328 HydrophobicContact CB-CD2 3.6Å; W320-F328 HydrophobicContact CB-CE1 4.06Å; W320-F328 HydrophobicContact CB-CE2 3.8Å; W320-F328 HydrophobicContact CB-CG 3.61Å; W320-F328 HydrophobicContact CB-CZ 4.01Å; W320-F328 HydrophobicContact CD2-CD1 4.46Å; W320-F328 AromaticContact CD2-CE1 3.99Å; W320-F328 HydrophobicContact CD2-CE1 3.99Å; W320-F328 HydrophobicContact CD2-CZ 4.11Å; W320-F328 AromaticContact CE3-CD1 3.85Å; W320-F328 HydrophobicContact CE3-CD1 3.85Å; W320-F328 AromaticContact CE3-CE1 3.39Å; W320-F328 HydrophobicContact CE3-CE1 3.39Å; W320-F328 AromaticContact CE3-CZ 3.94Å; W320-F328 HydrophobicContact CE3-CZ 3.94Å; W320-F328 HydrophobicContact CG-CE1 4.3Å; W320-F328 HydrophobicContact CG-CE2 4.31Å; W320-F328 HydrophobicContact CG-CZ 4.16Å; W320-F328 HydrophobicContact CZ3-CE1 4.15Å; M321-F328 WeakPolarHBondContact CE-O 3.31Å; M321-F328 HydrophobicContact CG-CB 4Å; Y324-F328 HydrophobicContact CD1-CD2 4.33Å; Y324-F328 HydrophobicContact CD1-CE2 4.27Å; Y324-F328 PolarHBondContact O-N 3.25Å; Y324-F328 VanDerWaalsContact O-N 3.08Å; F328-V330 PolarHBondContact O-N 2.65Å; F328-R333 WeakPolarHBondContact O-CB 3.39Å
329	L	96.7	Very high	96.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	-87.7	59.6	-177.2	-168	65	0	0	0	111.5	M321 P325 L334 L359 F365 N368	M321-L329 HydrophobicContact CB-CD1 4.18Å; M321-L329 HydrophobicContact CG-CD1 4.19Å; M321-L329 HydrophobicContact SD-CD1 4.15Å; P325-L329 HydrophobicContact CB-CB 3.84Å; P325-L329 HydrophobicContact CB-CD2 4.14Å; P325-L329 WeakPolarHBondContact O-CA 3.42Å; P325-L329 VanDerWaalsContact O-CB 3.28Å; P325-L329 WeakPolarHBondContact O-CB 3.41Å; P325-L329 PolarHBondContact O-N 2.83Å; L329-L334 HydrophobicContact CD1-CD1 4.1Å; L329-L334 HydrophobicContact CD1-CD2 3.93Å; L329-L334 HydrophobicContact CD1-CG 4.19Å; L329-L359 HydrophobicContact CD1-CD1 3.91Å; L329-L359 HydrophobicContact CD1-CD2 3.98Å; L329-L359 HydrophobicContact CD2-CD2 4.43Å; L329-F365 HydrophobicContact CD2-CB 3.83Å; L329-F365 HydrophobicContact CD2-CD1 3.31Å; L329-F365 HydrophobicContact CD2-CD2 4.33Å; L329-F365 HydrophobicContact CD2-CE1 3.93Å; L329-F365 HydrophobicContact CD2-CG 3.56Å; L329-N368 HydrophobicContact CD2-CB 3.84Å; L329-N368 HydrophobicContact CG-CB 3.77Å; L329-N368 PolarHBondContact O-ND2 3.04Å
330	V	96	Very high	96.2	Very high	48 Å²	48	38.1 Å²	38.1	29%	0.291	19%	0.194	S	C	.	.	S	Bend	trans	-132.3	152.8	178.9	-62	0	0	0	0	110.7	F328 A332 R333 L334	F328-V330 PolarHBondContact O-N 2.65Å; V330-A332 HydrophobicContact CG2-CB 4.34Å; V330-A332 PolarHBondContact O-N 3.37Å; V330-R333 PolarHBondContact O-N 2.82Å; V330-L334 PolarHBondContact O-N 2.9Å
331	D	94.7	Very high	96.2	Very high	84 Å²	84	38.1 Å²	38.1	45%	0.449	19%	0.194	S	C	.	.	H	α-helix	trans	-48.9	-37.1	-177.1	-80.7	-5.7	0	0	0	113.9	R333 K335	D331-R333 PolarHBondContact O-N 2.92Å; D331-K335 WeakPolarHBondContact O-CB 3.48Å; D331-K335 PolarHBondContact O-N 2.88Å; D331-K335 VanDerWaalsContact O-N 3.16Å
332	A	95.1	Very high	96.3	Very high	50 Å²	50	44 Å²	44	41%	0.413	22%	0.217	S	C	.	.	H	α-helix	trans	-60.5	-24.1	179.2	0	0	0	0	0	114	V330 K335	V330-A332 HydrophobicContact CG2-CB 4.34Å; V330-A332 PolarHBondContact O-N 3.37Å; A332-K335 WeakPolarHBondContact O-CD 3.45Å; A332-K335 WeakPolarHBondContact O-CE 3.06Å; A332-K335 PolarHBondContact O-NZ 3.01Å
333	R	95.9	Very high	96.4	Very high	45 Å²	45	41.9 Å²	41.9	17%	0.17	21%	0.206	C	C	.	.	H	α-helix	trans	-108.8	-39.6	176.5	-72.6	93	-171.9	-176.4	5.6	112.5	E291 F294 L317 M321 H327 F328 V330 D331 K335 Y336	E291-R333 IonicContact OE1-CZ 3.75Å; E291-R333 IonicContact OE1-NH2 2.78Å; E291-R333 PolarHBondContact OE1-NH2 3.23Å; E291-R333 IonicContact OE2-NH2 2.71Å; E291-R333 PolarHBondContact OE2-NH2 3.06Å; F294-R333 HydrophobicContact CE1-CG 4.37Å; F294-R333 HydrophobicContact CE2-CG 4.31Å; F294-R333 HydrophobicContact CZ-CG 3.78Å; L317-R333 HydrophobicContact CD1-CB 4.49Å; M321-R333 HydrophobicContact CE-CB 3.95Å; H327-R333 PolarHBondContact O-NH1 2.68Å; F328-R333 WeakPolarHBondContact O-CB 3.39Å; V330-R333 PolarHBondContact O-N 2.82Å; D331-R333 PolarHBondContact O-N 2.92Å; R333-K335 PolarHBondContact O-N 3.29Å; R333-K335 VanDerWaalsContact O-N 3.13Å; R333-Y336 VanDerWaalsContact O-CD2 3.22Å; R333-Y336 WeakPolarHBondContact O-CD2 3.42Å; R333-Y336 PolarHBondContact O-N 2.92Å
334	L	95.9	Very high	96.5	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-54.2	-32.5	175	-84	169.2	0	0	0	113.3	M321 L329 V330 Y336 I337 G338 L359 L369 F372	M321-L334 HydrophobicContact CE-CB 4.42Å; M321-L334 HydrophobicContact CE-CD2 3.9Å; M321-L334 HydrophobicContact CE-CG 3.95Å; M321-L334 HydrophobicContact SD-CD2 3.81Å; M321-L334 HydrophobicContact SD-CG 4.41Å; L329-L334 HydrophobicContact CD1-CD1 4.1Å; L329-L334 HydrophobicContact CD1-CD2 3.93Å; L329-L334 HydrophobicContact CD1-CG 4.19Å; V330-L334 PolarHBondContact O-N 2.9Å; L334-Y336 PolarHBondContact O-N 3.19Å; L334-Y336 VanDerWaalsContact O-N 3.12Å; L334-I337 PolarHBondContact O-N 3.07Å; L334-G338 PolarHBondContact O-N 3.34Å; L334-G338 VanDerWaalsContact O-N 3.16Å; L334-L359 HydrophobicContact CD2-CD1 4.43Å; L334-L369 HydrophobicContact CD1-CD2 4.17Å; L334-L369 HydrophobicContact CD2-CD2 4.16Å; L334-F372 HydrophobicContact CB-CD2 3.99Å; L334-F372 HydrophobicContact CB-CE2 4.49Å; L334-F372 HydrophobicContact CD2-CD2 4.4Å
335	K	96.2	Very high	96.6	Very high	63 Å²	63	50.7 Å²	50.7	27%	0.274	24%	0.243	S	C	.	.	H	α-helix	trans	-52.7	-32.7	175.7	76.3	-168.9	-171.1	-149.4	0	113.9	D331 A332 R333 G338 W339	D331-K335 WeakPolarHBondContact O-CB 3.48Å; D331-K335 PolarHBondContact O-N 2.88Å; D331-K335 VanDerWaalsContact O-N 3.16Å; A332-K335 WeakPolarHBondContact O-CD 3.45Å; A332-K335 WeakPolarHBondContact O-CE 3.06Å; A332-K335 PolarHBondContact O-NZ 3.01Å; R333-K335 PolarHBondContact O-N 3.29Å; R333-K335 VanDerWaalsContact O-N 3.13Å; K335-G338 PolarHBondContact O-N 3.3Å; K335-W339 HydrophobicContact CB-CZ2 4.45Å; K335-W339 HydrophobicContact CD-CH2 3.83Å; K335-W339 HydrophobicContact CD-CZ2 4.33Å; K335-W339 HydrophobicContact CD-CZ3 4.16Å; K335-W339 HydrophobicContact CG-CE3 4.36Å; K335-W339 HydrophobicContact CG-CH2 4.09Å; K335-W339 HydrophobicContact CG-CZ2 4.43Å; K335-W339 HydrophobicContact CG-CZ3 4.04Å; K335-W339 VanDerWaalsContact O-CG 3.3Å; K335-W339 PolarHBondContact O-N 2.83Å
336	Y	97.8	Very high	96.7	Very high	20 Å²	20	49.2 Å²	49.2	8%	0.078	24%	0.235	C	C	.	.	H	α-helix	trans	-67.4	-42.2	-178	-63.6	-64.3	0	0	0	111.3	F294 F298 Y302 R333 L334 W339 T340	F294-Y336 AromaticContact CE1-CE2 3.87Å; F294-Y336 HydrophobicContact CE1-CE2 3.87Å; F294-Y336 HydrophobicContact CZ-CD2 4.02Å; F294-Y336 AromaticContact CZ-CE2 3.6Å; F294-Y336 HydrophobicContact CZ-CE2 3.6Å; F298-Y336 HydrophobicContact CE1-CD1 4.28Å; F298-Y336 AromaticContact CE1-CD2 3.68Å; F298-Y336 HydrophobicContact CE1-CD2 3.68Å; F298-Y336 HydrophobicContact CE1-CE2 4.09Å; F298-Y336 AromaticContact CE1-CG 3.81Å; F298-Y336 HydrophobicContact CE1-CG 3.81Å; F298-Y336 HydrophobicContact CZ-CD2 4.3Å; F298-Y336 HydrophobicContact CZ-CG 4.22Å; Y302-Y336 HydrophobicContact CD1-CD1 4.21Å; Y302-Y336 HydrophobicContact CD1-CE1 4.46Å; Y302-Y336 HydrophobicContact CD2-CD1 4.2Å; Y302-Y336 AromaticContact CE1-CD1 3.83Å; Y302-Y336 HydrophobicContact CE1-CD1 3.83Å; Y302-Y336 AromaticContact CE1-CE1 3.88Å; Y302-Y336 HydrophobicContact CE1-CE1 3.88Å; Y302-Y336 AromaticContact CE2-CD1 3.84Å; Y302-Y336 HydrophobicContact CE2-CD1 3.84Å; Y302-Y336 HydrophobicContact CG-CD1 4.38Å; Y302-Y336 AromaticContact CZ-CD1 3.64Å; Y302-Y336 AromaticContact CZ-CE1 3.97Å; R333-Y336 VanDerWaalsContact O-CD2 3.22Å; R333-Y336 WeakPolarHBondContact O-CD2 3.42Å; R333-Y336 PolarHBondContact O-N 2.92Å; L334-Y336 PolarHBondContact O-N 3.19Å; L334-Y336 VanDerWaalsContact O-N 3.12Å; Y336-W339 HydrophobicContact CD1-CE3 4.09Å; Y336-W339 HydrophobicContact CD1-CZ3 4.03Å; Y336-W339 HydrophobicContact CE1-CZ3 4Å; Y336-T340 WeakPolarHBondContact O-CB 3.33Å; Y336-T340 PolarHBondContact O-N 2.91Å; Y336-T340 VanDerWaalsContact O-N 3.08Å; Y336-T340 PolarHBondContact O-OG1 3.19Å
337	I	97.6	Very high	96.9	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.8	-45	173.9	-59.1	159	0	0	0	110	L317 M321 L334 W339 T340 L341 C352 T355 L356	L317-I337 HydrophobicContact CD2-CD1 4.15Å; L317-I337 HydrophobicContact CD2-CG1 3.93Å; L317-I337 HydrophobicContact CG-CD1 4.42Å; M321-I337 HydrophobicContact CE-CD1 3.8Å; M321-I337 HydrophobicContact SD-CD1 3.47Å; M321-I337 WeakPolarHBondContact SD-CD1 3.46Å; L334-I337 PolarHBondContact O-N 3.07Å; I337-W339 VanDerWaalsContact C-N 3.33Å; I337-W339 PolarHBondContact O-N 3.43Å; I337-T340 PolarHBondContact O-N 3.24Å; I337-T340 VanDerWaalsContact O-N 3.08Å; I337-L341 PolarHBondContact O-N 2.87Å; I337-C352 HydrophobicContact CG2-CB 3.99Å; I337-T355 HydrophobicContact CD1-CG2 3.62Å; I337-T355 HydrophobicContact CG1-CG2 4.31Å; I337-L356 HydrophobicContact CG2-CD1 4.01Å; I337-L356 HydrophobicContact CG2-CD2 3.93Å; I337-L356 HydrophobicContact CG2-CG 3.77Å
338	G	96.8	Very high	97	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.6	-39.7	180	0	0	0	0	0	113.9	L334 K335 F376	L334-G338 PolarHBondContact O-N 3.34Å; L334-G338 VanDerWaalsContact O-N 3.16Å; K335-G338 PolarHBondContact O-N 3.3Å; G338-F376 VanDerWaalsContact C-CE1 3.44Å; G338-F376 WeakPolarHBondContact O-CE1 3.19Å
339	W	97.6	Very high	97.1	Very high	127 Å²	127	45.5 Å²	45.5	48%	0.481	22%	0.216	S	C	.	.	H	α-helix	trans	-69.7	-41.3	172.1	-65.9	-29.5	0	0	0	112.4	K335 Y336 I337 L341 Y342	K335-W339 HydrophobicContact CB-CZ2 4.45Å; K335-W339 HydrophobicContact CD-CH2 3.83Å; K335-W339 HydrophobicContact CD-CZ2 4.33Å; K335-W339 HydrophobicContact CD-CZ3 4.16Å; K335-W339 HydrophobicContact CG-CE3 4.36Å; K335-W339 HydrophobicContact CG-CH2 4.09Å; K335-W339 HydrophobicContact CG-CZ2 4.43Å; K335-W339 HydrophobicContact CG-CZ3 4.04Å; K335-W339 VanDerWaalsContact O-CG 3.3Å; K335-W339 PolarHBondContact O-N 2.83Å; Y336-W339 HydrophobicContact CD1-CE3 4.09Å; Y336-W339 HydrophobicContact CD1-CZ3 4.03Å; Y336-W339 HydrophobicContact CE1-CZ3 4Å; I337-W339 VanDerWaalsContact C-N 3.33Å; I337-W339 PolarHBondContact O-N 3.43Å; W339-L341 PolarHBondContact O-N 3.26Å; W339-Y342 WeakPolarHBondContact O-CB 3.43Å; W339-Y342 PolarHBondContact O-N 3.45Å
340	T	97.7	Very high	97.2	Very high	9 Å²	9	47.3 Å²	47.3	6%	0.055	23%	0.226	C	C	.	.	H	α-helix	trans	-73	-13.3	-177.2	-51.3	0	0	0	0	113.4	V314 Y336 I337 Y342 D343 V348 C352	V314-T340 HydrophobicContact CG2-CG2 3.9Å; Y336-T340 WeakPolarHBondContact O-CB 3.33Å; Y336-T340 PolarHBondContact O-N 2.91Å; Y336-T340 VanDerWaalsContact O-N 3.08Å; Y336-T340 PolarHBondContact O-OG1 3.19Å; I337-T340 PolarHBondContact O-N 3.24Å; I337-T340 VanDerWaalsContact O-N 3.08Å; T340-Y342 PolarHBondContact O-N 3.14Å; T340-D343 HydrophobicContact CG2-CB 4.25Å; T340-D343 VanDerWaalsContact O-CB 3.27Å; T340-D343 WeakPolarHBondContact O-CB 3.42Å; T340-D343 PolarHBondContact O-N 2.65Å; T340-V348 HydrophobicContact CG2-CG1 3.44Å; T340-V348 VanDerWaalsContact CG2-CG1 3.44Å; T340-C352 VanDerWaalsContact C-SG 3.57Å; T340-C352 VanDerWaalsContact CB-SG 3.57Å; T340-C352 VanDerWaalsContact CG2-SG 3.56Å
341	L	97.7	Very high	97.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-17.6	163.5	-70.3	172	0	0	0	113.6	I337 W339 R349 C352 L353 L356 F372 F376 R379 L380 M383	I337-L341 PolarHBondContact O-N 2.87Å; W339-L341 PolarHBondContact O-N 3.26Å; L341-R349 WeakPolarHBondContact O-CD 3.13Å; L341-C352 HydrophobicContact CD2-CB 3.62Å; L341-C352 HydrophobicContact CG-CB 4.22Å; L341-L353 HydrophobicContact CD2-CD2 3.87Å; L341-L353 HydrophobicContact CD2-CG 4.32Å; L341-L356 HydrophobicContact CD1-CD1 4.08Å; L341-L356 HydrophobicContact CD2-CD1 4.13Å; L341-L356 HydrophobicContact CG-CD1 4.47Å; L341-F372 HydrophobicContact CD1-CZ 4.44Å; L341-F376 HydrophobicContact CD1-CB 4.4Å; L341-R379 HydrophobicContact CB-CG 4.04Å; L341-R379 PolarHBondContact O-NE 3.03Å; L341-R379 PolarHBondContact O-NH2 3.42Å; L341-L380 HydrophobicContact CD1-CD2 4.25Å; L341-M383 HydrophobicContact CB-SD 4.4Å; L341-M383 HydrophobicContact CD2-CE 4.37Å; L341-M383 HydrophobicContact CD2-SD 3.95Å
342	Y	97.8	Very high	97.4	Very high	125 Å²	125	43.9 Å²	43.9	49%	0.49	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	7.4	176.8	-64.2	-99.2	0	0	0	113.7	W339 T340 F376 R379	W339-Y342 WeakPolarHBondContact O-CB 3.43Å; W339-Y342 PolarHBondContact O-N 3.45Å; T340-Y342 PolarHBondContact O-N 3.14Å; Y342-F376 HydrophobicContact CE2-CD1 4.14Å; Y342-F376 HydrophobicContact CE2-CE1 4.17Å; Y342-R379 HydrophobicContact CD2-CG 4.36Å; Y342-R379 HydrophobicContact CE1-CG 4.17Å; Y342-R379 HydrophobicContact CE2-CB 4.21Å; Y342-R379 HydrophobicContact CE2-CG 3.88Å
343	D	98.2	Very high	97.6	Very high	25 Å²	25	41.5 Å²	41.5	13%	0.134	18%	0.183	C	C	.	.			trans	-57.5	145.3	178.4	-160.1	-68.7	0	0	0	112.1	R310 T340 V345 V348 R349	R310-D343 IonicContact CZ-OD1 3.74Å; R310-D343 IonicContact CZ-OD2 2.74Å; R310-D343 VanDerWaalsContact CZ-OD2 3.25Å; R310-D343 IonicContact NE-OD2 2.69Å; R310-D343 PolarHBondContact NE-OD2 3.29Å; R310-D343 VanDerWaalsContact NH2-CG 3.34Å; R310-D343 IonicContact NH2-OD1 2.99Å; R310-D343 PolarHBondContact NH2-OD1 3.44Å; R310-D343 IonicContact NH2-OD2 3Å; R310-D343 PolarHBondContact NH2-OD2 2.92Å; T340-D343 HydrophobicContact CG2-CB 4.25Å; T340-D343 VanDerWaalsContact O-CB 3.27Å; T340-D343 WeakPolarHBondContact O-CB 3.42Å; T340-D343 PolarHBondContact O-N 2.65Å; D343-V345 VanDerWaalsContact C-N 3.32Å; D343-V345 PolarHBondContact OD1-N 3.05Å; D343-V348 HydrophobicContact CB-CB 4.01Å; D343-V348 HydrophobicContact CB-CG1 4.03Å; D343-R349 HydrophobicContact CB-CG 4.1Å; D343-R349 VanDerWaalsContact O-CD 3.23Å; D343-R349 WeakPolarHBondContact O-CD 3.33Å; D343-R349 WeakPolarHBondContact O-CG 3.23Å; D343-R349 PolarHBondContact O-NH1 2.75Å
344	K	97.3	Very high	97.7	Very high	189 Å²	189	43.5 Å²	43.5	82%	0.822	19%	0.193	S	C	*	.	S	Bend	trans	-74.9	-22.6	-179.7	-56.3	-51.4	-177.4	-169	0	112.9	R349	K344-R349 VanDerWaalsContact C-NH1 3.35Å; K344-R349 PolarHBondContact O-NH1 3.26Å
345	V	97.9	Very high	97.7	Very high	55 Å²	55	44 Å²	44	33%	0.333	20%	0.196	S	C	.	.	S	Bend	trans	-95	126.3	-178.1	-178.9	0	0	0	0	110.8	P307 D343 E347 V348 R349	P307-V345 HydrophobicContact CB-CB 4.42Å; P307-V345 HydrophobicContact CB-CG1 4.1Å; P307-V345 HydrophobicContact CB-CG2 4.32Å; P307-V345 HydrophobicContact CG-CG1 4.37Å; P307-V345 HydrophobicContact CG-CG2 3.89Å; D343-V345 VanDerWaalsContact C-N 3.32Å; D343-V345 PolarHBondContact OD1-N 3.05Å; V345-E347 VanDerWaalsContact C-N 3.35Å; V345-E347 HydrophobicContact CG1-CB 4.49Å; V345-E347 PolarHBondContact O-N 2.71Å; V345-V348 HydrophobicContact CB-CG2 3.99Å; V345-V348 HydrophobicContact CG1-CG2 4.22Å; V345-V348 PolarHBondContact O-N 3.27Å; V345-R349 PolarHBondContact O-N 3.33Å
346	G	97.5	Very high	97.7	Very high	5 Å²	5	41 Å²	41	5%	0.052	18%	0.183	C	C	.	.	H	α-helix	trans	-55.1	-42.9	-177.9	0	0	0	0	0	114.9	V348 R349 M350 E388 N391	G346-V348 VanDerWaalsContact C-N 3.34Å; G346-V348 PolarHBondContact O-N 3.23Å; G346-R349 PolarHBondContact O-N 3.13Å; G346-M350 PolarHBondContact O-N 3.26Å; G346-E388 WeakPolarHBondContact CA-OE2 3.42Å; G346-N391 PolarHBondContact O-ND2 2.94Å
347	E	97.8	Very high	97.7	Very high	95 Å²	95	41.2 Å²	41.2	44%	0.444	19%	0.185	S	C	.	.	H	α-helix	trans	-62.6	-39.8	-179.6	-166.5	-174.4	163.1	0	0	112.2	V345 R349 M350 K351	V345-E347 VanDerWaalsContact C-N 3.35Å; V345-E347 HydrophobicContact CG1-CB 4.49Å; V345-E347 PolarHBondContact O-N 2.71Å; E347-R349 VanDerWaalsContact C-N 3.33Å; E347-R349 PolarHBondContact O-N 3.01Å; E347-M350 WeakPolarHBondContact O-CA 3.47Å; E347-M350 VanDerWaalsContact O-CB 3.27Å; E347-M350 WeakPolarHBondContact O-CB 3.43Å; E347-M350 PolarHBondContact O-N 3.11Å; E347-M350 VanDerWaalsContact O-N 3.12Å; E347-K351 WeakPolarHBondContact O-CG 3.45Å; E347-K351 PolarHBondContact O-N 3.37Å
348	V	98.4	Very high	97.6	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.6	-40.5	179.2	-170.2	0	0	0	0	110.3	P307 R310 T340 D343 V345 G346 M350 K351 C352	P307-V348 HydrophobicContact CB-CG2 3.88Å; R310-V348 HydrophobicContact CB-CG1 3.95Å; R310-V348 HydrophobicContact CB-CG2 4.4Å; T340-V348 HydrophobicContact CG2-CG1 3.44Å; T340-V348 VanDerWaalsContact CG2-CG1 3.44Å; D343-V348 HydrophobicContact CB-CB 4.01Å; D343-V348 HydrophobicContact CB-CG1 4.03Å; V345-V348 HydrophobicContact CB-CG2 3.99Å; V345-V348 HydrophobicContact CG1-CG2 4.22Å; V345-V348 PolarHBondContact O-N 3.27Å; G346-V348 VanDerWaalsContact C-N 3.34Å; G346-V348 PolarHBondContact O-N 3.23Å; V348-M350 VanDerWaalsContact C-N 3.34Å; V348-K351 PolarHBondContact O-N 2.67Å; V348-C352 PolarHBondContact O-N 2.94Å; V348-C352 VanDerWaalsContact O-N 3.13Å; V348-C352 PolarHBondContact O-SG 2.77Å
349	R	98.4	Very high	97.5	Very high	14 Å²	14	43.1 Å²	43.1	5%	0.053	20%	0.197	C	C	.	.	H	α-helix	trans	-62.7	-40.4	171.7	-62.4	-159.4	-61	-69.9	-2.6	111.8	L341 D343 K344 V345 G346 E347 K351 C352 L353 M383 D386 E388	L341-R349 WeakPolarHBondContact O-CD 3.13Å; D343-R349 HydrophobicContact CB-CG 4.1Å; D343-R349 VanDerWaalsContact O-CD 3.23Å; D343-R349 WeakPolarHBondContact O-CD 3.33Å; D343-R349 WeakPolarHBondContact O-CG 3.23Å; D343-R349 PolarHBondContact O-NH1 2.75Å; K344-R349 VanDerWaalsContact C-NH1 3.35Å; K344-R349 PolarHBondContact O-NH1 3.26Å; V345-R349 PolarHBondContact O-N 3.33Å; G346-R349 PolarHBondContact O-N 3.13Å; E347-R349 VanDerWaalsContact C-N 3.33Å; E347-R349 PolarHBondContact O-N 3.01Å; R349-K351 VanDerWaalsContact C-N 3.34Å; R349-K351 PolarHBondContact O-N 3.08Å; R349-C352 WeakPolarHBondContact O-CB 3.33Å; R349-C352 PolarHBondContact O-N 3.31Å; R349-C352 VanDerWaalsContact O-N 3.15Å; R349-L353 PolarHBondContact O-N 3.17Å; R349-M383 HydrophobicContact CB-CE 3.77Å; R349-M383 HydrophobicContact CG-CE 4.37Å; R349-D386 IonicContact CZ-OD1 2.63Å; R349-D386 IonicContact CZ-OD2 3.18Å; R349-D386 IonicContact NE-OD1 3.98Å; R349-D386 IonicContact NE-OD2 2.68Å; R349-D386 PolarHBondContact NE-OD2 3.44Å; R349-D386 VanDerWaalsContact NH2-CG 3.29Å; R349-D386 IonicContact NH2-OD1 2.77Å; R349-D386 PolarHBondContact NH2-OD1 2.95Å; R349-D386 IonicContact NH2-OD2 3.79Å; R349-D386 PolarHBondContact NH2-OD2 2.94Å; R349-D386 VanDerWaalsContact NH2-OD2 3.11Å; R349-E388 IonicContact CZ-OE2 3.41Å; R349-E388 IonicContact NH2-OE2 3.67Å; R349-E388 PolarHBondContact NH2-OE2 3.17Å
350	M	98.2	Very high	97.3	Very high	39 Å²	39	37.2 Å²	37.2	19%	0.192	18%	0.175	C	C	.	.	H	α-helix	trans	-60.7	-41.2	175.4	-160.2	-166.7	-61.8	0	0	112	G346 E347 V348 C352 L353 K354 E390 N391 L394	G346-M350 PolarHBondContact O-N 3.26Å; E347-M350 WeakPolarHBondContact O-CA 3.47Å; E347-M350 VanDerWaalsContact O-CB 3.27Å; E347-M350 WeakPolarHBondContact O-CB 3.43Å; E347-M350 PolarHBondContact O-N 3.11Å; E347-M350 VanDerWaalsContact O-N 3.12Å; V348-M350 VanDerWaalsContact C-N 3.34Å; M350-C352 VanDerWaalsContact C-N 3.35Å; M350-L353 PolarHBondContact O-N 2.99Å; M350-K354 HydrophobicContact CG-CD 4.41Å; M350-K354 WeakPolarHBondContact O-CB 3.23Å; M350-K354 WeakPolarHBondContact O-CG 3.36Å; M350-K354 PolarHBondContact O-N 3.3Å; M350-E390 HydrophobicContact CE-CB 4.05Å; M350-N391 WeakPolarHBondContact CA-OD1 3.22Å; M350-N391 WeakPolarHBondContact CB-OD1 3.49Å; M350-N391 PolarHBondContact N-OD1 3.47Å; M350-L394 HydrophobicContact CG-CD1 3.61Å
351	K	98	Very high	97	Very high	60 Å²	60	41.1 Å²	41.1	26%	0.261	19%	0.193	S	C	.	.	H	α-helix	trans	-63.4	-39.6	174.3	-63.4	-57	-174.8	161.4	0	112	C311 V314 E347 V348 R349 K354 T355	C311-K351 HydrophobicContact CB-CG 3.9Å; V314-K351 HydrophobicContact CB-CB 4.4Å; V314-K351 HydrophobicContact CG1-CB 4.01Å; E347-K351 WeakPolarHBondContact O-CG 3.45Å; E347-K351 PolarHBondContact O-N 3.37Å; V348-K351 PolarHBondContact O-N 2.67Å; R349-K351 VanDerWaalsContact C-N 3.34Å; R349-K351 PolarHBondContact O-N 3.08Å; K351-K354 PolarHBondContact O-N 3.19Å; K351-T355 VanDerWaalsContact O-CB 3.28Å; K351-T355 WeakPolarHBondContact O-CB 3.42Å; K351-T355 PolarHBondContact O-N 2.81Å; K351-T355 PolarHBondContact O-OG1 3.34Å
352	C	98.3	Very high	96.6	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.6	-47.5	174.9	-61.3	0	0	0	0	111.2	V314 I337 T340 L341 V348 R349 M350 T355 L356	V314-C352 HydrophobicContact CG1-CB 4.39Å; I337-C352 HydrophobicContact CG2-CB 3.99Å; T340-C352 VanDerWaalsContact C-SG 3.57Å; T340-C352 VanDerWaalsContact CB-SG 3.57Å; T340-C352 VanDerWaalsContact CG2-SG 3.56Å; L341-C352 HydrophobicContact CD2-CB 3.62Å; L341-C352 HydrophobicContact CG-CB 4.22Å; V348-C352 PolarHBondContact O-N 2.94Å; V348-C352 VanDerWaalsContact O-N 3.13Å; V348-C352 PolarHBondContact O-SG 2.77Å; R349-C352 WeakPolarHBondContact O-CB 3.33Å; R349-C352 PolarHBondContact O-N 3.31Å; R349-C352 VanDerWaalsContact O-N 3.15Å; M350-C352 VanDerWaalsContact C-N 3.35Å; C352-T355 WeakPolarHBondContact O-CB 3.27Å; C352-T355 PolarHBondContact O-N 2.84Å; C352-L356 WeakPolarHBondContact O-CG 3.38Å; C352-L356 PolarHBondContact O-N 2.86Å
353	L	98.2	Very high	96.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-66.8	-41.9	178.7	-63.3	174.3	0	0	0	112.4	L341 R349 M350 T355 L356 L357 L380 M383 N391 L394 A395 I398	L341-L353 HydrophobicContact CD2-CD2 3.87Å; L341-L353 HydrophobicContact CD2-CG 4.32Å; R349-L353 PolarHBondContact O-N 3.17Å; M350-L353 PolarHBondContact O-N 2.99Å; L353-T355 PolarHBondContact O-N 3.04Å; L353-L356 PolarHBondContact O-N 3.22Å; L353-L357 WeakPolarHBondContact O-CB 3.14Å; L353-L357 PolarHBondContact O-N 3.21Å; L353-L380 HydrophobicContact CD2-CD2 3.81Å; L353-M383 HydrophobicContact CD1-CE 3.61Å; L353-M383 HydrophobicContact CD2-CE 4.12Å; L353-M383 HydrophobicContact CD2-SD 4.26Å; L353-M383 HydrophobicContact CG-CE 3.92Å; L353-N391 HydrophobicContact CD1-CB 4.04Å; L353-N391 WeakPolarHBondContact CD1-O 3.44Å; L353-L394 HydrophobicContact CB-CB 3.75Å; L353-L394 HydrophobicContact CB-CD1 4.12Å; L353-L394 HydrophobicContact CD1-CB 3.86Å; L353-L394 HydrophobicContact CG-CB 4.44Å; L353-A395 HydrophobicContact CD1-CB 4.44Å; L353-I398 HydrophobicContact CB-CD1 4.21Å; L353-I398 HydrophobicContact CD2-CD1 3.75Å
354	K	98	Very high	95.8	Very high	87 Å²	87	52.4 Å²	52.4	38%	0.378	25%	0.249	S	C	.	.	H	α-helix	trans	-63.3	-30.3	174.3	-74	-178.2	178.2	176.4	0	113	M350 K351 P358 L394	M350-K354 HydrophobicContact CG-CD 4.41Å; M350-K354 WeakPolarHBondContact O-CB 3.23Å; M350-K354 WeakPolarHBondContact O-CG 3.36Å; M350-K354 PolarHBondContact O-N 3.3Å; K351-K354 PolarHBondContact O-N 3.19Å; K354-P358 WeakPolarHBondContact O-CD 3.35Å; K354-L394 HydrophobicContact CD-CD1 4.44Å; K354-L394 HydrophobicContact CG-CD1 3.72Å; K354-L394 HydrophobicContact CG-CD2 4.19Å
355	T	96.7	Very high	95.5	Very high	12 Å²	12	44 Å²	44	7%	0.074	21%	0.213	C	C	.	.	H	α-helix	trans	-73.9	-42.3	173.9	-65.3	0	0	0	0	111.8	V314 I337 K351 C352 L353	V314-T355 PolarHBondContact O-OG1 3.13Å; I337-T355 HydrophobicContact CD1-CG2 3.62Å; I337-T355 HydrophobicContact CG1-CG2 4.31Å; K351-T355 VanDerWaalsContact O-CB 3.28Å; K351-T355 WeakPolarHBondContact O-CB 3.42Å; K351-T355 PolarHBondContact O-N 2.81Å; K351-T355 PolarHBondContact O-OG1 3.34Å; C352-T355 WeakPolarHBondContact O-CB 3.27Å; C352-T355 PolarHBondContact O-N 2.84Å; L353-T355 PolarHBondContact O-N 3.04Å
356	L	96.7	Very high	95	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-70.8	-36.7	179.7	-72.5	172.7	0	0	0	112.8	I337 L341 C352 L353 L359 Y360 F372 L380 I398	I337-L356 HydrophobicContact CG2-CD1 4.01Å; I337-L356 HydrophobicContact CG2-CD2 3.93Å; I337-L356 HydrophobicContact CG2-CG 3.77Å; L341-L356 HydrophobicContact CD1-CD1 4.08Å; L341-L356 HydrophobicContact CD2-CD1 4.13Å; L341-L356 HydrophobicContact CG-CD1 4.47Å; C352-L356 WeakPolarHBondContact O-CG 3.38Å; C352-L356 PolarHBondContact O-N 2.86Å; L353-L356 PolarHBondContact O-N 3.22Å; L356-L359 HydrophobicContact CD2-CD1 4.49Å; L356-L359 WeakPolarHBondContact O-CB 3.43Å; L356-L359 PolarHBondContact O-N 3.32Å; L356-Y360 HydrophobicContact CB-CD2 4.43Å; L356-Y360 HydrophobicContact CB-CE2 4.25Å; L356-Y360 VanDerWaalsContact O-CD2 3.31Å; L356-Y360 WeakPolarHBondContact O-CD2 3.42Å; L356-Y360 PolarHBondContact O-N 2.87Å; L356-F372 HydrophobicContact CD1-CE1 4Å; L356-F372 HydrophobicContact CD1-CZ 3.99Å; L356-F372 HydrophobicContact CD2-CE1 3.67Å; L356-F372 HydrophobicContact CD2-CZ 3.71Å; L356-L380 HydrophobicContact CD1-CD2 4.47Å; L356-I398 HydrophobicContact CB-CD1 3.8Å
357	L	96.3	Very high	94.6	Very high	23 Å²	23	48.1 Å²	48.1	12%	0.12	24%	0.241	C	C	.	.	H	α-helix	trans	-54	-55.4	-171.4	175.4	62.4	0	0	0	112.7	L353 L359 Y360 E361 L394 K397 I398 K401	L353-L357 WeakPolarHBondContact O-CB 3.14Å; L353-L357 PolarHBondContact O-N 3.21Å; L357-L359 PolarHBondContact O-N 3.01Å; L357-Y360 PolarHBondContact O-N 3.25Å; L357-E361 HydrophobicContact CD1-CG 4.25Å; L357-E361 HydrophobicContact CG-CG 4.41Å; L357-E361 WeakPolarHBondContact O-CG 3.3Å; L357-E361 PolarHBondContact O-N 3.25Å; L357-L394 HydrophobicContact CD2-CD2 4.23Å; L357-K397 HydrophobicContact CD1-CB 4.04Å; L357-K397 HydrophobicContact CD2-CB 4.33Å; L357-I398 HydrophobicContact CB-CD1 4.46Å; L357-I398 HydrophobicContact CB-CG1 4.01Å; L357-I398 HydrophobicContact CD1-CG1 4.02Å; L357-K401 HydrophobicContact CD1-CG 4.32Å
358	P	96.2	Very high	94.3	Very high	39 Å²	39	46 Å²	46	25%	0.253	23%	0.233	S	C	.	.	H	α-helix	trans	-56.2	-33.2	177.1	-26.9	36.2	0	0	0	114.3	L322 K354 Y360 E361 E362	L322-P358 HydrophobicContact CD1-CB 4Å; L322-P358 HydrophobicContact CD1-CG 4.5Å; L322-P358 HydrophobicContact CD2-CB 4.09Å; K354-P358 WeakPolarHBondContact O-CD 3.35Å; P358-Y360 PolarHBondContact O-N 3.46Å; P358-E361 PolarHBondContact O-N 3.12Å; P358-E362 PolarHBondContact O-N 3.44Å
359	L	95.2	Very high	94	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-66.3	-25.5	177.5	-57.5	175.1	0	0	0	112.6	M321 L322 L329 L334 L356 L357 F365 L369	M321-L359 HydrophobicContact CB-CD1 4.44Å; M321-L359 HydrophobicContact CB-CD2 4.15Å; M321-L359 HydrophobicContact SD-CD1 4.06Å; L322-L359 HydrophobicContact CD2-CD2 3.67Å; L322-L359 HydrophobicContact CG-CD2 4.09Å; L329-L359 HydrophobicContact CD1-CD1 3.91Å; L329-L359 HydrophobicContact CD1-CD2 3.98Å; L329-L359 HydrophobicContact CD2-CD2 4.43Å; L334-L359 HydrophobicContact CD2-CD1 4.43Å; L356-L359 HydrophobicContact CD2-CD1 4.49Å; L356-L359 WeakPolarHBondContact O-CB 3.43Å; L356-L359 PolarHBondContact O-N 3.32Å; L357-L359 PolarHBondContact O-N 3.01Å; L359-F365 HydrophobicContact CD2-CD2 4.11Å; L359-F365 HydrophobicContact CD2-CE2 4.32Å; L359-F365 WeakPolarHBondContact O-CB 3.49Å; L359-L369 HydrophobicContact CB-CD1 4.14Å; L359-L369 WeakPolarHBondContact O-CD1 3.25Å
360	Y	92.9	Very high	93.5	Very high	3 Å²	3	53.2 Å²	53.2	1%	0.012	26%	0.264	C	S	.	.	H	α-helix	trans	-92.3	-8.3	171	-70.4	-81.5	0	0	0	113.4	L356 L357 P358 L369 T373 I398 I402 Q405	L356-Y360 HydrophobicContact CB-CD2 4.43Å; L356-Y360 HydrophobicContact CB-CE2 4.25Å; L356-Y360 VanDerWaalsContact O-CD2 3.31Å; L356-Y360 WeakPolarHBondContact O-CD2 3.42Å; L356-Y360 PolarHBondContact O-N 2.87Å; L357-Y360 PolarHBondContact O-N 3.25Å; P358-Y360 PolarHBondContact O-N 3.46Å; Y360-L369 HydrophobicContact CD1-CD1 3.78Å; Y360-L369 HydrophobicContact CD2-CD1 4.27Å; Y360-L369 HydrophobicContact CE1-CD1 3.76Å; Y360-L369 HydrophobicContact CE2-CD1 4.25Å; Y360-L369 HydrophobicContact CG-CD1 4.05Å; Y360-T373 HydrophobicContact CE1-CG2 4.15Å; Y360-T373 PolarHBondContact OH-OG1 3.2Å; Y360-T373 VanDerWaalsContact OH-OG1 3.13Å; Y360-I398 HydrophobicContact CD2-CG2 3.65Å; Y360-I398 HydrophobicContact CE2-CG2 3.66Å; Y360-I398 HydrophobicContact CG-CG2 4.24Å; Y360-I402 HydrophobicContact CD1-CD1 4.3Å; Y360-I402 HydrophobicContact CD1-CG1 3.63Å; Y360-I402 HydrophobicContact CE1-CD1 3.78Å; Y360-I402 HydrophobicContact CE1-CG1 3.47Å; Y360-I402 VanDerWaalsContact CE1-CG1 3.47Å; Y360-I402 HydrophobicContact CG-CG1 4.43Å; Y360-Q405 PolarHBondContact O-NE2 2.81Å
361	E	91.9	Very high	93.1	Very high	92 Å²	92	57.3 Å²	57.3	43%	0.43	29%	0.285	S	S	.	.	H	α-helix	trans	-82.2	-32.1	175.2	-55.1	-159.8	103.6	0	0	112.2	L357 P358 K401	L357-E361 HydrophobicContact CD1-CG 4.25Å; L357-E361 HydrophobicContact CG-CG 4.41Å; L357-E361 WeakPolarHBondContact O-CG 3.3Å; L357-E361 PolarHBondContact O-N 3.25Å; P358-E361 PolarHBondContact O-N 3.12Å; E361-K401 HydrophobicContact CG-CD 4.18Å; E361-K401 WeakPolarHBondContact OE1-CE 3.38Å; E361-K401 IonicContact OE1-NZ 2.8Å; E361-K401 PolarHBondContact OE1-NZ 3.49Å
362	E	89.2	Confident	92.9	Very high	101 Å²	101	54.7 Å²	54.7	47%	0.472	27%	0.273	S	S	.	.	S	Bend	trans	-91.9	107.4	-179.6	-67.1	-64.6	164	0	0	111.7	P358 Q364 F365	P358-E362 PolarHBondContact O-N 3.44Å; E362-Q364 HydrophobicContact CB-CG 4.18Å; E362-Q364 PolarHBondContact O-N 3.47Å; E362-F365 HydrophobicContact CB-CD2 3.55Å; E362-F365 HydrophobicContact CB-CE2 3.71Å; E362-F365 HydrophobicContact CB-CG 4.41Å; E362-F365 HydrophobicContact CG-CD2 4.3Å; E362-F365 HydrophobicContact CG-CE2 4.01Å; E362-F365 PolarHBondContact O-N 3.37Å
363	E	86.7	Confident	92.5	Very high	153 Å²	153	56 Å²	56	72%	0.715	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-56.7	-28.7	-174.9	-66.1	-174.6	168.4	0	0	113.9	F365 T366	E363-F365 PolarHBondContact O-N 3.4Å; E363-T366 VanDerWaalsContact O-CB 3.3Å; E363-T366 WeakPolarHBondContact O-CB 3.34Å; E363-T366 PolarHBondContact O-N 2.92Å; E363-T366 VanDerWaalsContact O-N 3.16Å; E363-T366 PolarHBondContact O-OG1 2.88Å
364	Q	91	Very high	92.1	Very high	133 Å²	133	60.4 Å²	60.4	62%	0.621	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-58.2	-29.2	177.5	60.1	-178.3	6.6	0	0	113.7	E362	E362-Q364 HydrophobicContact CB-CG 4.18Å; E362-Q364 PolarHBondContact O-N 3.47Å
365	F	92.2	Very high	91.8	Very high	13 Å²	13	63 Å²	63	6%	0.057	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-85.4	-6.5	-178.3	-60.8	-35.9	0	0	0	114	L322 P325 L329 L359 E362 E363 S367 N368 L369	L322-F365 HydrophobicContact CD2-CE2 3.85Å; P325-F365 HydrophobicContact CB-CE1 3.82Å; P325-F365 HydrophobicContact CB-CZ 4.48Å; P325-F365 HydrophobicContact CG-CE1 4.01Å; L329-F365 HydrophobicContact CD2-CB 3.83Å; L329-F365 HydrophobicContact CD2-CD1 3.31Å; L329-F365 HydrophobicContact CD2-CD2 4.33Å; L329-F365 HydrophobicContact CD2-CE1 3.93Å; L329-F365 HydrophobicContact CD2-CG 3.56Å; L359-F365 HydrophobicContact CD2-CD2 4.11Å; L359-F365 HydrophobicContact CD2-CE2 4.32Å; L359-F365 WeakPolarHBondContact O-CB 3.49Å; E362-F365 HydrophobicContact CB-CD2 3.55Å; E362-F365 HydrophobicContact CB-CE2 3.71Å; E362-F365 HydrophobicContact CB-CG 4.41Å; E362-F365 HydrophobicContact CG-CD2 4.3Å; E362-F365 HydrophobicContact CG-CE2 4.01Å; E362-F365 PolarHBondContact O-N 3.37Å; E363-F365 PolarHBondContact O-N 3.4Å; F365-S367 PolarHBondContact O-N 2.63Å; F365-S367 VanDerWaalsContact O-N 3.13Å; F365-N368 PolarHBondContact O-N 3.35Å; F365-L369 PolarHBondContact O-N 3.05Å; F365-L369 VanDerWaalsContact O-N 3.11Å
366	T	86.3	Confident	91.6	Very high	56 Å²	56	63 Å²	63	34%	0.344	32%	0.32	S	S	.	.	H	α-helix	trans	-54	-36	179.5	-49.9	0	0	0	0	112.1	E363 L369 K370	E363-T366 VanDerWaalsContact O-CB 3.3Å; E363-T366 WeakPolarHBondContact O-CB 3.34Å; E363-T366 PolarHBondContact O-N 2.92Å; E363-T366 VanDerWaalsContact O-N 3.16Å; E363-T366 PolarHBondContact O-OG1 2.88Å; T366-L369 PolarHBondContact O-N 3.36Å; T366-K370 PolarHBondContact O-N 2.89Å
367	S	89.4	Confident	91.3	Very high	89 Å²	89	65.1 Å²	65.1	62%	0.622	33%	0.329	S	S	*	.	H	α-helix	trans	-67.3	-41.5	179.1	73.6	0	0	0	0	112.7	F365 L369 K370	F365-S367 PolarHBondContact O-N 2.63Å; F365-S367 VanDerWaalsContact O-N 3.13Å; S367-L369 VanDerWaalsContact C-N 3.33Å; S367-L369 PolarHBondContact O-N 2.9Å; S367-K370 VanDerWaalsContact O-CB 3.31Å; S367-K370 WeakPolarHBondContact O-CB 3.48Å; S367-K370 PolarHBondContact O-N 3.42Å
368	N	92.3	Very high	91	Very high	52 Å²	52	69.3 Å²	69.3	28%	0.278	36%	0.356	S	S	.	.	H	α-helix	trans	-67.2	-33.2	176.2	-55.6	71.9	0	0	0	112.1	L329 F365 K370	L329-N368 HydrophobicContact CD2-CB 3.84Å; L329-N368 HydrophobicContact CG-CB 3.77Å; L329-N368 PolarHBondContact O-ND2 3.04Å; F365-N368 PolarHBondContact O-N 3.35Å; N368-K370 VanDerWaalsContact C-N 3.33Å
369	L	92.1	Very high	90.9	Very high	2 Å²	2	69.5 Å²	69.5	1%	0.01	35%	0.352	C	S	.	.	H	α-helix	trans	-81.9	-8.1	-179	-64.7	175.2	0	0	0	113.8	L334 L359 Y360 F365 T366 S367 M371 F372 T373	L334-L369 HydrophobicContact CD1-CD2 4.17Å; L334-L369 HydrophobicContact CD2-CD2 4.16Å; L359-L369 HydrophobicContact CB-CD1 4.14Å; L359-L369 WeakPolarHBondContact O-CD1 3.25Å; Y360-L369 HydrophobicContact CD1-CD1 3.78Å; Y360-L369 HydrophobicContact CD2-CD1 4.27Å; Y360-L369 HydrophobicContact CE1-CD1 3.76Å; Y360-L369 HydrophobicContact CE2-CD1 4.25Å; Y360-L369 HydrophobicContact CG-CD1 4.05Å; F365-L369 PolarHBondContact O-N 3.05Å; F365-L369 VanDerWaalsContact O-N 3.11Å; T366-L369 PolarHBondContact O-N 3.36Å; S367-L369 VanDerWaalsContact C-N 3.33Å; S367-L369 PolarHBondContact O-N 2.9Å; L369-M371 PolarHBondContact O-N 2.78Å; L369-M371 VanDerWaalsContact O-N 3.08Å; L369-F372 HydrophobicContact CD2-CB 4.39Å; L369-F372 HydrophobicContact CD2-CD1 4.43Å; L369-F372 PolarHBondContact O-N 3.46Å; L369-T373 PolarHBondContact O-N 3.35Å; L369-T373 PolarHBondContact O-OG1 3.1Å; L369-T373 VanDerWaalsContact O-OG1 3.08Å
370	K	87.1	Confident	90.8	Very high	162 Å²	162	69.4 Å²	69.4	70%	0.704	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-32.6	-173.9	-172.9	172.1	-178.3	174.6	0	114.9	T366 S367 N368 P374	T366-K370 PolarHBondContact O-N 2.89Å; S367-K370 VanDerWaalsContact O-CB 3.31Å; S367-K370 WeakPolarHBondContact O-CB 3.48Å; S367-K370 PolarHBondContact O-N 3.42Å; N368-K370 VanDerWaalsContact C-N 3.33Å; K370-P374 WeakPolarHBondContact O-CD 3.3Å; K370-P374 WeakPolarHBondContact O-CG 3.45Å
371	M	89.8	Confident	90.8	Very high	126 Å²	126	70.6 Å²	70.6	62%	0.621	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-26.3	175.5	-64.9	-58.6	-68.4	0	0	113.2	L369 K375	L369-M371 PolarHBondContact O-N 2.78Å; L369-M371 VanDerWaalsContact O-N 3.08Å; M371-K375 WeakPolarHBondContact O-CB 3.2Å
372	F	93.8	Very high	90.9	Very high	5 Å²	5	69 Å²	69	2%	0.022	36%	0.357	C	S	.	.	H	α-helix	trans	-74.1	-49.3	-179.8	-177.5	-88.5	0	0	0	111.9	L334 L341 L356 L369 K375 F376	L334-F372 HydrophobicContact CB-CD2 3.99Å; L334-F372 HydrophobicContact CB-CE2 4.49Å; L334-F372 HydrophobicContact CD2-CD2 4.4Å; L341-F372 HydrophobicContact CD1-CZ 4.44Å; L356-F372 HydrophobicContact CD1-CE1 4Å; L356-F372 HydrophobicContact CD1-CZ 3.99Å; L356-F372 HydrophobicContact CD2-CE1 3.67Å; L356-F372 HydrophobicContact CD2-CZ 3.71Å; L369-F372 HydrophobicContact CD2-CB 4.39Å; L369-F372 HydrophobicContact CD2-CD1 4.43Å; L369-F372 PolarHBondContact O-N 3.46Å; F372-K375 PolarHBondContact O-N 3.4Å; F372-F376 HydrophobicContact CD1-CD2 4.29Å; F372-F376 AromaticContact CD2-CD2 3.61Å; F372-F376 HydrophobicContact CD2-CD2 3.61Å; F372-F376 AromaticContact CD2-CE2 3.75Å; F372-F376 HydrophobicContact CD2-CE2 3.75Å; F372-F376 HydrophobicContact CE1-CB 4.38Å; F372-F376 HydrophobicContact CE1-CD2 4.13Å; F372-F376 AromaticContact CE2-CD2 3.44Å; F372-F376 HydrophobicContact CE2-CD2 3.44Å; F372-F376 VanDerWaalsContact CE2-CD2 3.44Å; F372-F376 AromaticContact CE2-CE2 3.62Å; F372-F376 HydrophobicContact CE2-CE2 3.62Å; F372-F376 HydrophobicContact CE2-CG 4.37Å; F372-F376 HydrophobicContact CG-CD2 4.04Å; F372-F376 HydrophobicContact CZ-CB 4.44Å; F372-F376 AromaticContact CZ-CD2 3.72Å; F372-F376 HydrophobicContact CZ-CD2 3.72Å; F372-F376 HydrophobicContact CZ-CE2 4.31Å; F372-F376 HydrophobicContact CZ-CG 4.26Å; F372-F376 WeakPolarHBondContact O-CD2 3.36Å; F372-F376 PolarHBondContact O-N 3.13Å; F372-F376 VanDerWaalsContact O-N 3.13Å
373	T	91.1	Very high	91.2	Very high	27 Å²	27	64.2 Å²	64.2	17%	0.166	33%	0.334	C	S	.	.	H	α-helix	trans	-58.3	-51.6	-172.9	-44.8	0	0	0	0	112.6	Y360 L369 K375 F376 K377 I402	Y360-T373 HydrophobicContact CE1-CG2 4.15Å; Y360-T373 PolarHBondContact OH-OG1 3.2Å; Y360-T373 VanDerWaalsContact OH-OG1 3.13Å; L369-T373 PolarHBondContact O-N 3.35Å; L369-T373 PolarHBondContact O-OG1 3.1Å; L369-T373 VanDerWaalsContact O-OG1 3.08Å; T373-K375 VanDerWaalsContact C-N 3.27Å; T373-K375 PolarHBondContact O-N 3.14Å; T373-F376 PolarHBondContact O-N 3.1Å; T373-K377 WeakPolarHBondContact O-CA 3.5Å; T373-K377 WeakPolarHBondContact O-CB 3.29Å; T373-K377 PolarHBondContact O-N 3.18Å; T373-I402 HydrophobicContact CG2-CD1 3.7Å; T373-I402 HydrophobicContact CG2-CG1 4.09Å; T373-I402 HydrophobicContact CG2-CG2 4.19Å
374	P	88.7	Confident	91.6	Very high	92 Å²	92	57 Å²	57	60%	0.597	30%	0.301	S	S	*	.	H	α-helix	trans	-64	-33.8	-179.1	-20.6	34.4	0	0	0	112.5	K370	K370-P374 WeakPolarHBondContact O-CD 3.3Å; K370-P374 WeakPolarHBondContact O-CG 3.45Å
375	K	92.7	Very high	91.7	Very high	142 Å²	142	54 Å²	54	62%	0.617	29%	0.289	S	S	*	.	H	α-helix	trans	-70	-32.9	-178.4	-176	173.5	-178.8	173.2	0	113.3	M371 F372 T373	M371-K375 WeakPolarHBondContact O-CB 3.2Å; F372-K375 PolarHBondContact O-N 3.4Å; T373-K375 VanDerWaalsContact C-N 3.27Å; T373-K375 PolarHBondContact O-N 3.14Å
376	F	93.2	Very high	91.9	Very high	12 Å²	12	54.3 Å²	54.3	5%	0.053	29%	0.291	C	S	.	.	H	α-helix	trans	-113.1	0.4	-177.1	-63.4	-72.4	0	0	0	114.4	G338 L341 Y342 F372 T373 T378 R379 L380	G338-F376 VanDerWaalsContact C-CE1 3.44Å; G338-F376 WeakPolarHBondContact O-CE1 3.19Å; L341-F376 HydrophobicContact CD1-CB 4.4Å; Y342-F376 HydrophobicContact CE2-CD1 4.14Å; Y342-F376 HydrophobicContact CE2-CE1 4.17Å; F372-F376 HydrophobicContact CD1-CD2 4.29Å; F372-F376 AromaticContact CD2-CD2 3.61Å; F372-F376 HydrophobicContact CD2-CD2 3.61Å; F372-F376 AromaticContact CD2-CE2 3.75Å; F372-F376 HydrophobicContact CD2-CE2 3.75Å; F372-F376 HydrophobicContact CE1-CB 4.38Å; F372-F376 HydrophobicContact CE1-CD2 4.13Å; F372-F376 AromaticContact CE2-CD2 3.44Å; F372-F376 HydrophobicContact CE2-CD2 3.44Å; F372-F376 VanDerWaalsContact CE2-CD2 3.44Å; F372-F376 AromaticContact CE2-CE2 3.62Å; F372-F376 HydrophobicContact CE2-CE2 3.62Å; F372-F376 HydrophobicContact CE2-CG 4.37Å; F372-F376 HydrophobicContact CG-CD2 4.04Å; F372-F376 HydrophobicContact CZ-CB 4.44Å; F372-F376 AromaticContact CZ-CD2 3.72Å; F372-F376 HydrophobicContact CZ-CD2 3.72Å; F372-F376 HydrophobicContact CZ-CE2 4.31Å; F372-F376 HydrophobicContact CZ-CG 4.26Å; F372-F376 WeakPolarHBondContact O-CD2 3.36Å; F372-F376 PolarHBondContact O-N 3.13Å; F372-F376 VanDerWaalsContact O-N 3.13Å; T373-F376 PolarHBondContact O-N 3.1Å; F376-T378 PolarHBondContact O-N 3.11Å; F376-R379 WeakPolarHBondContact O-CA 3.42Å; F376-R379 WeakPolarHBondContact O-CB 3.02Å; F376-R379 PolarHBondContact O-N 3.31Å; F376-L380 PolarHBondContact O-N 3.44Å
377	K	89.1	Confident	92.3	Very high	44 Å²	44	62.9 Å²	62.9	19%	0.191	32%	0.317	C	S	.	.	H	α-helix	trans	-46.2	-53.5	177.5	-173.1	-165.6	-177.3	-158.1	0	112.8	T373 R379 L380 L381 L411 E416	T373-K377 WeakPolarHBondContact O-CA 3.5Å; T373-K377 WeakPolarHBondContact O-CB 3.29Å; T373-K377 PolarHBondContact O-N 3.18Å; K377-R379 PolarHBondContact O-N 2.94Å; K377-L380 PolarHBondContact O-N 3.35Å; K377-L380 VanDerWaalsContact O-N 3.13Å; K377-L381 HydrophobicContact CG-CD1 4.06Å; K377-L381 PolarHBondContact O-N 3.09Å; K377-L411 PolarHBondContact NZ-O 3.31Å; K377-E416 WeakPolarHBondContact CE-OE2 3.38Å; K377-E416 VanDerWaalsContact NZ-CD 3.33Å; K377-E416 IonicContact NZ-OE1 3.84Å; K377-E416 PolarHBondContact NZ-OE1 3.05Å; K377-E416 VanDerWaalsContact NZ-OE1 3.1Å; K377-E416 IonicContact NZ-OE2 3.73Å; K377-E416 PolarHBondContact NZ-OE2 2.64Å
378	T	91	Very high	92.5	Very high	112 Å²	112	61.8 Å²	61.8	69%	0.687	30%	0.302	S	S	*	.	H	α-helix	trans	-60.2	-33.9	-179.7	-46	0	0	0	0	112.3	F376 S382	F376-T378 PolarHBondContact O-N 3.11Å; T378-S382 PolarHBondContact O-N 2.71Å
379	R	94.1	Very high	92.6	Very high	42 Å²	42	61.2 Å²	61.2	16%	0.158	30%	0.301	C	S	.	.	H	α-helix	trans	-70.6	-46	175.4	-178.3	58.1	-172.9	136.4	2.8	111	L341 Y342 F376 K377 L381 S382 M383 D386	L341-R379 HydrophobicContact CB-CG 4.04Å; L341-R379 PolarHBondContact O-NE 3.03Å; L341-R379 PolarHBondContact O-NH2 3.42Å; Y342-R379 HydrophobicContact CD2-CG 4.36Å; Y342-R379 HydrophobicContact CE1-CG 4.17Å; Y342-R379 HydrophobicContact CE2-CB 4.21Å; Y342-R379 HydrophobicContact CE2-CG 3.88Å; F376-R379 WeakPolarHBondContact O-CA 3.42Å; F376-R379 WeakPolarHBondContact O-CB 3.02Å; F376-R379 PolarHBondContact O-N 3.31Å; K377-R379 PolarHBondContact O-N 2.94Å; R379-L381 VanDerWaalsContact C-N 3.34Å; R379-L381 PolarHBondContact O-N 3.47Å; R379-S382 PolarHBondContact NH1-OG 2.93Å; R379-S382 PolarHBondContact O-N 3.17Å; R379-S382 VanDerWaalsContact O-N 3.17Å; R379-S382 PolarHBondContact O-OG 3.46Å; R379-M383 HydrophobicContact CG-SD 4.22Å; R379-M383 VanDerWaalsContact CZ-CG 3.46Å; R379-M383 WeakPolarHBondContact O-CG 3.15Å; R379-M383 PolarHBondContact O-N 3.28Å; R379-M383 VanDerWaalsContact O-N 3.08Å; R379-D386 IonicContact NH2-OD2 2.92Å
380	L	93.4	Very high	92.8	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-58.3	-44.3	176.7	-66.7	171.4	0	0	0	111.6	L341 L353 L356 F376 K377 M383 I398 L399 I402	L341-L380 HydrophobicContact CD1-CD2 4.25Å; L353-L380 HydrophobicContact CD2-CD2 3.81Å; L356-L380 HydrophobicContact CD1-CD2 4.47Å; F376-L380 PolarHBondContact O-N 3.44Å; K377-L380 PolarHBondContact O-N 3.35Å; K377-L380 VanDerWaalsContact O-N 3.13Å; L380-M383 WeakPolarHBondContact O-CB 3.3Å; L380-M383 PolarHBondContact O-N 2.92Å; L380-M383 VanDerWaalsContact O-N 3.13Å; L380-I398 HydrophobicContact CD1-CG2 4.12Å; L380-L399 HydrophobicContact CB-CD2 4.24Å; L380-I402 HydrophobicContact CD1-CD1 4.24Å
381	L	92.3	Very high	93.3	Very high	27 Å²	27	57.7 Å²	57.7	14%	0.141	29%	0.287	C	S	.	.	H	α-helix	trans	-60	-45.8	173.5	-72.5	164.2	0	0	0	112.2	K377 R379 M383 V384 L399 E416	K377-L381 HydrophobicContact CG-CD1 4.06Å; K377-L381 PolarHBondContact O-N 3.09Å; R379-L381 VanDerWaalsContact C-N 3.34Å; R379-L381 PolarHBondContact O-N 3.47Å; L381-M383 PolarHBondContact O-N 3.27Å; L381-M383 VanDerWaalsContact O-N 3.14Å; L381-V384 WeakPolarHBondContact O-CB 3.47Å; L381-V384 VanDerWaalsContact O-CG2 3.3Å; L381-V384 WeakPolarHBondContact O-CG2 3.13Å; L381-V384 PolarHBondContact O-N 3.05Å; L381-V384 VanDerWaalsContact O-N 3.1Å; L381-L399 HydrophobicContact CD2-CD1 3.93Å; L381-L399 HydrophobicContact CD2-CD2 3.96Å; L381-L399 HydrophobicContact CG-CD1 4.49Å; L381-L399 HydrophobicContact CG-CD2 4.12Å; L381-E416 HydrophobicContact CD1-CB 4.36Å; L381-E416 HydrophobicContact CD1-CG 4.49Å; L381-E416 WeakPolarHBondContact CD1-OE2 3.33Å
382	S	93.1	Very high	93.7	Very high	59 Å²	59	51.7 Å²	51.7	41%	0.413	26%	0.258	S	S	.	.	H	α-helix	trans	-62.3	-21.7	176.6	75.9	0	0	0	0	113.8	T378 R379 V384	T378-S382 PolarHBondContact O-N 2.71Å; R379-S382 PolarHBondContact NH1-OG 2.93Å; R379-S382 PolarHBondContact O-N 3.17Å; R379-S382 VanDerWaalsContact O-N 3.17Å; R379-S382 PolarHBondContact O-OG 3.46Å; S382-V384 VanDerWaalsContact C-N 3.31Å
383	M	95.6	Very high	93.8	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-82.5	-6.5	179.1	-69.7	178.6	77.3	0	0	113.4	L341 R349 L353 R379 L380 L381 L385 D386 G392 A395	L341-M383 HydrophobicContact CB-SD 4.4Å; L341-M383 HydrophobicContact CD2-CE 4.37Å; L341-M383 HydrophobicContact CD2-SD 3.95Å; R349-M383 HydrophobicContact CB-CE 3.77Å; R349-M383 HydrophobicContact CG-CE 4.37Å; L353-M383 HydrophobicContact CD1-CE 3.61Å; L353-M383 HydrophobicContact CD2-CE 4.12Å; L353-M383 HydrophobicContact CD2-SD 4.26Å; L353-M383 HydrophobicContact CG-CE 3.92Å; R379-M383 HydrophobicContact CG-SD 4.22Å; R379-M383 VanDerWaalsContact CZ-CG 3.46Å; R379-M383 WeakPolarHBondContact O-CG 3.15Å; R379-M383 PolarHBondContact O-N 3.28Å; R379-M383 VanDerWaalsContact O-N 3.08Å; L380-M383 WeakPolarHBondContact O-CB 3.3Å; L380-M383 PolarHBondContact O-N 2.92Å; L380-M383 VanDerWaalsContact O-N 3.13Å; L381-M383 PolarHBondContact O-N 3.27Å; L381-M383 VanDerWaalsContact O-N 3.14Å; M383-L385 PolarHBondContact O-N 3.45Å; M383-D386 HydrophobicContact CB-CB 4.4Å; M383-D386 WeakPolarHBondContact O-CB 3.28Å; M383-D386 PolarHBondContact O-N 2.87Å; M383-D386 VanDerWaalsContact O-N 3.17Å; M383-G392 WeakPolarHBondContact O-CA 3.44Å; M383-G392 PolarHBondContact O-N 3.19Å; M383-A395 HydrophobicContact CB-CB 3.89Å
384	V	95.1	Very high	94.2	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.012	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-59.2	-35.7	167.7	176	0	0	0	0	110.8	L381 S382 I396 L399 T419 I420	L381-V384 WeakPolarHBondContact O-CB 3.47Å; L381-V384 VanDerWaalsContact O-CG2 3.3Å; L381-V384 WeakPolarHBondContact O-CG2 3.13Å; L381-V384 PolarHBondContact O-N 3.05Å; L381-V384 VanDerWaalsContact O-N 3.1Å; S382-V384 VanDerWaalsContact C-N 3.31Å; V384-I396 HydrophobicContact CG1-CD1 4.14Å; V384-I396 HydrophobicContact CG1-CG1 4.08Å; V384-I396 HydrophobicContact CG2-CG1 4.02Å; V384-L399 HydrophobicContact CG2-CD1 3.7Å; V384-T419 HydrophobicContact CB-CG2 4.4Å; V384-T419 HydrophobicContact CG1-CG2 4.08Å; V384-I420 HydrophobicContact CG1-CG1 4.24Å; V384-I420 HydrophobicContact CG2-CG1 4.04Å
385	L	94.1	Very high	94.5	Very high	70 Å²	70	48 Å²	48	37%	0.366	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-104.8	35.3	174.7	-54.1	-175	0	0	0	112.4	M383 T419 L1080	M383-L385 PolarHBondContact O-N 3.45Å; L385-T419 HydrophobicContact CD1-CG2 3.67Å; L385-T419 HydrophobicContact CD2-CG2 3.87Å; L385-T419 HydrophobicContact CG-CG2 3.55Å; L385-L1080 HydrophobicContact CD2-CD1 3.89Å; L385-L1080 HydrophobicContact CD2-CD2 3.68Å; L385-L1080 HydrophobicContact CD2-CG 4.04Å
386	D	96.3	Very high	94.7	Very high	20 Å²	20	41.2 Å²	41.2	11%	0.107	20%	0.203	C	C	.	.			trans	-65	150.5	174.1	-164.4	-77.8	0	0	0	111	R349 R379 M383 E388 N391	R349-D386 IonicContact CZ-OD1 2.63Å; R349-D386 IonicContact CZ-OD2 3.18Å; R349-D386 IonicContact NE-OD1 3.98Å; R349-D386 IonicContact NE-OD2 2.68Å; R349-D386 PolarHBondContact NE-OD2 3.44Å; R349-D386 VanDerWaalsContact NH2-CG 3.29Å; R349-D386 IonicContact NH2-OD1 2.77Å; R349-D386 PolarHBondContact NH2-OD1 2.95Å; R349-D386 IonicContact NH2-OD2 3.79Å; R349-D386 PolarHBondContact NH2-OD2 2.94Å; R349-D386 VanDerWaalsContact NH2-OD2 3.11Å; R379-D386 IonicContact NH2-OD2 2.92Å; M383-D386 HydrophobicContact CB-CB 4.4Å; M383-D386 WeakPolarHBondContact O-CB 3.28Å; M383-D386 PolarHBondContact O-N 2.87Å; M383-D386 VanDerWaalsContact O-N 3.17Å; D386-E388 PolarHBondContact O-N 2.79Å; D386-E388 PolarHBondContact OD1-N 3.25Å; D386-E388 VanDerWaalsContact OD1-OE2 3.05Å; D386-N391 HydrophobicContact CB-CB 3.71Å; D386-N391 PolarHBondContact OD1-ND2 3.3Å
387	R	94.3	Very high	94.8	Very high	235 Å²	235	44.2 Å²	44.2	89%	0.887	22%	0.216	S	C	*	.	S	Bend	trans	-65	-29	-174.1	-70.8	-176.7	176.9	-177.5	-2.8	112.9
388	E	94.2	Very high	95	Very high	66 Å²	66	42.1 Å²	42.1	31%	0.308	21%	0.207	S	C	.	.	S	Bend	trans	-98.1	112	169.9	-59.8	89.2	-173.3	0	0	108.5	G346 R349 D386 E390 N391	G346-E388 WeakPolarHBondContact CA-OE2 3.42Å; R349-E388 IonicContact CZ-OE2 3.41Å; R349-E388 IonicContact NH2-OE2 3.67Å; R349-E388 PolarHBondContact NH2-OE2 3.17Å; D386-E388 PolarHBondContact O-N 2.79Å; D386-E388 PolarHBondContact OD1-N 3.25Å; D386-E388 VanDerWaalsContact OD1-OE2 3.05Å; E388-E390 PolarHBondContact O-N 3.34Å; E388-E390 VanDerWaalsContact O-N 3.11Å; E388-N391 VanDerWaalsContact O-CB 3.3Å; E388-N391 WeakPolarHBondContact O-CB 3.35Å; E388-N391 PolarHBondContact O-N 3.28Å; E388-N391 PolarHBondContact OE2-ND2 3.1Å
389	P	94.2	Very high	95.1	Very high	40 Å²	40	37.1 Å²	37.1	26%	0.26	18%	0.176	S	C	.	.	H	α-helix	trans	-65.7	-19.7	-168.5	27.5	-36.3	0	0	0	113.8	N391 G392 V393 H428	P389-N391 PolarHBondContact O-N 3.41Å; P389-G392 WeakPolarHBondContact O-CA 3.36Å; P389-G392 PolarHBondContact O-N 2.86Å; P389-G392 VanDerWaalsContact O-N 3.1Å; P389-V393 PolarHBondContact O-N 3.03Å; P389-H428 HydrophobicContact CB-CB 4.04Å; P389-H428 HydrophobicContact CG-CB 4.33Å
390	E	95.9	Very high	94.9	Very high	91 Å²	91	36 Å²	36	43%	0.425	17%	0.173	S	C	.	.	H	α-helix	trans	-63.7	-28.3	171.2	-61.2	84.2	172.6	0	0	112.6	M350 E388 L394	M350-E390 HydrophobicContact CE-CB 4.05Å; E388-E390 PolarHBondContact O-N 3.34Å; E388-E390 VanDerWaalsContact O-N 3.11Å; E390-L394 WeakPolarHBondContact O-CG 3.26Å; E390-L394 PolarHBondContact O-N 3.49Å
391	N	97.8	Very high	94.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-69.4	-40.4	170.3	-70.4	-29.5	0	0	0	110.7	G346 M350 L353 D386 E388 P389 V393 L394 A395	G346-N391 PolarHBondContact O-ND2 2.94Å; M350-N391 WeakPolarHBondContact CA-OD1 3.22Å; M350-N391 WeakPolarHBondContact CB-OD1 3.49Å; M350-N391 PolarHBondContact N-OD1 3.47Å; L353-N391 HydrophobicContact CD1-CB 4.04Å; L353-N391 WeakPolarHBondContact CD1-O 3.44Å; D386-N391 HydrophobicContact CB-CB 3.71Å; D386-N391 PolarHBondContact OD1-ND2 3.3Å; E388-N391 VanDerWaalsContact O-CB 3.3Å; E388-N391 WeakPolarHBondContact O-CB 3.35Å; E388-N391 PolarHBondContact O-N 3.28Å; E388-N391 PolarHBondContact OE2-ND2 3.1Å; P389-N391 PolarHBondContact O-N 3.41Å; N391-V393 PolarHBondContact O-N 2.92Å; N391-L394 PolarHBondContact O-N 3.28Å; N391-A395 WeakPolarHBondContact O-CB 3.37Å; N391-A395 PolarHBondContact O-N 3.43Å
392	G	97	Very high	94.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.4	-44.1	173.9	0	0	0	0	0	112.9	M383 P389 L394 A395 I396 L431	M383-G392 WeakPolarHBondContact O-CA 3.44Å; M383-G392 PolarHBondContact O-N 3.19Å; P389-G392 WeakPolarHBondContact O-CA 3.36Å; P389-G392 PolarHBondContact O-N 2.86Å; P389-G392 VanDerWaalsContact O-N 3.1Å; G392-L394 PolarHBondContact O-N 2.92Å; G392-A395 PolarHBondContact O-N 3.18Å; G392-I396 WeakPolarHBondContact O-CG1 3.38Å; G392-I396 PolarHBondContact O-N 3.19Å; G392-L431 VanDerWaalsContact C-CD1 3.48Å
393	V	97.5	Very high	94.2	Very high	24 Å²	24	37.1 Å²	37.1	15%	0.145	17%	0.17	C	C	.	.	H	α-helix	trans	-54.4	-51.4	173.5	168.9	0	0	0	0	111.4	P389 N391 I396 K397 G430 L431	P389-V393 PolarHBondContact O-N 3.03Å; N391-V393 PolarHBondContact O-N 2.92Å; V393-I396 PolarHBondContact O-N 3.37Å; V393-K397 WeakPolarHBondContact O-CG 3.38Å; V393-K397 PolarHBondContact O-N 2.97Å; V393-G430 WeakPolarHBondContact CG2-O 3.41Å; V393-L431 HydrophobicContact CG2-CB 4.24Å; V393-L431 HydrophobicContact CG2-CD1 4.32Å
394	L	97.9	Very high	93.5	Very high	21 Å²	21	42.3 Å²	42.3	11%	0.11	19%	0.192	C	C	.	.	H	α-helix	trans	-68.9	-35.2	-178.7	-67.4	166.2	0	0	0	112.3	M350 L353 K354 L357 E390 N391 G392 K397 I398	M350-L394 HydrophobicContact CG-CD1 3.61Å; L353-L394 HydrophobicContact CB-CB 3.75Å; L353-L394 HydrophobicContact CB-CD1 4.12Å; L353-L394 HydrophobicContact CD1-CB 3.86Å; L353-L394 HydrophobicContact CG-CB 4.44Å; K354-L394 HydrophobicContact CD-CD1 4.44Å; K354-L394 HydrophobicContact CG-CD1 3.72Å; K354-L394 HydrophobicContact CG-CD2 4.19Å; L357-L394 HydrophobicContact CD2-CD2 4.23Å; E390-L394 WeakPolarHBondContact O-CG 3.26Å; E390-L394 PolarHBondContact O-N 3.49Å; N391-L394 PolarHBondContact O-N 3.28Å; G392-L394 PolarHBondContact O-N 2.92Å; L394-K397 PolarHBondContact O-N 2.95Å; L394-I398 WeakPolarHBondContact O-CG1 3.44Å; L394-I398 PolarHBondContact O-N 3.1Å
395	A	96.6	Very high	92.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.7	-47.2	174.9	0	0	0	0	0	111.6	L353 M383 N391 G392 K397 I398 L399	L353-A395 HydrophobicContact CD1-CB 4.44Å; M383-A395 HydrophobicContact CB-CB 3.89Å; N391-A395 WeakPolarHBondContact O-CB 3.37Å; N391-A395 PolarHBondContact O-N 3.43Å; G392-A395 PolarHBondContact O-N 3.18Å; A395-K397 VanDerWaalsContact C-N 3.33Å; A395-K397 PolarHBondContact O-N 3.39Å; A395-I398 PolarHBondContact O-N 3.24Å; A395-L399 WeakPolarHBondContact O-CB 3.42Å; A395-L399 WeakPolarHBondContact O-CD1 3.19Å; A395-L399 VanDerWaalsContact O-CG 3.25Å; A395-L399 WeakPolarHBondContact O-CG 3.38Å; A395-L399 PolarHBondContact O-N 2.85Å
396	I	95.4	Very high	91.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.7	-41	175	-60.6	170.3	0	0	0	110.6	V384 G392 V393 I398 L399 M400 I420 L431 T434 A435 F438	V384-I396 HydrophobicContact CG1-CD1 4.14Å; V384-I396 HydrophobicContact CG1-CG1 4.08Å; V384-I396 HydrophobicContact CG2-CG1 4.02Å; G392-I396 WeakPolarHBondContact O-CG1 3.38Å; G392-I396 PolarHBondContact O-N 3.19Å; V393-I396 PolarHBondContact O-N 3.37Å; I396-I398 PolarHBondContact O-N 3.47Å; I396-L399 PolarHBondContact O-N 2.9Å; I396-M400 VanDerWaalsContact O-CB 3.29Å; I396-M400 WeakPolarHBondContact O-CB 3.46Å; I396-M400 PolarHBondContact O-N 3.33Å; I396-I420 HydrophobicContact CD1-CG2 4.15Å; I396-I420 HydrophobicContact CG1-CG2 4.18Å; I396-I420 HydrophobicContact CG2-CG2 4.02Å; I396-L431 HydrophobicContact CD1-CD1 3.67Å; I396-T434 HydrophobicContact CB-CG2 3.85Å; I396-T434 HydrophobicContact CG2-CG2 3.79Å; I396-A435 HydrophobicContact CD1-CB 4.15Å; I396-F438 HydrophobicContact CG2-CB 3.87Å; I396-F438 HydrophobicContact CG2-CD2 4.37Å; I396-F438 HydrophobicContact CG2-CG 4.35Å
397	K	95.7	Very high	89.6	Confident	75 Å²	75	48.4 Å²	48.4	33%	0.326	23%	0.226	S	C	.	.	H	α-helix	trans	-60.1	-42.3	176.4	-73	-173.1	177.8	-164.8	0	112.8	L357 V393 L394 A395 M400 K401 T434	L357-K397 HydrophobicContact CD1-CB 4.04Å; L357-K397 HydrophobicContact CD2-CB 4.33Å; V393-K397 WeakPolarHBondContact O-CG 3.38Å; V393-K397 PolarHBondContact O-N 2.97Å; L394-K397 PolarHBondContact O-N 2.95Å; A395-K397 VanDerWaalsContact C-N 3.33Å; A395-K397 PolarHBondContact O-N 3.39Å; K397-M400 HydrophobicContact CG-CE 4.46Å; K397-M400 PolarHBondContact O-N 2.89Å; K397-K401 WeakPolarHBondContact O-CG 3.48Å; K397-K401 PolarHBondContact O-N 3.06Å; K397-T434 HydrophobicContact CG-CG2 3.67Å
398	I	94	Very high	87.4	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64.5	-48.4	174.2	-68.3	169.8	0	0	0	110.7	L353 L356 L357 Y360 L380 L394 A395 I396 M400 K401 I402	L353-I398 HydrophobicContact CB-CD1 4.21Å; L353-I398 HydrophobicContact CD2-CD1 3.75Å; L356-I398 HydrophobicContact CB-CD1 3.8Å; L357-I398 HydrophobicContact CB-CD1 4.46Å; L357-I398 HydrophobicContact CB-CG1 4.01Å; L357-I398 HydrophobicContact CD1-CG1 4.02Å; Y360-I398 HydrophobicContact CD2-CG2 3.65Å; Y360-I398 HydrophobicContact CE2-CG2 3.66Å; Y360-I398 HydrophobicContact CG-CG2 4.24Å; L380-I398 HydrophobicContact CD1-CG2 4.12Å; L394-I398 WeakPolarHBondContact O-CG1 3.44Å; L394-I398 PolarHBondContact O-N 3.1Å; A395-I398 PolarHBondContact O-N 3.24Å; I396-I398 PolarHBondContact O-N 3.47Å; I398-M400 PolarHBondContact O-N 3.43Å; I398-K401 PolarHBondContact O-N 3.05Å; I398-I402 HydrophobicContact CG2-CD1 3.76Å; I398-I402 HydrophobicContact CG2-CG1 4.43Å; I398-I402 WeakPolarHBondContact O-CG1 3.4Å; I398-I402 PolarHBondContact O-N 3.49Å
399	L	92	Very high	85.3	Confident	8 Å²	8	47.5 Å²	47.5	4%	0.042	25%	0.249	C	C	.	.	H	α-helix	trans	-60.1	-34.8	178.7	-69.6	164.2	0	0	0	111.9	L380 L381 V384 A395 I396 Y403 I420	L380-L399 HydrophobicContact CB-CD2 4.24Å; L381-L399 HydrophobicContact CD2-CD1 3.93Å; L381-L399 HydrophobicContact CD2-CD2 3.96Å; L381-L399 HydrophobicContact CG-CD1 4.49Å; L381-L399 HydrophobicContact CG-CD2 4.12Å; V384-L399 HydrophobicContact CG2-CD1 3.7Å; A395-L399 WeakPolarHBondContact O-CB 3.42Å; A395-L399 WeakPolarHBondContact O-CD1 3.19Å; A395-L399 VanDerWaalsContact O-CG 3.25Å; A395-L399 WeakPolarHBondContact O-CG 3.38Å; A395-L399 PolarHBondContact O-N 2.85Å; I396-L399 PolarHBondContact O-N 2.9Å; L399-Y403 VanDerWaalsContact O-CB 3.3Å; L399-Y403 WeakPolarHBondContact O-CB 3.39Å; L399-Y403 PolarHBondContact O-N 3.5Å; L399-I420 HydrophobicContact CD1-CD1 4.13Å
400	M	90.6	Very high	83.4	Confident	18 Å²	18	49.3 Å²	49.3	9%	0.089	26%	0.263	C	S	.	.	H	α-helix	trans	-66.8	-35.8	173.9	-175.1	173.6	38.7	0	0	112.7	I396 K397 I398 Y403 K404 E437 F438 L441	I396-M400 VanDerWaalsContact O-CB 3.29Å; I396-M400 WeakPolarHBondContact O-CB 3.46Å; I396-M400 PolarHBondContact O-N 3.33Å; K397-M400 HydrophobicContact CG-CE 4.46Å; K397-M400 PolarHBondContact O-N 2.89Å; I398-M400 PolarHBondContact O-N 3.43Å; M400-Y403 WeakPolarHBondContact O-CB 3.22Å; M400-Y403 PolarHBondContact O-N 2.92Å; M400-K404 WeakPolarHBondContact O-CG 3.21Å; M400-K404 PolarHBondContact O-N 2.95Å; M400-E437 HydrophobicContact CE-CB 4.47Å; M400-E437 HydrophobicContact SD-CB 4.23Å; M400-F438 HydrophobicContact CB-CD2 4.03Å; M400-F438 HydrophobicContact CG-CD2 4.47Å; M400-L441 HydrophobicContact CG-CD2 3.55Å; M400-L441 HydrophobicContact SD-CD2 4.36Å
401	K	90.5	Very high	81.4	Confident	53 Å²	53	46.7 Å²	46.7	23%	0.23	25%	0.252	C	S	.	.	H	α-helix	trans	-70.9	-44.6	175	-64	-74.4	-179.6	153.3	0	111	L357 E361 K397 I398 Y403 K404 Q405	L357-K401 HydrophobicContact CD1-CG 4.32Å; E361-K401 HydrophobicContact CG-CD 4.18Å; E361-K401 WeakPolarHBondContact OE1-CE 3.38Å; E361-K401 IonicContact OE1-NZ 2.8Å; E361-K401 PolarHBondContact OE1-NZ 3.49Å; K397-K401 WeakPolarHBondContact O-CG 3.48Å; K397-K401 PolarHBondContact O-N 3.06Å; I398-K401 PolarHBondContact O-N 3.05Å; K401-Y403 VanDerWaalsContact C-N 3.27Å; K401-Y403 PolarHBondContact O-N 3.31Å; K401-K404 PolarHBondContact O-N 3.15Å; K401-K404 VanDerWaalsContact O-N 3.09Å; K401-Q405 PolarHBondContact O-N 3.09Å; K401-Q405 VanDerWaalsContact O-N 3.11Å
402	I	87.7	Confident	79.3	Confident	24 Å²	24	47.6 Å²	47.6	12%	0.123	26%	0.258	C	S	.	.	H	α-helix	trans	-56.3	-43.7	170.9	-62.7	164	0	0	0	110.1	Y360 T373 L380 I398 K404 Q405 A406 L411	Y360-I402 HydrophobicContact CD1-CD1 4.3Å; Y360-I402 HydrophobicContact CD1-CG1 3.63Å; Y360-I402 HydrophobicContact CE1-CD1 3.78Å; Y360-I402 HydrophobicContact CE1-CG1 3.47Å; Y360-I402 VanDerWaalsContact CE1-CG1 3.47Å; Y360-I402 HydrophobicContact CG-CG1 4.43Å; T373-I402 HydrophobicContact CG2-CD1 3.7Å; T373-I402 HydrophobicContact CG2-CG1 4.09Å; T373-I402 HydrophobicContact CG2-CG2 4.19Å; L380-I402 HydrophobicContact CD1-CD1 4.24Å; I398-I402 HydrophobicContact CG2-CD1 3.76Å; I398-I402 HydrophobicContact CG2-CG1 4.43Å; I398-I402 WeakPolarHBondContact O-CG1 3.4Å; I398-I402 PolarHBondContact O-N 3.49Å; I402-K404 VanDerWaalsContact C-N 3.29Å; I402-K404 PolarHBondContact O-N 3.41Å; I402-Q405 PolarHBondContact O-N 2.97Å; I402-A406 PolarHBondContact O-N 2.59Å; I402-A406 VanDerWaalsContact O-N 3.17Å; I402-L411 HydrophobicContact CG2-CD1 4.24Å; I402-L411 WeakPolarHBondContact O-CD1 3.34Å
403	Y	85	Confident	77.2	Confident	33 Å²	33	53.2 Å²	53.2	13%	0.129	29%	0.287	C	S	.	.	H	α-helix	trans	-55.6	-40.9	176.1	-168	-75.1	0	0	0	112.5	L399 M400 K401 L411 F438 L441 D442 S445	L399-Y403 VanDerWaalsContact O-CB 3.3Å; L399-Y403 WeakPolarHBondContact O-CB 3.39Å; L399-Y403 PolarHBondContact O-N 3.5Å; M400-Y403 WeakPolarHBondContact O-CB 3.22Å; M400-Y403 PolarHBondContact O-N 2.92Å; K401-Y403 VanDerWaalsContact C-N 3.27Å; K401-Y403 PolarHBondContact O-N 3.31Å; Y403-L411 HydrophobicContact CD1-CD2 4.23Å; Y403-L411 HydrophobicContact CD2-CD2 3.6Å; Y403-L411 HydrophobicContact CD2-CG 3.92Å; Y403-L411 HydrophobicContact CE1-CD2 4.34Å; Y403-L411 HydrophobicContact CE2-CD2 3.76Å; Y403-L411 HydrophobicContact CE2-CG 4.38Å; Y403-L411 HydrophobicContact CG-CD2 3.86Å; Y403-L411 HydrophobicContact CG-CG 4.34Å; Y403-F438 AromaticContact CD2-CE2 3.98Å; Y403-F438 HydrophobicContact CD2-CE2 3.98Å; Y403-F438 AromaticContact CD2-CZ 3.75Å; Y403-F438 HydrophobicContact CD2-CZ 3.75Å; Y403-F438 HydrophobicContact CE2-CZ 4.28Å; Y403-F438 HydrophobicContact CG-CE2 4.24Å; Y403-F438 HydrophobicContact CG-CZ 4.44Å; Y403-L441 HydrophobicContact CD1-CD2 3.6Å; Y403-L441 HydrophobicContact CD1-CG 3.93Å; Y403-L441 HydrophobicContact CE1-CD2 4.31Å; Y403-L441 HydrophobicContact CE1-CG 4.14Å; Y403-L441 HydrophobicContact CG-CD2 4.19Å; Y403-D442 PolarHBondContact OH-OD1 3.44Å; Y403-S445 PolarHBondContact OH-OG 3.49Å
404	K	82.7	Confident	75.4	Confident	108 Å²	108	58 Å²	58	47%	0.47	31%	0.308	S	S	.	.	H	α-helix	trans	-75	-33.3	-179.7	-69.5	177.9	-175.2	-178	0	114	M400 K401 I402 L441	M400-K404 WeakPolarHBondContact O-CG 3.21Å; M400-K404 PolarHBondContact O-N 2.95Å; K401-K404 PolarHBondContact O-N 3.15Å; K401-K404 VanDerWaalsContact O-N 3.09Å; I402-K404 VanDerWaalsContact C-N 3.29Å; I402-K404 PolarHBondContact O-N 3.41Å; K404-L441 HydrophobicContact CD-CD1 4.47Å; K404-L441 HydrophobicContact CD-CD2 4.28Å; K404-L441 VanDerWaalsContact CE-CD2 3.47Å; K404-L441 HydrophobicContact CG-CD1 4.12Å; K404-L441 HydrophobicContact CG-CD2 3.75Å
405	Q	78.6	Confident	73.5	Confident	54 Å²	54	63.1 Å²	63.1	25%	0.252	33%	0.334	S	S	.	.	H	α-helix	trans	-84.7	-21.9	-173.4	-75.9	173.1	-15	0	0	114	Y360 K401 I402 D407	Y360-Q405 PolarHBondContact O-NE2 2.81Å; K401-Q405 PolarHBondContact O-N 3.09Å; K401-Q405 VanDerWaalsContact O-N 3.11Å; I402-Q405 PolarHBondContact O-N 2.97Å; Q405-D407 PolarHBondContact O-N 3.48Å
406	A	66.9	Low	72.3	Confident	19 Å²	19	66.5 Å²	66.5	16%	0.157	35%	0.35	C	S	.	.			trans	-67.2	117.4	178.5	0	0	0	0	0	112.2	I402 S410 L411	I402-A406 PolarHBondContact O-N 2.59Å; I402-A406 VanDerWaalsContact O-N 3.17Å; A406-S410 WeakPolarHBondContact CB-OG 3.38Å; A406-L411 HydrophobicContact CB-CD1 3.19Å; A406-L411 HydrophobicContact CB-CD2 4.08Å; A406-L411 HydrophobicContact CB-CG 4.1Å
407	D	56.3	Low	71.7	Confident	147 Å²	147	66.5 Å²	66.5	79%	0.786	35%	0.35	S	S	*	.			trans	-56.5	141.6	140.4	-79	-37.4	0	0	0	108.1	Q405 D409 S410	Q405-D407 PolarHBondContact O-N 3.48Å; D407-D409 PolarHBondContact O-N 2.59Å; D407-S410 PolarHBondContact O-N 3.32Å; D407-S410 PolarHBondContact O-OG 3.04Å
408	S	49.3	Very low	71.2	Confident	113 Å²	113	67.3 Å²	67.3	79%	0.79	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-9.5	-151	-50.1	0	0	0	0	118.1
409	D	50.4	Low	71	Confident	169 Å²	169	70 Å²	70	90%	0.904	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	1.1	-174.2	-62.9	-30	0	0	0	114.4	D407	D407-D409 PolarHBondContact O-N 2.59Å
410	S	53.7	Low	71	Confident	78 Å²	78	69.6 Å²	69.6	55%	0.545	37%	0.372	S	S	.	.	S	Bend	trans	-116.8	9.5	-172.2	57.2	0	0	0	0	116.5	A406 D407	A406-S410 WeakPolarHBondContact CB-OG 3.38Å; D407-S410 PolarHBondContact O-N 3.32Å; D407-S410 PolarHBondContact O-OG 3.04Å
411	L	53.5	Low	71	Confident	37 Å²	37	69.8 Å²	69.8	19%	0.194	37%	0.372	C	S	.	.	S	Bend	trans	-94	168.1	-174.2	-114.4	34.9	0	0	0	114.8	K377 I402 Y403 A406 L413	K377-L411 PolarHBondContact NZ-O 3.31Å; I402-L411 HydrophobicContact CG2-CD1 4.24Å; I402-L411 WeakPolarHBondContact O-CD1 3.34Å; Y403-L411 HydrophobicContact CD1-CD2 4.23Å; Y403-L411 HydrophobicContact CD2-CD2 3.6Å; Y403-L411 HydrophobicContact CD2-CG 3.92Å; Y403-L411 HydrophobicContact CE1-CD2 4.34Å; Y403-L411 HydrophobicContact CE2-CD2 3.76Å; Y403-L411 HydrophobicContact CE2-CG 4.38Å; Y403-L411 HydrophobicContact CG-CD2 3.86Å; Y403-L411 HydrophobicContact CG-CG 4.34Å; A406-L411 HydrophobicContact CB-CD1 3.19Å; A406-L411 HydrophobicContact CB-CD2 4.08Å; A406-L411 HydrophobicContact CB-CG 4.1Å; L411-L413 PolarHBondContact O-N 3.42Å
412	P	53.4	Low	71.1	Confident	19 Å²	19	67.6 Å²	67.6	12%	0.123	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-57.5	131.8	160.7	-12.2	29.1	0	0	0	108.7	E416	P412-E416 WeakPolarHBondContact CA-OE2 3.43Å; P412-E416 HydrophobicContact CB-CB 3.48Å; P412-E416 VanDerWaalsContact CB-CB 3.48Å; P412-E416 HydrophobicContact CB-CG 4.28Å; P412-E416 WeakPolarHBondContact CB-OE2 3.16Å
413	L	53.9	Low	71.4	Confident	118 Å²	118	66.4 Å²	66.4	62%	0.618	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-53.9	148.2	160.2	-88.4	74.6	0	0	0	107.1	L411 I415 E416	L411-L413 PolarHBondContact O-N 3.42Å; L413-I415 PolarHBondContact O-N 2.95Å; L413-E416 WeakPolarHBondContact O-CB 3.37Å; L413-E416 PolarHBondContact O-N 3.33Å
414	H	59.5	Low	71.8	Confident	123 Å²	123	64.9 Å²	64.9	57%	0.569	35%	0.352	S	S	*	.	H	α-helix	trans	-47.5	-33	-179.1	-77.8	-74.5	0	0	0	113.7	E416 C417 D442	H414-E416 VanDerWaalsContact C-N 3.3Å; H414-E416 PolarHBondContact O-N 3.38Å; H414-C417 WeakPolarHBondContact O-CA 3.28Å; H414-C417 WeakPolarHBondContact O-CB 3.45Å; H414-C417 PolarHBondContact O-N 3.1Å; H414-D442 IonicContact CE1-OD1 3.14Å; H414-D442 PolarHBondContact CE1-OD1 3.45Å; H414-D442 IonicContact CE1-OD2 2.81Å; H414-D442 IonicContact ND1-OD1 2.71Å; H414-D442 IonicContact ND1-OD2 3.87Å
415	I	58.5	Low	72.4	Confident	129 Å²	129	59.9 Å²	59.9	66%	0.662	33%	0.33	S	S	*	.	H	α-helix	trans	-54.5	-36.9	173.6	-55.6	169.9	0	0	0	113.4	L413 C417	L413-I415 PolarHBondContact O-N 2.95Å; I415-C417 VanDerWaalsContact C-N 3.28Å; I415-C417 PolarHBondContact O-N 3.13Å
416	E	71.2	Confident	73	Confident	71 Å²	71	57.4 Å²	57.4	33%	0.332	32%	0.319	S	S	.	.	H	α-helix	trans	-74.4	-18.8	176.6	-72.4	178.1	-144	0	0	112.4	K377 L381 P412 L413 H414	K377-E416 WeakPolarHBondContact CE-OE2 3.38Å; K377-E416 VanDerWaalsContact NZ-CD 3.33Å; K377-E416 IonicContact NZ-OE1 3.84Å; K377-E416 PolarHBondContact NZ-OE1 3.05Å; K377-E416 VanDerWaalsContact NZ-OE1 3.1Å; K377-E416 IonicContact NZ-OE2 3.73Å; K377-E416 PolarHBondContact NZ-OE2 2.64Å; L381-E416 HydrophobicContact CD1-CB 4.36Å; L381-E416 HydrophobicContact CD1-CG 4.49Å; L381-E416 WeakPolarHBondContact CD1-OE2 3.33Å; P412-E416 WeakPolarHBondContact CA-OE2 3.43Å; P412-E416 HydrophobicContact CB-CB 3.48Å; P412-E416 VanDerWaalsContact CB-CB 3.48Å; P412-E416 HydrophobicContact CB-CG 4.28Å; P412-E416 WeakPolarHBondContact CB-OE2 3.16Å; L413-E416 WeakPolarHBondContact O-CB 3.37Å; L413-E416 PolarHBondContact O-N 3.33Å; H414-E416 VanDerWaalsContact C-N 3.3Å; H414-E416 PolarHBondContact O-N 3.38Å
417	C	82.6	Confident	74.1	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.007	33%	0.33	C	S	.	.	H	α-helix	trans	-86.3	-14.3	179.2	-65.8	0	0	0	0	113.6	H414 I415 T419 I420 Y421 F438	H414-C417 WeakPolarHBondContact O-CA 3.28Å; H414-C417 WeakPolarHBondContact O-CB 3.45Å; H414-C417 PolarHBondContact O-N 3.1Å; I415-C417 VanDerWaalsContact C-N 3.28Å; I415-C417 PolarHBondContact O-N 3.13Å; C417-T419 PolarHBondContact O-N 3.16Å; C417-T419 VanDerWaalsContact O-N 3.09Å; C417-I420 WeakPolarHBondContact O-CA 3.5Å; C417-I420 WeakPolarHBondContact O-CB 3.38Å; C417-I420 PolarHBondContact O-N 3.24Å; C417-Y421 HydrophobicContact CB-CD2 4.18Å; C417-Y421 HydrophobicContact CB-CE1 4.19Å; C417-Y421 HydrophobicContact CB-CE2 3.45Å; C417-Y421 VanDerWaalsContact CB-CE2 3.45Å; C417-Y421 VanDerWaalsContact CB-CZ 3.48Å; C417-Y421 WeakPolarHBondContact O-CD2 3.28Å; C417-Y421 PolarHBondContact O-N 3.27Å; C417-F438 HydrophobicContact CB-CE1 4.18Å
418	D	85.8	Confident	75.8	Confident	92 Å²	92	55 Å²	55	49%	0.492	31%	0.308	S	S	.	.	H	α-helix	trans	-53.3	-34.8	-179	-70.2	-22.9	0	0	0	113.1	Y421 A422	D418-Y421 PolarHBondContact O-N 3.34Å; D418-A422 WeakPolarHBondContact O-CB 3.42Å; D418-A422 PolarHBondContact O-N 2.84Å
419	T	87.8	Confident	77.9	Confident	55 Å²	55	52 Å²	52	34%	0.337	28%	0.279	S	S	.	.	H	α-helix	trans	-67.5	-35	175.2	-60.1	0	0	0	0	112.4	V384 L385 C417 C423	V384-T419 HydrophobicContact CB-CG2 4.4Å; V384-T419 HydrophobicContact CG1-CG2 4.08Å; L385-T419 HydrophobicContact CD1-CG2 3.67Å; L385-T419 HydrophobicContact CD2-CG2 3.87Å; L385-T419 HydrophobicContact CG-CG2 3.55Å; C417-T419 PolarHBondContact O-N 3.16Å; C417-T419 VanDerWaalsContact O-N 3.09Å; T419-C423 PolarHBondContact O-N 3.29Å; T419-C423 PolarHBondContact O-SG 3.04Å
420	I	92.2	Very high	80	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-72.6	-44.1	175.7	-53.7	172.8	0	0	0	109.5	V384 I396 L399 C417 A422 C423 A435 F438	V384-I420 HydrophobicContact CG1-CG1 4.24Å; V384-I420 HydrophobicContact CG2-CG1 4.04Å; I396-I420 HydrophobicContact CD1-CG2 4.15Å; I396-I420 HydrophobicContact CG1-CG2 4.18Å; I396-I420 HydrophobicContact CG2-CG2 4.02Å; L399-I420 HydrophobicContact CD1-CD1 4.13Å; C417-I420 WeakPolarHBondContact O-CA 3.5Å; C417-I420 WeakPolarHBondContact O-CB 3.38Å; C417-I420 PolarHBondContact O-N 3.24Å; I420-A422 VanDerWaalsContact C-N 3.34Å; I420-A422 PolarHBondContact O-N 3.41Å; I420-C423 WeakPolarHBondContact O-CB 3.4Å; I420-C423 PolarHBondContact O-N 3.43Å; I420-C423 VanDerWaalsContact O-N 3.13Å; I420-A435 HydrophobicContact CG2-CB 4.42Å; I420-A435 WeakPolarHBondContact O-CB 3.49Å; I420-F438 HydrophobicContact CB-CD1 4.27Å; I420-F438 HydrophobicContact CB-CE1 4.43Å; I420-F438 HydrophobicContact CD1-CD1 4.36Å; I420-F438 HydrophobicContact CD1-CD2 4.45Å; I420-F438 HydrophobicContact CD1-CE1 3.99Å; I420-F438 HydrophobicContact CD1-CE2 4.09Å; I420-F438 HydrophobicContact CD1-CZ 3.85Å; I420-F438 HydrophobicContact CG2-CB 4.04Å; I420-F438 HydrophobicContact CG2-CD1 3.6Å; I420-F438 HydrophobicContact CG2-CE1 4.2Å; I420-F438 HydrophobicContact CG2-CG 3.8Å
421	Y	91.5	Very high	82	Confident	21 Å²	21	42 Å²	42	8%	0.082	23%	0.226	C	C	.	.	H	α-helix	trans	-64.3	-38.1	177.9	-50.5	-48.9	0	0	0	112	C417 D418 C423 V424 F438 F439 D442 F465	C417-Y421 HydrophobicContact CB-CD2 4.18Å; C417-Y421 HydrophobicContact CB-CE1 4.19Å; C417-Y421 HydrophobicContact CB-CE2 3.45Å; C417-Y421 VanDerWaalsContact CB-CE2 3.45Å; C417-Y421 VanDerWaalsContact CB-CZ 3.48Å; C417-Y421 WeakPolarHBondContact O-CD2 3.28Å; C417-Y421 PolarHBondContact O-N 3.27Å; D418-Y421 PolarHBondContact O-N 3.34Å; Y421-C423 VanDerWaalsContact C-N 3.25Å; Y421-C423 PolarHBondContact O-N 3.18Å; Y421-V424 WeakPolarHBondContact O-CB 3.14Å; Y421-V424 WeakPolarHBondContact O-CG2 3.4Å; Y421-V424 PolarHBondContact O-N 2.76Å; Y421-V424 VanDerWaalsContact O-N 3.11Å; Y421-F438 HydrophobicContact CE1-CD1 4.16Å; Y421-F438 AromaticContact CE1-CE1 3.99Å; Y421-F438 HydrophobicContact CE1-CE1 3.99Å; Y421-F439 HydrophobicContact CD1-CB 4.28Å; Y421-F439 AromaticContact CD1-CD2 3.71Å; Y421-F439 HydrophobicContact CD1-CD2 3.71Å; Y421-F439 HydrophobicContact CD1-CG 4.4Å; Y421-F439 AromaticContact CE1-CD2 3.91Å; Y421-F439 HydrophobicContact CE1-CD2 3.91Å; Y421-D442 HydrophobicContact CE1-CB 4.45Å; Y421-D442 VanDerWaalsContact OH-CG 3.25Å; Y421-D442 PolarHBondContact OH-OD2 2.69Å; Y421-F465 HydrophobicContact CG-CE2 4.44Å
422	A	91.7	Very high	84	Confident	7 Å²	7	40.2 Å²	40.2	6%	0.058	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-32.7	173.7	0	0	0	0	0	112.9	D418 I420 V424 Y425 I471 L1077 L1080	D418-A422 WeakPolarHBondContact O-CB 3.42Å; D418-A422 PolarHBondContact O-N 2.84Å; I420-A422 VanDerWaalsContact C-N 3.34Å; I420-A422 PolarHBondContact O-N 3.41Å; A422-V424 PolarHBondContact O-N 3.29Å; A422-V424 VanDerWaalsContact O-N 3.15Å; A422-Y425 PolarHBondContact O-N 2.69Å; A422-I471 HydrophobicContact CB-CD1 4.04Å; A422-L1077 HydrophobicContact CB-CD1 4.36Å; A422-L1077 HydrophobicContact CB-CD2 4.07Å; A422-L1077 HydrophobicContact CB-CG 4.24Å; A422-L1080 HydrophobicContact CB-CD1 4.15Å
423	C	94.2	Very high	86	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-63.8	-14.9	175.6	-74.2	0	0	0	0	114.2	T419 I420 Y421 Y425 A426 L431 A432 A435	T419-C423 PolarHBondContact O-N 3.29Å; T419-C423 PolarHBondContact O-SG 3.04Å; I420-C423 WeakPolarHBondContact O-CB 3.4Å; I420-C423 PolarHBondContact O-N 3.43Å; I420-C423 VanDerWaalsContact O-N 3.13Å; Y421-C423 VanDerWaalsContact C-N 3.25Å; Y421-C423 PolarHBondContact O-N 3.18Å; C423-Y425 PolarHBondContact O-N 3.48Å; C423-A426 WeakPolarHBondContact O-CB 3.35Å; C423-A426 PolarHBondContact O-N 3.32Å; C423-L431 HydrophobicContact CB-CD2 4.4Å; C423-L431 HydrophobicContact CB-CG 4.2Å; C423-A432 VanDerWaalsContact O-CA 3.28Å; C423-A432 WeakPolarHBondContact O-CA 3.46Å; C423-A435 HydrophobicContact CB-CB 3.77Å
424	V	94.6	Very high	88	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-57.1	-26.7	169.7	176.7	0	0	0	0	111.5	Y421 A422 A435 F439 F465 L478 A481 R538	Y421-V424 WeakPolarHBondContact O-CB 3.14Å; Y421-V424 WeakPolarHBondContact O-CG2 3.4Å; Y421-V424 PolarHBondContact O-N 2.76Å; Y421-V424 VanDerWaalsContact O-N 3.11Å; A422-V424 PolarHBondContact O-N 3.29Å; A422-V424 VanDerWaalsContact O-N 3.15Å; V424-A435 HydrophobicContact CG2-CB 3.88Å; V424-F439 HydrophobicContact CG2-CB 4.46Å; V424-F465 HydrophobicContact CG1-CE1 4.43Å; V424-L478 HydrophobicContact CG1-CD1 3.61Å; V424-A481 HydrophobicContact CG1-CB 3.67Å; V424-A481 WeakPolarHBondContact O-CB 3.47Å; V424-R538 PolarHBondContact O-NH2 3.05Å
425	Y	93.8	Very high	89.7	Confident	3 Å²	3	29.4 Å²	29.4	1%	0.012	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-96.2	4.8	175.6	-60.9	-77.9	0	0	0	114.2	A422 C423 F465 H466 S469 I471 H472 F477 L478	A422-Y425 PolarHBondContact O-N 2.69Å; C423-Y425 PolarHBondContact O-N 3.48Å; Y425-F465 AromaticContact CE2-CE1 3.89Å; Y425-F465 HydrophobicContact CE2-CE1 3.89Å; Y425-F465 HydrophobicContact CE2-CZ 4.06Å; Y425-H466 AromaticContact CZ-ND1 3.81Å; Y425-H466 PolarHBondContact OH-ND1 2.98Å; Y425-S469 PolarHBondContact OH-OG 2.97Å; Y425-I471 HydrophobicContact CD2-CB 4.11Å; Y425-I471 HydrophobicContact CD2-CD1 3.78Å; Y425-I471 HydrophobicContact CD2-CG1 4.43Å; Y425-I471 HydrophobicContact CD2-CG2 4.27Å; Y425-I471 HydrophobicContact CE2-CB 4.45Å; Y425-I471 HydrophobicContact CE2-CD1 4.24Å; Y425-I471 HydrophobicContact CG-CB 4.34Å; Y425-I471 HydrophobicContact CG-CG2 4.16Å; Y425-H472 HydrophobicContact CD1-CB 4.4Å; Y425-H472 AromaticContact CD1-CD2 3.35Å; Y425-H472 WeakPolarHBondContact CD1-CD2 3.16Å; Y425-H472 HydrophobicContact CE1-CB 4.42Å; Y425-H472 AromaticContact CG-CD2 3.75Å; Y425-F477 HydrophobicContact CD1-CB 4.03Å; Y425-L478 HydrophobicContact CE1-CB 3.92Å
426	A	92.4	Very high	91.4	Very high	3 Å²	3	23.3 Å²	23.3	3%	0.025	13%	0.131	C	C	.	.			trans	-61.2	143.2	-178	0	0	0	0	0	112.4	C423 H428 L431 R538 L1080	C423-A426 WeakPolarHBondContact O-CB 3.35Å; C423-A426 PolarHBondContact O-N 3.32Å; A426-H428 VanDerWaalsContact C-N 3.27Å; A426-H428 PolarHBondContact O-N 3.5Å; A426-L431 HydrophobicContact CB-CD2 4.05Å; A426-L431 HydrophobicContact CB-CG 4.44Å; A426-R538 PolarHBondContact O-NE 3.11Å; A426-R538 PolarHBondContact O-NH2 3.02Å; A426-L1080 HydrophobicContact CB-CD2 4.3Å
427	A	90.2	Very high	92.5	Very high	46 Å²	46	23.3 Å²	23.3	38%	0.38	13%	0.131	S	C	.	.	S	Bend	trans	-65.8	-28.6	174.6	0	0	0	0	0	112.8	R429 L1080	A427-R429 PolarHBondContact O-N 3.07Å; A427-R429 VanDerWaalsContact O-N 3.16Å; A427-L1080 PolarHBondContact N-O 2.87Å
428	H	92.1	Very high	92.9	Very high	70 Å²	70	23.3 Å²	23.3	32%	0.324	13%	0.131	S	C	.	.	S	Bend	trans	-77.3	99.8	174.7	-178.5	-100.3	0	0	0	110.8	P389 A426 G430 L431 A432	P389-H428 HydrophobicContact CB-CB 4.04Å; P389-H428 HydrophobicContact CG-CB 4.33Å; A426-H428 VanDerWaalsContact C-N 3.27Å; A426-H428 PolarHBondContact O-N 3.5Å; H428-G430 VanDerWaalsContact C-N 3.27Å; H428-G430 PolarHBondContact O-N 3.01Å; H428-G430 VanDerWaalsContact O-N 3.1Å; H428-L431 HydrophobicContact CB-CB 4.26Å; H428-L431 PolarHBondContact ND1-N 2.71Å; H428-L431 VanDerWaalsContact ND1-N 3.15Å; H428-L431 WeakPolarHBondContact O-CB 3.42Å; H428-L431 PolarHBondContact O-N 3.08Å; H428-A432 PolarHBondContact O-N 2.74Å; H428-A432 VanDerWaalsContact O-N 3.17Å
429	R	93.6	Very high	93.1	Very high	48 Å²	48	19.4 Å²	19.4	18%	0.181	11%	0.11	C	C	.	.	H	α-helix	trans	-47.6	-42.8	-175.4	-170.3	174.5	-169.5	-103.2	-2	113.9	A427 L431 A432 L433 D480 E484 R538	A427-R429 PolarHBondContact O-N 3.07Å; A427-R429 VanDerWaalsContact O-N 3.16Å; R429-L431 VanDerWaalsContact C-N 3.3Å; R429-L431 PolarHBondContact O-N 3.31Å; R429-A432 PolarHBondContact O-N 2.79Å; R429-L433 HydrophobicContact CG-CD1 3.93Å; R429-L433 HydrophobicContact CG-CG 4.2Å; R429-L433 WeakPolarHBondContact O-CG 3.37Å; R429-L433 PolarHBondContact O-N 2.91Å; R429-D480 IonicContact CZ-OD1 2.84Å; R429-D480 VanDerWaalsContact CZ-OD1 3.27Å; R429-D480 IonicContact NE-OD1 3.25Å; R429-D480 PolarHBondContact NE-OD1 3.2Å; R429-D480 IonicContact NE-OD2 3.04Å; R429-D480 PolarHBondContact NE-OD2 3.06Å; R429-D480 IonicContact NH2-OD1 2.69Å; R429-D480 PolarHBondContact NH2-OD1 2.82Å; R429-E484 IonicContact CZ-OE1 3Å; R429-E484 IonicContact NH1-OE1 2.87Å; R429-E484 PolarHBondContact NH1-OE1 3.2Å; R429-E484 IonicContact NH2-OE1 3.23Å; R429-E484 PolarHBondContact NH2-OE1 3.02Å; R429-R538 HydrophobicContact CB-CB 4Å; R429-R538 HydrophobicContact CB-CG 4.05Å; R429-R538 HydrophobicContact CG-CB 4.26Å; R429-R538 HydrophobicContact CG-CG 4.5Å
430	G	93.6	Very high	93.1	Very high	28 Å²	28	18 Å²	18	29%	0.289	10%	0.1	S	C	.	.	H	α-helix	trans	-63.7	-32.3	179.4	0	0	0	0	0	114.1	V393 H428 T434	V393-G430 WeakPolarHBondContact CG2-O 3.41Å; H428-G430 VanDerWaalsContact C-N 3.27Å; H428-G430 PolarHBondContact O-N 3.01Å; H428-G430 VanDerWaalsContact O-N 3.1Å; G430-T434 PolarHBondContact O-N 3.32Å; G430-T434 PolarHBondContact O-OG1 3.47Å
431	L	95.3	Very high	92.8	Very high	10 Å²	10	19.4 Å²	19.4	5%	0.052	11%	0.108	C	C	.	.	H	α-helix	trans	-73.2	-42.9	175.6	-175.6	66.9	0	0	0	110.1	G392 V393 I396 C423 A426 H428 R429 T434 A435	G392-L431 VanDerWaalsContact C-CD1 3.48Å; V393-L431 HydrophobicContact CG2-CB 4.24Å; V393-L431 HydrophobicContact CG2-CD1 4.32Å; I396-L431 HydrophobicContact CD1-CD1 3.67Å; C423-L431 HydrophobicContact CB-CD2 4.4Å; C423-L431 HydrophobicContact CB-CG 4.2Å; A426-L431 HydrophobicContact CB-CD2 4.05Å; A426-L431 HydrophobicContact CB-CG 4.44Å; H428-L431 HydrophobicContact CB-CB 4.26Å; H428-L431 PolarHBondContact ND1-N 2.71Å; H428-L431 VanDerWaalsContact ND1-N 3.15Å; H428-L431 WeakPolarHBondContact O-CB 3.42Å; H428-L431 PolarHBondContact O-N 3.08Å; R429-L431 VanDerWaalsContact C-N 3.3Å; R429-L431 PolarHBondContact O-N 3.31Å; L431-T434 PolarHBondContact O-N 3.47Å; L431-A435 WeakPolarHBondContact O-CB 3.49Å; L431-A435 PolarHBondContact O-N 3.01Å
432	A	95.7	Very high	92.5	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.4	-45.7	177.7	0	0	0	0	0	113.4	C423 H428 R429 T434 A435 G436 A481	C423-A432 VanDerWaalsContact O-CA 3.28Å; C423-A432 WeakPolarHBondContact O-CA 3.46Å; H428-A432 PolarHBondContact O-N 2.74Å; H428-A432 VanDerWaalsContact O-N 3.17Å; R429-A432 PolarHBondContact O-N 2.79Å; A432-T434 VanDerWaalsContact C-N 3.34Å; A432-T434 PolarHBondContact O-N 3.49Å; A432-A435 WeakPolarHBondContact O-CB 3.39Å; A432-A435 PolarHBondContact O-N 3.06Å; A432-G436 PolarHBondContact O-N 3.3Å; A432-A481 HydrophobicContact CB-CB 4.14Å
433	L	95.7	Very high	91.9	Very high	24 Å²	24	19.4 Å²	19.4	13%	0.126	11%	0.108	C	C	.	.	H	α-helix	trans	-58.7	-45.3	174.7	-70.6	168.6	0	0	0	111.6	R429 A435 G436 E437 D480	R429-L433 HydrophobicContact CG-CD1 3.93Å; R429-L433 HydrophobicContact CG-CG 4.2Å; R429-L433 WeakPolarHBondContact O-CG 3.37Å; R429-L433 PolarHBondContact O-N 2.91Å; L433-A435 VanDerWaalsContact C-N 3.33Å; L433-A435 PolarHBondContact O-N 3.06Å; L433-G436 WeakPolarHBondContact O-CA 3.48Å; L433-G436 PolarHBondContact O-N 2.92Å; L433-G436 VanDerWaalsContact O-N 3.14Å; L433-E437 PolarHBondContact O-N 3.36Å; L433-D480 VanDerWaalsContact CD2-O 3.27Å; L433-D480 WeakPolarHBondContact CD2-O 3.45Å
434	T	96.1	Very high	91	Very high	9 Å²	9	21.2 Å²	21.2	6%	0.055	12%	0.119	C	C	.	.	H	α-helix	trans	-67.7	-34.6	179.6	-48	0	0	0	0	111.9	I396 K397 G430 L431 A432 F438	I396-T434 HydrophobicContact CB-CG2 3.85Å; I396-T434 HydrophobicContact CG2-CG2 3.79Å; K397-T434 HydrophobicContact CG-CG2 3.67Å; G430-T434 PolarHBondContact O-N 3.32Å; G430-T434 PolarHBondContact O-OG1 3.47Å; L431-T434 PolarHBondContact O-N 3.47Å; A432-T434 VanDerWaalsContact C-N 3.34Å; A432-T434 PolarHBondContact O-N 3.49Å; T434-F438 PolarHBondContact O-N 3.32Å
435	A	95.2	Very high	89.9	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-67.1	-37.6	171	0	0	0	0	0	112.1	I396 I420 C423 V424 L431 A432 L433 F438 F439	I396-A435 HydrophobicContact CD1-CB 4.15Å; I420-A435 HydrophobicContact CG2-CB 4.42Å; I420-A435 WeakPolarHBondContact O-CB 3.49Å; C423-A435 HydrophobicContact CB-CB 3.77Å; V424-A435 HydrophobicContact CG2-CB 3.88Å; L431-A435 WeakPolarHBondContact O-CB 3.49Å; L431-A435 PolarHBondContact O-N 3.01Å; A432-A435 WeakPolarHBondContact O-CB 3.39Å; A432-A435 PolarHBondContact O-N 3.06Å; L433-A435 VanDerWaalsContact C-N 3.33Å; L433-A435 PolarHBondContact O-N 3.06Å; A435-F438 PolarHBondContact O-N 3.37Å; A435-F439 WeakPolarHBondContact O-CB 3.13Å; A435-F439 PolarHBondContact O-N 3.45Å
436	G	94.3	Very high	88.2	Confident	0 Å²	0	27 Å²	27	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.8	-42.9	173.3	0	0	0	0	0	112.9	A432 L433 F438 F439 L440 L482	A432-G436 PolarHBondContact O-N 3.3Å; L433-G436 WeakPolarHBondContact O-CA 3.48Å; L433-G436 PolarHBondContact O-N 2.92Å; L433-G436 VanDerWaalsContact O-N 3.14Å; G436-F438 PolarHBondContact O-N 3.32Å; G436-F439 PolarHBondContact O-N 3.11Å; G436-L440 WeakPolarHBondContact O-CB 3.28Å; G436-L440 PolarHBondContact O-N 3.44Å; G436-L482 WeakPolarHBondContact O-CD2 3.35Å
437	E	93.6	Very high	86.3	Confident	71 Å²	71	29 Å²	29	33%	0.332	18%	0.176	S	C	.	.	H	α-helix	trans	-58	-45.2	171.6	-72.2	179.8	175.7	0	0	112.1	M400 L433 L440 L441	M400-E437 HydrophobicContact CE-CB 4.47Å; M400-E437 HydrophobicContact SD-CB 4.23Å; L433-E437 PolarHBondContact O-N 3.36Å; E437-L440 PolarHBondContact O-N 3.03Å; E437-L441 PolarHBondContact O-N 2.89Å
438	F	91.9	Very high	84.4	Confident	2 Å²	2	28.6 Å²	28.6	1%	0.009	18%	0.177	C	C	.	.	H	α-helix	trans	-64.2	-44.2	176.9	-178.1	-84.3	0	0	0	111.8	I396 M400 Y403 C417 I420 Y421 T434 A435 G436 L441 D442	I396-F438 HydrophobicContact CG2-CB 3.87Å; I396-F438 HydrophobicContact CG2-CD2 4.37Å; I396-F438 HydrophobicContact CG2-CG 4.35Å; M400-F438 HydrophobicContact CB-CD2 4.03Å; M400-F438 HydrophobicContact CG-CD2 4.47Å; Y403-F438 AromaticContact CD2-CE2 3.98Å; Y403-F438 HydrophobicContact CD2-CE2 3.98Å; Y403-F438 AromaticContact CD2-CZ 3.75Å; Y403-F438 HydrophobicContact CD2-CZ 3.75Å; Y403-F438 HydrophobicContact CE2-CZ 4.28Å; Y403-F438 HydrophobicContact CG-CE2 4.24Å; Y403-F438 HydrophobicContact CG-CZ 4.44Å; C417-F438 HydrophobicContact CB-CE1 4.18Å; I420-F438 HydrophobicContact CB-CD1 4.27Å; I420-F438 HydrophobicContact CB-CE1 4.43Å; I420-F438 HydrophobicContact CD1-CD1 4.36Å; I420-F438 HydrophobicContact CD1-CD2 4.45Å; I420-F438 HydrophobicContact CD1-CE1 3.99Å; I420-F438 HydrophobicContact CD1-CE2 4.09Å; I420-F438 HydrophobicContact CD1-CZ 3.85Å; I420-F438 HydrophobicContact CG2-CB 4.04Å; I420-F438 HydrophobicContact CG2-CD1 3.6Å; I420-F438 HydrophobicContact CG2-CE1 4.2Å; I420-F438 HydrophobicContact CG2-CG 3.8Å; Y421-F438 HydrophobicContact CE1-CD1 4.16Å; Y421-F438 AromaticContact CE1-CE1 3.99Å; Y421-F438 HydrophobicContact CE1-CE1 3.99Å; T434-F438 PolarHBondContact O-N 3.32Å; A435-F438 PolarHBondContact O-N 3.37Å; G436-F438 PolarHBondContact O-N 3.32Å; F438-L441 WeakPolarHBondContact O-CB 3.3Å; F438-L441 PolarHBondContact O-N 3.13Å; F438-D442 PolarHBondContact O-N 3.41Å
439	F	89.8	Confident	82.5	Confident	9 Å²	9	36.4 Å²	36.4	4%	0.039	20%	0.203	C	C	.	.	H	α-helix	trans	-63.6	-42.7	177.8	177.6	-121.4	0	0	0	111.9	Y421 V424 A435 G436 L441 D442 L443 L462 F465 L482	Y421-F439 HydrophobicContact CD1-CB 4.28Å; Y421-F439 AromaticContact CD1-CD2 3.71Å; Y421-F439 HydrophobicContact CD1-CD2 3.71Å; Y421-F439 HydrophobicContact CD1-CG 4.4Å; Y421-F439 AromaticContact CE1-CD2 3.91Å; Y421-F439 HydrophobicContact CE1-CD2 3.91Å; V424-F439 HydrophobicContact CG2-CB 4.46Å; A435-F439 WeakPolarHBondContact O-CB 3.13Å; A435-F439 PolarHBondContact O-N 3.45Å; G436-F439 PolarHBondContact O-N 3.11Å; F439-L441 VanDerWaalsContact C-N 3.31Å; F439-L441 PolarHBondContact O-N 3.32Å; F439-D442 PolarHBondContact O-N 3.23Å; F439-L443 HydrophobicContact CD1-CD1 3.91Å; F439-L443 HydrophobicContact CD1-CG 4.47Å; F439-L443 HydrophobicContact CD2-CG 4.25Å; F439-L443 HydrophobicContact CE1-CD1 3.54Å; F439-L443 HydrophobicContact CE1-CG 4.2Å; F439-L443 HydrophobicContact CE2-CD1 4.2Å; F439-L443 HydrophobicContact CE2-CD2 3.98Å; F439-L443 HydrophobicContact CE2-CG 3.95Å; F439-L443 HydrophobicContact CG-CD1 4.4Å; F439-L443 HydrophobicContact CZ-CD1 3.69Å; F439-L443 HydrophobicContact CZ-CD2 3.91Å; F439-L443 HydrophobicContact CZ-CG 3.92Å; F439-L443 WeakPolarHBondContact O-CB 3.47Å; F439-L443 VanDerWaalsContact O-CG 3.28Å; F439-L443 WeakPolarHBondContact O-CG 3.29Å; F439-L443 PolarHBondContact O-N 2.83Å; F439-L462 HydrophobicContact CE1-CD2 3.79Å; F439-F465 HydrophobicContact CE1-CB 4.49Å; F439-F465 AromaticContact CE1-CD1 3.87Å; F439-F465 HydrophobicContact CE1-CD1 3.87Å; F439-F465 HydrophobicContact CE1-CE1 4.34Å; F439-F465 HydrophobicContact CE1-CG 4.11Å; F439-F465 HydrophobicContact CE2-CB 4.3Å; F439-F465 HydrophobicContact CE2-CD1 4.36Å; F439-F465 AromaticContact CE2-CD2 3.85Å; F439-F465 HydrophobicContact CE2-CD2 3.85Å; F439-F465 HydrophobicContact CE2-CE2 4.33Å; F439-F465 AromaticContact CE2-CG 3.88Å; F439-F465 HydrophobicContact CE2-CG 3.88Å; F439-F465 HydrophobicContact CZ-CB 3.63Å; F439-F465 AromaticContact CZ-CD1 3.67Å; F439-F465 HydrophobicContact CZ-CD1 3.67Å; F439-F465 AromaticContact CZ-CD2 3.9Å; F439-F465 HydrophobicContact CZ-CD2 3.9Å; F439-F465 HydrophobicContact CZ-CE1 4.34Å; F439-F465 AromaticContact CZ-CG 3.41Å; F439-F465 HydrophobicContact CZ-CG 3.41Å; F439-F465 VanDerWaalsContact CZ-CG 3.41Å; F439-L482 HydrophobicContact CD1-CD1 4.45Å; F439-L482 HydrophobicContact CD1-CD2 4.35Å
440	L	87.6	Confident	80.4	Confident	26 Å²	26	44 Å²	44	14%	0.136	24%	0.238	C	C	.	.	H	α-helix	trans	-63.3	-36.5	174.9	-176.2	62.7	0	0	0	112.4	G436 E437 T444 S485 C486 Y488	G436-L440 WeakPolarHBondContact O-CB 3.28Å; G436-L440 PolarHBondContact O-N 3.44Å; E437-L440 PolarHBondContact O-N 3.03Å; L440-T444 HydrophobicContact CD1-CG2 4.23Å; L440-T444 WeakPolarHBondContact O-CB 3.36Å; L440-T444 WeakPolarHBondContact O-CG2 3.32Å; L440-T444 PolarHBondContact O-N 2.88Å; L440-T444 VanDerWaalsContact O-N 3.08Å; L440-T444 PolarHBondContact O-OG1 3.18Å; L440-S485 WeakPolarHBondContact CD2-O 3.41Å; L440-C486 HydrophobicContact CD2-CB 4.09Å; L440-Y488 HydrophobicContact CD1-CE2 4.44Å
441	L	86.5	Confident	78.6	Confident	31 Å²	31	52.8 Å²	52.8	16%	0.162	26%	0.262	C	S	.	.	H	α-helix	trans	-62.4	-46	173.2	175.4	65.7	0	0	0	112	M400 Y403 K404 E437 F438 F439 T444 S445	M400-L441 HydrophobicContact CG-CD2 3.55Å; M400-L441 HydrophobicContact SD-CD2 4.36Å; Y403-L441 HydrophobicContact CD1-CD2 3.6Å; Y403-L441 HydrophobicContact CD1-CG 3.93Å; Y403-L441 HydrophobicContact CE1-CD2 4.31Å; Y403-L441 HydrophobicContact CE1-CG 4.14Å; Y403-L441 HydrophobicContact CG-CD2 4.19Å; K404-L441 HydrophobicContact CD-CD1 4.47Å; K404-L441 HydrophobicContact CD-CD2 4.28Å; K404-L441 VanDerWaalsContact CE-CD2 3.47Å; K404-L441 HydrophobicContact CG-CD1 4.12Å; K404-L441 HydrophobicContact CG-CD2 3.75Å; E437-L441 PolarHBondContact O-N 2.89Å; F438-L441 WeakPolarHBondContact O-CB 3.3Å; F438-L441 PolarHBondContact O-N 3.13Å; F439-L441 VanDerWaalsContact C-N 3.31Å; F439-L441 PolarHBondContact O-N 3.32Å; L441-T444 PolarHBondContact O-N 3.08Å; L441-T444 PolarHBondContact O-OG1 2.95Å; L441-S445 VanDerWaalsContact O-CB 3.26Å; L441-S445 WeakPolarHBondContact O-CB 3.16Å; L441-S445 PolarHBondContact O-N 2.91Å; L441-S445 PolarHBondContact O-OG 3.15Å
442	D	83.7	Confident	77.1	Confident	15 Å²	15	62.2 Å²	62.2	8%	0.08	30%	0.303	C	S	.	.	H	α-helix	trans	-65.8	-42.9	178.3	-174.6	59.4	0	0	0	111.8	Y403 H414 Y421 F438 F439 T444 S445 A446	Y403-D442 PolarHBondContact OH-OD1 3.44Å; H414-D442 IonicContact CE1-OD1 3.14Å; H414-D442 PolarHBondContact CE1-OD1 3.45Å; H414-D442 IonicContact CE1-OD2 2.81Å; H414-D442 IonicContact ND1-OD1 2.71Å; H414-D442 IonicContact ND1-OD2 3.87Å; Y421-D442 HydrophobicContact CE1-CB 4.45Å; Y421-D442 VanDerWaalsContact OH-CG 3.25Å; Y421-D442 PolarHBondContact OH-OD2 2.69Å; F438-D442 PolarHBondContact O-N 3.41Å; F439-D442 PolarHBondContact O-N 3.23Å; D442-T444 VanDerWaalsContact C-N 3.29Å; D442-T444 PolarHBondContact O-N 3.14Å; D442-S445 PolarHBondContact O-OG 3.26Å; D442-A446 PolarHBondContact O-N 2.92Å
443	L	80.4	Confident	75.8	Confident	12 Å²	12	64 Å²	64	6%	0.063	31%	0.313	C	S	.	.	H	α-helix	trans	-57.1	-40.8	174.6	-75.2	178.2	0	0	0	113	F439 V458 K461	F439-L443 HydrophobicContact CD1-CD1 3.91Å; F439-L443 HydrophobicContact CD1-CG 4.47Å; F439-L443 HydrophobicContact CD2-CG 4.25Å; F439-L443 HydrophobicContact CE1-CD1 3.54Å; F439-L443 HydrophobicContact CE1-CG 4.2Å; F439-L443 HydrophobicContact CE2-CD1 4.2Å; F439-L443 HydrophobicContact CE2-CD2 3.98Å; F439-L443 HydrophobicContact CE2-CG 3.95Å; F439-L443 HydrophobicContact CG-CD1 4.4Å; F439-L443 HydrophobicContact CZ-CD1 3.69Å; F439-L443 HydrophobicContact CZ-CD2 3.91Å; F439-L443 HydrophobicContact CZ-CG 3.92Å; F439-L443 WeakPolarHBondContact O-CB 3.47Å; F439-L443 VanDerWaalsContact O-CG 3.28Å; F439-L443 WeakPolarHBondContact O-CG 3.29Å; F439-L443 PolarHBondContact O-N 2.83Å; L443-V458 HydrophobicContact CD1-CG1 4.48Å; L443-K461 HydrophobicContact CD2-CB 3.62Å; L443-K461 HydrophobicContact CD2-CD 3.52Å; L443-K461 HydrophobicContact CD2-CG 4.21Å; L443-K461 PolarHBondContact O-NZ 2.8Å
444	T	75.2	Confident	75	Confident	39 Å²	39	66.1 Å²	66.1	24%	0.239	33%	0.325	C	S	.	.	H	α-helix	trans	-86.9	-35.5	-175.9	54	0	0	0	0	113.1	L440 L441 D442 A446 T447 V453	L440-T444 HydrophobicContact CD1-CG2 4.23Å; L440-T444 WeakPolarHBondContact O-CB 3.36Å; L440-T444 WeakPolarHBondContact O-CG2 3.32Å; L440-T444 PolarHBondContact O-N 2.88Å; L440-T444 VanDerWaalsContact O-N 3.08Å; L440-T444 PolarHBondContact O-OG1 3.18Å; L441-T444 PolarHBondContact O-N 3.08Å; L441-T444 PolarHBondContact O-OG1 2.95Å; D442-T444 VanDerWaalsContact C-N 3.29Å; D442-T444 PolarHBondContact O-N 3.14Å; T444-A446 VanDerWaalsContact C-N 3.26Å; T444-A446 PolarHBondContact O-N 2.9Å; T444-T447 PolarHBondContact O-N 3.34Å; T444-T447 PolarHBondContact O-OG1 3.38Å; T444-V453 HydrophobicContact CG2-CG1 4.44Å; T444-V453 HydrophobicContact CG2-CG2 4.26Å
445	S	70.9	Confident	74.4	Confident	51 Å²	51	67.2 Å²	67.2	36%	0.357	33%	0.332	S	S	.	.	H	α-helix	trans	-57.2	-42.3	176.3	70.3	0	0	0	0	111.2	Y403 L441 D442 T447 G448	Y403-S445 PolarHBondContact OH-OG 3.49Å; L441-S445 VanDerWaalsContact O-CB 3.26Å; L441-S445 WeakPolarHBondContact O-CB 3.16Å; L441-S445 PolarHBondContact O-N 2.91Å; L441-S445 PolarHBondContact O-OG 3.15Å; D442-S445 PolarHBondContact O-OG 3.26Å; S445-T447 PolarHBondContact O-N 2.87Å; S445-T447 VanDerWaalsContact O-N 3.1Å; S445-G448 PolarHBondContact O-N 3.14Å; S445-G448 VanDerWaalsContact O-N 3.13Å
446	A	58.9	Low	73.9	Confident	74 Å²	74	70.3 Å²	70.3	61%	0.612	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-15	177.3	0	0	0	0	0	114.5	D442 T444	D442-A446 PolarHBondContact O-N 2.92Å; T444-A446 VanDerWaalsContact C-N 3.26Å; T444-A446 PolarHBondContact O-N 2.9Å
447	T	51.4	Low	73.3	Confident	43 Å²	43	74.7 Å²	74.7	26%	0.264	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-8.4	178	67.4	0	0	0	0	113.8	T444 S445	T444-T447 PolarHBondContact O-N 3.34Å; T444-T447 PolarHBondContact O-OG1 3.38Å; S445-T447 PolarHBondContact O-N 2.87Å; S445-T447 VanDerWaalsContact O-N 3.1Å
448	G	50.5	Low	73	Confident	38 Å²	38	71.4 Å²	71.4	39%	0.392	35%	0.352	S	S	.	.			trans	77.1	130	-178.5	0	0	0	0	0	112.8	S445 K450 R451	S445-G448 PolarHBondContact O-N 3.14Å; S445-G448 VanDerWaalsContact O-N 3.13Å; G448-K450 PolarHBondContact O-N 3.1Å; G448-R451 PolarHBondContact O-N 3.17Å
449	R	51.7	Low	72.9	Confident	234 Å²	234	71.4 Å²	71.4	88%	0.883	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	9.2	-170.1	-61.4	-179	179	171.4	-0.4	117.4
450	K	50.5	Low	72.9	Confident	209 Å²	209	72.8 Å²	72.8	91%	0.909	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.8	-2.6	-175	-68.2	-171.6	177.8	-179.5	0	115.9	G448	G448-K450 PolarHBondContact O-N 3.1Å
451	R	55.2	Low	72.9	Confident	211 Å²	211	74.8 Å²	74.8	80%	0.796	37%	0.365	S	S	*	.	S	Bend	trans	-98.9	142.3	172.2	-70.7	-178	176.4	175.7	-0.7	109.3	G448 V453	G448-R451 PolarHBondContact O-N 3.17Å; R451-V453 PolarHBondContact O-N 2.89Å
452	K	64	Low	73.1	Confident	208 Å²	208	73.4 Å²	73.4	90%	0.904	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-59	124.7	165.2	-75.9	-175	175.6	-176.9	0	106.7	D454	K452-D454 PolarHBondContact O-N 3.31Å; K452-D454 VanDerWaalsContact O-N 3.14Å
453	V	68.6	Low	73.6	Confident	37 Å²	37	72.9 Å²	72.9	22%	0.224	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-60.8	117.3	176.1	179.3	0	0	0	0	107.4	T444 R451 V455 V458 Y488	T444-V453 HydrophobicContact CG2-CG1 4.44Å; T444-V453 HydrophobicContact CG2-CG2 4.26Å; R451-V453 PolarHBondContact O-N 2.89Å; V453-V455 PolarHBondContact O-N 3.47Å; V453-V458 HydrophobicContact CG1-CG2 3.39Å; V453-Y488 HydrophobicContact CG1-CE2 4.34Å
454	D	79.1	Confident	74.1	Confident	70 Å²	70	75.6 Å²	75.6	37%	0.374	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-74.6	119.2	175.7	168.8	26.6	0	0	0	109.4	K452 R456 N457 V458	K452-D454 PolarHBondContact O-N 3.31Å; K452-D454 VanDerWaalsContact O-N 3.14Å; D454-R456 PolarHBondContact O-N 3.23Å; D454-R456 PolarHBondContact OD1-N 3.14Å; D454-N457 HydrophobicContact CB-CB 4.17Å; D454-N457 PolarHBondContact O-N 3.37Å; D454-N457 PolarHBondContact OD2-N 3.47Å; D454-N457 PolarHBondContact OD2-ND2 2.93Å; D454-V458 PolarHBondContact O-N 3.27Å; D454-V458 VanDerWaalsContact O-N 3.15Å
455	V	83.9	Confident	74.9	Confident	32 Å²	32	74.7 Å²	74.7	19%	0.194	36%	0.363	C	S	.	.	H	α-helix	trans	-57.2	-39.9	-179.3	-175.3	0	0	0	0	110.8	V453 V458 L459 Y488 N491 A494	V453-V455 PolarHBondContact O-N 3.47Å; V455-V458 PolarHBondContact O-N 2.7Å; V455-V458 VanDerWaalsContact O-N 3.16Å; V455-L459 HydrophobicContact CG1-CD1 4.12Å; V455-L459 HydrophobicContact CG1-CG 4.42Å; V455-L459 WeakPolarHBondContact O-CG 3.34Å; V455-L459 PolarHBondContact O-N 3.06Å; V455-Y488 HydrophobicContact CB-CD1 4.24Å; V455-Y488 HydrophobicContact CG1-CD1 3.85Å; V455-Y488 HydrophobicContact CG1-CG 4.4Å; V455-Y488 HydrophobicContact CG2-CD1 3.8Å; V455-Y488 HydrophobicContact CG2-CE1 3.86Å; V455-N491 HydrophobicContact CG1-CB 4.39Å; V455-A494 HydrophobicContact CG1-CB 3.83Å
456	R	83.7	Confident	75.9	Confident	65 Å²	65	72.8 Å²	72.8	25%	0.245	35%	0.348	C	S	.	.	H	α-helix	trans	-62.4	-49.5	-179.5	-66	-177.3	177.8	-178.6	0.2	110.4	D454 V458 L459 F460 D497 L498 L501 N507	D454-R456 PolarHBondContact O-N 3.23Å; D454-R456 PolarHBondContact OD1-N 3.14Å; R456-V458 VanDerWaalsContact C-N 3.25Å; R456-V458 PolarHBondContact O-N 3.1Å; R456-L459 PolarHBondContact O-N 3.21Å; R456-L459 VanDerWaalsContact O-N 3.11Å; R456-F460 HydrophobicContact CB-CE2 4.28Å; R456-F460 WeakPolarHBondContact O-CD2 3.18Å; R456-F460 PolarHBondContact O-N 3.39Å; R456-D497 IonicContact NH2-OD2 3.25Å; R456-D497 PolarHBondContact NH2-OD2 3.13Å; R456-L498 HydrophobicContact CB-CD1 4.43Å; R456-L498 HydrophobicContact CB-CD2 4.18Å; R456-L498 HydrophobicContact CG-CD1 4.36Å; R456-L498 HydrophobicContact CG-CD2 3.97Å; R456-L498 HydrophobicContact CG-CG 4.23Å; R456-L501 VanDerWaalsContact NH2-CD1 3.32Å; R456-N507 PolarHBondContact NH1-OD1 2.95Å
457	N	83.2	Confident	77.5	Confident	91 Å²	91	70.9 Å²	70.9	49%	0.487	33%	0.327	S	S	.	.	H	α-helix	trans	-58	-31.6	174.6	-89.7	-66.7	0	0	0	114	D454 K461	D454-N457 HydrophobicContact CB-CB 4.17Å; D454-N457 PolarHBondContact O-N 3.37Å; D454-N457 PolarHBondContact OD2-N 3.47Å; D454-N457 PolarHBondContact OD2-ND2 2.93Å; N457-K461 WeakPolarHBondContact O-CG 3.48Å; N457-K461 PolarHBondContact O-N 3.08Å
458	V	86.8	Confident	79.4	Confident	3 Å²	3	76.8 Å²	76.8	2%	0.018	35%	0.345	C	S	.	.	H	α-helix	trans	-72.1	-44.6	173.1	178.8	0	0	0	0	111.3	L443 V453 D454 V455 R456 F460 K461 L462 Y488	L443-V458 HydrophobicContact CD1-CG1 4.48Å; V453-V458 HydrophobicContact CG1-CG2 3.39Å; D454-V458 PolarHBondContact O-N 3.27Å; D454-V458 VanDerWaalsContact O-N 3.15Å; V455-V458 PolarHBondContact O-N 2.7Å; V455-V458 VanDerWaalsContact O-N 3.16Å; R456-V458 VanDerWaalsContact C-N 3.25Å; R456-V458 PolarHBondContact O-N 3.1Å; V458-F460 PolarHBondContact O-N 3.42Å; V458-K461 PolarHBondContact O-N 3.08Å; V458-L462 HydrophobicContact CG1-CD1 3.96Å; V458-L462 HydrophobicContact CG1-CG 4.42Å; V458-L462 WeakPolarHBondContact O-CG 2.92Å; V458-L462 PolarHBondContact O-N 3.16Å; V458-Y488 HydrophobicContact CB-CD2 4.22Å; V458-Y488 HydrophobicContact CG1-CD2 3.74Å; V458-Y488 HydrophobicContact CG1-CE2 4.37Å; V458-Y488 HydrophobicContact CG1-CG 4.33Å; V458-Y488 HydrophobicContact CG2-CD2 4.27Å; V458-Y488 HydrophobicContact CG2-CE2 4.19Å
459	L	89.7	Confident	81.2	Confident	2 Å²	2	76.4 Å²	76.4	1%	0.01	34%	0.336	C	S	.	.	H	α-helix	trans	-60.3	-43.1	176.7	-67.7	171.7	0	0	0	111.8	V455 R456 K461 L462 V463 A494 M495 L498 L518	V455-L459 HydrophobicContact CG1-CD1 4.12Å; V455-L459 HydrophobicContact CG1-CG 4.42Å; V455-L459 WeakPolarHBondContact O-CG 3.34Å; V455-L459 PolarHBondContact O-N 3.06Å; R456-L459 PolarHBondContact O-N 3.21Å; R456-L459 VanDerWaalsContact O-N 3.11Å; L459-K461 PolarHBondContact O-N 3.28Å; L459-L462 HydrophobicContact CD2-CD1 4.3Å; L459-L462 WeakPolarHBondContact O-CB 3.34Å; L459-L462 PolarHBondContact O-N 3.17Å; L459-V463 WeakPolarHBondContact O-CG2 3.27Å; L459-V463 PolarHBondContact O-N 2.68Å; L459-A494 HydrophobicContact CD1-CB 4.04Å; L459-M495 HydrophobicContact CD1-CG 3.95Å; L459-M495 HydrophobicContact CD2-CE 3.81Å; L459-M495 HydrophobicContact CD2-CG 4.17Å; L459-L498 HydrophobicContact CB-CD1 3.94Å; L459-L498 HydrophobicContact CD1-CD1 3.77Å; L459-L518 HydrophobicContact CD2-CD1 4.46Å
460	F	89.2	Confident	82.8	Confident	37 Å²	37	71.1 Å²	71.1	16%	0.162	33%	0.326	C	S	.	.	H	α-helix	trans	-57.3	-45.2	172.7	-77.3	-66.3	0	0	0	112.6	R456 V458 L462 V463 D464 L498 R508 L510	R456-F460 HydrophobicContact CB-CE2 4.28Å; R456-F460 WeakPolarHBondContact O-CD2 3.18Å; R456-F460 PolarHBondContact O-N 3.39Å; V458-F460 PolarHBondContact O-N 3.42Å; F460-L462 VanDerWaalsContact C-N 3.32Å; F460-L462 PolarHBondContact O-N 3.18Å; F460-V463 PolarHBondContact O-N 3.18Å; F460-D464 WeakPolarHBondContact O-CB 3.24Å; F460-D464 PolarHBondContact O-N 2.89Å; F460-L498 HydrophobicContact CE2-CD2 3.76Å; F460-L498 HydrophobicContact CZ-CD2 3.68Å; F460-R508 HydrophobicContact CZ-CB 4.47Å; F460-R508 WeakPolarHBondContact CZ-O 3.37Å; F460-L510 HydrophobicContact CD1-CD2 3.58Å; F460-L510 HydrophobicContact CD1-CG 4.33Å; F460-L510 HydrophobicContact CE1-CD2 3.5Å; F460-L510 VanDerWaalsContact CE1-CD2 3.5Å; F460-L510 HydrophobicContact CE1-CG 3.74Å
461	K	88	Confident	84.4	Confident	68 Å²	68	63.3 Å²	63.3	30%	0.296	29%	0.293	S	S	.	.	H	α-helix	trans	-67.9	-30.2	178	-71.9	-178.3	-176	-173.7	0	112.8	L443 N457 V458 L459 F465	L443-K461 HydrophobicContact CD2-CB 3.62Å; L443-K461 HydrophobicContact CD2-CD 3.52Å; L443-K461 HydrophobicContact CD2-CG 4.21Å; L443-K461 PolarHBondContact O-NZ 2.8Å; N457-K461 WeakPolarHBondContact O-CG 3.48Å; N457-K461 PolarHBondContact O-N 3.08Å; V458-K461 PolarHBondContact O-N 3.08Å; L459-K461 PolarHBondContact O-N 3.28Å; K461-F465 WeakPolarHBondContact O-CB 3.49Å; K461-F465 PolarHBondContact O-N 3.48Å
462	L	91	Very high	85.9	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-68.4	-47.1	175.2	-76.7	164	0	0	0	111.7	F439 V458 L459 F460 F465 H466 L478 L482 V489 I521	F439-L462 HydrophobicContact CE1-CD2 3.79Å; V458-L462 HydrophobicContact CG1-CD1 3.96Å; V458-L462 HydrophobicContact CG1-CG 4.42Å; V458-L462 WeakPolarHBondContact O-CG 2.92Å; V458-L462 PolarHBondContact O-N 3.16Å; L459-L462 HydrophobicContact CD2-CD1 4.3Å; L459-L462 WeakPolarHBondContact O-CB 3.34Å; L459-L462 PolarHBondContact O-N 3.17Å; F460-L462 VanDerWaalsContact C-N 3.32Å; F460-L462 PolarHBondContact O-N 3.18Å; L462-F465 PolarHBondContact O-N 3.28Å; L462-H466 PolarHBondContact O-N 3.11Å; L462-L478 HydrophobicContact CD2-CD1 4.46Å; L462-L482 HydrophobicContact CD2-CD1 3.34Å; L462-V489 HydrophobicContact CD1-CG1 4.21Å; L462-I521 HydrophobicContact CB-CD1 4.46Å
463	V	93.1	Very high	86.9	Confident	5 Å²	5	50.2 Å²	50.2	3%	0.03	25%	0.252	C	S	.	.	H	α-helix	trans	-59.3	-52.2	174.8	167.3	0	0	0	0	110.7	L459 F460 F465 H466 I467 L510 T517 L518 I521	L459-V463 WeakPolarHBondContact O-CG2 3.27Å; L459-V463 PolarHBondContact O-N 2.68Å; F460-V463 PolarHBondContact O-N 3.18Å; V463-F465 VanDerWaalsContact C-N 3.33Å; V463-F465 PolarHBondContact O-N 2.71Å; V463-H466 PolarHBondContact O-N 2.96Å; V463-I467 HydrophobicContact CG1-CD1 3.71Å; V463-I467 WeakPolarHBondContact O-CB 3.44Å; V463-I467 WeakPolarHBondContact O-CG1 3.42Å; V463-I467 PolarHBondContact O-N 2.94Å; V463-L510 HydrophobicContact CG1-CD2 4.25Å; V463-T517 HydrophobicContact CB-CG2 4.27Å; V463-T517 HydrophobicContact CG1-CG2 4.04Å; V463-T517 HydrophobicContact CG2-CG2 4.15Å; V463-L518 HydrophobicContact CG2-CB 4.08Å; V463-L518 HydrophobicContact CG2-CD1 4.36Å; V463-I521 HydrophobicContact CG2-CD1 4.11Å
464	D	91.2	Very high	87.9	Confident	68 Å²	68	49.8 Å²	49.8	36%	0.364	25%	0.248	S	C	.	.	H	α-helix	trans	-62.1	-37.1	178.6	177.6	39.6	0	0	0	112.4	F460 R468	F460-D464 WeakPolarHBondContact O-CB 3.24Å; F460-D464 PolarHBondContact O-N 2.89Å; D464-R468 VanDerWaalsContact O-CB 3.28Å; D464-R468 WeakPolarHBondContact O-CB 3.26Å; D464-R468 WeakPolarHBondContact O-CG 3.33Å; D464-R468 PolarHBondContact O-N 3.26Å; D464-R468 WeakPolarHBondContact OD1-CD 3.29Å; D464-R468 IonicContact OD1-CZ 3.77Å; D464-R468 IonicContact OD1-NE 2.82Å; D464-R468 PolarHBondContact OD1-NE 3.39Å; D464-R468 IonicContact OD1-NH2 2.73Å; D464-R468 IonicContact OD2-CZ 3.16Å; D464-R468 IonicContact OD2-NE 2.73Å; D464-R468 PolarHBondContact OD2-NE 3.32Å; D464-R468 VanDerWaalsContact OD2-NE 3.17Å; D464-R468 IonicContact OD2-NH2 3.78Å; D464-R468 PolarHBondContact OD2-NH2 3.49Å
465	F	91.6	Very high	88.6	Confident	20 Å²	20	46.5 Å²	46.5	9%	0.088	23%	0.23	C	C	.	.	H	α-helix	trans	-62.8	-47.6	172.4	170.8	-107	0	0	0	112.5	Y421 V424 Y425 F439 K461 L462 V463 R468 S469 L478	Y421-F465 HydrophobicContact CG-CE2 4.44Å; V424-F465 HydrophobicContact CG1-CE1 4.43Å; Y425-F465 AromaticContact CE2-CE1 3.89Å; Y425-F465 HydrophobicContact CE2-CE1 3.89Å; Y425-F465 HydrophobicContact CE2-CZ 4.06Å; F439-F465 HydrophobicContact CE1-CB 4.49Å; F439-F465 AromaticContact CE1-CD1 3.87Å; F439-F465 HydrophobicContact CE1-CD1 3.87Å; F439-F465 HydrophobicContact CE1-CE1 4.34Å; F439-F465 HydrophobicContact CE1-CG 4.11Å; F439-F465 HydrophobicContact CE2-CB 4.3Å; F439-F465 HydrophobicContact CE2-CD1 4.36Å; F439-F465 AromaticContact CE2-CD2 3.85Å; F439-F465 HydrophobicContact CE2-CD2 3.85Å; F439-F465 HydrophobicContact CE2-CE2 4.33Å; F439-F465 AromaticContact CE2-CG 3.88Å; F439-F465 HydrophobicContact CE2-CG 3.88Å; F439-F465 HydrophobicContact CZ-CB 3.63Å; F439-F465 AromaticContact CZ-CD1 3.67Å; F439-F465 HydrophobicContact CZ-CD1 3.67Å; F439-F465 AromaticContact CZ-CD2 3.9Å; F439-F465 HydrophobicContact CZ-CD2 3.9Å; F439-F465 HydrophobicContact CZ-CE1 4.34Å; F439-F465 AromaticContact CZ-CG 3.41Å; F439-F465 HydrophobicContact CZ-CG 3.41Å; F439-F465 VanDerWaalsContact CZ-CG 3.41Å; K461-F465 WeakPolarHBondContact O-CB 3.49Å; K461-F465 PolarHBondContact O-N 3.48Å; L462-F465 PolarHBondContact O-N 3.28Å; V463-F465 VanDerWaalsContact C-N 3.33Å; V463-F465 PolarHBondContact O-N 2.71Å; F465-R468 PolarHBondContact O-N 3.16Å; F465-S469 VanDerWaalsContact O-CB 3.3Å; F465-S469 WeakPolarHBondContact O-CB 3.41Å; F465-S469 PolarHBondContact O-N 3.48Å; F465-S469 PolarHBondContact O-OG 2.73Å; F465-L478 HydrophobicContact CD1-CD1 4.06Å; F465-L478 HydrophobicContact CD1-CD2 4.4Å; F465-L478 HydrophobicContact CE1-CD1 3.98Å
466	H	93.4	Very high	89.1	Confident	12 Å²	12	45.3 Å²	45.3	6%	0.056	22%	0.224	C	C	.	.	H	α-helix	trans	-60	-52.4	178.7	-177	62.3	0	0	0	110.9	Y425 L462 V463 R468 S469 N470 H472 H474 L478 T517	Y425-H466 AromaticContact CZ-ND1 3.81Å; Y425-H466 PolarHBondContact OH-ND1 2.98Å; L462-H466 PolarHBondContact O-N 3.11Å; V463-H466 PolarHBondContact O-N 2.96Å; H466-R468 PolarHBondContact O-N 3.15Å; H466-S469 PolarHBondContact O-N 2.96Å; H466-S469 VanDerWaalsContact O-N 3.15Å; H466-S469 PolarHBondContact O-OG 3.39Å; H466-N470 PolarHBondContact O-N 2.62Å; H466-H472 PolarHBondContact CE1-O 3.07Å; H466-H472 VanDerWaalsContact CE1-O 3.32Å; H466-H474 PolarHBondContact CE1-O 3.15Å; H466-L478 HydrophobicContact CB-CD2 3.92Å; H466-T517 HydrophobicContact CB-CG2 4.18Å
467	I	92.6	Very high	89.6	Confident	33 Å²	33	43.4 Å²	43.4	17%	0.169	22%	0.217	C	C	.	.	H	α-helix	trans	-56.1	-45.5	178.7	-70.5	171.8	0	0	0	111.8	V463 R513	V463-I467 HydrophobicContact CG1-CD1 3.71Å; V463-I467 WeakPolarHBondContact O-CB 3.44Å; V463-I467 WeakPolarHBondContact O-CG1 3.42Å; V463-I467 PolarHBondContact O-N 2.94Å; I467-R513 HydrophobicContact CD1-CG 4.01Å; I467-R513 HydrophobicContact CG1-CG 4.31Å
468	R	90.4	Very high	90.2	Very high	168 Å²	168	39.2 Å²	39.2	63%	0.634	20%	0.195	S	C	*	.	H	α-helix	trans	-74.3	-26	179.4	-73.6	-169.6	-77.3	116.1	-4.9	114.1	D464 F465 H466	D464-R468 VanDerWaalsContact O-CB 3.28Å; D464-R468 WeakPolarHBondContact O-CB 3.26Å; D464-R468 WeakPolarHBondContact O-CG 3.33Å; D464-R468 PolarHBondContact O-N 3.26Å; D464-R468 WeakPolarHBondContact OD1-CD 3.29Å; D464-R468 IonicContact OD1-CZ 3.77Å; D464-R468 IonicContact OD1-NE 2.82Å; D464-R468 PolarHBondContact OD1-NE 3.39Å; D464-R468 IonicContact OD1-NH2 2.73Å; D464-R468 IonicContact OD2-CZ 3.16Å; D464-R468 IonicContact OD2-NE 2.73Å; D464-R468 PolarHBondContact OD2-NE 3.32Å; D464-R468 VanDerWaalsContact OD2-NE 3.17Å; D464-R468 IonicContact OD2-NH2 3.78Å; D464-R468 PolarHBondContact OD2-NH2 3.49Å; F465-R468 PolarHBondContact O-N 3.16Å; H466-R468 PolarHBondContact O-N 3.15Å
469	S	87.5	Confident	90.6	Very high	30 Å²	30	39.1 Å²	39.1	21%	0.21	19%	0.194	C	C	.	.	H	α-helix	trans	-68.4	-42.2	177.9	74.9	0	0	0	0	111.8	Y425 F465 H466 I471	Y425-S469 PolarHBondContact OH-OG 2.97Å; F465-S469 VanDerWaalsContact O-CB 3.3Å; F465-S469 WeakPolarHBondContact O-CB 3.41Å; F465-S469 PolarHBondContact O-N 3.48Å; F465-S469 PolarHBondContact O-OG 2.73Å; H466-S469 PolarHBondContact O-N 2.96Å; H466-S469 VanDerWaalsContact O-N 3.15Å; H466-S469 PolarHBondContact O-OG 3.39Å; S469-I471 WeakPolarHBondContact O-CG1 3.37Å; S469-I471 PolarHBondContact O-N 3.4Å
470	N	86.3	Confident	90.8	Very high	123 Å²	123	39 Å²	39	66%	0.658	19%	0.194	S	C	*	.			trans	50.6	34.8	-178.2	-158	75.7	0	0	0	113.8	H466	H466-N470 PolarHBondContact O-N 2.62Å
471	I	85.1	Confident	91.1	Very high	44 Å²	44	37.3 Å²	37.3	23%	0.226	19%	0.186	C	C	.	.	S	Bend	trans	-93.2	-34.7	-178.4	-57.4	179.6	0	0	0	111.7	A422 Y425 S469 L1077 T1081	A422-I471 HydrophobicContact CB-CD1 4.04Å; Y425-I471 HydrophobicContact CD2-CB 4.11Å; Y425-I471 HydrophobicContact CD2-CD1 3.78Å; Y425-I471 HydrophobicContact CD2-CG1 4.43Å; Y425-I471 HydrophobicContact CD2-CG2 4.27Å; Y425-I471 HydrophobicContact CE2-CB 4.45Å; Y425-I471 HydrophobicContact CE2-CD1 4.24Å; Y425-I471 HydrophobicContact CG-CB 4.34Å; Y425-I471 HydrophobicContact CG-CG2 4.16Å; S469-I471 WeakPolarHBondContact O-CG1 3.37Å; S469-I471 PolarHBondContact O-N 3.4Å; I471-L1077 HydrophobicContact CD1-CD2 3.55Å; I471-L1077 HydrophobicContact CG1-CD2 3.95Å; I471-T1081 HydrophobicContact CG2-CG2 3.45Å; I471-T1081 VanDerWaalsContact CG2-CG2 3.45Å
472	H	84.6	Confident	91.4	Very high	31 Å²	31	34.1 Å²	34.1	14%	0.144	17%	0.172	C	C	.	.			trans	-132.3	153	176.5	-79.4	-97	0	0	0	110.1	Y425 H466 H474 F477 T1081	Y425-H472 HydrophobicContact CD1-CB 4.4Å; Y425-H472 AromaticContact CD1-CD2 3.35Å; Y425-H472 WeakPolarHBondContact CD1-CD2 3.16Å; Y425-H472 HydrophobicContact CE1-CB 4.42Å; Y425-H472 AromaticContact CG-CD2 3.75Å; H466-H472 PolarHBondContact CE1-O 3.07Å; H466-H472 VanDerWaalsContact CE1-O 3.32Å; H472-H474 WeakPolarHBondContact CB-O 3.44Å; H472-H474 AromaticContact ND1-NE2 3.59Å; H472-F477 AromaticContact CE1-CD2 3.36Å; H472-F477 WeakPolarHBondContact CE1-CD2 3.49Å; H472-F477 AromaticContact CE1-CE2 3.51Å; H472-F477 AromaticContact ND1-CD2 3.61Å; H472-F477 AromaticContact ND1-CE2 3.89Å; H472-F477 AromaticContact NE2-CD2 3.88Å; H472-T1081 VanDerWaalsContact NE2-CG2 3.32Å; H472-T1081 WeakPolarHBondContact NE2-CG2 3.26Å
473	T	85.2	Confident	91.5	Very high	114 Å²	114	35.2 Å²	35.2	70%	0.699	18%	0.177	S	C	*	.	S	Bend	trans	-78.2	-24.1	170.5	48.2	0	0	0	0	113.1
474	H	90	Very high	91.2	Very high	28 Å²	28	40.7 Å²	40.7	13%	0.13	20%	0.202	C	C	.	.	S	Bend	trans	-124.7	156.8	-176	71.2	97.9	0	0	0	111.4	H466 H472 A476 F477 F524	H466-H474 PolarHBondContact CE1-O 3.15Å; H472-H474 WeakPolarHBondContact CB-O 3.44Å; H472-H474 AromaticContact ND1-NE2 3.59Å; H474-A476 WeakPolarHBondContact ND1-CB 3.5Å; H474-F477 AromaticContact CE1-CD2 3.53Å; H474-F477 AromaticContact CE1-CE2 3.51Å; H474-F477 AromaticContact NE2-CD2 3.92Å; H474-F477 AromaticContact NE2-CE2 3.74Å; H474-F524 HydrophobicContact CB-CE2 4.1Å
475	T	94.3	Very high	91	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.006	20%	0.199	C	C	.	.	S	Bend	trans	-98.1	-5.8	-166.8	65.1	0	0	0	0	114	F477 L478 V479 T517 D520 I521	T475-F477 PolarHBondContact O-N 3.16Å; T475-L478 WeakPolarHBondContact O-CA 3.27Å; T475-L478 WeakPolarHBondContact O-CB 3.32Å; T475-L478 PolarHBondContact O-N 3.49Å; T475-V479 PolarHBondContact O-N 2.99Å; T475-T517 HydrophobicContact CG2-CG2 4.15Å; T475-D520 WeakPolarHBondContact CA-OD2 3.23Å; T475-D520 VanDerWaalsContact CB-OD2 3.22Å; T475-D520 WeakPolarHBondContact CB-OD2 3.43Å; T475-D520 HydrophobicContact CG2-CB 4.22Å; T475-D520 VanDerWaalsContact CG2-OD2 3.28Å; T475-D520 WeakPolarHBondContact CG2-OD2 3.37Å; T475-D520 PolarHBondContact N-OD2 2.7Å; T475-D520 VanDerWaalsContact OG1-C 3.27Å; T475-D520 PolarHBondContact OG1-O 2.94Å; T475-D520 PolarHBondContact OG1-OD2 3.29Å; T475-I521 HydrophobicContact CG2-CG1 3.78Å; T475-I521 WeakPolarHBondContact OG1-CA 3.5Å; T475-I521 PolarHBondContact OG1-N 2.73Å
476	A	94	Very high	90.7	Very high	7 Å²	7	38.7 Å²	38.7	6%	0.058	20%	0.196	C	C	.	.	H	α-helix	trans	-46.5	-41.9	-177.2	0	0	0	0	0	114.9	H474 D480 F524 P535	H474-A476 WeakPolarHBondContact ND1-CB 3.5Å; A476-D480 PolarHBondContact O-N 2.73Å; A476-F524 HydrophobicContact CB-CB 4.47Å; A476-F524 HydrophobicContact CB-CD1 3.46Å; A476-F524 VanDerWaalsContact CB-CD1 3.46Å; A476-F524 HydrophobicContact CB-CD2 3.95Å; A476-F524 HydrophobicContact CB-CE1 3.56Å; A476-F524 HydrophobicContact CB-CE2 4.02Å; A476-F524 HydrophobicContact CB-CG 3.69Å; A476-F524 HydrophobicContact CB-CZ 3.85Å; A476-P535 HydrophobicContact CB-CB 4.03Å; A476-P535 HydrophobicContact CB-CG 4.44Å
477	F	94.3	Very high	90.3	Very high	25 Å²	25	43.2 Å²	43.2	11%	0.11	22%	0.221	C	C	.	.	H	α-helix	trans	-73	-30.6	178	-68.6	-69.8	0	0	0	113.5	Y425 H472 H474 T475 A481 P535 R538	Y425-F477 HydrophobicContact CD1-CB 4.03Å; H472-F477 AromaticContact CE1-CD2 3.36Å; H472-F477 WeakPolarHBondContact CE1-CD2 3.49Å; H472-F477 AromaticContact CE1-CE2 3.51Å; H472-F477 AromaticContact ND1-CD2 3.61Å; H472-F477 AromaticContact ND1-CE2 3.89Å; H472-F477 AromaticContact NE2-CD2 3.88Å; H474-F477 AromaticContact CE1-CD2 3.53Å; H474-F477 AromaticContact CE1-CE2 3.51Å; H474-F477 AromaticContact NE2-CD2 3.92Å; H474-F477 AromaticContact NE2-CE2 3.74Å; T475-F477 PolarHBondContact O-N 3.16Å; F477-A481 VanDerWaalsContact O-CB 3.29Å; F477-A481 WeakPolarHBondContact O-CB 3.43Å; F477-A481 PolarHBondContact O-N 2.83Å; F477-P535 HydrophobicContact CD1-CB 4.35Å; F477-P535 HydrophobicContact CD1-CG 3.82Å; F477-P535 HydrophobicContact CE1-CB 4.14Å; F477-P535 HydrophobicContact CE1-CG 4.01Å; F477-P535 HydrophobicContact CG-CG 4.48Å; F477-R538 HydrophobicContact CD1-CG 4.3Å; F477-R538 HydrophobicContact CE1-CG 4.23Å; F477-R538 PolarHBondContact O-NH1 3.45Å; F477-R538 PolarHBondContact O-NH2 3.43Å
478	L	95.2	Very high	89.9	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-70.3	-44.5	171.6	170.5	62	0	0	0	110.6	V424 Y425 L462 F465 H466 T475 A481 L482	V424-L478 HydrophobicContact CG1-CD1 3.61Å; Y425-L478 HydrophobicContact CE1-CB 3.92Å; L462-L478 HydrophobicContact CD2-CD1 4.46Å; F465-L478 HydrophobicContact CD1-CD1 4.06Å; F465-L478 HydrophobicContact CD1-CD2 4.4Å; F465-L478 HydrophobicContact CE1-CD1 3.98Å; H466-L478 HydrophobicContact CB-CD2 3.92Å; T475-L478 WeakPolarHBondContact O-CA 3.27Å; T475-L478 WeakPolarHBondContact O-CB 3.32Å; T475-L478 PolarHBondContact O-N 3.49Å; L478-A481 PolarHBondContact O-N 2.82Å; L478-L482 HydrophobicContact CD1-CD1 3.64Å; L478-L482 HydrophobicContact CD1-CG 4.4Å; L478-L482 HydrophobicContact CG-CD1 4.33Å; L478-L482 PolarHBondContact O-N 3.26Å
479	V	95.4	Very high	89.9	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-58.7	-55.1	177.2	174.4	0	0	0	0	110.3	T475 A481 L482 F483 I521 F524	T475-V479 PolarHBondContact O-N 2.99Å; V479-A481 VanDerWaalsContact C-N 3.29Å; V479-A481 PolarHBondContact O-N 2.83Å; V479-L482 CarbonylContact O-C 3.5Å; V479-L482 PolarHBondContact O-N 3.05Å; V479-F483 HydrophobicContact CG1-CD2 4.1Å; V479-F483 WeakPolarHBondContact O-CB 3.36Å; V479-F483 PolarHBondContact O-N 3.34Å; V479-I521 HydrophobicContact CG2-CB 4.48Å; V479-I521 HydrophobicContact CG2-CG2 4.24Å; V479-F524 HydrophobicContact CB-CB 4.36Å; V479-F524 HydrophobicContact CG1-CB 4.49Å; V479-F524 HydrophobicContact CG2-CB 4.05Å
480	D	95.4	Very high	90.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.6	-35.4	-179.8	169.2	70.7	0	0	0	113.6	R429 L433 A476 L482 F483 Q528 P534 P535 R538	R429-D480 IonicContact CZ-OD1 2.84Å; R429-D480 VanDerWaalsContact CZ-OD1 3.27Å; R429-D480 IonicContact NE-OD1 3.25Å; R429-D480 PolarHBondContact NE-OD1 3.2Å; R429-D480 IonicContact NE-OD2 3.04Å; R429-D480 PolarHBondContact NE-OD2 3.06Å; R429-D480 IonicContact NH2-OD1 2.69Å; R429-D480 PolarHBondContact NH2-OD1 2.82Å; L433-D480 VanDerWaalsContact CD2-O 3.27Å; L433-D480 WeakPolarHBondContact CD2-O 3.45Å; A476-D480 PolarHBondContact O-N 2.73Å; D480-L482 PolarHBondContact O-N 3.24Å; D480-F483 PolarHBondContact O-N 3.29Å; D480-Q528 VanDerWaalsContact CA-OE1 3.23Å; D480-Q528 PolarHBondContact OD1-NE2 3.27Å; D480-P534 WeakPolarHBondContact OD1-CB 3.47Å; D480-P535 VanDerWaalsContact CB-CD 3.46Å; D480-P535 HydrophobicContact CB-CG 3.93Å; D480-R538 WeakPolarHBondContact OD2-CD 3.47Å; D480-R538 IonicContact OD2-CZ 2.76Å; D480-R538 IonicContact OD2-NE 3.4Å; D480-R538 IonicContact OD2-NH1 2.64Å; D480-R538 PolarHBondContact OD2-NH1 3.39Å
481	A	95.3	Very high	90.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66.6	-19.6	177.3	0	0	0	0	0	113.3	V424 A432 F477 L478 V479	V424-A481 HydrophobicContact CG1-CB 3.67Å; V424-A481 WeakPolarHBondContact O-CB 3.47Å; A432-A481 HydrophobicContact CB-CB 4.14Å; F477-A481 VanDerWaalsContact O-CB 3.29Å; F477-A481 WeakPolarHBondContact O-CB 3.43Å; F477-A481 PolarHBondContact O-N 2.83Å; L478-A481 PolarHBondContact O-N 2.82Å; V479-A481 VanDerWaalsContact C-N 3.29Å; V479-A481 PolarHBondContact O-N 2.83Å
482	L	94.7	Very high	90.9	Very high	2 Å²	2	34 Å²	34	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-112.4	-13.8	-179.3	-66	173.6	0	0	0	113.3	G436 F439 L462 L478 V479 D480 E484 S485 C486 V489	G436-L482 WeakPolarHBondContact O-CD2 3.35Å; F439-L482 HydrophobicContact CD1-CD1 4.45Å; F439-L482 HydrophobicContact CD1-CD2 4.35Å; L462-L482 HydrophobicContact CD2-CD1 3.34Å; L478-L482 HydrophobicContact CD1-CD1 3.64Å; L478-L482 HydrophobicContact CD1-CG 4.4Å; L478-L482 HydrophobicContact CG-CD1 4.33Å; L478-L482 PolarHBondContact O-N 3.26Å; V479-L482 CarbonylContact O-C 3.5Å; V479-L482 PolarHBondContact O-N 3.05Å; D480-L482 PolarHBondContact O-N 3.24Å; L482-E484 VanDerWaalsContact C-N 3.35Å; L482-E484 PolarHBondContact O-N 2.98Å; L482-S485 PolarHBondContact O-N 3.07Å; L482-C486 HydrophobicContact CB-CB 3.93Å; L482-C486 WeakPolarHBondContact O-CB 3.45Å; L482-C486 PolarHBondContact O-N 3.16Å; L482-V489 HydrophobicContact CB-CG1 4.33Å
483	F	92.8	Very high	91.3	Very high	24 Å²	24	35.3 Å²	35.3	11%	0.105	19%	0.185	C	C	.	.	H	α-helix	trans	-57.7	-40.6	-166.3	-165.7	-96.4	0	0	0	114.3	V479 D480 V489 R490 Q528 A529	V479-F483 HydrophobicContact CG1-CD2 4.1Å; V479-F483 WeakPolarHBondContact O-CB 3.36Å; V479-F483 PolarHBondContact O-N 3.34Å; D480-F483 PolarHBondContact O-N 3.29Å; F483-V489 HydrophobicContact CD2-CG2 4.42Å; F483-R490 HydrophobicContact CE2-CG 4.06Å; F483-R490 HydrophobicContact CZ-CG 4.38Å; F483-Q528 HydrophobicContact CD1-CG 4.04Å; F483-Q528 HydrophobicContact CD2-CB 4.12Å; F483-Q528 HydrophobicContact CD2-CG 3.97Å; F483-Q528 HydrophobicContact CE1-CG 4.03Å; F483-Q528 HydrophobicContact CE2-CB 3.86Å; F483-Q528 HydrophobicContact CE2-CG 3.96Å; F483-Q528 HydrophobicContact CG-CG 4.02Å; F483-Q528 HydrophobicContact CZ-CB 4.18Å; F483-Q528 HydrophobicContact CZ-CG 4Å; F483-A529 HydrophobicContact CE2-CB 4.36Å; F483-A529 HydrophobicContact CZ-CB 3.88Å
484	E	86.6	Confident	91.7	Very high	121 Å²	121	30.3 Å²	30.3	57%	0.565	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-23.6	179.8	-67.2	176.1	-149.2	0	0	113.1	R429 L482	R429-E484 IonicContact CZ-OE1 3Å; R429-E484 IonicContact NH1-OE1 2.87Å; R429-E484 PolarHBondContact NH1-OE1 3.2Å; R429-E484 IonicContact NH2-OE1 3.23Å; R429-E484 PolarHBondContact NH2-OE1 3.02Å; L482-E484 VanDerWaalsContact C-N 3.35Å; L482-E484 PolarHBondContact O-N 2.98Å
485	S	85.6	Confident	91.9	Very high	43 Å²	43	29 Å²	29	30%	0.301	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-16.9	-170.1	-47.1	0	0	0	0	114.2	L440 L482	L440-S485 WeakPolarHBondContact CD2-O 3.41Å; L482-S485 PolarHBondContact O-N 3.07Å
486	C	85.2	Confident	91.9	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.014	15%	0.15	C	C	.	.			trans	-126.9	96.2	-168.1	-172	0	0	0	0	111.4	L440 L482 Y488 V489	L440-C486 HydrophobicContact CD2-CB 4.09Å; L482-C486 HydrophobicContact CB-CB 3.93Å; L482-C486 WeakPolarHBondContact O-CB 3.45Å; L482-C486 PolarHBondContact O-N 3.16Å; C486-Y488 PolarHBondContact O-N 2.66Å; C486-V489 WeakPolarHBondContact O-CG2 3.29Å; C486-V489 PolarHBondContact O-N 2.75Å
487	D	86	Confident	91.8	Very high	108 Å²	108	31.7 Å²	31.7	58%	0.578	16%	0.163	S	C	*	.	G	3₁₀ helix	trans	-60.7	-20.8	177.1	-68	-34.2	0	0	0	113.4	V489 R490 N491	D487-V489 VanDerWaalsContact C-N 3.32Å; D487-V489 PolarHBondContact O-N 2.67Å; D487-R490 PolarHBondContact O-N 2.76Å; D487-R490 VanDerWaalsContact O-N 3.09Å; D487-R490 IonicContact OD1-CZ 2.72Å; D487-R490 IonicContact OD1-NH2 3.86Å; D487-R490 PolarHBondContact OD1-NH2 2.84Å; D487-N491 PolarHBondContact O-N 2.79Å
488	Y	84.9	Confident	91.6	Very high	56 Å²	56	31.7 Å²	31.7	22%	0.22	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-65.5	-30.6	179.6	-48.6	-53.5	0	0	0	113.3	L440 V453 V455 V458 C486 R490 N491	L440-Y488 HydrophobicContact CD1-CE2 4.44Å; V453-Y488 HydrophobicContact CG1-CE2 4.34Å; V455-Y488 HydrophobicContact CB-CD1 4.24Å; V455-Y488 HydrophobicContact CG1-CD1 3.85Å; V455-Y488 HydrophobicContact CG1-CG 4.4Å; V455-Y488 HydrophobicContact CG2-CD1 3.8Å; V455-Y488 HydrophobicContact CG2-CE1 3.86Å; V458-Y488 HydrophobicContact CB-CD2 4.22Å; V458-Y488 HydrophobicContact CG1-CD2 3.74Å; V458-Y488 HydrophobicContact CG1-CE2 4.37Å; V458-Y488 HydrophobicContact CG1-CG 4.33Å; V458-Y488 HydrophobicContact CG2-CD2 4.27Å; V458-Y488 HydrophobicContact CG2-CE2 4.19Å; C486-Y488 PolarHBondContact O-N 2.66Å; Y488-R490 PolarHBondContact O-N 3.49Å; Y488-N491 PolarHBondContact O-N 3.39Å
489	V	90.7	Very high	91.5	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.012	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-72.7	-8.8	175.2	-57.3	0	0	0	0	112.9	L462 L482 F483 C486 D487 M495 S525	L462-V489 HydrophobicContact CD1-CG1 4.21Å; L482-V489 HydrophobicContact CB-CG1 4.33Å; F483-V489 HydrophobicContact CD2-CG2 4.42Å; C486-V489 WeakPolarHBondContact O-CG2 3.29Å; C486-V489 PolarHBondContact O-N 2.75Å; D487-V489 VanDerWaalsContact C-N 3.32Å; D487-V489 PolarHBondContact O-N 2.67Å; V489-M495 VanDerWaalsContact O-CE 3.3Å; V489-M495 WeakPolarHBondContact O-CE 3.12Å; V489-S525 WeakPolarHBondContact O-CB 3.46Å; V489-S525 PolarHBondContact O-OG 3.09Å
490	R	91.3	Very high	91.3	Very high	74 Å²	74	34.1 Å²	34.1	28%	0.279	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-106.8	8.3	173.7	-59.8	-177.8	-68.1	170.3	-2.6	112.7	F483 D487 Y488 W492	F483-R490 HydrophobicContact CE2-CG 4.06Å; F483-R490 HydrophobicContact CZ-CG 4.38Å; D487-R490 PolarHBondContact O-N 2.76Å; D487-R490 VanDerWaalsContact O-N 3.09Å; D487-R490 IonicContact OD1-CZ 2.72Å; D487-R490 IonicContact OD1-NH2 3.86Å; D487-R490 PolarHBondContact OD1-NH2 2.84Å; Y488-R490 PolarHBondContact O-N 3.49Å; R490-W492 HydrophobicContact CB-CZ2 4.37Å; R490-W492 PolarHBondContact O-N 2.9Å
491	N	92.9	Very high	90.5	Very high	58 Å²	58	38.2 Å²	38.2	31%	0.31	20%	0.198	S	C	.	.			trans	-91.4	69.6	178.2	-166.3	-20.3	0	0	0	111.1	V455 D487 Y488 S493 A494 M495	V455-N491 HydrophobicContact CG1-CB 4.39Å; D487-N491 PolarHBondContact O-N 2.79Å; Y488-N491 PolarHBondContact O-N 3.39Å; N491-S493 PolarHBondContact O-N 2.84Å; N491-A494 HydrophobicContact CB-CB 4.22Å; N491-A494 PolarHBondContact O-N 2.71Å; N491-A494 VanDerWaalsContact O-N 3.07Å; N491-A494 WeakPolarHBondContact OD1-CB 3.47Å; N491-A494 PolarHBondContact OD1-N 2.98Å; N491-A494 VanDerWaalsContact OD1-N 3.08Å; N491-M495 PolarHBondContact O-N 3.19Å; N491-M495 VanDerWaalsContact O-N 3.17Å
492	W	94.9	Very high	89	Confident	14 Å²	14	46.7 Å²	46.7	5%	0.053	24%	0.237	C	C	.	.	H	α-helix	trans	-59.2	-31.9	-177	-53.4	-57.5	0	0	0	113.6	R490 M495 T496 S525 A529 R559 I560 F564	R490-W492 HydrophobicContact CB-CZ2 4.37Å; R490-W492 PolarHBondContact O-N 2.9Å; W492-M495 PolarHBondContact O-N 3.02Å; W492-T496 VanDerWaalsContact O-CB 3.28Å; W492-T496 WeakPolarHBondContact O-CB 3.39Å; W492-T496 PolarHBondContact O-N 3.11Å; W492-T496 PolarHBondContact O-OG1 3.3Å; W492-S525 PolarHBondContact NE1-OG 3.48Å; W492-A529 HydrophobicContact CH2-CB 4.23Å; W492-A529 HydrophobicContact CZ2-CB 3.92Å; W492-R559 HydrophobicContact CZ3-CB 4.5Å; W492-I560 HydrophobicContact CD2-CG1 4.27Å; W492-I560 HydrophobicContact CE3-CG1 3.91Å; W492-I560 HydrophobicContact CH2-CD1 3.67Å; W492-I560 HydrophobicContact CH2-CG1 3.33Å; W492-I560 HydrophobicContact CZ2-CD1 3.85Å; W492-I560 HydrophobicContact CZ2-CG1 3.72Å; W492-I560 HydrophobicContact CZ3-CD1 4.29Å; W492-I560 HydrophobicContact CZ3-CG1 3.44Å; W492-I560 VanDerWaalsContact CZ3-CG1 3.44Å; W492-F564 HydrophobicContact CB-CE2 3.8Å; W492-F564 HydrophobicContact CB-CZ 3.77Å; W492-F564 HydrophobicContact CD2-CE2 4.39Å; W492-F564 AromaticContact CG-CE2 3.83Å; W492-F564 HydrophobicContact CG-CE2 3.83Å; W492-F564 HydrophobicContact CG-CZ 4.1Å
493	S	93.6	Very high	87.3	Confident	58 Å²	58	51.2 Å²	51.2	41%	0.406	27%	0.269	S	S	.	.	H	α-helix	trans	-62	-47.4	172.6	166.3	0	0	0	0	111.7	N491 M495 T496 D497	N491-S493 PolarHBondContact O-N 2.84Å; S493-M495 VanDerWaalsContact C-N 3.32Å; S493-M495 PolarHBondContact O-N 2.94Å; S493-T496 PolarHBondContact O-N 3.13Å; S493-D497 WeakPolarHBondContact O-CB 3.4Å; S493-D497 PolarHBondContact O-N 2.9Å
494	A	91.9	Very high	85.6	Confident	10 Å²	10	52.8 Å²	52.8	8%	0.083	28%	0.283	C	S	.	.	H	α-helix	trans	-65.1	-33.8	177.3	0	0	0	0	0	113.1	V455 L459 N491 L498	V455-A494 HydrophobicContact CG1-CB 3.83Å; L459-A494 HydrophobicContact CD1-CB 4.04Å; N491-A494 HydrophobicContact CB-CB 4.22Å; N491-A494 PolarHBondContact O-N 2.71Å; N491-A494 VanDerWaalsContact O-N 3.07Å; N491-A494 WeakPolarHBondContact OD1-CB 3.47Å; N491-A494 PolarHBondContact OD1-N 2.98Å; N491-A494 VanDerWaalsContact OD1-N 3.08Å; A494-L498 WeakPolarHBondContact O-CG 3.22Å; A494-L498 PolarHBondContact O-N 3.38Å
495	M	94.6	Very high	83.9	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-67.9	-44.3	173.6	-59.6	177.9	179.4	0	0	111.4	L459 V489 N491 W492 S493 L498 L499 L518 I521 M522	L459-M495 HydrophobicContact CD1-CG 3.95Å; L459-M495 HydrophobicContact CD2-CE 3.81Å; L459-M495 HydrophobicContact CD2-CG 4.17Å; V489-M495 VanDerWaalsContact O-CE 3.3Å; V489-M495 WeakPolarHBondContact O-CE 3.12Å; N491-M495 PolarHBondContact O-N 3.19Å; N491-M495 VanDerWaalsContact O-N 3.17Å; W492-M495 PolarHBondContact O-N 3.02Å; S493-M495 VanDerWaalsContact C-N 3.32Å; S493-M495 PolarHBondContact O-N 2.94Å; M495-L498 PolarHBondContact O-N 3.08Å; M495-L499 WeakPolarHBondContact O-CG 3.08Å; M495-L499 PolarHBondContact O-N 3.07Å; M495-L499 VanDerWaalsContact O-N 3.14Å; M495-L518 HydrophobicContact CB-CD1 4.17Å; M495-L518 HydrophobicContact CB-CG 4.39Å; M495-L518 HydrophobicContact CG-CD1 3.94Å; M495-L518 HydrophobicContact SD-CD1 4.49Å; M495-I521 HydrophobicContact CE-CG2 3.78Å; M495-I521 HydrophobicContact SD-CG2 4.45Å; M495-M522 HydrophobicContact CB-CG 4.48Å; M495-M522 HydrophobicContact CB-SD 3.99Å; M495-M522 HydrophobicContact SD-CB 3.71Å; M495-M522 HydrophobicContact SD-CG 3.94Å
496	T	94.4	Very high	82.3	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.018	33%	0.33	C	S	.	.	H	α-helix	trans	-65.4	-42.4	179.3	-60.2	0	0	0	0	111.8	W492 S493 L498 L499 L500 H563 T567 L571	W492-T496 VanDerWaalsContact O-CB 3.28Å; W492-T496 WeakPolarHBondContact O-CB 3.39Å; W492-T496 PolarHBondContact O-N 3.11Å; W492-T496 PolarHBondContact O-OG1 3.3Å; S493-T496 PolarHBondContact O-N 3.13Å; T496-L498 VanDerWaalsContact C-N 3.33Å; T496-L498 PolarHBondContact O-N 3.35Å; T496-L499 PolarHBondContact O-N 2.73Å; T496-L499 VanDerWaalsContact O-N 3.15Å; T496-L500 HydrophobicContact CG2-CD1 3.7Å; T496-L500 HydrophobicContact CG2-CG 4.31Å; T496-L500 WeakPolarHBondContact O-CB 3.22Å; T496-L500 WeakPolarHBondContact O-CG 3.34Å; T496-L500 PolarHBondContact O-N 3.29Å; T496-H563 PolarHBondContact OG1-NE2 3.06Å; T496-T567 HydrophobicContact CG2-CG2 3.86Å; T496-L571 HydrophobicContact CG2-CD1 4.27Å
497	D	91.7	Very high	81.1	Confident	62 Å²	62	66.1 Å²	66.1	33%	0.332	34%	0.342	S	S	.	.	H	α-helix	trans	-54.2	-48.7	171.8	-84.8	14.5	0	0	0	111.3	R456 S493 L499 L500 L501	R456-D497 IonicContact NH2-OD2 3.25Å; R456-D497 PolarHBondContact NH2-OD2 3.13Å; S493-D497 WeakPolarHBondContact O-CB 3.4Å; S493-D497 PolarHBondContact O-N 2.9Å; D497-L499 PolarHBondContact O-N 3.37Å; D497-L500 PolarHBondContact O-N 2.94Å; D497-L501 HydrophobicContact CB-CD1 3.99Å; D497-L501 VanDerWaalsContact O-CB 3.25Å; D497-L501 WeakPolarHBondContact O-CB 3.35Å; D497-L501 WeakPolarHBondContact O-CD1 3.36Å; D497-L501 WeakPolarHBondContact O-CG 3.49Å; D497-L501 PolarHBondContact O-N 3.36Å
498	L	90.7	Very high	80.1	Confident	24 Å²	24	70.8 Å²	70.8	13%	0.126	35%	0.352	C	S	.	.	H	α-helix	trans	-64	-28.1	179.6	-74.5	173.4	0	0	0	113.1	R456 L459 F460 A494 M495 T496 L518	R456-L498 HydrophobicContact CB-CD1 4.43Å; R456-L498 HydrophobicContact CB-CD2 4.18Å; R456-L498 HydrophobicContact CG-CD1 4.36Å; R456-L498 HydrophobicContact CG-CD2 3.97Å; R456-L498 HydrophobicContact CG-CG 4.23Å; L459-L498 HydrophobicContact CB-CD1 3.94Å; L459-L498 HydrophobicContact CD1-CD1 3.77Å; F460-L498 HydrophobicContact CE2-CD2 3.76Å; F460-L498 HydrophobicContact CZ-CD2 3.68Å; A494-L498 WeakPolarHBondContact O-CG 3.22Å; A494-L498 PolarHBondContact O-N 3.38Å; M495-L498 PolarHBondContact O-N 3.08Å; T496-L498 VanDerWaalsContact C-N 3.33Å; T496-L498 PolarHBondContact O-N 3.35Å; L498-L518 HydrophobicContact CB-CD2 3.8Å; L498-L518 HydrophobicContact CD1-CD2 4.15Å
499	L	93.2	Very high	79.6	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-86.7	-20.5	178.3	-68.4	169.5	0	0	0	113.6	M495 T496 D497 E515 L518 I519 M522 L571 K574 F575	M495-L499 WeakPolarHBondContact O-CG 3.08Å; M495-L499 PolarHBondContact O-N 3.07Å; M495-L499 VanDerWaalsContact O-N 3.14Å; T496-L499 PolarHBondContact O-N 2.73Å; T496-L499 VanDerWaalsContact O-N 3.15Å; D497-L499 PolarHBondContact O-N 3.37Å; L499-E515 HydrophobicContact CD2-CB 4.02Å; L499-E515 HydrophobicContact CD2-CG 4.25Å; L499-L518 HydrophobicContact CD1-CD2 4.47Å; L499-L518 HydrophobicContact CD1-CG 4.44Å; L499-L518 HydrophobicContact CD2-CB 4.35Å; L499-L518 HydrophobicContact CD2-CD2 4.1Å; L499-L518 HydrophobicContact CD2-CG 4.43Å; L499-L518 HydrophobicContact CG-CD2 3.93Å; L499-L518 HydrophobicContact CG-CG 4.37Å; L499-I519 HydrophobicContact CD1-CG1 3.67Å; L499-I519 HydrophobicContact CD2-CD1 4.33Å; L499-I519 HydrophobicContact CD2-CG1 3.97Å; L499-M522 HydrophobicContact CD1-CE 3.8Å; L499-M522 HydrophobicContact CD1-SD 4.32Å; L499-L571 HydrophobicContact CB-CD2 3.77Å; L499-L571 HydrophobicContact CD1-CD2 4.08Å; L499-K574 WeakPolarHBondContact O-CD 3.42Å; L499-K574 PolarHBondContact O-NZ 3.38Å; L499-F575 HydrophobicContact CB-CE2 4.11Å; L499-F575 HydrophobicContact CB-CZ 4.25Å; L499-F575 HydrophobicContact CD2-CE2 4.2Å; L499-F575 HydrophobicContact CD2-CZ 3.78Å
500	L	90.7	Very high	79.3	Confident	56 Å²	56	72.3 Å²	72.3	29%	0.293	37%	0.372	S	S	.	.	H	α-helix	trans	-111.9	-22.2	-175.6	-66.3	-179	0	0	0	114.9	T496 D497 Q570 L571	T496-L500 HydrophobicContact CG2-CD1 3.7Å; T496-L500 HydrophobicContact CG2-CG 4.31Å; T496-L500 WeakPolarHBondContact O-CB 3.22Å; T496-L500 WeakPolarHBondContact O-CG 3.34Å; T496-L500 PolarHBondContact O-N 3.29Å; D497-L500 PolarHBondContact O-N 2.94Å; L500-Q570 HydrophobicContact CD1-CB 4.16Å; L500-Q570 HydrophobicContact CD2-CB 4.17Å; L500-L571 HydrophobicContact CD1-CD2 4.4Å; L500-L571 HydrophobicContact CD2-CD2 3.81Å; L500-L571 HydrophobicContact CD2-CG 4.34Å; L500-L571 HydrophobicContact CG-CD2 3.91Å
501	L	79.5	Confident	79.2	Confident	85 Å²	85	73.8 Å²	73.8	45%	0.445	39%	0.386	S	S	.	.	S	Bend	trans	-71.7	134.4	-179.8	-72.8	168.9	0	0	0	112	R456 D497	R456-L501 VanDerWaalsContact NH2-CD1 3.32Å; D497-L501 HydrophobicContact CB-CD1 3.99Å; D497-L501 VanDerWaalsContact O-CB 3.25Å; D497-L501 WeakPolarHBondContact O-CB 3.35Å; D497-L501 WeakPolarHBondContact O-CD1 3.36Å; D497-L501 WeakPolarHBondContact O-CG 3.49Å; D497-L501 PolarHBondContact O-N 3.36Å
502	E	62.6	Low	79.1	Confident	178 Å²	178	78.9 Å²	78.9	83%	0.832	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-64.7	146.8	169.8	-65.3	-176.8	167.2	0	0	111.1	S504	E502-S504 PolarHBondContact O-N 3.23Å
503	S	60.4	Low	79	Confident	97 Å²	97	84.7 Å²	84.7	68%	0.678	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-65.6	129	178.8	53.7	0	0	0	0	111.2
504	S	57.5	Low	79	Confident	58 Å²	58	81.9 Å²	81.9	41%	0.406	41%	0.41	S	S	.	.	B	Isolated β-bridge	trans	-126.3	166.1	173.8	71.8	0	0	0	0	109.4	E502 E506 N507	E502-S504 PolarHBondContact O-N 3.23Å; S504-E506 PolarHBondContact O-N 3Å; S504-E506 PolarHBondContact OG-N 3.49Å; S504-N507 CarbonylContact O-C 3.56Å; S504-N507 PolarHBondContact O-N 3.23Å; S504-N507 VanDerWaalsContact O-O 3.08Å; S504-N507 PolarHBondContact OG-N 3.42Å; S504-N507 PolarHBondContact OG-ND2 3.08Å
505	E	50.1	Low	79.1	Confident	211 Å²	211	83.1 Å²	83.1	99%	0.986	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-19.9	175.5	-64.6	-168.6	153.8	0	0	113.1
506	E	52.6	Low	79.1	Confident	185 Å²	185	84.4 Å²	84.4	86%	0.864	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-19.1	176	-59.3	-172.6	155	0	0	113.7	S504	S504-E506 PolarHBondContact O-N 3Å; S504-E506 PolarHBondContact OG-N 3.49Å
507	N	58.9	Low	79.2	Confident	49 Å²	49	84.9 Å²	84.9	26%	0.262	43%	0.426	S	S	.	.	B	Isolated β-bridge	trans	-113.9	102.3	-178.1	-70.3	-46.2	0	0	0	111	R456 S504 A509	R456-N507 PolarHBondContact NH1-OD1 2.95Å; S504-N507 CarbonylContact O-C 3.56Å; S504-N507 PolarHBondContact O-N 3.23Å; S504-N507 VanDerWaalsContact O-O 3.08Å; S504-N507 PolarHBondContact OG-N 3.42Å; S504-N507 PolarHBondContact OG-ND2 3.08Å; N507-A509 PolarHBondContact O-N 3.13Å
508	R	65.7	Low	79.4	Confident	206 Å²	206	82 Å²	82	78%	0.777	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-59.5	118.6	168.4	-179.6	177.7	-179.6	-178.1	-1.2	109.4	F460	F460-R508 HydrophobicContact CZ-CB 4.47Å; F460-R508 WeakPolarHBondContact CZ-O 3.37Å
509	A	73.4	Confident	79.7	Confident	63 Å²	63	80.9 Å²	80.9	52%	0.521	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-66.2	148.4	171	0	0	0	0	0	111.3	N507	N507-A509 PolarHBondContact O-N 3.13Å
510	L	84.6	Confident	79.8	Confident	28 Å²	28	81.5 Å²	81.5	15%	0.147	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-72.6	151.8	158.9	-69.7	166.8	0	0	0	109	F460 V463 E515 L518	F460-L510 HydrophobicContact CD1-CD2 3.58Å; F460-L510 HydrophobicContact CD1-CG 4.33Å; F460-L510 HydrophobicContact CE1-CD2 3.5Å; F460-L510 VanDerWaalsContact CE1-CD2 3.5Å; F460-L510 HydrophobicContact CE1-CG 3.74Å; V463-L510 HydrophobicContact CG1-CD2 4.25Å; L510-E515 HydrophobicContact CB-CG 3.64Å; L510-E515 HydrophobicContact CD1-CG 4.32Å; L510-L518 HydrophobicContact CD1-CB 4.15Å; L510-L518 HydrophobicContact CD1-CD2 3.57Å
511	D	89.4	Confident	80.1	Confident	105 Å²	105	79 Å²	79	56%	0.561	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-81.4	167.6	161.5	59.3	-8.2	0	0	0	109.8	R513 G514 E515	D511-R513 PolarHBondContact O-N 2.83Å; D511-G514 CarbonylContact O-C 3.49Å; D511-G514 WeakPolarHBondContact O-CA 3.47Å; D511-G514 PolarHBondContact O-N 3.37Å; D511-G514 WeakPolarHBondContact OD1-CA 3.46Å; D511-G514 PolarHBondContact OD1-N 2.92Å; D511-E515 PolarHBondContact O-N 3.43Å
512	E	90.7	Very high	80.9	Confident	165 Å²	165	75 Å²	75	77%	0.771	37%	0.374	S	S	*	.	H	α-helix	trans	-51.9	-42.9	-177.6	-62.9	174.1	172.6	0	0	112	G514 E515 S516	E512-G514 VanDerWaalsContact C-N 3.35Å; E512-G514 PolarHBondContact O-N 3.41Å; E512-E515 PolarHBondContact O-N 3.42Å; E512-S516 PolarHBondContact O-N 2.9Å; E512-S516 PolarHBondContact O-OG 3.23Å
513	R	92	Very high	82.5	Confident	135 Å²	135	66.8 Å²	66.8	51%	0.509	34%	0.337	S	S	.	.	H	α-helix	trans	-64.3	-38.4	176.3	-170	178.2	-176.7	-174.3	-0.2	112.3	I467 D511 T517	I467-R513 HydrophobicContact CD1-CG 4.01Å; I467-R513 HydrophobicContact CG1-CG 4.31Å; D511-R513 PolarHBondContact O-N 2.83Å; R513-T517 WeakPolarHBondContact O-CB 3.32Å; R513-T517 PolarHBondContact O-N 3.15Å; R513-T517 PolarHBondContact O-OG1 2.78Å
514	G	93.5	Very high	84.2	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-68.4	-37.5	174.7	0	0	0	0	0	113.3	D511 E512 L518	D511-G514 CarbonylContact O-C 3.49Å; D511-G514 WeakPolarHBondContact O-CA 3.47Å; D511-G514 PolarHBondContact O-N 3.37Å; D511-G514 WeakPolarHBondContact OD1-CA 3.46Å; D511-G514 PolarHBondContact OD1-N 2.92Å; E512-G514 VanDerWaalsContact C-N 3.35Å; E512-G514 PolarHBondContact O-N 3.41Å; G514-L518 WeakPolarHBondContact O-CB 3.42Å; G514-L518 PolarHBondContact O-N 2.96Å
515	E	94.4	Very high	86.1	Confident	35 Å²	35	61.9 Å²	61.9	16%	0.164	30%	0.296	C	S	.	.	H	α-helix	trans	-63.3	-52.6	173.6	-66.9	-168.4	128.6	0	0	111	L499 L510 D511 E512 T517 L518 I519 K574 F575	L499-E515 HydrophobicContact CD2-CB 4.02Å; L499-E515 HydrophobicContact CD2-CG 4.25Å; L510-E515 HydrophobicContact CB-CG 3.64Å; L510-E515 HydrophobicContact CD1-CG 4.32Å; D511-E515 PolarHBondContact O-N 3.43Å; E512-E515 PolarHBondContact O-N 3.42Å; E515-T517 VanDerWaalsContact C-N 3.31Å; E515-T517 PolarHBondContact O-N 3.25Å; E515-L518 PolarHBondContact O-N 2.88Å; E515-I519 WeakPolarHBondContact O-CG1 3.26Å; E515-I519 PolarHBondContact O-N 2.86Å; E515-K574 IonicContact OE1-NZ 3.92Å; E515-K574 PolarHBondContact OE1-NZ 2.9Å; E515-K574 IonicContact OE2-NZ 3.99Å; E515-F575 HydrophobicContact CB-CE1 3.9Å; E515-F575 HydrophobicContact CB-CZ 4.29Å; E515-F575 HydrophobicContact CG-CE1 4.39Å; E515-F575 WeakPolarHBondContact OE2-CE1 3.41Å
516	S	95.3	Very high	88.3	Confident	28 Å²	28	51.8 Å²	51.8	20%	0.196	25%	0.249	C	C	.	.	H	α-helix	trans	-60.2	-39.7	177.1	-56.5	0	0	0	0	112.6	E512 L518 I519 D520 N578 D581	E512-S516 PolarHBondContact O-N 2.9Å; E512-S516 PolarHBondContact O-OG 3.23Å; S516-L518 VanDerWaalsContact C-N 3.32Å; S516-L518 PolarHBondContact O-N 3.16Å; S516-I519 PolarHBondContact O-N 2.82Å; S516-D520 WeakPolarHBondContact O-CB 3.36Å; S516-D520 PolarHBondContact O-N 3.44Å; S516-N578 PolarHBondContact OG-ND2 3.44Å; S516-D581 VanDerWaalsContact CA-OD1 3.22Å; S516-D581 WeakPolarHBondContact CA-OD1 3.42Å; S516-D581 WeakPolarHBondContact CB-OD1 3.36Å; S516-D581 VanDerWaalsContact OG-CG 3.29Å; S516-D581 PolarHBondContact OG-OD1 3.11Å; S516-D581 VanDerWaalsContact OG-OD1 3.13Å; S516-D581 PolarHBondContact OG-OD2 3.4Å
517	T	95.8	Very high	90.2	Very high	13 Å²	13	45.3 Å²	45.3	8%	0.08	22%	0.218	C	C	.	.	H	α-helix	trans	-62.3	-38.7	174.5	-58.1	0	0	0	0	111.9	V463 H466 T475 R513 E515 D520 I521	V463-T517 HydrophobicContact CB-CG2 4.27Å; V463-T517 HydrophobicContact CG1-CG2 4.04Å; V463-T517 HydrophobicContact CG2-CG2 4.15Å; H466-T517 HydrophobicContact CB-CG2 4.18Å; T475-T517 HydrophobicContact CG2-CG2 4.15Å; R513-T517 WeakPolarHBondContact O-CB 3.32Å; R513-T517 PolarHBondContact O-N 3.15Å; R513-T517 PolarHBondContact O-OG1 2.78Å; E515-T517 VanDerWaalsContact C-N 3.31Å; E515-T517 PolarHBondContact O-N 3.25Å; T517-D520 PolarHBondContact O-N 3.26Å; T517-I521 HydrophobicContact CG2-CD1 4.28Å; T517-I521 WeakPolarHBondContact O-CG1 3.19Å; T517-I521 PolarHBondContact O-N 3.17Å
518	L	96.1	Very high	91.9	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-71.6	-36.9	177.6	-176.3	60.1	0	0	0	111.9	L459 V463 M495 L498 L499 L510 G514 E515 S516 D520 I521 M522	L459-L518 HydrophobicContact CD2-CD1 4.46Å; V463-L518 HydrophobicContact CG2-CB 4.08Å; V463-L518 HydrophobicContact CG2-CD1 4.36Å; M495-L518 HydrophobicContact CB-CD1 4.17Å; M495-L518 HydrophobicContact CB-CG 4.39Å; M495-L518 HydrophobicContact CG-CD1 3.94Å; M495-L518 HydrophobicContact SD-CD1 4.49Å; L498-L518 HydrophobicContact CB-CD2 3.8Å; L498-L518 HydrophobicContact CD1-CD2 4.15Å; L499-L518 HydrophobicContact CD1-CD2 4.47Å; L499-L518 HydrophobicContact CD1-CG 4.44Å; L499-L518 HydrophobicContact CD2-CB 4.35Å; L499-L518 HydrophobicContact CD2-CD2 4.1Å; L499-L518 HydrophobicContact CD2-CG 4.43Å; L499-L518 HydrophobicContact CG-CD2 3.93Å; L499-L518 HydrophobicContact CG-CG 4.37Å; L510-L518 HydrophobicContact CD1-CB 4.15Å; L510-L518 HydrophobicContact CD1-CD2 3.57Å; G514-L518 WeakPolarHBondContact O-CB 3.42Å; G514-L518 PolarHBondContact O-N 2.96Å; E515-L518 PolarHBondContact O-N 2.88Å; S516-L518 VanDerWaalsContact C-N 3.32Å; S516-L518 PolarHBondContact O-N 3.16Å; L518-D520 VanDerWaalsContact C-N 3.33Å; L518-I521 PolarHBondContact O-N 2.97Å; L518-M522 VanDerWaalsContact O-CB 3.27Å; L518-M522 WeakPolarHBondContact O-CB 3.38Å; L518-M522 PolarHBondContact O-N 2.96Å
519	I	96.9	Very high	93.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61.9	-42.2	172.7	-68.8	167.4	0	0	0	110.6	L499 E515 S516 M522 A523 F575 D581 N584 L585	L499-I519 HydrophobicContact CD1-CG1 3.67Å; L499-I519 HydrophobicContact CD2-CD1 4.33Å; L499-I519 HydrophobicContact CD2-CG1 3.97Å; E515-I519 WeakPolarHBondContact O-CG1 3.26Å; E515-I519 PolarHBondContact O-N 2.86Å; S516-I519 PolarHBondContact O-N 2.82Å; I519-M522 WeakPolarHBondContact O-CB 3.47Å; I519-M522 PolarHBondContact O-N 3.15Å; I519-A523 WeakPolarHBondContact O-CB 3.39Å; I519-A523 PolarHBondContact O-N 2.92Å; I519-F575 HydrophobicContact CD1-CB 4.36Å; I519-F575 HydrophobicContact CD1-CD1 3.74Å; I519-F575 HydrophobicContact CD1-CD2 3.69Å; I519-F575 HydrophobicContact CD1-CE1 3.91Å; I519-F575 HydrophobicContact CD1-CE2 3.87Å; I519-F575 HydrophobicContact CD1-CG 3.64Å; I519-F575 HydrophobicContact CD1-CZ 3.97Å; I519-D581 HydrophobicContact CD1-CB 3.89Å; I519-D581 HydrophobicContact CG2-CB 4.32Å; I519-N584 HydrophobicContact CG2-CB 3.84Å; I519-L585 HydrophobicContact CG2-CD2 4.16Å; I519-L585 HydrophobicContact CG2-CG 3.97Å
520	D	96.1	Very high	94	Very high	14 Å²	14	30.8 Å²	30.8	8%	0.075	15%	0.147	C	C	.	.	H	α-helix	trans	-65.3	-46	177.4	-164.1	71	0	0	0	112.3	T475 S516 T517 L518 M522 A523 F524 N584	T475-D520 WeakPolarHBondContact CA-OD2 3.23Å; T475-D520 VanDerWaalsContact CB-OD2 3.22Å; T475-D520 WeakPolarHBondContact CB-OD2 3.43Å; T475-D520 HydrophobicContact CG2-CB 4.22Å; T475-D520 VanDerWaalsContact CG2-OD2 3.28Å; T475-D520 WeakPolarHBondContact CG2-OD2 3.37Å; T475-D520 PolarHBondContact N-OD2 2.7Å; T475-D520 VanDerWaalsContact OG1-C 3.27Å; T475-D520 PolarHBondContact OG1-O 2.94Å; T475-D520 PolarHBondContact OG1-OD2 3.29Å; S516-D520 WeakPolarHBondContact O-CB 3.36Å; S516-D520 PolarHBondContact O-N 3.44Å; T517-D520 PolarHBondContact O-N 3.26Å; L518-D520 VanDerWaalsContact C-N 3.33Å; D520-M522 VanDerWaalsContact C-N 3.27Å; D520-M522 PolarHBondContact O-N 3.37Å; D520-A523 PolarHBondContact O-N 2.75Å; D520-F524 WeakPolarHBondContact O-CD2 3.25Å; D520-F524 PolarHBondContact O-N 2.94Å; D520-F524 WeakPolarHBondContact OD1-CE2 3.4Å; D520-F524 WeakPolarHBondContact OD2-CD2 3.48Å; D520-F524 WeakPolarHBondContact OD2-CE2 3.49Å; D520-N584 PolarHBondContact OD1-ND2 2.99Å
521	I	96.3	Very high	94.2	Very high	3 Å²	3	31 Å²	31	2%	0.015	15%	0.15	C	C	.	.	H	α-helix	trans	-55.7	-45.4	172.3	-71.4	169.1	0	0	0	110.3	L462 V463 T475 V479 M495 T517 L518 S525	L462-I521 HydrophobicContact CB-CD1 4.46Å; V463-I521 HydrophobicContact CG2-CD1 4.11Å; T475-I521 HydrophobicContact CG2-CG1 3.78Å; T475-I521 WeakPolarHBondContact OG1-CA 3.5Å; T475-I521 PolarHBondContact OG1-N 2.73Å; V479-I521 HydrophobicContact CG2-CB 4.48Å; V479-I521 HydrophobicContact CG2-CG2 4.24Å; M495-I521 HydrophobicContact CE-CG2 3.78Å; M495-I521 HydrophobicContact SD-CG2 4.45Å; T517-I521 HydrophobicContact CG2-CD1 4.28Å; T517-I521 WeakPolarHBondContact O-CG1 3.19Å; T517-I521 PolarHBondContact O-N 3.17Å; L518-I521 PolarHBondContact O-N 2.97Å; I521-S525 VanDerWaalsContact O-CB 3.26Å; I521-S525 WeakPolarHBondContact O-CB 3.46Å; I521-S525 PolarHBondContact O-N 3.41Å; I521-S525 PolarHBondContact O-OG 3.49Å
522	M	96.8	Very high	94.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.9	-49.7	-179.3	-174.1	170.6	65.6	0	0	111.3	M495 L499 L518 I519 D520 S525 V526 F564 L571 L585 I588	M495-M522 HydrophobicContact CB-CG 4.48Å; M495-M522 HydrophobicContact CB-SD 3.99Å; M495-M522 HydrophobicContact SD-CB 3.71Å; M495-M522 HydrophobicContact SD-CG 3.94Å; L499-M522 HydrophobicContact CD1-CE 3.8Å; L499-M522 HydrophobicContact CD1-SD 4.32Å; L518-M522 VanDerWaalsContact O-CB 3.27Å; L518-M522 WeakPolarHBondContact O-CB 3.38Å; L518-M522 PolarHBondContact O-N 2.96Å; I519-M522 WeakPolarHBondContact O-CB 3.47Å; I519-M522 PolarHBondContact O-N 3.15Å; D520-M522 VanDerWaalsContact C-N 3.27Å; D520-M522 PolarHBondContact O-N 3.37Å; M522-S525 PolarHBondContact O-N 3.4Å; M522-S525 PolarHBondContact O-OG 3.02Å; M522-V526 WeakPolarHBondContact O-CG2 3.35Å; M522-V526 PolarHBondContact O-N 3.47Å; M522-F564 HydrophobicContact CE-CE1 4.17Å; M522-F564 HydrophobicContact CG-CE1 4.35Å; M522-F564 HydrophobicContact CG-CZ 3.76Å; M522-F564 HydrophobicContact SD-CE1 3.7Å; M522-F564 HydrophobicContact SD-CZ 3.64Å; M522-L571 HydrophobicContact CE-CD1 4.03Å; M522-L585 HydrophobicContact CE-CD2 3.79Å; M522-I588 HydrophobicContact CE-CD1 4.1Å; M522-I588 HydrophobicContact CG-CD1 4.24Å
523	A	96.5	Very high	93.9	Very high	6 Å²	6	25.3 Å²	25.3	5%	0.05	13%	0.128	C	C	.	.	H	α-helix	trans	-62.8	-46	179.8	0	0	0	0	0	112.7	I519 D520 S525 V526 K527 N584 I588	I519-A523 WeakPolarHBondContact O-CB 3.39Å; I519-A523 PolarHBondContact O-N 2.92Å; D520-A523 PolarHBondContact O-N 2.75Å; A523-S525 VanDerWaalsContact C-N 3.33Å; A523-S525 PolarHBondContact O-N 3.39Å; A523-V526 PolarHBondContact O-N 3.18Å; A523-K527 WeakPolarHBondContact O-CB 3.42Å; A523-K527 PolarHBondContact O-N 3Å; A523-N584 HydrophobicContact CB-CB 3.83Å; A523-N584 WeakPolarHBondContact CB-O 3.04Å; A523-I588 HydrophobicContact CB-CD1 4.41Å; A523-I588 HydrophobicContact CB-CG1 4.28Å
524	F	95.9	Very high	93.7	Very high	52 Å²	52	20 Å²	20	23%	0.228	11%	0.111	C	C	.	.	H	α-helix	trans	-67.2	-32.6	176.4	-79	-63.4	0	0	0	113	H474 A476 V479 D520 K527 Q528	H474-F524 HydrophobicContact CB-CE2 4.1Å; A476-F524 HydrophobicContact CB-CB 4.47Å; A476-F524 HydrophobicContact CB-CD1 3.46Å; A476-F524 VanDerWaalsContact CB-CD1 3.46Å; A476-F524 HydrophobicContact CB-CD2 3.95Å; A476-F524 HydrophobicContact CB-CE1 3.56Å; A476-F524 HydrophobicContact CB-CE2 4.02Å; A476-F524 HydrophobicContact CB-CG 3.69Å; A476-F524 HydrophobicContact CB-CZ 3.85Å; V479-F524 HydrophobicContact CB-CB 4.36Å; V479-F524 HydrophobicContact CG1-CB 4.49Å; V479-F524 HydrophobicContact CG2-CB 4.05Å; D520-F524 WeakPolarHBondContact O-CD2 3.25Å; D520-F524 PolarHBondContact O-N 2.94Å; D520-F524 WeakPolarHBondContact OD1-CE2 3.4Å; D520-F524 WeakPolarHBondContact OD2-CD2 3.48Å; D520-F524 WeakPolarHBondContact OD2-CE2 3.49Å; F524-K527 PolarHBondContact O-N 3.21Å; F524-Q528 WeakPolarHBondContact O-CB 3.5Å; F524-Q528 PolarHBondContact O-N 3.01Å
525	S	96.1	Very high	93.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-67.8	-38.9	174.5	76.6	0	0	0	0	112.9	V489 W492 I521 M522 A523 A529	V489-S525 WeakPolarHBondContact O-CB 3.46Å; V489-S525 PolarHBondContact O-OG 3.09Å; W492-S525 PolarHBondContact NE1-OG 3.48Å; I521-S525 VanDerWaalsContact O-CB 3.26Å; I521-S525 WeakPolarHBondContact O-CB 3.46Å; I521-S525 PolarHBondContact O-N 3.41Å; I521-S525 PolarHBondContact O-OG 3.49Å; M522-S525 PolarHBondContact O-N 3.4Å; M522-S525 PolarHBondContact O-OG 3.02Å; A523-S525 VanDerWaalsContact C-N 3.33Å; A523-S525 PolarHBondContact O-N 3.39Å; S525-A529 VanDerWaalsContact O-CB 3.31Å; S525-A529 WeakPolarHBondContact O-CB 3.42Å; S525-A529 PolarHBondContact O-N 2.97Å
526	V	96.3	Very high	93	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.3	-51.1	173.1	162.1	0	0	0	0	109.6	M522 A523 Q528 A529 S530 I560 F564 I588 Y591	M522-V526 WeakPolarHBondContact O-CG2 3.35Å; M522-V526 PolarHBondContact O-N 3.47Å; A523-V526 PolarHBondContact O-N 3.18Å; V526-Q528 PolarHBondContact O-N 3.06Å; V526-A529 PolarHBondContact O-N 3.43Å; V526-S530 WeakPolarHBondContact O-CB 3.35Å; V526-S530 PolarHBondContact O-N 3.32Å; V526-S530 PolarHBondContact O-OG 3.41Å; V526-I560 HydrophobicContact CG1-CD1 4.25Å; V526-I560 HydrophobicContact CG1-CG2 3.87Å; V526-I560 HydrophobicContact CG2-CG1 4.49Å; V526-I560 HydrophobicContact CG2-CG2 4.27Å; V526-F564 HydrophobicContact CG2-CD2 4.39Å; V526-F564 HydrophobicContact CG2-CE2 3.58Å; V526-F564 HydrophobicContact CG2-CZ 4.18Å; V526-I588 HydrophobicContact CB-CG1 4.25Å; V526-I588 HydrophobicContact CG1-CB 4.41Å; V526-I588 HydrophobicContact CG1-CG1 4.19Å; V526-I588 HydrophobicContact CG1-CG2 4.22Å; V526-I588 HydrophobicContact CG2-CD1 4.47Å; V526-I588 HydrophobicContact CG2-CG1 4.23Å; V526-I588 HydrophobicContact CG2-CG2 4.43Å; V526-Y591 HydrophobicContact CG1-CD2 4.03Å
527	K	94.2	Very high	92.3	Very high	48 Å²	48	22.7 Å²	22.7	21%	0.209	15%	0.145	C	C	.	.	H	α-helix	trans	-54.1	-52.2	178.5	176.6	163.4	-174.5	136	0	112.1	A523 F524 A529 S530 T531 Y591 E1093	A523-K527 WeakPolarHBondContact O-CB 3.42Å; A523-K527 PolarHBondContact O-N 3Å; F524-K527 PolarHBondContact O-N 3.21Å; K527-A529 VanDerWaalsContact C-N 3.32Å; K527-A529 PolarHBondContact O-N 2.92Å; K527-S530 PolarHBondContact O-N 3.47Å; K527-T531 PolarHBondContact O-N 3.33Å; K527-T531 PolarHBondContact O-OG1 3.17Å; K527-Y591 HydrophobicContact CB-CE2 3.77Å; K527-Y591 HydrophobicContact CD-CE2 4.38Å; K527-Y591 WeakPolarHBondContact CD-OH 3.42Å; K527-Y591 WeakPolarHBondContact CE-OH 3.34Å; K527-Y591 HydrophobicContact CG-CE2 4Å; K527-Y591 WeakPolarHBondContact CG-OH 3.32Å; K527-Y591 PolarHBondContact NZ-OH 3.26Å; K527-Y591 VanDerWaalsContact NZ-OH 3.14Å; K527-E1093 WeakPolarHBondContact CE-OE1 3.23Å; K527-E1093 IonicContact NZ-OE1 2.78Å; K527-E1093 PolarHBondContact NZ-OE1 3.1Å; K527-E1093 IonicContact NZ-OE2 3.79Å; K527-E1093 PolarHBondContact NZ-OE2 3.32Å
528	Q	92.9	Very high	91.9	Very high	9 Å²	9	22.3 Å²	22.3	4%	0.042	14%	0.142	C	C	.	.	H	α-helix	trans	-68.6	-28.6	-177.8	-172.9	165.1	9.3	0	0	113.1	D480 F483 F524 V526 G532	D480-Q528 VanDerWaalsContact CA-OE1 3.23Å; D480-Q528 PolarHBondContact OD1-NE2 3.27Å; F483-Q528 HydrophobicContact CD1-CG 4.04Å; F483-Q528 HydrophobicContact CD2-CB 4.12Å; F483-Q528 HydrophobicContact CD2-CG 3.97Å; F483-Q528 HydrophobicContact CE1-CG 4.03Å; F483-Q528 HydrophobicContact CE2-CB 3.86Å; F483-Q528 HydrophobicContact CE2-CG 3.96Å; F483-Q528 HydrophobicContact CG-CG 4.02Å; F483-Q528 HydrophobicContact CZ-CB 4.18Å; F483-Q528 HydrophobicContact CZ-CG 4Å; F524-Q528 WeakPolarHBondContact O-CB 3.5Å; F524-Q528 PolarHBondContact O-N 3.01Å; V526-Q528 PolarHBondContact O-N 3.06Å; Q528-G532 VanDerWaalsContact O-CA 3.24Å; Q528-G532 WeakPolarHBondContact O-CA 3.48Å; Q528-G532 PolarHBondContact O-N 3.05Å
529	A	93.3	Very high	90.9	Very high	2 Å²	2	25.8 Å²	25.8	2%	0.017	16%	0.164	C	C	.	.	H	α-helix	trans	-71.4	-42	172.1	0	0	0	0	0	112.5	F483 W492 S525 V526 K527 D556 I560	F483-A529 HydrophobicContact CE2-CB 4.36Å; F483-A529 HydrophobicContact CZ-CB 3.88Å; W492-A529 HydrophobicContact CH2-CB 4.23Å; W492-A529 HydrophobicContact CZ2-CB 3.92Å; S525-A529 VanDerWaalsContact O-CB 3.31Å; S525-A529 WeakPolarHBondContact O-CB 3.42Å; S525-A529 PolarHBondContact O-N 2.97Å; V526-A529 PolarHBondContact O-N 3.43Å; K527-A529 VanDerWaalsContact C-N 3.32Å; K527-A529 PolarHBondContact O-N 2.92Å; A529-D556 HydrophobicContact CB-CB 4.3Å; A529-I560 HydrophobicContact CB-CD1 3.98Å
530	S	91.8	Very high	89.4	Confident	3 Å²	3	30.3 Å²	30.3	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-76	-28.6	-176.9	-64.6	0	0	0	0	114.4	V526 K527 Q557 I560	V526-S530 WeakPolarHBondContact O-CB 3.35Å; V526-S530 PolarHBondContact O-N 3.32Å; V526-S530 PolarHBondContact O-OG 3.41Å; K527-S530 PolarHBondContact O-N 3.47Å; S530-Q557 PolarHBondContact O-NE2 2.92Å; S530-I560 VanDerWaalsContact OG-CD1 3.31Å; S530-I560 WeakPolarHBondContact OG-CD1 3.46Å
531	T	88.3	Confident	87.7	Confident	33 Å²	33	33.3 Å²	33.3	20%	0.202	21%	0.213	C	C	.	.	H	α-helix	trans	-107.7	-22.1	-179.1	67.9	0	0	0	0	113.9	K527 E533 W553 Y591	K527-T531 PolarHBondContact O-N 3.33Å; K527-T531 PolarHBondContact O-OG1 3.17Å; T531-E533 PolarHBondContact O-N 2.97Å; T531-E533 VanDerWaalsContact O-N 3.16Å; T531-E533 PolarHBondContact OG1-N 3.11Å; T531-E533 VanDerWaalsContact OG1-N 3.14Å; T531-W553 WeakPolarHBondContact O-CH2 3.37Å; T531-W553 WeakPolarHBondContact O-CZ3 3.45Å; T531-Y591 HydrophobicContact CG2-CD1 4.37Å; T531-Y591 HydrophobicContact CG2-CE1 3.79Å
532	G	87	Confident	85.9	Confident	32 Å²	32	41.7 Å²	41.7	33%	0.33	25%	0.25	S	C	.	.			trans	67	1.5	-169.3	0	0	0	0	0	115	Q528	Q528-G532 VanDerWaalsContact O-CA 3.24Å; Q528-G532 WeakPolarHBondContact O-CA 3.48Å; Q528-G532 PolarHBondContact O-N 3.05Å
533	E	85.7	Confident	84.3	Confident	118 Å²	118	49.7 Å²	49.7	55%	0.551	28%	0.284	S	S	*	.	P	Polyproline II helix	trans	-89.9	129.3	-175.4	-61	-150.4	143.8	0	0	112	T531	T531-E533 PolarHBondContact O-N 2.97Å; T531-E533 VanDerWaalsContact O-N 3.16Å; T531-E533 PolarHBondContact OG1-N 3.11Å; T531-E533 VanDerWaalsContact OG1-N 3.14Å
534	P	89.1	Confident	83	Confident	24 Å²	24	60.1 Å²	60.1	16%	0.156	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-73.6	158	171.1	34.4	-37.3	0	0	0	110.7	D480 R538	D480-P534 WeakPolarHBondContact OD1-CB 3.47Å; P534-R538 HydrophobicContact CB-CB 4.18Å
535	P	89.3	Confident	82.1	Confident	25 Å²	25	62.4 Å²	62.4	16%	0.162	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-57.1	150.9	-179.4	24.6	-35.4	0	0	0	112.8	A476 F477 D480 G537 R538	A476-P535 HydrophobicContact CB-CB 4.03Å; A476-P535 HydrophobicContact CB-CG 4.44Å; F477-P535 HydrophobicContact CD1-CB 4.35Å; F477-P535 HydrophobicContact CD1-CG 3.82Å; F477-P535 HydrophobicContact CE1-CB 4.14Å; F477-P535 HydrophobicContact CE1-CG 4.01Å; F477-P535 HydrophobicContact CG-CG 4.48Å; D480-P535 VanDerWaalsContact CB-CD 3.46Å; D480-P535 HydrophobicContact CB-CG 3.93Å; P535-G537 PolarHBondContact O-N 3.48Å; P535-R538 WeakPolarHBondContact O-CB 3.49Å; P535-R538 PolarHBondContact O-N 3Å
536	A	83.2	Confident	81.5	Confident	31 Å²	31	65.8 Å²	65.8	26%	0.256	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	132.4	-178.6	0	0	0	0	0	111.7	I1088	A536-I1088 HydrophobicContact CB-CD1 3.71Å
537	G	81.2	Confident	81.1	Confident	63 Å²	63	73.2 Å²	73.2	65%	0.649	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.9	-21.2	-172.1	0	0	0	0	0	113.9	P535	P535-G537 PolarHBondContact O-N 3.48Å
538	R	88	Confident	80.9	Confident	4 Å²	4	80.8 Å²	80.8	2%	0.015	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-8.2	171.1	-73.7	-168.1	-179.8	163.7	12	114.7	V424 A426 R429 F477 D480 P534 P535 V540	V424-R538 PolarHBondContact O-NH2 3.05Å; A426-R538 PolarHBondContact O-NE 3.11Å; A426-R538 PolarHBondContact O-NH2 3.02Å; R429-R538 HydrophobicContact CB-CB 4Å; R429-R538 HydrophobicContact CB-CG 4.05Å; R429-R538 HydrophobicContact CG-CB 4.26Å; R429-R538 HydrophobicContact CG-CG 4.5Å; F477-R538 HydrophobicContact CD1-CG 4.3Å; F477-R538 HydrophobicContact CE1-CG 4.23Å; F477-R538 PolarHBondContact O-NH1 3.45Å; F477-R538 PolarHBondContact O-NH2 3.43Å; D480-R538 WeakPolarHBondContact OD2-CD 3.47Å; D480-R538 IonicContact OD2-CZ 2.76Å; D480-R538 IonicContact OD2-NE 3.4Å; D480-R538 IonicContact OD2-NH1 2.64Å; D480-R538 PolarHBondContact OD2-NH1 3.39Å; P534-R538 HydrophobicContact CB-CB 4.18Å; P535-R538 WeakPolarHBondContact O-CB 3.49Å; P535-R538 PolarHBondContact O-N 3Å; R538-V540 PolarHBondContact O-N 3.34Å; R538-V540 VanDerWaalsContact O-N 3.09Å
539	T	74.9	Confident	80.6	Confident	75 Å²	75	84.6 Å²	84.6	46%	0.46	44%	0.438	S	S	.	.			trans	-57.9	109.4	174.3	-32.4	0	0	0	0	111.1
540	V	65.2	Low	80.3	Confident	94 Å²	94	88.4 Å²	88.4	57%	0.57	46%	0.455	S	S	*	.			trans	-80.5	124.3	171.5	-174.8	0	0	0	0	107.8	R538 K542	R538-V540 PolarHBondContact O-N 3.34Å; R538-V540 VanDerWaalsContact O-N 3.09Å; V540-K542 PolarHBondContact O-N 2.98Å
541	S	59.9	Low	80.3	Confident	77 Å²	77	95.3 Å²	95.3	54%	0.538	48%	0.481	S	S	.	.	S	Bend	trans	-21	119.3	-173.8	58.8	0	0	0	0	116	K543	S541-K543 PolarHBondContact O-N 3.36Å
542	K	57.7	Low	80.3	Confident	180 Å²	180	97.7 Å²	97.7	78%	0.783	49%	0.49	S	S	*	.			trans	-17.8	94.8	-176.7	-73.6	-163.1	176.4	-166.7	0	112	V540 E1096	V540-K542 PolarHBondContact O-N 2.98Å; K542-E1096 IonicContact NZ-OE2 3.98Å; K542-E1096 PolarHBondContact NZ-OE2 3.43Å; K542-E1096 VanDerWaalsContact NZ-OE2 3.14Å
543	K	63	Low	80.4	Confident	167 Å²	167	98.5 Å²	98.5	73%	0.726	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-77.7	141.1	167.3	-75.4	-178.9	179.5	174.1	0	107.7	S541 I545	S541-K543 PolarHBondContact O-N 3.36Å; K543-I545 PolarHBondContact O-N 3.21Å
544	Y	70.3	Confident	80.6	Confident	226 Å²	226	95.7 Å²	95.7	89%	0.886	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-60.3	122.9	164.6	-69.1	-84.7	0	0	0	109
545	I	76.1	Confident	80.8	Confident	99 Å²	99	99.3 Å²	99.3	51%	0.508	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-69.3	129.5	178.9	-59.6	159.2	0	0	0	107.9	K543 E549 H550 W553	K543-I545 PolarHBondContact O-N 3.21Å; I545-E549 HydrophobicContact CG2-CB 4.13Å; I545-H550 HydrophobicContact CG2-CB 4.2Å; I545-W553 HydrophobicContact CB-CH2 4.19Å; I545-W553 HydrophobicContact CD1-CH2 3.58Å; I545-W553 HydrophobicContact CD1-CZ3 3.7Å; I545-W553 HydrophobicContact CG1-CH2 3.64Å; I545-W553 HydrophobicContact CG1-CZ3 4.19Å; I545-W553 HydrophobicContact CG2-CE3 4.47Å; I545-W553 HydrophobicContact CG2-CH2 3.46Å; I545-W553 VanDerWaalsContact CG2-CH2 3.46Å; I545-W553 HydrophobicContact CG2-CZ2 4.02Å; I545-W553 HydrophobicContact CG2-CZ3 3.71Å
546	T	85.2	Confident	80.9	Confident	71 Å²	71	98.3 Å²	98.3	44%	0.436	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-80.1	150.1	177.2	68.4	0	0	0	0	111	R548 E549 H550	T546-R548 PolarHBondContact O-N 3.36Å; T546-E549 VanDerWaalsContact CB-OE2 3.24Å; T546-E549 WeakPolarHBondContact CB-OE2 3.31Å; T546-E549 VanDerWaalsContact CG2-OE2 3.31Å; T546-E549 WeakPolarHBondContact CG2-OE2 3.24Å; T546-E549 PolarHBondContact N-OE2 3.04Å; T546-E549 PolarHBondContact O-N 2.78Å; T546-E549 VanDerWaalsContact OG1-CD 3.26Å; T546-E549 WeakPolarHBondContact OG1-CG 3.49Å; T546-E549 PolarHBondContact OG1-N 2.83Å; T546-E549 PolarHBondContact OG1-OE2 2.9Å; T546-H550 PolarHBondContact O-N 3.33Å
547	Q	87.8	Confident	81.4	Confident	157 Å²	157	98.8 Å²	98.8	73%	0.734	48%	0.476	S	S	*	.	H	α-helix	trans	-58.3	-11.3	173.4	-66.8	-177	-6.4	0	0	114.5	R551	Q547-R551 PolarHBondContact O-NE 3.4Å
548	R	89.5	Confident	82.1	Confident	207 Å²	207	99.5 Å²	99.5	78%	0.781	46%	0.463	S	S	*	.	H	α-helix	trans	-85.9	-43.5	173.2	-176.7	179.9	176.9	-173.8	-2.4	111.2	T546 R551 Q552	T546-R548 PolarHBondContact O-N 3.36Å; R548-R551 PolarHBondContact O-N 2.82Å; R548-Q552 PolarHBondContact O-N 3.39Å; R548-Q552 VanDerWaalsContact O-N 3.09Å
549	E	86.9	Confident	82.4	Confident	89 Å²	89	104.8 Å²	104.8	42%	0.416	48%	0.483	S	S	.	.	H	α-helix	trans	-63.5	-48.1	175.7	-71.2	153.5	146.3	0	0	110.3	I545 T546 R551 Q552 W553	I545-E549 HydrophobicContact CG2-CB 4.13Å; T546-E549 VanDerWaalsContact CB-OE2 3.24Å; T546-E549 WeakPolarHBondContact CB-OE2 3.31Å; T546-E549 VanDerWaalsContact CG2-OE2 3.31Å; T546-E549 WeakPolarHBondContact CG2-OE2 3.24Å; T546-E549 PolarHBondContact N-OE2 3.04Å; T546-E549 PolarHBondContact O-N 2.78Å; T546-E549 VanDerWaalsContact OG1-CD 3.26Å; T546-E549 WeakPolarHBondContact OG1-CG 3.49Å; T546-E549 PolarHBondContact OG1-N 2.83Å; T546-E549 PolarHBondContact OG1-OE2 2.9Å; E549-R551 VanDerWaalsContact C-N 3.29Å; E549-R551 PolarHBondContact O-N 2.75Å; E549-Q552 WeakPolarHBondContact O-CA 3.44Å; E549-Q552 WeakPolarHBondContact O-CB 3.4Å; E549-Q552 PolarHBondContact O-N 3.4Å; E549-W553 HydrophobicContact CB-CZ2 4.17Å; E549-W553 VanDerWaalsContact O-CD1 3.27Å; E549-W553 VanDerWaalsContact O-CG 3.25Å; E549-W553 PolarHBondContact O-N 3.25Å
550	H	86.6	Confident	83.3	Confident	82 Å²	82	101.2 Å²	101.2	38%	0.38	46%	0.461	S	S	.	.	H	α-helix	trans	-58	-38.6	177.6	-178	59.7	0	0	0	113.2	I545 T546 W553 L554	I545-H550 HydrophobicContact CG2-CB 4.2Å; T546-H550 PolarHBondContact O-N 3.33Å; H550-W553 PolarHBondContact O-N 3.06Å; H550-L554 PolarHBondContact O-N 2.74Å
551	R	91.2	Very high	84.8	Confident	147 Å²	147	96.8 Å²	96.8	56%	0.555	43%	0.434	S	S	*	.	H	α-helix	trans	-65.3	-41.7	173.2	-89.2	-177.2	-83.7	-175.4	-14.4	112.7	Q547 R548 E549 W553 L554 E555	Q547-R551 PolarHBondContact O-NE 3.4Å; R548-R551 PolarHBondContact O-N 2.82Å; E549-R551 VanDerWaalsContact C-N 3.29Å; E549-R551 PolarHBondContact O-N 2.75Å; R551-W553 VanDerWaalsContact C-N 3.28Å; R551-W553 PolarHBondContact O-N 3Å; R551-L554 PolarHBondContact O-N 3.4Å; R551-E555 WeakPolarHBondContact O-CG 3.3Å; R551-E555 PolarHBondContact O-N 2.86Å
552	Q	89.7	Confident	86.4	Confident	83 Å²	83	97.6 Å²	97.6	39%	0.388	43%	0.429	S	S	.	.	H	α-helix	trans	-61.3	-38.5	175.9	-171	64.5	74.8	0	0	111.7	R548 E549 E555 D556	R548-Q552 PolarHBondContact O-N 3.39Å; R548-Q552 VanDerWaalsContact O-N 3.09Å; E549-Q552 WeakPolarHBondContact O-CA 3.44Å; E549-Q552 WeakPolarHBondContact O-CB 3.4Å; E549-Q552 PolarHBondContact O-N 3.4Å; Q552-E555 PolarHBondContact NE2-OE2 3.2Å; Q552-E555 PolarHBondContact O-N 3.23Å; Q552-D556 PolarHBondContact NE2-OD1 3.26Å; Q552-D556 WeakPolarHBondContact O-CB 3.48Å; Q552-D556 PolarHBondContact O-N 3.07Å; Q552-D556 VanDerWaalsContact O-OD1 3.08Å
553	W	89	Confident	88.3	Confident	50 Å²	50	91 Å²	91	19%	0.189	40%	0.401	C	S	.	.	H	α-helix	trans	-67.2	-38.5	178.7	-53.5	-21.7	0	0	0	112.3	T531 I545 E549 H550 R551 D556 Q557	T531-W553 WeakPolarHBondContact O-CH2 3.37Å; T531-W553 WeakPolarHBondContact O-CZ3 3.45Å; I545-W553 HydrophobicContact CB-CH2 4.19Å; I545-W553 HydrophobicContact CD1-CH2 3.58Å; I545-W553 HydrophobicContact CD1-CZ3 3.7Å; I545-W553 HydrophobicContact CG1-CH2 3.64Å; I545-W553 HydrophobicContact CG1-CZ3 4.19Å; I545-W553 HydrophobicContact CG2-CE3 4.47Å; I545-W553 HydrophobicContact CG2-CH2 3.46Å; I545-W553 VanDerWaalsContact CG2-CH2 3.46Å; I545-W553 HydrophobicContact CG2-CZ2 4.02Å; I545-W553 HydrophobicContact CG2-CZ3 3.71Å; E549-W553 HydrophobicContact CB-CZ2 4.17Å; E549-W553 VanDerWaalsContact O-CD1 3.27Å; E549-W553 VanDerWaalsContact O-CG 3.25Å; E549-W553 PolarHBondContact O-N 3.25Å; H550-W553 PolarHBondContact O-N 3.06Å; R551-W553 VanDerWaalsContact C-N 3.28Å; R551-W553 PolarHBondContact O-N 3Å; W553-D556 PolarHBondContact O-N 3.03Å; W553-Q557 WeakPolarHBondContact O-CB 3.5Å; W553-Q557 VanDerWaalsContact O-CG 3.26Å; W553-Q557 WeakPolarHBondContact O-CG 3.49Å; W553-Q557 PolarHBondContact O-N 3.03Å
554	L	89.7	Confident	89.9	Confident	58 Å²	58	83.1 Å²	83.1	30%	0.304	37%	0.367	S	S	.	.	H	α-helix	trans	-64.7	-45.1	173.1	-67.5	171.7	0	0	0	111.5	H550 R551 D556 Q557 E558	H550-L554 PolarHBondContact O-N 2.74Å; R551-L554 PolarHBondContact O-N 3.4Å; L554-D556 VanDerWaalsContact C-N 3.26Å; L554-D556 PolarHBondContact O-N 3.48Å; L554-Q557 PolarHBondContact O-N 3.41Å; L554-E558 WeakPolarHBondContact O-CG 3.38Å; L554-E558 PolarHBondContact O-N 2.96Å
555	E	92.7	Very high	91	Very high	100 Å²	100	72.4 Å²	72.4	47%	0.467	33%	0.325	S	S	.	.	H	α-helix	trans	-60.1	-35.4	173.5	-71	172	-164.2	0	0	112.2	R551 Q552 R559	R551-E555 WeakPolarHBondContact O-CG 3.3Å; R551-E555 PolarHBondContact O-N 2.86Å; Q552-E555 PolarHBondContact NE2-OE2 3.2Å; Q552-E555 PolarHBondContact O-N 3.23Å; E555-R559 VanDerWaalsContact O-CG 3.31Å; E555-R559 WeakPolarHBondContact O-CG 3.36Å; E555-R559 PolarHBondContact O-N 3.47Å
556	D	92.2	Very high	91.8	Very high	5 Å²	5	72.4 Å²	72.4	3%	0.027	32%	0.324	C	S	.	.	H	α-helix	trans	-73.4	-45.3	177.2	-74	16.5	0	0	0	111	A529 Q552 W553 L554 E558 R559 I560	A529-D556 HydrophobicContact CB-CB 4.3Å; Q552-D556 PolarHBondContact NE2-OD1 3.26Å; Q552-D556 WeakPolarHBondContact O-CB 3.48Å; Q552-D556 PolarHBondContact O-N 3.07Å; Q552-D556 VanDerWaalsContact O-OD1 3.08Å; W553-D556 PolarHBondContact O-N 3.03Å; L554-D556 VanDerWaalsContact C-N 3.26Å; L554-D556 PolarHBondContact O-N 3.48Å; D556-E558 VanDerWaalsContact C-N 3.32Å; D556-E558 PolarHBondContact O-N 3.25Å; D556-R559 VanDerWaalsContact CG-NH2 3.32Å; D556-R559 PolarHBondContact O-N 3.34Å; D556-R559 IonicContact OD1-CZ 3.48Å; D556-R559 IonicContact OD1-NE 2.7Å; D556-R559 IonicContact OD1-NH2 3.95Å; D556-R559 PolarHBondContact OD1-NH2 2.93Å; D556-R559 IonicContact OD2-NH2 3.94Å; D556-I560 WeakPolarHBondContact O-CB 3.34Å; D556-I560 WeakPolarHBondContact O-CD1 3.31Å; D556-I560 WeakPolarHBondContact O-CG1 3.41Å; D556-I560 PolarHBondContact O-N 3.03Å
557	Q	93.3	Very high	92.3	Very high	40 Å²	40	69.9 Å²	69.9	19%	0.187	31%	0.309	C	S	.	.	H	α-helix	trans	-58.5	-40.6	174	-75	176.3	7	0	0	112.2	S530 W553 L554 I560 T561 H593	S530-Q557 PolarHBondContact O-NE2 2.92Å; W553-Q557 WeakPolarHBondContact O-CB 3.5Å; W553-Q557 VanDerWaalsContact O-CG 3.26Å; W553-Q557 WeakPolarHBondContact O-CG 3.49Å; W553-Q557 PolarHBondContact O-N 3.03Å; L554-Q557 PolarHBondContact O-N 3.41Å; Q557-I560 PolarHBondContact O-N 3.22Å; Q557-T561 WeakPolarHBondContact O-CB 3.38Å; Q557-T561 PolarHBondContact O-N 2.67Å; Q557-T561 PolarHBondContact O-OG1 2.99Å; Q557-H593 HydrophobicContact CB-CB 4.16Å
558	E	94.3	Very high	92.7	Very high	79 Å²	79	62.4 Å²	62.4	37%	0.369	27%	0.274	S	S	.	.	H	α-helix	trans	-61.1	-52.2	174.5	-75.2	-176.7	164.3	0	0	110.9	L554 D556 I560 T561 E562 H593 V596	L554-E558 WeakPolarHBondContact O-CG 3.38Å; L554-E558 PolarHBondContact O-N 2.96Å; D556-E558 VanDerWaalsContact C-N 3.32Å; D556-E558 PolarHBondContact O-N 3.25Å; E558-I560 VanDerWaalsContact C-N 3.32Å; E558-I560 PolarHBondContact O-N 3.47Å; E558-T561 WeakPolarHBondContact O-CB 3.4Å; E558-T561 PolarHBondContact O-N 3.23Å; E558-E562 WeakPolarHBondContact O-CG 3.4Å; E558-E562 PolarHBondContact O-N 3.14Å; E558-H593 HydrophobicContact CG-CB 4.23Å; E558-H593 WeakPolarHBondContact CG-ND1 3.09Å; E558-H593 IonicContact OE1-CE1 3.75Å; E558-H593 PolarHBondContact OE1-CE1 3.35Å; E558-H593 IonicContact OE1-ND1 3.69Å; E558-H593 PolarHBondContact OE1-ND1 3.02Å; E558-V596 HydrophobicContact CB-CG2 4.21Å; E558-V596 HydrophobicContact CG-CG2 3.95Å
559	R	94.4	Very high	92.9	Very high	115 Å²	115	53.3 Å²	53.3	43%	0.434	24%	0.241	S	C	.	.	H	α-helix	trans	-60.5	-37.9	178.1	-69	-175	-58.8	135.2	-5.8	113.3	W492 E555 D556 H563	W492-R559 HydrophobicContact CZ3-CB 4.5Å; E555-R559 VanDerWaalsContact O-CG 3.31Å; E555-R559 WeakPolarHBondContact O-CG 3.36Å; E555-R559 PolarHBondContact O-N 3.47Å; D556-R559 VanDerWaalsContact CG-NH2 3.32Å; D556-R559 PolarHBondContact O-N 3.34Å; D556-R559 IonicContact OD1-CZ 3.48Å; D556-R559 IonicContact OD1-NE 2.7Å; D556-R559 IonicContact OD1-NH2 3.95Å; D556-R559 PolarHBondContact OD1-NH2 2.93Å; D556-R559 IonicContact OD2-NH2 3.94Å; R559-H563 PolarHBondContact O-N 3.1Å
560	I	95.6	Very high	93.3	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-48.2	173.4	-72	162.5	0	0	0	109.5	W492 V526 A529 S530 D556 Q557 E558 H563 F564 F592	W492-I560 HydrophobicContact CD2-CG1 4.27Å; W492-I560 HydrophobicContact CE3-CG1 3.91Å; W492-I560 HydrophobicContact CH2-CD1 3.67Å; W492-I560 HydrophobicContact CH2-CG1 3.33Å; W492-I560 HydrophobicContact CZ2-CD1 3.85Å; W492-I560 HydrophobicContact CZ2-CG1 3.72Å; W492-I560 HydrophobicContact CZ3-CD1 4.29Å; W492-I560 HydrophobicContact CZ3-CG1 3.44Å; W492-I560 VanDerWaalsContact CZ3-CG1 3.44Å; V526-I560 HydrophobicContact CG1-CD1 4.25Å; V526-I560 HydrophobicContact CG1-CG2 3.87Å; V526-I560 HydrophobicContact CG2-CG1 4.49Å; V526-I560 HydrophobicContact CG2-CG2 4.27Å; A529-I560 HydrophobicContact CB-CD1 3.98Å; S530-I560 VanDerWaalsContact OG-CD1 3.31Å; S530-I560 WeakPolarHBondContact OG-CD1 3.46Å; D556-I560 WeakPolarHBondContact O-CB 3.34Å; D556-I560 WeakPolarHBondContact O-CD1 3.31Å; D556-I560 WeakPolarHBondContact O-CG1 3.41Å; D556-I560 PolarHBondContact O-N 3.03Å; Q557-I560 PolarHBondContact O-N 3.22Å; E558-I560 VanDerWaalsContact C-N 3.32Å; E558-I560 PolarHBondContact O-N 3.47Å; I560-H563 PolarHBondContact O-N 3.09Å; I560-F564 HydrophobicContact CG2-CD2 3.86Å; I560-F564 HydrophobicContact CG2-CE2 4.39Å; I560-F564 WeakPolarHBondContact O-CB 3.33Å; I560-F564 WeakPolarHBondContact O-CD2 3.28Å; I560-F564 PolarHBondContact O-N 3.34Å; I560-F592 HydrophobicContact CG2-CE1 4.46Å
561	T	94.9	Very high	93.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.7	-44.4	-178.5	-51.3	0	0	0	0	111.5	Q557 E558 H563 A565 F592 H593 V596 Y597	Q557-T561 WeakPolarHBondContact O-CB 3.38Å; Q557-T561 PolarHBondContact O-N 2.67Å; Q557-T561 PolarHBondContact O-OG1 2.99Å; E558-T561 WeakPolarHBondContact O-CB 3.4Å; E558-T561 PolarHBondContact O-N 3.23Å; T561-H563 PolarHBondContact O-N 3.08Å; T561-A565 WeakPolarHBondContact O-CB 3.32Å; T561-A565 PolarHBondContact O-N 3.36Å; T561-F592 HydrophobicContact CG2-CB 4.03Å; T561-F592 HydrophobicContact CG2-CD1 4.33Å; T561-F592 HydrophobicContact CG2-CD2 4.4Å; T561-F592 HydrophobicContact CG2-CG 4.02Å; T561-F592 WeakPolarHBondContact OG1-CA 3.31Å; T561-H593 PolarHBondContact OG1-N 3.15Å; T561-V596 HydrophobicContact CG2-CB 3.82Å; T561-V596 HydrophobicContact CG2-CG1 4.05Å; T561-V596 HydrophobicContact CG2-CG2 4.2Å; T561-Y597 HydrophobicContact CG2-CD2 4.11Å; T561-Y597 HydrophobicContact CG2-CE2 3.83Å
562	E	95.3	Very high	93.9	Very high	95 Å²	95	43.3 Å²	43.3	44%	0.444	20%	0.201	S	C	.	.	H	α-helix	trans	-59	-44.3	177.9	-68.5	-169.9	136.2	0	0	112.5	E558 V596 Y602	E558-E562 WeakPolarHBondContact O-CG 3.4Å; E558-E562 PolarHBondContact O-N 3.14Å; E562-V596 HydrophobicContact CG-CG1 3.81Å; E562-Y602 WeakPolarHBondContact CG-OH 3.42Å
563	H	95.8	Very high	94.1	Very high	42 Å²	42	46 Å²	46	19%	0.194	21%	0.213	C	C	.	.	H	α-helix	trans	-71.3	-51.6	178.7	174.7	68.7	0	0	0	112.5	T496 R559 I560 T561 M566 T567	T496-H563 PolarHBondContact OG1-NE2 3.06Å; R559-H563 PolarHBondContact O-N 3.1Å; I560-H563 PolarHBondContact O-N 3.09Å; T561-H563 PolarHBondContact O-N 3.08Å; H563-M566 PolarHBondContact O-N 3.11Å; H563-T567 PolarHBondContact NE2-OG1 3.06Å; H563-T567 PolarHBondContact O-N 3.05Å; H563-T567 PolarHBondContact O-OG1 3.31Å
564	F	96.9	Very high	94.3	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-77.9	-22.7	-173.2	-75	-68.6	0	0	0	113.6	W492 M522 V526 I560 M566 T567 L568 L571 I588 F592	W492-F564 HydrophobicContact CB-CE2 3.8Å; W492-F564 HydrophobicContact CB-CZ 3.77Å; W492-F564 HydrophobicContact CD2-CE2 4.39Å; W492-F564 AromaticContact CG-CE2 3.83Å; W492-F564 HydrophobicContact CG-CE2 3.83Å; W492-F564 HydrophobicContact CG-CZ 4.1Å; M522-F564 HydrophobicContact CE-CE1 4.17Å; M522-F564 HydrophobicContact CG-CE1 4.35Å; M522-F564 HydrophobicContact CG-CZ 3.76Å; M522-F564 HydrophobicContact SD-CE1 3.7Å; M522-F564 HydrophobicContact SD-CZ 3.64Å; V526-F564 HydrophobicContact CG2-CD2 4.39Å; V526-F564 HydrophobicContact CG2-CE2 3.58Å; V526-F564 HydrophobicContact CG2-CZ 4.18Å; I560-F564 HydrophobicContact CG2-CD2 3.86Å; I560-F564 HydrophobicContact CG2-CE2 4.39Å; I560-F564 WeakPolarHBondContact O-CB 3.33Å; I560-F564 WeakPolarHBondContact O-CD2 3.28Å; I560-F564 PolarHBondContact O-N 3.34Å; F564-M566 PolarHBondContact O-N 3.25Å; F564-T567 PolarHBondContact O-N 3.43Å; F564-L568 HydrophobicContact CB-CB 4.25Å; F564-L568 HydrophobicContact CD1-CB 4.45Å; F564-L568 WeakPolarHBondContact O-CB 3.46Å; F564-L568 PolarHBondContact O-N 3Å; F564-L571 HydrophobicContact CD1-CD1 4.47Å; F564-L571 HydrophobicContact CE1-CD1 4.24Å; F564-I588 HydrophobicContact CB-CG2 4.08Å; F564-I588 HydrophobicContact CD1-CG2 4.08Å; F564-I588 HydrophobicContact CD2-CG2 3.69Å; F564-I588 HydrophobicContact CE1-CD1 4.16Å; F564-I588 HydrophobicContact CE1-CG2 4.44Å; F564-I588 HydrophobicContact CE2-CG2 4.09Å; F564-I588 HydrophobicContact CG-CG2 3.68Å; F564-I588 HydrophobicContact CZ-CD1 4.14Å; F564-I588 HydrophobicContact CZ-CG2 4.44Å; F564-F592 HydrophobicContact CB-CE1 3.68Å; F564-F592 HydrophobicContact CB-CZ 3.61Å
565	A	93.6	Very high	94.5	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-54.3	-41.3	169.7	0	0	0	0	0	111.6	T561 Y597 Y602 P605	T561-A565 WeakPolarHBondContact O-CB 3.32Å; T561-A565 PolarHBondContact O-N 3.36Å; A565-Y597 WeakPolarHBondContact CA-OH 3.27Å; A565-Y597 HydrophobicContact CB-CE1 3.92Å; A565-Y597 WeakPolarHBondContact CB-OH 3.49Å; A565-Y602 HydrophobicContact CB-CD1 4Å; A565-Y602 HydrophobicContact CB-CE1 4.46Å; A565-P605 HydrophobicContact CB-CB 4.34Å; A565-P605 WeakPolarHBondContact O-CB 3.21Å
566	M	93.9	Very high	94.5	Very high	99 Å²	99	43 Å²	43	49%	0.488	20%	0.201	S	C	.	.	H	α-helix	trans	-80.1	-26.9	-177.6	-62.4	-59.9	-64.6	0	0	114	H563 F564 Q570 Y602 P605	H563-M566 PolarHBondContact O-N 3.11Å; F564-M566 PolarHBondContact O-N 3.25Å; M566-Q570 PolarHBondContact O-NE2 2.88Å; M566-Q570 VanDerWaalsContact O-NE2 3.09Å; M566-Y602 HydrophobicContact SD-CD1 4.41Å; M566-Y602 HydrophobicContact SD-CE1 4.49Å; M566-P605 HydrophobicContact SD-CB 4.29Å; M566-P605 HydrophobicContact SD-CG 3.47Å; M566-P605 WeakPolarHBondContact SD-CG 3.5Å
567	T	95.3	Very high	94.4	Very high	19 Å²	19	49.4 Å²	49.4	12%	0.117	24%	0.24	C	C	.	.	H	α-helix	trans	-117.1	-29.8	-164.5	55.9	0	0	0	0	114.4	T496 H563 F564 P569 Q570 L571	T496-T567 HydrophobicContact CG2-CG2 3.86Å; H563-T567 PolarHBondContact NE2-OG1 3.06Å; H563-T567 PolarHBondContact O-N 3.05Å; H563-T567 PolarHBondContact O-OG1 3.31Å; F564-T567 PolarHBondContact O-N 3.43Å; T567-P569 VanDerWaalsContact C-CD 3.5Å; T567-Q570 WeakPolarHBondContact O-CB 3.34Å; T567-Q570 PolarHBondContact O-N 2.95Å; T567-L571 PolarHBondContact O-N 3.27Å; T567-L571 VanDerWaalsContact O-N 3.15Å
568	L	95.7	Very high	94.4	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-58.9	-39	-178.7	-173.2	61.3	0	0	0	114.1	F564 Q570 L571 L572 L585 I588 A589 F592 L609	F564-L568 HydrophobicContact CB-CB 4.25Å; F564-L568 HydrophobicContact CD1-CB 4.45Å; F564-L568 WeakPolarHBondContact O-CB 3.46Å; F564-L568 PolarHBondContact O-N 3Å; L568-Q570 PolarHBondContact O-N 3.15Å; L568-L571 PolarHBondContact O-N 3.11Å; L568-L572 HydrophobicContact CD1-CD1 4.44Å; L568-L572 HydrophobicContact CD1-CG 4.15Å; L568-L572 HydrophobicContact CG-CD1 4.01Å; L568-L572 HydrophobicContact CG-CG 4.21Å; L568-L572 WeakPolarHBondContact O-CB 3.5Å; L568-L572 WeakPolarHBondContact O-CG 3.41Å; L568-L572 PolarHBondContact O-N 3.33Å; L568-L585 HydrophobicContact CD1-CB 3.95Å; L568-L585 HydrophobicContact CD1-CD2 3.9Å; L568-L585 HydrophobicContact CD1-CG 4.48Å; L568-I588 HydrophobicContact CD2-CG2 4.46Å; L568-A589 HydrophobicContact CD2-CB 3.76Å; L568-F592 HydrophobicContact CD2-CE2 4.32Å; L568-F592 HydrophobicContact CD2-CZ 3.82Å; L568-L609 HydrophobicContact CD2-CD1 4.07Å; L568-L609 HydrophobicContact CG-CD1 4.33Å
569	P	94.7	Very high	94.3	Very high	16 Å²	16	49.2 Å²	49.2	10%	0.104	25%	0.245	C	C	.	.	H	α-helix	trans	-58.9	-33.1	174.2	-25.7	36.3	0	0	0	113.4	T567 H573 L609	T567-P569 VanDerWaalsContact C-CD 3.5Å; P569-H573 WeakPolarHBondContact O-CB 3.36Å; P569-H573 PolarHBondContact O-N 3.09Å; P569-L609 HydrophobicContact CG-CB 4.15Å
570	Q	94.6	Very high	94.3	Very high	106 Å²	106	48 Å²	48	50%	0.495	24%	0.244	S	C	.	.	H	α-helix	trans	-74.9	-42.5	179.5	-53.6	178.3	44.1	0	0	110.8	L500 M566 T567 L568 H573 K574	L500-Q570 HydrophobicContact CD1-CB 4.16Å; L500-Q570 HydrophobicContact CD2-CB 4.17Å; M566-Q570 PolarHBondContact O-NE2 2.88Å; M566-Q570 VanDerWaalsContact O-NE2 3.09Å; T567-Q570 WeakPolarHBondContact O-CB 3.34Å; T567-Q570 PolarHBondContact O-N 2.95Å; L568-Q570 PolarHBondContact O-N 3.15Å; Q570-H573 PolarHBondContact O-N 2.85Å; Q570-K574 PolarHBondContact O-N 2.89Å
571	L	95.8	Very high	94.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.7	-49.6	175.1	-67.6	167.7	0	0	0	111.3	T496 L499 L500 M522 F564 T567 L568 H573 K574 F575 L585	T496-L571 HydrophobicContact CG2-CD1 4.27Å; L499-L571 HydrophobicContact CB-CD2 3.77Å; L499-L571 HydrophobicContact CD1-CD2 4.08Å; L500-L571 HydrophobicContact CD1-CD2 4.4Å; L500-L571 HydrophobicContact CD2-CD2 3.81Å; L500-L571 HydrophobicContact CD2-CG 4.34Å; L500-L571 HydrophobicContact CG-CD2 3.91Å; M522-L571 HydrophobicContact CE-CD1 4.03Å; F564-L571 HydrophobicContact CD1-CD1 4.47Å; F564-L571 HydrophobicContact CE1-CD1 4.24Å; T567-L571 PolarHBondContact O-N 3.27Å; T567-L571 VanDerWaalsContact O-N 3.15Å; L568-L571 PolarHBondContact O-N 3.11Å; L571-H573 VanDerWaalsContact C-N 3.26Å; L571-H573 PolarHBondContact O-N 3.46Å; L571-K574 PolarHBondContact O-N 3.16Å; L571-K574 VanDerWaalsContact O-N 3.11Å; L571-F575 HydrophobicContact CD2-CD2 4.44Å; L571-F575 HydrophobicContact CD2-CE2 4.03Å; L571-F575 VanDerWaalsContact O-CD2 3.31Å; L571-F575 WeakPolarHBondContact O-CD2 3.22Å; L571-F575 PolarHBondContact O-N 2.98Å; L571-L585 HydrophobicContact CB-CD1 4.04Å; L571-L585 HydrophobicContact CB-CD2 3.97Å; L571-L585 HydrophobicContact CD1-CD2 4.09Å
572	L	95.3	Very high	94.4	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-58.4	-37.2	177.2	-72.5	172.8	0	0	0	112.4	L568 V576 L585 L586 L609 C612 L616	L568-L572 HydrophobicContact CD1-CD1 4.44Å; L568-L572 HydrophobicContact CD1-CG 4.15Å; L568-L572 HydrophobicContact CG-CD1 4.01Å; L568-L572 HydrophobicContact CG-CG 4.21Å; L568-L572 WeakPolarHBondContact O-CB 3.5Å; L568-L572 WeakPolarHBondContact O-CG 3.41Å; L568-L572 PolarHBondContact O-N 3.33Å; L572-V576 PolarHBondContact O-N 3.1Å; L572-L585 HydrophobicContact CD2-CB 3.51Å; L572-L585 HydrophobicContact CD2-CD1 4.19Å; L572-L585 HydrophobicContact CG-CB 4.34Å; L572-L586 HydrophobicContact CD2-CD2 4.46Å; L572-L586 HydrophobicContact CD2-CG 4.33Å; L572-L609 HydrophobicContact CD1-CD1 3.98Å; L572-C612 HydrophobicContact CD1-CB 4.37Å; L572-L616 HydrophobicContact CB-CD1 4.27Å; L572-L616 HydrophobicContact CD1-CD1 4.23Å; L572-L616 HydrophobicContact CD2-CD1 3.92Å; L572-L616 HydrophobicContact CG-CD1 4.37Å
573	H	92.8	Very high	94.4	Very high	138 Å²	138	44 Å²	44	64%	0.639	23%	0.226	S	C	*	.	H	α-helix	trans	-70.4	-39.2	175.4	-175.2	-77.4	0	0	0	112.7	P569 Q570 L571	P569-H573 WeakPolarHBondContact O-CB 3.36Å; P569-H573 PolarHBondContact O-N 3.09Å; Q570-H573 PolarHBondContact O-N 2.85Å; L571-H573 VanDerWaalsContact C-N 3.26Å; L571-H573 PolarHBondContact O-N 3.46Å
574	K	93.8	Very high	94.4	Very high	92 Å²	92	42.6 Å²	42.6	40%	0.4	22%	0.22	S	C	.	.	H	α-helix	trans	-67.5	-45.8	178	178.9	175.4	167.5	-177.6	0	111.9	L499 E515 Q570 L571	L499-K574 WeakPolarHBondContact O-CD 3.42Å; L499-K574 PolarHBondContact O-NZ 3.38Å; E515-K574 IonicContact OE1-NZ 3.92Å; E515-K574 PolarHBondContact OE1-NZ 2.9Å; E515-K574 IonicContact OE2-NZ 3.99Å; Q570-K574 PolarHBondContact O-N 2.89Å; L571-K574 PolarHBondContact O-N 3.16Å; L571-K574 VanDerWaalsContact O-N 3.11Å
575	F	93.9	Very high	94.4	Very high	13 Å²	13	42.6 Å²	42.6	6%	0.057	22%	0.22	C	C	.	.	S	Bend	trans	-96.5	11.2	-169.5	-64	-72.9	0	0	0	114.8	L499 E515 I519 L571 V577 N578 D581 L585	L499-F575 HydrophobicContact CB-CE2 4.11Å; L499-F575 HydrophobicContact CB-CZ 4.25Å; L499-F575 HydrophobicContact CD2-CE2 4.2Å; L499-F575 HydrophobicContact CD2-CZ 3.78Å; E515-F575 HydrophobicContact CB-CE1 3.9Å; E515-F575 HydrophobicContact CB-CZ 4.29Å; E515-F575 HydrophobicContact CG-CE1 4.39Å; E515-F575 WeakPolarHBondContact OE2-CE1 3.41Å; I519-F575 HydrophobicContact CD1-CB 4.36Å; I519-F575 HydrophobicContact CD1-CD1 3.74Å; I519-F575 HydrophobicContact CD1-CD2 3.69Å; I519-F575 HydrophobicContact CD1-CE1 3.91Å; I519-F575 HydrophobicContact CD1-CE2 3.87Å; I519-F575 HydrophobicContact CD1-CG 3.64Å; I519-F575 HydrophobicContact CD1-CZ 3.97Å; L571-F575 HydrophobicContact CD2-CD2 4.44Å; L571-F575 HydrophobicContact CD2-CE2 4.03Å; L571-F575 VanDerWaalsContact O-CD2 3.31Å; L571-F575 WeakPolarHBondContact O-CD2 3.22Å; L571-F575 PolarHBondContact O-N 2.98Å; F575-V577 PolarHBondContact O-N 2.9Å; F575-N578 PolarHBondContact O-N 3.34Å; F575-D581 HydrophobicContact CB-CB 4.14Å; F575-L585 HydrophobicContact CB-CD1 4.12Å; F575-L585 HydrophobicContact CD2-CD1 4.28Å
576	V	92.2	Very high	94.5	Very high	41 Å²	41	42.6 Å²	42.6	25%	0.248	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-25.7	-177.6	63.1	0	0	0	0	115.7	L572 L616 H620	L572-V576 PolarHBondContact O-N 3.1Å; V576-L616 HydrophobicContact CB-CD2 4.42Å; V576-L616 HydrophobicContact CG2-CD2 3.75Å; V576-H620 PolarHBondContact O-CE1 3.18Å; V576-H620 PolarHBondContact O-NE2 2.68Å
577	V	90.4	Very high	94.6	Very high	139 Å²	139	38.7 Å²	38.7	84%	0.842	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-29.9	-177.9	-176.2	0	0	0	0	112.6	F575	F575-V577 PolarHBondContact O-N 2.9Å
578	N	92.2	Very high	94.6	Very high	58 Å²	58	37.9 Å²	37.9	31%	0.31	20%	0.196	S	C	.	.			trans	-95	115	-176.6	-176.2	-19.7	0	0	0	110.6	S516 F575 Q580 D581 V582	S516-N578 PolarHBondContact OG-ND2 3.44Å; F575-N578 PolarHBondContact O-N 3.34Å; N578-Q580 PolarHBondContact O-N 2.85Å; N578-Q580 PolarHBondContact OD1-N 2.95Å; N578-D581 HydrophobicContact CB-CB 3.96Å; N578-D581 WeakPolarHBondContact CB-OD2 3.31Å; N578-D581 VanDerWaalsContact CG-OD2 3.25Å; N578-D581 VanDerWaalsContact ND2-CG 3.32Å; N578-D581 PolarHBondContact ND2-OD2 3.15Å; N578-D581 PolarHBondContact O-N 3.5Å; N578-D581 PolarHBondContact OD1-N 3.31Å; N578-V582 WeakPolarHBondContact O-CG2 3.12Å; N578-V582 PolarHBondContact O-N 2.88Å
579	T	93.8	Very high	94.5	Very high	58 Å²	58	38 Å²	38	36%	0.356	20%	0.197	S	C	.	.	H	α-helix	trans	-60.8	-43.1	-177.7	48.9	0	0	0	0	112.8	V582 I583 D622 V625	T579-V582 PolarHBondContact O-N 3.24Å; T579-I583 WeakPolarHBondContact O-CD1 3.3Å; T579-I583 VanDerWaalsContact O-CG1 3.28Å; T579-I583 WeakPolarHBondContact O-CG1 3.26Å; T579-I583 PolarHBondContact O-N 2.87Å; T579-D622 HydrophobicContact CG2-CB 4.14Å; T579-V625 HydrophobicContact CG2-CG2 4.1Å
580	Q	93.8	Very high	94.5	Very high	89 Å²	89	38.6 Å²	38.6	42%	0.416	20%	0.199	S	C	.	.	H	α-helix	trans	-67.6	-40	-179.2	-172.5	60.1	53	0	0	111.7	N578 I583 N584	N578-Q580 PolarHBondContact O-N 2.85Å; N578-Q580 PolarHBondContact OD1-N 2.95Å; Q580-I583 PolarHBondContact O-N 3.03Å; Q580-N584 PolarHBondContact NE2-OD1 3.26Å; Q580-N584 WeakPolarHBondContact O-CB 3.43Å; Q580-N584 PolarHBondContact O-N 3.42Å
581	D	95.7	Very high	94.4	Very high	5 Å²	5	34.9 Å²	34.9	3%	0.027	18%	0.18	C	C	.	.	H	α-helix	trans	-65.5	-41.7	176.7	-67.4	-20.1	0	0	0	110.8	S516 I519 F575 N578 N584 L585	S516-D581 VanDerWaalsContact CA-OD1 3.22Å; S516-D581 WeakPolarHBondContact CA-OD1 3.42Å; S516-D581 WeakPolarHBondContact CB-OD1 3.36Å; S516-D581 VanDerWaalsContact OG-CG 3.29Å; S516-D581 PolarHBondContact OG-OD1 3.11Å; S516-D581 VanDerWaalsContact OG-OD1 3.13Å; S516-D581 PolarHBondContact OG-OD2 3.4Å; I519-D581 HydrophobicContact CD1-CB 3.89Å; I519-D581 HydrophobicContact CG2-CB 4.32Å; F575-D581 HydrophobicContact CB-CB 4.14Å; N578-D581 HydrophobicContact CB-CB 3.96Å; N578-D581 WeakPolarHBondContact CB-OD2 3.31Å; N578-D581 VanDerWaalsContact CG-OD2 3.25Å; N578-D581 VanDerWaalsContact ND2-CG 3.32Å; N578-D581 PolarHBondContact ND2-OD2 3.15Å; N578-D581 PolarHBondContact O-N 3.5Å; N578-D581 PolarHBondContact OD1-N 3.31Å; D581-N584 PolarHBondContact O-N 3.09Å; D581-L585 WeakPolarHBondContact O-CB 3.24Å; D581-L585 WeakPolarHBondContact O-CG 3.46Å; D581-L585 PolarHBondContact O-N 2.99Å
582	V	96	Very high	94.3	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62	-43.4	174	170	0	0	0	0	111.5	N578 T579 L585 L586 L616 V625	N578-V582 WeakPolarHBondContact O-CG2 3.12Å; N578-V582 PolarHBondContact O-N 2.88Å; T579-V582 PolarHBondContact O-N 3.24Å; V582-L585 PolarHBondContact O-N 3.33Å; V582-L586 HydrophobicContact CG1-CD1 3.72Å; V582-L586 HydrophobicContact CG1-CG 4.26Å; V582-L586 WeakPolarHBondContact O-CB 3.44Å; V582-L586 VanDerWaalsContact O-CG 3.23Å; V582-L586 WeakPolarHBondContact O-CG 3.31Å; V582-L586 PolarHBondContact O-N 3.02Å; V582-L616 HydrophobicContact CG1-CD1 4.28Å; V582-L616 HydrophobicContact CG1-CD2 4.13Å; V582-L616 HydrophobicContact CG2-CD2 4.33Å; V582-V625 HydrophobicContact CG1-CG1 3.82Å; V582-V625 HydrophobicContact CG1-CG2 4.35Å
583	I	95.7	Very high	94	Very high	6 Å²	6	37.2 Å²	37.2	3%	0.031	19%	0.191	C	C	.	.	H	α-helix	trans	-59.3	-52.5	175.5	-71.7	160.8	0	0	0	110.3	T579 Q580 L585 L586 T587 E624 V625 P1090	T579-I583 WeakPolarHBondContact O-CD1 3.3Å; T579-I583 VanDerWaalsContact O-CG1 3.28Å; T579-I583 WeakPolarHBondContact O-CG1 3.26Å; T579-I583 PolarHBondContact O-N 2.87Å; Q580-I583 PolarHBondContact O-N 3.03Å; I583-L585 VanDerWaalsContact C-N 3.32Å; I583-L585 PolarHBondContact O-N 3.45Å; I583-L586 PolarHBondContact O-N 2.81Å; I583-L586 VanDerWaalsContact O-N 3.16Å; I583-T587 PolarHBondContact O-N 2.61Å; I583-T587 PolarHBondContact O-OG1 3.01Å; I583-E624 HydrophobicContact CD1-CB 3.65Å; I583-E624 HydrophobicContact CG1-CB 4.46Å; I583-V625 HydrophobicContact CD1-CG2 4.16Å; I583-V625 HydrophobicContact CG1-CG2 3.92Å; I583-P1090 HydrophobicContact CG2-CG 4.31Å
584	N	96.1	Very high	93.8	Very high	13 Å²	13	31.5 Å²	31.5	7%	0.07	17%	0.165	C	C	.	.	H	α-helix	trans	-58.1	-41.4	179.4	-79.1	-7.6	0	0	0	112.3	I519 D520 A523 Q580 D581 I588	I519-N584 HydrophobicContact CG2-CB 3.84Å; D520-N584 PolarHBondContact OD1-ND2 2.99Å; A523-N584 HydrophobicContact CB-CB 3.83Å; A523-N584 WeakPolarHBondContact CB-O 3.04Å; Q580-N584 PolarHBondContact NE2-OD1 3.26Å; Q580-N584 WeakPolarHBondContact O-CB 3.43Å; Q580-N584 PolarHBondContact O-N 3.42Å; D581-N584 PolarHBondContact O-N 3.09Å; N584-I588 PolarHBondContact O-N 3.05Å
585	L	97.2	Very high	93.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-70.4	-38.2	176.3	-70.1	171.4	0	0	0	112.8	I519 M522 L568 L571 L572 F575 D581 V582 I583 T587 I588	I519-L585 HydrophobicContact CG2-CD2 4.16Å; I519-L585 HydrophobicContact CG2-CG 3.97Å; M522-L585 HydrophobicContact CE-CD2 3.79Å; L568-L585 HydrophobicContact CD1-CB 3.95Å; L568-L585 HydrophobicContact CD1-CD2 3.9Å; L568-L585 HydrophobicContact CD1-CG 4.48Å; L571-L585 HydrophobicContact CB-CD1 4.04Å; L571-L585 HydrophobicContact CB-CD2 3.97Å; L571-L585 HydrophobicContact CD1-CD2 4.09Å; L572-L585 HydrophobicContact CD2-CB 3.51Å; L572-L585 HydrophobicContact CD2-CD1 4.19Å; L572-L585 HydrophobicContact CG-CB 4.34Å; F575-L585 HydrophobicContact CB-CD1 4.12Å; F575-L585 HydrophobicContact CD2-CD1 4.28Å; D581-L585 WeakPolarHBondContact O-CB 3.24Å; D581-L585 WeakPolarHBondContact O-CG 3.46Å; D581-L585 PolarHBondContact O-N 2.99Å; V582-L585 PolarHBondContact O-N 3.33Å; I583-L585 VanDerWaalsContact C-N 3.32Å; I583-L585 PolarHBondContact O-N 3.45Å; L585-T587 VanDerWaalsContact C-N 3.34Å; L585-I588 HydrophobicContact CD2-CD1 4.32Å; L585-I588 WeakPolarHBondContact O-CB 3.46Å; L585-I588 PolarHBondContact O-N 3.28Å
586	L	96.1	Very high	93.4	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-66.1	-35.9	174.8	-74.9	168.4	0	0	0	112.1	L572 V582 I583 I588 A589 I613 L616 V625 N628 C629 T632	L572-L586 HydrophobicContact CD2-CD2 4.46Å; L572-L586 HydrophobicContact CD2-CG 4.33Å; V582-L586 HydrophobicContact CG1-CD1 3.72Å; V582-L586 HydrophobicContact CG1-CG 4.26Å; V582-L586 WeakPolarHBondContact O-CB 3.44Å; V582-L586 VanDerWaalsContact O-CG 3.23Å; V582-L586 WeakPolarHBondContact O-CG 3.31Å; V582-L586 PolarHBondContact O-N 3.02Å; I583-L586 PolarHBondContact O-N 2.81Å; I583-L586 VanDerWaalsContact O-N 3.16Å; L586-I588 VanDerWaalsContact C-N 3.29Å; L586-I588 PolarHBondContact O-N 3.46Å; L586-A589 PolarHBondContact O-N 2.91Å; L586-I613 HydrophobicContact CD2-CG1 4.11Å; L586-L616 HydrophobicContact CD2-CD1 4.34Å; L586-V625 HydrophobicContact CD1-CG1 4.48Å; L586-N628 HydrophobicContact CB-CB 4.16Å; L586-N628 HydrophobicContact CD1-CB 3.99Å; L586-C629 VanDerWaalsContact CD1-SG 3.53Å; L586-T632 PolarHBondContact O-OG1 3.21Å; L586-T632 VanDerWaalsContact O-OG1 3.13Å
587	T	94.6	Very high	93.3	Very high	17 Å²	17	29.6 Å²	29.6	10%	0.104	16%	0.158	C	C	.	.	H	α-helix	trans	-61.2	-34.6	174.8	-58.5	0	0	0	0	112.2	I583 L585 A589 Q590 Y591	I583-T587 PolarHBondContact O-N 2.61Å; I583-T587 PolarHBondContact O-OG1 3.01Å; L585-T587 VanDerWaalsContact C-N 3.34Å; T587-A589 VanDerWaalsContact C-N 3.3Å; T587-A589 PolarHBondContact O-N 3.15Å; T587-Q590 WeakPolarHBondContact O-CB 3.45Å; T587-Q590 PolarHBondContact O-N 2.98Å; T587-Q590 VanDerWaalsContact O-N 3.12Å; T587-Y591 HydrophobicContact CG2-CE2 3.81Å; T587-Y591 WeakPolarHBondContact O-CD2 3.38Å
588	I	96.5	Very high	93.1	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-58.1	-41.8	174.8	-68.7	172.3	0	0	0	111.5	M522 A523 V526 F564 L568 N584 L585 L586 Q590 Y591 F592	M522-I588 HydrophobicContact CE-CD1 4.1Å; M522-I588 HydrophobicContact CG-CD1 4.24Å; A523-I588 HydrophobicContact CB-CD1 4.41Å; A523-I588 HydrophobicContact CB-CG1 4.28Å; V526-I588 HydrophobicContact CB-CG1 4.25Å; V526-I588 HydrophobicContact CG1-CB 4.41Å; V526-I588 HydrophobicContact CG1-CG1 4.19Å; V526-I588 HydrophobicContact CG1-CG2 4.22Å; V526-I588 HydrophobicContact CG2-CD1 4.47Å; V526-I588 HydrophobicContact CG2-CG1 4.23Å; V526-I588 HydrophobicContact CG2-CG2 4.43Å; F564-I588 HydrophobicContact CB-CG2 4.08Å; F564-I588 HydrophobicContact CD1-CG2 4.08Å; F564-I588 HydrophobicContact CD2-CG2 3.69Å; F564-I588 HydrophobicContact CE1-CD1 4.16Å; F564-I588 HydrophobicContact CE1-CG2 4.44Å; F564-I588 HydrophobicContact CE2-CG2 4.09Å; F564-I588 HydrophobicContact CG-CG2 3.68Å; F564-I588 HydrophobicContact CZ-CD1 4.14Å; F564-I588 HydrophobicContact CZ-CG2 4.44Å; L568-I588 HydrophobicContact CD2-CG2 4.46Å; N584-I588 PolarHBondContact O-N 3.05Å; L585-I588 HydrophobicContact CD2-CD1 4.32Å; L585-I588 WeakPolarHBondContact O-CB 3.46Å; L585-I588 PolarHBondContact O-N 3.28Å; L586-I588 VanDerWaalsContact C-N 3.29Å; L586-I588 PolarHBondContact O-N 3.46Å; I588-Q590 VanDerWaalsContact C-N 3.25Å; I588-Q590 PolarHBondContact O-N 3.31Å; I588-Y591 PolarHBondContact O-N 3.09Å; I588-F592 HydrophobicContact CG2-CE1 3.99Å; I588-F592 WeakPolarHBondContact O-CD1 3.36Å
589	A	94	Very high	93	Very high	2 Å²	2	26 Å²	26	2%	0.017	15%	0.151	C	C	.	.	H	α-helix	trans	-69.4	-19.2	179.4	0	0	0	0	0	114.1	L568 L586 T587 Y591 F592 T632	L568-A589 HydrophobicContact CD2-CB 3.76Å; L586-A589 PolarHBondContact O-N 2.91Å; T587-A589 VanDerWaalsContact C-N 3.3Å; T587-A589 PolarHBondContact O-N 3.15Å; A589-Y591 PolarHBondContact O-N 2.86Å; A589-F592 HydrophobicContact CB-CD2 4.23Å; A589-F592 HydrophobicContact CB-CE2 4Å; A589-F592 HydrophobicContact CB-CZ 4.25Å; A589-F592 PolarHBondContact O-N 3.48Å; A589-T632 HydrophobicContact CB-CG2 3.62Å
590	Q	93.4	Very high	92.6	Very high	30 Å²	30	28.3 Å²	28.3	14%	0.14	17%	0.17	C	C	.	.	H	α-helix	trans	-72.4	-19.1	177.4	-62.8	170.7	20.2	0	0	112	T587 I588 N628 K631 T632	T587-Q590 WeakPolarHBondContact O-CB 3.45Å; T587-Q590 PolarHBondContact O-N 2.98Å; T587-Q590 VanDerWaalsContact O-N 3.12Å; I588-Q590 VanDerWaalsContact C-N 3.25Å; I588-Q590 PolarHBondContact O-N 3.31Å; Q590-N628 PolarHBondContact NE2-OD1 2.92Å; Q590-K631 HydrophobicContact CG-CG 4.34Å; Q590-T632 VanDerWaalsContact CG-OG1 3.32Å; Q590-T632 WeakPolarHBondContact CG-OG1 3.38Å; Q590-T632 PolarHBondContact NE2-OG1 3.14Å
591	Y	93.2	Very high	92.5	Very high	27 Å²	27	29 Å²	29	11%	0.106	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	16.5	178	-59.1	-62.5	0	0	0	114.1	V526 K527 T531 T587 I588 A589 E1093	V526-Y591 HydrophobicContact CG1-CD2 4.03Å; K527-Y591 HydrophobicContact CB-CE2 3.77Å; K527-Y591 HydrophobicContact CD-CE2 4.38Å; K527-Y591 WeakPolarHBondContact CD-OH 3.42Å; K527-Y591 WeakPolarHBondContact CE-OH 3.34Å; K527-Y591 HydrophobicContact CG-CE2 4Å; K527-Y591 WeakPolarHBondContact CG-OH 3.32Å; K527-Y591 PolarHBondContact NZ-OH 3.26Å; K527-Y591 VanDerWaalsContact NZ-OH 3.14Å; T531-Y591 HydrophobicContact CG2-CD1 4.37Å; T531-Y591 HydrophobicContact CG2-CE1 3.79Å; T587-Y591 HydrophobicContact CG2-CE2 3.81Å; T587-Y591 WeakPolarHBondContact O-CD2 3.38Å; I588-Y591 PolarHBondContact O-N 3.09Å; A589-Y591 PolarHBondContact O-N 2.86Å; Y591-E1093 PolarHBondContact OH-OE2 3.12Å
592	F	92.9	Very high	92.3	Very high	17 Å²	17	30.4 Å²	30.4	8%	0.075	19%	0.185	C	C	.	.			trans	-76.6	131.4	-178.5	-75.8	-3.1	0	0	0	113.6	I560 T561 F564 L568 I588 A589 M594 Y597 L609	I560-F592 HydrophobicContact CG2-CE1 4.46Å; T561-F592 HydrophobicContact CG2-CB 4.03Å; T561-F592 HydrophobicContact CG2-CD1 4.33Å; T561-F592 HydrophobicContact CG2-CD2 4.4Å; T561-F592 HydrophobicContact CG2-CG 4.02Å; T561-F592 WeakPolarHBondContact OG1-CA 3.31Å; F564-F592 HydrophobicContact CB-CE1 3.68Å; F564-F592 HydrophobicContact CB-CZ 3.61Å; L568-F592 HydrophobicContact CD2-CE2 4.32Å; L568-F592 HydrophobicContact CD2-CZ 3.82Å; I588-F592 HydrophobicContact CG2-CE1 3.99Å; I588-F592 WeakPolarHBondContact O-CD1 3.36Å; A589-F592 HydrophobicContact CB-CD2 4.23Å; A589-F592 HydrophobicContact CB-CE2 4Å; A589-F592 HydrophobicContact CB-CZ 4.25Å; A589-F592 PolarHBondContact O-N 3.48Å; F592-M594 PolarHBondContact O-N 3.1Å; F592-M594 VanDerWaalsContact O-N 3.16Å; F592-Y597 AromaticContact CD2-CE2 3.8Å; F592-Y597 HydrophobicContact CD2-CE2 3.8Å; F592-Y597 HydrophobicContact CE2-CE2 4.31Å; F592-L609 HydrophobicContact CD2-CD2 4.37Å; F592-L609 HydrophobicContact CE2-CD2 3.8Å
593	H	90.3	Very high	91.8	Very high	35 Å²	35	31.6 Å²	31.6	16%	0.162	19%	0.193	C	C	.	.			trans	-81.2	94.6	172.5	-171.1	-132.6	0	0	0	109.9	Q557 E558 T561 N595 V596	Q557-H593 HydrophobicContact CB-CB 4.16Å; E558-H593 HydrophobicContact CG-CB 4.23Å; E558-H593 WeakPolarHBondContact CG-ND1 3.09Å; E558-H593 IonicContact OE1-CE1 3.75Å; E558-H593 PolarHBondContact OE1-CE1 3.35Å; E558-H593 IonicContact OE1-ND1 3.69Å; E558-H593 PolarHBondContact OE1-ND1 3.02Å; T561-H593 PolarHBondContact OG1-N 3.15Å; H593-N595 PolarHBondContact CE1-ND2 3.32Å; H593-N595 VanDerWaalsContact CE1-ND2 3.32Å; H593-N595 PolarHBondContact NE2-ND2 3Å; H593-N595 PolarHBondContact O-N 3.47Å; H593-V596 HydrophobicContact CB-CG2 4.48Å; H593-V596 WeakPolarHBondContact O-CB 3.11Å; H593-V596 WeakPolarHBondContact O-CG2 3.44Å; H593-V596 PolarHBondContact O-N 2.99Å
594	M	89	Confident	91.6	Very high	18 Å²	18	36.4 Å²	36.4	9%	0.089	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-16.2	-171.5	-69.3	-62.6	-68.4	0	0	115.5	F592 V596 Y597 L636	F592-M594 PolarHBondContact O-N 3.1Å; F592-M594 VanDerWaalsContact O-N 3.16Å; M594-V596 VanDerWaalsContact C-N 3.26Å; M594-V596 PolarHBondContact O-N 3.31Å; M594-Y597 HydrophobicContact CE-CD2 4.44Å; M594-Y597 PolarHBondContact O-N 2.92Å; M594-Y597 HydrophobicContact SD-CD2 3.95Å; M594-Y597 HydrophobicContact SD-CE2 4.41Å; M594-L636 HydrophobicContact CE-CD2 4.1Å; M594-L636 HydrophobicContact SD-CD2 3.58Å; M594-L636 VanDerWaalsContact SD-CD2 3.58Å
595	N	87.7	Confident	91.5	Very high	84 Å²	84	36.5 Å²	36.5	45%	0.449	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-32.3	170.5	-72.8	-53.7	0	0	0	112.9	H593 Y597 A598 L641	H593-N595 PolarHBondContact CE1-ND2 3.32Å; H593-N595 VanDerWaalsContact CE1-ND2 3.32Å; H593-N595 PolarHBondContact NE2-ND2 3Å; H593-N595 PolarHBondContact O-N 3.47Å; N595-Y597 VanDerWaalsContact C-N 3.29Å; N595-Y597 PolarHBondContact O-N 2.92Å; N595-A598 WeakPolarHBondContact O-CB 3.49Å; N595-A598 PolarHBondContact O-N 2.9Å; N595-A598 VanDerWaalsContact O-N 3.08Å; N595-L641 WeakPolarHBondContact OD1-CD1 3.36Å
596	V	90.5	Very high	91.2	Very high	15 Å²	15	36.5 Å²	36.5	9%	0.091	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-59.7	-41.7	177.1	176.8	0	0	0	0	110.7	E558 T561 E562 H593 M594 A598 A599 Y602	E558-V596 HydrophobicContact CB-CG2 4.21Å; E558-V596 HydrophobicContact CG-CG2 3.95Å; T561-V596 HydrophobicContact CG2-CB 3.82Å; T561-V596 HydrophobicContact CG2-CG1 4.05Å; T561-V596 HydrophobicContact CG2-CG2 4.2Å; E562-V596 HydrophobicContact CG-CG1 3.81Å; H593-V596 HydrophobicContact CB-CG2 4.48Å; H593-V596 WeakPolarHBondContact O-CB 3.11Å; H593-V596 WeakPolarHBondContact O-CG2 3.44Å; H593-V596 PolarHBondContact O-N 2.99Å; M594-V596 VanDerWaalsContact C-N 3.26Å; M594-V596 PolarHBondContact O-N 3.31Å; V596-A598 PolarHBondContact O-N 2.99Å; V596-A598 VanDerWaalsContact O-N 3.08Å; V596-A599 PolarHBondContact O-N 3.24Å; V596-A599 VanDerWaalsContact O-N 3.14Å; V596-Y602 HydrophobicContact CG1-CD2 3.79Å; V596-Y602 HydrophobicContact CG1-CE2 3.53Å; V596-Y602 VanDerWaalsContact O-CD2 3.29Å; V596-Y602 WeakPolarHBondContact O-CD2 3.24Å
597	Y	89.9	Confident	91	Very high	6 Å²	6	40.9 Å²	40.9	2%	0.024	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-66.8	-7.1	178.2	-78.6	-73.9	0	0	0	114.7	T561 A565 F592 M594 N595 A599 Y602 L606	T561-Y597 HydrophobicContact CG2-CD2 4.11Å; T561-Y597 HydrophobicContact CG2-CE2 3.83Å; A565-Y597 WeakPolarHBondContact CA-OH 3.27Å; A565-Y597 HydrophobicContact CB-CE1 3.92Å; A565-Y597 WeakPolarHBondContact CB-OH 3.49Å; F592-Y597 AromaticContact CD2-CE2 3.8Å; F592-Y597 HydrophobicContact CD2-CE2 3.8Å; F592-Y597 HydrophobicContact CE2-CE2 4.31Å; M594-Y597 HydrophobicContact CE-CD2 4.44Å; M594-Y597 PolarHBondContact O-N 2.92Å; M594-Y597 HydrophobicContact SD-CD2 3.95Å; M594-Y597 HydrophobicContact SD-CE2 4.41Å; N595-Y597 VanDerWaalsContact C-N 3.29Å; N595-Y597 PolarHBondContact O-N 2.92Å; Y597-A599 PolarHBondContact O-N 2.71Å; Y597-Y602 WeakPolarHBondContact CD1-O 3.46Å; Y597-L606 HydrophobicContact CD1-CB 3.69Å; Y597-L606 HydrophobicContact CD1-CD1 4.26Å; Y597-L606 HydrophobicContact CD1-CD2 4.36Å; Y597-L606 HydrophobicContact CD1-CG 4.32Å; Y597-L606 HydrophobicContact CE1-CB 3.64Å; Y597-L606 HydrophobicContact CE1-CD1 4.09Å; Y597-L606 HydrophobicContact CE1-CG 4.38Å
598	A	87.2	Confident	91	Very high	71 Å²	71	43 Å²	43	59%	0.587	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-69.6	-21.6	170.9	0	0	0	0	0	112.8	N595 V596	N595-A598 WeakPolarHBondContact O-CB 3.49Å; N595-A598 PolarHBondContact O-N 2.9Å; N595-A598 VanDerWaalsContact O-N 3.08Å; V596-A598 PolarHBondContact O-N 2.99Å; V596-A598 VanDerWaalsContact O-N 3.08Å
599	A	89.3	Confident	90.9	Very high	50 Å²	50	43 Å²	43	41%	0.413	26%	0.256	S	S	.	.	S	Bend	trans	-75.8	132.7	174	0	0	0	0	0	111.2	V596 Y597 V601 Y602	V596-A599 PolarHBondContact O-N 3.24Å; V596-A599 VanDerWaalsContact O-N 3.14Å; Y597-A599 PolarHBondContact O-N 2.71Å; A599-V601 PolarHBondContact O-N 2.92Å; A599-Y602 HydrophobicContact CB-CD2 4.05Å; A599-Y602 HydrophobicContact CB-CE2 4.37Å; A599-Y602 PolarHBondContact O-N 3.19Å
600	S	86.5	Confident	90.9	Very high	108 Å²	108	43 Å²	43	76%	0.755	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-58.6	-25.2	-172	55.5	0	0	0	0	114.9	Y602 S603	S600-Y602 PolarHBondContact O-N 3.21Å; S600-S603 WeakPolarHBondContact O-CB 3.38Å; S600-S603 PolarHBondContact O-N 3.03Å
601	V	91.1	Very high	90.9	Very high	104 Å²	104	47.3 Å²	47.3	63%	0.63	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-59.3	-34.9	176	-178.2	0	0	0	0	111.6	A599 P605	A599-V601 PolarHBondContact O-N 2.92Å; V601-P605 WeakPolarHBondContact O-CD 3.37Å
602	Y	90.5	Very high	90.9	Very high	34 Å²	34	47.1 Å²	47.1	13%	0.133	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-90.3	2.3	-177.5	-55.1	-66.8	0	0	0	114	E562 A565 M566 V596 Y597 A599 S600 N604 L606	E562-Y602 WeakPolarHBondContact CG-OH 3.42Å; A565-Y602 HydrophobicContact CB-CD1 4Å; A565-Y602 HydrophobicContact CB-CE1 4.46Å; M566-Y602 HydrophobicContact SD-CD1 4.41Å; M566-Y602 HydrophobicContact SD-CE1 4.49Å; V596-Y602 HydrophobicContact CG1-CD2 3.79Å; V596-Y602 HydrophobicContact CG1-CE2 3.53Å; V596-Y602 VanDerWaalsContact O-CD2 3.29Å; V596-Y602 WeakPolarHBondContact O-CD2 3.24Å; Y597-Y602 WeakPolarHBondContact CD1-O 3.46Å; A599-Y602 HydrophobicContact CB-CD2 4.05Å; A599-Y602 HydrophobicContact CB-CE2 4.37Å; A599-Y602 PolarHBondContact O-N 3.19Å; S600-Y602 PolarHBondContact O-N 3.21Å; Y602-N604 PolarHBondContact O-N 2.98Å; Y602-L606 PolarHBondContact O-N 3.42Å
603	S	86.8	Confident	91	Very high	25 Å²	25	46.3 Å²	46.3	18%	0.175	27%	0.273	C	S	.	.	H	α-helix	trans	-52.8	-54.1	174.8	164.4	0	0	0	0	112.7	S600 L606 E607 R646	S600-S603 WeakPolarHBondContact O-CB 3.38Å; S600-S603 PolarHBondContact O-N 3.03Å; S603-L606 PolarHBondContact O-N 2.99Å; S603-E607 PolarHBondContact O-N 3.03Å; S603-R646 PolarHBondContact O-NH1 3.23Å; S603-R646 VanDerWaalsContact O-NH1 3.12Å; S603-R646 PolarHBondContact OG-NH1 3.42Å; S603-R646 PolarHBondContact OG-NH2 3.12Å
604	N	91.4	Very high	91.1	Very high	106 Å²	106	47 Å²	47	57%	0.567	28%	0.276	S	S	*	.	H	α-helix	trans	-76.9	-39.5	-175.6	-54.7	-0	0	0	0	111.5	Y602 L606 E607 S608	Y602-N604 PolarHBondContact O-N 2.98Å; N604-L606 VanDerWaalsContact C-N 3.28Å; N604-L606 PolarHBondContact O-N 3.04Å; N604-E607 PolarHBondContact O-N 2.7Å; N604-S608 PolarHBondContact O-N 3.47Å; N604-S608 PolarHBondContact O-OG 3.06Å; N604-S608 VanDerWaalsContact O-OG 3.13Å
605	P	92.6	Very high	91.3	Very high	16 Å²	16	48.9 Å²	48.9	10%	0.104	29%	0.285	C	S	.	.	H	α-helix	trans	-49.6	-42.9	166.2	-34.3	39	0	0	0	114.6	A565 M566 V601 S608 L609	A565-P605 HydrophobicContact CB-CB 4.34Å; A565-P605 WeakPolarHBondContact O-CB 3.21Å; M566-P605 HydrophobicContact SD-CB 4.29Å; M566-P605 HydrophobicContact SD-CG 3.47Å; M566-P605 WeakPolarHBondContact SD-CG 3.5Å; V601-P605 WeakPolarHBondContact O-CD 3.37Å; P605-S608 PolarHBondContact O-N 3.04Å; P605-L609 PolarHBondContact O-N 3.42Å
606	L	92.1	Very high	91.6	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.6	-45.3	176.3	-176.7	60	0	0	0	112.2	Y597 Y602 S603 N604 S608 L609 L610 V643	Y597-L606 HydrophobicContact CD1-CB 3.69Å; Y597-L606 HydrophobicContact CD1-CD1 4.26Å; Y597-L606 HydrophobicContact CD1-CD2 4.36Å; Y597-L606 HydrophobicContact CD1-CG 4.32Å; Y597-L606 HydrophobicContact CE1-CB 3.64Å; Y597-L606 HydrophobicContact CE1-CD1 4.09Å; Y597-L606 HydrophobicContact CE1-CG 4.38Å; Y602-L606 PolarHBondContact O-N 3.42Å; S603-L606 PolarHBondContact O-N 2.99Å; N604-L606 VanDerWaalsContact C-N 3.28Å; N604-L606 PolarHBondContact O-N 3.04Å; L606-S608 VanDerWaalsContact C-N 3.3Å; L606-S608 PolarHBondContact O-N 2.94Å; L606-L609 PolarHBondContact O-N 3.25Å; L606-L610 HydrophobicContact CD1-CD1 4.22Å; L606-L610 HydrophobicContact CD1-CG 4.15Å; L606-L610 HydrophobicContact CG-CD1 3.92Å; L606-L610 HydrophobicContact CG-CG 4.31Å; L606-L610 WeakPolarHBondContact O-CB 3.5Å; L606-L610 VanDerWaalsContact O-CG 3.26Å; L606-L610 WeakPolarHBondContact O-CG 3.25Å; L606-L610 PolarHBondContact O-N 3.06Å; L606-V643 HydrophobicContact CD2-CG2 3.37Å
607	E	92.1	Very high	91.8	Very high	93 Å²	93	44.7 Å²	44.7	44%	0.435	26%	0.262	S	S	.	.	H	α-helix	trans	-60.1	-41.2	176.5	-71.7	173.9	-161.6	0	0	111.5	S603 N604 K611 R646	S603-E607 PolarHBondContact O-N 3.03Å; N604-E607 PolarHBondContact O-N 2.7Å; E607-K611 WeakPolarHBondContact O-CB 3.37Å; E607-K611 PolarHBondContact O-N 3.47Å; E607-R646 IonicContact OE1-CZ 2.63Å; E607-R646 IonicContact OE1-NE 3.88Å; E607-R646 IonicContact OE1-NH1 2.84Å; E607-R646 PolarHBondContact OE1-NH1 3.14Å; E607-R646 IonicContact OE1-NH2 3.01Å; E607-R646 PolarHBondContact OE1-NH2 3.35Å
608	S	94.1	Very high	91.9	Very high	60 Å²	60	47.3 Å²	47.3	42%	0.42	29%	0.285	S	S	.	.	H	α-helix	trans	-62.1	-45.2	174.8	-62.7	0	0	0	0	112.4	N604 P605 L606 K611 C612	N604-S608 PolarHBondContact O-N 3.47Å; N604-S608 PolarHBondContact O-OG 3.06Å; N604-S608 VanDerWaalsContact O-OG 3.13Å; P605-S608 PolarHBondContact O-N 3.04Å; L606-S608 VanDerWaalsContact C-N 3.3Å; L606-S608 PolarHBondContact O-N 2.94Å; S608-K611 PolarHBondContact O-N 3.48Å; S608-C612 PolarHBondContact O-N 2.73Å; S608-C612 PolarHBondContact O-SG 2.98Å
609	L	94.4	Very high	92	Very high	1 Å²	1	50 Å²	50	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-63.4	-49.1	176.7	179	62.5	0	0	0	111.6	L568 P569 L572 F592 P605 L606 K611 C612 I613 L636	L568-L609 HydrophobicContact CD2-CD1 4.07Å; L568-L609 HydrophobicContact CG-CD1 4.33Å; P569-L609 HydrophobicContact CG-CB 4.15Å; L572-L609 HydrophobicContact CD1-CD1 3.98Å; F592-L609 HydrophobicContact CD2-CD2 4.37Å; F592-L609 HydrophobicContact CE2-CD2 3.8Å; P605-L609 PolarHBondContact O-N 3.42Å; L606-L609 PolarHBondContact O-N 3.25Å; L609-K611 PolarHBondContact O-N 3.17Å; L609-C612 PolarHBondContact O-N 3.2Å; L609-C612 VanDerWaalsContact O-N 3.09Å; L609-I613 HydrophobicContact CD1-CD1 4.05Å; L609-I613 HydrophobicContact CD1-CG1 4.28Å; L609-I613 HydrophobicContact CG-CD1 3.97Å; L609-I613 WeakPolarHBondContact O-CG1 3.45Å; L609-I613 PolarHBondContact O-N 3.33Å; L609-L636 HydrophobicContact CD2-CD1 4.37Å
610	L	93.8	Very high	92.1	Very high	4 Å²	4	48.6 Å²	48.6	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-58.2	-38.1	178.5	-72	172.5	0	0	0	111.7	L606 E614 Y633 L636 R646 T650	L606-L610 HydrophobicContact CD1-CD1 4.22Å; L606-L610 HydrophobicContact CD1-CG 4.15Å; L606-L610 HydrophobicContact CG-CD1 3.92Å; L606-L610 HydrophobicContact CG-CG 4.31Å; L606-L610 WeakPolarHBondContact O-CB 3.5Å; L606-L610 VanDerWaalsContact O-CG 3.26Å; L606-L610 WeakPolarHBondContact O-CG 3.25Å; L606-L610 PolarHBondContact O-N 3.06Å; L610-E614 WeakPolarHBondContact O-CB 3.33Å; L610-E614 PolarHBondContact O-N 3.35Å; L610-Y633 HydrophobicContact CD2-CD1 4.37Å; L610-Y633 HydrophobicContact CD2-CE1 3.77Å; L610-Y633 PolarHBondContact O-OH 3.33Å; L610-L636 HydrophobicContact CD2-CD1 4.04Å; L610-R646 HydrophobicContact CD1-CB 4.31Å; L610-T650 HydrophobicContact CB-CG2 4.34Å
611	K	93.9	Very high	92.4	Very high	119 Å²	119	47 Å²	47	52%	0.517	25%	0.254	S	S	.	.	H	α-helix	trans	-68.9	-41.3	174.1	-170.3	-171.2	179.2	-119.4	0	112.5	E607 S608 L609 I613 E614 E615	E607-K611 WeakPolarHBondContact O-CB 3.37Å; E607-K611 PolarHBondContact O-N 3.47Å; S608-K611 PolarHBondContact O-N 3.48Å; L609-K611 PolarHBondContact O-N 3.17Å; K611-I613 VanDerWaalsContact C-N 3.35Å; K611-I613 PolarHBondContact O-N 3.05Å; K611-E614 WeakPolarHBondContact O-CB 3.45Å; K611-E614 PolarHBondContact O-N 3.04Å; K611-E615 WeakPolarHBondContact CE-OE1 3.34Å; K611-E615 IonicContact NZ-OE1 2.74Å; K611-E615 PolarHBondContact NZ-OE1 3.17Å; K611-E615 WeakPolarHBondContact O-CG 3.41Å; K611-E615 PolarHBondContact O-N 3.34Å
612	C	93.6	Very high	92.5	Very high	24 Å²	24	44.8 Å²	44.8	16%	0.162	24%	0.239	C	C	.	.	H	α-helix	trans	-61.9	-43.3	176.8	-68.4	0	0	0	0	111.4	L572 S608 L609 E615 L616	L572-C612 HydrophobicContact CD1-CB 4.37Å; S608-C612 PolarHBondContact O-N 2.73Å; S608-C612 PolarHBondContact O-SG 2.98Å; L609-C612 PolarHBondContact O-N 3.2Å; L609-C612 VanDerWaalsContact O-N 3.09Å; C612-E615 PolarHBondContact O-N 2.59Å; C612-L616 VanDerWaalsContact O-CG 3.27Å; C612-L616 WeakPolarHBondContact O-CG 3.31Å; C612-L616 PolarHBondContact O-N 3.43Å
613	I	93.5	Very high	92.5	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-66.4	-38.8	176.7	-55.3	164.9	0	0	0	110.7	L586 L609 K611 E615 L616 F617 C629 T632 Y633 L636	L586-I613 HydrophobicContact CD2-CG1 4.11Å; L609-I613 HydrophobicContact CD1-CD1 4.05Å; L609-I613 HydrophobicContact CD1-CG1 4.28Å; L609-I613 HydrophobicContact CG-CD1 3.97Å; L609-I613 WeakPolarHBondContact O-CG1 3.45Å; L609-I613 PolarHBondContact O-N 3.33Å; K611-I613 VanDerWaalsContact C-N 3.35Å; K611-I613 PolarHBondContact O-N 3.05Å; I613-E615 PolarHBondContact O-N 2.95Å; I613-L616 PolarHBondContact O-N 3.39Å; I613-F617 VanDerWaalsContact O-CB 3.32Å; I613-F617 WeakPolarHBondContact O-CB 3.41Å; I613-F617 PolarHBondContact O-N 3.4Å; I613-C629 HydrophobicContact CG2-CB 3.97Å; I613-T632 HydrophobicContact CD1-CG2 3.74Å; I613-Y633 HydrophobicContact CB-CE2 4.15Å; I613-Y633 HydrophobicContact CG2-CD2 3.98Å; I613-Y633 HydrophobicContact CG2-CE2 3.34Å; I613-L636 HydrophobicContact CD1-CD1 3.87Å
614	E	93.7	Very high	92.8	Very high	49 Å²	49	48.4 Å²	48.4	23%	0.229	25%	0.254	C	S	.	.	H	α-helix	trans	-58.2	-46.1	173	-178.7	173.7	-169.4	0	0	111.5	L610 K611 A618 Y633 K653 I654	L610-E614 WeakPolarHBondContact O-CB 3.33Å; L610-E614 PolarHBondContact O-N 3.35Å; K611-E614 WeakPolarHBondContact O-CB 3.45Å; K611-E614 PolarHBondContact O-N 3.04Å; E614-A618 WeakPolarHBondContact O-CB 3.26Å; E614-A618 PolarHBondContact O-N 3.07Å; E614-A618 VanDerWaalsContact O-N 3.09Å; E614-Y633 PolarHBondContact N-OH 2.86Å; E614-Y633 VanDerWaalsContact N-OH 3.16Å; E614-K653 WeakPolarHBondContact OE1-CE 3.39Å; E614-K653 IonicContact OE1-NZ 2.73Å; E614-K653 PolarHBondContact OE1-NZ 3.29Å; E614-K653 IonicContact OE2-NZ 3.44Å; E614-K653 PolarHBondContact OE2-NZ 2.97Å; E614-I654 HydrophobicContact CB-CD1 3.88Å; E614-I654 HydrophobicContact CB-CG1 4.45Å; E614-I654 HydrophobicContact CG-CD1 3.97Å; E614-I654 HydrophobicContact CG-CG1 3.99Å
615	E	93.1	Very high	93	Very high	58 Å²	58	43.4 Å²	43.4	27%	0.271	23%	0.227	S	C	.	.	H	α-helix	trans	-67.3	-38.8	177.9	-72.9	-171.1	-142.9	0	0	113	K611 C612 I613 A618 K619	K611-E615 WeakPolarHBondContact CE-OE1 3.34Å; K611-E615 IonicContact NZ-OE1 2.74Å; K611-E615 PolarHBondContact NZ-OE1 3.17Å; K611-E615 WeakPolarHBondContact O-CG 3.41Å; K611-E615 PolarHBondContact O-N 3.34Å; C612-E615 PolarHBondContact O-N 2.59Å; I613-E615 PolarHBondContact O-N 2.95Å; E615-A618 PolarHBondContact O-N 3.08Å; E615-K619 WeakPolarHBondContact O-CB 3.19Å; E615-K619 WeakPolarHBondContact O-CD 3.32Å; E615-K619 WeakPolarHBondContact O-CG 3.37Å; E615-K619 PolarHBondContact O-N 2.8Å; E615-K619 IonicContact OE2-NZ 3.39Å; E615-K619 PolarHBondContact OE2-NZ 3.32Å
616	L	93.3	Very high	93.1	Very high	6 Å²	6	42.6 Å²	42.6	3%	0.031	22%	0.222	C	C	.	.	H	α-helix	trans	-64.4	-48.6	175.9	-72.9	167	0	0	0	111.2	L572 V576 V582 L586 C612 I613 A618 K619 H620	L572-L616 HydrophobicContact CB-CD1 4.27Å; L572-L616 HydrophobicContact CD1-CD1 4.23Å; L572-L616 HydrophobicContact CD2-CD1 3.92Å; L572-L616 HydrophobicContact CG-CD1 4.37Å; V576-L616 HydrophobicContact CB-CD2 4.42Å; V576-L616 HydrophobicContact CG2-CD2 3.75Å; V582-L616 HydrophobicContact CG1-CD1 4.28Å; V582-L616 HydrophobicContact CG1-CD2 4.13Å; V582-L616 HydrophobicContact CG2-CD2 4.33Å; L586-L616 HydrophobicContact CD2-CD1 4.34Å; C612-L616 VanDerWaalsContact O-CG 3.27Å; C612-L616 WeakPolarHBondContact O-CG 3.31Å; C612-L616 PolarHBondContact O-N 3.43Å; I613-L616 PolarHBondContact O-N 3.39Å; L616-A618 PolarHBondContact O-N 3.25Å; L616-K619 PolarHBondContact O-N 3.44Å; L616-K619 VanDerWaalsContact O-N 3.11Å; L616-H620 PolarHBondContact O-CD2 2.91Å; L616-H620 PolarHBondContact O-N 3.17Å
617	F	93.8	Very high	93.2	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.018	22%	0.223	C	C	.	.	H	α-helix	trans	-61.4	-34	179.1	-166.3	-98.8	0	0	0	112.2	I613 L626 C629 I654 T658 R690 A693 L694	I613-F617 VanDerWaalsContact O-CB 3.32Å; I613-F617 WeakPolarHBondContact O-CB 3.41Å; I613-F617 PolarHBondContact O-N 3.4Å; F617-L626 HydrophobicContact CD2-CD2 3.53Å; F617-L626 HydrophobicContact CE2-CB 4.19Å; F617-L626 HydrophobicContact CE2-CD2 3.69Å; F617-L626 HydrophobicContact CG-CD2 4.1Å; F617-L626 HydrophobicContact CZ-CD2 4.36Å; F617-C629 HydrophobicContact CB-CB 4.41Å; F617-C629 HydrophobicContact CD2-CB 3.69Å; F617-I654 HydrophobicContact CD1-CG2 3.65Å; F617-I654 HydrophobicContact CE1-CG2 3.83Å; F617-I654 HydrophobicContact CG-CG2 4.49Å; F617-T658 HydrophobicContact CE1-CG2 4.43Å; F617-R690 HydrophobicContact CE1-CB 3.72Å; F617-R690 HydrophobicContact CE1-CG 3.91Å; F617-R690 HydrophobicContact CZ-CB 3.63Å; F617-R690 HydrophobicContact CZ-CG 3.94Å; F617-R690 WeakPolarHBondContact O-CD 3.35Å; F617-R690 PolarHBondContact O-NE 3.25Å; F617-A693 HydrophobicContact CE2-CB 4.47Å; F617-L694 HydrophobicContact CE1-CD1 4.07Å; F617-L694 HydrophobicContact CE1-CG 4.26Å; F617-L694 HydrophobicContact CZ-CD1 3.97Å; F617-L694 HydrophobicContact CZ-CD2 4.13Å; F617-L694 HydrophobicContact CZ-CG 3.7Å
618	A	92	Very high	93.3	Very high	62 Å²	62	38.5 Å²	38.5	51%	0.512	20%	0.204	S	C	.	.	H	α-helix	trans	-71.3	-42.6	172.5	0	0	0	0	0	113	E614 E615 L616 R690	E614-A618 WeakPolarHBondContact O-CB 3.26Å; E614-A618 PolarHBondContact O-N 3.07Å; E614-A618 VanDerWaalsContact O-N 3.09Å; E615-A618 PolarHBondContact O-N 3.08Å; L616-A618 PolarHBondContact O-N 3.25Å; A618-R690 PolarHBondContact O-NH2 3.15Å
619	K	90.1	Very high	93.4	Very high	127 Å²	127	35.7 Å²	35.7	55%	0.552	18%	0.184	S	C	*	.	H	α-helix	trans	-80.8	-35	-172.2	-70.8	165.8	-170.4	166.2	0	114.3	E615 L616	E615-K619 WeakPolarHBondContact O-CB 3.19Å; E615-K619 WeakPolarHBondContact O-CD 3.32Å; E615-K619 WeakPolarHBondContact O-CG 3.37Å; E615-K619 PolarHBondContact O-N 2.8Å; E615-K619 IonicContact OE2-NZ 3.39Å; E615-K619 PolarHBondContact OE2-NZ 3.32Å; L616-K619 PolarHBondContact O-N 3.44Å; L616-K619 VanDerWaalsContact O-N 3.11Å
620	H	91.6	Very high	93.4	Very high	21 Å²	21	35.6 Å²	35.6	10%	0.097	18%	0.183	C	C	.	.			trans	-85.2	154.6	-176.8	-72.1	-95.2	0	0	0	113.4	V576 L616 V625 R690	V576-H620 PolarHBondContact O-CE1 3.18Å; V576-H620 PolarHBondContact O-NE2 2.68Å; L616-H620 PolarHBondContact O-CD2 2.91Å; L616-H620 PolarHBondContact O-N 3.17Å; H620-V625 HydrophobicContact CB-CB 4.37Å; H620-V625 HydrophobicContact CB-CG1 3.85Å; H620-R690 PolarHBondContact O-NH2 3.08Å
621	T	92.1	Very high	93.4	Very high	74 Å²	74	36.8 Å²	36.8	45%	0.454	19%	0.188	S	C	.	.			trans	-124.3	-1.5	173.2	57	0	0	0	0	113	A686 R689	T621-A686 HydrophobicContact CG2-CB 3.74Å; T621-R689 WeakPolarHBondContact O-CD 3.41Å
622	D	93.7	Very high	93.3	Very high	58 Å²	58	31.1 Å²	31.1	31%	0.31	16%	0.164	S	C	.	.			trans	-71.6	132.9	176.9	178.6	-90.1	0	0	0	111.1	T579 E624 V625 L626	T579-D622 HydrophobicContact CG2-CB 4.14Å; D622-E624 PolarHBondContact O-N 3.29Å; D622-E624 PolarHBondContact OD1-N 2.74Å; D622-V625 HydrophobicContact CB-CB 4.18Å; D622-V625 HydrophobicContact CB-CG2 4.08Å; D622-V625 PolarHBondContact OD1-N 2.69Å; D622-L626 WeakPolarHBondContact O-CB 3.26Å; D622-L626 WeakPolarHBondContact O-CG 3.49Å; D622-L626 PolarHBondContact O-N 3.22Å; D622-L626 VanDerWaalsContact O-N 3.1Å
623	E	91.7	Very high	93.2	Very high	60 Å²	60	30.1 Å²	30.1	28%	0.28	16%	0.156	S	C	.	.	H	α-helix	trans	-70.6	-33.3	-172.5	-65.2	-171.1	-165.1	0	0	112.8	A627 R689 R733	E623-A627 WeakPolarHBondContact O-CB 3.41Å; E623-A627 PolarHBondContact O-N 3.45Å; E623-R689 HydrophobicContact CG-CG 4.09Å; E623-R689 IonicContact OE1-CZ 2.83Å; E623-R689 IonicContact OE1-NE 3.45Å; E623-R689 PolarHBondContact OE1-NE 3.17Å; E623-R689 IonicContact OE1-NH2 3.68Å; E623-R733 IonicContact OE1-NH2 2.62Å; E623-R733 PolarHBondContact OE1-NH2 2.95Å; E623-R733 IonicContact OE2-CZ 3.8Å; E623-R733 VanDerWaalsContact OE2-CZ 3.25Å; E623-R733 IonicContact OE2-NH1 2.7Å; E623-R733 PolarHBondContact OE2-NH1 2.75Å; E623-R733 IonicContact OE2-NH2 3.87Å; E623-R733 PolarHBondContact OE2-NH2 3.44Å
624	E	92.3	Very high	93.1	Very high	75 Å²	75	32.3 Å²	32.3	35%	0.35	17%	0.167	S	C	.	.	H	α-helix	trans	-77.1	-38.3	-179.8	-61.5	-155.3	163.7	0	0	112	I583 D622 A627 N628 N1089	I583-E624 HydrophobicContact CD1-CB 3.65Å; I583-E624 HydrophobicContact CG1-CB 4.46Å; D622-E624 PolarHBondContact O-N 3.29Å; D622-E624 PolarHBondContact OD1-N 2.74Å; E624-A627 PolarHBondContact O-N 3.49Å; E624-N628 WeakPolarHBondContact O-CB 3.43Å; E624-N628 PolarHBondContact O-N 2.99Å; E624-N628 PolarHBondContact O-ND2 3.01Å; E624-N1089 PolarHBondContact OE1-ND2 3.34Å
625	V	95.3	Very high	92.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60.4	-47.8	171.1	174.8	0	0	0	0	110.4	T579 V582 I583 L586 H620 D622 N628 C629	T579-V625 HydrophobicContact CG2-CG2 4.1Å; V582-V625 HydrophobicContact CG1-CG1 3.82Å; V582-V625 HydrophobicContact CG1-CG2 4.35Å; I583-V625 HydrophobicContact CD1-CG2 4.16Å; I583-V625 HydrophobicContact CG1-CG2 3.92Å; L586-V625 HydrophobicContact CD1-CG1 4.48Å; H620-V625 HydrophobicContact CB-CB 4.37Å; H620-V625 HydrophobicContact CB-CG1 3.85Å; D622-V625 HydrophobicContact CB-CB 4.18Å; D622-V625 HydrophobicContact CB-CG2 4.08Å; D622-V625 PolarHBondContact OD1-N 2.69Å; V625-N628 PolarHBondContact O-N 2.73Å; V625-C629 PolarHBondContact O-N 2.92Å; V625-C629 PolarHBondContact O-SG 3.06Å; V625-C629 VanDerWaalsContact O-SG 3.38Å
626	L	95.8	Very high	92.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.6	-41.7	-179.7	-68.8	175.7	0	0	0	112.1	F617 D622 C629 S630 R689 R690 A693	F617-L626 HydrophobicContact CD2-CD2 3.53Å; F617-L626 HydrophobicContact CE2-CB 4.19Å; F617-L626 HydrophobicContact CE2-CD2 3.69Å; F617-L626 HydrophobicContact CG-CD2 4.1Å; F617-L626 HydrophobicContact CZ-CD2 4.36Å; D622-L626 WeakPolarHBondContact O-CB 3.26Å; D622-L626 WeakPolarHBondContact O-CG 3.49Å; D622-L626 PolarHBondContact O-N 3.22Å; D622-L626 VanDerWaalsContact O-N 3.1Å; L626-C629 PolarHBondContact O-N 3.12Å; L626-S630 WeakPolarHBondContact O-CB 3.4Å; L626-S630 PolarHBondContact O-N 2.94Å; L626-R689 HydrophobicContact CD1-CB 3.97Å; L626-R690 HydrophobicContact CD1-CG 3.79Å; L626-R690 HydrophobicContact CD2-CG 3.88Å; L626-R690 HydrophobicContact CG-CG 4.48Å; L626-A693 HydrophobicContact CB-CB 3.77Å
627	A	93.9	Very high	92.5	Very high	3 Å²	3	28.9 Å²	28.9	3%	0.025	16%	0.155	C	C	.	.	H	α-helix	trans	-61.8	-43.7	174.1	0	0	0	0	0	111.9	E623 E624 S630 K631 L1091	E623-A627 WeakPolarHBondContact O-CB 3.41Å; E623-A627 PolarHBondContact O-N 3.45Å; E624-A627 PolarHBondContact O-N 3.49Å; A627-S630 WeakPolarHBondContact O-CB 3.32Å; A627-S630 PolarHBondContact O-N 3.34Å; A627-K631 WeakPolarHBondContact O-CB 3.47Å; A627-K631 PolarHBondContact O-N 2.98Å; A627-L1091 HydrophobicContact CB-CD1 4.15Å; A627-L1091 HydrophobicContact CB-CD2 4.25Å; A627-L1091 HydrophobicContact CB-CG 4.44Å
628	N	94.6	Very high	91.5	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-66	-40.4	176.3	-84.1	-80.8	0	0	0	112.6	L586 Q590 E624 V625 S630 K631 T632	L586-N628 HydrophobicContact CB-CB 4.16Å; L586-N628 HydrophobicContact CD1-CB 3.99Å; Q590-N628 PolarHBondContact NE2-OD1 2.92Å; E624-N628 WeakPolarHBondContact O-CB 3.43Å; E624-N628 PolarHBondContact O-N 2.99Å; E624-N628 PolarHBondContact O-ND2 3.01Å; V625-N628 PolarHBondContact O-N 2.73Å; N628-S630 VanDerWaalsContact C-N 3.32Å; N628-S630 PolarHBondContact O-N 2.94Å; N628-K631 PolarHBondContact O-N 3.02Å; N628-T632 WeakPolarHBondContact O-CB 3.48Å; N628-T632 PolarHBondContact O-N 3.13Å; N628-T632 PolarHBondContact O-OG1 2.66Å
629	C	95.7	Very high	90.6	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-58.3	-45	171.5	-72.8	0	0	0	0	111.7	L586 I613 F617 V625 L626 T632 Y633	L586-C629 VanDerWaalsContact CD1-SG 3.53Å; I613-C629 HydrophobicContact CG2-CB 3.97Å; F617-C629 HydrophobicContact CB-CB 4.41Å; F617-C629 HydrophobicContact CD2-CB 3.69Å; V625-C629 PolarHBondContact O-N 2.92Å; V625-C629 PolarHBondContact O-SG 3.06Å; V625-C629 VanDerWaalsContact O-SG 3.38Å; L626-C629 PolarHBondContact O-N 3.12Å; C629-T632 PolarHBondContact O-N 3.5Å; C629-Y633 VanDerWaalsContact O-CD2 3.29Å; C629-Y633 WeakPolarHBondContact O-CD2 3.41Å; C629-Y633 PolarHBondContact O-N 3.24Å
630	S	94.2	Very high	89.9	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63	-43.8	178.3	-172.8	0	0	0	0	112.2	L626 A627 N628 Y633 E634 A693 L694 H698	L626-S630 WeakPolarHBondContact O-CB 3.4Å; L626-S630 PolarHBondContact O-N 2.94Å; A627-S630 WeakPolarHBondContact O-CB 3.32Å; A627-S630 PolarHBondContact O-N 3.34Å; N628-S630 VanDerWaalsContact C-N 3.32Å; N628-S630 PolarHBondContact O-N 2.94Å; S630-Y633 WeakPolarHBondContact O-CB 3.1Å; S630-Y633 PolarHBondContact O-N 3.35Å; S630-E634 PolarHBondContact O-N 3.29Å; S630-A693 WeakPolarHBondContact CB-O 3.41Å; S630-A693 PolarHBondContact OG-O 2.86Å; S630-L694 WeakPolarHBondContact OG-CA 3.08Å; S630-H698 PolarHBondContact O-NE2 2.99Å; S630-H698 PolarHBondContact OG-CD2 3.14Å
631	K	93.1	Very high	89.4	Confident	29 Å²	29	35.8 Å²	35.8	13%	0.126	20%	0.201	C	C	.	.	H	α-helix	trans	-63.9	-43.7	175.4	-179.8	64.3	-173.7	-179.6	0	112.1	Q590 A627 N628 Y633 E634 C635 E1093	Q590-K631 HydrophobicContact CG-CG 4.34Å; A627-K631 WeakPolarHBondContact O-CB 3.47Å; A627-K631 PolarHBondContact O-N 2.98Å; N628-K631 PolarHBondContact O-N 3.02Å; K631-Y633 VanDerWaalsContact C-N 3.28Å; K631-Y633 PolarHBondContact O-N 3Å; K631-E634 VanDerWaalsContact CD-OE2 3.29Å; K631-E634 WeakPolarHBondContact CD-OE2 3.47Å; K631-E634 WeakPolarHBondContact CE-OE2 3.47Å; K631-E634 IonicContact NZ-OE2 2.69Å; K631-E634 PolarHBondContact NZ-OE2 3.48Å; K631-E634 WeakPolarHBondContact O-CA 3.41Å; K631-E634 WeakPolarHBondContact O-CB 3.28Å; K631-E634 PolarHBondContact O-N 3.41Å; K631-C635 PolarHBondContact O-N 3Å; K631-C635 VanDerWaalsContact O-N 3.09Å; K631-C635 PolarHBondContact O-SG 3.28Å; K631-E1093 PolarHBondContact NZ-O 2.88Å
632	T	93	Very high	88.9	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62.3	-36.1	174.4	-58.8	0	0	0	0	111.2	L586 A589 Q590 I613 N628 C629 C635 L636	L586-T632 PolarHBondContact O-OG1 3.21Å; L586-T632 VanDerWaalsContact O-OG1 3.13Å; A589-T632 HydrophobicContact CB-CG2 3.62Å; Q590-T632 VanDerWaalsContact CG-OG1 3.32Å; Q590-T632 WeakPolarHBondContact CG-OG1 3.38Å; Q590-T632 PolarHBondContact NE2-OG1 3.14Å; I613-T632 HydrophobicContact CD1-CG2 3.74Å; N628-T632 WeakPolarHBondContact O-CB 3.48Å; N628-T632 PolarHBondContact O-N 3.13Å; N628-T632 PolarHBondContact O-OG1 2.66Å; C629-T632 PolarHBondContact O-N 3.5Å; T632-C635 PolarHBondContact O-N 3.4Å; T632-L636 HydrophobicContact CG2-CD1 4Å; T632-L636 HydrophobicContact CG2-CG 4.31Å; T632-L636 WeakPolarHBondContact O-CB 3.22Å; T632-L636 VanDerWaalsContact O-CG 3.26Å; T632-L636 WeakPolarHBondContact O-CG 3.35Å; T632-L636 PolarHBondContact O-N 2.91Å
633	Y	91.5	Very high	88.4	Confident	2 Å²	2	36 Å²	36	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-66.8	-31.8	169.6	-81.6	-59.6	0	0	0	114	L610 I613 E614 C629 S630 K631 C637 T650 I654	L610-Y633 HydrophobicContact CD2-CD1 4.37Å; L610-Y633 HydrophobicContact CD2-CE1 3.77Å; L610-Y633 PolarHBondContact O-OH 3.33Å; I613-Y633 HydrophobicContact CB-CE2 4.15Å; I613-Y633 HydrophobicContact CG2-CD2 3.98Å; I613-Y633 HydrophobicContact CG2-CE2 3.34Å; E614-Y633 PolarHBondContact N-OH 2.86Å; E614-Y633 VanDerWaalsContact N-OH 3.16Å; C629-Y633 VanDerWaalsContact O-CD2 3.29Å; C629-Y633 WeakPolarHBondContact O-CD2 3.41Å; C629-Y633 PolarHBondContact O-N 3.24Å; S630-Y633 WeakPolarHBondContact O-CB 3.1Å; S630-Y633 PolarHBondContact O-N 3.35Å; K631-Y633 VanDerWaalsContact C-N 3.28Å; K631-Y633 PolarHBondContact O-N 3Å; Y633-C637 VanDerWaalsContact O-CB 3.26Å; Y633-C637 WeakPolarHBondContact O-CB 3.25Å; Y633-C637 PolarHBondContact O-N 3.26Å; Y633-C637 VanDerWaalsContact O-N 3.13Å; Y633-C637 PolarHBondContact O-SG 2.95Å; Y633-T650 HydrophobicContact CE1-CG2 4.16Å; Y633-I654 HydrophobicContact CE1-CD1 4.27Å; Y633-I654 HydrophobicContact CE2-CD1 3.51Å; Y633-I654 WeakPolarHBondContact OH-CD1 3.46Å
634	E	91.2	Very high	88.1	Confident	46 Å²	46	33.5 Å²	33.5	22%	0.215	20%	0.195	C	C	.	.	H	α-helix	trans	-57.7	-55.4	171.6	-161.6	-172.4	-138.5	0	0	109.1	K18 S630 K631 L636 C637 S638 C697	K18-E634 IonicContact NZ-OE1 2.8Å; K18-E634 PolarHBondContact NZ-OE1 2.81Å; S630-E634 PolarHBondContact O-N 3.29Å; K631-E634 VanDerWaalsContact CD-OE2 3.29Å; K631-E634 WeakPolarHBondContact CD-OE2 3.47Å; K631-E634 WeakPolarHBondContact CE-OE2 3.47Å; K631-E634 IonicContact NZ-OE2 2.69Å; K631-E634 PolarHBondContact NZ-OE2 3.48Å; K631-E634 WeakPolarHBondContact O-CA 3.41Å; K631-E634 WeakPolarHBondContact O-CB 3.28Å; K631-E634 PolarHBondContact O-N 3.41Å; E634-L636 PolarHBondContact O-N 3.43Å; E634-C637 CarbonylContact O-C 3.52Å; E634-C637 PolarHBondContact O-N 3.49Å; E634-C637 VanDerWaalsContact O-N 3.16Å; E634-S638 WeakPolarHBondContact O-CB 3.22Å; E634-S638 PolarHBondContact O-N 2.92Å; E634-C697 HydrophobicContact CB-CB 4.09Å; E634-C697 HydrophobicContact CG-CB 4.26Å
635	C	89.6	Confident	87.9	Confident	25 Å²	25	34.5 Å²	34.5	17%	0.169	21%	0.206	C	C	.	.	H	α-helix	trans	-61.2	-43.8	179.9	-60.4	0	0	0	0	113.4	K631 T632 C637 S638	K631-C635 PolarHBondContact O-N 3Å; K631-C635 VanDerWaalsContact O-N 3.09Å; K631-C635 PolarHBondContact O-SG 3.28Å; T632-C635 PolarHBondContact O-N 3.4Å; C635-C637 PolarHBondContact O-N 3.04Å; C635-S638 PolarHBondContact O-N 3.48Å; C635-S638 PolarHBondContact O-OG 3.19Å
636	L	89.6	Confident	87.5	Confident	1 Å²	1	39 Å²	39	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-70.8	-17.3	178.9	-66.7	176.9	0	0	0	113.1	M594 L609 L610 I613 T632 E634 H644 S647	M594-L636 HydrophobicContact CE-CD2 4.1Å; M594-L636 HydrophobicContact SD-CD2 3.58Å; M594-L636 VanDerWaalsContact SD-CD2 3.58Å; L609-L636 HydrophobicContact CD2-CD1 4.37Å; L610-L636 HydrophobicContact CD2-CD1 4.04Å; I613-L636 HydrophobicContact CD1-CD1 3.87Å; T632-L636 HydrophobicContact CG2-CD1 4Å; T632-L636 HydrophobicContact CG2-CG 4.31Å; T632-L636 WeakPolarHBondContact O-CB 3.22Å; T632-L636 VanDerWaalsContact O-CG 3.26Å; T632-L636 WeakPolarHBondContact O-CG 3.35Å; T632-L636 PolarHBondContact O-N 2.91Å; E634-L636 PolarHBondContact O-N 3.43Å; L636-H644 PolarHBondContact O-ND1 3.3Å; L636-S647 VanDerWaalsContact O-CB 3.28Å; L636-S647 WeakPolarHBondContact O-CB 3.16Å; L636-S647 PolarHBondContact O-OG 3.48Å; L636-S647 VanDerWaalsContact O-OG 3.12Å
637	C	87	Confident	87.2	Confident	15 Å²	15	39 Å²	39	10%	0.101	22%	0.223	C	C	.	.	H	α-helix	trans	-100.6	-13.3	175.9	-66.2	0	0	0	0	113.9	Y633 E634 C635 G639 V648	Y633-C637 VanDerWaalsContact O-CB 3.26Å; Y633-C637 WeakPolarHBondContact O-CB 3.25Å; Y633-C637 PolarHBondContact O-N 3.26Å; Y633-C637 VanDerWaalsContact O-N 3.13Å; Y633-C637 PolarHBondContact O-SG 2.95Å; E634-C637 CarbonylContact O-C 3.52Å; E634-C637 PolarHBondContact O-N 3.49Å; E634-C637 VanDerWaalsContact O-N 3.16Å; C635-C637 PolarHBondContact O-N 3.04Å; C637-G639 PolarHBondContact O-N 3.16Å; C637-V648 HydrophobicContact CB-CG2 4.21Å
638	S	74	Confident	87.1	Confident	84 Å²	84	41.2 Å²	41.2	59%	0.587	24%	0.236	S	C	*	.			trans	-78.5	86.2	-176.6	59.1	0	0	0	0	112.1	E634 C635	E634-S638 WeakPolarHBondContact O-CB 3.22Å; E634-S638 PolarHBondContact O-N 2.92Å; C635-S638 PolarHBondContact O-N 3.48Å; C635-S638 PolarHBondContact O-OG 3.19Å
639	G	73.7	Confident	87	Confident	45 Å²	45	45.5 Å²	45.5	46%	0.464	26%	0.262	S	S	.	.	S	Bend	trans	168.6	176.5	171.3	0	0	0	0	0	113.7	C637 H644	C637-G639 PolarHBondContact O-N 3.16Å; G639-H644 VanDerWaalsContact C-CD2 3.5Å; G639-H644 WeakPolarHBondContact CA-NE2 3.45Å
640	Q	74.6	Confident	86.7	Confident	176 Å²	176	46.8 Å²	46.8	82%	0.822	27%	0.27	S	S	*	.			trans	-114	3.7	-176.5	-63.6	-176.3	0.7	0	0	113.8
641	L	80.2	Confident	86.7	Confident	55 Å²	55	50 Å²	50	29%	0.288	28%	0.282	S	S	.	.	S	Bend	trans	-64.7	146.8	175.1	-54.7	171.6	0	0	0	111.5	N595 V643 H644	N595-L641 WeakPolarHBondContact OD1-CD1 3.36Å; L641-V643 HydrophobicContact CB-CG1 3.94Å; L641-V643 HydrophobicContact CD1-CG1 4.39Å; L641-V643 PolarHBondContact O-N 2.82Å; L641-H644 PolarHBondContact N-CD2 2.83Å; L641-H644 PolarHBondContact O-CD2 2.88Å; L641-H644 PolarHBondContact O-N 3.37Å; L641-H644 VanDerWaalsContact O-N 3.11Å
642	P	82.4	Confident	86.6	Confident	116 Å²	116	50.8 Å²	50.8	75%	0.753	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-25.6	177.6	-28	35.5	0	0	0	114.8	H644 V645	P642-H644 VanDerWaalsContact C-N 3.35Å; P642-H644 PolarHBondContact O-N 3.23Å; P642-V645 WeakPolarHBondContact O-CB 3.39Å; P642-V645 VanDerWaalsContact O-CG2 3.31Å; P642-V645 WeakPolarHBondContact O-CG2 3.45Å; P642-V645 PolarHBondContact O-N 3.29Å
643	V	83.2	Confident	86.6	Confident	19 Å²	19	56.1 Å²	56.1	12%	0.115	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-30.4	-179.6	67.1	0	0	0	0	113.5	L606 L641 V645 R646	L606-V643 HydrophobicContact CD2-CG2 3.37Å; L641-V643 HydrophobicContact CB-CG1 3.94Å; L641-V643 HydrophobicContact CD1-CG1 4.39Å; L641-V643 PolarHBondContact O-N 2.82Å; V643-V645 PolarHBondContact O-N 3.31Å; V643-R646 PolarHBondContact O-N 2.85Å
644	H	85.4	Confident	86.7	Confident	9 Å²	9	56.2 Å²	56.2	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-66.2	-20.2	178.7	-61.6	-81.6	0	0	0	113.2	L636 G639 L641 P642 R646 S647 V648	L636-H644 PolarHBondContact O-ND1 3.3Å; G639-H644 VanDerWaalsContact C-CD2 3.5Å; G639-H644 WeakPolarHBondContact CA-NE2 3.45Å; L641-H644 PolarHBondContact N-CD2 2.83Å; L641-H644 PolarHBondContact O-CD2 2.88Å; L641-H644 PolarHBondContact O-N 3.37Å; L641-H644 VanDerWaalsContact O-N 3.11Å; P642-H644 VanDerWaalsContact C-N 3.35Å; P642-H644 PolarHBondContact O-N 3.23Å; H644-R646 PolarHBondContact O-N 3.38Å; H644-R646 VanDerWaalsContact O-N 3.16Å; H644-S647 WeakPolarHBondContact O-CB 3.44Å; H644-S647 PolarHBondContact O-N 3.04Å; H644-S647 VanDerWaalsContact O-N 3.09Å; H644-V648 WeakPolarHBondContact O-CB 3.48Å; H644-V648 WeakPolarHBondContact O-CG2 3.31Å; H644-V648 PolarHBondContact O-N 2.87Å
645	V	88.4	Confident	86.9	Confident	95 Å²	95	54.3 Å²	54.3	58%	0.576	31%	0.306	S	S	*	.	H	α-helix	trans	-53.5	-38.3	177.9	175.8	0	0	0	0	110.9	P642 V643 V649	P642-V645 WeakPolarHBondContact O-CB 3.39Å; P642-V645 VanDerWaalsContact O-CG2 3.31Å; P642-V645 WeakPolarHBondContact O-CG2 3.45Å; P642-V645 PolarHBondContact O-N 3.29Å; V643-V645 PolarHBondContact O-N 3.31Å; V645-V649 VanDerWaalsContact O-CG2 3.31Å; V645-V649 WeakPolarHBondContact O-CG2 3.36Å; V645-V649 PolarHBondContact O-N 3.16Å
646	R	87.2	Confident	87.2	Confident	95 Å²	95	57.1 Å²	57.1	36%	0.358	32%	0.319	S	S	.	.	H	α-helix	trans	-66.5	-50.1	176.9	-66.3	176.9	172.9	-170.8	-3.9	112	S603 E607 L610 V643 H644 V648 V649 T650	S603-R646 PolarHBondContact O-NH1 3.23Å; S603-R646 VanDerWaalsContact O-NH1 3.12Å; S603-R646 PolarHBondContact OG-NH1 3.42Å; S603-R646 PolarHBondContact OG-NH2 3.12Å; E607-R646 IonicContact OE1-CZ 2.63Å; E607-R646 IonicContact OE1-NE 3.88Å; E607-R646 IonicContact OE1-NH1 2.84Å; E607-R646 PolarHBondContact OE1-NH1 3.14Å; E607-R646 IonicContact OE1-NH2 3.01Å; E607-R646 PolarHBondContact OE1-NH2 3.35Å; L610-R646 HydrophobicContact CD1-CB 4.31Å; V643-R646 PolarHBondContact O-N 2.85Å; H644-R646 PolarHBondContact O-N 3.38Å; H644-R646 VanDerWaalsContact O-N 3.16Å; R646-V648 VanDerWaalsContact C-N 3.28Å; R646-V648 PolarHBondContact O-N 3.4Å; R646-V649 PolarHBondContact O-N 3.4Å; R646-T650 PolarHBondContact O-N 2.88Å; R646-T650 PolarHBondContact O-OG1 2.91Å
647	S	90	Very high	87.4	Confident	0 Å²	0	60 Å²	60	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-56	-43.7	176.2	-48.2	0	0	0	0	111.6	L636 H644 T650 R651	L636-S647 VanDerWaalsContact O-CB 3.28Å; L636-S647 WeakPolarHBondContact O-CB 3.16Å; L636-S647 PolarHBondContact O-OG 3.48Å; L636-S647 VanDerWaalsContact O-OG 3.12Å; H644-S647 WeakPolarHBondContact O-CB 3.44Å; H644-S647 PolarHBondContact O-N 3.04Å; H644-S647 VanDerWaalsContact O-N 3.09Å; S647-T650 PolarHBondContact O-N 3.44Å; S647-R651 WeakPolarHBondContact O-CB 3.47Å; S647-R651 PolarHBondContact O-N 2.93Å
648	V	90.4	Very high	87.8	Confident	49 Å²	49	59.8 Å²	59.8	30%	0.297	34%	0.338	S	S	.	.	H	α-helix	trans	-64.5	-39.3	178.8	168.1	0	0	0	0	112.2	C637 H644 R646 S652	C637-V648 HydrophobicContact CB-CG2 4.21Å; H644-V648 WeakPolarHBondContact O-CB 3.48Å; H644-V648 WeakPolarHBondContact O-CG2 3.31Å; H644-V648 PolarHBondContact O-N 2.87Å; R646-V648 VanDerWaalsContact C-N 3.28Å; R646-V648 PolarHBondContact O-N 3.4Å; V648-S652 PolarHBondContact O-N 3.48Å; V648-S652 PolarHBondContact O-OG 3.33Å
649	V	92.2	Very high	88.8	Confident	95 Å²	95	55.9 Å²	55.9	58%	0.576	31%	0.311	S	S	*	.	H	α-helix	trans	-66.6	-47.7	175.1	168.3	0	0	0	0	110.6	V645 R646 R651 S652 K653	V645-V649 VanDerWaalsContact O-CG2 3.31Å; V645-V649 WeakPolarHBondContact O-CG2 3.36Å; V645-V649 PolarHBondContact O-N 3.16Å; R646-V649 PolarHBondContact O-N 3.4Å; V649-R651 PolarHBondContact O-N 3.47Å; V649-S652 PolarHBondContact O-N 3.43Å; V649-K653 PolarHBondContact O-N 2.94Å
650	T	91	Very high	89.9	Confident	26 Å²	26	58.5 Å²	58.5	16%	0.16	31%	0.313	C	S	.	.	H	α-helix	trans	-61	-45.4	177.9	-59.7	0	0	0	0	111.7	L610 Y633 R646 S647 S652 K653 I654	L610-T650 HydrophobicContact CB-CG2 4.34Å; Y633-T650 HydrophobicContact CE1-CG2 4.16Å; R646-T650 PolarHBondContact O-N 2.88Å; R646-T650 PolarHBondContact O-OG1 2.91Å; S647-T650 PolarHBondContact O-N 3.44Å; T650-S652 VanDerWaalsContact C-N 3.32Å; T650-S652 PolarHBondContact O-N 2.92Å; T650-K653 WeakPolarHBondContact O-CB 3.22Å; T650-K653 PolarHBondContact O-N 3.47Å; T650-I654 HydrophobicContact CG2-CD1 3.91Å; T650-I654 WeakPolarHBondContact O-CG1 2.94Å; T650-I654 PolarHBondContact O-N 3.48Å
651	R	92.6	Very high	90.8	Very high	69 Å²	69	54 Å²	54	26%	0.26	29%	0.291	S	S	.	.	H	α-helix	trans	-53.9	-48.1	173.2	178.3	-169.7	63.7	178.4	1.8	111.7	S647 V649 K653 I654 I655 H698	S647-R651 WeakPolarHBondContact O-CB 3.47Å; S647-R651 PolarHBondContact O-N 2.93Å; V649-R651 PolarHBondContact O-N 3.47Å; R651-K653 PolarHBondContact O-N 3.33Å; R651-I654 PolarHBondContact O-N 3.49Å; R651-I655 HydrophobicContact CG-CD1 3.9Å; R651-I655 WeakPolarHBondContact O-CG1 3.44Å; R651-I655 PolarHBondContact O-N 3.14Å; R651-H698 VanDerWaalsContact CD-ND1 3.25Å; R651-H698 WeakPolarHBondContact CD-ND1 3.36Å
652	S	92.7	Very high	91.6	Very high	45 Å²	45	51.4 Å²	51.4	32%	0.315	28%	0.277	S	S	.	.	H	α-helix	trans	-60.7	-45.5	-179.1	-54	0	0	0	0	111.4	V648 V649 T650 I654 I655 D656	V648-S652 PolarHBondContact O-N 3.48Å; V648-S652 PolarHBondContact O-OG 3.33Å; V649-S652 PolarHBondContact O-N 3.43Å; T650-S652 VanDerWaalsContact C-N 3.32Å; T650-S652 PolarHBondContact O-N 2.92Å; S652-I654 VanDerWaalsContact C-N 3.33Å; S652-I654 PolarHBondContact O-N 2.89Å; S652-I655 PolarHBondContact O-N 3.19Å; S652-D656 PolarHBondContact O-N 2.74Å
653	K	93	Very high	92.2	Very high	111 Å²	111	50.1 Å²	50.1	48%	0.483	26%	0.258	S	S	.	.	H	α-helix	trans	-57.9	-41.3	175.5	-178.8	-163.1	174.6	-155.5	0	112.7	E614 V649 T650 R651 S657	E614-K653 WeakPolarHBondContact OE1-CE 3.39Å; E614-K653 IonicContact OE1-NZ 2.73Å; E614-K653 PolarHBondContact OE1-NZ 3.29Å; E614-K653 IonicContact OE2-NZ 3.44Å; E614-K653 PolarHBondContact OE2-NZ 2.97Å; V649-K653 PolarHBondContact O-N 2.94Å; T650-K653 WeakPolarHBondContact O-CB 3.22Å; T650-K653 PolarHBondContact O-N 3.47Å; R651-K653 PolarHBondContact O-N 3.33Å; K653-S657 WeakPolarHBondContact O-CB 3.18Å; K653-S657 PolarHBondContact O-N 3.18Å; K653-S657 PolarHBondContact O-OG 3.39Å; K653-S657 VanDerWaalsContact O-OG 3.06Å
654	I	93.3	Very high	92.8	Very high	4 Å²	4	54 Å²	54	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-69.3	-40.9	178.9	-70.6	168.8	0	0	0	111.4	E614 F617 Y633 T650 R651 S652 S657 T658	E614-I654 HydrophobicContact CB-CD1 3.88Å; E614-I654 HydrophobicContact CB-CG1 4.45Å; E614-I654 HydrophobicContact CG-CD1 3.97Å; E614-I654 HydrophobicContact CG-CG1 3.99Å; F617-I654 HydrophobicContact CD1-CG2 3.65Å; F617-I654 HydrophobicContact CE1-CG2 3.83Å; F617-I654 HydrophobicContact CG-CG2 4.49Å; Y633-I654 HydrophobicContact CE1-CD1 4.27Å; Y633-I654 HydrophobicContact CE2-CD1 3.51Å; Y633-I654 WeakPolarHBondContact OH-CD1 3.46Å; T650-I654 HydrophobicContact CG2-CD1 3.91Å; T650-I654 WeakPolarHBondContact O-CG1 2.94Å; T650-I654 PolarHBondContact O-N 3.48Å; R651-I654 PolarHBondContact O-N 3.49Å; S652-I654 VanDerWaalsContact C-N 3.33Å; S652-I654 PolarHBondContact O-N 2.89Å; I654-S657 PolarHBondContact O-OG 3.41Å; I654-T658 WeakPolarHBondContact O-CB 3.46Å; I654-T658 PolarHBondContact O-N 3.4Å; I654-T658 PolarHBondContact O-OG1 3.07Å
655	I	94.9	Very high	93.3	Very high	6 Å²	6	53.9 Å²	53.9	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-51.3	174.6	-66.4	166.7	0	0	0	109.8	R651 S652 S657 T658 V659 L694 H698 L700 W703	R651-I655 HydrophobicContact CG-CD1 3.9Å; R651-I655 WeakPolarHBondContact O-CG1 3.44Å; R651-I655 PolarHBondContact O-N 3.14Å; S652-I655 PolarHBondContact O-N 3.19Å; I655-S657 PolarHBondContact O-N 3.31Å; I655-T658 PolarHBondContact O-N 3.01Å; I655-V659 HydrophobicContact CG2-CG2 4.18Å; I655-V659 WeakPolarHBondContact O-CB 3.45Å; I655-V659 VanDerWaalsContact O-CG2 3.26Å; I655-V659 WeakPolarHBondContact O-CG2 3.35Å; I655-V659 PolarHBondContact O-N 3.48Å; I655-L694 HydrophobicContact CG1-CD1 4.15Å; I655-L694 HydrophobicContact CG1-CD2 4.1Å; I655-H698 HydrophobicContact CD1-CB 4.37Å; I655-L700 HydrophobicContact CD1-CD1 3.93Å; I655-L700 HydrophobicContact CG1-CD1 4.15Å; I655-L700 HydrophobicContact CG2-CD1 4.21Å; I655-L700 HydrophobicContact CG2-CD2 4.02Å; I655-L700 HydrophobicContact CG2-CG 3.71Å; I655-W703 HydrophobicContact CB-CH2 4.34Å; I655-W703 HydrophobicContact CB-CZ2 4.31Å; I655-W703 HydrophobicContact CG2-CD2 4.01Å; I655-W703 HydrophobicContact CG2-CE3 4Å; I655-W703 HydrophobicContact CG2-CH2 3.52Å; I655-W703 HydrophobicContact CG2-CZ2 3.5Å; I655-W703 VanDerWaalsContact CG2-CZ2 3.5Å; I655-W703 HydrophobicContact CG2-CZ3 3.77Å
656	D	94.9	Very high	93.6	Very high	84 Å²	84	49.6 Å²	49.6	45%	0.449	25%	0.248	S	C	.	.	H	α-helix	trans	-57.8	-45.7	-179.2	-79.1	-39.5	0	0	0	112.5	S652 L660 W703	S652-D656 PolarHBondContact O-N 2.74Å; D656-L660 VanDerWaalsContact O-CB 3.27Å; D656-L660 WeakPolarHBondContact O-CB 3.32Å; D656-L660 PolarHBondContact O-N 3.04Å; D656-W703 WeakPolarHBondContact OD1-CZ2 3.48Å; D656-W703 PolarHBondContact OD1-NE1 3.11Å
657	S	94.5	Very high	93.9	Very high	61 Å²	61	51 Å²	51	43%	0.427	26%	0.258	S	S	.	.	H	α-helix	trans	-69.4	-40.7	179.4	62.6	0	0	0	0	112.9	K653 I654 I655 L660 K661	K653-S657 WeakPolarHBondContact O-CB 3.18Å; K653-S657 PolarHBondContact O-N 3.18Å; K653-S657 PolarHBondContact O-OG 3.39Å; K653-S657 VanDerWaalsContact O-OG 3.06Å; I654-S657 PolarHBondContact O-OG 3.41Å; I655-S657 PolarHBondContact O-N 3.31Å; S657-L660 PolarHBondContact O-N 3.36Å; S657-K661 WeakPolarHBondContact O-CB 3.43Å; S657-K661 PolarHBondContact O-N 2.71Å
658	T	95.2	Very high	94	Very high	12 Å²	12	53.3 Å²	53.3	7%	0.074	27%	0.271	C	S	.	.	H	α-helix	trans	-63.8	-45.3	177.7	-60.1	0	0	0	0	111.3	F617 I654 I655 K661 F662 R690 V691 L694	F617-T658 HydrophobicContact CE1-CG2 4.43Å; I654-T658 WeakPolarHBondContact O-CB 3.46Å; I654-T658 PolarHBondContact O-N 3.4Å; I654-T658 PolarHBondContact O-OG1 3.07Å; I655-T658 PolarHBondContact O-N 3.01Å; T658-K661 PolarHBondContact O-N 2.66Å; T658-F662 PolarHBondContact O-N 2.88Å; T658-R690 HydrophobicContact CG2-CB 3.5Å; T658-R690 VanDerWaalsContact CG2-CB 3.5Å; T658-V691 HydrophobicContact CG2-CG2 3.94Å; T658-L694 HydrophobicContact CG2-CD1 3.93Å
659	V	95.6	Very high	94	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.012	26%	0.258	C	S	.	.	H	α-helix	trans	-69.3	-37.8	179.3	172.5	0	0	0	0	111.7	I655 F662 R663 L700 W703 I705	I655-V659 HydrophobicContact CG2-CG2 4.18Å; I655-V659 WeakPolarHBondContact O-CB 3.45Å; I655-V659 VanDerWaalsContact O-CG2 3.26Å; I655-V659 WeakPolarHBondContact O-CG2 3.35Å; I655-V659 PolarHBondContact O-N 3.48Å; V659-F662 PolarHBondContact O-N 3.41Å; V659-R663 WeakPolarHBondContact O-CB 3.28Å; V659-R663 PolarHBondContact O-N 3.27Å; V659-L700 HydrophobicContact CG2-CD2 4.19Å; V659-W703 HydrophobicContact CB-CG 4.38Å; V659-W703 HydrophobicContact CG1-CB 3.81Å; V659-W703 HydrophobicContact CG1-CG 3.92Å; V659-W703 HydrophobicContact CG2-CB 4.41Å; V659-W703 HydrophobicContact CG2-CG 4.21Å; V659-I705 HydrophobicContact CG1-CD1 4.42Å; V659-I705 HydrophobicContact CG1-CG1 4.48Å; V659-I705 HydrophobicContact CG2-CD1 3.73Å
660	L	95.5	Very high	93.9	Very high	99 Å²	99	49.9 Å²	49.9	52%	0.518	25%	0.247	S	C	.	.	H	α-helix	trans	-60.8	-48.7	174.6	-179.8	61.7	0	0	0	110.9	D656 S657 R663 E664	D656-L660 VanDerWaalsContact O-CB 3.27Å; D656-L660 WeakPolarHBondContact O-CB 3.32Å; D656-L660 PolarHBondContact O-N 3.04Å; S657-L660 PolarHBondContact O-N 3.36Å; L660-R663 WeakPolarHBondContact O-CB 3.42Å; L660-R663 PolarHBondContact O-N 3.34Å; L660-R663 VanDerWaalsContact O-N 3.15Å; L660-E664 WeakPolarHBondContact O-CG 3.33Å; L660-E664 PolarHBondContact O-N 3.02Å
661	K	95.1	Very high	93.8	Very high	82 Å²	82	52.4 Å²	52.4	36%	0.357	27%	0.271	S	S	.	.	H	α-helix	trans	-60.4	-46.6	176.8	176.1	53.9	177.3	162.6	0	112.1	S657 T658 R663 E664 D665 S683	S657-K661 WeakPolarHBondContact O-CB 3.43Å; S657-K661 PolarHBondContact O-N 2.71Å; T658-K661 PolarHBondContact O-N 2.66Å; K661-R663 VanDerWaalsContact C-N 3.26Å; K661-R663 PolarHBondContact O-N 3.31Å; K661-E664 PolarHBondContact O-N 3.17Å; K661-E664 VanDerWaalsContact O-N 3.17Å; K661-D665 WeakPolarHBondContact CE-OD1 3.48Å; K661-D665 VanDerWaalsContact CE-OD2 3.27Å; K661-D665 WeakPolarHBondContact CE-OD2 3.46Å; K661-D665 IonicContact NZ-OD1 3.89Å; K661-D665 PolarHBondContact NZ-OD1 2.69Å; K661-D665 IonicContact NZ-OD2 3.51Å; K661-D665 VanDerWaalsContact O-CG 3.25Å; K661-D665 PolarHBondContact O-N 2.84Å; K661-S683 PolarHBondContact NZ-OG 3.06Å
662	F	95.9	Very high	93.6	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.2	-37	175.3	177	-117.8	0	0	0	112.5	T658 V659 M666 L688 V691 I705 M708	T658-F662 PolarHBondContact O-N 2.88Å; V659-F662 PolarHBondContact O-N 3.41Å; F662-M666 HydrophobicContact CD1-CG 4.47Å; F662-M666 HydrophobicContact CD2-CG 3.87Å; F662-M666 HydrophobicContact CE1-CG 4.02Å; F662-M666 HydrophobicContact CE2-CG 3.33Å; F662-M666 HydrophobicContact CE2-SD 3.74Å; F662-M666 HydrophobicContact CG-CG 4.4Å; F662-M666 HydrophobicContact CZ-CG 3.42Å; F662-M666 VanDerWaalsContact CZ-CG 3.42Å; F662-M666 HydrophobicContact CZ-SD 3.88Å; F662-M666 VanDerWaalsContact O-CB 3.3Å; F662-M666 WeakPolarHBondContact O-CB 3.43Å; F662-M666 VanDerWaalsContact O-CG 3.24Å; F662-M666 WeakPolarHBondContact O-CG 3.34Å; F662-M666 PolarHBondContact O-N 3.02Å; F662-L688 HydrophobicContact CD2-CB 4.14Å; F662-L688 HydrophobicContact CD2-CD1 4.48Å; F662-L688 HydrophobicContact CE1-CD1 4.34Å; F662-L688 HydrophobicContact CE2-CB 3.81Å; F662-L688 HydrophobicContact CE2-CD1 3.79Å; F662-L688 HydrophobicContact CE2-CG 4.26Å; F662-L688 HydrophobicContact CZ-CD1 3.71Å; F662-V691 HydrophobicContact CB-CG2 3.94Å; F662-V691 HydrophobicContact CD1-CG2 4.15Å; F662-V691 HydrophobicContact CG-CG2 4.05Å; F662-I705 HydrophobicContact CE1-CG2 4.07Å; F662-M708 HydrophobicContact CD1-CE 4.09Å; F662-M708 HydrophobicContact CE1-CB 3.77Å; F662-M708 HydrophobicContact CE1-CE 4.2Å; F662-M708 HydrophobicContact CZ-CB 4.29Å
663	R	96.3	Very high	93.2	Very high	90 Å²	90	55.6 Å²	55.6	34%	0.34	29%	0.289	S	S	.	.	H	α-helix	trans	-66	-41.5	175.8	-176.9	179.6	-58.8	-76.7	-2.2	112.4	V659 L660 K661 Q667 W703 M708	V659-R663 WeakPolarHBondContact O-CB 3.28Å; V659-R663 PolarHBondContact O-N 3.27Å; L660-R663 WeakPolarHBondContact O-CB 3.42Å; L660-R663 PolarHBondContact O-N 3.34Å; L660-R663 VanDerWaalsContact O-N 3.15Å; K661-R663 VanDerWaalsContact C-N 3.26Å; K661-R663 PolarHBondContact O-N 3.31Å; R663-Q667 VanDerWaalsContact O-CG 3.26Å; R663-Q667 WeakPolarHBondContact O-CG 3.32Å; R663-Q667 PolarHBondContact O-N 3.13Å; R663-W703 PolarHBondContact NH2-O 3.47Å; R663-M708 HydrophobicContact CB-SD 3.86Å; R663-M708 HydrophobicContact CG-SD 3.88Å; R663-M708 PolarHBondContact NH1-SD 2.62Å; R663-M708 VanDerWaalsContact NH1-SD 3.39Å
664	E	95.7	Very high	92.8	Very high	101 Å²	101	51.1 Å²	51.1	47%	0.472	27%	0.274	S	S	.	.	H	α-helix	trans	-63.9	-47.2	175.6	-69.7	170.5	176.1	0	0	111.2	L660 K661 M666 Q667 N668	L660-E664 WeakPolarHBondContact O-CG 3.33Å; L660-E664 PolarHBondContact O-N 3.02Å; K661-E664 PolarHBondContact O-N 3.17Å; K661-E664 VanDerWaalsContact O-N 3.17Å; E664-M666 PolarHBondContact O-N 3.05Å; E664-Q667 WeakPolarHBondContact O-CB 3.47Å; E664-Q667 PolarHBondContact O-N 3.27Å; E664-Q667 VanDerWaalsContact O-N 3.15Å; E664-N668 PolarHBondContact O-N 3Å; E664-N668 VanDerWaalsContact O-N 3.07Å
665	D	94.8	Very high	92.4	Very high	6 Å²	6	57.2 Å²	57.2	3%	0.032	30%	0.301	C	S	.	.	H	α-helix	trans	-59.1	-47.3	177.3	-66.4	-23.1	0	0	0	111.4	K661 Q667 N668 F669 T684 S687	K661-D665 WeakPolarHBondContact CE-OD1 3.48Å; K661-D665 VanDerWaalsContact CE-OD2 3.27Å; K661-D665 WeakPolarHBondContact CE-OD2 3.46Å; K661-D665 IonicContact NZ-OD1 3.89Å; K661-D665 PolarHBondContact NZ-OD1 2.69Å; K661-D665 IonicContact NZ-OD2 3.51Å; K661-D665 VanDerWaalsContact O-CG 3.25Å; K661-D665 PolarHBondContact O-N 2.84Å; D665-Q667 VanDerWaalsContact C-N 3.3Å; D665-Q667 PolarHBondContact O-N 3.35Å; D665-N668 PolarHBondContact O-N 3.28Å; D665-F669 WeakPolarHBondContact O-CB 3.31Å; D665-F669 PolarHBondContact O-N 3.46Å; D665-T684 HydrophobicContact CB-CG2 4.39Å; D665-S687 WeakPolarHBondContact OD2-CB 3.43Å; D665-S687 PolarHBondContact OD2-OG 3.36Å
666	M	94	Very high	92	Very high	4 Å²	4	58 Å²	58	2%	0.02	31%	0.305	C	S	.	.	H	α-helix	trans	-66.1	-28.7	177	-75	-62	-49.8	0	0	113.5	F662 E664 N670 T684 M708 L712	F662-M666 HydrophobicContact CD1-CG 4.47Å; F662-M666 HydrophobicContact CD2-CG 3.87Å; F662-M666 HydrophobicContact CE1-CG 4.02Å; F662-M666 HydrophobicContact CE2-CG 3.33Å; F662-M666 HydrophobicContact CE2-SD 3.74Å; F662-M666 HydrophobicContact CG-CG 4.4Å; F662-M666 HydrophobicContact CZ-CG 3.42Å; F662-M666 VanDerWaalsContact CZ-CG 3.42Å; F662-M666 HydrophobicContact CZ-SD 3.88Å; F662-M666 VanDerWaalsContact O-CB 3.3Å; F662-M666 WeakPolarHBondContact O-CB 3.43Å; F662-M666 VanDerWaalsContact O-CG 3.24Å; F662-M666 WeakPolarHBondContact O-CG 3.34Å; F662-M666 PolarHBondContact O-N 3.02Å; E664-M666 PolarHBondContact O-N 3.05Å; M666-N670 WeakPolarHBondContact CE-ND2 3.45Å; M666-N670 VanDerWaalsContact O-CB 3.28Å; M666-N670 WeakPolarHBondContact O-CB 3.46Å; M666-N670 VanDerWaalsContact O-CG 3.31Å; M666-N670 PolarHBondContact O-N 2.9Å; M666-N670 VanDerWaalsContact O-N 3.08Å; M666-N670 PolarHBondContact O-ND2 3.13Å; M666-T684 HydrophobicContact SD-CG2 4.13Å; M666-M708 VanDerWaalsContact CE-O 3.24Å; M666-M708 WeakPolarHBondContact CE-O 3.25Å; M666-M708 HydrophobicContact CG-CB 4.48Å; M666-L712 HydrophobicContact CE-CD1 4.27Å; M666-L712 HydrophobicContact CE-CD2 3.75Å; M666-L712 HydrophobicContact CE-CG 3.99Å; M666-L712 HydrophobicContact SD-CD1 3.96Å; M666-L712 HydrophobicContact SD-CD2 4.03Å; M666-L712 HydrophobicContact SD-CG 4.29Å
667	Q	93.7	Very high	91.8	Very high	124 Å²	124	58.4 Å²	58.4	58%	0.579	31%	0.308	S	S	*	.	H	α-helix	trans	-67.8	-45.9	172.5	-78.5	172	5.5	0	0	110.7	R663 E664 D665 A671	R663-Q667 VanDerWaalsContact O-CG 3.26Å; R663-Q667 WeakPolarHBondContact O-CG 3.32Å; R663-Q667 PolarHBondContact O-N 3.13Å; E664-Q667 WeakPolarHBondContact O-CB 3.47Å; E664-Q667 PolarHBondContact O-N 3.27Å; E664-Q667 VanDerWaalsContact O-N 3.15Å; D665-Q667 VanDerWaalsContact C-N 3.3Å; D665-Q667 PolarHBondContact O-N 3.35Å; Q667-A671 VanDerWaalsContact O-CB 3.23Å; Q667-A671 WeakPolarHBondContact O-CB 3.39Å; Q667-A671 PolarHBondContact O-N 2.99Å
668	N	92.1	Very high	91.5	Very high	50 Å²	50	61.9 Å²	61.9	27%	0.267	32%	0.321	S	S	.	.	H	α-helix	trans	-63.9	-47.2	176.2	-174.1	35.1	0	0	0	112	E664 D665 N670 A671 N672 D680	E664-N668 PolarHBondContact O-N 3Å; E664-N668 VanDerWaalsContact O-N 3.07Å; D665-N668 PolarHBondContact O-N 3.28Å; N668-N670 PolarHBondContact O-N 3.05Å; N668-A671 PolarHBondContact O-N 2.98Å; N668-N672 PolarHBondContact O-N 3.34Å; N668-N672 VanDerWaalsContact O-N 3.12Å; N668-N672 PolarHBondContact O-ND2 3.49Å; N668-N672 VanDerWaalsContact O-ND2 3.08Å; N668-N672 PolarHBondContact OD1-ND2 3.28Å; N668-D680 PolarHBondContact ND2-OD1 2.86Å; N668-D680 PolarHBondContact ND2-OD2 2.89Å
669	F	91	Very high	91.4	Very high	5 Å²	5	69.2 Å²	69.2	2%	0.022	36%	0.355	C	S	.	.	H	α-helix	trans	-58.5	-45.3	178.8	-170.8	-93.8	0	0	0	112.4	D665 L673 G674 V676 F681 T684 L712 Y719 I723 L727	D665-F669 WeakPolarHBondContact O-CB 3.31Å; D665-F669 PolarHBondContact O-N 3.46Å; F669-L673 PolarHBondContact O-N 2.65Å; F669-G674 PolarHBondContact O-N 3.3Å; F669-V676 HydrophobicContact CD2-CG1 4.27Å; F669-V676 HydrophobicContact CD2-CG2 3.81Å; F669-V676 HydrophobicContact CE2-CG2 4.06Å; F669-F681 HydrophobicContact CE2-CD2 4.33Å; F669-T684 HydrophobicContact CB-CG2 4.45Å; F669-T684 HydrophobicContact CD2-CG2 4.34Å; F669-T684 HydrophobicContact CG-CG2 4.42Å; F669-L712 HydrophobicContact CD1-CD2 4.19Å; F669-L712 HydrophobicContact CE1-CD2 3.87Å; F669-Y719 HydrophobicContact CD1-CE1 4Å; F669-Y719 AromaticContact CE1-CD1 3.88Å; F669-Y719 HydrophobicContact CE1-CD1 3.88Å; F669-Y719 AromaticContact CE1-CE1 3.59Å; F669-Y719 HydrophobicContact CE1-CE1 3.59Å; F669-Y719 HydrophobicContact CE1-CG 4.47Å; F669-Y719 AromaticContact CE1-CZ 3.97Å; F669-I723 HydrophobicContact CE1-CD1 4.09Å; F669-I723 HydrophobicContact CZ-CD1 3.98Å; F669-I723 HydrophobicContact CZ-CG1 4.25Å; F669-L727 HydrophobicContact CE2-CD2 4.22Å; F669-L727 HydrophobicContact CZ-CD2 3.99Å
670	N	89.8	Confident	91.2	Very high	66 Å²	66	71.6 Å²	71.6	35%	0.353	37%	0.367	S	S	.	.	H	α-helix	trans	-72.9	-38.2	178.1	-73.9	-46.4	0	0	0	112.9	M666 N668 N672 L673 Y719	M666-N670 WeakPolarHBondContact CE-ND2 3.45Å; M666-N670 VanDerWaalsContact O-CB 3.28Å; M666-N670 WeakPolarHBondContact O-CB 3.46Å; M666-N670 VanDerWaalsContact O-CG 3.31Å; M666-N670 PolarHBondContact O-N 2.9Å; M666-N670 VanDerWaalsContact O-N 3.08Å; M666-N670 PolarHBondContact O-ND2 3.13Å; N668-N670 PolarHBondContact O-N 3.05Å; N670-N672 PolarHBondContact O-N 3.45Å; N670-L673 PolarHBondContact O-N 2.93Å; N670-L673 VanDerWaalsContact O-N 3.1Å; N670-Y719 PolarHBondContact OD1-OH 3.05Å
671	A	90.2	Very high	91	Very high	80 Å²	80	69.2 Å²	69.2	66%	0.661	35%	0.353	S	S	*	.	H	α-helix	trans	-59.5	-36	176.9	0	0	0	0	0	112.2	Q667 N668	Q667-A671 VanDerWaalsContact O-CB 3.23Å; Q667-A671 WeakPolarHBondContact O-CB 3.39Å; Q667-A671 PolarHBondContact O-N 2.99Å; N668-A671 PolarHBondContact O-N 2.98Å
672	N	87.3	Confident	90.9	Very high	71 Å²	71	67.9 Å²	67.9	38%	0.38	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	7.8	178	-65.6	-52.9	0	0	0	114.2	N668 N670 G674 K675 V676	N668-N672 PolarHBondContact O-N 3.34Å; N668-N672 VanDerWaalsContact O-N 3.12Å; N668-N672 PolarHBondContact O-ND2 3.49Å; N668-N672 VanDerWaalsContact O-ND2 3.08Å; N668-N672 PolarHBondContact OD1-ND2 3.28Å; N670-N672 PolarHBondContact O-N 3.45Å; N672-G674 PolarHBondContact O-N 3.06Å; N672-K675 WeakPolarHBondContact O-CB 3.27Å; N672-K675 PolarHBondContact O-N 3.14Å; N672-V676 HydrophobicContact CB-CG1 4.21Å
673	L	84.6	Confident	90.8	Very high	110 Å²	110	69.8 Å²	69.8	58%	0.576	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	41	-176	-59.7	172.3	0	0	0	112.8	F669 N670 K675 A720	F669-L673 PolarHBondContact O-N 2.65Å; N670-L673 PolarHBondContact O-N 2.93Å; N670-L673 VanDerWaalsContact O-N 3.1Å; L673-K675 PolarHBondContact O-N 3.32Å; L673-A720 PolarHBondContact O-N 3.47Å
674	G	83.7	Confident	90.7	Very high	16 Å²	16	65.5 Å²	65.5	17%	0.165	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	0	-179	0	0	0	0	0	115.1	F669 N672 V676	F669-G674 PolarHBondContact O-N 3.3Å; N672-G674 PolarHBondContact O-N 3.06Å; G674-V676 PolarHBondContact O-N 2.91Å; G674-V676 VanDerWaalsContact O-N 3.13Å
675	K	85.4	Confident	90.6	Very high	133 Å²	133	61.4 Å²	61.4	58%	0.578	34%	0.336	S	S	*	.			trans	-86.5	59.6	172.4	-72.2	170	164.7	163	0	111.2	N672 L673 A720	N672-K675 WeakPolarHBondContact O-CB 3.27Å; N672-K675 PolarHBondContact O-N 3.14Å; L673-K675 PolarHBondContact O-N 3.32Å; K675-A720 HydrophobicContact CD-CB 3.77Å; K675-A720 HydrophobicContact CG-CB 4.04Å
676	V	86.8	Confident	90.6	Very high	22 Å²	22	61.6 Å²	61.6	13%	0.133	34%	0.338	C	S	.	.			trans	-86.4	166.8	166.4	-67	0	0	0	0	110.1	F669 N672 G674 D680 F681	F669-V676 HydrophobicContact CD2-CG1 4.27Å; F669-V676 HydrophobicContact CD2-CG2 3.81Å; F669-V676 HydrophobicContact CE2-CG2 4.06Å; N672-V676 HydrophobicContact CB-CG1 4.21Å; G674-V676 PolarHBondContact O-N 2.91Å; G674-V676 VanDerWaalsContact O-N 3.13Å; V676-D680 HydrophobicContact CB-CB 3.67Å; V676-D680 HydrophobicContact CG1-CB 4.14Å; V676-D680 HydrophobicContact CG2-CB 4.27Å; V676-F681 HydrophobicContact CG2-CB 3.89Å
677	D	90.3	Very high	90.7	Very high	92 Å²	92	61.4 Å²	61.4	49%	0.492	34%	0.337	S	S	.	.			trans	-79.9	177.3	168.6	64.6	39.1	0	0	0	111.8	E679 D680 F681	D677-E679 VanDerWaalsContact C-N 3.27Å; D677-E679 PolarHBondContact O-N 3.29Å; D677-E679 PolarHBondContact OD1-N 2.97Å; D677-D680 PolarHBondContact OD1-N 3.28Å; D677-F681 VanDerWaalsContact O-CB 3.29Å; D677-F681 WeakPolarHBondContact O-CB 3.23Å; D677-F681 PolarHBondContact O-N 3.15Å
678	D	89.2	Confident	90.8	Very high	134 Å²	134	55.5 Å²	55.5	72%	0.717	31%	0.31	S	S	*	.	H	α-helix	trans	-68.7	-25.8	-175.3	-60.2	-29.9	0	0	0	112.3	A682	D678-A682 VanDerWaalsContact O-CB 3.23Å; D678-A682 WeakPolarHBondContact O-CB 3.3Å; D678-A682 PolarHBondContact O-N 3.11Å
679	E	92.3	Very high	90.9	Very high	166 Å²	166	55.4 Å²	55.4	78%	0.776	31%	0.305	S	S	*	.	H	α-helix	trans	-76.4	-46.8	177.9	-65	-171.3	-176	0	0	111.1	D677 F681 A682 S683	D677-E679 VanDerWaalsContact C-N 3.27Å; D677-E679 PolarHBondContact O-N 3.29Å; D677-E679 PolarHBondContact OD1-N 2.97Å; E679-F681 VanDerWaalsContact C-N 3.35Å; E679-A682 PolarHBondContact O-N 3.42Å; E679-S683 PolarHBondContact O-N 3.44Å
680	D	92.2	Very high	91.2	Very high	52 Å²	52	57.1 Å²	57.1	28%	0.278	31%	0.312	S	S	.	.	H	α-helix	trans	-63.2	-39.9	174	-90	-22.5	0	0	0	111.8	N668 V676 D677 S683 T684	N668-D680 PolarHBondContact ND2-OD1 2.86Å; N668-D680 PolarHBondContact ND2-OD2 2.89Å; V676-D680 HydrophobicContact CB-CB 3.67Å; V676-D680 HydrophobicContact CG1-CB 4.14Å; V676-D680 HydrophobicContact CG2-CB 4.27Å; D677-D680 PolarHBondContact OD1-N 3.28Å; D680-S683 WeakPolarHBondContact O-CB 3.31Å; D680-S683 PolarHBondContact O-N 3.11Å; D680-T684 PolarHBondContact O-N 3.39Å; D680-T684 PolarHBondContact O-OG1 3.4Å
681	F	91.3	Very high	91.5	Very high	50 Å²	50	54 Å²	54	22%	0.219	30%	0.295	C	S	.	.	H	α-helix	trans	-62.8	-47.1	173.8	176.3	-100.8	0	0	0	111.4	F669 V676 D677 E679 S683 T684 L685 D724 L727	F669-F681 HydrophobicContact CE2-CD2 4.33Å; V676-F681 HydrophobicContact CG2-CB 3.89Å; D677-F681 VanDerWaalsContact O-CB 3.29Å; D677-F681 WeakPolarHBondContact O-CB 3.23Å; D677-F681 PolarHBondContact O-N 3.15Å; E679-F681 VanDerWaalsContact C-N 3.35Å; F681-S683 VanDerWaalsContact C-N 3.31Å; F681-S683 PolarHBondContact O-N 3.33Å; F681-T684 PolarHBondContact O-N 2.87Å; F681-L685 HydrophobicContact CE1-CD2 4.1Å; F681-L685 HydrophobicContact CZ-CD2 4.25Å; F681-L685 WeakPolarHBondContact O-CB 3.35Å; F681-L685 PolarHBondContact O-N 3.48Å; F681-D724 HydrophobicContact CE1-CB 4.32Å; F681-D724 HydrophobicContact CE2-CB 3.84Å; F681-D724 HydrophobicContact CZ-CB 3.4Å; F681-D724 VanDerWaalsContact CZ-CB 3.4Å; F681-L727 HydrophobicContact CE2-CB 4.46Å; F681-L727 HydrophobicContact CE2-CD2 3.9Å
682	A	92.1	Very high	91.7	Very high	54 Å²	54	50.4 Å²	50.4	45%	0.446	27%	0.265	S	S	.	.	H	α-helix	trans	-61.9	-37.8	176	0	0	0	0	0	112.2	D678 E679 A686	D678-A682 VanDerWaalsContact O-CB 3.23Å; D678-A682 WeakPolarHBondContact O-CB 3.3Å; D678-A682 PolarHBondContact O-N 3.11Å; E679-A682 PolarHBondContact O-N 3.42Å; A682-A686 WeakPolarHBondContact O-CB 3.18Å; A682-A686 PolarHBondContact O-N 3.49Å
683	S	94	Very high	92	Very high	39 Å²	39	47.1 Å²	47.1	27%	0.273	25%	0.247	S	C	.	.	H	α-helix	trans	-56.4	-53.7	170.9	-116.3	0	0	0	0	111.1	K661 E679 D680 F681 L685 A686 S687	K661-S683 PolarHBondContact NZ-OG 3.06Å; E679-S683 PolarHBondContact O-N 3.44Å; D680-S683 WeakPolarHBondContact O-CB 3.31Å; D680-S683 PolarHBondContact O-N 3.11Å; F681-S683 VanDerWaalsContact C-N 3.31Å; F681-S683 PolarHBondContact O-N 3.33Å; S683-L685 PolarHBondContact O-N 2.83Å; S683-A686 PolarHBondContact O-N 3.26Å; S683-S687 PolarHBondContact O-N 2.94Å; S683-S687 PolarHBondContact O-OG 2.78Å
684	T	93.6	Very high	92.6	Very high	1 Å²	1	42 Å²	42	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-60.3	-44.3	-177.7	-52.5	0	0	0	0	112.1	D665 M666 F669 D680 F681 S687 L688	D665-T684 HydrophobicContact CB-CG2 4.39Å; M666-T684 HydrophobicContact SD-CG2 4.13Å; F669-T684 HydrophobicContact CB-CG2 4.45Å; F669-T684 HydrophobicContact CD2-CG2 4.34Å; F669-T684 HydrophobicContact CG-CG2 4.42Å; D680-T684 PolarHBondContact O-N 3.39Å; D680-T684 PolarHBondContact O-OG1 3.4Å; F681-T684 PolarHBondContact O-N 2.87Å; T684-S687 PolarHBondContact O-OG 3.31Å; T684-L688 PolarHBondContact O-N 3.49Å; T684-L688 VanDerWaalsContact O-N 3.11Å
685	L	93.8	Very high	93	Very high	15 Å²	15	41.4 Å²	41.4	8%	0.079	21%	0.213	C	C	.	.	H	α-helix	trans	-66.1	-42	177.4	-175.7	63	0	0	0	111.3	F681 S683 R689 N726 L727 L730	F681-L685 HydrophobicContact CE1-CD2 4.1Å; F681-L685 HydrophobicContact CZ-CD2 4.25Å; F681-L685 WeakPolarHBondContact O-CB 3.35Å; F681-L685 PolarHBondContact O-N 3.48Å; S683-L685 PolarHBondContact O-N 2.83Å; L685-R689 WeakPolarHBondContact O-CG 3.16Å; L685-R689 PolarHBondContact O-N 2.92Å; L685-N726 HydrophobicContact CD1-CB 4.17Å; L685-N726 HydrophobicContact CD2-CB 4.44Å; L685-L727 HydrophobicContact CD1-CB 4.3Å; L685-L727 HydrophobicContact CD1-CD1 4.18Å; L685-L730 HydrophobicContact CD1-CD2 3.99Å
686	A	94.9	Very high	93.3	Very high	9 Å²	9	35.8 Å²	35.8	7%	0.074	19%	0.189	C	C	.	.	H	α-helix	trans	-70.4	-34.9	179.5	0	0	0	0	0	113.2	T621 A682 S683 R689 R690	T621-A686 HydrophobicContact CG2-CB 3.74Å; A682-A686 WeakPolarHBondContact O-CB 3.18Å; A682-A686 PolarHBondContact O-N 3.49Å; S683-A686 PolarHBondContact O-N 3.26Å; A686-R689 PolarHBondContact O-N 3.46Å; A686-R690 WeakPolarHBondContact O-CG 3.38Å; A686-R690 PolarHBondContact O-N 2.94Å; A686-R690 PolarHBondContact O-NH1 2.93Å
687	S	95.9	Very high	93.5	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.007	19%	0.186	C	C	.	.	H	α-helix	trans	-71.5	-38.5	175.4	57.7	0	0	0	0	111.3	D665 S683 T684 R689 R690 V691	D665-S687 WeakPolarHBondContact OD2-CB 3.43Å; D665-S687 PolarHBondContact OD2-OG 3.36Å; S683-S687 PolarHBondContact O-N 2.94Å; S683-S687 PolarHBondContact O-OG 2.78Å; T684-S687 PolarHBondContact O-OG 3.31Å; S687-R689 PolarHBondContact O-N 3.38Å; S687-R690 PolarHBondContact O-N 3.37Å; S687-V691 WeakPolarHBondContact O-CG2 3.31Å; S687-V691 PolarHBondContact O-N 2.87Å; S687-V691 VanDerWaalsContact O-N 3.08Å
688	L	95.6	Very high	93.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.6	-36.6	171.7	-173	60.2	0	0	0	112.7	F662 T684 R690 V691 E692 L712 L727 L730 A731 T734	F662-L688 HydrophobicContact CD2-CB 4.14Å; F662-L688 HydrophobicContact CD2-CD1 4.48Å; F662-L688 HydrophobicContact CE1-CD1 4.34Å; F662-L688 HydrophobicContact CE2-CB 3.81Å; F662-L688 HydrophobicContact CE2-CD1 3.79Å; F662-L688 HydrophobicContact CE2-CG 4.26Å; F662-L688 HydrophobicContact CZ-CD1 3.71Å; T684-L688 PolarHBondContact O-N 3.49Å; T684-L688 VanDerWaalsContact O-N 3.11Å; L688-R690 VanDerWaalsContact C-N 3.32Å; L688-R690 PolarHBondContact O-N 2.9Å; L688-V691 HydrophobicContact CD1-CB 4.46Å; L688-V691 HydrophobicContact CD1-CG1 4.47Å; L688-V691 PolarHBondContact O-N 3.23Å; L688-E692 PolarHBondContact O-N 2.75Å; L688-L712 HydrophobicContact CD2-CD1 4.11Å; L688-L727 HydrophobicContact CD2-CD1 3.7Å; L688-L730 HydrophobicContact CB-CD2 3.87Å; L688-L730 HydrophobicContact CD2-CB 4.2Å; L688-L730 HydrophobicContact CD2-CD2 3.89Å; L688-L730 HydrophobicContact CD2-CG 3.93Å; L688-L730 HydrophobicContact CG-CD2 3.7Å; L688-L730 HydrophobicContact CG-CG 3.86Å; L688-A731 HydrophobicContact CD2-CB 4.12Å; L688-T734 HydrophobicContact CD1-CG2 4.21Å
689	R	95.8	Very high	93.7	Very high	47 Å²	47	28 Å²	28	18%	0.177	15%	0.147	C	C	.	.	H	α-helix	trans	-60.5	-42.3	176.3	-81.1	-175.4	177	124.2	3.9	111.9	T621 E623 L626 L685 A686 S687 E692 A693 L730	T621-R689 WeakPolarHBondContact O-CD 3.41Å; E623-R689 HydrophobicContact CG-CG 4.09Å; E623-R689 IonicContact OE1-CZ 2.83Å; E623-R689 IonicContact OE1-NE 3.45Å; E623-R689 PolarHBondContact OE1-NE 3.17Å; E623-R689 IonicContact OE1-NH2 3.68Å; L626-R689 HydrophobicContact CD1-CB 3.97Å; L685-R689 WeakPolarHBondContact O-CG 3.16Å; L685-R689 PolarHBondContact O-N 2.92Å; A686-R689 PolarHBondContact O-N 3.46Å; S687-R689 PolarHBondContact O-N 3.38Å; R689-E692 PolarHBondContact O-N 2.88Å; R689-A693 WeakPolarHBondContact O-CB 3.35Å; R689-A693 PolarHBondContact O-N 3.35Å; R689-L730 HydrophobicContact CB-CD2 4.24Å; R689-L730 HydrophobicContact CG-CD1 4.21Å; R689-L730 HydrophobicContact CG-CD2 3.47Å; R689-L730 VanDerWaalsContact CG-CD2 3.47Å
690	R	96.5	Very high	93.8	Very high	41 Å²	41	20.1 Å²	20.1	16%	0.155	11%	0.11	C	C	.	.	H	α-helix	trans	-65.2	-40.5	175.6	-68.5	-179	-169.7	93.2	-10.9	111.9	F617 A618 H620 L626 T658 A686 S687 L688 L694	F617-R690 HydrophobicContact CE1-CB 3.72Å; F617-R690 HydrophobicContact CE1-CG 3.91Å; F617-R690 HydrophobicContact CZ-CB 3.63Å; F617-R690 HydrophobicContact CZ-CG 3.94Å; F617-R690 WeakPolarHBondContact O-CD 3.35Å; F617-R690 PolarHBondContact O-NE 3.25Å; A618-R690 PolarHBondContact O-NH2 3.15Å; H620-R690 PolarHBondContact O-NH2 3.08Å; L626-R690 HydrophobicContact CD1-CG 3.79Å; L626-R690 HydrophobicContact CD2-CG 3.88Å; L626-R690 HydrophobicContact CG-CG 4.48Å; T658-R690 HydrophobicContact CG2-CB 3.5Å; T658-R690 VanDerWaalsContact CG2-CB 3.5Å; A686-R690 WeakPolarHBondContact O-CG 3.38Å; A686-R690 PolarHBondContact O-N 2.94Å; A686-R690 PolarHBondContact O-NH1 2.93Å; S687-R690 PolarHBondContact O-N 3.37Å; L688-R690 VanDerWaalsContact C-N 3.32Å; L688-R690 PolarHBondContact O-N 2.9Å; R690-L694 WeakPolarHBondContact O-CG 3.2Å; R690-L694 PolarHBondContact O-N 3.04Å
691	V	96.4	Very high	93.7	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-61.9	-44.8	174.3	168.3	0	0	0	0	111.6	T658 F662 S687 L688 L694 Y695 I705 T734	T658-V691 HydrophobicContact CG2-CG2 3.94Å; F662-V691 HydrophobicContact CB-CG2 3.94Å; F662-V691 HydrophobicContact CD1-CG2 4.15Å; F662-V691 HydrophobicContact CG-CG2 4.05Å; S687-V691 WeakPolarHBondContact O-CG2 3.31Å; S687-V691 PolarHBondContact O-N 2.87Å; S687-V691 VanDerWaalsContact O-N 3.08Å; L688-V691 HydrophobicContact CD1-CB 4.46Å; L688-V691 HydrophobicContact CD1-CG1 4.47Å; L688-V691 PolarHBondContact O-N 3.23Å; V691-L694 PolarHBondContact O-N 2.83Å; V691-Y695 HydrophobicContact CG1-CD2 3.87Å; V691-Y695 HydrophobicContact CG1-CE2 4.02Å; V691-Y695 WeakPolarHBondContact O-CD2 3.39Å; V691-Y695 PolarHBondContact O-N 2.87Å; V691-I705 HydrophobicContact CG1-CD1 3.96Å; V691-I705 HydrophobicContact CG1-CG2 3.95Å; V691-T734 HydrophobicContact CG1-CG2 3.99Å
692	E	94.7	Very high	93.7	Very high	6 Å²	6	25 Å²	25	3%	0.028	13%	0.133	C	C	.	.	H	α-helix	trans	-64.1	-48.6	178.6	-164.7	-84.2	163.6	0	0	111.3	L688 R689 L694 Y695 Q696 L730 R733 T734 W737	L688-E692 PolarHBondContact O-N 2.75Å; R689-E692 PolarHBondContact O-N 2.88Å; E692-L694 VanDerWaalsContact C-N 3.3Å; E692-L694 PolarHBondContact O-N 2.87Å; E692-Y695 WeakPolarHBondContact O-CB 3.44Å; E692-Y695 PolarHBondContact O-N 2.84Å; E692-Q696 PolarHBondContact O-N 3.39Å; E692-Q696 VanDerWaalsContact O-N 3.12Å; E692-Q696 PolarHBondContact OE1-NE2 3.35Å; E692-Q696 PolarHBondContact OE2-NE2 3.46Å; E692-L730 HydrophobicContact CB-CD1 3.8Å; E692-L730 HydrophobicContact CG-CD1 3.87Å; E692-R733 HydrophobicContact CG-CB 3.98Å; E692-R733 IonicContact OE1-NH1 3.09Å; E692-R733 IonicContact OE2-NH1 2.73Å; E692-T734 WeakPolarHBondContact CB-OG1 3.43Å; E692-W737 PolarHBondContact OE1-NE1 2.93Å
693	A	94	Very high	93.7	Very high	2 Å²	2	25.2 Å²	25.2	2%	0.017	12%	0.122	C	C	.	.	H	α-helix	trans	-58.3	-39.1	176.9	0	0	0	0	0	112.7	F617 L626 S630 R689 Q696	F617-A693 HydrophobicContact CE2-CB 4.47Å; L626-A693 HydrophobicContact CB-CB 3.77Å; S630-A693 WeakPolarHBondContact CB-O 3.41Å; S630-A693 PolarHBondContact OG-O 2.86Å; R689-A693 WeakPolarHBondContact O-CB 3.35Å; R689-A693 PolarHBondContact O-N 3.35Å; A693-Q696 PolarHBondContact O-N 3.44Å
694	L	95.4	Very high	93.7	Very high	3 Å²	3	30 Å²	30	2%	0.016	14%	0.138	C	C	.	.	H	α-helix	trans	-63.5	-45.9	172.9	-74.8	166.2	0	0	0	111.5	F617 S630 I655 T658 R690 V691 E692 Q696 C697 H698 L700	F617-L694 HydrophobicContact CE1-CD1 4.07Å; F617-L694 HydrophobicContact CE1-CG 4.26Å; F617-L694 HydrophobicContact CZ-CD1 3.97Å; F617-L694 HydrophobicContact CZ-CD2 4.13Å; F617-L694 HydrophobicContact CZ-CG 3.7Å; S630-L694 WeakPolarHBondContact OG-CA 3.08Å; I655-L694 HydrophobicContact CG1-CD1 4.15Å; I655-L694 HydrophobicContact CG1-CD2 4.1Å; T658-L694 HydrophobicContact CG2-CD1 3.93Å; R690-L694 WeakPolarHBondContact O-CG 3.2Å; R690-L694 PolarHBondContact O-N 3.04Å; V691-L694 PolarHBondContact O-N 2.83Å; E692-L694 VanDerWaalsContact C-N 3.3Å; E692-L694 PolarHBondContact O-N 2.87Å; L694-Q696 PolarHBondContact O-N 2.96Å; L694-C697 PolarHBondContact O-N 3.04Å; L694-C697 VanDerWaalsContact O-N 3.13Å; L694-H698 WeakPolarHBondContact O-CB 3.42Å; L694-H698 PolarHBondContact O-CD2 3.03Å; L694-H698 PolarHBondContact O-N 2.87Å; L694-L700 HydrophobicContact CB-CD1 4.01Å; L694-L700 HydrophobicContact CB-CD2 3.88Å; L694-L700 HydrophobicContact CD1-CD2 4.31Å
695	Y	94	Very high	93.8	Very high	2 Å²	2	30 Å²	30	1%	0.008	14%	0.138	C	C	.	.	H	α-helix	trans	-61.4	-25.6	179.4	-99.4	-59.2	0	0	0	114.5	V691 E692 C697 L700 I705 T734 W737 I738 W741	V691-Y695 HydrophobicContact CG1-CD2 3.87Å; V691-Y695 HydrophobicContact CG1-CE2 4.02Å; V691-Y695 WeakPolarHBondContact O-CD2 3.39Å; V691-Y695 PolarHBondContact O-N 2.87Å; E692-Y695 WeakPolarHBondContact O-CB 3.44Å; E692-Y695 PolarHBondContact O-N 2.84Å; Y695-C697 PolarHBondContact O-N 2.95Å; Y695-L700 HydrophobicContact CD1-CB 3.98Å; Y695-L700 HydrophobicContact CD2-CB 4.27Å; Y695-L700 HydrophobicContact CD2-CD2 4.28Å; Y695-L700 HydrophobicContact CE1-CB 3.49Å; Y695-L700 VanDerWaalsContact CE1-CB 3.49Å; Y695-L700 HydrophobicContact CE2-CB 3.8Å; Y695-L700 HydrophobicContact CE2-CD2 4.3Å; Y695-L700 HydrophobicContact CG-CB 4.35Å; Y695-L700 PolarHBondContact OH-O 3.18Å; Y695-I705 HydrophobicContact CE2-CB 4.1Å; Y695-I705 HydrophobicContact CE2-CD1 3.66Å; Y695-I705 HydrophobicContact CE2-CG1 4.43Å; Y695-I705 HydrophobicContact CE2-CG2 4.14Å; Y695-T734 HydrophobicContact CD2-CG2 3.95Å; Y695-T734 HydrophobicContact CE2-CG2 4.16Å; Y695-W737 HydrophobicContact CD1-CB 4.3Å; Y695-W737 HydrophobicContact CG-CB 4.16Å; Y695-I738 HydrophobicContact CD2-CG1 4.46Å; Y695-I738 HydrophobicContact CE1-CG1 3.87Å; Y695-I738 HydrophobicContact CE2-CD1 4.16Å; Y695-I738 HydrophobicContact CE2-CG1 3.73Å; Y695-I738 VanDerWaalsContact CZ-CG1 3.4Å; Y695-I738 WeakPolarHBondContact OH-CG1 3.3Å; Y695-W741 AromaticContact CD1-CD1 3.58Å; Y695-W741 HydrophobicContact CD1-CG 4.5Å; Y695-W741 AromaticContact CD1-NE1 3.98Å; Y695-W741 PolarHBondContact O-NE1 3.37Å
696	Q	90.9	Very high	93.8	Very high	16 Å²	16	29.9 Å²	29.9	8%	0.075	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-26.3	175	-64.2	177.4	12	0	0	113.3	E692 A693 L694 W737 L1091	E692-Q696 PolarHBondContact O-N 3.39Å; E692-Q696 VanDerWaalsContact O-N 3.12Å; E692-Q696 PolarHBondContact OE1-NE2 3.35Å; E692-Q696 PolarHBondContact OE2-NE2 3.46Å; A693-Q696 PolarHBondContact O-N 3.44Å; L694-Q696 PolarHBondContact O-N 2.96Å; Q696-W737 HydrophobicContact CB-CZ2 4.35Å; Q696-W737 HydrophobicContact CG-CZ2 3.81Å; Q696-L1091 VanDerWaalsContact OE1-CD2 3.26Å
697	C	90.8	Very high	93.8	Very high	9 Å²	9	34.1 Å²	34.1	6%	0.061	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.8	-16.5	-173	-62.8	0	0	0	0	114.9	E634 L694 Y695	E634-C697 HydrophobicContact CB-CB 4.09Å; E634-C697 HydrophobicContact CG-CB 4.26Å; L694-C697 PolarHBondContact O-N 3.04Å; L694-C697 VanDerWaalsContact O-N 3.13Å; Y695-C697 PolarHBondContact O-N 2.95Å
698	H	92.1	Very high	93.7	Very high	6 Å²	6	34.9 Å²	34.9	3%	0.028	16%	0.162	C	C	.	.	S	Bend	trans	-134.2	143.7	-171.1	-53.1	-78.8	0	0	0	112.5	S630 R651 I655 L694 L700 W741	S630-H698 PolarHBondContact O-NE2 2.99Å; S630-H698 PolarHBondContact OG-CD2 3.14Å; R651-H698 VanDerWaalsContact CD-ND1 3.25Å; R651-H698 WeakPolarHBondContact CD-ND1 3.36Å; I655-H698 HydrophobicContact CD1-CB 4.37Å; L694-H698 WeakPolarHBondContact O-CB 3.42Å; L694-H698 PolarHBondContact O-CD2 3.03Å; L694-H698 PolarHBondContact O-N 2.87Å; H698-L700 HydrophobicContact CB-CD1 3.81Å; H698-L700 WeakPolarHBondContact O-CD1 3.38Å; H698-L700 PolarHBondContact O-N 3.16Å; H698-W741 VanDerWaalsContact C-CZ2 3.4Å; H698-W741 PolarHBondContact O-NE1 2.95Å
699	D	91.1	Very high	93.6	Very high	69 Å²	69	34.9 Å²	34.9	37%	0.369	16%	0.162	S	C	.	.			trans	-75.2	110.5	174.9	178.5	16.2	0	0	0	111.7	S701 W741	D699-S701 WeakPolarHBondContact OD1-CB 3.24Å; D699-S701 PolarHBondContact OD1-N 2.83Å; D699-S701 PolarHBondContact OD1-OG 3.44Å; D699-W741 HydrophobicContact CB-CD2 4Å; D699-W741 HydrophobicContact CB-CE3 3.55Å; D699-W741 HydrophobicContact CB-CH2 4.31Å; D699-W741 HydrophobicContact CB-CZ3 3.73Å
700	L	94.3	Very high	93.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.155	C	C	.	.			trans	-106.3	16.7	176.3	-84.8	68.7	0	0	0	113	I655 V659 L694 Y695 H698 K702 W703 I705	I655-L700 HydrophobicContact CD1-CD1 3.93Å; I655-L700 HydrophobicContact CG1-CD1 4.15Å; I655-L700 HydrophobicContact CG2-CD1 4.21Å; I655-L700 HydrophobicContact CG2-CD2 4.02Å; I655-L700 HydrophobicContact CG2-CG 3.71Å; V659-L700 HydrophobicContact CG2-CD2 4.19Å; L694-L700 HydrophobicContact CB-CD1 4.01Å; L694-L700 HydrophobicContact CB-CD2 3.88Å; L694-L700 HydrophobicContact CD1-CD2 4.31Å; Y695-L700 HydrophobicContact CD1-CB 3.98Å; Y695-L700 HydrophobicContact CD2-CB 4.27Å; Y695-L700 HydrophobicContact CD2-CD2 4.28Å; Y695-L700 HydrophobicContact CE1-CB 3.49Å; Y695-L700 VanDerWaalsContact CE1-CB 3.49Å; Y695-L700 HydrophobicContact CE2-CB 3.8Å; Y695-L700 HydrophobicContact CE2-CD2 4.3Å; Y695-L700 HydrophobicContact CG-CB 4.35Å; Y695-L700 PolarHBondContact OH-O 3.18Å; H698-L700 HydrophobicContact CB-CD1 3.81Å; H698-L700 WeakPolarHBondContact O-CD1 3.38Å; H698-L700 PolarHBondContact O-N 3.16Å; L700-K702 VanDerWaalsContact C-N 3.27Å; L700-K702 PolarHBondContact O-N 2.84Å; L700-W703 HydrophobicContact CB-CE3 4.18Å; L700-W703 HydrophobicContact CG-CE3 4.31Å; L700-W703 HydrophobicContact CG-CZ3 4.44Å; L700-W703 PolarHBondContact O-N 3.22Å; L700-I705 HydrophobicContact CB-CD1 4.08Å; L700-I705 HydrophobicContact CD2-CD1 3.96Å
701	S	90	Very high	93.5	Very high	30 Å²	30	32.6 Å²	32.6	21%	0.21	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-60.4	-32.3	-174.3	-53.1	0	0	0	0	113.8	D699 W703 K704	D699-S701 WeakPolarHBondContact OD1-CB 3.24Å; D699-S701 PolarHBondContact OD1-N 2.83Å; D699-S701 PolarHBondContact OD1-OG 3.44Å; S701-W703 PolarHBondContact O-N 3.04Å; S701-W703 VanDerWaalsContact O-N 3.11Å; S701-K704 PolarHBondContact O-N 3.36Å
702	K	91.1	Very high	93.3	Very high	176 Å²	176	32.6 Å²	32.6	77%	0.765	16%	0.157	S	C	*	.	G	3₁₀ helix	trans	-57.1	-27.9	179.5	-63.9	179.9	-178.4	175.4	0	114.1	L700	L700-K702 VanDerWaalsContact C-N 3.27Å; L700-K702 PolarHBondContact O-N 2.84Å
703	W	93.9	Very high	93.2	Very high	57 Å²	57	32.6 Å²	32.6	22%	0.216	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-90.9	-1.6	-172.2	-68.6	-94.3	0	0	0	114.5	I655 D656 V659 R663 L700 S701 I705	I655-W703 HydrophobicContact CB-CH2 4.34Å; I655-W703 HydrophobicContact CB-CZ2 4.31Å; I655-W703 HydrophobicContact CG2-CD2 4.01Å; I655-W703 HydrophobicContact CG2-CE3 4Å; I655-W703 HydrophobicContact CG2-CH2 3.52Å; I655-W703 HydrophobicContact CG2-CZ2 3.5Å; I655-W703 VanDerWaalsContact CG2-CZ2 3.5Å; I655-W703 HydrophobicContact CG2-CZ3 3.77Å; D656-W703 WeakPolarHBondContact OD1-CZ2 3.48Å; D656-W703 PolarHBondContact OD1-NE1 3.11Å; V659-W703 HydrophobicContact CB-CG 4.38Å; V659-W703 HydrophobicContact CG1-CB 3.81Å; V659-W703 HydrophobicContact CG1-CG 3.92Å; V659-W703 HydrophobicContact CG2-CB 4.41Å; V659-W703 HydrophobicContact CG2-CG 4.21Å; R663-W703 PolarHBondContact NH2-O 3.47Å; L700-W703 HydrophobicContact CB-CE3 4.18Å; L700-W703 HydrophobicContact CG-CE3 4.31Å; L700-W703 HydrophobicContact CG-CZ3 4.44Å; L700-W703 PolarHBondContact O-N 3.22Å; S701-W703 PolarHBondContact O-N 3.04Å; S701-W703 VanDerWaalsContact O-N 3.11Å; W703-I705 HydrophobicContact CB-CD1 4.19Å; W703-I705 HydrophobicContact CB-CG1 4.01Å; W703-I705 PolarHBondContact O-N 2.82Å
704	K	92.5	Very high	93.1	Very high	141 Å²	141	39.6 Å²	39.6	61%	0.613	18%	0.183	S	C	*	.			trans	52.9	49.7	175.9	-56.7	-173.4	178.6	-171.8	0	113.4	S701 W706	S701-K704 PolarHBondContact O-N 3.36Å; K704-W706 VanDerWaalsContact C-N 3.27Å; K704-W706 PolarHBondContact O-N 3.37Å
705	I	95.3	Very high	92.7	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-23.3	-172.9	-64.1	174	0	0	0	112.6	V659 F662 V691 Y695 L700 W703 D707 M708 A709 T734 I738	V659-I705 HydrophobicContact CG1-CD1 4.42Å; V659-I705 HydrophobicContact CG1-CG1 4.48Å; V659-I705 HydrophobicContact CG2-CD1 3.73Å; F662-I705 HydrophobicContact CE1-CG2 4.07Å; V691-I705 HydrophobicContact CG1-CD1 3.96Å; V691-I705 HydrophobicContact CG1-CG2 3.95Å; Y695-I705 HydrophobicContact CE2-CB 4.1Å; Y695-I705 HydrophobicContact CE2-CD1 3.66Å; Y695-I705 HydrophobicContact CE2-CG1 4.43Å; Y695-I705 HydrophobicContact CE2-CG2 4.14Å; L700-I705 HydrophobicContact CB-CD1 4.08Å; L700-I705 HydrophobicContact CD2-CD1 3.96Å; W703-I705 HydrophobicContact CB-CD1 4.19Å; W703-I705 HydrophobicContact CB-CG1 4.01Å; W703-I705 PolarHBondContact O-N 2.82Å; I705-D707 VanDerWaalsContact C-N 3.27Å; I705-D707 PolarHBondContact O-N 2.98Å; I705-M708 HydrophobicContact CB-CE 4.35Å; I705-M708 HydrophobicContact CG1-CE 4.05Å; I705-M708 HydrophobicContact CG2-CE 4.5Å; I705-M708 PolarHBondContact O-N 2.92Å; I705-A709 HydrophobicContact CG2-CB 4.4Å; I705-A709 PolarHBondContact O-N 3.14Å; I705-T734 HydrophobicContact CG2-CG2 4.38Å; I705-I738 HydrophobicContact CB-CD1 4.28Å; I705-I738 HydrophobicContact CG2-CD1 4.26Å
706	W	95.6	Very high	92.2	Very high	11 Å²	11	44.1 Å²	44.1	4%	0.042	21%	0.21	C	C	.	.	H	α-helix	trans	-46	-48.7	175	-177.4	-91.1	0	0	0	113.1	K704 M708 A709 F710 C735 I738 L739 R762 L766	K704-W706 VanDerWaalsContact C-N 3.27Å; K704-W706 PolarHBondContact O-N 3.37Å; W706-M708 PolarHBondContact O-N 2.74Å; W706-M708 VanDerWaalsContact O-N 3.1Å; W706-A709 PolarHBondContact O-N 3.06Å; W706-F710 HydrophobicContact CD2-CB 4.15Å; W706-F710 AromaticContact CE2-CG 3.79Å; W706-F710 HydrophobicContact CG-CB 4.45Å; W706-F710 HydrophobicContact CH2-CD2 4.14Å; W706-F710 HydrophobicContact CH2-CG 4.37Å; W706-F710 HydrophobicContact CZ2-CB 4.1Å; W706-F710 AromaticContact CZ2-CD1 3.94Å; W706-F710 HydrophobicContact CZ2-CD1 3.94Å; W706-F710 AromaticContact CZ2-CD2 3.82Å; W706-F710 HydrophobicContact CZ2-CD2 3.82Å; W706-F710 HydrophobicContact CZ2-CE1 4.37Å; W706-F710 HydrophobicContact CZ2-CE2 4.3Å; W706-F710 AromaticContact CZ2-CG 3.66Å; W706-F710 HydrophobicContact CZ2-CG 3.66Å; W706-F710 AromaticContact NE1-CD1 3.87Å; W706-F710 AromaticContact NE1-CG 3.99Å; W706-F710 VanDerWaalsContact O-CB 3.29Å; W706-F710 WeakPolarHBondContact O-CB 3.4Å; W706-F710 PolarHBondContact O-N 2.91Å; W706-C735 HydrophobicContact CE3-CB 4.38Å; W706-C735 HydrophobicContact CH2-CB 4.49Å; W706-C735 HydrophobicContact CZ3-CB 3.86Å; W706-I738 HydrophobicContact CB-CD1 4.43Å; W706-I738 HydrophobicContact CB-CG2 4.46Å; W706-I738 HydrophobicContact CE3-CB 4.33Å; W706-I738 HydrophobicContact CE3-CD1 4.44Å; W706-I738 HydrophobicContact CE3-CG2 3.93Å; W706-L739 HydrophobicContact CH2-CD2 4.26Å; W706-L739 HydrophobicContact CZ3-CD2 3.93Å; W706-L739 HydrophobicContact CZ3-CG 4.06Å; W706-R762 HydrophobicContact CD2-CB 4.35Å; W706-R762 HydrophobicContact CD2-CG 3.92Å; W706-R762 HydrophobicContact CE3-CB 4.42Å; W706-R762 HydrophobicContact CE3-CG 4.4Å; W706-R762 HydrophobicContact CG-CG 4.39Å; W706-R762 HydrophobicContact CH2-CB 3.62Å; W706-R762 HydrophobicContact CH2-CG 4.22Å; W706-R762 WeakPolarHBondContact CH2-O 3.49Å; W706-R762 HydrophobicContact CZ2-CB 3.54Å; W706-R762 HydrophobicContact CZ2-CG 3.74Å; W706-R762 HydrophobicContact CZ3-CB 4.08Å; W706-L766 HydrophobicContact CH2-CB 4.08Å
707	D	93.6	Very high	91.6	Very high	99 Å²	99	50.7 Å²	50.7	53%	0.529	25%	0.246	S	C	.	.	H	α-helix	trans	-68.1	-13.8	-174	-52.9	-29.8	0	0	0	112.8	I705 P711	I705-D707 VanDerWaalsContact C-N 3.27Å; I705-D707 PolarHBondContact O-N 2.98Å; D707-P711 WeakPolarHBondContact O-CG 3.41Å
708	M	93.9	Very high	90.8	Very high	17 Å²	17	54 Å²	54	8%	0.084	27%	0.274	C	S	.	.	H	α-helix	trans	-101.7	-40.7	175.7	-60.7	-178.4	-67.9	0	0	111.9	F662 R663 M666 I705 W706	F662-M708 HydrophobicContact CD1-CE 4.09Å; F662-M708 HydrophobicContact CE1-CB 3.77Å; F662-M708 HydrophobicContact CE1-CE 4.2Å; F662-M708 HydrophobicContact CZ-CB 4.29Å; R663-M708 HydrophobicContact CB-SD 3.86Å; R663-M708 HydrophobicContact CG-SD 3.88Å; R663-M708 PolarHBondContact NH1-SD 2.62Å; R663-M708 VanDerWaalsContact NH1-SD 3.39Å; M666-M708 VanDerWaalsContact CE-O 3.24Å; M666-M708 WeakPolarHBondContact CE-O 3.25Å; M666-M708 HydrophobicContact CG-CB 4.48Å; I705-M708 HydrophobicContact CB-CE 4.35Å; I705-M708 HydrophobicContact CG1-CE 4.05Å; I705-M708 HydrophobicContact CG2-CE 4.5Å; I705-M708 PolarHBondContact O-N 2.92Å; W706-M708 PolarHBondContact O-N 2.74Å; W706-M708 VanDerWaalsContact O-N 3.1Å
709	A	94.8	Very high	90.1	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-81.1	-44	-176.1	0	0	0	0	0	113.4	I705 W706 L712 T734	I705-A709 HydrophobicContact CG2-CB 4.4Å; I705-A709 PolarHBondContact O-N 3.14Å; W706-A709 PolarHBondContact O-N 3.06Å; A709-L712 WeakPolarHBondContact O-CB 3.37Å; A709-L712 PolarHBondContact O-N 3.34Å; A709-T734 HydrophobicContact CB-CG2 4.38Å
710	F	95.6	Very high	88.7	Confident	9 Å²	9	53.9 Å²	53.9	4%	0.039	28%	0.278	C	S	.	.	H	α-helix	trans	-62.2	-36.1	-174.7	-176.4	-118.1	0	0	0	114.7	W706 L712 I713 R714 E765 L766	W706-F710 HydrophobicContact CD2-CB 4.15Å; W706-F710 AromaticContact CE2-CG 3.79Å; W706-F710 HydrophobicContact CG-CB 4.45Å; W706-F710 HydrophobicContact CH2-CD2 4.14Å; W706-F710 HydrophobicContact CH2-CG 4.37Å; W706-F710 HydrophobicContact CZ2-CB 4.1Å; W706-F710 AromaticContact CZ2-CD1 3.94Å; W706-F710 HydrophobicContact CZ2-CD1 3.94Å; W706-F710 AromaticContact CZ2-CD2 3.82Å; W706-F710 HydrophobicContact CZ2-CD2 3.82Å; W706-F710 HydrophobicContact CZ2-CE1 4.37Å; W706-F710 HydrophobicContact CZ2-CE2 4.3Å; W706-F710 AromaticContact CZ2-CG 3.66Å; W706-F710 HydrophobicContact CZ2-CG 3.66Å; W706-F710 AromaticContact NE1-CD1 3.87Å; W706-F710 AromaticContact NE1-CG 3.99Å; W706-F710 VanDerWaalsContact O-CB 3.29Å; W706-F710 WeakPolarHBondContact O-CB 3.4Å; W706-F710 PolarHBondContact O-N 2.91Å; F710-L712 PolarHBondContact O-N 3.48Å; F710-I713 HydrophobicContact CD2-CD1 4.17Å; F710-I713 PolarHBondContact O-N 2.88Å; F710-R714 HydrophobicContact CD1-CB 4.48Å; F710-R714 HydrophobicContact CE1-CB 3.99Å; F710-R714 HydrophobicContact CE1-CG 4.36Å; F710-R714 HydrophobicContact CE2-CB 4.48Å; F710-R714 HydrophobicContact CZ-CB 3.94Å; F710-R714 HydrophobicContact CZ-CG 4.44Å; F710-R714 PolarHBondContact O-N 3.24Å; F710-E765 HydrophobicContact CE1-CB 3.8Å; F710-E765 HydrophobicContact CE1-CG 4.39Å; F710-E765 WeakPolarHBondContact CE1-OE2 3.49Å; F710-E765 HydrophobicContact CE2-CB 4.4Å; F710-E765 HydrophobicContact CZ-CB 3.59Å; F710-L766 HydrophobicContact CE2-CD1 4.45Å
711	P	93.1	Very high	87.3	Confident	31 Å²	31	62.3 Å²	62.3	20%	0.201	31%	0.31	C	S	.	.	H	α-helix	trans	-56.7	-30	174.2	-28.5	37.1	0	0	0	114.9	D707 I713 N715	D707-P711 WeakPolarHBondContact O-CG 3.41Å; P711-I713 PolarHBondContact O-N 3.44Å; P711-N715 WeakPolarHBondContact O-CB 3.37Å; P711-N715 PolarHBondContact O-N 3.43Å
712	L	92.4	Very high	86.3	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-62.8	-29.6	176.8	-61.2	169.9	0	0	0	112.2	M666 F669 L688 A709 F710 I723 L727 A731	M666-L712 HydrophobicContact CE-CD1 4.27Å; M666-L712 HydrophobicContact CE-CD2 3.75Å; M666-L712 HydrophobicContact CE-CG 3.99Å; M666-L712 HydrophobicContact SD-CD1 3.96Å; M666-L712 HydrophobicContact SD-CD2 4.03Å; M666-L712 HydrophobicContact SD-CG 4.29Å; F669-L712 HydrophobicContact CD1-CD2 4.19Å; F669-L712 HydrophobicContact CE1-CD2 3.87Å; L688-L712 HydrophobicContact CD2-CD1 4.11Å; A709-L712 WeakPolarHBondContact O-CB 3.37Å; A709-L712 PolarHBondContact O-N 3.34Å; F710-L712 PolarHBondContact O-N 3.48Å; L712-I723 HydrophobicContact CB-CD1 4.27Å; L712-I723 HydrophobicContact CD2-CD1 3.78Å; L712-L727 HydrophobicContact CD1-CD1 4.11Å; L712-L727 HydrophobicContact CD1-CG 4.23Å; L712-L727 HydrophobicContact CD2-CD2 4.19Å; L712-L727 HydrophobicContact CD2-CG 4.42Å; L712-A731 HydrophobicContact CB-CB 3.98Å; L712-A731 HydrophobicContact CD1-CB 4.01Å
713	I	93.2	Very high	85.7	Confident	6 Å²	6	59.4 Å²	59.4	3%	0.031	31%	0.307	C	S	.	.	H	α-helix	trans	-85.7	-53.9	177.4	-45.2	174	0	0	0	109.7	F710 P711 N715 S716 A731 C735 L766 C769 M773	F710-I713 HydrophobicContact CD2-CD1 4.17Å; F710-I713 PolarHBondContact O-N 2.88Å; P711-I713 PolarHBondContact O-N 3.44Å; I713-N715 PolarHBondContact O-N 3.35Å; I713-S716 PolarHBondContact O-OG 3.27Å; I713-S716 VanDerWaalsContact O-OG 3.14Å; I713-A731 HydrophobicContact CD1-CB 4.3Å; I713-A731 HydrophobicContact CG1-CB 3.83Å; I713-C735 HydrophobicContact CD1-CB 4.15Å; I713-L766 HydrophobicContact CD1-CD1 3.85Å; I713-C769 HydrophobicContact CG2-CB 3.69Å; I713-M773 HydrophobicContact CG2-SD 3.63Å
714	R	92	Very high	85.3	Confident	148 Å²	148	59.2 Å²	59.2	56%	0.558	31%	0.31	S	S	*	.	H	α-helix	trans	-66.8	-36.8	-171.8	179.8	179.6	172.7	162.1	2.3	113.6	F710 E765	F710-R714 HydrophobicContact CD1-CB 4.48Å; F710-R714 HydrophobicContact CE1-CB 3.99Å; F710-R714 HydrophobicContact CE1-CG 4.36Å; F710-R714 HydrophobicContact CE2-CB 4.48Å; F710-R714 HydrophobicContact CZ-CB 3.94Å; F710-R714 HydrophobicContact CZ-CG 4.44Å; F710-R714 PolarHBondContact O-N 3.24Å; R714-E765 IonicContact NH1-OE1 3.21Å
715	N	86.6	Confident	85.1	Confident	71 Å²	71	55.4 Å²	55.4	38%	0.38	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	21.1	-173.8	-57	-28.6	0	0	0	111.9	P711 I713 D717 A718 Y719	P711-N715 WeakPolarHBondContact O-CB 3.37Å; P711-N715 PolarHBondContact O-N 3.43Å; I713-N715 PolarHBondContact O-N 3.35Å; N715-D717 PolarHBondContact O-N 3.43Å; N715-D717 VanDerWaalsContact O-N 3.17Å; N715-A718 HydrophobicContact CB-CB 4.17Å; N715-A718 WeakPolarHBondContact O-CB 3.15Å; N715-A718 PolarHBondContact O-N 2.78Å; N715-Y719 HydrophobicContact CB-CE2 4.25Å; N715-Y719 WeakPolarHBondContact O-CD2 3.33Å; N715-Y719 WeakPolarHBondContact O-CE2 3.48Å
716	S	83.8	Confident	84.9	Confident	29 Å²	29	57.8 Å²	57.8	20%	0.203	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-49.8	-40	-177.9	49.1	0	0	0	0	113.7	I713	I713-S716 PolarHBondContact O-OG 3.27Å; I713-S716 VanDerWaalsContact O-OG 3.14Å
717	D	78	Confident	84.7	Confident	155 Å²	155	57.3 Å²	57.3	83%	0.829	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-77.4	-15.7	176.7	-65.5	-36	0	0	0	114.7	N715	N715-D717 PolarHBondContact O-N 3.43Å; N715-D717 VanDerWaalsContact O-N 3.17Å
718	A	73.7	Confident	84.7	Confident	79 Å²	79	53.2 Å²	53.2	65%	0.653	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-86.7	-14.4	-177.4	0	0	0	0	0	113.1	N715	N715-A718 HydrophobicContact CB-CB 4.17Å; N715-A718 WeakPolarHBondContact O-CB 3.15Å; N715-A718 PolarHBondContact O-N 2.78Å
719	Y	77.7	Confident	84.6	Confident	23 Å²	23	53 Å²	53	9%	0.09	28%	0.284	C	S	.	.	S	Bend	trans	-72.2	147.1	172.9	-67.9	-76.6	0	0	0	110.5	F669 N670 N715 R721 I723	F669-Y719 HydrophobicContact CD1-CE1 4Å; F669-Y719 AromaticContact CE1-CD1 3.88Å; F669-Y719 HydrophobicContact CE1-CD1 3.88Å; F669-Y719 AromaticContact CE1-CE1 3.59Å; F669-Y719 HydrophobicContact CE1-CE1 3.59Å; F669-Y719 HydrophobicContact CE1-CG 4.47Å; F669-Y719 AromaticContact CE1-CZ 3.97Å; N670-Y719 PolarHBondContact OD1-OH 3.05Å; N715-Y719 HydrophobicContact CB-CE2 4.25Å; N715-Y719 WeakPolarHBondContact O-CD2 3.33Å; N715-Y719 WeakPolarHBondContact O-CE2 3.48Å; Y719-R721 CarbonylContact C-O 3.5Å; Y719-R721 CarbonylContact O-C 3.58Å; Y719-R721 PolarHBondContact O-N 3.2Å; Y719-I723 HydrophobicContact CD2-CD1 4.2Å; Y719-I723 HydrophobicContact CE2-CD1 4.29Å
720	A	60.7	Low	84.6	Confident	48 Å²	48	53.1 Å²	53.1	40%	0.397	28%	0.284	S	S	.	.	S	Bend	trans	-80.9	12.3	-166.2	0	0	0	0	0	114.9	L673 K675	L673-A720 PolarHBondContact O-N 3.47Å; K675-A720 HydrophobicContact CD-CB 3.77Å; K675-A720 HydrophobicContact CG-CB 4.04Å
721	R	66.9	Low	84.6	Confident	177 Å²	177	52.7 Å²	52.7	67%	0.668	28%	0.282	S	S	*	.	S	Bend	trans	-141.5	151.8	155.6	-73.2	-178.4	175.5	170.3	-0.7	105.6	Y719 I723	Y719-R721 CarbonylContact C-O 3.5Å; Y719-R721 CarbonylContact O-C 3.58Å; Y719-R721 PolarHBondContact O-N 3.2Å; R721-I723 PolarHBondContact O-N 2.77Å; R721-I723 VanDerWaalsContact O-N 3.1Å
722	P	68.2	Low	84.7	Confident	121 Å²	121	51.2 Å²	51.2	79%	0.786	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-54.6	123.3	167.1	25.2	-33.4	0	0	0	108.1
723	I	78.8	Confident	84.8	Confident	24 Å²	24	54 Å²	54	12%	0.123	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-60.3	146.2	-177.9	-171	167.2	0	0	0	110.3	F669 L712 Y719 R721 H725 L727 V728	F669-I723 HydrophobicContact CE1-CD1 4.09Å; F669-I723 HydrophobicContact CZ-CD1 3.98Å; F669-I723 HydrophobicContact CZ-CG1 4.25Å; L712-I723 HydrophobicContact CB-CD1 4.27Å; L712-I723 HydrophobicContact CD2-CD1 3.78Å; Y719-I723 HydrophobicContact CD2-CD1 4.2Å; Y719-I723 HydrophobicContact CE2-CD1 4.29Å; R721-I723 PolarHBondContact O-N 2.77Å; R721-I723 VanDerWaalsContact O-N 3.1Å; I723-H725 PolarHBondContact O-N 3.27Å; I723-L727 HydrophobicContact CD1-CD2 3.78Å; I723-L727 HydrophobicContact CD1-CG 4.2Å; I723-L727 HydrophobicContact CG1-CB 4.4Å; I723-L727 HydrophobicContact CG1-CD2 3.93Å; I723-L727 HydrophobicContact CG1-CG 4.43Å; I723-V728 HydrophobicContact CG2-CG2 3.4Å
724	D	85.6	Confident	84.9	Confident	54 Å²	54	53.8 Å²	53.8	29%	0.289	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-61.6	134.7	-178.8	-172.1	-88.6	0	0	0	111.5	F681 N726 L727 V728	F681-D724 HydrophobicContact CE1-CB 4.32Å; F681-D724 HydrophobicContact CE2-CB 3.84Å; F681-D724 HydrophobicContact CZ-CB 3.4Å; F681-D724 VanDerWaalsContact CZ-CB 3.4Å; D724-N726 VanDerWaalsContact C-N 3.25Å; D724-N726 PolarHBondContact O-N 2.91Å; D724-N726 WeakPolarHBondContact OD1-CB 3.25Å; D724-N726 PolarHBondContact OD1-N 3.5Å; D724-N726 PolarHBondContact OD1-ND2 2.96Å; D724-L727 WeakPolarHBondContact O-CB 3.42Å; D724-L727 PolarHBondContact O-N 3.1Å; D724-V728 PolarHBondContact O-N 3Å
725	H	87.9	Confident	85.1	Confident	60 Å²	60	46.7 Å²	46.7	28%	0.278	26%	0.256	S	S	.	.	H	α-helix	trans	-57.8	-33.4	-177.4	59.8	-71.2	0	0	0	113.6	I723 L727 V728 V729 E780 V781	I723-H725 PolarHBondContact O-N 3.27Å; H725-L727 VanDerWaalsContact C-N 3.33Å; H725-L727 PolarHBondContact O-N 2.96Å; H725-V728 PolarHBondContact O-N 2.97Å; H725-V729 WeakPolarHBondContact O-CB 3.45Å; H725-V729 VanDerWaalsContact O-CG2 3.3Å; H725-V729 WeakPolarHBondContact O-CG2 3.49Å; H725-V729 PolarHBondContact O-N 3.37Å; H725-E780 IonicContact CD2-OE2 3.25Å; H725-E780 PolarHBondContact CD2-OE2 3Å; H725-E780 IonicContact NE2-OE2 3.72Å; H725-V781 HydrophobicContact CB-CG2 3.7Å
726	N	90	Very high	85.6	Confident	52 Å²	52	44.2 Å²	44.2	28%	0.278	24%	0.241	S	C	.	.	H	α-helix	trans	-63.5	-41.2	176.1	-64	-85.9	0	0	0	111.1	L685 D724 V728 V729 L730	L685-N726 HydrophobicContact CD1-CB 4.17Å; L685-N726 HydrophobicContact CD2-CB 4.44Å; D724-N726 VanDerWaalsContact C-N 3.25Å; D724-N726 PolarHBondContact O-N 2.91Å; D724-N726 WeakPolarHBondContact OD1-CB 3.25Å; D724-N726 PolarHBondContact OD1-N 3.5Å; D724-N726 PolarHBondContact OD1-ND2 2.96Å; N726-V728 VanDerWaalsContact C-N 3.32Å; N726-V728 PolarHBondContact O-N 2.83Å; N726-V729 PolarHBondContact O-N 2.95Å; N726-L730 WeakPolarHBondContact O-CB 3.45Å; N726-L730 PolarHBondContact O-N 3.41Å
727	L	92.2	Very high	86.1	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.2	-37.1	179.8	-171.3	56.9	0	0	0	111	F669 F681 L685 L688 L712 I723 D724 H725 A731	F669-L727 HydrophobicContact CE2-CD2 4.22Å; F669-L727 HydrophobicContact CZ-CD2 3.99Å; F681-L727 HydrophobicContact CE2-CB 4.46Å; F681-L727 HydrophobicContact CE2-CD2 3.9Å; L685-L727 HydrophobicContact CD1-CB 4.3Å; L685-L727 HydrophobicContact CD1-CD1 4.18Å; L688-L727 HydrophobicContact CD2-CD1 3.7Å; L712-L727 HydrophobicContact CD1-CD1 4.11Å; L712-L727 HydrophobicContact CD1-CG 4.23Å; L712-L727 HydrophobicContact CD2-CD2 4.19Å; L712-L727 HydrophobicContact CD2-CG 4.42Å; I723-L727 HydrophobicContact CD1-CD2 3.78Å; I723-L727 HydrophobicContact CD1-CG 4.2Å; I723-L727 HydrophobicContact CG1-CB 4.4Å; I723-L727 HydrophobicContact CG1-CD2 3.93Å; I723-L727 HydrophobicContact CG1-CG 4.43Å; D724-L727 WeakPolarHBondContact O-CB 3.42Å; D724-L727 PolarHBondContact O-N 3.1Å; H725-L727 VanDerWaalsContact C-N 3.33Å; H725-L727 PolarHBondContact O-N 2.96Å; L727-A731 WeakPolarHBondContact O-CB 3.45Å; L727-A731 PolarHBondContact O-N 2.99Å
728	V	92.7	Very high	86.9	Confident	13 Å²	13	37.8 Å²	37.8	8%	0.079	20%	0.201	C	C	.	.	H	α-helix	trans	-70.4	-47.5	174.7	-175.8	0	0	0	0	112.1	I723 D724 H725 N726 L730 A731 T732 M773	I723-V728 HydrophobicContact CG2-CG2 3.4Å; D724-V728 PolarHBondContact O-N 3Å; H725-V728 PolarHBondContact O-N 2.97Å; N726-V728 VanDerWaalsContact C-N 3.32Å; N726-V728 PolarHBondContact O-N 2.83Å; V728-L730 VanDerWaalsContact C-N 3.29Å; V728-L730 PolarHBondContact O-N 2.92Å; V728-A731 PolarHBondContact O-N 3.22Å; V728-T732 WeakPolarHBondContact O-CB 3.43Å; V728-T732 PolarHBondContact O-N 3.24Å; V728-T732 PolarHBondContact O-OG1 3.42Å; V728-M773 HydrophobicContact CG1-CE 3.54Å; V728-M773 HydrophobicContact CG1-SD 4.35Å
729	V	92.8	Very high	87.9	Confident	13 Å²	13	34 Å²	34	8%	0.079	17%	0.17	C	C	.	.	H	α-helix	trans	-56.4	-45.9	176.6	159.9	0	0	0	0	110.7	H725 N726 T732 R733 V781 T784	H725-V729 WeakPolarHBondContact O-CB 3.45Å; H725-V729 VanDerWaalsContact O-CG2 3.3Å; H725-V729 WeakPolarHBondContact O-CG2 3.49Å; H725-V729 PolarHBondContact O-N 3.37Å; N726-V729 PolarHBondContact O-N 2.95Å; V729-T732 PolarHBondContact O-N 3.25Å; V729-R733 PolarHBondContact O-N 3.35Å; V729-R733 VanDerWaalsContact O-N 3.12Å; V729-V781 HydrophobicContact CG2-CG2 4.11Å; V729-T784 HydrophobicContact CG1-CG2 4.17Å
730	L	93.8	Very high	88.6	Confident	2 Å²	2	33 Å²	33	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-70.4	-45.2	-179.5	-172.3	67.6	0	0	0	112	L685 L688 R689 E692 N726 V728 T732 R733 T734	L685-L730 HydrophobicContact CD1-CD2 3.99Å; L688-L730 HydrophobicContact CB-CD2 3.87Å; L688-L730 HydrophobicContact CD2-CB 4.2Å; L688-L730 HydrophobicContact CD2-CD2 3.89Å; L688-L730 HydrophobicContact CD2-CG 3.93Å; L688-L730 HydrophobicContact CG-CD2 3.7Å; L688-L730 HydrophobicContact CG-CG 3.86Å; R689-L730 HydrophobicContact CB-CD2 4.24Å; R689-L730 HydrophobicContact CG-CD1 4.21Å; R689-L730 HydrophobicContact CG-CD2 3.47Å; R689-L730 VanDerWaalsContact CG-CD2 3.47Å; E692-L730 HydrophobicContact CB-CD1 3.8Å; E692-L730 HydrophobicContact CG-CD1 3.87Å; N726-L730 WeakPolarHBondContact O-CB 3.45Å; N726-L730 PolarHBondContact O-N 3.41Å; V728-L730 VanDerWaalsContact C-N 3.29Å; V728-L730 PolarHBondContact O-N 2.92Å; L730-T732 PolarHBondContact O-N 2.65Å; L730-R733 PolarHBondContact O-N 3.38Å; L730-R733 VanDerWaalsContact O-N 3.17Å; L730-T734 PolarHBondContact O-N 3.14Å; L730-T734 PolarHBondContact O-OG1 3.34Å; L730-T734 VanDerWaalsContact O-OG1 3.07Å
731	A	95.6	Very high	90.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.5	-36.9	173.7	0	0	0	0	0	112	L688 L712 I713 L727 V728 T734 C735	L688-A731 HydrophobicContact CD2-CB 4.12Å; L712-A731 HydrophobicContact CB-CB 3.98Å; L712-A731 HydrophobicContact CD1-CB 4.01Å; I713-A731 HydrophobicContact CD1-CB 4.3Å; I713-A731 HydrophobicContact CG1-CB 3.83Å; L727-A731 WeakPolarHBondContact O-CB 3.45Å; L727-A731 PolarHBondContact O-N 2.99Å; V728-A731 PolarHBondContact O-N 3.22Å; A731-T734 PolarHBondContact O-N 2.87Å; A731-C735 WeakPolarHBondContact O-CB 3.48Å; A731-C735 PolarHBondContact O-N 3.36Å
732	T	95.6	Very high	91.3	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-65	-43	176.7	-54.4	0	0	0	0	111.8	V728 V729 L730 F736 M773 V788	V728-T732 WeakPolarHBondContact O-CB 3.43Å; V728-T732 PolarHBondContact O-N 3.24Å; V728-T732 PolarHBondContact O-OG1 3.42Å; V729-T732 PolarHBondContact O-N 3.25Å; L730-T732 PolarHBondContact O-N 2.65Å; T732-F736 WeakPolarHBondContact O-CB 3.34Å; T732-F736 PolarHBondContact O-N 2.98Å; T732-M773 WeakPolarHBondContact OG1-CE 3.09Å; T732-V788 HydrophobicContact CG2-CB 4.44Å; T732-V788 HydrophobicContact CG2-CG1 4.27Å; T732-V788 HydrophobicContact CG2-CG2 4.32Å
733	R	94.6	Very high	92.4	Very high	60 Å²	60	19.3 Å²	19.3	23%	0.226	9%	0.091	C	C	.	.	H	α-helix	trans	-61.7	-46.4	171.1	-74.8	-171.8	-77.6	164.2	-12.3	112	E623 E692 V729 L730 C735 F736 W737 T784	E623-R733 IonicContact OE1-NH2 2.62Å; E623-R733 PolarHBondContact OE1-NH2 2.95Å; E623-R733 IonicContact OE2-CZ 3.8Å; E623-R733 VanDerWaalsContact OE2-CZ 3.25Å; E623-R733 IonicContact OE2-NH1 2.7Å; E623-R733 PolarHBondContact OE2-NH1 2.75Å; E623-R733 IonicContact OE2-NH2 3.87Å; E623-R733 PolarHBondContact OE2-NH2 3.44Å; E692-R733 HydrophobicContact CG-CB 3.98Å; E692-R733 IonicContact OE1-NH1 3.09Å; E692-R733 IonicContact OE2-NH1 2.73Å; V729-R733 PolarHBondContact O-N 3.35Å; V729-R733 VanDerWaalsContact O-N 3.12Å; L730-R733 PolarHBondContact O-N 3.38Å; L730-R733 VanDerWaalsContact O-N 3.17Å; R733-C735 PolarHBondContact O-N 2.94Å; R733-F736 WeakPolarHBondContact O-CB 3.31Å; R733-F736 PolarHBondContact O-N 2.77Å; R733-W737 PolarHBondContact O-N 2.83Å; R733-T784 HydrophobicContact CG-CG2 4.17Å
734	T	95.9	Very high	92.9	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-60.4	-45.2	178	-54.4	0	0	0	0	111.9	L688 V691 E692 Y695 I705 A709 L730 A731 F736 W737 I738	L688-T734 HydrophobicContact CD1-CG2 4.21Å; V691-T734 HydrophobicContact CG1-CG2 3.99Å; E692-T734 WeakPolarHBondContact CB-OG1 3.43Å; Y695-T734 HydrophobicContact CD2-CG2 3.95Å; Y695-T734 HydrophobicContact CE2-CG2 4.16Å; I705-T734 HydrophobicContact CG2-CG2 4.38Å; A709-T734 HydrophobicContact CB-CG2 4.38Å; L730-T734 PolarHBondContact O-N 3.14Å; L730-T734 PolarHBondContact O-OG1 3.34Å; L730-T734 VanDerWaalsContact O-OG1 3.07Å; A731-T734 PolarHBondContact O-N 2.87Å; T734-F736 VanDerWaalsContact C-N 3.34Å; T734-F736 PolarHBondContact O-N 3.39Å; T734-W737 PolarHBondContact O-N 3.43Å; T734-I738 HydrophobicContact CG2-CD1 4.15Å; T734-I738 VanDerWaalsContact O-CG1 3.29Å; T734-I738 WeakPolarHBondContact O-CG1 3.41Å; T734-I738 PolarHBondContact O-N 3.15Å
735	C	97	Very high	93	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-62.9	-37.5	175.4	-78.6	0	0	0	0	112.7	W706 I713 A731 R733 I738 L739 L766	W706-C735 HydrophobicContact CE3-CB 4.38Å; W706-C735 HydrophobicContact CH2-CB 4.49Å; W706-C735 HydrophobicContact CZ3-CB 3.86Å; I713-C735 HydrophobicContact CD1-CB 4.15Å; A731-C735 WeakPolarHBondContact O-CB 3.48Å; A731-C735 PolarHBondContact O-N 3.36Å; R733-C735 PolarHBondContact O-N 2.94Å; C735-I738 PolarHBondContact O-N 3.04Å; C735-L739 WeakPolarHBondContact O-CG 3.4Å; C735-L739 PolarHBondContact O-N 3Å; C735-L766 HydrophobicContact CB-CD1 4.03Å; C735-L766 HydrophobicContact CB-CD2 3.99Å
736	F	95.5	Very high	92.9	Very high	18 Å²	18	14.9 Å²	14.9	8%	0.079	7%	0.074	C	C	.	.	H	α-helix	trans	-59.9	-51	172	169.8	-102	0	0	0	111.7	T732 R733 T734 I738 L739 L740 V788 D791 L792	T732-F736 WeakPolarHBondContact O-CB 3.34Å; T732-F736 PolarHBondContact O-N 2.98Å; R733-F736 WeakPolarHBondContact O-CB 3.31Å; R733-F736 PolarHBondContact O-N 2.77Å; T734-F736 VanDerWaalsContact C-N 3.34Å; T734-F736 PolarHBondContact O-N 3.39Å; F736-I738 VanDerWaalsContact C-N 3.32Å; F736-I738 PolarHBondContact O-N 2.87Å; F736-L739 PolarHBondContact O-N 3.32Å; F736-L739 VanDerWaalsContact O-N 3.17Å; F736-L740 HydrophobicContact CD1-CD1 4.2Å; F736-L740 HydrophobicContact CE1-CD1 3.59Å; F736-L740 HydrophobicContact CE1-CG 4.4Å; F736-L740 HydrophobicContact CE2-CD1 4.33Å; F736-L740 HydrophobicContact CE2-CD2 4.42Å; F736-L740 HydrophobicContact CE2-CG 4.5Å; F736-L740 HydrophobicContact CZ-CD1 3.67Å; F736-L740 HydrophobicContact CZ-CD2 4.47Å; F736-L740 HydrophobicContact CZ-CG 4.31Å; F736-L740 PolarHBondContact O-N 2.92Å; F736-V788 HydrophobicContact CB-CG1 3.95Å; F736-V788 HydrophobicContact CB-CG2 4.2Å; F736-V788 HydrophobicContact CD2-CG1 3.96Å; F736-V788 HydrophobicContact CG-CG1 4.26Å; F736-V788 HydrophobicContact CG-CG2 4.31Å; F736-D791 HydrophobicContact CE2-CB 3.9Å; F736-D791 HydrophobicContact CZ-CB 4.1Å; F736-L792 HydrophobicContact CD2-CD2 3.88Å; F736-L792 HydrophobicContact CD2-CG 3.95Å; F736-L792 HydrophobicContact CE2-CD2 4.22Å; F736-L792 HydrophobicContact CE2-CG 4.27Å
737	W	94.5	Very high	92.7	Very high	45 Å²	45	14.6 Å²	14.6	17%	0.17	7%	0.071	C	C	.	.	H	α-helix	trans	-59.9	-39.3	177.9	-67.6	120.2	0	0	0	113.1	E692 Y695 Q696 R733 T734 L739 L740 W741	E692-W737 PolarHBondContact OE1-NE1 2.93Å; Y695-W737 HydrophobicContact CD1-CB 4.3Å; Y695-W737 HydrophobicContact CG-CB 4.16Å; Q696-W737 HydrophobicContact CB-CZ2 4.35Å; Q696-W737 HydrophobicContact CG-CZ2 3.81Å; R733-W737 PolarHBondContact O-N 2.83Å; T734-W737 PolarHBondContact O-N 3.43Å; W737-L739 VanDerWaalsContact C-N 3.33Å; W737-L739 PolarHBondContact O-N 3.07Å; W737-L740 HydrophobicContact CE3-CD1 3.86Å; W737-L740 HydrophobicContact CZ3-CD1 3.97Å; W737-L740 PolarHBondContact O-N 3.45Å; W737-L740 VanDerWaalsContact O-N 3.15Å; W737-W741 VanDerWaalsContact O-CD1 3.27Å; W737-W741 PolarHBondContact O-N 2.93Å
738	I	95.3	Very high	92.3	Very high	4 Å²	4	18.9 Å²	18.9	2%	0.021	9%	0.094	C	C	.	.	H	α-helix	trans	-56.1	-47	175.6	-70.3	162.1	0	0	0	111	Y695 I705 W706 T734 C735 F736 L740 W741 D742	Y695-I738 HydrophobicContact CD2-CG1 4.46Å; Y695-I738 HydrophobicContact CE1-CG1 3.87Å; Y695-I738 HydrophobicContact CE2-CD1 4.16Å; Y695-I738 HydrophobicContact CE2-CG1 3.73Å; Y695-I738 VanDerWaalsContact CZ-CG1 3.4Å; Y695-I738 WeakPolarHBondContact OH-CG1 3.3Å; I705-I738 HydrophobicContact CB-CD1 4.28Å; I705-I738 HydrophobicContact CG2-CD1 4.26Å; W706-I738 HydrophobicContact CB-CD1 4.43Å; W706-I738 HydrophobicContact CB-CG2 4.46Å; W706-I738 HydrophobicContact CE3-CB 4.33Å; W706-I738 HydrophobicContact CE3-CD1 4.44Å; W706-I738 HydrophobicContact CE3-CG2 3.93Å; T734-I738 HydrophobicContact CG2-CD1 4.15Å; T734-I738 VanDerWaalsContact O-CG1 3.29Å; T734-I738 WeakPolarHBondContact O-CG1 3.41Å; T734-I738 PolarHBondContact O-N 3.15Å; C735-I738 PolarHBondContact O-N 3.04Å; F736-I738 VanDerWaalsContact C-N 3.32Å; F736-I738 PolarHBondContact O-N 2.87Å; I738-L740 VanDerWaalsContact C-N 3.27Å; I738-L740 PolarHBondContact O-N 3.38Å; I738-W741 PolarHBondContact O-N 3.39Å; I738-D742 WeakPolarHBondContact O-CB 3.45Å; I738-D742 PolarHBondContact O-N 2.75Å
739	L	94.4	Very high	91.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63.3	-32.8	179.3	-63.4	173.3	0	0	0	112.7	W706 C735 F736 W737 L743 L759 R762 L763 L766 L792	W706-L739 HydrophobicContact CH2-CD2 4.26Å; W706-L739 HydrophobicContact CZ3-CD2 3.93Å; W706-L739 HydrophobicContact CZ3-CG 4.06Å; C735-L739 WeakPolarHBondContact O-CG 3.4Å; C735-L739 PolarHBondContact O-N 3Å; F736-L739 PolarHBondContact O-N 3.32Å; F736-L739 VanDerWaalsContact O-N 3.17Å; W737-L739 VanDerWaalsContact C-N 3.33Å; W737-L739 PolarHBondContact O-N 3.07Å; L739-L743 VanDerWaalsContact O-CB 3.31Å; L739-L743 WeakPolarHBondContact O-CB 3.33Å; L739-L743 PolarHBondContact O-N 3.49Å; L739-L759 HydrophobicContact CB-CD1 4.22Å; L739-L759 HydrophobicContact CD2-CD1 3.54Å; L739-L759 HydrophobicContact CG-CD1 4.48Å; L739-R762 HydrophobicContact CD2-CB 3.63Å; L739-L763 HydrophobicContact CD1-CD1 4.39Å; L739-L766 HydrophobicContact CD1-CB 4.43Å; L739-L766 HydrophobicContact CD1-CD2 3.56Å; L739-L792 HydrophobicContact CD1-CD1 4.39Å; L739-L792 HydrophobicContact CD1-CD2 3.78Å
740	L	92.5	Very high	90.7	Very high	3 Å²	3	23.3 Å²	23.3	2%	0.016	13%	0.13	C	C	.	.	H	α-helix	trans	-71.8	-39.5	177.5	-61.7	-173.4	0	0	0	112.6	A17 F736 W737 I738 L743 L744 I795	A17-L740 HydrophobicContact CB-CD1 3.48Å; A17-L740 VanDerWaalsContact CB-CD1 3.48Å; A17-L740 HydrophobicContact CB-CD2 4.45Å; F736-L740 HydrophobicContact CD1-CD1 4.2Å; F736-L740 HydrophobicContact CE1-CD1 3.59Å; F736-L740 HydrophobicContact CE1-CG 4.4Å; F736-L740 HydrophobicContact CE2-CD1 4.33Å; F736-L740 HydrophobicContact CE2-CD2 4.42Å; F736-L740 HydrophobicContact CE2-CG 4.5Å; F736-L740 HydrophobicContact CZ-CD1 3.67Å; F736-L740 HydrophobicContact CZ-CD2 4.47Å; F736-L740 HydrophobicContact CZ-CG 4.31Å; F736-L740 PolarHBondContact O-N 2.92Å; W737-L740 HydrophobicContact CE3-CD1 3.86Å; W737-L740 HydrophobicContact CZ3-CD1 3.97Å; W737-L740 PolarHBondContact O-N 3.45Å; W737-L740 VanDerWaalsContact O-N 3.15Å; I738-L740 VanDerWaalsContact C-N 3.27Å; I738-L740 PolarHBondContact O-N 3.38Å; L740-L743 PolarHBondContact O-N 3.33Å; L740-L744 WeakPolarHBondContact O-CB 3.39Å; L740-L744 PolarHBondContact O-N 2.91Å; L740-I795 HydrophobicContact CD2-CD1 3.63Å; L740-I795 HydrophobicContact CD2-CG2 4.33Å
741	W	92.8	Very high	89.8	Confident	30 Å²	30	26.9 Å²	26.9	11%	0.114	15%	0.148	C	C	.	.	H	α-helix	trans	-71	-41.2	174.7	-75.6	105.6	0	0	0	112.1	M14 Y695 H698 D699 W737 I738 L743 L744 A745	M14-W741 HydrophobicContact CE-CH2 3.92Å; M14-W741 HydrophobicContact CE-CZ2 3.74Å; M14-W741 HydrophobicContact SD-CE3 4.45Å; M14-W741 HydrophobicContact SD-CH2 3.45Å; M14-W741 WeakPolarHBondContact SD-CH2 3.44Å; M14-W741 HydrophobicContact SD-CZ2 3.69Å; M14-W741 HydrophobicContact SD-CZ3 3.86Å; Y695-W741 AromaticContact CD1-CD1 3.58Å; Y695-W741 HydrophobicContact CD1-CG 4.5Å; Y695-W741 AromaticContact CD1-NE1 3.98Å; Y695-W741 PolarHBondContact O-NE1 3.37Å; H698-W741 VanDerWaalsContact C-CZ2 3.4Å; H698-W741 PolarHBondContact O-NE1 2.95Å; D699-W741 HydrophobicContact CB-CD2 4Å; D699-W741 HydrophobicContact CB-CE3 3.55Å; D699-W741 HydrophobicContact CB-CH2 4.31Å; D699-W741 HydrophobicContact CB-CZ3 3.73Å; W737-W741 VanDerWaalsContact O-CD1 3.27Å; W737-W741 PolarHBondContact O-N 2.93Å; I738-W741 PolarHBondContact O-N 3.39Å; W741-L743 VanDerWaalsContact C-N 3.31Å; W741-L743 PolarHBondContact O-N 2.97Å; W741-L744 HydrophobicContact CE3-CD2 3.78Å; W741-L744 HydrophobicContact CZ3-CD2 3.62Å; W741-L744 PolarHBondContact O-N 3.41Å; W741-A745 WeakPolarHBondContact O-CB 3.25Å; W741-A745 PolarHBondContact O-N 2.95Å
742	D	91.8	Very high	89.2	Confident	27 Å²	27	32.6 Å²	32.6	14%	0.144	18%	0.175	C	C	.	.	H	α-helix	trans	-56.2	-45.8	171.3	-79.8	-16.7	0	0	0	110.3	I738 A745 I746 L759 R762	I738-D742 WeakPolarHBondContact O-CB 3.45Å; I738-D742 PolarHBondContact O-N 2.75Å; D742-A745 PolarHBondContact O-N 2.92Å; D742-I746 VanDerWaalsContact O-CG1 3.3Å; D742-I746 WeakPolarHBondContact O-CG1 3.18Å; D742-I746 PolarHBondContact O-N 3.04Å; D742-L759 HydrophobicContact CB-CD1 3.87Å; D742-L759 HydrophobicContact CB-CD2 4.42Å; D742-R762 IonicContact OD1-NH1 3.27Å; D742-R762 IonicContact OD2-CZ 3.62Å; D742-R762 IonicContact OD2-NH1 3.68Å; D742-R762 PolarHBondContact OD2-NH1 3.31Å
743	L	91	Very high	88.7	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-63.6	-47.5	176.7	177.6	60	0	0	0	112.6	P13 L739 L740 W741 A745 I746 E747 L759 I795 F796 V800 L807 L810	P13-L743 HydrophobicContact CB-CD2 4.09Å; P13-L743 HydrophobicContact CB-CG 4.29Å; P13-L743 HydrophobicContact CG-CD2 4.41Å; P13-L743 HydrophobicContact CG-CG 4.21Å; L739-L743 VanDerWaalsContact O-CB 3.31Å; L739-L743 WeakPolarHBondContact O-CB 3.33Å; L739-L743 PolarHBondContact O-N 3.49Å; L740-L743 PolarHBondContact O-N 3.33Å; W741-L743 VanDerWaalsContact C-N 3.31Å; W741-L743 PolarHBondContact O-N 2.97Å; L743-A745 VanDerWaalsContact C-N 3.29Å; L743-A745 PolarHBondContact O-N 3.42Å; L743-I746 PolarHBondContact O-N 3.33Å; L743-E747 HydrophobicContact CD1-CG 4.39Å; L743-E747 PolarHBondContact O-N 2.92Å; L743-L759 HydrophobicContact CB-CD2 4.07Å; L743-L759 HydrophobicContact CD1-CD2 4.37Å; L743-I795 HydrophobicContact CD2-CG2 3.63Å; L743-F796 HydrophobicContact CB-CZ 4.39Å; L743-F796 HydrophobicContact CD1-CE1 4.36Å; L743-F796 HydrophobicContact CD2-CE1 4.09Å; L743-F796 HydrophobicContact CD2-CZ 4.05Å; L743-V800 HydrophobicContact CD1-CG2 3.83Å; L743-V800 HydrophobicContact CD2-CG2 4.36Å; L743-L807 HydrophobicContact CD1-CD1 4.39Å; L743-L810 HydrophobicContact CD1-CD1 4.22Å
744	L	88.6	Confident	88.4	Confident	7 Å²	7	45.8 Å²	45.8	4%	0.037	24%	0.239	C	C	.	.	H	α-helix	trans	-61.9	-36	178.2	176.9	66.7	0	0	0	112.2	P13 M14 L740 W741 N748	P13-L744 HydrophobicContact CG-CB 4.34Å; P13-L744 HydrophobicContact CG-CD1 4.24Å; M14-L744 HydrophobicContact CG-CD2 4.06Å; M14-L744 HydrophobicContact SD-CD2 3.7Å; L740-L744 WeakPolarHBondContact O-CB 3.39Å; L740-L744 PolarHBondContact O-N 2.91Å; W741-L744 HydrophobicContact CE3-CD2 3.78Å; W741-L744 HydrophobicContact CZ3-CD2 3.62Å; W741-L744 PolarHBondContact O-N 3.41Å; L744-N748 WeakPolarHBondContact CD1-ND2 3.29Å; L744-N748 WeakPolarHBondContact CG-ND2 3.35Å; L744-N748 WeakPolarHBondContact O-CB 3.44Å; L744-N748 VanDerWaalsContact O-CG 3.3Å; L744-N748 PolarHBondContact O-N 3.03Å; L744-N748 PolarHBondContact O-ND2 3.42Å
745	A	87.8	Confident	88.1	Confident	35 Å²	35	46.9 Å²	46.9	29%	0.289	25%	0.248	S	C	.	.	H	α-helix	trans	-64.8	-40	175.6	0	0	0	0	0	111.9	W741 D742 L743 N750	W741-A745 WeakPolarHBondContact O-CB 3.25Å; W741-A745 PolarHBondContact O-N 2.95Å; D742-A745 PolarHBondContact O-N 2.92Å; L743-A745 VanDerWaalsContact C-N 3.29Å; L743-A745 PolarHBondContact O-N 3.42Å; A745-N750 VanDerWaalsContact O-CB 3.23Å; A745-N750 WeakPolarHBondContact O-CB 3.3Å; A745-N750 PolarHBondContact O-N 3.16Å; A745-N750 VanDerWaalsContact O-N 3.1Å
746	I	87.2	Confident	87.8	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.015	25%	0.251	C	S	.	.	H	α-helix	trans	-68.9	-45.4	176.9	-60.9	164.2	0	0	0	110.7	D742 L743 N748 G749 N750 L751 A755 I756 L759 L807	D742-I746 VanDerWaalsContact O-CG1 3.3Å; D742-I746 WeakPolarHBondContact O-CG1 3.18Å; D742-I746 PolarHBondContact O-N 3.04Å; L743-I746 PolarHBondContact O-N 3.33Å; I746-N748 VanDerWaalsContact C-N 3.29Å; I746-N748 PolarHBondContact O-N 2.68Å; I746-G749 PolarHBondContact O-N 2.99Å; I746-N750 PolarHBondContact O-N 2.61Å; I746-L751 HydrophobicContact CG2-CD2 3.83Å; I746-L751 WeakPolarHBondContact O-CD2 3.5Å; I746-A755 HydrophobicContact CD1-CB 4.38Å; I746-A755 HydrophobicContact CG1-CB 4.31Å; I746-I756 HydrophobicContact CD1-CG1 4.23Å; I746-I756 HydrophobicContact CG2-CD1 4.34Å; I746-I756 HydrophobicContact CG2-CG1 3.94Å; I746-L759 HydrophobicContact CD1-CB 4.24Å; I746-L759 HydrophobicContact CD1-CD2 3.61Å; I746-L807 HydrophobicContact CB-CD2 4.5Å; I746-L807 HydrophobicContact CG2-CD2 3.52Å
747	E	84.3	Confident	87.6	Confident	45 Å²	45	50.1 Å²	50.1	21%	0.21	27%	0.272	C	S	.	.	H	α-helix	trans	-60.8	-35.4	175.7	-75	-168	-171.2	0	0	113	P13 L743 G749 I804 L807	P13-E747 WeakPolarHBondContact CD-OE2 3.37Å; P13-E747 HydrophobicContact CG-CG 4.32Å; P13-E747 WeakPolarHBondContact CG-OE2 3.38Å; L743-E747 HydrophobicContact CD1-CG 4.39Å; L743-E747 PolarHBondContact O-N 2.92Å; E747-G749 PolarHBondContact O-N 3.15Å; E747-I804 HydrophobicContact CB-CD1 4.32Å; E747-I804 HydrophobicContact CG-CD1 4.2Å; E747-L807 HydrophobicContact CG-CD1 3.79Å
748	N	83.8	Confident	87.6	Confident	90 Å²	90	50.1 Å²	50.1	48%	0.481	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	5.8	175	-74	-38.5	0	0	0	114.2	L744 I746	L744-N748 WeakPolarHBondContact CD1-ND2 3.29Å; L744-N748 WeakPolarHBondContact CG-ND2 3.35Å; L744-N748 WeakPolarHBondContact O-CB 3.44Å; L744-N748 VanDerWaalsContact O-CG 3.3Å; L744-N748 PolarHBondContact O-N 3.03Å; L744-N748 PolarHBondContact O-ND2 3.42Å; I746-N748 VanDerWaalsContact C-N 3.29Å; I746-N748 PolarHBondContact O-N 2.68Å
749	G	78.5	Confident	87.5	Confident	54 Å²	54	50 Å²	50	56%	0.557	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	120.6	-0.4	169	0	0	0	0	0	116	I746 E747 L751	I746-G749 PolarHBondContact O-N 2.99Å; E747-G749 PolarHBondContact O-N 3.15Å; G749-L751 PolarHBondContact O-N 3.36Å
750	N	74.1	Confident	87.5	Confident	65 Å²	65	55.2 Å²	55.2	35%	0.348	30%	0.301	S	S	.	.			trans	-78.5	60.4	174.3	-168.5	23	0	0	0	112.2	A745 I746 E752	A745-N750 VanDerWaalsContact O-CB 3.23Å; A745-N750 WeakPolarHBondContact O-CB 3.3Å; A745-N750 PolarHBondContact O-N 3.16Å; A745-N750 VanDerWaalsContact O-N 3.1Å; I746-N750 PolarHBondContact O-N 2.61Å; N750-E752 PolarHBondContact O-N 3.1Å; N750-E752 WeakPolarHBondContact OD1-CG 3.47Å
751	L	75.4	Confident	87.7	Confident	77 Å²	77	60.8 Å²	60.8	40%	0.403	33%	0.327	S	S	.	.			trans	-78.3	30.4	-175.9	-59.2	177.4	0	0	0	113.7	I746 G749 I804	I746-L751 HydrophobicContact CG2-CD2 3.83Å; I746-L751 WeakPolarHBondContact O-CD2 3.5Å; G749-L751 PolarHBondContact O-N 3.36Å; L751-I804 HydrophobicContact CD2-CG2 3.75Å
752	E	82.1	Confident	87.9	Confident	120 Å²	120	61.2 Å²	61.2	56%	0.561	33%	0.328	S	S	*	.			trans	-68.7	130	176.5	-67.4	-178.3	168.7	0	0	110.5	N750 E754 A755 I756	N750-E752 PolarHBondContact O-N 3.1Å; N750-E752 WeakPolarHBondContact OD1-CG 3.47Å; E752-E754 PolarHBondContact O-N 3.28Å; E752-A755 HydrophobicContact CB-CB 4.14Å; E752-A755 WeakPolarHBondContact O-CB 3.43Å; E752-A755 PolarHBondContact O-N 3.41Å; E752-I756 PolarHBondContact O-N 3.14Å; E752-I756 VanDerWaalsContact O-N 3.1Å
753	E	84.7	Confident	88.1	Confident	173 Å²	173	60.1 Å²	60.1	81%	0.808	32%	0.323	S	S	*	.	H	α-helix	trans	-58.6	-34.7	-179.1	-172.8	176.1	-176.5	0	0	111.9	S757	E753-S757 WeakPolarHBondContact O-CB 3.36Å; E753-S757 PolarHBondContact O-N 3.14Å
754	E	88.3	Confident	88.3	Confident	164 Å²	164	61.3 Å²	61.3	77%	0.766	34%	0.335	S	S	*	.	H	α-helix	trans	-63.7	-40.1	174	-63.4	-170.4	-178	0	0	112.5	E752 S758	E752-E754 PolarHBondContact O-N 3.28Å; E754-S758 WeakPolarHBondContact O-CB 3.47Å; E754-S758 PolarHBondContact O-N 3Å
755	A	89.4	Confident	88.7	Confident	23 Å²	23	63 Å²	63	19%	0.19	34%	0.343	C	S	.	.	H	α-helix	trans	-67.3	-44.8	178.3	0	0	0	0	0	111.4	I746 E752 S758 L759	I746-A755 HydrophobicContact CD1-CB 4.38Å; I746-A755 HydrophobicContact CG1-CB 4.31Å; E752-A755 HydrophobicContact CB-CB 4.14Å; E752-A755 WeakPolarHBondContact O-CB 3.43Å; E752-A755 PolarHBondContact O-N 3.41Å; A755-S758 PolarHBondContact O-N 2.96Å; A755-L759 WeakPolarHBondContact O-CB 3.05Å; A755-L759 PolarHBondContact O-N 3.43Å
756	I	91	Very high	89.1	Confident	13 Å²	13	61.4 Å²	61.4	7%	0.067	33%	0.329	C	S	.	.	H	α-helix	trans	-63.3	-44.2	176.3	-63	172.9	0	0	0	110.8	I746 E752 L759 K760 E806 L807 T809 L810	I746-I756 HydrophobicContact CD1-CG1 4.23Å; I746-I756 HydrophobicContact CG2-CD1 4.34Å; I746-I756 HydrophobicContact CG2-CG1 3.94Å; E752-I756 PolarHBondContact O-N 3.14Å; E752-I756 VanDerWaalsContact O-N 3.1Å; I756-L759 PolarHBondContact O-N 3.37Å; I756-K760 WeakPolarHBondContact O-CB 3.41Å; I756-K760 PolarHBondContact O-N 3.2Å; I756-E806 HydrophobicContact CD1-CB 3.94Å; I756-L807 HydrophobicContact CD1-CD2 4.46Å; I756-L807 HydrophobicContact CG1-CD2 4.48Å; I756-T809 WeakPolarHBondContact CG2-OG1 3.41Å; I756-L810 HydrophobicContact CG2-CD2 3.88Å; I756-L810 HydrophobicContact CG2-CG 4.15Å; I756-L810 WeakPolarHBondContact O-CD2 3.44Å
757	S	92.8	Very high	89.6	Confident	74 Å²	74	61.4 Å²	61.4	52%	0.517	33%	0.33	S	S	.	.	H	α-helix	trans	-63.6	-43.5	177.7	-170.9	0	0	0	0	112.2	E753 K760 Q761	E753-S757 WeakPolarHBondContact O-CB 3.36Å; E753-S757 PolarHBondContact O-N 3.14Å; S757-K760 WeakPolarHBondContact O-CB 3.31Å; S757-K760 PolarHBondContact O-N 3.42Å; S757-Q761 PolarHBondContact O-N 3.35Å
758	S	93.2	Very high	90.1	Very high	44 Å²	44	63.6 Å²	63.6	31%	0.308	35%	0.346	S	S	.	.	H	α-helix	trans	-60.2	-50.4	174.8	179.8	0	0	0	0	111.8	E754 A755 K760 Q761 R762	E754-S758 WeakPolarHBondContact O-CB 3.47Å; E754-S758 PolarHBondContact O-N 3Å; A755-S758 PolarHBondContact O-N 2.96Å; S758-K760 VanDerWaalsContact C-N 3.3Å; S758-K760 PolarHBondContact O-N 3.12Å; S758-Q761 PolarHBondContact O-N 3.21Å; S758-R762 WeakPolarHBondContact O-CG 3.43Å; S758-R762 PolarHBondContact O-N 3.32Å
759	L	94	Very high	90.7	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-58.6	-42.4	177.1	178	55.6	0	0	0	111.5	L739 D742 L743 I746 A755 I756 Q761 R762 L763 F796 L810	L739-L759 HydrophobicContact CB-CD1 4.22Å; L739-L759 HydrophobicContact CD2-CD1 3.54Å; L739-L759 HydrophobicContact CG-CD1 4.48Å; D742-L759 HydrophobicContact CB-CD1 3.87Å; D742-L759 HydrophobicContact CB-CD2 4.42Å; L743-L759 HydrophobicContact CB-CD2 4.07Å; L743-L759 HydrophobicContact CD1-CD2 4.37Å; I746-L759 HydrophobicContact CD1-CB 4.24Å; I746-L759 HydrophobicContact CD1-CD2 3.61Å; A755-L759 WeakPolarHBondContact O-CB 3.05Å; A755-L759 PolarHBondContact O-N 3.43Å; I756-L759 PolarHBondContact O-N 3.37Å; L759-Q761 PolarHBondContact O-N 2.96Å; L759-R762 PolarHBondContact O-N 3.42Å; L759-L763 VanDerWaalsContact O-CB 3.3Å; L759-L763 WeakPolarHBondContact O-CB 3.42Å; L759-L763 PolarHBondContact O-N 3.27Å; L759-F796 HydrophobicContact CD1-CZ 4.23Å; L759-F796 HydrophobicContact CD2-CE1 4.13Å; L759-F796 HydrophobicContact CD2-CZ 4.45Å; L759-F796 HydrophobicContact CG-CE1 4.32Å; L759-L810 HydrophobicContact CB-CD2 4.44Å; L759-L810 HydrophobicContact CD2-CD1 3.76Å; L759-L810 HydrophobicContact CD2-CD2 4.5Å; L759-L810 HydrophobicContact CG-CD1 4.41Å; L759-L810 HydrophobicContact CG-CD2 4.32Å
760	K	94.8	Very high	91.5	Very high	111 Å²	111	57.7 Å²	57.7	48%	0.483	30%	0.303	S	S	.	.	H	α-helix	trans	-60.7	-43.2	176.2	-172.1	172.6	-179.6	159.4	0	113	I756 S757 S758 G764 T809 L810	I756-K760 WeakPolarHBondContact O-CB 3.41Å; I756-K760 PolarHBondContact O-N 3.2Å; S757-K760 WeakPolarHBondContact O-CB 3.31Å; S757-K760 PolarHBondContact O-N 3.42Å; S758-K760 VanDerWaalsContact C-N 3.3Å; S758-K760 PolarHBondContact O-N 3.12Å; K760-G764 PolarHBondContact O-N 3.46Å; K760-T809 WeakPolarHBondContact CD-O 3.38Å; K760-T809 VanDerWaalsContact CE-O 3.24Å; K760-T809 WeakPolarHBondContact CE-O 3.32Å; K760-T809 PolarHBondContact NZ-O 2.92Å; K760-L810 HydrophobicContact CB-CD2 3.79Å
761	Q	96.1	Very high	92.5	Very high	119 Å²	119	57.2 Å²	57.2	56%	0.556	30%	0.297	S	S	*	.	H	α-helix	trans	-62.4	-53	176.1	-179.5	-175.7	-19.7	0	0	110.4	S757 S758 L759 L763 G764 E765	S757-Q761 PolarHBondContact O-N 3.35Å; S758-Q761 PolarHBondContact O-N 3.21Å; L759-Q761 PolarHBondContact O-N 2.96Å; Q761-L763 VanDerWaalsContact C-N 3.32Å; Q761-L763 PolarHBondContact O-N 3.26Å; Q761-G764 PolarHBondContact O-N 3.38Å; Q761-G764 VanDerWaalsContact O-N 3.11Å; Q761-E765 HydrophobicContact CG-CG 4.37Å; Q761-E765 PolarHBondContact NE2-OE1 3.03Å; Q761-E765 WeakPolarHBondContact O-CG 3.48Å; Q761-E765 PolarHBondContact O-N 2.91Å
762	R	96.7	Very high	93.3	Very high	39 Å²	39	58.5 Å²	58.5	15%	0.147	31%	0.308	C	S	.	.	H	α-helix	trans	-57.4	-42.6	-178.9	-69.6	-178.8	170	167.3	-0.6	112.6	W706 L739 D742 S758 L759 E765 L766	W706-R762 HydrophobicContact CD2-CB 4.35Å; W706-R762 HydrophobicContact CD2-CG 3.92Å; W706-R762 HydrophobicContact CE3-CB 4.42Å; W706-R762 HydrophobicContact CE3-CG 4.4Å; W706-R762 HydrophobicContact CG-CG 4.39Å; W706-R762 HydrophobicContact CH2-CB 3.62Å; W706-R762 HydrophobicContact CH2-CG 4.22Å; W706-R762 WeakPolarHBondContact CH2-O 3.49Å; W706-R762 HydrophobicContact CZ2-CB 3.54Å; W706-R762 HydrophobicContact CZ2-CG 3.74Å; W706-R762 HydrophobicContact CZ3-CB 4.08Å; L739-R762 HydrophobicContact CD2-CB 3.63Å; D742-R762 IonicContact OD1-NH1 3.27Å; D742-R762 IonicContact OD2-CZ 3.62Å; D742-R762 IonicContact OD2-NH1 3.68Å; D742-R762 PolarHBondContact OD2-NH1 3.31Å; S758-R762 WeakPolarHBondContact O-CG 3.43Å; S758-R762 PolarHBondContact O-N 3.32Å; L759-R762 PolarHBondContact O-N 3.42Å; R762-E765 PolarHBondContact O-N 2.86Å; R762-L766 PolarHBondContact O-N 3.26Å
763	L	96.2	Very high	93.9	Very high	4 Å²	4	53.8 Å²	53.8	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-57.8	-50.3	173.7	175.1	64.3	0	0	0	111.7	L739 L759 Q761 E765 L766 V767 L792 F796 F812	L739-L763 HydrophobicContact CD1-CD1 4.39Å; L759-L763 VanDerWaalsContact O-CB 3.3Å; L759-L763 WeakPolarHBondContact O-CB 3.42Å; L759-L763 PolarHBondContact O-N 3.27Å; Q761-L763 VanDerWaalsContact C-N 3.32Å; Q761-L763 PolarHBondContact O-N 3.26Å; L763-E765 VanDerWaalsContact C-N 3.32Å; L763-E765 PolarHBondContact O-N 2.88Å; L763-L766 PolarHBondContact O-N 2.72Å; L763-V767 HydrophobicContact CD1-CG2 4.04Å; L763-V767 WeakPolarHBondContact O-CB 3.08Å; L763-V767 VanDerWaalsContact O-CG2 3.3Å; L763-V767 WeakPolarHBondContact O-CG2 3.35Å; L763-V767 PolarHBondContact O-N 3.43Å; L763-L792 HydrophobicContact CD1-CB 4.35Å; L763-L792 HydrophobicContact CD1-CD1 4.49Å; L763-L792 HydrophobicContact CD1-CD2 4.07Å; L763-F796 HydrophobicContact CD1-CD2 3.61Å; L763-F796 HydrophobicContact CD1-CE2 3.9Å; L763-F796 HydrophobicContact CD1-CG 4.07Å; L763-F796 HydrophobicContact CD2-CB 3.8Å; L763-F796 HydrophobicContact CD2-CD1 3.68Å; L763-F796 HydrophobicContact CD2-CD2 3.98Å; L763-F796 HydrophobicContact CD2-CE1 4.23Å; L763-F796 HydrophobicContact CD2-CE2 4.5Å; L763-F796 HydrophobicContact CD2-CG 3.53Å; L763-F796 HydrophobicContact CG-CD2 4.44Å; L763-F796 HydrophobicContact CG-CG 4.45Å; L763-F812 HydrophobicContact CD2-CD2 4.4Å
764	G	96	Very high	94.3	Very high	26 Å²	26	45.8 Å²	45.8	27%	0.268	25%	0.249	S	C	.	.	H	α-helix	trans	-63	-37.7	179.3	0	0	0	0	0	113.2	K760 Q761 T768	K760-G764 PolarHBondContact O-N 3.46Å; Q761-G764 PolarHBondContact O-N 3.38Å; Q761-G764 VanDerWaalsContact O-N 3.11Å; G764-T768 WeakPolarHBondContact O-CB 3.48Å; G764-T768 PolarHBondContact O-N 3.48Å; G764-T768 VanDerWaalsContact O-N 3.13Å; G764-T768 PolarHBondContact O-OG1 3.16Å
765	E	96.3	Very high	94.5	Very high	44 Å²	44	43 Å²	43	21%	0.206	24%	0.239	C	C	.	.	H	α-helix	trans	-64.2	-49.4	175.3	-73.1	-177.1	174.3	0	0	111.9	F710 R714 Q761 R762 L763 T768 C769	F710-E765 HydrophobicContact CE1-CB 3.8Å; F710-E765 HydrophobicContact CE1-CG 4.39Å; F710-E765 WeakPolarHBondContact CE1-OE2 3.49Å; F710-E765 HydrophobicContact CE2-CB 4.4Å; F710-E765 HydrophobicContact CZ-CB 3.59Å; R714-E765 IonicContact NH1-OE1 3.21Å; Q761-E765 HydrophobicContact CG-CG 4.37Å; Q761-E765 PolarHBondContact NE2-OE1 3.03Å; Q761-E765 WeakPolarHBondContact O-CG 3.48Å; Q761-E765 PolarHBondContact O-N 2.91Å; R762-E765 PolarHBondContact O-N 2.86Å; L763-E765 VanDerWaalsContact C-N 3.32Å; L763-E765 PolarHBondContact O-N 2.88Å; E765-T768 PolarHBondContact O-N 3.16Å; E765-C769 PolarHBondContact O-N 3.34Å
766	L	96.7	Very high	94.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-67	-42.5	179	-176.3	62.5	0	0	0	112.7	W706 F710 I713 C735 L739 R762 L763 T768 C769 C770 V788 L792	W706-L766 HydrophobicContact CH2-CB 4.08Å; F710-L766 HydrophobicContact CE2-CD1 4.45Å; I713-L766 HydrophobicContact CD1-CD1 3.85Å; C735-L766 HydrophobicContact CB-CD1 4.03Å; C735-L766 HydrophobicContact CB-CD2 3.99Å; L739-L766 HydrophobicContact CD1-CB 4.43Å; L739-L766 HydrophobicContact CD1-CD2 3.56Å; R762-L766 PolarHBondContact O-N 3.26Å; L763-L766 PolarHBondContact O-N 2.72Å; L766-T768 VanDerWaalsContact C-N 3.26Å; L766-T768 PolarHBondContact O-N 3Å; L766-C769 PolarHBondContact O-N 2.92Å; L766-C769 VanDerWaalsContact O-N 3.14Å; L766-C770 PolarHBondContact O-N 2.88Å; L766-C770 PolarHBondContact O-SG 3.29Å; L766-C770 VanDerWaalsContact O-SG 3.35Å; L766-V788 HydrophobicContact CD2-CG1 4.46Å; L766-L792 HydrophobicContact CD2-CD1 3.85Å; L766-L792 HydrophobicContact CG-CD1 4.31Å
767	V	96.3	Very high	94.4	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.018	27%	0.272	C	S	.	.	H	α-helix	trans	-58.4	-41.6	176	168.3	0	0	0	0	110.7	L763 C769 C770 R771 L789 L792 F812	L763-V767 HydrophobicContact CD1-CG2 4.04Å; L763-V767 WeakPolarHBondContact O-CB 3.08Å; L763-V767 VanDerWaalsContact O-CG2 3.3Å; L763-V767 WeakPolarHBondContact O-CG2 3.35Å; L763-V767 PolarHBondContact O-N 3.43Å; V767-C769 VanDerWaalsContact C-N 3.34Å; V767-C769 PolarHBondContact O-N 3.4Å; V767-C770 PolarHBondContact O-N 3Å; V767-R771 HydrophobicContact CG1-CG 4.46Å; V767-R771 VanDerWaalsContact O-CG 3.32Å; V767-R771 WeakPolarHBondContact O-CG 3.38Å; V767-R771 PolarHBondContact O-N 3.42Å; V767-L789 HydrophobicContact CB-CD1 4.49Å; V767-L789 HydrophobicContact CG1-CD1 3.88Å; V767-L789 HydrophobicContact CG2-CD1 4.31Å; V767-L792 HydrophobicContact CG2-CD1 4.41Å; V767-F812 HydrophobicContact CB-CE2 4.24Å; V767-F812 HydrophobicContact CB-CZ 4.43Å; V767-F812 HydrophobicContact CG1-CE1 4.39Å; V767-F812 HydrophobicContact CG1-CE2 3.94Å; V767-F812 HydrophobicContact CG1-CZ 3.63Å; V767-F812 HydrophobicContact CG2-CE2 4.24Å
768	T	95.7	Very high	94.1	Very high	92 Å²	92	50.5 Å²	50.5	56%	0.564	27%	0.27	S	S	*	.	H	α-helix	trans	-61.5	-41.1	177.2	-57.3	0	0	0	0	111.8	G764 E765 L766 T772	G764-T768 WeakPolarHBondContact O-CB 3.48Å; G764-T768 PolarHBondContact O-N 3.48Å; G764-T768 VanDerWaalsContact O-N 3.13Å; G764-T768 PolarHBondContact O-OG1 3.16Å; E765-T768 PolarHBondContact O-N 3.16Å; L766-T768 VanDerWaalsContact C-N 3.26Å; L766-T768 PolarHBondContact O-N 3Å; T768-T772 PolarHBondContact O-OG1 2.68Å
769	C	95.5	Very high	93.9	Very high	20 Å²	20	50 Å²	50	14%	0.135	27%	0.272	C	S	.	.	H	α-helix	trans	-66.1	-48	174.3	-67.6	0	0	0	0	112.2	I713 E765 L766 V767 R771 T772 M773	I713-C769 HydrophobicContact CG2-CB 3.69Å; E765-C769 PolarHBondContact O-N 3.34Å; L766-C769 PolarHBondContact O-N 2.92Å; L766-C769 VanDerWaalsContact O-N 3.14Å; V767-C769 VanDerWaalsContact C-N 3.34Å; V767-C769 PolarHBondContact O-N 3.4Å; C769-R771 VanDerWaalsContact C-N 3.29Å; C769-R771 PolarHBondContact O-N 3.33Å; C769-T772 PolarHBondContact O-N 3.47Å; C769-T772 VanDerWaalsContact O-N 3.08Å; C769-M773 VanDerWaalsContact O-CG 3.31Å; C769-M773 WeakPolarHBondContact O-CG 3.21Å; C769-M773 PolarHBondContact O-N 3.21Å
770	C	95.6	Very high	93.7	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59	-38.6	-179.8	-67.6	0	0	0	0	112.4	L766 V767 T772 M773 I774 A785 L789	L766-C770 PolarHBondContact O-N 2.88Å; L766-C770 PolarHBondContact O-SG 3.29Å; L766-C770 VanDerWaalsContact O-SG 3.35Å; V767-C770 PolarHBondContact O-N 3Å; C770-T772 VanDerWaalsContact C-N 3.32Å; C770-T772 PolarHBondContact O-N 3.48Å; C770-M773 PolarHBondContact O-N 3Å; C770-M773 VanDerWaalsContact O-N 3.11Å; C770-I774 PolarHBondContact O-N 3.13Å; C770-A785 HydrophobicContact CB-CB 4.37Å; C770-L789 HydrophobicContact CB-CB 4.11Å; C770-L789 HydrophobicContact CB-CD1 4.46Å; C770-L789 HydrophobicContact CB-CD2 4.49Å
771	R	95.2	Very high	93.6	Very high	55 Å²	55	50.6 Å²	50.6	21%	0.208	28%	0.278	C	S	.	.	H	α-helix	trans	-56.7	-41.3	173.8	-76.3	-175.4	66.6	175.4	-2.9	113.4	V767 C769 I774 L789 D817 L818 E821	V767-R771 HydrophobicContact CG1-CG 4.46Å; V767-R771 VanDerWaalsContact O-CG 3.32Å; V767-R771 WeakPolarHBondContact O-CG 3.38Å; V767-R771 PolarHBondContact O-N 3.42Å; C769-R771 VanDerWaalsContact C-N 3.29Å; C769-R771 PolarHBondContact O-N 3.33Å; R771-I774 WeakPolarHBondContact O-CG1 3.36Å; R771-L789 HydrophobicContact CG-CD2 4.46Å; R771-D817 IonicContact CZ-OD2 2.67Å; R771-D817 VanDerWaalsContact CZ-OD2 3.23Å; R771-D817 IonicContact NH1-OD2 2.63Å; R771-D817 PolarHBondContact NH1-OD2 2.86Å; R771-D817 IonicContact NH2-OD2 3.49Å; R771-D817 PolarHBondContact NH2-OD2 2.88Å; R771-L818 HydrophobicContact CG-CD1 3.65Å; R771-E821 IonicContact CZ-OE1 3.07Å; R771-E821 IonicContact CZ-OE2 2.9Å; R771-E821 IonicContact NE-OE1 3.3Å; R771-E821 IonicContact NE-OE2 3.74Å; R771-E821 PolarHBondContact NE-OE2 3.13Å; R771-E821 VanDerWaalsContact NH2-CD 3.27Å; R771-E821 IonicContact NH2-OE1 3.23Å; R771-E821 PolarHBondContact NH2-OE1 3.43Å; R771-E821 IonicContact NH2-OE2 2.75Å; R771-E821 PolarHBondContact NH2-OE2 2.89Å
772	T	93	Very high	93.5	Very high	103 Å²	103	45 Å²	45	63%	0.632	25%	0.252	S	S	*	.	H	α-helix	trans	-69.7	-39.4	174.8	-51.3	0	0	0	0	111.1	T768 C769 C770 L775	T768-T772 PolarHBondContact O-OG1 2.68Å; C769-T772 PolarHBondContact O-N 3.47Å; C769-T772 VanDerWaalsContact O-N 3.08Å; C770-T772 VanDerWaalsContact C-N 3.32Å; C770-T772 PolarHBondContact O-N 3.48Å; T772-L775 PolarHBondContact O-N 3.37Å
773	M	93.8	Very high	93.4	Very high	21 Å²	21	43.3 Å²	43.3	10%	0.103	25%	0.247	C	C	.	.	H	α-helix	trans	-71.7	-32.9	-174.8	-68.1	168.7	67.3	0	0	114.3	I713 V728 T732 C769 C770 L775 S776 V781 A785	I713-M773 HydrophobicContact CG2-SD 3.63Å; V728-M773 HydrophobicContact CG1-CE 3.54Å; V728-M773 HydrophobicContact CG1-SD 4.35Å; T732-M773 WeakPolarHBondContact OG1-CE 3.09Å; C769-M773 VanDerWaalsContact O-CG 3.31Å; C769-M773 WeakPolarHBondContact O-CG 3.21Å; C769-M773 PolarHBondContact O-N 3.21Å; C770-M773 PolarHBondContact O-N 3Å; C770-M773 VanDerWaalsContact O-N 3.11Å; M773-L775 PolarHBondContact O-N 3.29Å; M773-S776 WeakPolarHBondContact O-CB 3.5Å; M773-S776 PolarHBondContact O-N 3.17Å; M773-V781 HydrophobicContact CB-CG1 4.22Å; M773-V781 HydrophobicContact CE-CG1 3.7Å; M773-V781 HydrophobicContact CG-CG1 4.42Å; M773-A785 HydrophobicContact CB-CB 3.51Å; M773-A785 HydrophobicContact CE-CB 4.19Å
774	I	94.6	Very high	93.3	Very high	5 Å²	5	44.5 Å²	44.5	3%	0.026	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-20.4	176.7	55.6	169.5	0	0	0	113.4	C770 R771 S776 A785 Y786 L789 E821 F825	C770-I774 PolarHBondContact O-N 3.13Å; R771-I774 WeakPolarHBondContact O-CG1 3.36Å; I774-S776 VanDerWaalsContact C-N 3.26Å; I774-S776 PolarHBondContact O-N 3.03Å; I774-A785 HydrophobicContact CG2-CB 3.84Å; I774-Y786 HydrophobicContact CG2-CD2 4.21Å; I774-L789 HydrophobicContact CD1-CD2 4.02Å; I774-L789 HydrophobicContact CG2-CD2 4.36Å; I774-E821 HydrophobicContact CD1-CB 3.93Å; I774-F825 HydrophobicContact CB-CD2 4.2Å
775	L	91.6	Very high	93.3	Very high	107 Å²	107	43.3 Å²	43.3	56%	0.56	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-8.3	174.9	-56.4	179.1	0	0	0	113.1	T772 M773	T772-L775 PolarHBondContact O-N 3.37Å; M773-L775 PolarHBondContact O-N 3.29Å
776	S	89.1	Confident	93.3	Very high	34 Å²	34	41.2 Å²	41.2	24%	0.238	23%	0.232	C	C	.	.			trans	-58.4	153.9	-178.7	-172.6	0	0	0	0	113	M773 I774 M778 K828	M773-S776 WeakPolarHBondContact O-CB 3.5Å; M773-S776 PolarHBondContact O-N 3.17Å; I774-S776 VanDerWaalsContact C-N 3.26Å; I774-S776 PolarHBondContact O-N 3.03Å; S776-M778 PolarHBondContact OG-N 3.29Å; S776-M778 VanDerWaalsContact OG-N 3.1Å; S776-K828 PolarHBondContact O-NZ 3.01Å
777	N	88.2	Confident	93.2	Very high	136 Å²	136	43.4 Å²	43.4	73%	0.727	24%	0.243	S	C	*	.	S	Bend	trans	-88.8	-11.7	169.3	-69	-30.2	0	0	0	112.4	G779 K828	N777-G779 PolarHBondContact O-N 2.89Å; N777-K828 PolarHBondContact OD1-NZ 3.47Å
778	M	88.2	Confident	93.2	Very high	96 Å²	96	43.7 Å²	43.7	47%	0.473	25%	0.245	S	C	.	.	S	Bend	trans	-80.2	110.3	171.6	-60.9	-58.9	-70.3	0	0	109	S776 E780 V781 A782	S776-M778 PolarHBondContact OG-N 3.29Å; S776-M778 VanDerWaalsContact OG-N 3.1Å; M778-E780 VanDerWaalsContact C-N 3.26Å; M778-E780 PolarHBondContact O-N 3.35Å; M778-V781 HydrophobicContact CB-CB 4.09Å; M778-V781 HydrophobicContact CB-CG2 3.84Å; M778-V781 PolarHBondContact O-N 3.39Å; M778-A782 WeakPolarHBondContact O-CB 3.42Å; M778-A782 PolarHBondContact O-N 3.37Å
779	G	88.5	Confident	93.2	Very high	34 Å²	34	39.3 Å²	39.3	35%	0.351	22%	0.218	S	C	.	.	H	α-helix	trans	-59.6	-32.9	-173.7	0	0	0	0	0	114.3	N777 G783 W829	N777-G779 PolarHBondContact O-N 2.89Å; G779-G783 WeakPolarHBondContact O-CA 3.4Å; G779-G783 PolarHBondContact O-N 3.15Å; G779-W829 VanDerWaalsContact CA-CH2 3.41Å
780	E	89.3	Confident	93.2	Very high	110 Å²	110	38.4 Å²	38.4	51%	0.514	21%	0.212	S	C	.	.	H	α-helix	trans	-69.3	-50.3	176.5	-62.6	-178.8	166.3	0	0	111.9	H725 M778 A782 G783 T784	H725-E780 IonicContact CD2-OE2 3.25Å; H725-E780 PolarHBondContact CD2-OE2 3Å; H725-E780 IonicContact NE2-OE2 3.72Å; M778-E780 VanDerWaalsContact C-N 3.26Å; M778-E780 PolarHBondContact O-N 3.35Å; E780-A782 PolarHBondContact O-N 3.45Å; E780-G783 PolarHBondContact O-N 2.76Å; E780-T784 WeakPolarHBondContact O-CB 3.34Å; E780-T784 PolarHBondContact O-N 2.83Å; E780-T784 PolarHBondContact O-OG1 3.32Å
781	V	92.6	Very high	93.1	Very high	15 Å²	15	39.8 Å²	39.8	9%	0.091	22%	0.22	C	C	.	.	H	α-helix	trans	-58.8	-48.1	177.4	-178.6	0	0	0	0	110.6	H725 V729 M773 M778 A785	H725-V781 HydrophobicContact CB-CG2 3.7Å; V729-V781 HydrophobicContact CG2-CG2 4.11Å; M773-V781 HydrophobicContact CB-CG1 4.22Å; M773-V781 HydrophobicContact CE-CG1 3.7Å; M773-V781 HydrophobicContact CG-CG1 4.42Å; M778-V781 HydrophobicContact CB-CB 4.09Å; M778-V781 HydrophobicContact CB-CG2 3.84Å; M778-V781 PolarHBondContact O-N 3.39Å; V781-A785 VanDerWaalsContact O-CB 3.23Å; V781-A785 WeakPolarHBondContact O-CB 3.49Å; V781-A785 PolarHBondContact O-N 3.19Å
782	A	94.7	Very high	93	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-65.7	-43.4	179.3	0	0	0	0	0	111.5	M778 E780 Y786 F825 W829	M778-A782 WeakPolarHBondContact O-CB 3.42Å; M778-A782 PolarHBondContact O-N 3.37Å; E780-A782 PolarHBondContact O-N 3.45Å; A782-Y786 VanDerWaalsContact O-CB 3.23Å; A782-Y786 WeakPolarHBondContact O-CB 3.37Å; A782-Y786 PolarHBondContact O-N 2.72Å; A782-F825 HydrophobicContact CB-CE2 3.96Å; A782-F825 WeakPolarHBondContact O-CE2 3.19Å; A782-W829 HydrophobicContact CB-CZ2 4.31Å
783	G	93.7	Very high	93.1	Very high	5 Å²	5	32.3 Å²	32.3	5%	0.052	18%	0.18	C	C	.	.	H	α-helix	trans	-66.2	-45.4	-179.8	0	0	0	0	0	113.7	G779 E780 Y786 L787	G779-G783 WeakPolarHBondContact O-CA 3.4Å; G779-G783 PolarHBondContact O-N 3.15Å; E780-G783 PolarHBondContact O-N 2.76Å; G783-Y786 PolarHBondContact O-N 3.24Å; G783-L787 WeakPolarHBondContact O-CG 3.4Å; G783-L787 PolarHBondContact O-N 3.16Å
784	T	94.1	Very high	93	Very high	29 Å²	29	32.7 Å²	32.7	18%	0.178	18%	0.182	C	C	.	.	H	α-helix	trans	-64	-46.9	175.1	-62.1	0	0	0	0	111	V729 R733 E780 Y786 L787 V788	V729-T784 HydrophobicContact CG1-CG2 4.17Å; R733-T784 HydrophobicContact CG-CG2 4.17Å; E780-T784 WeakPolarHBondContact O-CB 3.34Å; E780-T784 PolarHBondContact O-N 2.83Å; E780-T784 PolarHBondContact O-OG1 3.32Å; T784-Y786 VanDerWaalsContact C-N 3.27Å; T784-Y786 PolarHBondContact O-N 3.49Å; T784-L787 PolarHBondContact O-N 2.94Å; T784-V788 HydrophobicContact CG2-CG2 4.35Å; T784-V788 WeakPolarHBondContact O-CB 3.05Å; T784-V788 WeakPolarHBondContact O-CG2 3.12Å; T784-V788 PolarHBondContact O-N 3.22Å
785	A	96.1	Very high	92.8	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-59.8	-39.2	176.8	0	0	0	0	0	112	C770 M773 I774 V781 L789	C770-A785 HydrophobicContact CB-CB 4.37Å; M773-A785 HydrophobicContact CB-CB 3.51Å; M773-A785 HydrophobicContact CE-CB 4.19Å; I774-A785 HydrophobicContact CG2-CB 3.84Å; V781-A785 VanDerWaalsContact O-CB 3.23Å; V781-A785 WeakPolarHBondContact O-CB 3.49Å; V781-A785 PolarHBondContact O-N 3.19Å; A785-L789 WeakPolarHBondContact O-CB 3.49Å; A785-L789 PolarHBondContact O-N 3.31Å
786	Y	97	Very high	92.8	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-66.9	-45.4	179.4	-174	-96.7	0	0	0	112.7	I774 A782 G783 T784 L789 C790 L822 F825 L826 F855 Y859	I774-Y786 HydrophobicContact CG2-CD2 4.21Å; A782-Y786 VanDerWaalsContact O-CB 3.23Å; A782-Y786 WeakPolarHBondContact O-CB 3.37Å; A782-Y786 PolarHBondContact O-N 2.72Å; G783-Y786 PolarHBondContact O-N 3.24Å; T784-Y786 VanDerWaalsContact C-N 3.27Å; T784-Y786 PolarHBondContact O-N 3.49Å; Y786-L789 PolarHBondContact O-N 3.44Å; Y786-C790 WeakPolarHBondContact O-CB 3.36Å; Y786-C790 PolarHBondContact O-N 3.39Å; Y786-C790 PolarHBondContact O-SG 3.33Å; Y786-L822 HydrophobicContact CD2-CD2 3.87Å; Y786-L822 HydrophobicContact CE2-CB 4.32Å; Y786-L822 HydrophobicContact CE2-CD2 3.48Å; Y786-L822 VanDerWaalsContact CE2-CD2 3.48Å; Y786-F825 AromaticContact CD1-CD1 3.82Å; Y786-F825 HydrophobicContact CD1-CD1 3.82Å; Y786-F825 AromaticContact CD1-CE1 3.57Å; Y786-F825 HydrophobicContact CD1-CE1 3.57Å; Y786-F825 HydrophobicContact CD1-CZ 4.09Å; Y786-F825 HydrophobicContact CD2-CB 3.72Å; Y786-F825 AromaticContact CD2-CD1 3.32Å; Y786-F825 HydrophobicContact CD2-CD1 3.32Å; Y786-F825 AromaticContact CD2-CD2 3.68Å; Y786-F825 HydrophobicContact CD2-CD2 3.68Å; Y786-F825 AromaticContact CD2-CE1 3.81Å; Y786-F825 HydrophobicContact CD2-CE1 3.81Å; Y786-F825 HydrophobicContact CD2-CE2 4.12Å; Y786-F825 AromaticContact CD2-CG 3.26Å; Y786-F825 HydrophobicContact CD2-CG 3.26Å; Y786-F825 HydrophobicContact CD2-CZ 4.19Å; Y786-F825 AromaticContact CE1-CD1 3.85Å; Y786-F825 HydrophobicContact CE1-CD1 3.85Å; Y786-F825 AromaticContact CE1-CE1 3.92Å; Y786-F825 HydrophobicContact CE1-CE1 3.92Å; Y786-F825 HydrophobicContact CE2-CB 3.58Å; Y786-F825 AromaticContact CE2-CD1 3.33Å; Y786-F825 HydrophobicContact CE2-CD1 3.33Å; Y786-F825 HydrophobicContact CE2-CD2 4.36Å; Y786-F825 HydrophobicContact CE2-CE1 4.12Å; Y786-F825 AromaticContact CE2-CG 3.5Å; Y786-F825 HydrophobicContact CE2-CG 3.5Å; Y786-F825 VanDerWaalsContact CE2-CG 3.5Å; Y786-F825 AromaticContact CG-CD1 3.55Å; Y786-F825 HydrophobicContact CG-CD1 3.55Å; Y786-F825 HydrophobicContact CG-CD2 4.01Å; Y786-F825 AromaticContact CG-CE1 3.5Å; Y786-F825 HydrophobicContact CG-CE1 3.5Å; Y786-F825 VanDerWaalsContact CG-CE1 3.5Å; Y786-F825 AromaticContact CG-CE2 3.95Å; Y786-F825 HydrophobicContact CG-CE2 3.95Å; Y786-F825 AromaticContact CG-CG 3.83Å; Y786-F825 HydrophobicContact CG-CG 3.83Å; Y786-F825 AromaticContact CG-CZ 3.71Å; Y786-F825 HydrophobicContact CG-CZ 3.71Å; Y786-F825 AromaticContact CZ-CD1 3.59Å; Y786-L826 WeakPolarHBondContact OH-CD2 3.38Å; Y786-L826 WeakPolarHBondContact OH-CG 3.47Å; Y786-F855 HydrophobicContact CD1-CB 4.23Å; Y786-F855 HydrophobicContact CD1-CD1 4.01Å; Y786-F855 HydrophobicContact CD1-CG 4.39Å; Y786-F855 HydrophobicContact CE1-CB 4Å; Y786-Y859 WeakPolarHBondContact OH-CB 3.22Å
787	L	95.2	Very high	92.8	Very high	46 Å²	46	26.6 Å²	26.6	24%	0.241	15%	0.148	C	C	.	.	H	α-helix	trans	-64.3	-50.8	177.4	-71.2	172.7	0	0	0	111	G783 T784 L789 C790 D791 F855	G783-L787 WeakPolarHBondContact O-CG 3.4Å; G783-L787 PolarHBondContact O-N 3.16Å; T784-L787 PolarHBondContact O-N 2.94Å; L787-L789 VanDerWaalsContact C-N 3.3Å; L787-L789 PolarHBondContact O-N 2.91Å; L787-C790 PolarHBondContact O-N 2.89Å; L787-D791 PolarHBondContact O-N 2.94Å; L787-F855 HydrophobicContact CD1-CD1 4.29Å; L787-F855 HydrophobicContact CD1-CE1 3.89Å; L787-F855 HydrophobicContact CD2-CD1 3.84Å; L787-F855 HydrophobicContact CD2-CE1 4.28Å; L787-F855 HydrophobicContact CG-CD1 3.88Å; L787-F855 HydrophobicContact CG-CE1 3.86Å
788	V	94.8	Very high	92.7	Very high	9 Å²	9	26 Å²	26	6%	0.055	14%	0.135	C	C	.	.	H	α-helix	trans	-56.9	-44.4	176.7	167.2	0	0	0	0	111.2	T732 F736 L766 T784 D791 L792	T732-V788 HydrophobicContact CG2-CB 4.44Å; T732-V788 HydrophobicContact CG2-CG1 4.27Å; T732-V788 HydrophobicContact CG2-CG2 4.32Å; F736-V788 HydrophobicContact CB-CG1 3.95Å; F736-V788 HydrophobicContact CB-CG2 4.2Å; F736-V788 HydrophobicContact CD2-CG1 3.96Å; F736-V788 HydrophobicContact CG-CG1 4.26Å; F736-V788 HydrophobicContact CG-CG2 4.31Å; L766-V788 HydrophobicContact CD2-CG1 4.46Å; T784-V788 HydrophobicContact CG2-CG2 4.35Å; T784-V788 WeakPolarHBondContact O-CB 3.05Å; T784-V788 WeakPolarHBondContact O-CG2 3.12Å; T784-V788 PolarHBondContact O-N 3.22Å; V788-D791 PolarHBondContact O-N 2.91Å; V788-L792 HydrophobicContact CG1-CD1 3.73Å; V788-L792 HydrophobicContact CG1-CG 4.31Å; V788-L792 WeakPolarHBondContact O-CB 3.46Å; V788-L792 WeakPolarHBondContact O-CG 3.45Å; V788-L792 PolarHBondContact O-N 3.49Å
789	L	96.2	Very high	92.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.5	-46.8	176.9	179.5	58.6	0	0	0	112	V767 C770 R771 I774 A785 Y786 L787 D791 L792 L793 L818 L822	V767-L789 HydrophobicContact CB-CD1 4.49Å; V767-L789 HydrophobicContact CG1-CD1 3.88Å; V767-L789 HydrophobicContact CG2-CD1 4.31Å; C770-L789 HydrophobicContact CB-CB 4.11Å; C770-L789 HydrophobicContact CB-CD1 4.46Å; C770-L789 HydrophobicContact CB-CD2 4.49Å; R771-L789 HydrophobicContact CG-CD2 4.46Å; I774-L789 HydrophobicContact CD1-CD2 4.02Å; I774-L789 HydrophobicContact CG2-CD2 4.36Å; A785-L789 WeakPolarHBondContact O-CB 3.49Å; A785-L789 PolarHBondContact O-N 3.31Å; Y786-L789 PolarHBondContact O-N 3.44Å; L787-L789 VanDerWaalsContact C-N 3.3Å; L787-L789 PolarHBondContact O-N 2.91Å; L789-D791 PolarHBondContact O-N 3.23Å; L789-L792 PolarHBondContact O-N 3.25Å; L789-L793 HydrophobicContact CD1-CD1 4.16Å; L789-L793 HydrophobicContact CD1-CG 4.19Å; L789-L793 HydrophobicContact CG-CD1 4.22Å; L789-L793 WeakPolarHBondContact O-CB 3.04Å; L789-L793 WeakPolarHBondContact O-CG 3.32Å; L789-L793 PolarHBondContact O-N 2.94Å; L789-L818 HydrophobicContact CD2-CD1 4.06Å; L789-L822 HydrophobicContact CD2-CD2 3.9Å; L789-L822 HydrophobicContact CG-CD2 4.33Å
790	C	95.4	Very high	92.3	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.007	11%	0.108	C	C	.	.	H	α-helix	trans	-61.8	-43.3	177.3	-69.2	0	0	0	0	112.1	Y786 L787 L793 L794 L862	Y786-C790 WeakPolarHBondContact O-CB 3.36Å; Y786-C790 PolarHBondContact O-N 3.39Å; Y786-C790 PolarHBondContact O-SG 3.33Å; L787-C790 PolarHBondContact O-N 2.89Å; C790-L793 PolarHBondContact O-N 3.37Å; C790-L794 WeakPolarHBondContact O-CB 3.27Å; C790-L794 PolarHBondContact O-N 2.96Å; C790-L862 HydrophobicContact CB-CD1 4.43Å; C790-L862 WeakPolarHBondContact O-CD2 3.41Å
791	D	93.1	Very high	91.8	Very high	30 Å²	30	16.7 Å²	16.7	16%	0.16	9%	0.085	C	C	.	.	H	α-helix	trans	-69.3	-39.3	-179	-67.9	-20.2	0	0	0	111.3	F736 L787 V788 L789 L794 I795	F736-D791 HydrophobicContact CE2-CB 3.9Å; F736-D791 HydrophobicContact CZ-CB 4.1Å; L787-D791 PolarHBondContact O-N 2.94Å; V788-D791 PolarHBondContact O-N 2.91Å; L789-D791 PolarHBondContact O-N 3.23Å; D791-L794 PolarHBondContact O-N 3.32Å; D791-I795 WeakPolarHBondContact O-CB 3.33Å; D791-I795 VanDerWaalsContact O-CG1 3.24Å; D791-I795 WeakPolarHBondContact O-CG1 3.44Å; D791-I795 PolarHBondContact O-N 2.82Å
792	L	93.9	Very high	91.2	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-62.2	-44	172.1	-71.4	170.7	0	0	0	112.3	F736 L739 L763 L766 V767 V788 L789 L794 I795 F796	F736-L792 HydrophobicContact CD2-CD2 3.88Å; F736-L792 HydrophobicContact CD2-CG 3.95Å; F736-L792 HydrophobicContact CE2-CD2 4.22Å; F736-L792 HydrophobicContact CE2-CG 4.27Å; L739-L792 HydrophobicContact CD1-CD1 4.39Å; L739-L792 HydrophobicContact CD1-CD2 3.78Å; L763-L792 HydrophobicContact CD1-CB 4.35Å; L763-L792 HydrophobicContact CD1-CD1 4.49Å; L763-L792 HydrophobicContact CD1-CD2 4.07Å; L766-L792 HydrophobicContact CD2-CD1 3.85Å; L766-L792 HydrophobicContact CG-CD1 4.31Å; V767-L792 HydrophobicContact CG2-CD1 4.41Å; V788-L792 HydrophobicContact CG1-CD1 3.73Å; V788-L792 HydrophobicContact CG1-CG 4.31Å; V788-L792 WeakPolarHBondContact O-CB 3.46Å; V788-L792 WeakPolarHBondContact O-CG 3.45Å; V788-L792 PolarHBondContact O-N 3.49Å; L789-L792 PolarHBondContact O-N 3.25Å; L792-L794 VanDerWaalsContact C-N 3.26Å; L792-L794 PolarHBondContact O-N 3.39Å; L792-I795 PolarHBondContact O-N 3.22Å; L792-F796 HydrophobicContact CD2-CD2 4Å; L792-F796 HydrophobicContact CD2-CE2 3.73Å; L792-F796 WeakPolarHBondContact O-CB 3.41Å; L792-F796 WeakPolarHBondContact O-CD2 3.22Å; L792-F796 PolarHBondContact O-N 2.73Å
793	L	94.3	Very high	90.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.5	-30.5	176.8	-70.9	178.5	0	0	0	112.6	L789 C790 G797 F812 V814 L818 L822 L862 V867	L789-L793 HydrophobicContact CD1-CD1 4.16Å; L789-L793 HydrophobicContact CD1-CG 4.19Å; L789-L793 HydrophobicContact CG-CD1 4.22Å; L789-L793 WeakPolarHBondContact O-CB 3.04Å; L789-L793 WeakPolarHBondContact O-CG 3.32Å; L789-L793 PolarHBondContact O-N 2.94Å; C790-L793 PolarHBondContact O-N 3.37Å; L793-G797 WeakPolarHBondContact O-CA 3.47Å; L793-G797 PolarHBondContact O-N 3.41Å; L793-F812 HydrophobicContact CD2-CD1 3.33Å; L793-F812 HydrophobicContact CD2-CE1 3.67Å; L793-F812 HydrophobicContact CD2-CG 4.11Å; L793-V814 HydrophobicContact CD1-CG2 4Å; L793-V814 HydrophobicContact CD2-CG2 3.79Å; L793-V814 HydrophobicContact CG-CG2 4.36Å; L793-L818 HydrophobicContact CD1-CD2 4.18Å; L793-L818 HydrophobicContact CD2-CD2 4.24Å; L793-L822 HydrophobicContact CD1-CD1 3.88Å; L793-L862 HydrophobicContact CB-CD2 3.88Å; L793-L862 HydrophobicContact CD1-CD1 4.38Å; L793-V867 HydrophobicContact CB-CG1 4.29Å; L793-V867 WeakPolarHBondContact O-CG1 3.45Å
794	L	92.3	Very high	90.1	Very high	29 Å²	29	28.2 Å²	28.2	15%	0.152	14%	0.138	C	C	.	.	H	α-helix	trans	-74.8	-48.5	175.1	-172.6	64.3	0	0	0	111.9	C790 D791 L792 G797 K861 L862 W865 V867	C790-L794 WeakPolarHBondContact O-CB 3.27Å; C790-L794 PolarHBondContact O-N 2.96Å; D791-L794 PolarHBondContact O-N 3.32Å; L792-L794 VanDerWaalsContact C-N 3.26Å; L792-L794 PolarHBondContact O-N 3.39Å; L794-G797 PolarHBondContact O-N 2.81Å; L794-K861 HydrophobicContact CD2-CB 4.22Å; L794-K861 HydrophobicContact CD2-CD 4.23Å; L794-L862 HydrophobicContact CB-CD2 4.08Å; L794-W865 HydrophobicContact CD1-CB 3.75Å; L794-W865 HydrophobicContact CD1-CG 3.84Å; L794-V867 HydrophobicContact CD1-CG2 4.25Å
795	I	90.2	Very high	89.7	Confident	15 Å²	15	29.6 Å²	29.6	8%	0.077	15%	0.152	C	C	.	.	H	α-helix	trans	-68.6	-49	-176.5	-68.8	168.4	0	0	0	110.9	A17 L740 L743 D791 L792 G797	A17-I795 HydrophobicContact CB-CD1 4.01Å; L740-I795 HydrophobicContact CD2-CD1 3.63Å; L740-I795 HydrophobicContact CD2-CG2 4.33Å; L743-I795 HydrophobicContact CD2-CG2 3.63Å; D791-I795 WeakPolarHBondContact O-CB 3.33Å; D791-I795 VanDerWaalsContact O-CG1 3.24Å; D791-I795 WeakPolarHBondContact O-CG1 3.44Å; D791-I795 PolarHBondContact O-N 2.82Å; L792-I795 PolarHBondContact O-N 3.22Å; I795-G797 PolarHBondContact O-N 3.05Å
796	F	92.4	Very high	89.2	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	20.2	175.9	-63.1	-82.8	0	0	0	112.8	L743 L759 L763 L792 L810 I811 F812	L743-F796 HydrophobicContact CB-CZ 4.39Å; L743-F796 HydrophobicContact CD1-CE1 4.36Å; L743-F796 HydrophobicContact CD2-CE1 4.09Å; L743-F796 HydrophobicContact CD2-CZ 4.05Å; L759-F796 HydrophobicContact CD1-CZ 4.23Å; L759-F796 HydrophobicContact CD2-CE1 4.13Å; L759-F796 HydrophobicContact CD2-CZ 4.45Å; L759-F796 HydrophobicContact CG-CE1 4.32Å; L763-F796 HydrophobicContact CD1-CD2 3.61Å; L763-F796 HydrophobicContact CD1-CE2 3.9Å; L763-F796 HydrophobicContact CD1-CG 4.07Å; L763-F796 HydrophobicContact CD2-CB 3.8Å; L763-F796 HydrophobicContact CD2-CD1 3.68Å; L763-F796 HydrophobicContact CD2-CD2 3.98Å; L763-F796 HydrophobicContact CD2-CE1 4.23Å; L763-F796 HydrophobicContact CD2-CE2 4.5Å; L763-F796 HydrophobicContact CD2-CG 3.53Å; L763-F796 HydrophobicContact CG-CD2 4.44Å; L763-F796 HydrophobicContact CG-CG 4.45Å; L792-F796 HydrophobicContact CD2-CD2 4Å; L792-F796 HydrophobicContact CD2-CE2 3.73Å; L792-F796 WeakPolarHBondContact O-CB 3.41Å; L792-F796 WeakPolarHBondContact O-CD2 3.22Å; L792-F796 PolarHBondContact O-N 2.73Å; F796-L810 HydrophobicContact CD1-CB 4.14Å; F796-L810 HydrophobicContact CE1-CD1 4.23Å; F796-I811 WeakPolarHBondContact O-CA 3.34Å; F796-F812 HydrophobicContact CB-CB 4.33Å; F796-F812 PolarHBondContact O-N 2.95Å
797	G	88.5	Confident	88.8	Confident	2 Å²	2	34.3 Å²	34.3	2%	0.021	17%	0.174	C	C	.	.	S	Bend	trans	-70.4	-166.4	171.7	0	0	0	0	0	112.8	L793 L794 I795 T799 V800	L793-G797 WeakPolarHBondContact O-CA 3.47Å; L793-G797 PolarHBondContact O-N 3.41Å; L794-G797 PolarHBondContact O-N 2.81Å; I795-G797 PolarHBondContact O-N 3.05Å; G797-T799 PolarHBondContact O-N 2.92Å; G797-V800 WeakPolarHBondContact O-CG1 3.28Å; G797-V800 PolarHBondContact O-N 2.87Å
798	W	85	Confident	88.6	Confident	124 Å²	124	37.9 Å²	37.9	47%	0.47	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-9.8	-179.8	71.1	-81	0	0	0	114.8	Q802 W865	W798-Q802 VanDerWaalsContact CE3-NE2 3.35Å; W798-Q802 VanDerWaalsContact CH2-NE2 3.29Å; W798-W865 PolarHBondContact NE1-O 3.26Å
799	T	84	Confident	88.4	Confident	31 Å²	31	40.8 Å²	40.8	19%	0.19	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-34.2	-179.3	39.7	0	0	0	0	113.9	G797 G801 Q802	G797-T799 PolarHBondContact O-N 2.92Å; T799-G801 VanDerWaalsContact C-N 3.26Å; T799-G801 PolarHBondContact O-N 2.98Å; T799-Q802 WeakPolarHBondContact O-CB 3.23Å; T799-Q802 WeakPolarHBondContact O-CG 3.36Å; T799-Q802 PolarHBondContact O-N 3.36Å; T799-Q802 VanDerWaalsContact O-N 3.16Å
800	V	84.4	Confident	88.2	Confident	10 Å²	10	41 Å²	41	6%	0.061	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-33.1	-172.9	73.8	0	0	0	0	113.2	L743 G797 L807 L810 I811	L743-V800 HydrophobicContact CD1-CG2 3.83Å; L743-V800 HydrophobicContact CD2-CG2 4.36Å; G797-V800 WeakPolarHBondContact O-CG1 3.28Å; G797-V800 PolarHBondContact O-N 2.87Å; V800-L807 HydrophobicContact CG2-CB 4.45Å; V800-L807 HydrophobicContact CG2-CD1 4.31Å; V800-L810 HydrophobicContact CG1-CB 4.34Å; V800-I811 HydrophobicContact CG1-CG1 3.87Å
801	G	79.9	Confident	88	Confident	3 Å²	3	43.7 Å²	43.7	3%	0.031	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	18.6	-179.4	0	0	0	0	0	115.4	T799 I804 K808	T799-G801 VanDerWaalsContact C-N 3.26Å; T799-G801 PolarHBondContact O-N 2.98Å; G801-I804 CarbonylContact C-O 3.44Å; G801-K808 WeakPolarHBondContact O-CE 3.38Å; G801-K808 WeakPolarHBondContact O-CG 3.49Å
802	Q	80.9	Confident	88	Confident	97 Å²	97	44.9 Å²	44.9	45%	0.453	22%	0.224	S	C	.	.	S	Bend	trans	-77.5	-48.4	-178.5	-75.4	-176.9	14.3	0	0	113.4	W798 T799	W798-Q802 VanDerWaalsContact CE3-NE2 3.35Å; W798-Q802 VanDerWaalsContact CH2-NE2 3.29Å; T799-Q802 WeakPolarHBondContact O-CB 3.23Å; T799-Q802 WeakPolarHBondContact O-CG 3.36Å; T799-Q802 PolarHBondContact O-N 3.36Å; T799-Q802 VanDerWaalsContact O-N 3.16Å
803	E	80.6	Confident	87.9	Confident	131 Å²	131	51.2 Å²	51.2	61%	0.612	26%	0.256	S	S	*	.	S	Bend	trans	-89.1	-37.5	-176.1	-75.2	168.5	-175.1	0	0	111.9	R12	R12-E803 WeakPolarHBondContact CD-OE2 3.48Å; R12-E803 IonicContact CZ-OE1 2.7Å; R12-E803 IonicContact CZ-OE2 3.17Å; R12-E803 VanDerWaalsContact CZ-OE2 3.25Å; R12-E803 IonicContact NE-OE1 3.54Å; R12-E803 IonicContact NE-OE2 2.68Å; R12-E803 IonicContact NH1-OE1 2.72Å; R12-E803 PolarHBondContact NH1-OE1 3.01Å; R12-E803 VanDerWaalsContact NH1-OE1 3.14Å; R12-E803 IonicContact NH1-OE2 3.37Å; R12-E803 PolarHBondContact NH1-OE2 3.31Å; R12-E803 IonicContact NH2-OE1 3.53Å; R12-E803 PolarHBondContact NH2-OE1 2.92Å
804	I	84	Confident	87.9	Confident	35 Å²	35	52.3 Å²	52.3	18%	0.179	26%	0.263	C	S	.	.			trans	-113.7	119.3	-179.2	-56.8	175.9	0	0	0	108.2	E747 L751 G801 E806 L807	E747-I804 HydrophobicContact CB-CD1 4.32Å; E747-I804 HydrophobicContact CG-CD1 4.2Å; L751-I804 HydrophobicContact CD2-CG2 3.75Å; G801-I804 CarbonylContact C-O 3.44Å; I804-E806 HydrophobicContact CG2-CB 4.27Å; I804-E806 VanDerWaalsContact CG2-OE2 3.24Å; I804-E806 WeakPolarHBondContact CG2-OE2 3.36Å; I804-E806 PolarHBondContact O-N 2.95Å; I804-L807 HydrophobicContact CB-CB 4.47Å; I804-L807 HydrophobicContact CB-CD1 3.93Å; I804-L807 HydrophobicContact CB-CG 3.9Å; I804-L807 HydrophobicContact CD1-CD1 4.08Å; I804-L807 HydrophobicContact CG1-CD1 4.49Å; I804-L807 HydrophobicContact CG2-CD1 4.27Å; I804-L807 HydrophobicContact CG2-CG 3.81Å; I804-L807 PolarHBondContact O-N 3.11Å
805	A	86	Confident	88	Confident	57 Å²	57	57.3 Å²	57.3	47%	0.471	28%	0.284	S	S	.	.	S	Bend	trans	-73.1	-31.1	-169.8	0	0	0	0	0	112.6	L807 K808	A805-L807 VanDerWaalsContact C-N 3.28Å; A805-L807 PolarHBondContact O-N 2.99Å; A805-K808 VanDerWaalsContact O-CB 3.27Å; A805-K808 WeakPolarHBondContact O-CB 3.43Å; A805-K808 WeakPolarHBondContact O-CD 3.46Å; A805-K808 VanDerWaalsContact O-CG 3.26Å; A805-K808 WeakPolarHBondContact O-CG 3.42Å; A805-K808 PolarHBondContact O-N 3.2Å
806	E	85.5	Confident	88.1	Confident	100 Å²	100	61.2 Å²	61.2	47%	0.467	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-62.3	-36.7	178.5	-63.4	69.3	-157.3	0	0	110.9	I756 I804 K808 T809	I756-E806 HydrophobicContact CD1-CB 3.94Å; I804-E806 HydrophobicContact CG2-CB 4.27Å; I804-E806 VanDerWaalsContact CG2-OE2 3.24Å; I804-E806 WeakPolarHBondContact CG2-OE2 3.36Å; I804-E806 PolarHBondContact O-N 2.95Å; E806-K808 PolarHBondContact O-N 3.37Å; E806-T809 PolarHBondContact O-N 3.03Å; E806-T809 PolarHBondContact O-OG1 3.23Å
807	L	88.4	Confident	88.2	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-69	-11.8	177.9	-61.1	-171.3	0	0	0	113.9	L743 I746 E747 I756 V800 I804 A805 T809 L810	L743-L807 HydrophobicContact CD1-CD1 4.39Å; I746-L807 HydrophobicContact CB-CD2 4.5Å; I746-L807 HydrophobicContact CG2-CD2 3.52Å; E747-L807 HydrophobicContact CG-CD1 3.79Å; I756-L807 HydrophobicContact CD1-CD2 4.46Å; I756-L807 HydrophobicContact CG1-CD2 4.48Å; V800-L807 HydrophobicContact CG2-CB 4.45Å; V800-L807 HydrophobicContact CG2-CD1 4.31Å; I804-L807 HydrophobicContact CB-CB 4.47Å; I804-L807 HydrophobicContact CB-CD1 3.93Å; I804-L807 HydrophobicContact CB-CG 3.9Å; I804-L807 HydrophobicContact CD1-CD1 4.08Å; I804-L807 HydrophobicContact CG1-CD1 4.49Å; I804-L807 HydrophobicContact CG2-CD1 4.27Å; I804-L807 HydrophobicContact CG2-CG 3.81Å; I804-L807 PolarHBondContact O-N 3.11Å; A805-L807 VanDerWaalsContact C-N 3.28Å; A805-L807 PolarHBondContact O-N 2.99Å; L807-T809 PolarHBondContact O-N 3.29Å; L807-T809 VanDerWaalsContact O-N 3.08Å; L807-L810 HydrophobicContact CD2-CD1 3.8Å; L807-L810 WeakPolarHBondContact O-CB 3.47Å; L807-L810 PolarHBondContact O-N 3.36Å
808	K	89.9	Confident	88.5	Confident	121 Å²	121	64.5 Å²	64.5	53%	0.526	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-58	-24	173.2	-68.6	174.3	-178.2	171.5	0	112.6	G801 A805 E806 L810 I811	G801-K808 WeakPolarHBondContact O-CE 3.38Å; G801-K808 WeakPolarHBondContact O-CG 3.49Å; A805-K808 VanDerWaalsContact O-CB 3.27Å; A805-K808 WeakPolarHBondContact O-CB 3.43Å; A805-K808 WeakPolarHBondContact O-CD 3.46Å; A805-K808 VanDerWaalsContact O-CG 3.26Å; A805-K808 WeakPolarHBondContact O-CG 3.42Å; A805-K808 PolarHBondContact O-N 3.2Å; E806-K808 PolarHBondContact O-N 3.37Å; K808-L810 PolarHBondContact O-N 3.49Å; K808-I811 HydrophobicContact CB-CD1 4.11Å; K808-I811 HydrophobicContact CG-CD1 4.24Å; K808-I811 WeakPolarHBondContact O-CG1 3.47Å; K808-I811 PolarHBondContact O-N 3.45Å
809	T	90.9	Very high	89	Confident	70 Å²	70	60.5 Å²	60.5	43%	0.429	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-67.1	-21.5	174.8	60.5	0	0	0	0	113.4	I756 K760 E806 L807	I756-T809 WeakPolarHBondContact CG2-OG1 3.41Å; K760-T809 WeakPolarHBondContact CD-O 3.38Å; K760-T809 VanDerWaalsContact CE-O 3.24Å; K760-T809 WeakPolarHBondContact CE-O 3.32Å; K760-T809 PolarHBondContact NZ-O 2.92Å; E806-T809 PolarHBondContact O-N 3.03Å; E806-T809 PolarHBondContact O-OG1 3.23Å; L807-T809 PolarHBondContact O-N 3.29Å; L807-T809 VanDerWaalsContact O-N 3.08Å
810	L	91.9	Very high	89.5	Confident	3 Å²	3	63.7 Å²	63.7	2%	0.016	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-85.4	-10.5	178.1	-58.4	-178.8	0	0	0	113.9	L743 I756 L759 K760 F796 V800 L807 K808 F812	L743-L810 HydrophobicContact CD1-CD1 4.22Å; I756-L810 HydrophobicContact CG2-CD2 3.88Å; I756-L810 HydrophobicContact CG2-CG 4.15Å; I756-L810 WeakPolarHBondContact O-CD2 3.44Å; L759-L810 HydrophobicContact CB-CD2 4.44Å; L759-L810 HydrophobicContact CD2-CD1 3.76Å; L759-L810 HydrophobicContact CD2-CD2 4.5Å; L759-L810 HydrophobicContact CG-CD1 4.41Å; L759-L810 HydrophobicContact CG-CD2 4.32Å; K760-L810 HydrophobicContact CB-CD2 3.79Å; F796-L810 HydrophobicContact CD1-CB 4.14Å; F796-L810 HydrophobicContact CE1-CD1 4.23Å; V800-L810 HydrophobicContact CG1-CB 4.34Å; L807-L810 HydrophobicContact CD2-CD1 3.8Å; L807-L810 WeakPolarHBondContact O-CB 3.47Å; L807-L810 PolarHBondContact O-N 3.36Å; K808-L810 PolarHBondContact O-N 3.49Å; L810-F812 PolarHBondContact O-N 3.49Å; L810-F812 VanDerWaalsContact O-N 3.09Å
811	I	92.6	Very high	90.1	Very high	59 Å²	59	65.3 Å²	65.3	30%	0.303	34%	0.336	S	S	.	.			trans	-59	116.2	-176.4	-64.5	170.3	0	0	0	110	F796 V800 K808 I813	F796-I811 WeakPolarHBondContact O-CA 3.34Å; V800-I811 HydrophobicContact CG1-CG1 3.87Å; K808-I811 HydrophobicContact CB-CD1 4.11Å; K808-I811 HydrophobicContact CG-CD1 4.24Å; K808-I811 WeakPolarHBondContact O-CG1 3.47Å; K808-I811 PolarHBondContact O-N 3.45Å; I811-I813 HydrophobicContact CG2-CG1 4.44Å
812	F	92.7	Very high	90.9	Very high	54 Å²	54	65.2 Å²	65.2	24%	0.237	34%	0.335	C	S	.	.			trans	-89	115.4	177.1	-164.1	-76.9	0	0	0	110	L763 V767 L793 F796 L810 L818	L763-F812 HydrophobicContact CD2-CD2 4.4Å; V767-F812 HydrophobicContact CB-CE2 4.24Å; V767-F812 HydrophobicContact CB-CZ 4.43Å; V767-F812 HydrophobicContact CG1-CE1 4.39Å; V767-F812 HydrophobicContact CG1-CE2 3.94Å; V767-F812 HydrophobicContact CG1-CZ 3.63Å; V767-F812 HydrophobicContact CG2-CE2 4.24Å; L793-F812 HydrophobicContact CD2-CD1 3.33Å; L793-F812 HydrophobicContact CD2-CE1 3.67Å; L793-F812 HydrophobicContact CD2-CG 4.11Å; F796-F812 HydrophobicContact CB-CB 4.33Å; F796-F812 PolarHBondContact O-N 2.95Å; L810-F812 PolarHBondContact O-N 3.49Å; L810-F812 VanDerWaalsContact O-N 3.09Å; F812-L818 HydrophobicContact CE1-CD2 3.96Å
813	I	92.5	Very high	91.5	Very high	134 Å²	134	62.4 Å²	62.4	69%	0.687	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-92.3	116.3	177.1	-58.8	176.4	0	0	0	108.7	I811 K815	I811-I813 HydrophobicContact CG2-CG1 4.44Å; I813-K815 PolarHBondContact O-N 2.83Å
814	V	93.5	Very high	92.2	Very high	24 Å²	24	59 Å²	59	15%	0.145	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-63.9	129	173.5	-176.8	0	0	0	0	109.5	L793 L818 E819 V867 L868	L793-V814 HydrophobicContact CD1-CG2 4Å; L793-V814 HydrophobicContact CD2-CG2 3.79Å; L793-V814 HydrophobicContact CG-CG2 4.36Å; V814-L818 HydrophobicContact CG1-CB 4.12Å; V814-L818 HydrophobicContact CG1-CD2 4.15Å; V814-L818 HydrophobicContact CG1-CG 4.03Å; V814-E819 HydrophobicContact CG1-CB 4.39Å; V814-V867 HydrophobicContact CG2-CG1 3.79Å; V814-L868 HydrophobicContact CB-CD2 4.15Å; V814-L868 HydrophobicContact CG1-CD2 3.75Å; V814-L868 HydrophobicContact CG2-CD2 4.33Å
815	K	93.6	Very high	92.8	Very high	134 Å²	134	57.7 Å²	57.7	58%	0.583	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-95.9	156.6	174	-62.8	-179.6	-178.6	175.6	0	110.2	I813 D817 L818 E819	I813-K815 PolarHBondContact O-N 2.83Å; K815-D817 VanDerWaalsContact C-N 3.27Å; K815-D817 WeakPolarHBondContact CB-OD1 3.3Å; K815-D817 PolarHBondContact O-N 2.92Å; K815-L818 WeakPolarHBondContact O-CB 3.17Å; K815-L818 PolarHBondContact O-N 2.91Å; K815-E819 PolarHBondContact O-N 3.26Å; K815-E819 VanDerWaalsContact O-N 3.11Å
816	P	93.4	Very high	93.2	Very high	96 Å²	96	55.1 Å²	55.1	62%	0.623	29%	0.288	S	S	*	.	H	α-helix	trans	-55.8	-37.1	-176.9	-27.3	36	0	0	0	114.4	L818 E819 D820	P816-L818 VanDerWaalsContact C-N 3.29Å; P816-L818 PolarHBondContact O-N 3.27Å; P816-E819 WeakPolarHBondContact O-CB 3.49Å; P816-E819 PolarHBondContact O-N 3.09Å; P816-D820 PolarHBondContact O-N 3.43Å
817	D	94.6	Very high	93.5	Very high	69 Å²	69	52.3 Å²	52.3	37%	0.369	29%	0.286	S	S	.	.	H	α-helix	trans	-59.1	-38.1	176.5	53.2	-57.1	0	0	0	113	R771 K815 E821	R771-D817 IonicContact CZ-OD2 2.67Å; R771-D817 VanDerWaalsContact CZ-OD2 3.23Å; R771-D817 IonicContact NH1-OD2 2.63Å; R771-D817 PolarHBondContact NH1-OD2 2.86Å; R771-D817 IonicContact NH2-OD2 3.49Å; R771-D817 PolarHBondContact NH2-OD2 2.88Å; K815-D817 VanDerWaalsContact C-N 3.27Å; K815-D817 WeakPolarHBondContact CB-OD1 3.3Å; K815-D817 PolarHBondContact O-N 2.92Å; D817-E821 VanDerWaalsContact O-CG 3.3Å; D817-E821 WeakPolarHBondContact O-CG 3.44Å; D817-E821 PolarHBondContact O-N 3.35Å
818	L	95.2	Very high	93.7	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-75.8	-32.4	174.9	176.3	55	0	0	0	112	R771 L789 L793 F812 V814 K815 P816 L822	R771-L818 HydrophobicContact CG-CD1 3.65Å; L789-L818 HydrophobicContact CD2-CD1 4.06Å; L793-L818 HydrophobicContact CD1-CD2 4.18Å; L793-L818 HydrophobicContact CD2-CD2 4.24Å; F812-L818 HydrophobicContact CE1-CD2 3.96Å; V814-L818 HydrophobicContact CG1-CB 4.12Å; V814-L818 HydrophobicContact CG1-CD2 4.15Å; V814-L818 HydrophobicContact CG1-CG 4.03Å; K815-L818 WeakPolarHBondContact O-CB 3.17Å; K815-L818 PolarHBondContact O-N 2.91Å; P816-L818 VanDerWaalsContact C-N 3.29Å; P816-L818 PolarHBondContact O-N 3.27Å; L818-L822 HydrophobicContact CD1-CD1 4.45Å; L818-L822 HydrophobicContact CD1-CG 4.3Å; L818-L822 HydrophobicContact CG-CD1 4.41Å; L818-L822 VanDerWaalsContact O-CG 3.28Å; L818-L822 WeakPolarHBondContact O-CG 3.44Å; L818-L822 PolarHBondContact O-N 3.18Å; L818-L822 VanDerWaalsContact O-N 3.1Å
819	E	94.8	Very high	93.8	Very high	40 Å²	40	53.7 Å²	53.7	19%	0.187	29%	0.29	C	S	.	.	H	α-helix	trans	-64.1	-44.7	174.2	-170.2	180	150.5	0	0	111.1	V814 K815 P816 L822 Q823 L868 S872	V814-E819 HydrophobicContact CG1-CB 4.39Å; K815-E819 PolarHBondContact O-N 3.26Å; K815-E819 VanDerWaalsContact O-N 3.11Å; P816-E819 WeakPolarHBondContact O-CB 3.49Å; P816-E819 PolarHBondContact O-N 3.09Å; E819-L822 PolarHBondContact O-N 2.9Å; E819-Q823 VanDerWaalsContact O-CG 3.3Å; E819-Q823 WeakPolarHBondContact O-CG 3.29Å; E819-Q823 PolarHBondContact O-N 2.99Å; E819-Q823 PolarHBondContact OE1-NE2 3.45Å; E819-Q823 VanDerWaalsContact OE1-NE2 3.16Å; E819-L868 HydrophobicContact CB-CD2 4.3Å; E819-L868 HydrophobicContact CG-CD2 3.88Å; E819-S872 WeakPolarHBondContact OE1-CB 3.29Å; E819-S872 PolarHBondContact OE1-OG 3.3Å; E819-S872 PolarHBondContact OE2-OG 3.27Å
820	D	95	Very high	93.9	Very high	99 Å²	99	50.4 Å²	50.4	53%	0.529	27%	0.27	S	S	.	.	H	α-helix	trans	-61.7	-42.7	176.7	-65.7	-24.6	0	0	0	111.6	P816 L822 Q823 A824	P816-D820 PolarHBondContact O-N 3.43Å; D820-L822 PolarHBondContact O-N 3.1Å; D820-Q823 PolarHBondContact O-N 3.13Å; D820-A824 WeakPolarHBondContact O-CB 3.44Å; D820-A824 PolarHBondContact O-N 3.37Å
821	E	95.7	Very high	93.9	Very high	44 Å²	44	51.4 Å²	51.4	21%	0.206	27%	0.274	C	S	.	.	H	α-helix	trans	-59.9	-43.6	174.8	-76.1	166.3	-169	0	0	112.5	R771 I774 D817 A824 F825	R771-E821 IonicContact CZ-OE1 3.07Å; R771-E821 IonicContact CZ-OE2 2.9Å; R771-E821 IonicContact NE-OE1 3.3Å; R771-E821 IonicContact NE-OE2 3.74Å; R771-E821 PolarHBondContact NE-OE2 3.13Å; R771-E821 VanDerWaalsContact NH2-CD 3.27Å; R771-E821 IonicContact NH2-OE1 3.23Å; R771-E821 PolarHBondContact NH2-OE1 3.43Å; R771-E821 IonicContact NH2-OE2 2.75Å; R771-E821 PolarHBondContact NH2-OE2 2.89Å; I774-E821 HydrophobicContact CD1-CB 3.93Å; D817-E821 VanDerWaalsContact O-CG 3.3Å; D817-E821 WeakPolarHBondContact O-CG 3.44Å; D817-E821 PolarHBondContact O-N 3.35Å; E821-A824 PolarHBondContact O-N 3.36Å; E821-F825 PolarHBondContact O-N 3.17Å; E821-F825 VanDerWaalsContact O-N 3.13Å
822	L	96.4	Very high	93.4	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-67.5	-34.6	177.7	-69.9	170.2	0	0	0	112.5	Y786 L789 L793 L818 E819 D820 L826 Y859 L862	Y786-L822 HydrophobicContact CD2-CD2 3.87Å; Y786-L822 HydrophobicContact CE2-CB 4.32Å; Y786-L822 HydrophobicContact CE2-CD2 3.48Å; Y786-L822 VanDerWaalsContact CE2-CD2 3.48Å; L789-L822 HydrophobicContact CD2-CD2 3.9Å; L789-L822 HydrophobicContact CG-CD2 4.33Å; L793-L822 HydrophobicContact CD1-CD1 3.88Å; L818-L822 HydrophobicContact CD1-CD1 4.45Å; L818-L822 HydrophobicContact CD1-CG 4.3Å; L818-L822 HydrophobicContact CG-CD1 4.41Å; L818-L822 VanDerWaalsContact O-CG 3.28Å; L818-L822 WeakPolarHBondContact O-CG 3.44Å; L818-L822 PolarHBondContact O-N 3.18Å; L818-L822 VanDerWaalsContact O-N 3.1Å; E819-L822 PolarHBondContact O-N 2.9Å; D820-L822 PolarHBondContact O-N 3.1Å; L822-L826 PolarHBondContact O-N 3.38Å; L822-Y859 HydrophobicContact CB-CD2 4.12Å; L822-Y859 HydrophobicContact CB-CE2 3.8Å; L822-L862 HydrophobicContact CD1-CD1 4.18Å
823	Q	95	Very high	92.1	Very high	38 Å²	38	51.3 Å²	51.3	18%	0.178	29%	0.285	C	S	.	.	H	α-helix	trans	-69.6	-43.2	174.7	-70.2	174.1	13.3	0	0	111.4	E819 D820 F825 L826 G827 Y859 E875	E819-Q823 VanDerWaalsContact O-CG 3.3Å; E819-Q823 WeakPolarHBondContact O-CG 3.29Å; E819-Q823 PolarHBondContact O-N 2.99Å; E819-Q823 PolarHBondContact OE1-NE2 3.45Å; E819-Q823 VanDerWaalsContact OE1-NE2 3.16Å; D820-Q823 PolarHBondContact O-N 3.13Å; Q823-F825 VanDerWaalsContact C-N 3.28Å; Q823-F825 PolarHBondContact O-N 3.25Å; Q823-L826 PolarHBondContact O-N 3.13Å; Q823-L826 VanDerWaalsContact O-N 3.13Å; Q823-G827 PolarHBondContact O-N 2.85Å; Q823-G827 VanDerWaalsContact O-N 3.1Å; Q823-Y859 HydrophobicContact CG-CE2 4.39Å; Q823-Y859 WeakPolarHBondContact CG-OH 3.18Å; Q823-Y859 PolarHBondContact NE2-OH 2.95Å; Q823-E875 HydrophobicContact CB-CG 4.31Å; Q823-E875 HydrophobicContact CG-CB 4.38Å; Q823-E875 HydrophobicContact CG-CG 3.85Å
824	A	94.5	Very high	90.5	Very high	61 Å²	61	51.5 Å²	51.5	50%	0.504	29%	0.287	S	S	.	.	H	α-helix	trans	-59.5	-38.2	176.5	0	0	0	0	0	112.2	D820 E821 G827 K828	D820-A824 WeakPolarHBondContact O-CB 3.44Å; D820-A824 PolarHBondContact O-N 3.37Å; E821-A824 PolarHBondContact O-N 3.36Å; A824-G827 PolarHBondContact O-N 3.16Å; A824-K828 PolarHBondContact O-N 3.02Å
825	F	96	Very high	88.8	Confident	6 Å²	6	53.7 Å²	53.7	3%	0.026	30%	0.296	C	S	.	.	H	α-helix	trans	-60	-45.9	173.2	-178	-80.9	0	0	0	112.3	I774 A782 Y786 E821 Q823 G827 K828 W829 F855	I774-F825 HydrophobicContact CB-CD2 4.2Å; A782-F825 HydrophobicContact CB-CE2 3.96Å; A782-F825 WeakPolarHBondContact O-CE2 3.19Å; Y786-F825 AromaticContact CD1-CD1 3.82Å; Y786-F825 HydrophobicContact CD1-CD1 3.82Å; Y786-F825 AromaticContact CD1-CE1 3.57Å; Y786-F825 HydrophobicContact CD1-CE1 3.57Å; Y786-F825 HydrophobicContact CD1-CZ 4.09Å; Y786-F825 HydrophobicContact CD2-CB 3.72Å; Y786-F825 AromaticContact CD2-CD1 3.32Å; Y786-F825 HydrophobicContact CD2-CD1 3.32Å; Y786-F825 AromaticContact CD2-CD2 3.68Å; Y786-F825 HydrophobicContact CD2-CD2 3.68Å; Y786-F825 AromaticContact CD2-CE1 3.81Å; Y786-F825 HydrophobicContact CD2-CE1 3.81Å; Y786-F825 HydrophobicContact CD2-CE2 4.12Å; Y786-F825 AromaticContact CD2-CG 3.26Å; Y786-F825 HydrophobicContact CD2-CG 3.26Å; Y786-F825 HydrophobicContact CD2-CZ 4.19Å; Y786-F825 AromaticContact CE1-CD1 3.85Å; Y786-F825 HydrophobicContact CE1-CD1 3.85Å; Y786-F825 AromaticContact CE1-CE1 3.92Å; Y786-F825 HydrophobicContact CE1-CE1 3.92Å; Y786-F825 HydrophobicContact CE2-CB 3.58Å; Y786-F825 AromaticContact CE2-CD1 3.33Å; Y786-F825 HydrophobicContact CE2-CD1 3.33Å; Y786-F825 HydrophobicContact CE2-CD2 4.36Å; Y786-F825 HydrophobicContact CE2-CE1 4.12Å; Y786-F825 AromaticContact CE2-CG 3.5Å; Y786-F825 HydrophobicContact CE2-CG 3.5Å; Y786-F825 VanDerWaalsContact CE2-CG 3.5Å; Y786-F825 AromaticContact CG-CD1 3.55Å; Y786-F825 HydrophobicContact CG-CD1 3.55Å; Y786-F825 HydrophobicContact CG-CD2 4.01Å; Y786-F825 AromaticContact CG-CE1 3.5Å; Y786-F825 HydrophobicContact CG-CE1 3.5Å; Y786-F825 VanDerWaalsContact CG-CE1 3.5Å; Y786-F825 AromaticContact CG-CE2 3.95Å; Y786-F825 HydrophobicContact CG-CE2 3.95Å; Y786-F825 AromaticContact CG-CG 3.83Å; Y786-F825 HydrophobicContact CG-CG 3.83Å; Y786-F825 AromaticContact CG-CZ 3.71Å; Y786-F825 HydrophobicContact CG-CZ 3.71Å; Y786-F825 AromaticContact CZ-CD1 3.59Å; E821-F825 PolarHBondContact O-N 3.17Å; E821-F825 VanDerWaalsContact O-N 3.13Å; Q823-F825 VanDerWaalsContact C-N 3.28Å; Q823-F825 PolarHBondContact O-N 3.25Å; F825-G827 VanDerWaalsContact C-N 3.34Å; F825-G827 PolarHBondContact O-N 3Å; F825-K828 PolarHBondContact O-N 3.46Å; F825-W829 HydrophobicContact CD1-CB 4.46Å; F825-W829 AromaticContact CD2-CD1 3.42Å; F825-W829 VanDerWaalsContact CD2-CD1 3.42Å; F825-W829 HydrophobicContact CD2-CG 4.5Å; F825-W829 AromaticContact CD2-NE1 3.84Å; F825-W829 HydrophobicContact CE1-CB 4Å; F825-W829 AromaticContact CE1-CD1 3.97Å; F825-W829 HydrophobicContact CE1-CG 4.27Å; F825-W829 AromaticContact CE2-CD1 3.27Å; F825-W829 HydrophobicContact CE2-CG 4.09Å; F825-W829 AromaticContact CE2-NE1 3.61Å; F825-W829 AromaticContact CG-CD1 3.84Å; F825-W829 HydrophobicContact CZ-CB 4.12Å; F825-W829 AromaticContact CZ-CD1 3.56Å; F825-W829 AromaticContact CZ-CG 3.96Å; F825-W829 HydrophobicContact CZ-CG 3.96Å; F825-W829 PolarHBondContact O-N 2.52Å; F825-F855 HydrophobicContact CE1-CB 4.08Å; F825-F855 HydrophobicContact CE1-CD1 4.23Å; F825-F855 AromaticContact CE1-CD2 3.91Å; F825-F855 HydrophobicContact CE1-CD2 3.91Å; F825-F855 HydrophobicContact CE1-CE2 4.4Å; F825-F855 AromaticContact CE1-CG 3.83Å; F825-F855 HydrophobicContact CE1-CG 3.83Å; F825-F855 HydrophobicContact CZ-CD1 4.39Å; F825-F855 HydrophobicContact CZ-CD2 4.21Å; F825-F855 HydrophobicContact CZ-CE1 4.42Å; F825-F855 HydrophobicContact CZ-CE2 4.25Å; F825-F855 HydrophobicContact CZ-CG 4.3Å; F825-F855 HydrophobicContact CZ-CZ 4.36Å
826	L	94.9	Very high	86.9	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.016	30%	0.302	C	S	.	.	H	α-helix	trans	-61.4	-41.9	177.6	-70.4	-177	0	0	0	112	Y786 L822 Q823 K828 V830 F831 L856 Y859 V876	Y786-L826 WeakPolarHBondContact OH-CD2 3.38Å; Y786-L826 WeakPolarHBondContact OH-CG 3.47Å; L822-L826 PolarHBondContact O-N 3.38Å; Q823-L826 PolarHBondContact O-N 3.13Å; Q823-L826 VanDerWaalsContact O-N 3.13Å; L826-K828 VanDerWaalsContact C-N 3.34Å; L826-K828 PolarHBondContact O-N 3.09Å; L826-V830 HydrophobicContact CD2-CB 4.24Å; L826-V830 HydrophobicContact CD2-CG2 3.73Å; L826-V830 WeakPolarHBondContact O-CA 3.14Å; L826-V830 WeakPolarHBondContact O-CB 3.23Å; L826-V830 PolarHBondContact O-N 3.49Å; L826-F831 HydrophobicContact CB-CD2 4.15Å; L826-F831 HydrophobicContact CB-CE2 4.18Å; L826-F831 HydrophobicContact CD1-CE2 4.38Å; L826-F831 PolarHBondContact O-N 3.01Å; L826-L856 HydrophobicContact CD1-CD1 4.34Å; L826-L856 HydrophobicContact CD2-CD1 4.41Å; L826-Y859 HydrophobicContact CD1-CD1 3.47Å; L826-Y859 VanDerWaalsContact CD1-CD1 3.47Å; L826-Y859 HydrophobicContact CD1-CD2 4.12Å; L826-Y859 HydrophobicContact CD1-CE1 3.97Å; L826-Y859 HydrophobicContact CD1-CG 3.55Å; L826-Y859 HydrophobicContact CG-CG 4.4Å; L826-V876 HydrophobicContact CD1-CG2 4.44Å
827	G	92.6	Very high	85.3	Confident	42 Å²	42	55.6 Å²	55.6	43%	0.433	31%	0.312	S	S	.	.	H	α-helix	trans	-60.2	-42.1	175.1	0	0	0	0	0	112.7	Q823 A824 F825	Q823-G827 PolarHBondContact O-N 2.85Å; Q823-G827 VanDerWaalsContact O-N 3.1Å; A824-G827 PolarHBondContact O-N 3.16Å; F825-G827 VanDerWaalsContact C-N 3.34Å; F825-G827 PolarHBondContact O-N 3Å
828	K	92.2	Very high	83.8	Confident	86 Å²	86	53.3 Å²	53.3	37%	0.374	30%	0.299	S	S	.	.	H	α-helix	trans	-71.7	-44.3	-179.6	-174.5	177.6	179.2	-176.6	0	113.3	S776 N777 A824 F825 L826	S776-K828 PolarHBondContact O-NZ 3.01Å; N777-K828 PolarHBondContact OD1-NZ 3.47Å; A824-K828 PolarHBondContact O-N 3.02Å; F825-K828 PolarHBondContact O-N 3.46Å; L826-K828 VanDerWaalsContact C-N 3.34Å; L826-K828 PolarHBondContact O-N 3.09Å
829	W	91.5	Very high	82.4	Confident	64 Å²	64	57.3 Å²	57.3	24%	0.242	32%	0.321	C	S	.	.	H	α-helix	trans	-110.9	-21.5	-165.5	-64.7	108.7	0	0	0	115.5	G779 A782 F825 R852	G779-W829 VanDerWaalsContact CA-CH2 3.41Å; A782-W829 HydrophobicContact CB-CZ2 4.31Å; F825-W829 HydrophobicContact CD1-CB 4.46Å; F825-W829 AromaticContact CD2-CD1 3.42Å; F825-W829 VanDerWaalsContact CD2-CD1 3.42Å; F825-W829 HydrophobicContact CD2-CG 4.5Å; F825-W829 AromaticContact CD2-NE1 3.84Å; F825-W829 HydrophobicContact CE1-CB 4Å; F825-W829 AromaticContact CE1-CD1 3.97Å; F825-W829 HydrophobicContact CE1-CG 4.27Å; F825-W829 AromaticContact CE2-CD1 3.27Å; F825-W829 HydrophobicContact CE2-CG 4.09Å; F825-W829 AromaticContact CE2-NE1 3.61Å; F825-W829 AromaticContact CG-CD1 3.84Å; F825-W829 HydrophobicContact CZ-CB 4.12Å; F825-W829 AromaticContact CZ-CD1 3.56Å; F825-W829 AromaticContact CZ-CG 3.96Å; F825-W829 HydrophobicContact CZ-CG 3.96Å; F825-W829 PolarHBondContact O-N 2.52Å; W829-R852 VanDerWaalsContact O-CD 3.3Å; W829-R852 WeakPolarHBondContact O-CD 3.46Å; W829-R852 WeakPolarHBondContact O-CG 3.49Å; W829-R852 PolarHBondContact O-NE 3.4Å
830	V	92.4	Very high	81.1	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109	-51.5	-176.3	177.8	0	0	0	0	111.7	L826 C832 F855 L856 Y887	L826-V830 HydrophobicContact CD2-CB 4.24Å; L826-V830 HydrophobicContact CD2-CG2 3.73Å; L826-V830 WeakPolarHBondContact O-CA 3.14Å; L826-V830 WeakPolarHBondContact O-CB 3.23Å; L826-V830 PolarHBondContact O-N 3.49Å; V830-C832 PolarHBondContact O-N 3.43Å; V830-F855 HydrophobicContact CG2-CB 3.77Å; V830-F855 HydrophobicContact CG2-CD2 4.21Å; V830-L856 HydrophobicContact CG1-CB 4.06Å; V830-L856 HydrophobicContact CG1-CD2 4.41Å; V830-Y887 HydrophobicContact CG1-CD2 4.3Å; V830-Y887 HydrophobicContact CG1-CE1 4.28Å; V830-Y887 HydrophobicContact CG1-CE2 3.65Å; V830-Y887 PolarHBondContact O-OH 3.46Å
831	F	91.9	Very high	79.8	Confident	25 Å²	25	61.3 Å²	61.3	11%	0.11	34%	0.335	C	S	.	.	S	Bend	trans	-99	51.6	-176.9	-56.3	-60.6	0	0	0	111.8	L826 L856 N879 Y883 Y887	L826-F831 HydrophobicContact CB-CD2 4.15Å; L826-F831 HydrophobicContact CB-CE2 4.18Å; L826-F831 HydrophobicContact CD1-CE2 4.38Å; L826-F831 PolarHBondContact O-N 3.01Å; F831-L856 HydrophobicContact CE1-CD2 4.39Å; F831-L856 HydrophobicContact CE2-CD1 4.11Å; F831-L856 HydrophobicContact CZ-CD1 3.62Å; F831-L856 HydrophobicContact CZ-CD2 4.22Å; F831-N879 HydrophobicContact CD1-CB 3.6Å; F831-N879 VanDerWaalsContact CD2-ND2 3.32Å; F831-N879 WeakPolarHBondContact CD2-ND2 3.26Å; F831-N879 HydrophobicContact CE1-CB 3.42Å; F831-N879 VanDerWaalsContact CE1-CB 3.42Å; F831-N879 HydrophobicContact CE2-CB 4.47Å; F831-N879 WeakPolarHBondContact CE2-ND2 3.41Å; F831-N879 HydrophobicContact CG-CB 4.22Å; F831-N879 WeakPolarHBondContact CG-ND2 3.44Å; F831-N879 HydrophobicContact CZ-CB 3.89Å; F831-Y883 VanDerWaalsContact C-OH 3.23Å; F831-Y883 HydrophobicContact CB-CE2 4.18Å; F831-Y883 AromaticContact CD1-CD2 3.8Å; F831-Y883 HydrophobicContact CD1-CD2 3.8Å; F831-Y883 AromaticContact CD1-CE2 3.98Å; F831-Y883 HydrophobicContact CD1-CE2 3.98Å; F831-Y883 HydrophobicContact CD1-CG 4.18Å; F831-Y883 HydrophobicContact CE1-CD2 4.45Å; F831-Y883 PolarHBondContact O-OH 2.93Å; F831-Y887 HydrophobicContact CD1-CD2 4.12Å; F831-Y887 AromaticContact CD1-CE2 4Å; F831-Y887 HydrophobicContact CD1-CE2 4Å; F831-Y887 AromaticContact CE1-CD2 3.75Å; F831-Y887 HydrophobicContact CE1-CD2 3.75Å; F831-Y887 HydrophobicContact CE1-CE2 4.05Å
832	C	83.2	Confident	78.8	Confident	30 Å²	30	61.8 Å²	61.8	20%	0.203	34%	0.339	C	S	.	.			trans	-97.9	141.6	178.2	56	0	0	0	0	111.5	V830 D834 R852 Y883	V830-C832 PolarHBondContact O-N 3.43Å; C832-D834 PolarHBondContact O-N 3.08Å; C832-R852 PolarHBondContact SG-NH2 3.4Å; C832-Y883 PolarHBondContact N-OH 3.29Å; C832-Y883 PolarHBondContact O-OH 3.06Å; C832-Y883 VanDerWaalsContact O-OH 3.13Å
833	S	65	Low	77.7	Confident	80 Å²	80	66.2 Å²	66.2	56%	0.559	37%	0.367	S	S	*	.	S	Bend	trans	-72.2	-23.2	-173	39.5	0	0	0	0	115.2	Q835	S833-Q835 PolarHBondContact O-N 3.29Å
834	D	59.1	Low	76.7	Confident	138 Å²	138	69.9 Å²	69.9	74%	0.738	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	6.8	-152.8	-56.2	-8.9	0	0	0	113.9	C832	C832-D834 PolarHBondContact O-N 3.08Å
835	Q	56.8	Low	76	Confident	71 Å²	71	69.5 Å²	69.5	33%	0.332	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.5	46.4	-172.3	-64	-174.2	-10.4	0	0	112.5	S833 D837 I838	S833-Q835 PolarHBondContact O-N 3.29Å; Q835-D837 PolarHBondContact O-N 2.82Å; Q835-I838 WeakPolarHBondContact O-CG1 3.5Å
836	T	54.1	Low	75.2	Confident	115 Å²	115	71.6 Å²	71.6	71%	0.706	39%	0.387	S	S	*	.	S	Bend	trans	-71.2	-16	172.2	47.7	0	0	0	0	113.8
837	D	60.6	Low	74.4	Confident	155 Å²	155	74.5 Å²	74.5	83%	0.829	40%	0.4	S	S	*	.			trans	-101.1	56.4	176.6	-69.1	-40.6	0	0	0	112	Q835 D839	Q835-D837 PolarHBondContact O-N 2.82Å; D837-D839 PolarHBondContact O-N 2.68Å; D837-D839 VanDerWaalsContact O-N 3.12Å
838	I	62.4	Low	74.1	Confident	21 Å²	21	75.6 Å²	75.6	11%	0.108	40%	0.395	C	S	.	.			trans	-65.4	107.9	168.2	-67	174.7	0	0	0	108.2	Q835 R840 Q845 L849	Q835-I838 WeakPolarHBondContact O-CG1 3.5Å; I838-R840 HydrophobicContact CG2-CG 4.38Å; I838-R840 PolarHBondContact O-N 3.23Å; I838-Q845 HydrophobicContact CG2-CB 4.09Å; I838-L849 HydrophobicContact CD1-CB 4.39Å; I838-L849 HydrophobicContact CD1-CD1 4.18Å; I838-L849 HydrophobicContact CD1-CD2 4.28Å
839	D	66.8	Low	73.8	Confident	86 Å²	86	72.6 Å²	72.6	46%	0.46	38%	0.383	S	S	.	.			trans	-67.2	108.1	167.4	-170.6	-11.5	0	0	0	108.8	D837 N841 D842	D837-D839 PolarHBondContact O-N 2.68Å; D837-D839 VanDerWaalsContact O-N 3.12Å; D839-N841 PolarHBondContact O-N 3.48Å; D839-N841 WeakPolarHBondContact OD1-CB 3.45Å; D839-N841 PolarHBondContact OD1-N 2.79Å; D839-N841 PolarHBondContact OD1-ND2 3.3Å; D839-D842 HydrophobicContact CB-CB 4.13Å; D839-D842 PolarHBondContact O-N 3.38Å
840	R	67.3	Low	73.5	Confident	119 Å²	119	72.8 Å²	72.8	45%	0.449	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	3.4	-178.5	-64.3	177.9	170.3	-145.6	-16.7	113.5	I838 N885 D886	I838-R840 HydrophobicContact CG2-CG 4.38Å; I838-R840 PolarHBondContact O-N 3.23Å; R840-N885 PolarHBondContact NH2-O 3.11Å; R840-D886 IonicContact CZ-OD1 2.65Å; R840-D886 IonicContact NH2-OD1 2.71Å; R840-D886 PolarHBondContact NH2-OD1 2.72Å
841	N	66.7	Low	73.3	Confident	104 Å²	104	78.4 Å²	78.4	56%	0.556	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	-12.4	171.3	-48.5	-83.5	0	0	0	112.6	D839	D839-N841 PolarHBondContact O-N 3.48Å; D839-N841 WeakPolarHBondContact OD1-CB 3.45Å; D839-N841 PolarHBondContact OD1-N 2.79Å; D839-N841 PolarHBondContact OD1-ND2 3.3Å
842	D	74.4	Confident	73.3	Confident	54 Å²	54	78.7 Å²	78.7	29%	0.289	41%	0.409	S	S	.	.			trans	-86	117.8	179.7	-178.1	-11.5	0	0	0	110.3	D839 D844 Q845 I846	D839-D842 HydrophobicContact CB-CB 4.13Å; D839-D842 PolarHBondContact O-N 3.38Å; D842-D844 VanDerWaalsContact C-N 3.29Å; D842-D844 PolarHBondContact O-N 3.38Å; D842-D844 PolarHBondContact OD1-N 3.28Å; D842-Q845 HydrophobicContact CB-CB 4.1Å; D842-Q845 HydrophobicContact CB-CG 3.85Å; D842-Q845 PolarHBondContact O-N 2.95Å; D842-Q845 WeakPolarHBondContact OD2-CG 3.1Å; D842-I846 VanDerWaalsContact O-CG1 3.31Å; D842-I846 WeakPolarHBondContact O-CG1 3.47Å; D842-I846 PolarHBondContact O-N 3.46Å; D842-I846 VanDerWaalsContact O-N 3.14Å
843	P	73.5	Confident	73.8	Confident	92 Å²	92	79.2 Å²	79.2	60%	0.597	41%	0.407	S	S	*	.	H	α-helix	trans	-60.3	-35.2	-178.6	25.6	-34.7	0	0	0	113.3	I846 E847	P843-I846 PolarHBondContact O-N 3.08Å; P843-E847 PolarHBondContact O-N 3.34Å
844	D	74.7	Confident	75.1	Confident	116 Å²	116	76.9 Å²	76.9	62%	0.62	39%	0.39	S	S	*	.	H	α-helix	trans	-68.2	-40.8	-177.7	-70.7	-15.8	0	0	0	110.5	D842 I846 E847 I848	D842-D844 VanDerWaalsContact C-N 3.29Å; D842-D844 PolarHBondContact O-N 3.38Å; D842-D844 PolarHBondContact OD1-N 3.28Å; D844-I846 VanDerWaalsContact C-N 3.34Å; D844-I846 PolarHBondContact O-N 3Å; D844-E847 PolarHBondContact O-N 3.04Å; D844-I848 VanDerWaalsContact O-CG1 3.31Å; D844-I848 WeakPolarHBondContact O-CG1 3.29Å; D844-I848 PolarHBondContact O-N 2.98Å
845	Q	80.4	Confident	76.8	Confident	52 Å²	52	71.4 Å²	71.4	24%	0.243	36%	0.36	C	S	.	.	H	α-helix	trans	-66.7	-35.4	176.1	-61.7	-63.3	-26.4	0	0	112.1	I838 D842 L849	I838-Q845 HydrophobicContact CG2-CB 4.09Å; D842-Q845 HydrophobicContact CB-CB 4.1Å; D842-Q845 HydrophobicContact CB-CG 3.85Å; D842-Q845 PolarHBondContact O-N 2.95Å; D842-Q845 WeakPolarHBondContact OD2-CG 3.1Å; Q845-L849 WeakPolarHBondContact O-CB 3.25Å; Q845-L849 PolarHBondContact O-N 3.14Å
846	I	78.9	Confident	78.7	Confident	51 Å²	51	68 Å²	68	26%	0.262	34%	0.344	S	S	.	.	H	α-helix	trans	-64.8	-42.3	175.1	-67.5	168	0	0	0	110.8	D842 P843 D844 L849 R850	D842-I846 VanDerWaalsContact O-CG1 3.31Å; D842-I846 WeakPolarHBondContact O-CG1 3.47Å; D842-I846 PolarHBondContact O-N 3.46Å; D842-I846 VanDerWaalsContact O-N 3.14Å; P843-I846 PolarHBondContact O-N 3.08Å; D844-I846 VanDerWaalsContact C-N 3.34Å; D844-I846 PolarHBondContact O-N 3Å; I846-L849 PolarHBondContact O-N 3.39Å; I846-R850 WeakPolarHBondContact O-CB 3.41Å; I846-R850 PolarHBondContact O-N 3.23Å
847	E	78.6	Confident	80.7	Confident	64 Å²	64	62.9 Å²	62.9	30%	0.299	31%	0.313	S	S	.	.	H	α-helix	trans	-71.9	-37	178.8	-174.7	52	-140.1	0	0	112.2	P843 D844 L849 R850 K851	P843-E847 PolarHBondContact O-N 3.34Å; D844-E847 PolarHBondContact O-N 3.04Å; E847-L849 VanDerWaalsContact C-N 3.34Å; E847-L849 PolarHBondContact O-N 2.83Å; E847-R850 WeakPolarHBondContact O-CB 3.46Å; E847-R850 PolarHBondContact O-N 3.5Å; E847-R850 WeakPolarHBondContact OE2-CD 3.32Å; E847-R850 IonicContact OE2-CZ 2.84Å; E847-R850 IonicContact OE2-NE 3.71Å; E847-R850 IonicContact OE2-NH1 3.3Å; E847-R850 PolarHBondContact OE2-NH1 3.08Å; E847-K851 WeakPolarHBondContact O-CG 3.37Å; E847-K851 PolarHBondContact O-N 2.78Å; E847-K851 VanDerWaalsContact OE1-CE 3.25Å; E847-K851 WeakPolarHBondContact OE1-CE 3.21Å
848	I	85.2	Confident	82.3	Confident	64 Å²	64	55.7 Å²	55.7	33%	0.328	28%	0.275	S	S	.	.	H	α-helix	trans	-58.1	-47.1	169.6	-69.3	165.5	0	0	0	110.6	D844 R850 K851 R852	D844-I848 VanDerWaalsContact O-CG1 3.31Å; D844-I848 WeakPolarHBondContact O-CG1 3.29Å; D844-I848 PolarHBondContact O-N 2.98Å; I848-R850 PolarHBondContact O-N 2.74Å; I848-K851 PolarHBondContact O-N 3.06Å; I848-R852 PolarHBondContact O-N 3.14Å
849	L	86.1	Confident	83.9	Confident	23 Å²	23	54.7 Å²	54.7	12%	0.12	27%	0.27	C	S	.	.	H	α-helix	trans	-63.7	-39.9	177.3	178.3	58.3	0	0	0	111.8	I838 Q845 I846 E847 K851 R852 R853 D886 Y887	I838-L849 HydrophobicContact CD1-CB 4.39Å; I838-L849 HydrophobicContact CD1-CD1 4.18Å; I838-L849 HydrophobicContact CD1-CD2 4.28Å; Q845-L849 WeakPolarHBondContact O-CB 3.25Å; Q845-L849 PolarHBondContact O-N 3.14Å; I846-L849 PolarHBondContact O-N 3.39Å; E847-L849 VanDerWaalsContact C-N 3.34Å; E847-L849 PolarHBondContact O-N 2.83Å; L849-K851 PolarHBondContact O-N 3.27Å; L849-R852 PolarHBondContact O-N 2.85Å; L849-R853 HydrophobicContact CD1-CG 4.1Å; L849-R853 HydrophobicContact CG-CG 4.39Å; L849-R853 WeakPolarHBondContact O-CB 3.29Å; L849-R853 WeakPolarHBondContact O-CG 3.32Å; L849-R853 PolarHBondContact O-N 2.87Å; L849-D886 HydrophobicContact CD1-CB 3.93Å; L849-Y887 HydrophobicContact CD1-CE1 3.96Å
850	R	86.3	Confident	85.3	Confident	69 Å²	69	50.7 Å²	50.7	26%	0.26	25%	0.249	S	C	.	.	H	α-helix	trans	-58.5	-46.2	174.4	-173.1	-163.9	-171.7	165	0.5	111.5	I25 I846 E847 I848 R853 S854 E1087	I25-R850 HydrophobicContact CD1-CG 4.37Å; I846-R850 WeakPolarHBondContact O-CB 3.41Å; I846-R850 PolarHBondContact O-N 3.23Å; E847-R850 WeakPolarHBondContact O-CB 3.46Å; E847-R850 PolarHBondContact O-N 3.5Å; E847-R850 WeakPolarHBondContact OE2-CD 3.32Å; E847-R850 IonicContact OE2-CZ 2.84Å; E847-R850 IonicContact OE2-NE 3.71Å; E847-R850 IonicContact OE2-NH1 3.3Å; E847-R850 PolarHBondContact OE2-NH1 3.08Å; I848-R850 PolarHBondContact O-N 2.74Å; R850-R853 PolarHBondContact O-N 2.98Å; R850-S854 PolarHBondContact O-N 3.18Å; R850-E1087 PolarHBondContact NH1-O 3.1Å; R850-E1087 VanDerWaalsContact NH1-O 3.17Å; R850-E1087 PolarHBondContact NH2-O 3.39Å
851	K	87.8	Confident	86.6	Confident	118 Å²	118	46.2 Å²	46.2	51%	0.513	23%	0.232	S	C	.	.	H	α-helix	trans	-61.2	-47.3	176.7	-71.4	173.9	-178.4	175.1	0	111.7	E847 I848 L849 R853 S854 F855	E847-K851 WeakPolarHBondContact O-CG 3.37Å; E847-K851 PolarHBondContact O-N 2.78Å; E847-K851 VanDerWaalsContact OE1-CE 3.25Å; E847-K851 WeakPolarHBondContact OE1-CE 3.21Å; I848-K851 PolarHBondContact O-N 3.06Å; L849-K851 PolarHBondContact O-N 3.27Å; K851-R853 PolarHBondContact O-N 3.26Å; K851-S854 VanDerWaalsContact O-CB 3.29Å; K851-S854 WeakPolarHBondContact O-CB 3.44Å; K851-S854 PolarHBondContact O-N 3.1Å; K851-S854 VanDerWaalsContact O-N 3.14Å; K851-F855 WeakPolarHBondContact O-CD2 3.43Å; K851-F855 WeakPolarHBondContact O-CG 3.06Å; K851-F855 PolarHBondContact O-N 3.48Å; K851-F855 VanDerWaalsContact O-N 3.14Å
852	R	91.7	Very high	87.9	Confident	30 Å²	30	41.3 Å²	41.3	11%	0.113	21%	0.206	C	C	.	.	H	α-helix	trans	-60.1	-42.9	175.5	-71.4	-168.4	177.6	126.2	7.1	113.5	W829 C832 I848 L849 S854 F855 L856 Y887	W829-R852 VanDerWaalsContact O-CD 3.3Å; W829-R852 WeakPolarHBondContact O-CD 3.46Å; W829-R852 WeakPolarHBondContact O-CG 3.49Å; W829-R852 PolarHBondContact O-NE 3.4Å; C832-R852 PolarHBondContact SG-NH2 3.4Å; I848-R852 PolarHBondContact O-N 3.14Å; L849-R852 PolarHBondContact O-N 2.85Å; R852-S854 VanDerWaalsContact C-N 3.27Å; R852-S854 PolarHBondContact O-N 2.83Å; R852-F855 PolarHBondContact O-N 2.93Å; R852-L856 PolarHBondContact O-N 3.3Å; R852-L856 VanDerWaalsContact O-N 3.1Å; R852-Y887 HydrophobicContact CB-CE1 4.2Å; R852-Y887 VanDerWaalsContact CD-OH 3.22Å; R852-Y887 WeakPolarHBondContact CD-OH 3.24Å
853	R	93.6	Very high	88.9	Confident	42 Å²	42	38.7 Å²	38.7	16%	0.158	19%	0.192	C	C	.	.	H	α-helix	trans	-60.9	-37.1	175.5	-72.8	169.8	62.3	77.6	14.7	111.8	L849 R850 K851 A857 D886 Y887 E889 I890	L849-R853 HydrophobicContact CD1-CG 4.1Å; L849-R853 HydrophobicContact CG-CG 4.39Å; L849-R853 WeakPolarHBondContact O-CB 3.29Å; L849-R853 WeakPolarHBondContact O-CG 3.32Å; L849-R853 PolarHBondContact O-N 2.87Å; R850-R853 PolarHBondContact O-N 2.98Å; K851-R853 PolarHBondContact O-N 3.26Å; R853-A857 VanDerWaalsContact O-CB 3.3Å; R853-A857 WeakPolarHBondContact O-CB 3.46Å; R853-A857 PolarHBondContact O-N 3.25Å; R853-D886 PolarHBondContact NH1-O 2.95Å; R853-Y887 HydrophobicContact CG-CD1 3.87Å; R853-Y887 HydrophobicContact CG-CE1 3.96Å; R853-E889 IonicContact CZ-OE1 3.1Å; R853-E889 IonicContact NH1-OE1 3.11Å; R853-E889 PolarHBondContact NH1-OE1 3.1Å; R853-E889 IonicContact NH1-OE2 2.71Å; R853-E889 IonicContact NH2-OE1 2.64Å; R853-E889 PolarHBondContact NH2-OE1 3.48Å; R853-I890 HydrophobicContact CB-CD1 4.01Å; R853-I890 HydrophobicContact CG-CD1 4.23Å
854	S	92.6	Very high	89.8	Confident	30 Å²	30	36 Å²	36	21%	0.21	17%	0.174	C	C	.	.	H	α-helix	trans	-61.6	-50.4	173.8	-168.1	0	0	0	0	111.7	R850 K851 R852 L856 A857 S858	R850-S854 PolarHBondContact O-N 3.18Å; K851-S854 VanDerWaalsContact O-CB 3.29Å; K851-S854 WeakPolarHBondContact O-CB 3.44Å; K851-S854 PolarHBondContact O-N 3.1Å; K851-S854 VanDerWaalsContact O-N 3.14Å; R852-S854 VanDerWaalsContact C-N 3.27Å; R852-S854 PolarHBondContact O-N 2.83Å; S854-L856 VanDerWaalsContact C-N 3.35Å; S854-L856 PolarHBondContact O-N 2.85Å; S854-A857 PolarHBondContact O-N 2.7Å; S854-A857 VanDerWaalsContact O-N 3.16Å; S854-S858 PolarHBondContact O-N 2.86Å; S854-S858 PolarHBondContact O-OG 3.33Å
855	F	95.2	Very high	90.6	Very high	24 Å²	24	36.9 Å²	36.9	11%	0.105	17%	0.169	C	C	.	.	H	α-helix	trans	-56.1	-46.9	177.3	-56.3	-37.9	0	0	0	112.3	Y786 L787 F825 V830 K851 R852 A857 S858 Y859	Y786-F855 HydrophobicContact CD1-CB 4.23Å; Y786-F855 HydrophobicContact CD1-CD1 4.01Å; Y786-F855 HydrophobicContact CD1-CG 4.39Å; Y786-F855 HydrophobicContact CE1-CB 4Å; L787-F855 HydrophobicContact CD1-CD1 4.29Å; L787-F855 HydrophobicContact CD1-CE1 3.89Å; L787-F855 HydrophobicContact CD2-CD1 3.84Å; L787-F855 HydrophobicContact CD2-CE1 4.28Å; L787-F855 HydrophobicContact CG-CD1 3.88Å; L787-F855 HydrophobicContact CG-CE1 3.86Å; F825-F855 HydrophobicContact CE1-CB 4.08Å; F825-F855 HydrophobicContact CE1-CD1 4.23Å; F825-F855 AromaticContact CE1-CD2 3.91Å; F825-F855 HydrophobicContact CE1-CD2 3.91Å; F825-F855 HydrophobicContact CE1-CE2 4.4Å; F825-F855 AromaticContact CE1-CG 3.83Å; F825-F855 HydrophobicContact CE1-CG 3.83Å; F825-F855 HydrophobicContact CZ-CD1 4.39Å; F825-F855 HydrophobicContact CZ-CD2 4.21Å; F825-F855 HydrophobicContact CZ-CE1 4.42Å; F825-F855 HydrophobicContact CZ-CE2 4.25Å; F825-F855 HydrophobicContact CZ-CG 4.3Å; F825-F855 HydrophobicContact CZ-CZ 4.36Å; V830-F855 HydrophobicContact CG2-CB 3.77Å; V830-F855 HydrophobicContact CG2-CD2 4.21Å; K851-F855 WeakPolarHBondContact O-CD2 3.43Å; K851-F855 WeakPolarHBondContact O-CG 3.06Å; K851-F855 PolarHBondContact O-N 3.48Å; K851-F855 VanDerWaalsContact O-N 3.14Å; R852-F855 PolarHBondContact O-N 2.93Å; F855-A857 PolarHBondContact O-N 3.43Å; F855-S858 PolarHBondContact O-N 3.44Å; F855-Y859 PolarHBondContact O-N 2.85Å; F855-Y859 VanDerWaalsContact O-N 3.16Å
856	L	96.3	Very high	91.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.7	-39.3	178.2	-174.7	59.5	0	0	0	112.7	L826 V830 F831 R852 S854 S860 V876 Y887 I890 I891	L826-L856 HydrophobicContact CD1-CD1 4.34Å; L826-L856 HydrophobicContact CD2-CD1 4.41Å; V830-L856 HydrophobicContact CG1-CB 4.06Å; V830-L856 HydrophobicContact CG1-CD2 4.41Å; F831-L856 HydrophobicContact CE1-CD2 4.39Å; F831-L856 HydrophobicContact CE2-CD1 4.11Å; F831-L856 HydrophobicContact CZ-CD1 3.62Å; F831-L856 HydrophobicContact CZ-CD2 4.22Å; R852-L856 PolarHBondContact O-N 3.3Å; R852-L856 VanDerWaalsContact O-N 3.1Å; S854-L856 VanDerWaalsContact C-N 3.35Å; S854-L856 PolarHBondContact O-N 2.85Å; L856-S860 VanDerWaalsContact O-CB 3.31Å; L856-S860 WeakPolarHBondContact O-CB 3.44Å; L856-S860 PolarHBondContact O-N 3.2Å; L856-S860 PolarHBondContact O-OG 3.38Å; L856-V876 HydrophobicContact CD1-CG1 4.15Å; L856-V876 HydrophobicContact CD1-CG2 4.06Å; L856-Y887 HydrophobicContact CD2-CD1 4.01Å; L856-Y887 HydrophobicContact CD2-CD2 4Å; L856-Y887 HydrophobicContact CD2-CG 3.59Å; L856-I890 HydrophobicContact CD2-CG2 4.22Å; L856-I890 HydrophobicContact CG-CG2 4.11Å; L856-I891 HydrophobicContact CD2-CG1 4.26Å
857	A	95.3	Very high	91.8	Very high	6 Å²	6	35.6 Å²	35.6	5%	0.05	17%	0.169	C	C	.	.	H	α-helix	trans	-63.7	-43.8	176.4	0	0	0	0	0	111.1	R853 S854 F855 S860 K861	R853-A857 VanDerWaalsContact O-CB 3.3Å; R853-A857 WeakPolarHBondContact O-CB 3.46Å; R853-A857 PolarHBondContact O-N 3.25Å; S854-A857 PolarHBondContact O-N 2.7Å; S854-A857 VanDerWaalsContact O-N 3.16Å; F855-A857 PolarHBondContact O-N 3.43Å; A857-S860 WeakPolarHBondContact O-CB 3.27Å; A857-S860 PolarHBondContact O-N 3.1Å; A857-K861 WeakPolarHBondContact O-CG 3.45Å; A857-K861 PolarHBondContact O-N 3.3Å
858	S	93.8	Very high	92.6	Very high	4 Å²	4	32.7 Å²	32.7	3%	0.028	16%	0.155	C	C	.	.	H	α-helix	trans	-61.8	-44.6	178.2	-68.1	0	0	0	0	112.6	S854 F855 S860 K861 L862	S854-S858 PolarHBondContact O-N 2.86Å; S854-S858 PolarHBondContact O-OG 3.33Å; F855-S858 PolarHBondContact O-N 3.44Å; S858-S860 VanDerWaalsContact C-N 3.35Å; S858-S860 PolarHBondContact O-N 3.3Å; S858-K861 WeakPolarHBondContact O-CB 3.23Å; S858-K861 PolarHBondContact O-N 3.16Å; S858-L862 PolarHBondContact O-N 2.91Å
859	Y	96.7	Very high	93	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.9	-42.2	172.2	-169	-102.7	0	0	0	112.7	Y786 L822 Q823 L826 F855 K861 L862 I863 L868 V876	Y786-Y859 WeakPolarHBondContact OH-CB 3.22Å; L822-Y859 HydrophobicContact CB-CD2 4.12Å; L822-Y859 HydrophobicContact CB-CE2 3.8Å; Q823-Y859 HydrophobicContact CG-CE2 4.39Å; Q823-Y859 WeakPolarHBondContact CG-OH 3.18Å; Q823-Y859 PolarHBondContact NE2-OH 2.95Å; L826-Y859 HydrophobicContact CD1-CD1 3.47Å; L826-Y859 VanDerWaalsContact CD1-CD1 3.47Å; L826-Y859 HydrophobicContact CD1-CD2 4.12Å; L826-Y859 HydrophobicContact CD1-CE1 3.97Å; L826-Y859 HydrophobicContact CD1-CG 3.55Å; L826-Y859 HydrophobicContact CG-CG 4.4Å; F855-Y859 PolarHBondContact O-N 2.85Å; F855-Y859 VanDerWaalsContact O-N 3.16Å; Y859-K861 VanDerWaalsContact C-N 3.3Å; Y859-K861 PolarHBondContact O-N 3.49Å; Y859-L862 WeakPolarHBondContact O-CB 3.43Å; Y859-L862 PolarHBondContact O-N 3.5Å; Y859-L862 VanDerWaalsContact O-N 3.15Å; Y859-I863 HydrophobicContact CD1-CD1 3.79Å; Y859-I863 HydrophobicContact CE1-CD1 3.59Å; Y859-I863 HydrophobicContact CE1-CG1 4.32Å; Y859-I863 PolarHBondContact O-N 3.36Å; Y859-L868 HydrophobicContact CD2-CD1 4.11Å; Y859-L868 HydrophobicContact CE1-CD1 4.45Å; Y859-L868 HydrophobicContact CE2-CD1 3.45Å; Y859-L868 VanDerWaalsContact CE2-CD1 3.45Å; Y859-V876 HydrophobicContact CD1-CG2 3.76Å; Y859-V876 HydrophobicContact CE1-CG2 4Å
860	S	96.4	Very high	93.5	Very high	3 Å²	3	32.2 Å²	32.2	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-63.1	-35.1	179.3	-59.8	0	0	0	0	112.3	L856 A857 S858 I863 V864 T894	L856-S860 VanDerWaalsContact O-CB 3.31Å; L856-S860 WeakPolarHBondContact O-CB 3.44Å; L856-S860 PolarHBondContact O-N 3.2Å; L856-S860 PolarHBondContact O-OG 3.38Å; A857-S860 WeakPolarHBondContact O-CB 3.27Å; A857-S860 PolarHBondContact O-N 3.1Å; S858-S860 VanDerWaalsContact C-N 3.35Å; S858-S860 PolarHBondContact O-N 3.3Å; S860-I863 PolarHBondContact O-N 3.37Å; S860-V864 WeakPolarHBondContact O-CG2 3.41Å; S860-V864 PolarHBondContact O-N 2.9Å; S860-T894 WeakPolarHBondContact CB-OG1 3.49Å; S860-T894 PolarHBondContact OG-OG1 2.9Å
861	K	93.9	Very high	93.9	Very high	25 Å²	25	37.1 Å²	37.1	11%	0.109	18%	0.176	C	C	.	.	H	α-helix	trans	-59.6	-45.1	172.9	-69.2	167.2	-157.6	163.8	0	111.1	G20 S24 L794 A857 S858 Y859 I863 V864 W865	G20-K861 PolarHBondContact O-NZ 3.3Å; S24-K861 WeakPolarHBondContact OG-CE 3.49Å; S24-K861 PolarHBondContact OG-NZ 3.35Å; L794-K861 HydrophobicContact CD2-CB 4.22Å; L794-K861 HydrophobicContact CD2-CD 4.23Å; A857-K861 WeakPolarHBondContact O-CG 3.45Å; A857-K861 PolarHBondContact O-N 3.3Å; S858-K861 WeakPolarHBondContact O-CB 3.23Å; S858-K861 PolarHBondContact O-N 3.16Å; Y859-K861 VanDerWaalsContact C-N 3.3Å; Y859-K861 PolarHBondContact O-N 3.49Å; K861-I863 VanDerWaalsContact C-N 3.27Å; K861-I863 PolarHBondContact O-N 3.38Å; K861-V864 PolarHBondContact O-N 2.99Å; K861-W865 WeakPolarHBondContact O-CB 3.05Å; K861-W865 VanDerWaalsContact O-CD1 3.31Å; K861-W865 PolarHBondContact O-N 2.8Å
862	L	95	Very high	94.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-57.7	-39.4	179.5	-60.9	178.4	0	0	0	112.2	C790 L793 L794 L822 S858 Y859 S866 V867 L868	C790-L862 HydrophobicContact CB-CD1 4.43Å; C790-L862 WeakPolarHBondContact O-CD2 3.41Å; L793-L862 HydrophobicContact CB-CD2 3.88Å; L793-L862 HydrophobicContact CD1-CD1 4.38Å; L794-L862 HydrophobicContact CB-CD2 4.08Å; L822-L862 HydrophobicContact CD1-CD1 4.18Å; S858-L862 PolarHBondContact O-N 2.91Å; Y859-L862 WeakPolarHBondContact O-CB 3.43Å; Y859-L862 PolarHBondContact O-N 3.5Å; Y859-L862 VanDerWaalsContact O-N 3.15Å; L862-S866 PolarHBondContact O-N 3Å; L862-V867 HydrophobicContact CB-CB 4.27Å; L862-V867 HydrophobicContact CD2-CB 4.07Å; L862-V867 HydrophobicContact CD2-CG1 4.09Å; L862-V867 HydrophobicContact CD2-CG2 4.27Å; L862-V867 PolarHBondContact O-N 2.86Å; L862-L868 HydrophobicContact CB-CB 4.42Å; L862-L868 HydrophobicContact CB-CD1 3.89Å; L862-L868 HydrophobicContact CB-CG 3.9Å; L862-L868 HydrophobicContact CD1-CD1 4.14Å; L862-L868 HydrophobicContact CD1-CG 4.5Å; L862-L868 PolarHBondContact O-N 3.01Å
863	I	95.4	Very high	94.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-69.5	-51.1	175.6	-61	162.9	0	0	0	110.9	Y859 S860 K861 W865 S866 L868 A873 V876	Y859-I863 HydrophobicContact CD1-CD1 3.79Å; Y859-I863 HydrophobicContact CE1-CD1 3.59Å; Y859-I863 HydrophobicContact CE1-CG1 4.32Å; Y859-I863 PolarHBondContact O-N 3.36Å; S860-I863 PolarHBondContact O-N 3.37Å; K861-I863 VanDerWaalsContact C-N 3.27Å; K861-I863 PolarHBondContact O-N 3.38Å; I863-W865 VanDerWaalsContact C-N 3.33Å; I863-W865 PolarHBondContact O-N 3.03Å; I863-S866 WeakPolarHBondContact O-CA 3.38Å; I863-S866 PolarHBondContact O-N 2.89Å; I863-L868 HydrophobicContact CG1-CB 4.16Å; I863-L868 HydrophobicContact CG1-CD1 4.39Å; I863-A873 HydrophobicContact CD1-CB 4.08Å; I863-A873 HydrophobicContact CG2-CB 4.06Å; I863-V876 HydrophobicContact CD1-CG2 4.37Å
864	V	93	Very high	94.6	Very high	35 Å²	35	28.9 Å²	28.9	21%	0.212	14%	0.144	C	C	.	.	H	α-helix	trans	-60.9	-43.2	-175.5	166.5	0	0	0	0	111.3	S860 K861 S866 T894 K897 K901	S860-V864 WeakPolarHBondContact O-CG2 3.41Å; S860-V864 PolarHBondContact O-N 2.9Å; K861-V864 PolarHBondContact O-N 2.99Å; V864-S866 PolarHBondContact O-N 2.84Å; V864-T894 HydrophobicContact CG2-CG2 4.35Å; V864-K897 HydrophobicContact CB-CB 4.33Å; V864-K897 HydrophobicContact CG1-CB 3.78Å; V864-K897 HydrophobicContact CG1-CD 4.28Å; V864-K897 HydrophobicContact CG1-CG 4.09Å; V864-K897 HydrophobicContact CG2-CB 3.62Å; V864-K897 HydrophobicContact CG2-CG 4.36Å; V864-K901 PolarHBondContact O-NZ 3.25Å
865	W	90.2	Very high	94.7	Very high	135 Å²	135	29.8 Å²	29.8	51%	0.511	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	1	175.2	-70.8	103	0	0	0	113.9	L794 W798 K861 I863 V867	L794-W865 HydrophobicContact CD1-CB 3.75Å; L794-W865 HydrophobicContact CD1-CG 3.84Å; W798-W865 PolarHBondContact NE1-O 3.26Å; K861-W865 WeakPolarHBondContact O-CB 3.05Å; K861-W865 VanDerWaalsContact O-CD1 3.31Å; K861-W865 PolarHBondContact O-N 2.8Å; I863-W865 VanDerWaalsContact C-N 3.33Å; I863-W865 PolarHBondContact O-N 3.03Å; W865-V867 VanDerWaalsContact C-N 3.31Å; W865-V867 PolarHBondContact O-N 3.42Å
866	S	92.4	Very high	94.8	Very high	49 Å²	49	28.7 Å²	28.7	34%	0.343	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	45.6	-175.6	58.2	0	0	0	0	115.1	L862 I863 V864 L868 K901	L862-S866 PolarHBondContact O-N 3Å; I863-S866 WeakPolarHBondContact O-CA 3.38Å; I863-S866 PolarHBondContact O-N 2.89Å; V864-S866 PolarHBondContact O-N 2.84Å; S866-L868 WeakPolarHBondContact CA-O 3.37Å; S866-K901 VanDerWaalsContact CB-CE 3.47Å; S866-K901 VanDerWaalsContact CB-NZ 3.29Å; S866-K901 VanDerWaalsContact OG-CE 3.27Å; S866-K901 WeakPolarHBondContact OG-CE 3.43Å; S866-K901 PolarHBondContact OG-NZ 3.21Å
867	V	92.7	Very high	94.8	Very high	26 Å²	26	28.7 Å²	28.7	16%	0.158	14%	0.14	C	C	.	.	S	Bend	trans	-74.3	-40	153.9	-178.8	0	0	0	0	109.1	L793 L794 V814 L862 W865	L793-V867 HydrophobicContact CB-CG1 4.29Å; L793-V867 WeakPolarHBondContact O-CG1 3.45Å; L794-V867 HydrophobicContact CD1-CG2 4.25Å; V814-V867 HydrophobicContact CG2-CG1 3.79Å; L862-V867 HydrophobicContact CB-CB 4.27Å; L862-V867 HydrophobicContact CD2-CB 4.07Å; L862-V867 HydrophobicContact CD2-CG1 4.09Å; L862-V867 HydrophobicContact CD2-CG2 4.27Å; L862-V867 PolarHBondContact O-N 2.86Å; W865-V867 VanDerWaalsContact C-N 3.31Å; W865-V867 PolarHBondContact O-N 3.42Å
868	L	94.8	Very high	94.8	Very high	4 Å²	4	30.5 Å²	30.5	2%	0.021	15%	0.147	C	C	.	.	S	Bend	trans	-100.7	159.5	167.7	-67.4	179.8	0	0	0	111.1	V814 E819 Y859 L862 I863 S866	V814-L868 HydrophobicContact CB-CD2 4.15Å; V814-L868 HydrophobicContact CG1-CD2 3.75Å; V814-L868 HydrophobicContact CG2-CD2 4.33Å; E819-L868 HydrophobicContact CB-CD2 4.3Å; E819-L868 HydrophobicContact CG-CD2 3.88Å; Y859-L868 HydrophobicContact CD2-CD1 4.11Å; Y859-L868 HydrophobicContact CE1-CD1 4.45Å; Y859-L868 HydrophobicContact CE2-CD1 3.45Å; Y859-L868 VanDerWaalsContact CE2-CD1 3.45Å; L862-L868 HydrophobicContact CB-CB 4.42Å; L862-L868 HydrophobicContact CB-CD1 3.89Å; L862-L868 HydrophobicContact CB-CG 3.9Å; L862-L868 HydrophobicContact CD1-CD1 4.14Å; L862-L868 HydrophobicContact CD1-CG 4.5Å; L862-L868 PolarHBondContact O-N 3.01Å; I863-L868 HydrophobicContact CG1-CB 4.16Å; I863-L868 HydrophobicContact CG1-CD1 4.39Å; S866-L868 WeakPolarHBondContact CA-O 3.37Å
869	S	94	Very high	94.8	Very high	58 Å²	58	31.1 Å²	31.1	41%	0.406	15%	0.15	S	C	.	.			trans	-69.7	157.8	175.4	81.8	0	0	0	0	111.3	R871 S872	S869-R871 PolarHBondContact O-N 3.43Å; S869-R871 WeakPolarHBondContact OG-CB 3.46Å; S869-R871 PolarHBondContact OG-N 2.98Å; S869-S872 PolarHBondContact N-OG 2.96Å; S869-S872 VanDerWaalsContact O-CB 3.23Å; S869-S872 WeakPolarHBondContact O-CB 3.38Å; S869-S872 PolarHBondContact O-N 3.09Å; S869-S872 PolarHBondContact O-OG 3.44Å; S869-S872 VanDerWaalsContact O-OG 3.06Å; S869-S872 PolarHBondContact OG-N 2.97Å; S869-S872 PolarHBondContact OG-OG 3.13Å
870	I	95.6	Very high	94.7	Very high	19 Å²	19	31.3 Å²	31.3	10%	0.097	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-63.4	-25.3	171.9	-67.2	167.8	0	0	0	111	S872 A873 C898 K901 D902 A905 C906 S909	I870-S872 PolarHBondContact O-N 2.89Å; I870-A873 WeakPolarHBondContact O-CB 3.28Å; I870-A873 PolarHBondContact O-N 3.39Å; I870-C898 HydrophobicContact CG2-CB 4.02Å; I870-K901 HydrophobicContact CD1-CD 4.41Å; I870-D902 HydrophobicContact CD1-CB 3.82Å; I870-A905 HydrophobicContact CB-CB 3.95Å; I870-A905 HydrophobicContact CD1-CB 4.05Å; I870-A905 HydrophobicContact CG2-CB 3.95Å; I870-C906 HydrophobicContact CG2-CB 4.38Å; I870-S909 VanDerWaalsContact C-OG 3.31Å; I870-S909 WeakPolarHBondContact O-CB 3.18Å; I870-S909 PolarHBondContact O-OG 2.68Å
871	R	95.5	Very high	94.5	Very high	171 Å²	171	32.2 Å²	32.2	65%	0.645	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	-59.9	-34.5	175.8	-166.5	-178.7	-174.9	-158	-5.1	112.4	S869 A873 T874 S909 D912	S869-R871 PolarHBondContact O-N 3.43Å; S869-R871 WeakPolarHBondContact OG-CB 3.46Å; S869-R871 PolarHBondContact OG-N 2.98Å; R871-A873 PolarHBondContact O-N 2.94Å; R871-A873 VanDerWaalsContact O-N 3.13Å; R871-T874 WeakPolarHBondContact O-CB 3.18Å; R871-T874 PolarHBondContact O-N 3.43Å; R871-T874 PolarHBondContact O-OG1 3.21Å; R871-S909 WeakPolarHBondContact CA-OG 3.09Å; R871-S909 PolarHBondContact N-OG 2.99Å; R871-D912 IonicContact NE-OD2 2.68Å; R871-D912 PolarHBondContact NE-OD2 3.36Å
872	S	95.9	Very high	94.3	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.014	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-60	-21.2	176.8	-41.2	0	0	0	0	112.4	E819 S869 I870 T874	E819-S872 WeakPolarHBondContact OE1-CB 3.29Å; E819-S872 PolarHBondContact OE1-OG 3.3Å; E819-S872 PolarHBondContact OE2-OG 3.27Å; S869-S872 PolarHBondContact N-OG 2.96Å; S869-S872 VanDerWaalsContact O-CB 3.23Å; S869-S872 WeakPolarHBondContact O-CB 3.38Å; S869-S872 PolarHBondContact O-N 3.09Å; S869-S872 PolarHBondContact O-OG 3.44Å; S869-S872 VanDerWaalsContact O-OG 3.06Å; S869-S872 PolarHBondContact OG-N 2.97Å; S869-S872 PolarHBondContact OG-OG 3.13Å; I870-S872 PolarHBondContact O-N 2.89Å; S872-T874 PolarHBondContact O-N 3.2Å
873	A	96.1	Very high	94.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-64.6	-16.8	173	0	0	0	0	0	114.1	I863 I870 R871 E875 V876 F877	I863-A873 HydrophobicContact CD1-CB 4.08Å; I863-A873 HydrophobicContact CG2-CB 4.06Å; I870-A873 WeakPolarHBondContact O-CB 3.28Å; I870-A873 PolarHBondContact O-N 3.39Å; R871-A873 PolarHBondContact O-N 2.94Å; R871-A873 VanDerWaalsContact O-N 3.13Å; A873-E875 PolarHBondContact O-N 2.92Å; A873-V876 PolarHBondContact O-N 3.29Å; A873-F877 HydrophobicContact CB-CD1 4.17Å; A873-F877 HydrophobicContact CB-CD2 4.09Å; A873-F877 HydrophobicContact CB-CE1 3.76Å; A873-F877 HydrophobicContact CB-CE2 3.69Å; A873-F877 HydrophobicContact CB-CG 4.33Å; A873-F877 HydrophobicContact CB-CZ 3.5Å; A873-F877 VanDerWaalsContact CB-CZ 3.5Å; A873-F877 WeakPolarHBondContact O-CB 3.36Å; A873-F877 WeakPolarHBondContact O-CD1 3.49Å; A873-F877 WeakPolarHBondContact O-CG 3.12Å; A873-F877 PolarHBondContact O-N 3.1Å
874	T	96.4	Very high	93.9	Very high	15 Å²	15	41.8 Å²	41.8	9%	0.092	20%	0.199	C	C	.	.	H	α-helix	trans	-50.6	-43.8	175.9	-61.3	0	0	0	0	112.1	R871 S872 V876 F877 K878 S909 D912 A913	R871-T874 WeakPolarHBondContact O-CB 3.18Å; R871-T874 PolarHBondContact O-N 3.43Å; R871-T874 PolarHBondContact O-OG1 3.21Å; S872-T874 PolarHBondContact O-N 3.2Å; T874-V876 VanDerWaalsContact C-N 3.28Å; T874-V876 PolarHBondContact O-N 3.34Å; T874-F877 PolarHBondContact O-N 2.92Å; T874-K878 PolarHBondContact O-N 3.18Å; T874-K878 VanDerWaalsContact O-N 3.11Å; T874-S909 PolarHBondContact OG1-O 2.78Å; T874-D912 HydrophobicContact CG2-CB 3.84Å; T874-A913 HydrophobicContact CG2-CB 4.28Å
875	E	94.6	Very high	93.6	Very high	50 Å²	50	45.9 Å²	45.9	23%	0.234	22%	0.22	C	C	.	.	H	α-helix	trans	-67.9	-26.8	-179.3	-66.7	-56.8	97.6	0	0	113.4	Q823 A873 K878 N879	Q823-E875 HydrophobicContact CB-CG 4.31Å; Q823-E875 HydrophobicContact CG-CB 4.38Å; Q823-E875 HydrophobicContact CG-CG 3.85Å; A873-E875 PolarHBondContact O-N 2.92Å; E875-K878 WeakPolarHBondContact OE1-CE 3.49Å; E875-K878 IonicContact OE1-NZ 3.73Å; E875-K878 PolarHBondContact OE1-NZ 3.35Å; E875-K878 WeakPolarHBondContact OE2-CE 3.26Å; E875-K878 IonicContact OE2-NZ 3.34Å; E875-K878 PolarHBondContact OE2-NZ 2.92Å; E875-N879 PolarHBondContact O-ND2 3.13Å
876	V	96	Very high	93.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-84.6	-44.2	174.7	176.8	0	0	0	0	110.6	L826 L856 Y859 I863 A873 T874 K878 N879 I891	L826-V876 HydrophobicContact CD1-CG2 4.44Å; L856-V876 HydrophobicContact CD1-CG1 4.15Å; L856-V876 HydrophobicContact CD1-CG2 4.06Å; Y859-V876 HydrophobicContact CD1-CG2 3.76Å; Y859-V876 HydrophobicContact CE1-CG2 4Å; I863-V876 HydrophobicContact CD1-CG2 4.37Å; A873-V876 PolarHBondContact O-N 3.29Å; T874-V876 VanDerWaalsContact C-N 3.28Å; T874-V876 PolarHBondContact O-N 3.34Å; V876-K878 PolarHBondContact O-N 3.49Å; V876-N879 PolarHBondContact O-N 3.44Å; V876-I891 HydrophobicContact CG1-CB 4.39Å; V876-I891 HydrophobicContact CG1-CG1 3.79Å; V876-I891 HydrophobicContact CG1-CG2 4.15Å
877	F	96.9	Very high	93.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-67.7	-36.3	-172.5	-71	-1.8	0	0	0	112.7	A873 T874 N879 Y880 I891 T894 I895 C898 M910 A913 L940 F944	A873-F877 HydrophobicContact CB-CD1 4.17Å; A873-F877 HydrophobicContact CB-CD2 4.09Å; A873-F877 HydrophobicContact CB-CE1 3.76Å; A873-F877 HydrophobicContact CB-CE2 3.69Å; A873-F877 HydrophobicContact CB-CG 4.33Å; A873-F877 HydrophobicContact CB-CZ 3.5Å; A873-F877 VanDerWaalsContact CB-CZ 3.5Å; A873-F877 WeakPolarHBondContact O-CB 3.36Å; A873-F877 WeakPolarHBondContact O-CD1 3.49Å; A873-F877 WeakPolarHBondContact O-CG 3.12Å; A873-F877 PolarHBondContact O-N 3.1Å; T874-F877 PolarHBondContact O-N 2.92Å; F877-N879 PolarHBondContact O-N 2.9Å; F877-Y880 WeakPolarHBondContact O-CB 3.42Å; F877-Y880 PolarHBondContact O-N 2.65Å; F877-I891 HydrophobicContact CD1-CG2 4.27Å; F877-T894 HydrophobicContact CE1-CG2 4Å; F877-I895 HydrophobicContact CD1-CD1 4.35Å; F877-I895 HydrophobicContact CD1-CG1 3.66Å; F877-I895 HydrophobicContact CD2-CG1 4.49Å; F877-I895 HydrophobicContact CE1-CB 4.24Å; F877-I895 HydrophobicContact CE1-CD1 4.43Å; F877-I895 HydrophobicContact CE1-CG1 3.31Å; F877-I895 HydrophobicContact CE2-CG1 4.2Å; F877-I895 HydrophobicContact CG-CG1 4.25Å; F877-I895 HydrophobicContact CZ-CB 4.24Å; F877-I895 HydrophobicContact CZ-CG1 3.62Å; F877-C898 HydrophobicContact CZ-CB 4.29Å; F877-M910 HydrophobicContact CD2-CG 3.7Å; F877-M910 HydrophobicContact CE2-CG 3.78Å; F877-A913 HydrophobicContact CB-CB 3.81Å; F877-L940 WeakPolarHBondContact O-CD1 2.97Å; F877-F944 HydrophobicContact CB-CE1 4.28Å; F877-F944 HydrophobicContact CB-CZ 3.91Å
878	K	94.7	Very high	93.4	Very high	45 Å²	45	37.2 Å²	37.2	20%	0.196	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-24.3	179.9	69.6	-171.1	-176.9	-172.1	0	113.9	T874 E875 V876 A913	T874-K878 PolarHBondContact O-N 3.18Å; T874-K878 VanDerWaalsContact O-N 3.11Å; E875-K878 WeakPolarHBondContact OE1-CE 3.49Å; E875-K878 IonicContact OE1-NZ 3.73Å; E875-K878 PolarHBondContact OE1-NZ 3.35Å; E875-K878 WeakPolarHBondContact OE2-CE 3.26Å; E875-K878 IonicContact OE2-NZ 3.34Å; E875-K878 PolarHBondContact OE2-NZ 2.92Å; V876-K878 PolarHBondContact O-N 3.49Å; K878-A913 HydrophobicContact CB-CB 4Å
879	N	94	Very high	93.3	Very high	16 Å²	16	40.4 Å²	40.4	9%	0.086	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	0.2	-178.4	-66.7	-55.4	0	0	0	113.8	F831 E875 V876 F877 A881 E882 Y883	F831-N879 HydrophobicContact CD1-CB 3.6Å; F831-N879 VanDerWaalsContact CD2-ND2 3.32Å; F831-N879 WeakPolarHBondContact CD2-ND2 3.26Å; F831-N879 HydrophobicContact CE1-CB 3.42Å; F831-N879 VanDerWaalsContact CE1-CB 3.42Å; F831-N879 HydrophobicContact CE2-CB 4.47Å; F831-N879 WeakPolarHBondContact CE2-ND2 3.41Å; F831-N879 HydrophobicContact CG-CB 4.22Å; F831-N879 WeakPolarHBondContact CG-ND2 3.44Å; F831-N879 HydrophobicContact CZ-CB 3.89Å; E875-N879 PolarHBondContact O-ND2 3.13Å; V876-N879 PolarHBondContact O-N 3.44Å; F877-N879 PolarHBondContact O-N 2.9Å; N879-A881 VanDerWaalsContact C-N 3.35Å; N879-A881 PolarHBondContact O-N 3.35Å; N879-E882 PolarHBondContact O-N 3.01Å; N879-Y883 HydrophobicContact CB-CD2 4.03Å; N879-Y883 PolarHBondContact O-N 3.26Å; N879-Y883 VanDerWaalsContact O-N 3.08Å
880	Y	94.9	Very high	93.2	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.016	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-31.4	-171	-175.4	-145.4	0	0	0	114.8	F877 Y884 G888 I891 K892 I895 L940 R943 F944 S947	F877-Y880 WeakPolarHBondContact O-CB 3.42Å; F877-Y880 PolarHBondContact O-N 2.65Å; Y880-Y884 HydrophobicContact CD2-CD2 4.23Å; Y880-Y884 AromaticContact CE2-CD2 3.65Å; Y880-Y884 HydrophobicContact CE2-CD2 3.65Å; Y880-Y884 AromaticContact CE2-CE2 3.92Å; Y880-Y884 HydrophobicContact CE2-CE2 3.92Å; Y880-Y884 WeakPolarHBondContact O-CB 3.41Å; Y880-G888 VanDerWaalsContact CE2-O 3.31Å; Y880-G888 WeakPolarHBondContact CE2-O 3.2Å; Y880-I891 HydrophobicContact CD2-CB 3.78Å; Y880-I891 HydrophobicContact CD2-CD1 4.34Å; Y880-I891 HydrophobicContact CD2-CG2 3.65Å; Y880-I891 HydrophobicContact CE2-CB 4.35Å; Y880-I891 HydrophobicContact CE2-CG2 4.43Å; Y880-I891 HydrophobicContact CG-CB 4.41Å; Y880-I891 HydrophobicContact CG-CG2 3.76Å; Y880-K892 HydrophobicContact CE2-CB 4.31Å; Y880-I895 HydrophobicContact CD1-CD1 4.02Å; Y880-I895 HydrophobicContact CE1-CD1 4.07Å; Y880-L940 HydrophobicContact CD1-CD1 4.43Å; Y880-R943 HydrophobicContact CD1-CB 3.83Å; Y880-R943 HydrophobicContact CE1-CB 3.6Å; Y880-F944 AromaticContact CD1-CD1 3.85Å; Y880-F944 HydrophobicContact CD1-CD1 3.85Å; Y880-F944 AromaticContact CD1-CE1 3.86Å; Y880-F944 HydrophobicContact CD1-CE1 3.86Å; Y880-F944 HydrophobicContact CE1-CD1 4.38Å; Y880-S947 PolarHBondContact OH-OG 3.49Å
881	A	92.6	Very high	93.2	Very high	23 Å²	23	36.9 Å²	36.9	19%	0.19	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-45.1	178.8	0	0	0	0	0	112	N879 E939 L940	N879-A881 VanDerWaalsContact C-N 3.35Å; N879-A881 PolarHBondContact O-N 3.35Å; A881-E939 HydrophobicContact CB-CG 4.1Å; A881-L940 HydrophobicContact CB-CB 4.26Å; A881-L940 HydrophobicContact CB-CD1 4.34Å
882	E	90.5	Very high	93.2	Very high	113 Å²	113	32.9 Å²	32.9	53%	0.528	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-51	-176.4	-170.5	171.5	173.6	0	0	111.4	N879 Y884	N879-E882 PolarHBondContact O-N 3.01Å; E882-Y884 PolarHBondContact O-N 3.24Å
883	Y	90.8	Very high	93	Very high	19 Å²	19	35.9 Å²	35.9	8%	0.075	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	27.7	-176.2	-62	-92.9	0	0	0	113.7	F831 C832 N879 N885 D886 Y887	F831-Y883 VanDerWaalsContact C-OH 3.23Å; F831-Y883 HydrophobicContact CB-CE2 4.18Å; F831-Y883 AromaticContact CD1-CD2 3.8Å; F831-Y883 HydrophobicContact CD1-CD2 3.8Å; F831-Y883 AromaticContact CD1-CE2 3.98Å; F831-Y883 HydrophobicContact CD1-CE2 3.98Å; F831-Y883 HydrophobicContact CD1-CG 4.18Å; F831-Y883 HydrophobicContact CE1-CD2 4.45Å; F831-Y883 PolarHBondContact O-OH 2.93Å; C832-Y883 PolarHBondContact N-OH 3.29Å; C832-Y883 PolarHBondContact O-OH 3.06Å; C832-Y883 VanDerWaalsContact O-OH 3.13Å; N879-Y883 HydrophobicContact CB-CD2 4.03Å; N879-Y883 PolarHBondContact O-N 3.26Å; N879-Y883 VanDerWaalsContact O-N 3.08Å; Y883-N885 VanDerWaalsContact C-N 3.27Å; Y883-N885 PolarHBondContact O-N 3.07Å; Y883-D886 PolarHBondContact O-N 3.45Å; Y883-Y887 HydrophobicContact CD1-CD2 4.04Å; Y883-Y887 AromaticContact CD1-CE2 3.57Å; Y883-Y887 HydrophobicContact CD1-CE2 3.57Å; Y883-Y887 HydrophobicContact CE1-CE2 4.34Å; Y883-Y887 AromaticContact CG-CD2 3.85Å; Y883-Y887 HydrophobicContact CG-CD2 3.85Å; Y883-Y887 AromaticContact CG-CE2 3.84Å; Y883-Y887 HydrophobicContact CG-CE2 3.84Å; Y883-Y887 PolarHBondContact O-N 2.95Å
884	Y	90	Very high	93	Very high	93 Å²	93	35.9 Å²	35.9	37%	0.365	17%	0.173	S	C	.	.	H	α-helix	trans	-58.4	-38.3	-175.4	-179.8	-101.6	0	0	0	113.7	Y880 E882 D886 G888	Y880-Y884 HydrophobicContact CD2-CD2 4.23Å; Y880-Y884 AromaticContact CE2-CD2 3.65Å; Y880-Y884 HydrophobicContact CE2-CD2 3.65Å; Y880-Y884 AromaticContact CE2-CE2 3.92Å; Y880-Y884 HydrophobicContact CE2-CE2 3.92Å; Y880-Y884 WeakPolarHBondContact O-CB 3.41Å; E882-Y884 PolarHBondContact O-N 3.24Å; Y884-D886 PolarHBondContact O-N 3.49Å; Y884-G888 WeakPolarHBondContact O-CA 3.46Å; Y884-G888 PolarHBondContact O-N 3.12Å
885	N	87.4	Confident	92.9	Very high	121 Å²	121	35.3 Å²	35.3	65%	0.647	17%	0.169	S	C	*	.	H	α-helix	trans	-71.9	-18.2	-176.2	-74	-23.1	0	0	0	113.4	R840 Y883	R840-N885 PolarHBondContact NH2-O 3.11Å; Y883-N885 VanDerWaalsContact C-N 3.27Å; Y883-N885 PolarHBondContact O-N 3.07Å
886	D	87.4	Confident	92.7	Very high	24 Å²	24	33.8 Å²	33.8	13%	0.128	17%	0.165	C	C	.	.	H	α-helix	trans	-116.7	-29.4	-169.1	-63	-21.4	0	0	0	112.6	R840 L849 R853 Y883 Y884	R840-D886 IonicContact CZ-OD1 2.65Å; R840-D886 IonicContact NH2-OD1 2.71Å; R840-D886 PolarHBondContact NH2-OD1 2.72Å; L849-D886 HydrophobicContact CD1-CB 3.93Å; R853-D886 PolarHBondContact NH1-O 2.95Å; Y883-D886 PolarHBondContact O-N 3.45Å; Y884-D886 PolarHBondContact O-N 3.49Å
887	Y	92.2	Very high	92.6	Very high	3 Å²	3	37.9 Å²	37.9	1%	0.012	18%	0.183	C	C	.	.	H	α-helix	trans	-132.3	0.7	-178	-51.9	-39.6	0	0	0	114	V830 F831 L849 R852 R853 L856 Y883 E889 I890 I891	V830-Y887 HydrophobicContact CG1-CD2 4.3Å; V830-Y887 HydrophobicContact CG1-CE1 4.28Å; V830-Y887 HydrophobicContact CG1-CE2 3.65Å; V830-Y887 PolarHBondContact O-OH 3.46Å; F831-Y887 HydrophobicContact CD1-CD2 4.12Å; F831-Y887 AromaticContact CD1-CE2 4Å; F831-Y887 HydrophobicContact CD1-CE2 4Å; F831-Y887 AromaticContact CE1-CD2 3.75Å; F831-Y887 HydrophobicContact CE1-CD2 3.75Å; F831-Y887 HydrophobicContact CE1-CE2 4.05Å; L849-Y887 HydrophobicContact CD1-CE1 3.96Å; R852-Y887 HydrophobicContact CB-CE1 4.2Å; R852-Y887 VanDerWaalsContact CD-OH 3.22Å; R852-Y887 WeakPolarHBondContact CD-OH 3.24Å; R853-Y887 HydrophobicContact CG-CD1 3.87Å; R853-Y887 HydrophobicContact CG-CE1 3.96Å; L856-Y887 HydrophobicContact CD2-CD1 4.01Å; L856-Y887 HydrophobicContact CD2-CD2 4Å; L856-Y887 HydrophobicContact CD2-CG 3.59Å; Y883-Y887 HydrophobicContact CD1-CD2 4.04Å; Y883-Y887 AromaticContact CD1-CE2 3.57Å; Y883-Y887 HydrophobicContact CD1-CE2 3.57Å; Y883-Y887 HydrophobicContact CE1-CE2 4.34Å; Y883-Y887 AromaticContact CG-CD2 3.85Å; Y883-Y887 HydrophobicContact CG-CD2 3.85Å; Y883-Y887 AromaticContact CG-CE2 3.84Å; Y883-Y887 HydrophobicContact CG-CE2 3.84Å; Y883-Y887 PolarHBondContact O-N 2.95Å; Y887-E889 VanDerWaalsContact C-N 3.35Å; Y887-E889 PolarHBondContact O-N 3.38Å; Y887-I890 PolarHBondContact O-N 3.38Å; Y887-I890 VanDerWaalsContact O-N 3.13Å; Y887-I891 WeakPolarHBondContact O-CG1 3.39Å; Y887-I891 PolarHBondContact O-N 2.88Å
888	G	91.8	Very high	92.5	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-36.6	-165.6	0	0	0	0	0	114.8	Y880 Y884 K892	Y880-G888 VanDerWaalsContact CE2-O 3.31Å; Y880-G888 WeakPolarHBondContact CE2-O 3.2Å; Y884-G888 WeakPolarHBondContact O-CA 3.46Å; Y884-G888 PolarHBondContact O-N 3.12Å; G888-K892 WeakPolarHBondContact O-CB 3.38Å; G888-K892 PolarHBondContact O-N 3.48Å
889	E	91.8	Very high	92.3	Very high	71 Å²	71	38.8 Å²	38.8	33%	0.332	19%	0.185	S	C	.	.	H	α-helix	trans	-72.8	-37.1	175.9	72.6	-53.9	127.5	0	0	113.5	R853 Y887 K892 M893	R853-E889 IonicContact CZ-OE1 3.1Å; R853-E889 IonicContact NH1-OE1 3.11Å; R853-E889 PolarHBondContact NH1-OE1 3.1Å; R853-E889 IonicContact NH1-OE2 2.71Å; R853-E889 IonicContact NH2-OE1 2.64Å; R853-E889 PolarHBondContact NH2-OE1 3.48Å; Y887-E889 VanDerWaalsContact C-N 3.35Å; Y887-E889 PolarHBondContact O-N 3.38Å; E889-K892 PolarHBondContact O-N 3.27Å; E889-M893 WeakPolarHBondContact O-CB 3.43Å; E889-M893 PolarHBondContact O-N 2.99Å
890	I	93.3	Very high	92.1	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.021	21%	0.208	C	C	.	.	H	α-helix	trans	-60.6	-50.2	171.9	-64.9	164.2	0	0	0	110	R853 L856 Y887 K892 M893 T894	R853-I890 HydrophobicContact CB-CD1 4.01Å; R853-I890 HydrophobicContact CG-CD1 4.23Å; L856-I890 HydrophobicContact CD2-CG2 4.22Å; L856-I890 HydrophobicContact CG-CG2 4.11Å; Y887-I890 PolarHBondContact O-N 3.38Å; Y887-I890 VanDerWaalsContact O-N 3.13Å; I890-K892 PolarHBondContact O-N 2.96Å; I890-M893 PolarHBondContact O-N 3.17Å; I890-T894 PolarHBondContact O-N 3.13Å; I890-T894 PolarHBondContact O-OG1 3.12Å
891	I	95.3	Very high	91.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.8	-43.2	-178.6	-59.3	171.7	0	0	0	110.6	L856 V876 F877 Y880 Y887 M893 T894 I895	L856-I891 HydrophobicContact CD2-CG1 4.26Å; V876-I891 HydrophobicContact CG1-CB 4.39Å; V876-I891 HydrophobicContact CG1-CG1 3.79Å; V876-I891 HydrophobicContact CG1-CG2 4.15Å; F877-I891 HydrophobicContact CD1-CG2 4.27Å; Y880-I891 HydrophobicContact CD2-CB 3.78Å; Y880-I891 HydrophobicContact CD2-CD1 4.34Å; Y880-I891 HydrophobicContact CD2-CG2 3.65Å; Y880-I891 HydrophobicContact CE2-CB 4.35Å; Y880-I891 HydrophobicContact CE2-CG2 4.43Å; Y880-I891 HydrophobicContact CG-CB 4.41Å; Y880-I891 HydrophobicContact CG-CG2 3.76Å; Y887-I891 WeakPolarHBondContact O-CG1 3.39Å; Y887-I891 PolarHBondContact O-N 2.88Å; I891-M893 PolarHBondContact O-N 3.43Å; I891-T894 WeakPolarHBondContact O-CB 3.26Å; I891-T894 PolarHBondContact O-N 2.88Å; I891-I895 HydrophobicContact CG2-CD1 4.15Å; I891-I895 WeakPolarHBondContact O-CG1 3.41Å; I891-I895 PolarHBondContact O-N 2.94Å
892	K	94	Very high	91.9	Very high	86 Å²	86	50.5 Å²	50.5	37%	0.374	24%	0.237	S	C	.	.	H	α-helix	trans	-60.9	-40.5	176.2	-177.4	174.3	-177.5	-179.5	0	112.8	Y880 G888 E889 I890 I895 A896	Y880-K892 HydrophobicContact CE2-CB 4.31Å; G888-K892 WeakPolarHBondContact O-CB 3.38Å; G888-K892 PolarHBondContact O-N 3.48Å; E889-K892 PolarHBondContact O-N 3.27Å; I890-K892 PolarHBondContact O-N 2.96Å; K892-I895 PolarHBondContact O-N 3.35Å; K892-A896 PolarHBondContact O-N 3.16Å
893	M	93	Very high	92	Very high	65 Å²	65	48.8 Å²	48.8	32%	0.32	23%	0.227	S	C	.	.	H	α-helix	trans	-65.8	-41.6	175.1	-174.8	59.7	72.1	0	0	111.2	F28 E889 I890 I891 I895 A896 K897	F28-M893 HydrophobicContact CD1-CB 4.4Å; F28-M893 HydrophobicContact CD1-CG 4.3Å; F28-M893 HydrophobicContact CE1-CB 3.82Å; F28-M893 HydrophobicContact CE1-CG 3.56Å; F28-M893 HydrophobicContact CZ-CG 3.8Å; E889-M893 WeakPolarHBondContact O-CB 3.43Å; E889-M893 PolarHBondContact O-N 2.99Å; I890-M893 PolarHBondContact O-N 3.17Å; I891-M893 PolarHBondContact O-N 3.43Å; M893-I895 PolarHBondContact O-N 3.2Å; M893-A896 PolarHBondContact O-N 3.31Å; M893-K897 HydrophobicContact CG-CG 4.43Å; M893-K897 WeakPolarHBondContact O-CB 3.48Å; M893-K897 WeakPolarHBondContact O-CG 3.28Å; M893-K897 PolarHBondContact O-N 3.35Å; M893-K897 HydrophobicContact SD-CG 4.23Å
894	T	94.9	Very high	92.1	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-60.4	-45.2	176.1	-52.5	0	0	0	0	111.3	S860 V864 F877 I890 I891 A896 K897 C898	S860-T894 WeakPolarHBondContact CB-OG1 3.49Å; S860-T894 PolarHBondContact OG-OG1 2.9Å; V864-T894 HydrophobicContact CG2-CG2 4.35Å; F877-T894 HydrophobicContact CE1-CG2 4Å; I890-T894 PolarHBondContact O-N 3.13Å; I890-T894 PolarHBondContact O-OG1 3.12Å; I891-T894 WeakPolarHBondContact O-CB 3.26Å; I891-T894 PolarHBondContact O-N 2.88Å; T894-A896 PolarHBondContact O-N 3.28Å; T894-K897 PolarHBondContact O-N 3.02Å; T894-C898 WeakPolarHBondContact O-CB 3.15Å; T894-C898 PolarHBondContact O-N 3.11Å; T894-C898 PolarHBondContact O-SG 3.47Å
895	I	94.1	Very high	92.3	Very high	2 Å²	2	48 Å²	48	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-57.7	-47.8	172.9	-66	165.5	0	0	0	111	F877 Y880 I891 K892 M893 K897 C898 R899 M910 F944	F877-I895 HydrophobicContact CD1-CD1 4.35Å; F877-I895 HydrophobicContact CD1-CG1 3.66Å; F877-I895 HydrophobicContact CD2-CG1 4.49Å; F877-I895 HydrophobicContact CE1-CB 4.24Å; F877-I895 HydrophobicContact CE1-CD1 4.43Å; F877-I895 HydrophobicContact CE1-CG1 3.31Å; F877-I895 HydrophobicContact CE2-CG1 4.2Å; F877-I895 HydrophobicContact CG-CG1 4.25Å; F877-I895 HydrophobicContact CZ-CB 4.24Å; F877-I895 HydrophobicContact CZ-CG1 3.62Å; Y880-I895 HydrophobicContact CD1-CD1 4.02Å; Y880-I895 HydrophobicContact CE1-CD1 4.07Å; I891-I895 HydrophobicContact CG2-CD1 4.15Å; I891-I895 WeakPolarHBondContact O-CG1 3.41Å; I891-I895 PolarHBondContact O-N 2.94Å; K892-I895 PolarHBondContact O-N 3.35Å; M893-I895 PolarHBondContact O-N 3.2Å; I895-K897 PolarHBondContact O-N 3.17Å; I895-C898 PolarHBondContact O-N 2.83Å; I895-R899 VanDerWaalsContact O-CB 3.32Å; I895-R899 WeakPolarHBondContact O-CB 3.2Å; I895-R899 PolarHBondContact O-N 3.23Å; I895-M910 HydrophobicContact CG2-CE 4.47Å; I895-M910 HydrophobicContact CG2-SD 4.22Å; I895-F944 HydrophobicContact CD1-CD1 3.92Å; I895-F944 HydrophobicContact CD1-CE1 3.89Å
896	A	92.4	Very high	92.7	Very high	19 Å²	19	42.2 Å²	42.2	16%	0.157	20%	0.202	C	C	.	.	H	α-helix	trans	-61.3	-45.6	-179.1	0	0	0	0	0	112	K892 M893 T894 R899 E900	K892-A896 PolarHBondContact O-N 3.16Å; M893-A896 PolarHBondContact O-N 3.31Å; T894-A896 PolarHBondContact O-N 3.28Å; A896-R899 PolarHBondContact O-N 3.34Å; A896-E900 WeakPolarHBondContact O-CG 3.48Å; A896-E900 PolarHBondContact O-N 3.45Å
897	K	93.2	Very high	93	Very high	85 Å²	85	41 Å²	41	37%	0.37	20%	0.196	S	C	.	.	H	α-helix	trans	-69.9	-39.5	179.2	-72.7	-73.1	161.1	-155.2	0	113.1	V864 M893 T894 I895 R899 E900 K901	V864-K897 HydrophobicContact CB-CB 4.33Å; V864-K897 HydrophobicContact CG1-CB 3.78Å; V864-K897 HydrophobicContact CG1-CD 4.28Å; V864-K897 HydrophobicContact CG1-CG 4.09Å; V864-K897 HydrophobicContact CG2-CB 3.62Å; V864-K897 HydrophobicContact CG2-CG 4.36Å; M893-K897 HydrophobicContact CG-CG 4.43Å; M893-K897 WeakPolarHBondContact O-CB 3.48Å; M893-K897 WeakPolarHBondContact O-CG 3.28Å; M893-K897 PolarHBondContact O-N 3.35Å; M893-K897 HydrophobicContact SD-CG 4.23Å; T894-K897 PolarHBondContact O-N 3.02Å; I895-K897 PolarHBondContact O-N 3.17Å; K897-R899 VanDerWaalsContact C-N 3.3Å; K897-R899 PolarHBondContact O-N 3Å; K897-E900 WeakPolarHBondContact CD-OE2 3.42Å; K897-E900 WeakPolarHBondContact CE-OE2 3.49Å; K897-E900 IonicContact NZ-OE2 3.43Å; K897-E900 PolarHBondContact NZ-OE2 3Å; K897-E900 PolarHBondContact O-N 3.4Å; K897-K901 PolarHBondContact O-N 2.91Å
898	C	93.9	Very high	93.2	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.007	22%	0.219	C	C	.	.	H	α-helix	trans	-61.6	-39.2	171.9	-68.6	0	0	0	0	111.7	I870 F877 T894 I895 K901 D902 C906	I870-C898 HydrophobicContact CG2-CB 4.02Å; F877-C898 HydrophobicContact CZ-CB 4.29Å; T894-C898 WeakPolarHBondContact O-CB 3.15Å; T894-C898 PolarHBondContact O-N 3.11Å; T894-C898 PolarHBondContact O-SG 3.47Å; I895-C898 PolarHBondContact O-N 2.83Å; C898-K901 WeakPolarHBondContact O-CA 3.07Å; C898-K901 PolarHBondContact O-N 3.16Å; C898-D902 CarbonylContact O-C 3.59Å; C898-D902 PolarHBondContact O-N 2.78Å; C898-C906 HydrophobicContact CB-CB 4.13Å
899	R	91.2	Very high	93.4	Very high	64 Å²	64	47.1 Å²	47.1	24%	0.242	22%	0.219	C	C	.	.	H	α-helix	trans	-69.1	-38.7	176.8	178	-171.1	67.2	-156.8	-11.5	113	I895 A896 K897 K901 K903 C906 S947 M948 L958	I895-R899 VanDerWaalsContact O-CB 3.32Å; I895-R899 WeakPolarHBondContact O-CB 3.2Å; I895-R899 PolarHBondContact O-N 3.23Å; A896-R899 PolarHBondContact O-N 3.34Å; K897-R899 VanDerWaalsContact C-N 3.3Å; K897-R899 PolarHBondContact O-N 3Å; R899-K901 VanDerWaalsContact C-N 3.28Å; R899-K903 HydrophobicContact CG-CG 4.27Å; R899-K903 WeakPolarHBondContact O-CG 3.44Å; R899-C906 HydrophobicContact CB-CB 4.45Å; R899-S947 PolarHBondContact NH1-O 3.43Å; R899-M948 PolarHBondContact NH1-O 3.32Å; R899-M948 VanDerWaalsContact NH1-O 3.15Å; R899-L958 HydrophobicContact CB-CD1 4.47Å; R899-L958 HydrophobicContact CG-CD1 3.78Å
900	E	90.4	Very high	93.7	Very high	119 Å²	119	43.8 Å²	43.8	56%	0.556	20%	0.203	S	C	*	.	H	α-helix	trans	-61.9	-41.1	171.3	-75.2	165	-161.1	0	0	110.5	A896 K897	A896-E900 WeakPolarHBondContact O-CG 3.48Å; A896-E900 PolarHBondContact O-N 3.45Å; K897-E900 WeakPolarHBondContact CD-OE2 3.42Å; K897-E900 WeakPolarHBondContact CE-OE2 3.49Å; K897-E900 IonicContact NZ-OE2 3.43Å; K897-E900 PolarHBondContact NZ-OE2 3Å; K897-E900 PolarHBondContact O-N 3.4Å
901	K	89.8	Confident	93.8	Very high	99 Å²	99	43.7 Å²	43.7	43%	0.43	20%	0.203	S	C	.	.	H	α-helix	trans	-52.6	-73.8	170.8	157.3	-64.6	-169	104.3	0	114.2	V864 S866 I870 K897 C898 R899	V864-K901 PolarHBondContact O-NZ 3.25Å; S866-K901 VanDerWaalsContact CB-CE 3.47Å; S866-K901 VanDerWaalsContact CB-NZ 3.29Å; S866-K901 VanDerWaalsContact OG-CE 3.27Å; S866-K901 WeakPolarHBondContact OG-CE 3.43Å; S866-K901 PolarHBondContact OG-NZ 3.21Å; I870-K901 HydrophobicContact CD1-CD 4.41Å; K897-K901 PolarHBondContact O-N 2.91Å; C898-K901 WeakPolarHBondContact O-CA 3.07Å; C898-K901 PolarHBondContact O-N 3.16Å; R899-K901 VanDerWaalsContact C-N 3.28Å
902	D	93	Very high	93.9	Very high	71 Å²	71	46.3 Å²	46.3	38%	0.38	22%	0.217	S	C	.	.			trans	-151	111.9	-179.6	175.5	-12.1	0	0	0	108.9	I870 C898 I904 A905 C906	I870-D902 HydrophobicContact CD1-CB 3.82Å; C898-D902 CarbonylContact O-C 3.59Å; C898-D902 PolarHBondContact O-N 2.78Å; D902-I904 VanDerWaalsContact C-N 3.31Å; D902-I904 PolarHBondContact O-N 3.05Å; D902-I904 WeakPolarHBondContact OD1-CA 3.17Å; D902-I904 WeakPolarHBondContact OD1-CB 3.3Å; D902-I904 PolarHBondContact OD1-N 2.8Å; D902-A905 HydrophobicContact CB-CB 3.98Å; D902-A905 PolarHBondContact OD1-N 2.83Å; D902-A905 VanDerWaalsContact OD2-CB 3.32Å; D902-A905 WeakPolarHBondContact OD2-CB 3.36Å; D902-C906 WeakPolarHBondContact O-CB 3.21Å; D902-C906 PolarHBondContact O-N 3.49Å
903	K	91.6	Very high	94	Very high	76 Å²	76	42.2 Å²	42.2	33%	0.33	20%	0.199	S	C	.	.	H	α-helix	trans	-62.7	-34.5	179.9	-57.3	179	-167.2	174.4	0	113.1	R899 A907 E957	R899-K903 HydrophobicContact CG-CG 4.27Å; R899-K903 WeakPolarHBondContact O-CG 3.44Å; K903-A907 VanDerWaalsContact O-CB 3.26Å; K903-A907 WeakPolarHBondContact O-CB 3.34Å; K903-A907 PolarHBondContact O-N 3.33Å; K903-E957 WeakPolarHBondContact CD-OE2 3.38Å; K903-E957 WeakPolarHBondContact CE-OE2 3.27Å; K903-E957 IonicContact NZ-OE2 2.86Å; K903-E957 PolarHBondContact NZ-OE2 3.38Å
904	I	92.8	Very high	94.2	Very high	71 Å²	71	39.1 Å²	39.1	36%	0.364	18%	0.184	S	C	.	.	H	α-helix	trans	-77.2	-46.1	-176	-67.8	174.3	0	0	0	109.8	D902 C906 A907 R908 M961	D902-I904 VanDerWaalsContact C-N 3.31Å; D902-I904 PolarHBondContact O-N 3.05Å; D902-I904 WeakPolarHBondContact OD1-CA 3.17Å; D902-I904 WeakPolarHBondContact OD1-CB 3.3Å; D902-I904 PolarHBondContact OD1-N 2.8Å; I904-C906 VanDerWaalsContact C-N 3.33Å; I904-A907 PolarHBondContact O-N 2.88Å; I904-R908 WeakPolarHBondContact O-CG 3.38Å; I904-R908 PolarHBondContact O-N 2.84Å; I904-M961 HydrophobicContact CD1-CE 4.43Å; I904-M961 HydrophobicContact CG1-CE 4.23Å; I904-M961 HydrophobicContact CG2-CE 3.85Å; I904-M961 HydrophobicContact CG2-CG 4.23Å; I904-M961 HydrophobicContact CG2-SD 4.17Å
905	A	95	Very high	94.3	Very high	24 Å²	24	39.7 Å²	39.7	20%	0.198	19%	0.188	C	C	.	.	H	α-helix	trans	-63.7	-39.8	174	0	0	0	0	0	111.6	I870 D902 R908 S909	I870-A905 HydrophobicContact CB-CB 3.95Å; I870-A905 HydrophobicContact CD1-CB 4.05Å; I870-A905 HydrophobicContact CG2-CB 3.95Å; D902-A905 HydrophobicContact CB-CB 3.98Å; D902-A905 PolarHBondContact OD1-N 2.83Å; D902-A905 VanDerWaalsContact OD2-CB 3.32Å; D902-A905 WeakPolarHBondContact OD2-CB 3.36Å; A905-R908 PolarHBondContact O-N 3.17Å; A905-S909 PolarHBondContact O-N 3.11Å; A905-S909 PolarHBondContact O-OG 3.24Å
906	C	95	Very high	94.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.6	-48	174.4	-170.9	0	0	0	0	111.5	I870 C898 R899 D902 I904 R908 S909 M910	I870-C906 HydrophobicContact CG2-CB 4.38Å; C898-C906 HydrophobicContact CB-CB 4.13Å; R899-C906 HydrophobicContact CB-CB 4.45Å; D902-C906 WeakPolarHBondContact O-CB 3.21Å; D902-C906 PolarHBondContact O-N 3.49Å; I904-C906 VanDerWaalsContact C-N 3.33Å; C906-R908 VanDerWaalsContact C-N 3.32Å; C906-R908 PolarHBondContact O-N 2.93Å; C906-S909 PolarHBondContact O-N 2.97Å; C906-M910 WeakPolarHBondContact O-CB 3.23Å; C906-M910 VanDerWaalsContact O-CG 3.25Å; C906-M910 WeakPolarHBondContact O-CG 3.48Å; C906-M910 PolarHBondContact O-N 3.42Å
907	A	94.8	Very high	94.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-57.5	-41.2	175.3	0	0	0	0	0	113.3	K903 I904 T911 L958 M961 I962	K903-A907 VanDerWaalsContact O-CB 3.26Å; K903-A907 WeakPolarHBondContact O-CB 3.34Å; K903-A907 PolarHBondContact O-N 3.33Å; I904-A907 PolarHBondContact O-N 2.88Å; A907-T911 PolarHBondContact O-N 3.06Å; A907-T911 PolarHBondContact O-OG1 3.45Å; A907-L958 HydrophobicContact CB-CD2 3.64Å; A907-L958 HydrophobicContact CB-CG 3.89Å; A907-M961 HydrophobicContact CB-CB 3.66Å; A907-M961 HydrophobicContact CB-CG 3.73Å; A907-I962 HydrophobicContact CB-CG1 4.16Å
908	R	96.4	Very high	94.4	Very high	130 Å²	130	37.3 Å²	37.3	49%	0.491	18%	0.179	S	C	.	.	H	α-helix	trans	-62.9	-49	175.7	-74.7	173.9	179.1	178.5	-0.5	111.3	I904 A905 C906 M910 T911 D912 M961	I904-R908 WeakPolarHBondContact O-CG 3.38Å; I904-R908 PolarHBondContact O-N 2.84Å; A905-R908 PolarHBondContact O-N 3.17Å; C906-R908 VanDerWaalsContact C-N 3.32Å; C906-R908 PolarHBondContact O-N 2.93Å; R908-M910 VanDerWaalsContact C-N 3.31Å; R908-M910 PolarHBondContact O-N 3.19Å; R908-T911 CarbonylContact O-C 3.58Å; R908-T911 WeakPolarHBondContact O-CA 3.11Å; R908-T911 WeakPolarHBondContact O-CB 3.44Å; R908-T911 PolarHBondContact O-N 2.89Å; R908-D912 PolarHBondContact O-N 3.47Å; R908-M961 HydrophobicContact CG-CG 4.31Å
909	S	96.6	Very high	94.4	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.014	20%	0.203	C	C	.	.	H	α-helix	trans	-64.2	-35.3	179.6	-44.3	0	0	0	0	112.6	I870 R871 T874 A905 C906 T911 A913	I870-S909 VanDerWaalsContact C-OG 3.31Å; I870-S909 WeakPolarHBondContact O-CB 3.18Å; I870-S909 PolarHBondContact O-OG 2.68Å; R871-S909 WeakPolarHBondContact CA-OG 3.09Å; R871-S909 PolarHBondContact N-OG 2.99Å; T874-S909 PolarHBondContact OG1-O 2.78Å; A905-S909 PolarHBondContact O-N 3.11Å; A905-S909 PolarHBondContact O-OG 3.24Å; C906-S909 PolarHBondContact O-N 2.97Å; S909-T911 VanDerWaalsContact C-N 3.33Å; S909-A913 VanDerWaalsContact O-CB 3.3Å; S909-A913 WeakPolarHBondContact O-CB 3.45Å; S909-A913 PolarHBondContact O-N 3.43Å
910	M	96.5	Very high	94.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.9	-35.5	170.6	-68.4	167.7	70.8	0	0	111.8	F877 I895 C906 R908 L914 F944 M948 L958 I962	F877-M910 HydrophobicContact CD2-CG 3.7Å; F877-M910 HydrophobicContact CE2-CG 3.78Å; I895-M910 HydrophobicContact CG2-CE 4.47Å; I895-M910 HydrophobicContact CG2-SD 4.22Å; C906-M910 WeakPolarHBondContact O-CB 3.23Å; C906-M910 VanDerWaalsContact O-CG 3.25Å; C906-M910 WeakPolarHBondContact O-CG 3.48Å; C906-M910 PolarHBondContact O-N 3.42Å; R908-M910 VanDerWaalsContact C-N 3.31Å; R908-M910 PolarHBondContact O-N 3.19Å; M910-L914 WeakPolarHBondContact O-CG 3.32Å; M910-L914 PolarHBondContact O-N 3.29Å; M910-F944 HydrophobicContact CB-CD2 4.01Å; M910-F944 HydrophobicContact CB-CE2 3.87Å; M910-F944 HydrophobicContact CB-CZ 4.48Å; M910-F944 HydrophobicContact CE-CB 3.45Å; M910-F944 VanDerWaalsContact CE-CB 3.45Å; M910-F944 HydrophobicContact CE-CD1 4.01Å; M910-F944 HydrophobicContact CE-CD2 3.8Å; M910-F944 HydrophobicContact CE-CG 3.48Å; M910-F944 VanDerWaalsContact CE-CG 3.48Å; M910-F944 HydrophobicContact CG-CD2 4.38Å; M910-F944 HydrophobicContact CG-CE2 4.29Å; M910-F944 HydrophobicContact CG-CZ 4.49Å; M910-F944 WeakPolarHBondContact O-CE2 3.36Å; M910-M948 HydrophobicContact CE-CE 4.33Å; M910-M948 HydrophobicContact CE-CG 4.46Å; M910-L958 HydrophobicContact CE-CD2 4.31Å; M910-L958 HydrophobicContact SD-CD2 3.94Å; M910-I962 HydrophobicContact CE-CD1 4.22Å
911	T	96.6	Very high	94.4	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.012	21%	0.208	C	C	.	.	H	α-helix	trans	-74.1	-45.5	176.2	-47.6	0	0	0	0	111.4	A907 R908 S909 A913 L914 C915 I962 C965	A907-T911 PolarHBondContact O-N 3.06Å; A907-T911 PolarHBondContact O-OG1 3.45Å; R908-T911 CarbonylContact O-C 3.58Å; R908-T911 WeakPolarHBondContact O-CA 3.11Å; R908-T911 WeakPolarHBondContact O-CB 3.44Å; R908-T911 PolarHBondContact O-N 2.89Å; S909-T911 VanDerWaalsContact C-N 3.33Å; T911-A913 PolarHBondContact O-N 3.41Å; T911-L914 WeakPolarHBondContact O-CB 3.44Å; T911-L914 PolarHBondContact O-N 3.29Å; T911-C915 PolarHBondContact O-N 3.48Å; T911-C915 PolarHBondContact O-SG 2.87Å; T911-I962 WeakPolarHBondContact OG1-CA 3.23Å; T911-C965 HydrophobicContact CG2-CB 3.65Å
912	D	96.9	Very high	94.4	Very high	55 Å²	55	38.4 Å²	38.4	29%	0.294	19%	0.188	S	C	.	.	H	α-helix	trans	-55.7	-38.8	174.4	-72.8	2.7	0	0	0	110.5	R871 T874 R908 C915 S916	R871-D912 IonicContact NE-OD2 2.68Å; R871-D912 PolarHBondContact NE-OD2 3.36Å; T874-D912 HydrophobicContact CG2-CB 3.84Å; R908-D912 PolarHBondContact O-N 3.47Å; D912-C915 PolarHBondContact O-N 3.09Å; D912-S916 VanDerWaalsContact O-CB 3.23Å; D912-S916 WeakPolarHBondContact O-CB 3.43Å; D912-S916 PolarHBondContact O-N 2.92Å
913	A	97	Very high	93.9	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.2	-41.4	174.9	0	0	0	0	0	113.2	T874 F877 K878 S909 T911 L917 F944	T874-A913 HydrophobicContact CG2-CB 4.28Å; F877-A913 HydrophobicContact CB-CB 3.81Å; K878-A913 HydrophobicContact CB-CB 4Å; S909-A913 VanDerWaalsContact O-CB 3.3Å; S909-A913 WeakPolarHBondContact O-CB 3.45Å; S909-A913 PolarHBondContact O-N 3.43Å; T911-A913 PolarHBondContact O-N 3.41Å; A913-L917 WeakPolarHBondContact O-CB 3.18Å; A913-L917 PolarHBondContact O-N 3.34Å; A913-F944 HydrophobicContact CB-CZ 4.41Å
914	L	96.9	Very high	93.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.6	-43.4	174.5	-71.9	161.8	0	0	0	111.6	M910 T911 L917 Y918 V937 L940 I941 F944 F983 V986	M910-L914 WeakPolarHBondContact O-CG 3.32Å; M910-L914 PolarHBondContact O-N 3.29Å; T911-L914 WeakPolarHBondContact O-CB 3.44Å; T911-L914 PolarHBondContact O-N 3.29Å; L914-L917 PolarHBondContact O-N 3.47Å; L914-Y918 VanDerWaalsContact O-CB 3.31Å; L914-Y918 WeakPolarHBondContact O-CB 3.47Å; L914-Y918 PolarHBondContact O-N 2.93Å; L914-V937 HydrophobicContact CB-CG1 4.5Å; L914-V937 HydrophobicContact CD2-CG1 3.86Å; L914-L940 HydrophobicContact CD2-CB 3.99Å; L914-L940 HydrophobicContact CD2-CD2 3.89Å; L914-L940 HydrophobicContact CD2-CG 3.85Å; L914-L940 HydrophobicContact CG-CD2 4.43Å; L914-I941 HydrophobicContact CD1-CB 4.1Å; L914-I941 HydrophobicContact CD1-CD1 3.78Å; L914-I941 HydrophobicContact CD1-CG1 3.89Å; L914-I941 HydrophobicContact CD2-CB 3.79Å; L914-F944 HydrophobicContact CD1-CD2 4.12Å; L914-F944 HydrophobicContact CD1-CE2 4.19Å; L914-F944 HydrophobicContact CD2-CE2 4.36Å; L914-F944 HydrophobicContact CG-CD2 4.29Å; L914-F944 HydrophobicContact CG-CE2 3.94Å; L914-F983 HydrophobicContact CB-CE2 3.94Å; L914-F983 HydrophobicContact CB-CZ 3.72Å; L914-V986 HydrophobicContact CD2-CG1 4.45Å
915	C	96	Very high	93.2	Very high	13 Å²	13	39.4 Å²	39.4	9%	0.088	21%	0.208	C	C	.	.	H	α-helix	trans	-64.2	-43.4	177.4	-63.7	0	0	0	0	111.3	T911 D912 Y918 Q919 F969	T911-C915 PolarHBondContact O-N 3.48Å; T911-C915 PolarHBondContact O-SG 2.87Å; D912-C915 PolarHBondContact O-N 3.09Å; C915-Y918 PolarHBondContact O-N 2.69Å; C915-Q919 WeakPolarHBondContact O-CB 3.48Å; C915-Q919 VanDerWaalsContact O-CG 3.31Å; C915-Q919 WeakPolarHBondContact O-CG 3.3Å; C915-Q919 PolarHBondContact O-N 3.29Å; C915-F969 HydrophobicContact CB-CD1 4.36Å; C915-F969 HydrophobicContact CB-CD2 3.99Å; C915-F969 HydrophobicContact CB-CE1 4.31Å; C915-F969 HydrophobicContact CB-CE2 3.93Å; C915-F969 HydrophobicContact CB-CG 4.21Å; C915-F969 HydrophobicContact CB-CZ 4.1Å; C915-F969 WeakPolarHBondContact SG-CG 3.17Å
916	S	94.3	Very high	92.5	Very high	38 Å²	38	41.5 Å²	41.5	27%	0.266	22%	0.219	S	C	.	.	H	α-helix	trans	-61.3	-45.3	175.9	-178.3	0	0	0	0	111.8	D912 Q919 K920	D912-S916 VanDerWaalsContact O-CB 3.23Å; D912-S916 WeakPolarHBondContact O-CB 3.43Å; D912-S916 PolarHBondContact O-N 2.92Å; S916-Q919 PolarHBondContact O-N 3.49Å; S916-K920 WeakPolarHBondContact O-CB 3.15Å; S916-K920 PolarHBondContact O-N 2.98Å
917	L	94.1	Very high	91.6	Very high	17 Å²	17	45.3 Å²	45.3	9%	0.089	24%	0.244	C	C	.	.	H	α-helix	trans	-66.3	-41.4	176.1	-175.8	61.3	0	0	0	112	A913 L914 K920 L921 V937 L940	A913-L917 WeakPolarHBondContact O-CB 3.18Å; A913-L917 PolarHBondContact O-N 3.34Å; L914-L917 PolarHBondContact O-N 3.47Å; L917-K920 PolarHBondContact O-N 3.11Å; L917-L921 HydrophobicContact CD1-CD1 3.9Å; L917-L921 HydrophobicContact CD1-CG 4.22Å; L917-L921 HydrophobicContact CG-CD1 3.94Å; L917-L921 WeakPolarHBondContact O-CG 3.49Å; L917-L921 PolarHBondContact O-N 3.04Å; L917-V937 HydrophobicContact CD2-CG2 4.41Å; L917-V937 HydrophobicContact CG-CG2 4.23Å; L917-L940 HydrophobicContact CD2-CB 4.26Å; L917-L940 HydrophobicContact CD2-CD2 3.71Å
918	Y	94.6	Very high	90.6	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-59.8	-45.6	173.8	178.9	-84.4	0	0	0	111.3	L914 C915 L921 C922 L934 F969 P979 N980 H982 F983	L914-Y918 VanDerWaalsContact O-CB 3.31Å; L914-Y918 WeakPolarHBondContact O-CB 3.47Å; L914-Y918 PolarHBondContact O-N 2.93Å; C915-Y918 PolarHBondContact O-N 2.69Å; Y918-L921 PolarHBondContact O-N 3.31Å; Y918-C922 HydrophobicContact CD1-CB 4.31Å; Y918-C922 HydrophobicContact CE1-CB 4.07Å; Y918-C922 HydrophobicContact CE2-CB 4.39Å; Y918-C922 WeakPolarHBondContact O-CA 3.43Å; Y918-C922 VanDerWaalsContact O-CB 3.24Å; Y918-C922 WeakPolarHBondContact O-CB 3.48Å; Y918-C922 PolarHBondContact O-N 3.4Å; Y918-L934 HydrophobicContact CD2-CD2 3.86Å; Y918-L934 HydrophobicContact CE2-CD2 3.58Å; Y918-F969 AromaticContact CD1-CE1 3.68Å; Y918-F969 HydrophobicContact CD1-CE1 3.68Å; Y918-F969 AromaticContact CD1-CZ 3.81Å; Y918-F969 HydrophobicContact CD1-CZ 3.81Å; Y918-F969 HydrophobicContact CE1-CE1 4.09Å; Y918-F969 HydrophobicContact CE1-CZ 4.32Å; Y918-F969 HydrophobicContact CG-CE1 4.21Å; Y918-P979 PolarHBondContact OH-O 3.32Å; Y918-N980 HydrophobicContact CE1-CB 4.4Å; Y918-H982 HydrophobicContact CE2-CB 4.45Å; Y918-F983 HydrophobicContact CD2-CB 4.45Å; Y918-F983 AromaticContact CD2-CD2 3.76Å; Y918-F983 HydrophobicContact CD2-CD2 3.76Å; Y918-F983 HydrophobicContact CE2-CB 4.23Å; Y918-F983 HydrophobicContact CE2-CD2 4.36Å; Y918-F983 AromaticContact CG-CD2 3.87Å; Y918-F983 HydrophobicContact CG-CD2 3.87Å
919	Q	93.3	Very high	89.9	Confident	105 Å²	105	53 Å²	53	49%	0.491	29%	0.286	S	S	.	.	H	α-helix	trans	-63.7	-42.2	177	-74.4	176.1	-30.5	0	0	112.2	C915 S916 L921 G923 F969	C915-Q919 WeakPolarHBondContact O-CB 3.48Å; C915-Q919 VanDerWaalsContact O-CG 3.31Å; C915-Q919 WeakPolarHBondContact O-CG 3.3Å; C915-Q919 PolarHBondContact O-N 3.29Å; S916-Q919 PolarHBondContact O-N 3.49Å; Q919-L921 VanDerWaalsContact C-N 3.3Å; Q919-L921 PolarHBondContact O-N 3Å; Q919-G923 WeakPolarHBondContact O-CA 3.47Å; Q919-G923 PolarHBondContact O-N 3.42Å; Q919-F969 HydrophobicContact CG-CE2 4.26Å; Q919-F969 HydrophobicContact CG-CZ 3.97Å
920	K	90.9	Very high	89.3	Confident	152 Å²	152	54.2 Å²	54.2	66%	0.661	29%	0.29	S	S	*	.	H	α-helix	trans	-58	-40.6	175.2	-177.1	-174	175.8	-170.7	0	112.1	S916 L917	S916-K920 WeakPolarHBondContact O-CB 3.15Å; S916-K920 PolarHBondContact O-N 2.98Å; L917-K920 PolarHBondContact O-N 3.11Å
921	L	90.3	Very high	88.5	Confident	49 Å²	49	55.8 Å²	55.8	26%	0.257	30%	0.303	S	S	.	.	H	α-helix	trans	-89.2	-36.5	-174.6	-65.5	172.8	0	0	0	113.8	L917 Y918 Q919 V925 P936 V937	L917-L921 HydrophobicContact CD1-CD1 3.9Å; L917-L921 HydrophobicContact CD1-CG 4.22Å; L917-L921 HydrophobicContact CG-CD1 3.94Å; L917-L921 WeakPolarHBondContact O-CG 3.49Å; L917-L921 PolarHBondContact O-N 3.04Å; Y918-L921 PolarHBondContact O-N 3.31Å; Q919-L921 VanDerWaalsContact C-N 3.3Å; Q919-L921 PolarHBondContact O-N 3Å; L921-V925 WeakPolarHBondContact O-CG2 3.4Å; L921-P936 HydrophobicContact CD1-CB 3.84Å; L921-P936 HydrophobicContact CD1-CG 3.82Å; L921-V937 HydrophobicContact CD1-CG2 3.92Å
922	C	89.2	Confident	87.9	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-109.5	-14	-170.6	-61	0	0	0	0	114.1	Y918 N924 V925 R930	Y918-C922 HydrophobicContact CD1-CB 4.31Å; Y918-C922 HydrophobicContact CE1-CB 4.07Å; Y918-C922 HydrophobicContact CE2-CB 4.39Å; Y918-C922 WeakPolarHBondContact O-CA 3.43Å; Y918-C922 VanDerWaalsContact O-CB 3.24Å; Y918-C922 WeakPolarHBondContact O-CB 3.48Å; Y918-C922 PolarHBondContact O-N 3.4Å; C922-N924 VanDerWaalsContact C-N 3.34Å; C922-N924 PolarHBondContact O-N 3.12Å; C922-V925 PolarHBondContact O-N 2.91Å; C922-V925 VanDerWaalsContact O-N 3.11Å; C922-R930 HydrophobicContact CB-CB 4.33Å; C922-R930 HydrophobicContact CB-CG 3.97Å; C922-R930 PolarHBondContact O-NE 3.17Å; C922-R930 VanDerWaalsContact O-NE 3.11Å; C922-R930 PolarHBondContact O-NH2 3.01Å
923	G	83.8	Confident	87.5	Confident	42 Å²	42	62.3 Å²	62.3	43%	0.433	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-39.9	-171.8	0	0	0	0	0	114.1	Q919	Q919-G923 WeakPolarHBondContact O-CA 3.47Å; Q919-G923 PolarHBondContact O-N 3.42Å
924	N	83.4	Confident	87.2	Confident	172 Å²	172	62.3 Å²	62.3	92%	0.92	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	1.5	178.1	-64.6	-21.1	0	0	0	113.5	C922	C922-N924 VanDerWaalsContact C-N 3.34Å; C922-N924 PolarHBondContact O-N 3.12Å
925	V	85.2	Confident	87	Confident	25 Å²	25	65.3 Å²	65.3	15%	0.152	36%	0.363	C	S	.	.	S	Bend	trans	-92.7	136.7	-176.9	178.1	0	0	0	0	109.2	L921 C922 E929 R930	L921-V925 WeakPolarHBondContact O-CG2 3.4Å; C922-V925 PolarHBondContact O-N 2.91Å; C922-V925 VanDerWaalsContact O-N 3.11Å; V925-E929 HydrophobicContact CG1-CB 3.51Å; V925-R930 HydrophobicContact CB-CG 4.28Å; V925-R930 HydrophobicContact CG1-CG 4.17Å; V925-R930 VanDerWaalsContact O-CZ 3.32Å; V925-R930 PolarHBondContact O-NE 3.33Å; V925-R930 PolarHBondContact O-NH2 3.07Å
926	P	81.1	Confident	86.8	Confident	67 Å²	67	67.5 Å²	67.5	44%	0.435	38%	0.377	S	S	.	.			trans	-53.9	143.6	173.4	-24.9	34.4	0	0	0	111.3	E928 E929 R930	P926-E928 PolarHBondContact O-N 3.29Å; P926-E929 PolarHBondContact O-N 2.96Å; P926-R930 WeakPolarHBondContact O-CG 3.33Å; P926-R930 PolarHBondContact O-N 2.89Å
927	P	75.7	Confident	86.8	Confident	80 Å²	80	65.7 Å²	65.7	52%	0.519	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-49.6	-39.6	-175.8	-30.2	36.4	0	0	0	114.5	E929 R930	P927-E929 VanDerWaalsContact C-N 3.31Å; P927-E929 PolarHBondContact O-N 3.12Å; P927-R930 PolarHBondContact O-N 3.04Å
928	E	74.6	Confident	86.8	Confident	185 Å²	185	68.1 Å²	68.1	86%	0.864	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-62.9	-30.5	-179.4	-61.4	175.2	-159.3	0	0	113.7	P926	P926-E928 PolarHBondContact O-N 3.29Å
929	E	81.8	Confident	86.8	Confident	108 Å²	108	71 Å²	71	51%	0.505	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-96.9	-0.4	-176.9	-66.9	176.7	-170.8	0	0	113.1	V925 P926 P927 A931 D932 N933	V925-E929 HydrophobicContact CG1-CB 3.51Å; P926-E929 PolarHBondContact O-N 2.96Å; P927-E929 VanDerWaalsContact C-N 3.31Å; P927-E929 PolarHBondContact O-N 3.12Å; E929-A931 VanDerWaalsContact C-N 3.3Å; E929-A931 PolarHBondContact O-N 3.03Å; E929-D932 PolarHBondContact O-N 3.3Å; E929-N933 PolarHBondContact O-ND2 3.4Å
930	R	83.1	Confident	86.9	Confident	27 Å²	27	66 Å²	66	10%	0.102	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-31.8	-177.1	-67.9	-176.9	-179.1	-177.2	-3	112.7	C922 V925 P926 P927 D932 N933 L934 P979	C922-R930 HydrophobicContact CB-CB 4.33Å; C922-R930 HydrophobicContact CB-CG 3.97Å; C922-R930 PolarHBondContact O-NE 3.17Å; C922-R930 VanDerWaalsContact O-NE 3.11Å; C922-R930 PolarHBondContact O-NH2 3.01Å; V925-R930 HydrophobicContact CB-CG 4.28Å; V925-R930 HydrophobicContact CG1-CG 4.17Å; V925-R930 VanDerWaalsContact O-CZ 3.32Å; V925-R930 PolarHBondContact O-NE 3.33Å; V925-R930 PolarHBondContact O-NH2 3.07Å; P926-R930 WeakPolarHBondContact O-CG 3.33Å; P926-R930 PolarHBondContact O-N 2.89Å; P927-R930 PolarHBondContact O-N 3.04Å; R930-D932 VanDerWaalsContact C-N 3.29Å; R930-D932 PolarHBondContact O-N 3.43Å; R930-N933 PolarHBondContact O-N 3.03Å; R930-L934 WeakPolarHBondContact O-CG 3.05Å; R930-P979 PolarHBondContact NH1-O 2.89Å
931	A	80.9	Confident	87.1	Confident	32 Å²	32	58.9 Å²	58.9	26%	0.264	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-37.3	179.4	0	0	0	0	0	112.9	E929 N933 L934	E929-A931 VanDerWaalsContact C-N 3.3Å; E929-A931 PolarHBondContact O-N 3.03Å; A931-N933 VanDerWaalsContact C-N 3.29Å; A931-N933 PolarHBondContact O-N 3.16Å; A931-L934 WeakPolarHBondContact O-CG 3.46Å; A931-L934 PolarHBondContact O-N 3.05Å
932	D	83.9	Confident	87.2	Confident	134 Å²	134	61.7 Å²	61.7	72%	0.717	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-70.6	-27.6	-179.1	-66.5	-30.3	0	0	0	112.4	E929 R930 L934	E929-D932 PolarHBondContact O-N 3.3Å; R930-D932 VanDerWaalsContact C-N 3.29Å; R930-D932 PolarHBondContact O-N 3.43Å; D932-L934 VanDerWaalsContact C-N 3.34Å
933	N	87.4	Confident	87.4	Confident	60 Å²	60	64.5 Å²	64.5	32%	0.321	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-87.3	1.1	-178.7	-70	-76	0	0	0	113.8	E929 R930 A931 A935 P936	E929-N933 PolarHBondContact O-ND2 3.4Å; R930-N933 PolarHBondContact O-N 3.03Å; A931-N933 VanDerWaalsContact C-N 3.29Å; A931-N933 PolarHBondContact O-N 3.16Å; N933-A935 VanDerWaalsContact C-N 3.32Å; N933-A935 PolarHBondContact O-N 3.02Å; N933-P936 WeakPolarHBondContact O-CD 3.32Å
934	L	90.6	Very high	87.9	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-75.1	-14.5	-178.3	-58.8	-177.6	0	0	0	114.5	Y918 R930 A931 D932 V937 R938 H982 E985 V986	Y918-L934 HydrophobicContact CD2-CD2 3.86Å; Y918-L934 HydrophobicContact CE2-CD2 3.58Å; R930-L934 WeakPolarHBondContact O-CG 3.05Å; A931-L934 WeakPolarHBondContact O-CG 3.46Å; A931-L934 PolarHBondContact O-N 3.05Å; D932-L934 VanDerWaalsContact C-N 3.34Å; L934-V937 PolarHBondContact O-N 2.7Å; L934-R938 HydrophobicContact CB-CG 4.38Å; L934-R938 PolarHBondContact O-N 3.34Å; L934-H982 HydrophobicContact CD1-CB 4.28Å; L934-H982 HydrophobicContact CD2-CB 4.47Å; L934-E985 HydrophobicContact CD1-CB 4.13Å; L934-V986 HydrophobicContact CD2-CG2 4.31Å
935	A	92.2	Very high	88.1	Confident	64 Å²	64	54.8 Å²	54.8	53%	0.529	29%	0.289	S	S	.	.	H	α-helix	trans	-55.8	-44.9	-170.8	0	0	0	0	0	114.3	N933 V937 R938 E939	N933-A935 VanDerWaalsContact C-N 3.32Å; N933-A935 PolarHBondContact O-N 3.02Å; A935-V937 PolarHBondContact O-N 3.02Å; A935-R938 PolarHBondContact O-N 2.72Å; A935-E939 WeakPolarHBondContact O-CB 3.38Å; A935-E939 PolarHBondContact O-N 3.25Å
936	P	92.3	Very high	88.2	Confident	58 Å²	58	58.4 Å²	58.4	38%	0.377	31%	0.312	S	S	.	.	H	α-helix	trans	-66.7	-34.8	176	-19.6	33.8	0	0	0	113	L921 N933 E939 L940	L921-P936 HydrophobicContact CD1-CB 3.84Å; L921-P936 HydrophobicContact CD1-CG 3.82Å; N933-P936 WeakPolarHBondContact O-CD 3.32Å; P936-E939 PolarHBondContact O-N 2.74Å; P936-L940 WeakPolarHBondContact O-CB 3.38Å; P936-L940 PolarHBondContact O-N 2.99Å
937	V	94.6	Very high	88.4	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-70	-41.7	178.6	-161.3	0	0	0	0	110.9	L914 L917 L921 L934 A935 E939 L940 I941 F983 V986	L914-V937 HydrophobicContact CB-CG1 4.5Å; L914-V937 HydrophobicContact CD2-CG1 3.86Å; L917-V937 HydrophobicContact CD2-CG2 4.41Å; L917-V937 HydrophobicContact CG-CG2 4.23Å; L921-V937 HydrophobicContact CD1-CG2 3.92Å; L934-V937 PolarHBondContact O-N 2.7Å; A935-V937 PolarHBondContact O-N 3.02Å; V937-E939 VanDerWaalsContact C-N 3.34Å; V937-L940 PolarHBondContact O-N 3.19Å; V937-I941 PolarHBondContact O-N 3.45Å; V937-F983 HydrophobicContact CG1-CE2 4.41Å; V937-V986 HydrophobicContact CB-CG2 4.18Å; V937-V986 HydrophobicContact CG1-CG1 3.81Å; V937-V986 HydrophobicContact CG1-CG2 3.99Å
938	R	94.7	Very high	88.8	Confident	68 Å²	68	52.5 Å²	52.5	26%	0.257	27%	0.273	S	S	.	.	H	α-helix	trans	-63.2	-38.7	173	-72.5	-176.5	-177.3	155.5	-3.2	111.8	L934 A935 I941 R942 E985 V986	L934-R938 HydrophobicContact CB-CG 4.38Å; L934-R938 PolarHBondContact O-N 3.34Å; A935-R938 PolarHBondContact O-N 2.72Å; R938-I941 WeakPolarHBondContact O-CG2 3.3Å; R938-R942 WeakPolarHBondContact O-CB 3.45Å; R938-R942 VanDerWaalsContact O-CG 3.24Å; R938-R942 WeakPolarHBondContact O-CG 3.25Å; R938-R942 PolarHBondContact O-N 3.4Å; R938-R942 VanDerWaalsContact O-N 3.11Å; R938-E985 IonicContact CZ-OE2 2.9Å; R938-E985 IonicContact NH2-OE2 2.92Å; R938-E985 PolarHBondContact NH2-OE2 3.35Å; R938-V986 HydrophobicContact CG-CG2 4.34Å
939	E	93.1	Very high	89	Confident	63 Å²	63	45.1 Å²	45.1	29%	0.294	25%	0.247	S	C	.	.	H	α-helix	trans	-65.8	-41.6	174.5	-179.1	61	-174.2	0	0	112.1	A881 A935 P936 V937 R942 R943	A881-E939 HydrophobicContact CB-CG 4.1Å; A935-E939 WeakPolarHBondContact O-CB 3.38Å; A935-E939 PolarHBondContact O-N 3.25Å; P936-E939 PolarHBondContact O-N 2.74Å; V937-E939 VanDerWaalsContact C-N 3.34Å; E939-R942 PolarHBondContact O-N 2.83Å; E939-R943 WeakPolarHBondContact O-CG 3.46Å; E939-R943 PolarHBondContact O-N 3.35Å; E939-R943 IonicContact OE1-CZ 2.62Å; E939-R943 IonicContact OE1-NE 3.15Å; E939-R943 PolarHBondContact OE1-NE 3.47Å; E939-R943 IonicContact OE1-NH2 3.74Å; E939-R943 PolarHBondContact OE1-NH2 3.21Å
940	L	95.9	Very high	88.9	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.8	-47.8	176.7	-177.6	58	0	0	0	112.1	F877 Y880 A881 L914 L917 P936 V937 R942 R943 F944	F877-L940 WeakPolarHBondContact O-CD1 2.97Å; Y880-L940 HydrophobicContact CD1-CD1 4.43Å; A881-L940 HydrophobicContact CB-CB 4.26Å; A881-L940 HydrophobicContact CB-CD1 4.34Å; L914-L940 HydrophobicContact CD2-CB 3.99Å; L914-L940 HydrophobicContact CD2-CD2 3.89Å; L914-L940 HydrophobicContact CD2-CG 3.85Å; L914-L940 HydrophobicContact CG-CD2 4.43Å; L917-L940 HydrophobicContact CD2-CB 4.26Å; L917-L940 HydrophobicContact CD2-CD2 3.71Å; P936-L940 WeakPolarHBondContact O-CB 3.38Å; P936-L940 PolarHBondContact O-N 2.99Å; V937-L940 PolarHBondContact O-N 3.19Å; L940-R942 VanDerWaalsContact C-N 3.33Å; L940-R942 PolarHBondContact O-N 3.47Å; L940-R943 PolarHBondContact O-N 3Å; L940-F944 HydrophobicContact CD1-CD1 4.23Å; L940-F944 HydrophobicContact CD1-CE1 3.59Å; L940-F944 HydrophobicContact CD1-CE2 4.14Å; L940-F944 HydrophobicContact CD1-CZ 3.53Å; L940-F944 HydrophobicContact CD2-CE2 4.25Å; L940-F944 HydrophobicContact CD2-CZ 4.08Å; L940-F944 HydrophobicContact CG-CD2 4.42Å; L940-F944 HydrophobicContact CG-CE1 4.23Å; L940-F944 HydrophobicContact CG-CE2 3.87Å; L940-F944 HydrophobicContact CG-CZ 3.74Å; L940-F944 WeakPolarHBondContact O-CG 3.33Å; L940-F944 PolarHBondContact O-N 3.31Å
941	I	95.5	Very high	88.9	Confident	2 Å²	2	48 Å²	48	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-67.9	-32.1	179.7	-160.9	167	0	0	0	112.5	L914 V937 R938 F944 G945 I962 V986 L987 E989 T990	L914-I941 HydrophobicContact CD1-CB 4.1Å; L914-I941 HydrophobicContact CD1-CD1 3.78Å; L914-I941 HydrophobicContact CD1-CG1 3.89Å; L914-I941 HydrophobicContact CD2-CB 3.79Å; V937-I941 PolarHBondContact O-N 3.45Å; R938-I941 WeakPolarHBondContact O-CG2 3.3Å; I941-F944 WeakPolarHBondContact O-CB 3.47Å; I941-F944 PolarHBondContact O-N 3.24Å; I941-G945 PolarHBondContact O-N 2.81Å; I941-I962 HydrophobicContact CD1-CG2 4.42Å; I941-V986 HydrophobicContact CB-CG1 4.14Å; I941-V986 HydrophobicContact CD1-CG1 4.01Å; I941-V986 HydrophobicContact CG2-CG1 3.78Å; I941-L987 HydrophobicContact CD1-CD2 4.43Å; I941-E989 HydrophobicContact CG2-CB 3.77Å; I941-E989 HydrophobicContact CG2-CG 3.92Å; I941-T990 HydrophobicContact CD1-CG2 3.46Å; I941-T990 VanDerWaalsContact CD1-CG2 3.46Å; I941-T990 HydrophobicContact CG1-CG2 3.73Å
942	R	93.2	Very high	89.1	Confident	109 Å²	109	49.2 Å²	49.2	41%	0.411	27%	0.274	S	S	.	.	H	α-helix	trans	-64.8	-44.4	172.1	-73.9	172.3	-169.5	144.1	1.3	111.8	R938 E939 L940 F944 G945 T946 E989	R938-R942 WeakPolarHBondContact O-CB 3.45Å; R938-R942 VanDerWaalsContact O-CG 3.24Å; R938-R942 WeakPolarHBondContact O-CG 3.25Å; R938-R942 PolarHBondContact O-N 3.4Å; R938-R942 VanDerWaalsContact O-N 3.11Å; E939-R942 PolarHBondContact O-N 2.83Å; L940-R942 VanDerWaalsContact C-N 3.33Å; L940-R942 PolarHBondContact O-N 3.47Å; R942-F944 PolarHBondContact O-N 2.87Å; R942-G945 CarbonylContact O-C 3.52Å; R942-G945 VanDerWaalsContact O-CA 3.23Å; R942-G945 WeakPolarHBondContact O-CA 3.31Å; R942-G945 PolarHBondContact O-N 3.35Å; R942-T946 PolarHBondContact O-N 3.26Å; R942-T946 PolarHBondContact O-OG1 3.41Å; R942-E989 IonicContact CZ-OE1 2.61Å; R942-E989 IonicContact CZ-OE2 3.77Å; R942-E989 VanDerWaalsContact NE-CD 3.3Å; R942-E989 IonicContact NE-OE1 3.47Å; R942-E989 IonicContact NE-OE2 3.72Å; R942-E989 PolarHBondContact NE-OE2 3.26Å; R942-E989 VanDerWaalsContact NH2-CD 3.31Å; R942-E989 IonicContact NH2-OE1 2.68Å; R942-E989 PolarHBondContact NH2-OE1 3.16Å; R942-E989 IonicContact NH2-OE2 3.98Å; R942-E989 PolarHBondContact NH2-OE2 2.99Å
943	R	91.9	Very high	89.1	Confident	58 Å²	58	49.1 Å²	49.1	22%	0.219	27%	0.273	C	S	.	.	H	α-helix	trans	-64.2	-38.7	175.8	-71.2	-178.3	-174.7	-98.3	-7.5	112.4	Y880 E939 L940 G945 T946 S947	Y880-R943 HydrophobicContact CD1-CB 3.83Å; Y880-R943 HydrophobicContact CE1-CB 3.6Å; E939-R943 WeakPolarHBondContact O-CG 3.46Å; E939-R943 PolarHBondContact O-N 3.35Å; E939-R943 IonicContact OE1-CZ 2.62Å; E939-R943 IonicContact OE1-NE 3.15Å; E939-R943 PolarHBondContact OE1-NE 3.47Å; E939-R943 IonicContact OE1-NH2 3.74Å; E939-R943 PolarHBondContact OE1-NH2 3.21Å; L940-R943 PolarHBondContact O-N 3Å; R943-G945 VanDerWaalsContact C-N 3.32Å; R943-T946 PolarHBondContact O-N 3.07Å; R943-S947 PolarHBondContact O-N 3.3Å; R943-S947 PolarHBondContact O-OG 2.9Å
944	F	94.1	Very high	88.9	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-58.8	-43.3	167.1	-71.9	-10.1	0	0	0	111.7	F877 Y880 I895 M910 A913 L914 L940 I941 R942 T946 S947 M948	F877-F944 HydrophobicContact CB-CE1 4.28Å; F877-F944 HydrophobicContact CB-CZ 3.91Å; Y880-F944 AromaticContact CD1-CD1 3.85Å; Y880-F944 HydrophobicContact CD1-CD1 3.85Å; Y880-F944 AromaticContact CD1-CE1 3.86Å; Y880-F944 HydrophobicContact CD1-CE1 3.86Å; Y880-F944 HydrophobicContact CE1-CD1 4.38Å; I895-F944 HydrophobicContact CD1-CD1 3.92Å; I895-F944 HydrophobicContact CD1-CE1 3.89Å; M910-F944 HydrophobicContact CB-CD2 4.01Å; M910-F944 HydrophobicContact CB-CE2 3.87Å; M910-F944 HydrophobicContact CB-CZ 4.48Å; M910-F944 HydrophobicContact CE-CB 3.45Å; M910-F944 VanDerWaalsContact CE-CB 3.45Å; M910-F944 HydrophobicContact CE-CD1 4.01Å; M910-F944 HydrophobicContact CE-CD2 3.8Å; M910-F944 HydrophobicContact CE-CG 3.48Å; M910-F944 VanDerWaalsContact CE-CG 3.48Å; M910-F944 HydrophobicContact CG-CD2 4.38Å; M910-F944 HydrophobicContact CG-CE2 4.29Å; M910-F944 HydrophobicContact CG-CZ 4.49Å; M910-F944 WeakPolarHBondContact O-CE2 3.36Å; A913-F944 HydrophobicContact CB-CZ 4.41Å; L914-F944 HydrophobicContact CD1-CD2 4.12Å; L914-F944 HydrophobicContact CD1-CE2 4.19Å; L914-F944 HydrophobicContact CD2-CE2 4.36Å; L914-F944 HydrophobicContact CG-CD2 4.29Å; L914-F944 HydrophobicContact CG-CE2 3.94Å; L940-F944 HydrophobicContact CD1-CD1 4.23Å; L940-F944 HydrophobicContact CD1-CE1 3.59Å; L940-F944 HydrophobicContact CD1-CE2 4.14Å; L940-F944 HydrophobicContact CD1-CZ 3.53Å; L940-F944 HydrophobicContact CD2-CE2 4.25Å; L940-F944 HydrophobicContact CD2-CZ 4.08Å; L940-F944 HydrophobicContact CG-CD2 4.42Å; L940-F944 HydrophobicContact CG-CE1 4.23Å; L940-F944 HydrophobicContact CG-CE2 3.87Å; L940-F944 HydrophobicContact CG-CZ 3.74Å; L940-F944 WeakPolarHBondContact O-CG 3.33Å; L940-F944 PolarHBondContact O-N 3.31Å; I941-F944 WeakPolarHBondContact O-CB 3.47Å; I941-F944 PolarHBondContact O-N 3.24Å; R942-F944 PolarHBondContact O-N 2.87Å; F944-T946 VanDerWaalsContact C-N 3.31Å; F944-T946 PolarHBondContact O-N 3.31Å; F944-S947 PolarHBondContact O-N 3.41Å; F944-S947 VanDerWaalsContact O-N 3.16Å; F944-M948 HydrophobicContact CB-CE 4.42Å; F944-M948 WeakPolarHBondContact O-CG 3.49Å; F944-M948 PolarHBondContact O-N 3.17Å
945	G	89.3	Confident	88.6	Confident	10 Å²	10	55.5 Å²	55.5	10%	0.103	29%	0.293	C	S	.	.	H	α-helix	trans	-51.6	-43.5	170.8	0	0	0	0	0	114	I941 R942 R943 K993	I941-G945 PolarHBondContact O-N 2.81Å; R942-G945 CarbonylContact O-C 3.52Å; R942-G945 VanDerWaalsContact O-CA 3.23Å; R942-G945 WeakPolarHBondContact O-CA 3.31Å; R942-G945 PolarHBondContact O-N 3.35Å; R943-G945 VanDerWaalsContact C-N 3.32Å; G945-K993 WeakPolarHBondContact O-CE 3.46Å; G945-K993 PolarHBondContact O-NZ 3.35Å; G945-K993 VanDerWaalsContact O-NZ 3.08Å
946	T	86.6	Confident	88.5	Confident	102 Å²	102	56.8 Å²	56.8	63%	0.626	28%	0.284	S	S	*	.	H	α-helix	trans	-70.2	-41.8	175.7	-49.7	0	0	0	0	112.1	R942 R943 F944 M948 G949	R942-T946 PolarHBondContact O-N 3.26Å; R942-T946 PolarHBondContact O-OG1 3.41Å; R943-T946 PolarHBondContact O-N 3.07Å; F944-T946 VanDerWaalsContact C-N 3.31Å; F944-T946 PolarHBondContact O-N 3.31Å; T946-M948 VanDerWaalsContact C-N 3.3Å; T946-M948 PolarHBondContact O-N 3.15Å; T946-G949 PolarHBondContact O-N 3.35Å
947	S	84.9	Confident	88.3	Confident	12 Å²	12	59 Å²	59	8%	0.084	29%	0.289	C	S	.	.	H	α-helix	trans	-68.4	-25.6	178.1	-69.2	0	0	0	0	113.7	Y880 R899 R943 F944 G949	Y880-S947 PolarHBondContact OH-OG 3.49Å; R899-S947 PolarHBondContact NH1-O 3.43Å; R943-S947 PolarHBondContact O-N 3.3Å; R943-S947 PolarHBondContact O-OG 2.9Å; F944-S947 PolarHBondContact O-N 3.41Å; F944-S947 VanDerWaalsContact O-N 3.16Å; S947-G949 VanDerWaalsContact C-N 3.27Å; S947-G949 PolarHBondContact O-N 2.89Å
948	M	84.3	Confident	88.1	Confident	10 Å²	10	59.1 Å²	59.1	5%	0.049	29%	0.29	C	S	.	.	H	α-helix	trans	-66.1	-25.4	172.6	-78.6	-170.7	-104.8	0	0	113.8	R899 M910 F944 T946 C955 L958 V959 I962	R899-M948 PolarHBondContact NH1-O 3.32Å; R899-M948 VanDerWaalsContact NH1-O 3.15Å; M910-M948 HydrophobicContact CE-CE 4.33Å; M910-M948 HydrophobicContact CE-CG 4.46Å; F944-M948 HydrophobicContact CB-CE 4.42Å; F944-M948 WeakPolarHBondContact O-CG 3.49Å; F944-M948 PolarHBondContact O-N 3.17Å; T946-M948 VanDerWaalsContact C-N 3.3Å; T946-M948 PolarHBondContact O-N 3.15Å; M948-C955 HydrophobicContact CB-CB 4.23Å; M948-C955 HydrophobicContact SD-CB 4.44Å; M948-L958 HydrophobicContact CG-CD1 4.21Å; M948-L958 HydrophobicContact CG-CD2 4.43Å; M948-L958 HydrophobicContact SD-CD1 4.44Å; M948-L958 HydrophobicContact SD-CD2 3.85Å; M948-V959 HydrophobicContact CE-CG2 4.44Å; M948-V959 HydrophobicContact SD-CG2 3.63Å; M948-I962 HydrophobicContact CE-CD1 3.79Å; M948-I962 HydrophobicContact SD-CD1 4.39Å
949	G	77.7	Confident	88	Confident	31 Å²	31	55.9 Å²	55.9	32%	0.32	28%	0.277	S	S	.	.			trans	89.8	-178.2	-173.9	0	0	0	0	0	113.9	T946 S947 K993	T946-G949 PolarHBondContact O-N 3.35Å; S947-G949 VanDerWaalsContact C-N 3.27Å; S947-G949 PolarHBondContact O-N 2.89Å; G949-K993 PolarHBondContact O-NZ 3.46Å
950	T	80.6	Confident	88.1	Confident	133 Å²	133	53.6 Å²	53.6	82%	0.816	27%	0.268	S	S	*	.	S	Bend	trans	-96.5	-19.7	-177.6	47.8	0	0	0	0	114	L952	T950-L952 PolarHBondContact O-N 3.36Å; T950-L952 VanDerWaalsContact O-N 3.08Å
951	D	83.8	Confident	88	Confident	63 Å²	63	54.8 Å²	54.8	34%	0.337	27%	0.274	S	S	.	.			trans	-72.2	99.5	178.9	-176.9	-25.2	0	0	0	111	I953 R954 C955	D951-I953 PolarHBondContact O-N 3.09Å; D951-I953 WeakPolarHBondContact OD1-CA 3.48Å; D951-I953 WeakPolarHBondContact OD1-CB 3.31Å; D951-I953 PolarHBondContact OD1-N 2.81Å; D951-R954 HydrophobicContact CB-CB 4.13Å; D951-R954 HydrophobicContact CB-CG 4.23Å; D951-R954 PolarHBondContact O-N 3.16Å; D951-R954 PolarHBondContact OD1-N 3.09Å; D951-R954 WeakPolarHBondContact OD2-CD 3.4Å; D951-R954 WeakPolarHBondContact OD2-CG 3.31Å; D951-R954 IonicContact OD2-CZ 3.8Å; D951-R954 IonicContact OD2-NE 2.68Å; D951-R954 PolarHBondContact OD2-NE 2.99Å; D951-C955 PolarHBondContact O-N 3.19Å; D951-C955 VanDerWaalsContact O-N 3.15Å; D951-C955 PolarHBondContact O-SG 3.49Å; D951-C955 VanDerWaalsContact O-SG 3.4Å
952	L	84.4	Confident	88	Confident	56 Å²	56	54.7 Å²	54.7	29%	0.293	27%	0.273	S	S	.	.	H	α-helix	trans	-59.7	-29.1	-179.7	-59.1	-174.2	0	0	0	113.2	T950 R956 K993 L995	T950-L952 PolarHBondContact O-N 3.36Å; T950-L952 VanDerWaalsContact O-N 3.08Å; L952-R956 WeakPolarHBondContact O-CB 3.39Å; L952-R956 PolarHBondContact O-N 3.04Å; L952-R956 VanDerWaalsContact O-N 3.11Å; L952-K993 HydrophobicContact CD2-CB 4.15Å; L952-K993 HydrophobicContact CD2-CG 4.18Å; L952-L995 HydrophobicContact CB-CD2 3.97Å; L952-L995 HydrophobicContact CD1-CD2 4.21Å
953	I	84.2	Confident	88.1	Confident	133 Å²	133	49.5 Å²	49.5	68%	0.682	25%	0.254	S	S	*	.	H	α-helix	trans	-74.2	-43.9	-179.6	-57.2	176.4	0	0	0	109.3	D951 R956	D951-I953 PolarHBondContact O-N 3.09Å; D951-I953 WeakPolarHBondContact OD1-CA 3.48Å; D951-I953 WeakPolarHBondContact OD1-CB 3.31Å; D951-I953 PolarHBondContact OD1-N 2.81Å; I953-R956 WeakPolarHBondContact O-CB 3.32Å
954	R	82.8	Confident	88.3	Confident	191 Å²	191	52 Å²	52	72%	0.721	26%	0.263	S	S	*	.	H	α-helix	trans	-66.5	-38.6	178.3	-73.2	178.7	-163.2	-142.3	-4.5	113.3	D951	D951-R954 HydrophobicContact CB-CB 4.13Å; D951-R954 HydrophobicContact CB-CG 4.23Å; D951-R954 PolarHBondContact O-N 3.16Å; D951-R954 PolarHBondContact OD1-N 3.09Å; D951-R954 WeakPolarHBondContact OD2-CD 3.4Å; D951-R954 WeakPolarHBondContact OD2-CG 3.31Å; D951-R954 IonicContact OD2-CZ 3.8Å; D951-R954 IonicContact OD2-NE 2.68Å; D951-R954 PolarHBondContact OD2-NE 2.99Å
955	C	84.6	Confident	88.4	Confident	3 Å²	3	53.3 Å²	53.3	2%	0.02	27%	0.272	C	S	.	.	H	α-helix	trans	-87.6	-8.8	-178.9	71.2	0	0	0	0	114.6	M948 D951 E957 L958 V959	M948-C955 HydrophobicContact CB-CB 4.23Å; M948-C955 HydrophobicContact SD-CB 4.44Å; D951-C955 PolarHBondContact O-N 3.19Å; D951-C955 VanDerWaalsContact O-N 3.15Å; D951-C955 PolarHBondContact O-SG 3.49Å; D951-C955 VanDerWaalsContact O-SG 3.4Å; C955-E957 PolarHBondContact O-N 2.94Å; C955-L958 WeakPolarHBondContact O-CA 3.43Å; C955-L958 VanDerWaalsContact O-CB 3.3Å; C955-L958 WeakPolarHBondContact O-CB 3.35Å; C955-L958 PolarHBondContact O-N 3.32Å; C955-V959 HydrophobicContact CB-CG2 4.24Å; C955-V959 WeakPolarHBondContact O-CG2 3.33Å; C955-V959 PolarHBondContact O-N 2.91Å
956	R	90.3	Very high	88.6	Confident	90 Å²	90	52.9 Å²	52.9	34%	0.34	27%	0.267	S	S	.	.	H	α-helix	trans	-39.6	-60.5	-176.2	-174.5	-175.5	179.9	-154.2	-8.2	114.4	L952 I953 L958 V959 V960 L995 D998	L952-R956 WeakPolarHBondContact O-CB 3.39Å; L952-R956 PolarHBondContact O-N 3.04Å; L952-R956 VanDerWaalsContact O-N 3.11Å; I953-R956 WeakPolarHBondContact O-CB 3.32Å; R956-L958 VanDerWaalsContact C-N 3.26Å; R956-L958 PolarHBondContact O-N 3.38Å; R956-V959 PolarHBondContact O-N 3.08Å; R956-V960 WeakPolarHBondContact O-CG2 3.26Å; R956-V960 PolarHBondContact O-N 3.39Å; R956-L995 HydrophobicContact CG-CD1 4.32Å; R956-D998 WeakPolarHBondContact CD-OD2 3.2Å; R956-D998 VanDerWaalsContact CG-OD2 3.29Å; R956-D998 WeakPolarHBondContact CG-OD2 3.45Å; R956-D998 IonicContact CZ-OD1 3.25Å; R956-D998 VanDerWaalsContact CZ-OD1 3.24Å; R956-D998 IonicContact CZ-OD2 3.01Å; R956-D998 IonicContact NE-OD1 3.48Å; R956-D998 PolarHBondContact NE-OD1 3.36Å; R956-D998 IonicContact NE-OD2 3.59Å; R956-D998 PolarHBondContact NE-OD2 3.37Å; R956-D998 IonicContact NH2-OD1 3.57Å; R956-D998 PolarHBondContact NH2-OD1 2.91Å; R956-D998 IonicContact NH2-OD2 3.06Å
957	E	88.8	Confident	89.1	Confident	106 Å²	106	48.1 Å²	48.1	50%	0.495	24%	0.238	S	C	.	.	H	α-helix	trans	-61.7	-35.5	-175.7	-63.5	165.1	140.6	0	0	112.2	K903 C955 M961	K903-E957 WeakPolarHBondContact CD-OE2 3.38Å; K903-E957 WeakPolarHBondContact CE-OE2 3.27Å; K903-E957 IonicContact NZ-OE2 2.86Å; K903-E957 PolarHBondContact NZ-OE2 3.38Å; C955-E957 PolarHBondContact O-N 2.94Å; E957-M961 VanDerWaalsContact O-CB 3.28Å; E957-M961 WeakPolarHBondContact O-CB 2.96Å; E957-M961 PolarHBondContact O-N 3.05Å
958	L	90.2	Very high	89.5	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-70.1	-48.4	-179.8	-152.5	172.2	0	0	0	110.2	R899 A907 M910 M948 C955 R956 M961 I962	R899-L958 HydrophobicContact CB-CD1 4.47Å; R899-L958 HydrophobicContact CG-CD1 3.78Å; A907-L958 HydrophobicContact CB-CD2 3.64Å; A907-L958 HydrophobicContact CB-CG 3.89Å; M910-L958 HydrophobicContact CE-CD2 4.31Å; M910-L958 HydrophobicContact SD-CD2 3.94Å; M948-L958 HydrophobicContact CG-CD1 4.21Å; M948-L958 HydrophobicContact CG-CD2 4.43Å; M948-L958 HydrophobicContact SD-CD1 4.44Å; M948-L958 HydrophobicContact SD-CD2 3.85Å; C955-L958 WeakPolarHBondContact O-CA 3.43Å; C955-L958 VanDerWaalsContact O-CB 3.3Å; C955-L958 WeakPolarHBondContact O-CB 3.35Å; C955-L958 PolarHBondContact O-N 3.32Å; R956-L958 VanDerWaalsContact C-N 3.26Å; R956-L958 PolarHBondContact O-N 3.38Å; L958-M961 PolarHBondContact O-N 3.19Å; L958-I962 HydrophobicContact CD2-CD1 3.42Å; L958-I962 VanDerWaalsContact CD2-CD1 3.42Å; L958-I962 HydrophobicContact CD2-CG1 3.99Å; L958-I962 WeakPolarHBondContact O-CG1 3.43Å; L958-I962 PolarHBondContact O-N 3.21Å
959	V	92.4	Very high	90	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.3	-41.9	179.4	-177.7	0	0	0	0	111.4	M948 C955 R956 M961 I962 N963 K993 L994	M948-V959 HydrophobicContact CE-CG2 4.44Å; M948-V959 HydrophobicContact SD-CG2 3.63Å; C955-V959 HydrophobicContact CB-CG2 4.24Å; C955-V959 WeakPolarHBondContact O-CG2 3.33Å; C955-V959 PolarHBondContact O-N 2.91Å; R956-V959 PolarHBondContact O-N 3.08Å; V959-M961 VanDerWaalsContact C-N 3.35Å; V959-M961 PolarHBondContact O-N 2.99Å; V959-I962 PolarHBondContact O-N 3.35Å; V959-N963 PolarHBondContact O-N 2.95Å; V959-N963 PolarHBondContact O-ND2 3.49Å; V959-K993 HydrophobicContact CG1-CB 4.2Å; V959-K993 HydrophobicContact CG2-CB 4.04Å; V959-L994 HydrophobicContact CB-CD2 4.36Å; V959-L994 HydrophobicContact CG1-CD2 3.65Å; V959-L994 HydrophobicContact CG1-CG 3.96Å
960	V	94	Very high	90.8	Very high	16 Å²	16	50.5 Å²	50.5	10%	0.097	24%	0.241	C	C	.	.	H	α-helix	trans	-62.3	-41.7	174.8	171.2	0	0	0	0	111.3	R956 N963 R964 L994 D998 L1001 Y1005	R956-V960 WeakPolarHBondContact O-CG2 3.26Å; R956-V960 PolarHBondContact O-N 3.39Å; V960-N963 PolarHBondContact O-N 3.2Å; V960-R964 WeakPolarHBondContact O-CB 3.49Å; V960-R964 PolarHBondContact O-N 3.22Å; V960-L994 HydrophobicContact CG2-CD2 3.9Å; V960-D998 HydrophobicContact CG2-CB 3.74Å; V960-L1001 HydrophobicContact CG1-CD2 4.04Å; V960-Y1005 HydrophobicContact CG1-CE2 4.24Å
961	M	94.7	Very high	91.3	Very high	25 Å²	25	45.6 Å²	45.6	12%	0.123	21%	0.212	C	C	.	.	H	α-helix	trans	-67.7	-41.1	178.1	-171.2	63	53.3	0	0	112.3	I904 A907 R908 E957 L958 V959 N963 R964 C965	I904-M961 HydrophobicContact CD1-CE 4.43Å; I904-M961 HydrophobicContact CG1-CE 4.23Å; I904-M961 HydrophobicContact CG2-CE 3.85Å; I904-M961 HydrophobicContact CG2-CG 4.23Å; I904-M961 HydrophobicContact CG2-SD 4.17Å; A907-M961 HydrophobicContact CB-CB 3.66Å; A907-M961 HydrophobicContact CB-CG 3.73Å; R908-M961 HydrophobicContact CG-CG 4.31Å; E957-M961 VanDerWaalsContact O-CB 3.28Å; E957-M961 WeakPolarHBondContact O-CB 2.96Å; E957-M961 PolarHBondContact O-N 3.05Å; L958-M961 PolarHBondContact O-N 3.19Å; V959-M961 VanDerWaalsContact C-N 3.35Å; V959-M961 PolarHBondContact O-N 2.99Å; M961-N963 PolarHBondContact O-N 3.44Å; M961-R964 PolarHBondContact O-N 3.02Å; M961-C965 WeakPolarHBondContact O-CB 3.24Å; M961-C965 PolarHBondContact O-N 3.39Å
962	I	95	Very high	91.6	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-57	-49.6	173	-72.6	170.9	0	0	0	110.5	A907 M910 T911 I941 M948 L958 V959 R964 C965 G966 L987	A907-I962 HydrophobicContact CB-CG1 4.16Å; M910-I962 HydrophobicContact CE-CD1 4.22Å; T911-I962 WeakPolarHBondContact OG1-CA 3.23Å; I941-I962 HydrophobicContact CD1-CG2 4.42Å; M948-I962 HydrophobicContact CE-CD1 3.79Å; M948-I962 HydrophobicContact SD-CD1 4.39Å; L958-I962 HydrophobicContact CD2-CD1 3.42Å; L958-I962 VanDerWaalsContact CD2-CD1 3.42Å; L958-I962 HydrophobicContact CD2-CG1 3.99Å; L958-I962 WeakPolarHBondContact O-CG1 3.43Å; L958-I962 PolarHBondContact O-N 3.21Å; V959-I962 PolarHBondContact O-N 3.35Å; I962-R964 PolarHBondContact O-N 3.33Å; I962-C965 PolarHBondContact O-N 3.04Å; I962-G966 PolarHBondContact O-N 3.28Å; I962-L987 HydrophobicContact CG2-CD2 4.11Å
963	N	95.4	Very high	91.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.4	-45.3	179.2	-82.7	-92.8	0	0	0	111.6	V959 V960 M961 G966 I967 T990 V1002 F1027	V959-N963 PolarHBondContact O-N 2.95Å; V959-N963 PolarHBondContact O-ND2 3.49Å; V960-N963 PolarHBondContact O-N 3.2Å; M961-N963 PolarHBondContact O-N 3.44Å; N963-G966 PolarHBondContact O-N 3.2Å; N963-I967 WeakPolarHBondContact O-CB 3.31Å; N963-I967 WeakPolarHBondContact O-CD1 3.44Å; N963-I967 WeakPolarHBondContact O-CG1 3.2Å; N963-I967 PolarHBondContact O-N 3.44Å; N963-T990 PolarHBondContact ND2-OG1 2.93Å; N963-V1002 HydrophobicContact CB-CG1 3.81Å; N963-V1002 HydrophobicContact CB-CG2 3.8Å; N963-F1027 WeakPolarHBondContact OD1-CZ 3.22Å
964	R	95.8	Very high	91.2	Very high	110 Å²	110	50.8 Å²	50.8	42%	0.415	23%	0.228	S	C	.	.	H	α-helix	trans	-61.6	-48.2	178.4	-173.5	-179.1	-179.6	-178.9	0.1	112.4	V960 M961 I962 I967 I968 Y1005	V960-R964 WeakPolarHBondContact O-CB 3.49Å; V960-R964 PolarHBondContact O-N 3.22Å; M961-R964 PolarHBondContact O-N 3.02Å; I962-R964 PolarHBondContact O-N 3.33Å; R964-I967 PolarHBondContact O-N 2.93Å; R964-I968 HydrophobicContact CG-CD1 4.35Å; R964-I968 WeakPolarHBondContact O-CG1 3.16Å; R964-I968 PolarHBondContact O-N 2.85Å; R964-I968 VanDerWaalsContact O-N 3.16Å; R964-Y1005 HydrophobicContact CB-CD2 3.86Å; R964-Y1005 HydrophobicContact CB-CE2 4.01Å; R964-Y1005 HydrophobicContact CG-CD2 3.83Å; R964-Y1005 HydrophobicContact CG-CE2 3.96Å; R964-Y1005 HydrophobicContact CG-CG 4.18Å
965	C	95.7	Very high	90.8	Very high	28 Å²	28	44.5 Å²	44.5	19%	0.189	22%	0.223	C	C	.	.	H	α-helix	trans	-66	-38.6	179	-73.9	0	0	0	0	111.9	T911 M961 I962 I968 F969	T911-C965 HydrophobicContact CG2-CB 3.65Å; M961-C965 WeakPolarHBondContact O-CB 3.24Å; M961-C965 PolarHBondContact O-N 3.39Å; I962-C965 PolarHBondContact O-N 3.04Å; C965-I968 PolarHBondContact O-N 3.43Å; C965-F969 PolarHBondContact O-N 3.21Å
966	G	95.3	Very high	90.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-69.4	-37.3	176.6	0	0	0	0	0	114	I962 N963 I968 F969 A970	I962-G966 PolarHBondContact O-N 3.28Å; N963-G966 PolarHBondContact O-N 3.2Å; G966-I968 VanDerWaalsContact C-N 3.33Å; G966-F969 PolarHBondContact O-N 2.95Å; G966-A970 WeakPolarHBondContact O-CB 3.4Å; G966-A970 PolarHBondContact O-N 2.93Å
967	I	95.5	Very high	89.6	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-60.8	-44.4	172.6	-75	166.1	0	0	0	110.2	N963 R964 F969 A970 S971 L984 L987 V1002 L1006 A1009 F1010 F1027	N963-I967 WeakPolarHBondContact O-CB 3.31Å; N963-I967 WeakPolarHBondContact O-CD1 3.44Å; N963-I967 WeakPolarHBondContact O-CG1 3.2Å; N963-I967 PolarHBondContact O-N 3.44Å; R964-I967 PolarHBondContact O-N 2.93Å; I967-F969 VanDerWaalsContact C-N 3.35Å; I967-F969 PolarHBondContact O-N 3.4Å; I967-A970 PolarHBondContact O-N 2.92Å; I967-S971 WeakPolarHBondContact O-CB 3.37Å; I967-S971 PolarHBondContact O-N 2.69Å; I967-S971 PolarHBondContact O-OG 3.15Å; I967-L984 HydrophobicContact CG1-CD2 4.31Å; I967-L987 HydrophobicContact CG1-CD1 4.18Å; I967-V1002 HydrophobicContact CD1-CG1 3.76Å; I967-L1006 HydrophobicContact CD1-CB 4.12Å; I967-L1006 HydrophobicContact CD1-CD1 4.2Å; I967-L1006 HydrophobicContact CG1-CD1 4.02Å; I967-L1006 HydrophobicContact CG2-CD1 4.34Å; I967-A1009 HydrophobicContact CG2-CB 3.58Å; I967-F1010 HydrophobicContact CG2-CE2 4.24Å; I967-F1027 HydrophobicContact CD1-CE1 4.12Å; I967-F1027 HydrophobicContact CG1-CE1 4.18Å
968	I	94.7	Very high	89.5	Confident	91 Å²	91	45.6 Å²	45.6	47%	0.467	25%	0.245	S	C	.	.	H	α-helix	trans	-59.1	-47.1	175.7	-67.8	164.3	0	0	0	110.2	R964 C965 G966 S971 Q972	R964-I968 HydrophobicContact CG-CD1 4.35Å; R964-I968 WeakPolarHBondContact O-CG1 3.16Å; R964-I968 PolarHBondContact O-N 2.85Å; R964-I968 VanDerWaalsContact O-N 3.16Å; C965-I968 PolarHBondContact O-N 3.43Å; G966-I968 VanDerWaalsContact C-N 3.33Å; I968-S971 PolarHBondContact O-N 3.48Å; I968-S971 PolarHBondContact O-OG 3.37Å; I968-Q972 PolarHBondContact O-N 3.5Å
969	F	94.6	Very high	89.3	Confident	12 Å²	12	47.1 Å²	47.1	5%	0.053	26%	0.255	C	S	.	.	H	α-helix	trans	-60.8	-45.7	177	177.8	-105.6	0	0	0	112.9	C915 Y918 Q919 C965 G966 I967 S971 Q972 N980 F983	C915-F969 HydrophobicContact CB-CD1 4.36Å; C915-F969 HydrophobicContact CB-CD2 3.99Å; C915-F969 HydrophobicContact CB-CE1 4.31Å; C915-F969 HydrophobicContact CB-CE2 3.93Å; C915-F969 HydrophobicContact CB-CG 4.21Å; C915-F969 HydrophobicContact CB-CZ 4.1Å; C915-F969 WeakPolarHBondContact SG-CG 3.17Å; Y918-F969 AromaticContact CD1-CE1 3.68Å; Y918-F969 HydrophobicContact CD1-CE1 3.68Å; Y918-F969 AromaticContact CD1-CZ 3.81Å; Y918-F969 HydrophobicContact CD1-CZ 3.81Å; Y918-F969 HydrophobicContact CE1-CE1 4.09Å; Y918-F969 HydrophobicContact CE1-CZ 4.32Å; Y918-F969 HydrophobicContact CG-CE1 4.21Å; Q919-F969 HydrophobicContact CG-CE2 4.26Å; Q919-F969 HydrophobicContact CG-CZ 3.97Å; C965-F969 PolarHBondContact O-N 3.21Å; G966-F969 PolarHBondContact O-N 2.95Å; I967-F969 VanDerWaalsContact C-N 3.35Å; I967-F969 PolarHBondContact O-N 3.4Å; F969-S971 VanDerWaalsContact C-N 3.26Å; F969-S971 PolarHBondContact O-N 3Å; F969-Q972 WeakPolarHBondContact O-CB 3.18Å; F969-Q972 WeakPolarHBondContact O-CG 3.46Å; F969-Q972 PolarHBondContact O-N 3.11Å; F969-N980 HydrophobicContact CD1-CB 4.05Å; F969-N980 HydrophobicContact CE1-CB 3.79Å; F969-N980 WeakPolarHBondContact CE2-ND2 3.32Å; F969-N980 HydrophobicContact CZ-CB 4.16Å; F969-N980 VanDerWaalsContact CZ-CG 3.48Å; F969-N980 WeakPolarHBondContact CZ-ND2 3.29Å; F969-N980 VanDerWaalsContact O-CB 3.27Å; F969-N980 WeakPolarHBondContact O-CB 3.44Å; F969-N980 PolarHBondContact O-ND2 3.2Å; F969-F983 HydrophobicContact CD1-CB 4.05Å; F969-F983 AromaticContact CD1-CD1 3.84Å; F969-F983 HydrophobicContact CD1-CD1 3.84Å; F969-F983 AromaticContact CD1-CD2 3.93Å; F969-F983 HydrophobicContact CD1-CD2 3.93Å; F969-F983 HydrophobicContact CD1-CE1 4.24Å; F969-F983 HydrophobicContact CD1-CE2 4.31Å; F969-F983 AromaticContact CD1-CG 3.67Å; F969-F983 HydrophobicContact CD1-CG 3.67Å; F969-F983 HydrophobicContact CD1-CZ 4.44Å; F969-F983 HydrophobicContact CE1-CB 4.19Å; F969-F983 AromaticContact CE1-CD2 3.84Å; F969-F983 HydrophobicContact CE1-CD2 3.84Å; F969-F983 HydrophobicContact CE1-CE2 4.33Å; F969-F983 AromaticContact CE1-CG 3.95Å; F969-F983 HydrophobicContact CE1-CG 3.95Å
970	A	93.3	Very high	89.2	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.1	-28.4	177.5	0	0	0	0	0	113.4	G966 I967 F983 L984 F1010	G966-A970 WeakPolarHBondContact O-CB 3.4Å; G966-A970 PolarHBondContact O-N 2.93Å; I967-A970 PolarHBondContact O-N 2.92Å; A970-F983 HydrophobicContact CB-CB 4.37Å; A970-L984 HydrophobicContact CB-CD2 3.63Å; A970-L984 HydrophobicContact CB-CG 3.83Å; A970-F1010 HydrophobicContact CB-CZ 4.08Å
971	S	91.9	Very high	89	Confident	30 Å²	30	47.6 Å²	47.6	21%	0.21	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-3.3	179.2	73.7	0	0	0	0	114.9	I967 I968 F969 R973	I967-S971 WeakPolarHBondContact O-CB 3.37Å; I967-S971 PolarHBondContact O-N 2.69Å; I967-S971 PolarHBondContact O-OG 3.15Å; I968-S971 PolarHBondContact O-N 3.48Å; I968-S971 PolarHBondContact O-OG 3.37Å; F969-S971 VanDerWaalsContact C-N 3.26Å; F969-S971 PolarHBondContact O-N 3Å; S971-R973 PolarHBondContact O-N 3.08Å
972	Q	90	Very high	88.8	Confident	93 Å²	93	48 Å²	48	44%	0.435	26%	0.258	S	S	.	.			trans	-63.1	127.1	175.4	-68.2	177.6	-8.2	0	0	110	I968 F969 N980	I968-Q972 PolarHBondContact O-N 3.5Å; F969-Q972 WeakPolarHBondContact O-CB 3.18Å; F969-Q972 WeakPolarHBondContact O-CG 3.46Å; F969-Q972 PolarHBondContact O-N 3.11Å; Q972-N980 PolarHBondContact OE1-ND2 2.69Å; Q972-N980 VanDerWaalsContact OE1-ND2 3.16Å
973	R	84.1	Confident	88.8	Confident	143 Å²	143	48 Å²	48	54%	0.54	26%	0.258	S	S	.	.			trans	-100.8	144.9	-179.4	-62.1	-176.5	-174.9	-160.1	-1	111.3	S971 D977 L978	S971-R973 PolarHBondContact O-N 3.08Å; R973-D977 VanDerWaalsContact CA-O 3.31Å; R973-D977 WeakPolarHBondContact CA-O 3.42Å; R973-L978 HydrophobicContact CG-CD2 3.75Å; R973-L978 HydrophobicContact CG-CG 4.45Å
974	D	75.6	Confident	88.7	Confident	125 Å²	125	48 Å²	48	67%	0.668	26%	0.258	S	S	*	.	B	Isolated β-bridge	trans	-121.9	103.8	161	-167	4.8	0	0	0	107.8	D977 P979	D974-D977 PolarHBondContact N-O 2.89Å; D974-D977 PolarHBondContact O-N 3.17Å; D974-P979 HydrophobicContact CB-CG 4.18Å
975	G	75.4	Confident	88.5	Confident	60 Å²	60	44.6 Å²	44.6	62%	0.619	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.5	-125.3	-167	0	0	0	0	0	112.6	D977	G975-D977 VanDerWaalsContact C-N 3.34Å
976	P	72.7	Confident	88.4	Confident	116 Å²	116	43.2 Å²	43.2	75%	0.753	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-16.1	175.5	34.7	-34.8	0	0	0	113.4
977	D	77.7	Confident	88.4	Confident	84 Å²	84	43.2 Å²	43.2	45%	0.449	24%	0.238	S	C	.	.	B	Isolated β-bridge	trans	-92.7	154.9	-168.4	-65.3	-42.2	0	0	0	112.6	R973 D974 G975 P979 R1020	R973-D977 VanDerWaalsContact CA-O 3.31Å; R973-D977 WeakPolarHBondContact CA-O 3.42Å; D974-D977 PolarHBondContact N-O 2.89Å; D974-D977 PolarHBondContact O-N 3.17Å; G975-D977 VanDerWaalsContact C-N 3.34Å; D977-P979 VanDerWaalsContact O-CD 3.25Å; D977-P979 WeakPolarHBondContact O-CD 3.19Å; D977-R1020 IonicContact OD1-NH1 2.63Å
978	L	86	Confident	88.2	Confident	21 Å²	21	45.1 Å²	45.1	11%	0.11	25%	0.251	C	S	.	.			trans	-113.6	78.7	176.7	-75.1	159.4	0	0	0	109.5	R973 N980 I981 F1010 I1013 F1021	R973-L978 HydrophobicContact CG-CD2 3.75Å; R973-L978 HydrophobicContact CG-CG 4.45Å; L978-N980 PolarHBondContact O-N 3.39Å; L978-I981 HydrophobicContact CB-CB 4.09Å; L978-I981 HydrophobicContact CB-CD1 4.49Å; L978-I981 HydrophobicContact CD1-CD1 4.2Å; L978-I981 WeakPolarHBondContact O-CG2 3.38Å; L978-I981 PolarHBondContact O-N 3.08Å; L978-I981 VanDerWaalsContact O-N 3.12Å; L978-F1010 HydrophobicContact CD1-CD1 4.34Å; L978-F1010 HydrophobicContact CD1-CE1 4.09Å; L978-F1010 HydrophobicContact CD2-CE1 4.31Å; L978-I1013 HydrophobicContact CD1-CD1 3.8Å; L978-F1021 HydrophobicContact CD1-CD1 4.42Å; L978-F1021 HydrophobicContact CD1-CE1 3.8Å
979	P	85.4	Confident	88.1	Confident	34 Å²	34	43.4 Å²	43.4	22%	0.221	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-23.3	-173.2	20.9	-34.3	0	0	0	114.5	Y918 R930 D974 D977	Y918-P979 PolarHBondContact OH-O 3.32Å; R930-P979 PolarHBondContact NH1-O 2.89Å; D974-P979 HydrophobicContact CB-CG 4.18Å; D977-P979 VanDerWaalsContact O-CD 3.25Å; D977-P979 WeakPolarHBondContact O-CD 3.19Å
980	N	90.1	Very high	87.9	Confident	14 Å²	14	42.9 Å²	42.9	8%	0.075	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	7.7	-174.3	-60.2	-23.9	0	0	0	113.6	Y918 F969 Q972 L978 H982 F983	Y918-N980 HydrophobicContact CE1-CB 4.4Å; F969-N980 HydrophobicContact CD1-CB 4.05Å; F969-N980 HydrophobicContact CE1-CB 3.79Å; F969-N980 WeakPolarHBondContact CE2-ND2 3.32Å; F969-N980 HydrophobicContact CZ-CB 4.16Å; F969-N980 VanDerWaalsContact CZ-CG 3.48Å; F969-N980 WeakPolarHBondContact CZ-ND2 3.29Å; F969-N980 VanDerWaalsContact O-CB 3.27Å; F969-N980 WeakPolarHBondContact O-CB 3.44Å; F969-N980 PolarHBondContact O-ND2 3.2Å; Q972-N980 PolarHBondContact OE1-ND2 2.69Å; Q972-N980 VanDerWaalsContact OE1-ND2 3.16Å; L978-N980 PolarHBondContact O-N 3.39Å; N980-H982 VanDerWaalsContact C-N 3.29Å; N980-H982 PolarHBondContact O-N 2.98Å; N980-F983 WeakPolarHBondContact O-CB 3.42Å; N980-F983 PolarHBondContact O-N 2.85Å
981	I	90.5	Very high	87.7	Confident	11 Å²	11	43 Å²	43	6%	0.056	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-34.4	-171.7	-165.1	162.5	0	0	0	113.8	L978 F983 L984 F1021 P1023 L1024	L978-I981 HydrophobicContact CB-CB 4.09Å; L978-I981 HydrophobicContact CB-CD1 4.49Å; L978-I981 HydrophobicContact CD1-CD1 4.2Å; L978-I981 WeakPolarHBondContact O-CG2 3.38Å; L978-I981 PolarHBondContact O-N 3.08Å; L978-I981 VanDerWaalsContact O-N 3.12Å; I981-F983 PolarHBondContact O-N 3.15Å; I981-F983 VanDerWaalsContact O-N 3.14Å; I981-L984 HydrophobicContact CG1-CD1 4.36Å; I981-L984 WeakPolarHBondContact O-CB 3.46Å; I981-L984 WeakPolarHBondContact O-CG 3.33Å; I981-L984 PolarHBondContact O-N 3.06Å; I981-L984 VanDerWaalsContact O-N 3.1Å; I981-F1021 HydrophobicContact CD1-CD1 3.77Å; I981-F1021 HydrophobicContact CD1-CE1 4.48Å; I981-F1021 HydrophobicContact CD1-CG 4.47Å; I981-P1023 HydrophobicContact CG1-CB 4.27Å; I981-P1023 HydrophobicContact CG2-CG 4.48Å; I981-P1023 WeakPolarHBondContact O-CB 3.29Å; I981-L1024 HydrophobicContact CD1-CB 4.32Å
982	H	91.1	Very high	87.5	Confident	33 Å²	33	47 Å²	47	15%	0.153	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-15	175	-71.5	-73.4	0	0	0	113.8	Y918 L934 N980 L984 E985	Y918-H982 HydrophobicContact CE2-CB 4.45Å; L934-H982 HydrophobicContact CD1-CB 4.28Å; L934-H982 HydrophobicContact CD2-CB 4.47Å; N980-H982 VanDerWaalsContact C-N 3.29Å; N980-H982 PolarHBondContact O-N 2.98Å; H982-L984 PolarHBondContact O-N 3.04Å; H982-E985 IonicContact CE1-OE1 3.62Å; H982-E985 IonicContact CG-OE1 2.77Å; H982-E985 IonicContact ND1-OE1 3.95Å; H982-E985 PolarHBondContact ND1-OE1 2.63Å; H982-E985 WeakPolarHBondContact O-CB 3.47Å; H982-E985 PolarHBondContact O-N 3.44Å
983	F	93.6	Very high	87.4	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.6	-22.3	171.9	-164	-97.8	0	0	0	112.7	L914 Y918 V937 F969 A970 N980 I981 E985 V986 L987	L914-F983 HydrophobicContact CB-CE2 3.94Å; L914-F983 HydrophobicContact CB-CZ 3.72Å; Y918-F983 HydrophobicContact CD2-CB 4.45Å; Y918-F983 AromaticContact CD2-CD2 3.76Å; Y918-F983 HydrophobicContact CD2-CD2 3.76Å; Y918-F983 HydrophobicContact CE2-CB 4.23Å; Y918-F983 HydrophobicContact CE2-CD2 4.36Å; Y918-F983 AromaticContact CG-CD2 3.87Å; Y918-F983 HydrophobicContact CG-CD2 3.87Å; V937-F983 HydrophobicContact CG1-CE2 4.41Å; F969-F983 HydrophobicContact CD1-CB 4.05Å; F969-F983 AromaticContact CD1-CD1 3.84Å; F969-F983 HydrophobicContact CD1-CD1 3.84Å; F969-F983 AromaticContact CD1-CD2 3.93Å; F969-F983 HydrophobicContact CD1-CD2 3.93Å; F969-F983 HydrophobicContact CD1-CE1 4.24Å; F969-F983 HydrophobicContact CD1-CE2 4.31Å; F969-F983 AromaticContact CD1-CG 3.67Å; F969-F983 HydrophobicContact CD1-CG 3.67Å; F969-F983 HydrophobicContact CD1-CZ 4.44Å; F969-F983 HydrophobicContact CE1-CB 4.19Å; F969-F983 AromaticContact CE1-CD2 3.84Å; F969-F983 HydrophobicContact CE1-CD2 3.84Å; F969-F983 HydrophobicContact CE1-CE2 4.33Å; F969-F983 AromaticContact CE1-CG 3.95Å; F969-F983 HydrophobicContact CE1-CG 3.95Å; A970-F983 HydrophobicContact CB-CB 4.37Å; N980-F983 WeakPolarHBondContact O-CB 3.42Å; N980-F983 PolarHBondContact O-N 2.85Å; I981-F983 PolarHBondContact O-N 3.15Å; I981-F983 VanDerWaalsContact O-N 3.14Å; F983-E985 PolarHBondContact O-N 3.2Å; F983-V986 HydrophobicContact CD2-CB 4.47Å; F983-V986 HydrophobicContact CD2-CG2 4.45Å; F983-V986 WeakPolarHBondContact O-CB 3.3Å; F983-V986 PolarHBondContact O-N 3.13Å; F983-V986 VanDerWaalsContact O-N 3.08Å; F983-L987 HydrophobicContact CD1-CD1 4.34Å; F983-L987 HydrophobicContact CD1-CD2 4.45Å; F983-L987 HydrophobicContact CD1-CG 4.1Å; F983-L987 HydrophobicContact CE1-CD2 3.95Å; F983-L987 HydrophobicContact CE1-CG 4.11Å; F983-L987 PolarHBondContact O-N 3.01Å; F983-L987 VanDerWaalsContact O-N 3.09Å
984	L	93.7	Very high	87.6	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.6	-29.9	172	-61.6	-179.5	0	0	0	112.3	I967 A970 I981 H982 V986 L987 S988 L1006 F1010 P1023 L1024 F1027	I967-L984 HydrophobicContact CG1-CD2 4.31Å; A970-L984 HydrophobicContact CB-CD2 3.63Å; A970-L984 HydrophobicContact CB-CG 3.83Å; I981-L984 HydrophobicContact CG1-CD1 4.36Å; I981-L984 WeakPolarHBondContact O-CB 3.46Å; I981-L984 WeakPolarHBondContact O-CG 3.33Å; I981-L984 PolarHBondContact O-N 3.06Å; I981-L984 VanDerWaalsContact O-N 3.1Å; H982-L984 PolarHBondContact O-N 3.04Å; L984-V986 VanDerWaalsContact C-N 3.32Å; L984-L987 HydrophobicContact CD2-CD1 4.08Å; L984-L987 PolarHBondContact O-N 2.84Å; L984-S988 PolarHBondContact O-N 2.95Å; L984-S988 VanDerWaalsContact O-N 3.11Å; L984-L1006 HydrophobicContact CD1-CD1 4.37Å; L984-L1006 HydrophobicContact CD2-CD1 4.19Å; L984-F1010 HydrophobicContact CD1-CE2 4.25Å; L984-F1010 HydrophobicContact CD1-CZ 4.07Å; L984-F1010 HydrophobicContact CD2-CE2 4.49Å; L984-P1023 HydrophobicContact CB-CB 4.42Å; L984-L1024 HydrophobicContact CD1-CB 3.94Å; L984-L1024 HydrophobicContact CD1-CD1 3.84Å; L984-F1027 HydrophobicContact CB-CB 4.08Å; L984-F1027 HydrophobicContact CB-CD1 4.44Å; L984-F1027 HydrophobicContact CB-CG 4.18Å; L984-F1027 HydrophobicContact CD2-CD1 4.07Å; L984-F1027 HydrophobicContact CD2-CE1 4.25Å; L984-F1027 WeakPolarHBondContact O-CD2 3.37Å
985	E	92.5	Very high	88.2	Confident	39 Å²	39	33.4 Å²	33.4	18%	0.182	20%	0.198	C	C	.	.	H	α-helix	trans	-68.2	-33.9	173.6	-55.4	178.9	-144.8	0	0	111.8	L934 R938 H982 F983 S988 P1023	L934-E985 HydrophobicContact CD1-CB 4.13Å; R938-E985 IonicContact CZ-OE2 2.9Å; R938-E985 IonicContact NH2-OE2 2.92Å; R938-E985 PolarHBondContact NH2-OE2 3.35Å; H982-E985 IonicContact CE1-OE1 3.62Å; H982-E985 IonicContact CG-OE1 2.77Å; H982-E985 IonicContact ND1-OE1 3.95Å; H982-E985 PolarHBondContact ND1-OE1 2.63Å; H982-E985 WeakPolarHBondContact O-CB 3.47Å; H982-E985 PolarHBondContact O-N 3.44Å; F983-E985 PolarHBondContact O-N 3.2Å; E985-S988 WeakPolarHBondContact O-CB 3.43Å; E985-S988 PolarHBondContact O-N 3.14Å; E985-S988 PolarHBondContact O-OG 2.72Å; E985-P1023 HydrophobicContact CG-CB 3.97Å; E985-P1023 HydrophobicContact CG-CG 4.4Å
986	V	93.5	Very high	88.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-66.5	-44.3	173.3	-179.5	0	0	0	0	109.9	L914 L934 V937 R938 I941 F983 L984 S988 E989	L914-V986 HydrophobicContact CD2-CG1 4.45Å; L934-V986 HydrophobicContact CD2-CG2 4.31Å; V937-V986 HydrophobicContact CB-CG2 4.18Å; V937-V986 HydrophobicContact CG1-CG1 3.81Å; V937-V986 HydrophobicContact CG1-CG2 3.99Å; R938-V986 HydrophobicContact CG-CG2 4.34Å; I941-V986 HydrophobicContact CB-CG1 4.14Å; I941-V986 HydrophobicContact CD1-CG1 4.01Å; I941-V986 HydrophobicContact CG2-CG1 3.78Å; F983-V986 HydrophobicContact CD2-CB 4.47Å; F983-V986 HydrophobicContact CD2-CG2 4.45Å; F983-V986 WeakPolarHBondContact O-CB 3.3Å; F983-V986 PolarHBondContact O-N 3.13Å; F983-V986 VanDerWaalsContact O-N 3.08Å; L984-V986 VanDerWaalsContact C-N 3.32Å; V986-S988 VanDerWaalsContact C-N 3.25Å; V986-S988 PolarHBondContact O-N 3.4Å; V986-E989 WeakPolarHBondContact O-CB 3.14Å; V986-E989 WeakPolarHBondContact O-CG 3.43Å; V986-E989 PolarHBondContact O-N 3.26Å
987	L	94.4	Very high	89.5	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.8	-29.7	178.3	-66.4	179.8	0	0	0	113.6	I941 I962 I967 F983 L984 E989 T990 F1027	I941-L987 HydrophobicContact CD1-CD2 4.43Å; I962-L987 HydrophobicContact CG2-CD2 4.11Å; I967-L987 HydrophobicContact CG1-CD1 4.18Å; F983-L987 HydrophobicContact CD1-CD1 4.34Å; F983-L987 HydrophobicContact CD1-CD2 4.45Å; F983-L987 HydrophobicContact CD1-CG 4.1Å; F983-L987 HydrophobicContact CE1-CD2 3.95Å; F983-L987 HydrophobicContact CE1-CG 4.11Å; F983-L987 PolarHBondContact O-N 3.01Å; F983-L987 VanDerWaalsContact O-N 3.09Å; L984-L987 HydrophobicContact CD2-CD1 4.08Å; L984-L987 PolarHBondContact O-N 2.84Å; L987-E989 PolarHBondContact O-N 3.46Å; L987-E989 VanDerWaalsContact O-N 3.13Å; L987-T990 PolarHBondContact O-N 3.38Å; L987-T990 PolarHBondContact O-OG1 3.35Å; L987-F1027 HydrophobicContact CB-CD2 4.4Å; L987-F1027 HydrophobicContact CB-CE2 3.62Å; L987-F1027 HydrophobicContact CB-CZ 3.9Å; L987-F1027 HydrophobicContact CD1-CZ 4.28Å
988	S	92.4	Very high	90.2	Very high	41 Å²	41	28.6 Å²	28.6	29%	0.287	15%	0.151	S	C	.	.	H	α-helix	trans	-54.9	-31.3	179.5	79.1	0	0	0	0	113.2	L984 E985 V986 T990 C991	L984-S988 PolarHBondContact O-N 2.95Å; L984-S988 VanDerWaalsContact O-N 3.11Å; E985-S988 WeakPolarHBondContact O-CB 3.43Å; E985-S988 PolarHBondContact O-N 3.14Å; E985-S988 PolarHBondContact O-OG 2.72Å; V986-S988 VanDerWaalsContact C-N 3.25Å; V986-S988 PolarHBondContact O-N 3.4Å; S988-T990 PolarHBondContact O-N 3.23Å; S988-C991 WeakPolarHBondContact O-CB 3.44Å; S988-C991 PolarHBondContact O-N 2.97Å
989	E	91.2	Very high	90.5	Very high	55 Å²	55	28.4 Å²	28.4	26%	0.257	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-17.7	174.9	-61.2	-69.2	160.3	0	0	113.6	I941 R942 V986 L987 N992	I941-E989 HydrophobicContact CG2-CB 3.77Å; I941-E989 HydrophobicContact CG2-CG 3.92Å; R942-E989 IonicContact CZ-OE1 2.61Å; R942-E989 IonicContact CZ-OE2 3.77Å; R942-E989 VanDerWaalsContact NE-CD 3.3Å; R942-E989 IonicContact NE-OE1 3.47Å; R942-E989 IonicContact NE-OE2 3.72Å; R942-E989 PolarHBondContact NE-OE2 3.26Å; R942-E989 VanDerWaalsContact NH2-CD 3.31Å; R942-E989 IonicContact NH2-OE1 2.68Å; R942-E989 PolarHBondContact NH2-OE1 3.16Å; R942-E989 IonicContact NH2-OE2 3.98Å; R942-E989 PolarHBondContact NH2-OE2 2.99Å; V986-E989 WeakPolarHBondContact O-CB 3.14Å; V986-E989 WeakPolarHBondContact O-CG 3.43Å; V986-E989 PolarHBondContact O-N 3.26Å; L987-E989 PolarHBondContact O-N 3.46Å; L987-E989 VanDerWaalsContact O-N 3.13Å; E989-N992 PolarHBondContact O-OD1 3.01Å
990	T	90.7	Very high	90.8	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.012	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-10.3	179	69.8	0	0	0	0	114	I941 N963 L987 S988 N992 K993	I941-T990 HydrophobicContact CD1-CG2 3.46Å; I941-T990 VanDerWaalsContact CD1-CG2 3.46Å; I941-T990 HydrophobicContact CG1-CG2 3.73Å; N963-T990 PolarHBondContact ND2-OG1 2.93Å; L987-T990 PolarHBondContact O-N 3.38Å; L987-T990 PolarHBondContact O-OG1 3.35Å; S988-T990 PolarHBondContact O-N 3.23Å; T990-N992 PolarHBondContact O-N 3.19Å; T990-K993 WeakPolarHBondContact O-CB 3.3Å; T990-K993 PolarHBondContact O-N 3.03Å
991	C	89.2	Confident	90.9	Very high	3 Å²	3	33.8 Å²	33.8	2%	0.02	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-65.9	-23.8	-174.2	-66.8	0	0	0	0	113.5	S988 K993 L994 F1027 V1030	S988-C991 WeakPolarHBondContact O-CB 3.44Å; S988-C991 PolarHBondContact O-N 2.97Å; C991-K993 PolarHBondContact O-N 3.05Å; C991-L994 PolarHBondContact O-N 3.38Å; C991-F1027 WeakPolarHBondContact SG-CE2 3.21Å; C991-V1030 HydrophobicContact CB-CG1 3.43Å; C991-V1030 VanDerWaalsContact CB-CG1 3.43Å
992	N	87.1	Confident	91	Very high	114 Å²	114	33.2 Å²	33.2	61%	0.61	17%	0.168	S	C	*	.	G	3₁₀ helix	trans	-70.3	-16.4	172.1	64	2.9	0	0	0	113.5	E989 T990	E989-N992 PolarHBondContact O-OD1 3.01Å; T990-N992 PolarHBondContact O-N 3.19Å
993	K	88.1	Confident	91.1	Very high	36 Å²	36	33.3 Å²	33.3	16%	0.157	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-97.5	-1.1	175.7	-70.8	177.1	178.9	-73.4	0	113.8	G945 G949 L952 V959 T990 C991	G945-K993 WeakPolarHBondContact O-CE 3.46Å; G945-K993 PolarHBondContact O-NZ 3.35Å; G945-K993 VanDerWaalsContact O-NZ 3.08Å; G949-K993 PolarHBondContact O-NZ 3.46Å; L952-K993 HydrophobicContact CD2-CB 4.15Å; L952-K993 HydrophobicContact CD2-CG 4.18Å; V959-K993 HydrophobicContact CG1-CB 4.2Å; V959-K993 HydrophobicContact CG2-CB 4.04Å; T990-K993 WeakPolarHBondContact O-CB 3.3Å; T990-K993 PolarHBondContact O-N 3.03Å; C991-K993 PolarHBondContact O-N 3.05Å
994	L	89.5	Confident	91	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	19%	0.194	C	C	.	.	S	Bend	trans	-85.7	135.8	172.4	-68.4	171.3	0	0	0	110.7	V959 V960 C991 D998 K999 V1002 L1031 Q1038	V959-L994 HydrophobicContact CB-CD2 4.36Å; V959-L994 HydrophobicContact CG1-CD2 3.65Å; V959-L994 HydrophobicContact CG1-CG 3.96Å; V960-L994 HydrophobicContact CG2-CD2 3.9Å; C991-L994 PolarHBondContact O-N 3.38Å; L994-D998 HydrophobicContact CB-CB 4.44Å; L994-D998 HydrophobicContact CD2-CB 3.93Å; L994-K999 HydrophobicContact CB-CG 3.78Å; L994-K999 HydrophobicContact CD1-CG 4.34Å; L994-V1002 HydrophobicContact CD1-CB 4.27Å; L994-V1002 HydrophobicContact CD1-CG1 4.45Å; L994-V1002 HydrophobicContact CD1-CG2 3.96Å; L994-V1002 HydrophobicContact CD2-CG2 4.08Å; L994-L1031 HydrophobicContact CD1-CD2 3.86Å; L994-Q1038 PolarHBondContact O-NE2 3.38Å
995	L	88.2	Confident	91	Very high	37 Å²	37	40.7 Å²	40.7	19%	0.194	20%	0.202	C	C	.	.			trans	-72.4	159.5	167.4	-55.7	170.4	0	0	0	109.8	L952 R956 Q997 D998 K999	L952-L995 HydrophobicContact CB-CD2 3.97Å; L952-L995 HydrophobicContact CD1-CD2 4.21Å; R956-L995 HydrophobicContact CG-CD1 4.32Å; L995-Q997 VanDerWaalsContact C-N 3.27Å; L995-Q997 HydrophobicContact CB-CG 4.2Å; L995-Q997 PolarHBondContact O-N 3.37Å; L995-Q997 VanDerWaalsContact O-N 3.16Å; L995-D998 WeakPolarHBondContact CB-OD2 3.23Å; L995-D998 CarbonylContact O-C 3.52Å; L995-D998 WeakPolarHBondContact O-CA 3.39Å; L995-D998 PolarHBondContact O-N 2.99Å; L995-K999 PolarHBondContact O-N 2.73Å
996	P	86.1	Confident	91	Very high	46 Å²	46	38.9 Å²	38.9	30%	0.299	19%	0.194	S	C	.	.	H	α-helix	trans	-54	-39.3	-179.4	-26.6	31.7	0	0	0	114.4	D998 K1000 Q1038	P996-D998 VanDerWaalsContact C-N 3.31Å; P996-D998 PolarHBondContact O-N 3.27Å; P996-K1000 PolarHBondContact O-N 3.04Å; P996-Q1038 VanDerWaalsContact CD-OE1 3.26Å; P996-Q1038 VanDerWaalsContact CG-OE1 3.26Å
997	Q	88.9	Confident	90.8	Very high	109 Å²	109	42.2 Å²	42.2	51%	0.509	21%	0.212	S	C	.	.	H	α-helix	trans	-65.8	-33.1	175.9	65.7	-171.7	-10.5	0	0	112.7	L995 L1001	L995-Q997 VanDerWaalsContact C-N 3.27Å; L995-Q997 HydrophobicContact CB-CG 4.2Å; L995-Q997 PolarHBondContact O-N 3.37Å; L995-Q997 VanDerWaalsContact O-N 3.16Å; Q997-L1001 PolarHBondContact O-N 2.88Å; Q997-L1001 VanDerWaalsContact O-N 3.17Å
998	D	92.1	Very high	90.7	Very high	4 Å²	4	49 Å²	49	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-84.1	-31.2	-178.3	-60.3	-51.7	0	0	0	111.5	R956 V960 L994 L995 P996 K1000 L1001 V1002	R956-D998 WeakPolarHBondContact CD-OD2 3.2Å; R956-D998 VanDerWaalsContact CG-OD2 3.29Å; R956-D998 WeakPolarHBondContact CG-OD2 3.45Å; R956-D998 IonicContact CZ-OD1 3.25Å; R956-D998 VanDerWaalsContact CZ-OD1 3.24Å; R956-D998 IonicContact CZ-OD2 3.01Å; R956-D998 IonicContact NE-OD1 3.48Å; R956-D998 PolarHBondContact NE-OD1 3.36Å; R956-D998 IonicContact NE-OD2 3.59Å; R956-D998 PolarHBondContact NE-OD2 3.37Å; R956-D998 IonicContact NH2-OD1 3.57Å; R956-D998 PolarHBondContact NH2-OD1 2.91Å; R956-D998 IonicContact NH2-OD2 3.06Å; V960-D998 HydrophobicContact CG2-CB 3.74Å; L994-D998 HydrophobicContact CB-CB 4.44Å; L994-D998 HydrophobicContact CD2-CB 3.93Å; L995-D998 WeakPolarHBondContact CB-OD2 3.23Å; L995-D998 CarbonylContact O-C 3.52Å; L995-D998 WeakPolarHBondContact O-CA 3.39Å; L995-D998 PolarHBondContact O-N 2.99Å; P996-D998 VanDerWaalsContact C-N 3.31Å; P996-D998 PolarHBondContact O-N 3.27Å; D998-K1000 VanDerWaalsContact C-N 3.28Å; D998-K1000 PolarHBondContact O-N 3.11Å; D998-L1001 PolarHBondContact O-N 3.18Å; D998-V1002 WeakPolarHBondContact O-CB 3.24Å; D998-V1002 WeakPolarHBondContact O-CG2 3.37Å; D998-V1002 PolarHBondContact O-N 3.43Å
999	K	92.3	Very high	90.5	Very high	17 Å²	17	48.4 Å²	48.4	7%	0.074	24%	0.241	C	C	.	.	H	α-helix	trans	-55.8	-44.7	165.3	-72	-166.6	176.3	-160.5	0	110.8	L994 L995 V1002 L1003 V1030 L1031 L1033	L994-K999 HydrophobicContact CB-CG 3.78Å; L994-K999 HydrophobicContact CD1-CG 4.34Å; L995-K999 PolarHBondContact O-N 2.73Å; K999-V1002 PolarHBondContact O-N 2.91Å; K999-L1003 VanDerWaalsContact O-CB 3.27Å; K999-L1003 WeakPolarHBondContact O-CB 3.46Å; K999-L1003 PolarHBondContact O-N 2.57Å; K999-V1030 PolarHBondContact NZ-O 2.96Å; K999-L1031 HydrophobicContact CB-CD2 4.37Å; K999-L1031 HydrophobicContact CG-CD2 4.38Å; K999-L1033 PolarHBondContact NZ-O 3.32Å
1000	K	91.2	Very high	90.3	Very high	112 Å²	112	46.2 Å²	46.2	49%	0.487	23%	0.23	S	C	.	.	H	α-helix	trans	-63.1	-39.5	176.4	-70.8	172.1	-177.4	170.4	0	112.3	P996 D998 Q1004 D1035	P996-K1000 PolarHBondContact O-N 3.04Å; D998-K1000 VanDerWaalsContact C-N 3.28Å; D998-K1000 PolarHBondContact O-N 3.11Å; K1000-Q1004 WeakPolarHBondContact O-CG 3.48Å; K1000-Q1004 PolarHBondContact O-N 3.48Å; K1000-Q1004 VanDerWaalsContact O-N 3.1Å; K1000-D1035 IonicContact NZ-OD1 2.65Å; K1000-D1035 IonicContact NZ-OD2 2.66Å; K1000-D1035 PolarHBondContact NZ-OD2 3.21Å
1001	L	92.9	Very high	89.5	Confident	49 Å²	49	48.8 Å²	48.8	26%	0.257	26%	0.258	S	S	.	.	H	α-helix	trans	-68.9	-43.2	175.2	-179.4	62.2	0	0	0	113	V960 Q997 D998 L1003 Q1004 Y1005	V960-L1001 HydrophobicContact CG1-CD2 4.04Å; Q997-L1001 PolarHBondContact O-N 2.88Å; Q997-L1001 VanDerWaalsContact O-N 3.17Å; D998-L1001 PolarHBondContact O-N 3.18Å; L1001-L1003 VanDerWaalsContact C-N 3.3Å; L1001-L1003 PolarHBondContact O-N 2.74Å; L1001-Q1004 WeakPolarHBondContact O-CB 3.29Å; L1001-Q1004 PolarHBondContact O-N 3.43Å; L1001-Q1004 VanDerWaalsContact O-N 3.15Å; L1001-Y1005 HydrophobicContact CD1-CE1 4.17Å; L1001-Y1005 HydrophobicContact CD1-CE2 4.19Å; L1001-Y1005 HydrophobicContact CD2-CE2 4.29Å; L1001-Y1005 HydrophobicContact CG-CE2 3.83Å; L1001-Y1005 PolarHBondContact O-N 2.9Å; L1001-Y1005 VanDerWaalsContact O-N 3.09Å
1002	V	93.3	Very high	88.5	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65.5	-36.4	176.2	172.4	0	0	0	0	110.9	N963 I967 L994 D998 K999 Q1004 Y1005 L1006 F1027 L1031	N963-V1002 HydrophobicContact CB-CG1 3.81Å; N963-V1002 HydrophobicContact CB-CG2 3.8Å; I967-V1002 HydrophobicContact CD1-CG1 3.76Å; L994-V1002 HydrophobicContact CD1-CB 4.27Å; L994-V1002 HydrophobicContact CD1-CG1 4.45Å; L994-V1002 HydrophobicContact CD1-CG2 3.96Å; L994-V1002 HydrophobicContact CD2-CG2 4.08Å; D998-V1002 WeakPolarHBondContact O-CB 3.24Å; D998-V1002 WeakPolarHBondContact O-CG2 3.37Å; D998-V1002 PolarHBondContact O-N 3.43Å; K999-V1002 PolarHBondContact O-N 2.91Å; V1002-Q1004 VanDerWaalsContact C-N 3.32Å; V1002-Q1004 PolarHBondContact O-N 3.21Å; V1002-Y1005 PolarHBondContact O-N 2.75Å; V1002-L1006 WeakPolarHBondContact O-CB 3.21Å; V1002-L1006 PolarHBondContact O-N 3.39Å; V1002-F1027 HydrophobicContact CG1-CE1 4.45Å; V1002-F1027 HydrophobicContact CG1-CZ 4.3Å; V1002-L1031 HydrophobicContact CB-CD2 4.16Å; V1002-L1031 HydrophobicContact CG1-CD1 3.86Å; V1002-L1031 HydrophobicContact CG1-CD2 3.86Å
1003	L	92	Very high	87.6	Confident	34 Å²	34	53.6 Å²	53.6	18%	0.178	28%	0.275	C	S	.	.	H	α-helix	trans	-64.5	-33.9	172.2	-177.8	62.1	0	0	0	112.5	K999 L1001 L1006 N1007 K1028 L1031	K999-L1003 VanDerWaalsContact O-CB 3.27Å; K999-L1003 WeakPolarHBondContact O-CB 3.46Å; K999-L1003 PolarHBondContact O-N 2.57Å; L1001-L1003 VanDerWaalsContact C-N 3.3Å; L1001-L1003 PolarHBondContact O-N 2.74Å; L1003-L1006 HydrophobicContact CD1-CD2 4.36Å; L1003-L1006 PolarHBondContact O-N 2.87Å; L1003-N1007 WeakPolarHBondContact O-CB 3.35Å; L1003-N1007 VanDerWaalsContact O-CG 3.27Å; L1003-N1007 PolarHBondContact O-N 3.45Å; L1003-N1007 PolarHBondContact O-ND2 3.36Å; L1003-K1028 HydrophobicContact CD1-CG 3.92Å; L1003-L1031 HydrophobicContact CB-CB 4.48Å; L1003-L1031 HydrophobicContact CB-CD1 4.4Å
1004	Q	92.1	Very high	86.4	Confident	112 Å²	112	60.7 Å²	60.7	52%	0.523	31%	0.308	S	S	.	.	H	α-helix	trans	-63.6	-50.5	171	-73	169.1	-16.7	0	0	111	K1000 L1001 V1002 L1006 N1007 E1008	K1000-Q1004 WeakPolarHBondContact O-CG 3.48Å; K1000-Q1004 PolarHBondContact O-N 3.48Å; K1000-Q1004 VanDerWaalsContact O-N 3.1Å; L1001-Q1004 WeakPolarHBondContact O-CB 3.29Å; L1001-Q1004 PolarHBondContact O-N 3.43Å; L1001-Q1004 VanDerWaalsContact O-N 3.15Å; V1002-Q1004 VanDerWaalsContact C-N 3.32Å; V1002-Q1004 PolarHBondContact O-N 3.21Å; Q1004-L1006 VanDerWaalsContact C-N 3.26Å; Q1004-L1006 PolarHBondContact O-N 3Å; Q1004-N1007 PolarHBondContact O-N 2.91Å; Q1004-N1007 VanDerWaalsContact O-N 3.15Å; Q1004-E1008 WeakPolarHBondContact O-CG 3.39Å; Q1004-E1008 PolarHBondContact O-N 3.44Å
1005	Y	93.2	Very high	85.1	Confident	44 Å²	44	61.9 Å²	61.9	17%	0.173	32%	0.318	C	S	.	.	H	α-helix	trans	-58.3	-36.9	175.6	-60.9	-35.3	0	0	0	112.9	V960 R964 L1001 V1002 E1008 A1009	V960-Y1005 HydrophobicContact CG1-CE2 4.24Å; R964-Y1005 HydrophobicContact CB-CD2 3.86Å; R964-Y1005 HydrophobicContact CB-CE2 4.01Å; R964-Y1005 HydrophobicContact CG-CD2 3.83Å; R964-Y1005 HydrophobicContact CG-CE2 3.96Å; R964-Y1005 HydrophobicContact CG-CG 4.18Å; L1001-Y1005 HydrophobicContact CD1-CE1 4.17Å; L1001-Y1005 HydrophobicContact CD1-CE2 4.19Å; L1001-Y1005 HydrophobicContact CD2-CE2 4.29Å; L1001-Y1005 HydrophobicContact CG-CE2 3.83Å; L1001-Y1005 PolarHBondContact O-N 2.9Å; L1001-Y1005 VanDerWaalsContact O-N 3.09Å; V1002-Y1005 PolarHBondContact O-N 2.75Å; Y1005-E1008 PolarHBondContact O-N 3.02Å; Y1005-A1009 WeakPolarHBondContact O-CB 3.33Å; Y1005-A1009 PolarHBondContact O-N 3.05Å
1006	L	92.4	Very high	83.7	Confident	1 Å²	1	67 Å²	67	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-65.4	-46.2	175.9	-170.2	71.9	0	0	0	111.6	I967 L984 V1002 L1003 Q1004 E1008 A1009 F1010 L1024 F1027 K1028 L1031	I967-L1006 HydrophobicContact CD1-CB 4.12Å; I967-L1006 HydrophobicContact CD1-CD1 4.2Å; I967-L1006 HydrophobicContact CG1-CD1 4.02Å; I967-L1006 HydrophobicContact CG2-CD1 4.34Å; L984-L1006 HydrophobicContact CD1-CD1 4.37Å; L984-L1006 HydrophobicContact CD2-CD1 4.19Å; V1002-L1006 WeakPolarHBondContact O-CB 3.21Å; V1002-L1006 PolarHBondContact O-N 3.39Å; L1003-L1006 HydrophobicContact CD1-CD2 4.36Å; L1003-L1006 PolarHBondContact O-N 2.87Å; Q1004-L1006 VanDerWaalsContact C-N 3.26Å; Q1004-L1006 PolarHBondContact O-N 3Å; L1006-E1008 VanDerWaalsContact C-N 3.34Å; L1006-A1009 PolarHBondContact O-N 3.1Å; L1006-F1010 HydrophobicContact CD1-CD2 3.7Å; L1006-F1010 HydrophobicContact CD1-CE2 3.79Å; L1006-F1010 HydrophobicContact CG-CD2 4.3Å; L1006-F1010 WeakPolarHBondContact O-CD2 3.27Å; L1006-F1010 PolarHBondContact O-N 3.35Å; L1006-L1024 HydrophobicContact CD1-CD1 3.71Å; L1006-L1024 HydrophobicContact CD2-CD1 4.02Å; L1006-L1024 HydrophobicContact CG-CD1 3.89Å; L1006-F1027 HydrophobicContact CD1-CD1 3.8Å; L1006-F1027 HydrophobicContact CD1-CE1 3.98Å; L1006-F1027 HydrophobicContact CD2-CD1 3.79Å; L1006-F1027 HydrophobicContact CD2-CE1 4.28Å; L1006-F1027 HydrophobicContact CG-CD1 4.42Å; L1006-K1028 HydrophobicContact CD2-CB 4.12Å; L1006-L1031 HydrophobicContact CD2-CD1 4.11Å
1007	N	90.4	Very high	82.4	Confident	70 Å²	70	73.3 Å²	73.3	37%	0.374	38%	0.377	S	S	.	.	H	α-helix	trans	-68.1	-32.2	177.4	-68.4	-39.8	0	0	0	112.2	L1003 Q1004 G1011	L1003-N1007 WeakPolarHBondContact O-CB 3.35Å; L1003-N1007 VanDerWaalsContact O-CG 3.27Å; L1003-N1007 PolarHBondContact O-N 3.45Å; L1003-N1007 PolarHBondContact O-ND2 3.36Å; Q1004-N1007 PolarHBondContact O-N 2.91Å; Q1004-N1007 VanDerWaalsContact O-N 3.15Å; N1007-G1011 WeakPolarHBondContact O-CA 3.24Å; N1007-G1011 PolarHBondContact O-N 3.4Å
1008	E	90.5	Very high	81.6	Confident	141 Å²	141	70.6 Å²	70.6	66%	0.659	37%	0.366	S	S	*	.	H	α-helix	trans	-65.1	-40.4	172.5	-74.3	171.1	-177	0	0	111.9	Q1004 Y1005 L1006	Q1004-E1008 WeakPolarHBondContact O-CG 3.39Å; Q1004-E1008 PolarHBondContact O-N 3.44Å; Y1005-E1008 PolarHBondContact O-N 3.02Å; L1006-E1008 VanDerWaalsContact C-N 3.34Å
1009	A	88.7	Confident	80.8	Confident	30 Å²	30	76.7 Å²	76.7	25%	0.248	40%	0.399	C	S	.	.	H	α-helix	trans	-78.4	-34.8	-178.2	0	0	0	0	0	113.9	I967 Y1005 L1006	I967-A1009 HydrophobicContact CG2-CB 3.58Å; Y1005-A1009 WeakPolarHBondContact O-CB 3.33Å; Y1005-A1009 PolarHBondContact O-N 3.05Å; L1006-A1009 PolarHBondContact O-N 3.1Å
1010	F	87.4	Confident	80.1	Confident	8 Å²	8	83 Å²	83	4%	0.035	42%	0.422	C	S	.	.	H	α-helix	trans	-114.5	3.3	-174	-65.2	-89.3	0	0	0	114.6	I967 A970 L978 L984 L1006 F1012 I1013 L1024	I967-F1010 HydrophobicContact CG2-CE2 4.24Å; A970-F1010 HydrophobicContact CB-CZ 4.08Å; L978-F1010 HydrophobicContact CD1-CD1 4.34Å; L978-F1010 HydrophobicContact CD1-CE1 4.09Å; L978-F1010 HydrophobicContact CD2-CE1 4.31Å; L984-F1010 HydrophobicContact CD1-CE2 4.25Å; L984-F1010 HydrophobicContact CD1-CZ 4.07Å; L984-F1010 HydrophobicContact CD2-CE2 4.49Å; L1006-F1010 HydrophobicContact CD1-CD2 3.7Å; L1006-F1010 HydrophobicContact CD1-CE2 3.79Å; L1006-F1010 HydrophobicContact CG-CD2 4.3Å; L1006-F1010 WeakPolarHBondContact O-CD2 3.27Å; L1006-F1010 PolarHBondContact O-N 3.35Å; F1010-F1012 PolarHBondContact O-N 2.9Å; F1010-I1013 HydrophobicContact CB-CD1 4.35Å; F1010-I1013 HydrophobicContact CD1-CD1 3.85Å; F1010-I1013 PolarHBondContact O-N 3.1Å; F1010-L1024 HydrophobicContact CB-CD1 4.09Å; F1010-L1024 HydrophobicContact CB-CD2 3.87Å; F1010-L1024 HydrophobicContact CD1-CD1 4.19Å; F1010-L1024 HydrophobicContact CD1-CD2 3.86Å; F1010-L1024 HydrophobicContact CD2-CD1 3.82Å; F1010-L1024 HydrophobicContact CE2-CD1 4.28Å; F1010-L1024 HydrophobicContact CG-CD1 3.78Å; F1010-L1024 HydrophobicContact CG-CD2 3.95Å
1011	G	73	Confident	79.8	Confident	57 Å²	57	79.4 Å²	79.4	59%	0.588	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	1.2	-169.1	0	0	0	0	0	118	N1007	N1007-G1011 WeakPolarHBondContact O-CA 3.24Å; N1007-G1011 PolarHBondContact O-N 3.4Å
1012	F	68.8	Low	79.5	Confident	178 Å²	178	84.3 Å²	84.3	78%	0.781	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	3.8	175	-56.4	-79.5	0	0	0	113.4	F1010	F1010-F1012 PolarHBondContact O-N 2.9Å
1013	I	69.2	Low	79.2	Confident	39 Å²	39	84.5 Å²	84.5	20%	0.2	42%	0.423	C	S	.	.			trans	-110.6	114.2	-174.1	-65.4	156	0	0	0	109.4	L978 F1010 A1015 F1021	L978-I1013 HydrophobicContact CD1-CD1 3.8Å; F1010-I1013 HydrophobicContact CB-CD1 4.35Å; F1010-I1013 HydrophobicContact CD1-CD1 3.85Å; F1010-I1013 PolarHBondContact O-N 3.1Å; I1013-A1015 HydrophobicContact CG2-CB 4.27Å; I1013-A1015 PolarHBondContact O-N 2.94Å; I1013-A1015 VanDerWaalsContact O-N 3.11Å; I1013-F1021 HydrophobicContact CD1-CE1 4.02Å; I1013-F1021 HydrophobicContact CG1-CE1 4.3Å; I1013-F1021 HydrophobicContact CG2-CD1 3.65Å; I1013-F1021 HydrophobicContact CG2-CE1 3.53Å; I1013-F1021 HydrophobicContact CG2-CE2 4.5Å; I1013-F1021 HydrophobicContact CG2-CG 4.19Å; I1013-F1021 HydrophobicContact CG2-CZ 3.99Å
1014	E	62.9	Low	79.1	Confident	185 Å²	185	83.4 Å²	83.4	86%	0.864	42%	0.417	S	S	*	.			trans	-77.3	88.2	166.9	-65.5	-171.8	165.7	0	0	108.7	N1016	E1014-N1016 PolarHBondContact O-N 2.87Å
1015	A	62.1	Low	78.9	Confident	26 Å²	26	80.6 Å²	80.6	22%	0.215	41%	0.407	C	S	.	.			trans	-75.1	32	-171.7	0	0	0	0	0	115	I1013 F1021 V1025	I1013-A1015 HydrophobicContact CG2-CB 4.27Å; I1013-A1015 PolarHBondContact O-N 2.94Å; I1013-A1015 VanDerWaalsContact O-N 3.11Å; A1015-F1021 HydrophobicContact CB-CB 4.25Å; A1015-V1025 HydrophobicContact CB-CG2 4.24Å
1016	N	58.6	Low	78.7	Confident	145 Å²	145	82.9 Å²	82.9	78%	0.775	42%	0.421	S	S	*	.	S	Bend	trans	-95.8	123.2	-178.1	-66.3	-15.7	0	0	0	110.4	E1014	E1014-N1016 PolarHBondContact O-N 2.87Å
1017	D	59.1	Low	78.7	Confident	178 Å²	178	83 Å²	83	95%	0.952	42%	0.421	S	S	*	.	S	Bend	trans	66.4	20.1	174.1	-69.4	-10.1	0	0	0	119
1018	D	72	Confident	78.7	Confident	52 Å²	52	84.2 Å²	84.2	28%	0.278	42%	0.423	S	S	.	.			trans	-117.7	110.4	170.4	-175.4	-15.2	0	0	0	111.7	R1020 F1021	D1018-R1020 PolarHBondContact O-N 3.19Å; D1018-R1020 VanDerWaalsContact OD1-CB 3.25Å; D1018-R1020 WeakPolarHBondContact OD1-CB 3.5Å; D1018-R1020 VanDerWaalsContact OD1-CG 3.26Å; D1018-R1020 WeakPolarHBondContact OD1-CG 3.38Å; D1018-R1020 PolarHBondContact OD1-N 2.63Å; D1018-R1020 IonicContact OD1-NE 3.64Å; D1018-R1020 PolarHBondContact OD1-NE 3.14Å; D1018-R1020 IonicContact OD2-CZ 3.69Å; D1018-R1020 VanDerWaalsContact OD2-CZ 3.24Å; D1018-R1020 IonicContact OD2-NE 3.36Å; D1018-R1020 PolarHBondContact OD2-NE 3.47Å; D1018-R1020 IonicContact OD2-NH2 3.14Å; D1018-R1020 PolarHBondContact OD2-NH2 2.82Å; D1018-F1021 HydrophobicContact CB-CD2 3.84Å; D1018-F1021 HydrophobicContact CB-CE2 4.2Å; D1018-F1021 PolarHBondContact O-N 3.17Å; D1018-F1021 WeakPolarHBondContact OD2-CE2 3.3Å
1019	D	75.6	Confident	78.6	Confident	132 Å²	132	82.9 Å²	82.9	71%	0.706	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-53	-26.7	-178.6	-91.6	-43	0	0	0	113.3	F1021 R1022	D1019-F1021 PolarHBondContact O-N 2.98Å; D1019-F1021 VanDerWaalsContact O-N 3.16Å; D1019-R1022 WeakPolarHBondContact O-CB 3.35Å; D1019-R1022 PolarHBondContact O-N 3.32Å
1020	R	77.7	Confident	78.5	Confident	149 Å²	149	84 Å²	84	56%	0.562	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-60.3	-25	177	-62.1	-179.6	-67.2	170	-2.4	112.8	D977 D1018	D977-R1020 IonicContact OD1-NH1 2.63Å; D1018-R1020 PolarHBondContact O-N 3.19Å; D1018-R1020 VanDerWaalsContact OD1-CB 3.25Å; D1018-R1020 WeakPolarHBondContact OD1-CB 3.5Å; D1018-R1020 VanDerWaalsContact OD1-CG 3.26Å; D1018-R1020 WeakPolarHBondContact OD1-CG 3.38Å; D1018-R1020 PolarHBondContact OD1-N 2.63Å; D1018-R1020 IonicContact OD1-NE 3.64Å; D1018-R1020 PolarHBondContact OD1-NE 3.14Å; D1018-R1020 IonicContact OD2-CZ 3.69Å; D1018-R1020 VanDerWaalsContact OD2-CZ 3.24Å; D1018-R1020 IonicContact OD2-NE 3.36Å; D1018-R1020 PolarHBondContact OD2-NE 3.47Å; D1018-R1020 IonicContact OD2-NH2 3.14Å; D1018-R1020 PolarHBondContact OD2-NH2 2.82Å
1021	F	83.5	Confident	78.6	Confident	37 Å²	37	83.9 Å²	83.9	16%	0.162	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-99	4.5	179.2	-58	-85.3	0	0	0	113.9	L978 I981 I1013 A1015 D1018 D1019 P1023 L1024 V1025	L978-F1021 HydrophobicContact CD1-CD1 4.42Å; L978-F1021 HydrophobicContact CD1-CE1 3.8Å; I981-F1021 HydrophobicContact CD1-CD1 3.77Å; I981-F1021 HydrophobicContact CD1-CE1 4.48Å; I981-F1021 HydrophobicContact CD1-CG 4.47Å; I1013-F1021 HydrophobicContact CD1-CE1 4.02Å; I1013-F1021 HydrophobicContact CG1-CE1 4.3Å; I1013-F1021 HydrophobicContact CG2-CD1 3.65Å; I1013-F1021 HydrophobicContact CG2-CE1 3.53Å; I1013-F1021 HydrophobicContact CG2-CE2 4.5Å; I1013-F1021 HydrophobicContact CG2-CG 4.19Å; I1013-F1021 HydrophobicContact CG2-CZ 3.99Å; A1015-F1021 HydrophobicContact CB-CB 4.25Å; D1018-F1021 HydrophobicContact CB-CD2 3.84Å; D1018-F1021 HydrophobicContact CB-CE2 4.2Å; D1018-F1021 PolarHBondContact O-N 3.17Å; D1018-F1021 WeakPolarHBondContact OD2-CE2 3.3Å; D1019-F1021 PolarHBondContact O-N 2.98Å; D1019-F1021 VanDerWaalsContact O-N 3.16Å; F1021-P1023 VanDerWaalsContact C-N 3.32Å; F1021-L1024 WeakPolarHBondContact O-CB 3.27Å; F1021-L1024 PolarHBondContact O-N 2.94Å; F1021-V1025 PolarHBondContact O-N 3.17Å
1022	R	86.6	Confident	79	Confident	153 Å²	153	84.7 Å²	84.7	58%	0.577	42%	0.417	S	S	*	.	H	α-helix	trans	-50.4	-39.9	177.8	-177.9	175	176.3	175	-0.7	114.6	D1019 L1024 V1025 M1026	D1019-R1022 WeakPolarHBondContact O-CB 3.35Å; D1019-R1022 PolarHBondContact O-N 3.32Å; R1022-L1024 VanDerWaalsContact C-N 3.28Å; R1022-L1024 PolarHBondContact O-N 2.61Å; R1022-V1025 PolarHBondContact O-N 2.95Å; R1022-M1026 HydrophobicContact CG-CG 4.35Å; R1022-M1026 HydrophobicContact CG-SD 3.99Å; R1022-M1026 WeakPolarHBondContact O-CG 3.42Å; R1022-M1026 PolarHBondContact O-N 3.48Å
1023	P	88.5	Confident	79	Confident	3 Å²	3	82 Å²	82	2%	0.019	41%	0.41	C	S	.	.	H	α-helix	trans	-59.7	-36.2	175.1	-26.4	36.9	0	0	0	113.8	I981 L984 E985 F1021 F1027	I981-P1023 HydrophobicContact CG1-CB 4.27Å; I981-P1023 HydrophobicContact CG2-CG 4.48Å; I981-P1023 WeakPolarHBondContact O-CB 3.29Å; L984-P1023 HydrophobicContact CB-CB 4.42Å; E985-P1023 HydrophobicContact CG-CB 3.97Å; E985-P1023 HydrophobicContact CG-CG 4.4Å; F1021-P1023 VanDerWaalsContact C-N 3.32Å; P1023-F1027 VanDerWaalsContact O-CB 3.29Å; P1023-F1027 WeakPolarHBondContact O-CB 3.34Å; P1023-F1027 PolarHBondContact O-N 3.2Å; P1023-F1027 VanDerWaalsContact O-N 3.08Å
1024	L	89.5	Confident	78.3	Confident	11 Å²	11	80.6 Å²	80.6	6%	0.058	41%	0.405	C	S	.	.	H	α-helix	trans	-70.2	-42.5	178.3	175.3	64.8	0	0	0	111.4	I981 L984 L1006 F1010 F1021 R1022 K1028	I981-L1024 HydrophobicContact CD1-CB 4.32Å; L984-L1024 HydrophobicContact CD1-CB 3.94Å; L984-L1024 HydrophobicContact CD1-CD1 3.84Å; L1006-L1024 HydrophobicContact CD1-CD1 3.71Å; L1006-L1024 HydrophobicContact CD2-CD1 4.02Å; L1006-L1024 HydrophobicContact CG-CD1 3.89Å; F1010-L1024 HydrophobicContact CB-CD1 4.09Å; F1010-L1024 HydrophobicContact CB-CD2 3.87Å; F1010-L1024 HydrophobicContact CD1-CD1 4.19Å; F1010-L1024 HydrophobicContact CD1-CD2 3.86Å; F1010-L1024 HydrophobicContact CD2-CD1 3.82Å; F1010-L1024 HydrophobicContact CE2-CD1 4.28Å; F1010-L1024 HydrophobicContact CG-CD1 3.78Å; F1010-L1024 HydrophobicContact CG-CD2 3.95Å; F1021-L1024 WeakPolarHBondContact O-CB 3.27Å; F1021-L1024 PolarHBondContact O-N 2.94Å; R1022-L1024 VanDerWaalsContact C-N 3.28Å; R1022-L1024 PolarHBondContact O-N 2.61Å; L1024-K1028 VanDerWaalsContact O-CB 3.26Å; L1024-K1028 WeakPolarHBondContact O-CB 3.26Å; L1024-K1028 PolarHBondContact O-N 2.96Å
1025	V	87.9	Confident	77.7	Confident	53 Å²	53	76.5 Å²	76.5	32%	0.321	39%	0.389	S	S	.	.	H	α-helix	trans	-61.6	-52.6	176.7	179.8	0	0	0	0	110.2	A1015 F1021 R1022 F1027 K1028 E1029	A1015-V1025 HydrophobicContact CB-CG2 4.24Å; F1021-V1025 PolarHBondContact O-N 3.17Å; R1022-V1025 PolarHBondContact O-N 2.95Å; V1025-F1027 PolarHBondContact O-N 2.94Å; V1025-K1028 WeakPolarHBondContact O-CB 3.38Å; V1025-K1028 PolarHBondContact O-N 3.3Å; V1025-K1028 VanDerWaalsContact O-N 3.13Å; V1025-E1029 WeakPolarHBondContact O-CG 3.39Å; V1025-E1029 PolarHBondContact O-N 3.46Å
1026	M	88.7	Confident	76.9	Confident	93 Å²	93	83.6 Å²	83.6	46%	0.458	42%	0.418	S	S	.	.	H	α-helix	trans	-60.9	-42.2	-179.2	-68.5	-178.4	65.6	0	0	112.4	R1022 K1028 E1029 V1030	R1022-M1026 HydrophobicContact CG-CG 4.35Å; R1022-M1026 HydrophobicContact CG-SD 3.99Å; R1022-M1026 WeakPolarHBondContact O-CG 3.42Å; R1022-M1026 PolarHBondContact O-N 3.48Å; M1026-K1028 VanDerWaalsContact C-N 3.34Å; M1026-K1028 PolarHBondContact O-N 3.03Å; M1026-E1029 PolarHBondContact O-N 3.06Å; M1026-V1030 WeakPolarHBondContact O-CG2 3.36Å; M1026-V1030 PolarHBondContact O-N 3.04Å; M1026-V1030 VanDerWaalsContact O-N 3.14Å
1027	F	91.9	Very high	76.3	Confident	2 Å²	2	83.8 Å²	83.8	1%	0.009	41%	0.414	C	S	.	.	H	α-helix	trans	-65.7	-37.1	177.1	-172.9	-113.8	0	0	0	112.1	N963 I967 L984 L987 C991 V1002 L1006 P1023 V1025 V1030 L1031	N963-F1027 WeakPolarHBondContact OD1-CZ 3.22Å; I967-F1027 HydrophobicContact CD1-CE1 4.12Å; I967-F1027 HydrophobicContact CG1-CE1 4.18Å; L984-F1027 HydrophobicContact CB-CB 4.08Å; L984-F1027 HydrophobicContact CB-CD1 4.44Å; L984-F1027 HydrophobicContact CB-CG 4.18Å; L984-F1027 HydrophobicContact CD2-CD1 4.07Å; L984-F1027 HydrophobicContact CD2-CE1 4.25Å; L984-F1027 WeakPolarHBondContact O-CD2 3.37Å; L987-F1027 HydrophobicContact CB-CD2 4.4Å; L987-F1027 HydrophobicContact CB-CE2 3.62Å; L987-F1027 HydrophobicContact CB-CZ 3.9Å; L987-F1027 HydrophobicContact CD1-CZ 4.28Å; C991-F1027 WeakPolarHBondContact SG-CE2 3.21Å; V1002-F1027 HydrophobicContact CG1-CE1 4.45Å; V1002-F1027 HydrophobicContact CG1-CZ 4.3Å; L1006-F1027 HydrophobicContact CD1-CD1 3.8Å; L1006-F1027 HydrophobicContact CD1-CE1 3.98Å; L1006-F1027 HydrophobicContact CD2-CD1 3.79Å; L1006-F1027 HydrophobicContact CD2-CE1 4.28Å; L1006-F1027 HydrophobicContact CG-CD1 4.42Å; P1023-F1027 VanDerWaalsContact O-CB 3.29Å; P1023-F1027 WeakPolarHBondContact O-CB 3.34Å; P1023-F1027 PolarHBondContact O-N 3.2Å; P1023-F1027 VanDerWaalsContact O-N 3.08Å; V1025-F1027 PolarHBondContact O-N 2.94Å; F1027-V1030 PolarHBondContact O-N 2.99Å; F1027-L1031 HydrophobicContact CD1-CD1 3.95Å; F1027-L1031 HydrophobicContact CE1-CD1 3.64Å; F1027-L1031 HydrophobicContact CE1-CG 4.49Å; F1027-L1031 HydrophobicContact CZ-CD1 4.05Å; F1027-L1031 WeakPolarHBondContact O-CG 3.46Å; F1027-L1031 PolarHBondContact O-N 2.92Å; F1027-L1031 VanDerWaalsContact O-N 3.16Å
1028	K	90.3	Very high	75.6	Confident	97 Å²	97	77.4 Å²	77.4	42%	0.422	38%	0.378	S	S	.	.	H	α-helix	trans	-66.2	-38.1	175.6	-173.6	171	-178.6	170.2	0	112.6	L1003 L1006 L1024 V1025 M1026 S1032	L1003-K1028 HydrophobicContact CD1-CG 3.92Å; L1006-K1028 HydrophobicContact CD2-CB 4.12Å; L1024-K1028 VanDerWaalsContact O-CB 3.26Å; L1024-K1028 WeakPolarHBondContact O-CB 3.26Å; L1024-K1028 PolarHBondContact O-N 2.96Å; V1025-K1028 WeakPolarHBondContact O-CB 3.38Å; V1025-K1028 PolarHBondContact O-N 3.3Å; V1025-K1028 VanDerWaalsContact O-N 3.13Å; M1026-K1028 VanDerWaalsContact C-N 3.34Å; M1026-K1028 PolarHBondContact O-N 3.03Å; K1028-S1032 WeakPolarHBondContact O-CB 3.43Å; K1028-S1032 PolarHBondContact O-N 3.18Å; K1028-S1032 VanDerWaalsContact O-N 3.1Å; K1028-S1032 PolarHBondContact O-OG 2.92Å
1029	E	87.9	Confident	74	Confident	112 Å²	112	84.7 Å²	84.7	52%	0.523	40%	0.402	S	S	.	.	H	α-helix	trans	-62.4	-49.6	173.9	-71.3	173.8	165.4	0	0	111.4	V1025 M1026 L1031 S1032 L1033	V1025-E1029 WeakPolarHBondContact O-CG 3.39Å; V1025-E1029 PolarHBondContact O-N 3.46Å; M1026-E1029 PolarHBondContact O-N 3.06Å; E1029-L1031 VanDerWaalsContact C-N 3.28Å; E1029-L1031 PolarHBondContact O-N 2.97Å; E1029-S1032 WeakPolarHBondContact O-CA 3.45Å; E1029-S1032 PolarHBondContact O-N 3.3Å; E1029-L1033 WeakPolarHBondContact O-CG 3.13Å; E1029-L1033 PolarHBondContact O-N 3.45Å; E1029-L1033 VanDerWaalsContact O-N 3.08Å
1030	V	87.9	Confident	72.3	Confident	55 Å²	55	83.1 Å²	83.1	33%	0.333	40%	0.397	S	S	.	.	H	α-helix	trans	-60.2	-34.8	179.8	172.7	0	0	0	0	112.8	C991 K999 M1026 F1027	C991-V1030 HydrophobicContact CB-CG1 3.43Å; C991-V1030 VanDerWaalsContact CB-CG1 3.43Å; K999-V1030 PolarHBondContact NZ-O 2.96Å; M1026-V1030 WeakPolarHBondContact O-CG2 3.36Å; M1026-V1030 PolarHBondContact O-N 3.04Å; M1026-V1030 VanDerWaalsContact O-N 3.14Å; F1027-V1030 PolarHBondContact O-N 2.99Å
1031	L	88.5	Confident	70.4	Confident	5 Å²	5	79.7 Å²	79.7	3%	0.026	39%	0.393	C	S	.	.	H	α-helix	trans	-73.3	-28.7	172.9	-69.4	172	0	0	0	113.1	L994 K999 V1002 L1003 L1006 F1027 E1029	L994-L1031 HydrophobicContact CD1-CD2 3.86Å; K999-L1031 HydrophobicContact CB-CD2 4.37Å; K999-L1031 HydrophobicContact CG-CD2 4.38Å; V1002-L1031 HydrophobicContact CB-CD2 4.16Å; V1002-L1031 HydrophobicContact CG1-CD1 3.86Å; V1002-L1031 HydrophobicContact CG1-CD2 3.86Å; L1003-L1031 HydrophobicContact CB-CB 4.48Å; L1003-L1031 HydrophobicContact CB-CD1 4.4Å; L1006-L1031 HydrophobicContact CD2-CD1 4.11Å; F1027-L1031 HydrophobicContact CD1-CD1 3.95Å; F1027-L1031 HydrophobicContact CE1-CD1 3.64Å; F1027-L1031 HydrophobicContact CE1-CG 4.49Å; F1027-L1031 HydrophobicContact CZ-CD1 4.05Å; F1027-L1031 WeakPolarHBondContact O-CG 3.46Å; F1027-L1031 PolarHBondContact O-N 2.92Å; F1027-L1031 VanDerWaalsContact O-N 3.16Å; E1029-L1031 VanDerWaalsContact C-N 3.28Å; E1029-L1031 PolarHBondContact O-N 2.97Å
1032	S	81.7	Confident	68.2	Low	74 Å²	74	80.4 Å²	80.4	52%	0.517	41%	0.406	S	S	.	.	H	α-helix	trans	-82.4	-25	-176.9	-58.4	0	0	0	0	113.5	K1028 E1029 G1034	K1028-S1032 WeakPolarHBondContact O-CB 3.43Å; K1028-S1032 PolarHBondContact O-N 3.18Å; K1028-S1032 VanDerWaalsContact O-N 3.1Å; K1028-S1032 PolarHBondContact O-OG 2.92Å; E1029-S1032 WeakPolarHBondContact O-CA 3.45Å; E1029-S1032 PolarHBondContact O-N 3.3Å; S1032-G1034 PolarHBondContact O-N 3.39Å
1033	L	69.9	Low	65.8	Low	122 Å²	122	75.8 Å²	75.8	64%	0.639	40%	0.4	S	S	*	.			trans	-72.1	64.3	174.9	-67.3	164.5	0	0	0	111.6	K999 E1029	K999-L1033 PolarHBondContact NZ-O 3.32Å; E1029-L1033 WeakPolarHBondContact O-CG 3.13Å; E1029-L1033 PolarHBondContact O-N 3.45Å; E1029-L1033 VanDerWaalsContact O-N 3.08Å
1034	G	54.1	Low	63.3	Low	9 Å²	9	77.9 Å²	77.9	9%	0.093	42%	0.418	C	S	.	.			trans	-102.4	-27.2	-161.9	0	0	0	0	0	117.9	S1032	S1032-G1034 PolarHBondContact O-N 3.39Å
1035	D	49.4	Very low	60.7	Low	98 Å²	98	80.9 Å²	80.9	52%	0.524	44%	0.44	S	S	.	.	S	Bend	trans	-114.8	-16	-160.4	-79.6	-46.9	0	0	0	116.2	K1000	K1000-D1035 IonicContact NZ-OD1 2.65Å; K1000-D1035 IonicContact NZ-OD2 2.66Å; K1000-D1035 PolarHBondContact NZ-OD2 3.21Å
1036	E	45.2	Very low	58.3	Low	176 Å²	176	83.4 Å²	83.4	82%	0.822	46%	0.455	S	S	*	.	S	Bend	trans	-101.6	-51.8	-177	-62.8	-157.3	142.5	0	0	115.3	Q1038	E1036-Q1038 PolarHBondContact O-N 3.35Å
1037	E	46.7	Very low	55.8	Low	148 Å²	148	85.2 Å²	85.2	69%	0.692	47%	0.467	S	S	*	.	H	α-helix	trans	-75	-20.9	-174.8	-68	-171.4	136.2	0	0	115.1	R1039 T1040 T1041	E1037-R1039 VanDerWaalsContact C-N 3.29Å; E1037-R1039 PolarHBondContact O-N 2.97Å; E1037-T1040 PolarHBondContact O-N 3.42Å; E1037-T1040 PolarHBondContact O-OG1 3.11Å; E1037-T1041 PolarHBondContact O-N 2.81Å; E1037-T1041 PolarHBondContact O-OG1 2.95Å; E1037-T1041 VanDerWaalsContact O-OG1 3.1Å
1038	Q	44.2	Very low	53.1	Low	44 Å²	44	89.1 Å²	89.1	21%	0.206	49%	0.49	C	S	.	.	H	α-helix	trans	-75.2	-16.2	-179	-81.5	-174.5	-25	0	0	113.7	L994 P996 E1036 T1041 A1042	L994-Q1038 PolarHBondContact O-NE2 3.38Å; P996-Q1038 VanDerWaalsContact CD-OE1 3.26Å; P996-Q1038 VanDerWaalsContact CG-OE1 3.26Å; E1036-Q1038 PolarHBondContact O-N 3.35Å; Q1038-T1041 WeakPolarHBondContact CA-OG1 3.34Å; Q1038-A1042 WeakPolarHBondContact O-CB 3.37Å; Q1038-A1042 PolarHBondContact O-N 3.19Å; Q1038-A1042 VanDerWaalsContact O-N 3.08Å
1039	R	38.6	Very low	50.4	Low	206 Å²	206	88.8 Å²	88.8	78%	0.777	50%	0.5	S	S	*	.	H	α-helix	trans	-73.4	-36.1	173.2	-69.5	-173.4	-176.7	-177	3.6	112.8	E1037	E1037-R1039 VanDerWaalsContact C-N 3.29Å; E1037-R1039 PolarHBondContact O-N 2.97Å
1040	T	39.4	Very low	48	Very low	98 Å²	98	90.5 Å²	90.5	60%	0.601	51%	0.513	S	S	*	.	H	α-helix	trans	-76.2	-41.2	176.5	50.7	0	0	0	0	111.3	E1037 A1044	E1037-T1040 PolarHBondContact O-N 3.42Å; E1037-T1040 PolarHBondContact O-OG1 3.11Å; T1040-A1044 WeakPolarHBondContact O-CB 3.45Å; T1040-A1044 PolarHBondContact O-N 3.27Å
1041	T	38.5	Very low	45.4	Very low	77 Å²	77	92.4 Å²	92.4	47%	0.472	52%	0.521	S	S	.	.	H	α-helix	trans	-72.6	-32.6	179.6	54	0	0	0	0	114.3	E1037 Q1038 A1044 S1045	E1037-T1041 PolarHBondContact O-N 2.81Å; E1037-T1041 PolarHBondContact O-OG1 2.95Å; E1037-T1041 VanDerWaalsContact O-OG1 3.1Å; Q1038-T1041 WeakPolarHBondContact CA-OG1 3.34Å; T1041-A1044 PolarHBondContact O-N 2.97Å; T1041-S1045 WeakPolarHBondContact O-CB 3.43Å; T1041-S1045 PolarHBondContact O-N 2.89Å; T1041-S1045 PolarHBondContact O-OG 3.23Å
1042	A	37.6	Very low	42.5	Very low	52 Å²	52	98.9 Å²	98.9	43%	0.43	56%	0.556	S	S	.	*	H	α-helix	trans	-70.8	-37.1	175.2	0	0	0	0	0	112.9	Q1038 S1045 T1046	Q1038-A1042 WeakPolarHBondContact O-CB 3.37Å; Q1038-A1042 PolarHBondContact O-N 3.19Å; Q1038-A1042 VanDerWaalsContact O-N 3.08Å; A1042-S1045 PolarHBondContact O-OG 3.42Å; A1042-T1046 PolarHBondContact O-N 2.91Å; A1042-T1046 PolarHBondContact O-OG1 2.99Å
1043	A	35.4	Very low	39.9	Very low	56 Å²	56	99 Å²	99	46%	0.463	56%	0.557	S	S	.	*	H	α-helix	trans	-63.7	-47.4	171.1	0	0	0	0	0	111	T1046 L1047	A1043-T1046 PolarHBondContact O-N 3.17Å; A1043-L1047 PolarHBondContact O-N 3.34Å
1044	A	36.6	Very low	38	Very low	48 Å²	48	99 Å²	99	40%	0.397	56%	0.562	S	S	.	*	H	α-helix	trans	-62	-47.1	178.3	0	0	0	0	0	112.8	T1040 T1041 T1046 L1047 V1048	T1040-A1044 WeakPolarHBondContact O-CB 3.45Å; T1040-A1044 PolarHBondContact O-N 3.27Å; T1041-A1044 PolarHBondContact O-N 2.97Å; A1044-T1046 VanDerWaalsContact C-N 3.3Å; A1044-T1046 PolarHBondContact O-N 3.35Å; A1044-L1047 PolarHBondContact O-N 2.94Å; A1044-V1048 VanDerWaalsContact O-CG2 3.28Å; A1044-V1048 WeakPolarHBondContact O-CG2 3.24Å; A1044-V1048 PolarHBondContact O-N 3.47Å
1045	S	34.9	Very low	36.8	Very low	73 Å²	73	106.5 Å²	106.5	51%	0.51	60%	0.597	S	S	.	*	H	α-helix	trans	-69.1	-23.8	-176.6	49.1	0	0	0	0	114.4	T1041 A1042 L1047 S1049	T1041-S1045 WeakPolarHBondContact O-CB 3.43Å; T1041-S1045 PolarHBondContact O-N 2.89Å; T1041-S1045 PolarHBondContact O-OG 3.23Å; A1042-S1045 PolarHBondContact O-OG 3.42Å; S1045-L1047 VanDerWaalsContact C-N 3.35Å; S1045-S1049 PolarHBondContact O-N 3.02Å
1046	T	37.4	Very low	35.9	Very low	106 Å²	106	109.1 Å²	109.1	65%	0.65	61%	0.606	S	S	*	*	H	α-helix	trans	-76.9	-21.8	171.9	-46.1	0	0	0	0	112.4	A1042 A1043 A1044 S1049	A1042-T1046 PolarHBondContact O-N 2.91Å; A1042-T1046 PolarHBondContact O-OG1 2.99Å; A1043-T1046 PolarHBondContact O-N 3.17Å; A1044-T1046 VanDerWaalsContact C-N 3.3Å; A1044-T1046 PolarHBondContact O-N 3.35Å; T1046-S1049 PolarHBondContact O-OG 3.1Å
1047	L	35.2	Very low	35	Very low	132 Å²	132	106.7 Å²	106.7	69%	0.691	61%	0.608	S	S	*	*	H	α-helix	trans	-89.5	-32.4	174.1	-72.9	161.7	0	0	0	112.3	A1043 A1044 S1045	A1043-L1047 PolarHBondContact O-N 3.34Å; A1044-L1047 PolarHBondContact O-N 2.94Å; S1045-L1047 VanDerWaalsContact C-N 3.35Å
1048	V	35.8	Very low	34.2	Very low	83 Å²	83	104.7 Å²	104.7	50%	0.503	61%	0.611	S	S	.	*	H	α-helix	trans	-72.7	-26.5	-178.8	169.5	0	0	0	0	112.8	A1044 N1050 N1051	A1044-V1048 VanDerWaalsContact O-CG2 3.28Å; A1044-V1048 WeakPolarHBondContact O-CG2 3.24Å; A1044-V1048 PolarHBondContact O-N 3.47Å; V1048-N1050 PolarHBondContact O-N 2.98Å; V1048-N1051 PolarHBondContact O-N 3.22Å
1049	S	34.8	Very low	33.5	Very low	90 Å²	90	107.2 Å²	107.2	63%	0.629	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	0.1	-175.6	61.3	0	0	0	0	116.3	S1045 T1046	S1045-S1049 PolarHBondContact O-N 3.02Å; T1046-S1049 PolarHBondContact O-OG 3.1Å
1050	N	35.5	Very low	33.1	Very low	148 Å²	148	101 Å²	101	79%	0.791	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.3	-0.7	172.8	-81.8	-22.9	0	0	0	114.3	V1048	V1048-N1050 PolarHBondContact O-N 2.98Å
1051	N	33.2	Very low	32.4	Very low	95 Å²	95	106.4 Å²	106.4	51%	0.508	65%	0.654	S	S	.	*			trans	-121	16.5	-166	-90.7	-14.3	0	0	0	116.2	V1048 S1053	V1048-N1051 PolarHBondContact O-N 3.22Å; N1051-S1053 PolarHBondContact O-N 3.07Å
1052	D	28.4	Very low	31.9	Very low	142 Å²	142	114.1 Å²	114.1	76%	0.759	67%	0.674	S	S	*	*			trans	-76.2	61.9	171.7	-90.2	-22.7	0	0	0	112.7
1053	S	28.1	Very low	31.5	Very low	77 Å²	77	117.7 Å²	117.7	54%	0.538	69%	0.693	S	S	.	*	S	Bend	trans	-150	118.5	159.1	47.1	0	0	0	0	110.7	N1051	N1051-S1053 PolarHBondContact O-N 3.07Å
1054	T	28.4	Very low	31.1	Very low	122 Å²	122	125.6 Å²	125.6	75%	0.748	71%	0.711	S	S	*	*	S	Bend	trans	79.8	142.8	-169	75.7	0	0	0	0	115.6
1055	M	29.5	Very low	30.8	Very low	165 Å²	165	131.2 Å²	131.2	81%	0.813	73%	0.734	S	S	*	*			trans	75.4	136	-170.3	-51.4	-127.6	152.3	0	0	113.9
1056	Q	30.6	Very low	30.6	Very low	154 Å²	154	134 Å²	134	72%	0.72	74%	0.743	S	S	*	*			cis	-148.5	133.8	-5.8	-118.5	171.2	36.3	0	0	110.3	S1058	Q1056-S1058 PolarHBondContact O-N 2.96Å
1057	S	26.9	Very low	30.3	Very low	125 Å²	125	136.1 Å²	136.1	87%	0.874	75%	0.751	S	S	*	*			trans	-75.5	104.5	164.7	57.2	0	0	0	0	110.2
1058	S	29.7	Very low	30	Very low	106 Å²	106	135.3 Å²	135.3	74%	0.741	76%	0.756	S	S	*	*			trans	-114.1	64.5	169.6	51.2	0	0	0	0	110.8	Q1056 G1060	Q1056-S1058 PolarHBondContact O-N 2.96Å; S1058-G1060 PolarHBondContact O-N 3.3Å
1059	A	29.5	Very low	29.6	Very low	97 Å²	97	136.7 Å²	136.7	80%	0.802	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-63.3	124.9	169.5	0	0	0	0	0	109.7	K1061	A1059-K1061 PolarHBondContact O-N 3.13Å
1060	G	29.1	Very low	29.3	Very low	74 Å²	74	136 Å²	136	76%	0.763	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-58.5	131.1	177.4	0	0	0	0	0	111.6	S1058 R1062	S1058-G1060 PolarHBondContact O-N 3.3Å; G1060-R1062 PolarHBondContact O-N 2.74Å
1061	K	26.1	Very low	28.9	Very low	212 Å²	212	135 Å²	135	92%	0.922	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-58.6	118.1	177.4	-68.8	170.9	177.1	171.5	0	110.5	A1059	A1059-K1061 PolarHBondContact O-N 3.13Å
1062	R	27.8	Very low	28.6	Very low	239 Å²	239	136.5 Å²	136.5	90%	0.902	80%	0.798	S	S	*	*			trans	-110.5	143	147.1	-76.7	-172	174.8	-173	-0.6	108.3	G1060	G1060-R1062 PolarHBondContact O-N 2.74Å
1063	P	28.7	Very low	28.5	Very low	128 Å²	128	141 Å²	141	83%	0.831	80%	0.804	S	S	*	*			trans	-73.7	158.5	-165.1	29.3	-35.2	0	0	0	113
1064	R	26.4	Very low	28.3	Very low	221 Å²	221	142.7 Å²	142.7	83%	0.834	82%	0.816	S	S	*	*			trans	-60.6	141.4	173.3	-65.6	172.2	173.1	159.1	-5.8	110.7
1065	N	30	Very low	28.4	Very low	166 Å²	166	141.6 Å²	141.6	89%	0.888	81%	0.809	S	S	*	*			trans	-117.8	136.5	135.6	-102.5	2.7	0	0	0	106.8
1066	D	31.3	Very low	28.4	Very low	131 Å²	131	136.9 Å²	136.9	70%	0.701	79%	0.792	S	S	*	*			trans	-71.5	147.3	171.1	-61.5	-63.2	0	0	0	109.9
1067	D	30.9	Very low	28.7	Very low	152 Å²	152	133.9 Å²	133.9	81%	0.813	78%	0.78	S	S	*	*				164.8	148.9	112	-97.6	-36.4	0	0	0	114.6
1068	S	29.7	Very low	29.1	Very low	115 Å²	115	130.5 Å²	130.5	80%	0.804	76%	0.756	S	S	*	*			trans	69.9	135.1	159.2	74.2	0	0	0	0	119.6
1069	A	26.9	Very low	29.6	Very low	112 Å²	112	130.3 Å²	130.3	93%	0.926	75%	0.751	S	S	*	*			trans	-75.6	131.2	173.2	0	0	0	0	0	110.9
1070	G	29.3	Very low	30.3	Very low	74 Å²	74	127 Å²	127	76%	0.763	72%	0.72	S	S	*	*			trans	-143.3	141.7	177.1	0	0	0	0	0	111.5
1071	T	25.9	Very low	30.9	Very low	128 Å²	128	125 Å²	125	79%	0.785	69%	0.693	S	S	*	*			trans	-38.8	150.6	176.8	33	0	0	0	0	115.6	R1073	T1071-R1073 PolarHBondContact O-N 2.86Å
1072	P	27.8	Very low	31.2	Very low	127 Å²	127	117.6 Å²	117.6	83%	0.825	68%	0.676	S	S	*	*			trans	-62	114.8	176.4	27.5	-33.8	0	0	0	109.6	S1074	P1072-S1074 PolarHBondContact O-N 3.29Å
1073	R	25.5	Very low	31.3	Very low	237 Å²	237	109.8 Å²	109.8	89%	0.894	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-58.4	130.7	168.6	-77.6	-177.6	171.2	176.1	-3.3	108.5	T1071 V1075	T1071-R1073 PolarHBondContact O-N 2.86Å; R1073-V1075 PolarHBondContact O-N 2.9Å; R1073-V1075 VanDerWaalsContact O-N 3.15Å
1074	S	25.3	Very low	31.3	Very low	112 Å²	112	105 Å²	105	78%	0.783	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-53.6	117.2	172.6	50.1	0	0	0	0	110	P1072 S1076	P1072-S1074 PolarHBondContact O-N 3.29Å; S1074-S1076 PolarHBondContact O-N 3.41Å
1075	V	29.3	Very low	31.3	Very low	99 Å²	99	96.8 Å²	96.8	60%	0.6	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-64.1	122.7	159.9	178.9	0	0	0	0	105.8	R1073 L1077	R1073-V1075 PolarHBondContact O-N 2.9Å; R1073-V1075 VanDerWaalsContact O-N 3.15Å; V1075-L1077 PolarHBondContact O-N 3.07Å
1076	S	30.4	Very low	31.2	Very low	66 Å²	66	94.4 Å²	94.4	46%	0.462	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-63.8	136.5	-178.7	55.7	0	0	0	0	110.1	S1074 S1078 T1079	S1074-S1076 PolarHBondContact O-N 3.41Å; S1076-S1078 WeakPolarHBondContact CB-OG 3.28Å; S1076-S1078 PolarHBondContact O-N 3.08Å; S1076-S1078 PolarHBondContact OG-OG 3.23Å; S1076-T1079 PolarHBondContact O-N 3.35Å; S1076-T1079 VanDerWaalsContact O-OG1 3.06Å; S1076-T1079 PolarHBondContact O-OG1 2.83Å
1077	L	36.7	Very low	30.9	Very low	90 Å²	90	94.6 Å²	94.6	47%	0.471	60%	0.597	S	S	.	*	G	3₁₀ helix	trans	-53.3	-26.9	180	-120.5	75.2	0	0	0	112.6	A422 I471 V1075 T1079 L1080	A422-L1077 HydrophobicContact CB-CD1 4.36Å; A422-L1077 HydrophobicContact CB-CD2 4.07Å; A422-L1077 HydrophobicContact CB-CG 4.24Å; I471-L1077 HydrophobicContact CD1-CD2 3.55Å; I471-L1077 HydrophobicContact CG1-CD2 3.95Å; V1075-L1077 PolarHBondContact O-N 3.07Å; L1077-T1079 PolarHBondContact O-N 3.38Å; L1077-L1080 HydrophobicContact CG-CD1 4.41Å; L1077-L1080 WeakPolarHBondContact O-CB 3.45Å; L1077-L1080 PolarHBondContact O-N 2.86Å
1078	S	34.5	Very low	30.7	Very low	54 Å²	54	91.2 Å²	91.2	38%	0.378	58%	0.577	S	S	.	*	G	3₁₀ helix	trans	-56.1	-12	174.8	56	0	0	0	0	115.6	S1076	S1076-S1078 WeakPolarHBondContact CB-OG 3.28Å; S1076-S1078 PolarHBondContact O-N 3.08Å; S1076-S1078 PolarHBondContact OG-OG 3.23Å
1079	T	39.5	Very low	30.5	Very low	102 Å²	102	88.2 Å²	88.2	63%	0.626	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-87.1	-17.5	174.5	-28.5	0	0	0	0	113.1	S1076 L1077	S1076-T1079 PolarHBondContact O-N 3.35Å; S1076-T1079 VanDerWaalsContact O-OG1 3.06Å; S1076-T1079 PolarHBondContact O-OG1 2.83Å; L1077-T1079 PolarHBondContact O-N 3.38Å
1080	L	45	Very low	30.4	Very low	29 Å²	29	84.6 Å²	84.6	15%	0.152	52%	0.519	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-39.3	179	-85.3	158.6	0	0	0	112.3	L385 A422 A426 A427 L1077 G1082	L385-L1080 HydrophobicContact CD2-CD1 3.89Å; L385-L1080 HydrophobicContact CD2-CD2 3.68Å; L385-L1080 HydrophobicContact CD2-CG 4.04Å; A422-L1080 HydrophobicContact CB-CD1 4.15Å; A426-L1080 HydrophobicContact CB-CD2 4.3Å; A427-L1080 PolarHBondContact N-O 2.87Å; L1077-L1080 HydrophobicContact CG-CD1 4.41Å; L1077-L1080 WeakPolarHBondContact O-CB 3.45Å; L1077-L1080 PolarHBondContact O-N 2.86Å; L1080-G1082 PolarHBondContact O-N 3.02Å
1081	T	42.8	Very low	30.3	Very low	31 Å²	31	84.2 Å²	84.2	19%	0.19	50%	0.5	C	S	.	.	S	Bend	trans	-85.1	105.2	172.2	45.8	0	0	0	0	108.5	I471 H472 A1083	I471-T1081 HydrophobicContact CG2-CG2 3.45Å; I471-T1081 VanDerWaalsContact CG2-CG2 3.45Å; H472-T1081 VanDerWaalsContact NE2-CG2 3.32Å; H472-T1081 WeakPolarHBondContact NE2-CG2 3.26Å; T1081-A1083 PolarHBondContact O-N 3.15Å; T1081-A1083 VanDerWaalsContact O-N 3.11Å
1082	G	31.9	Very low	30.3	Very low	56 Å²	56	80.8 Å²	80.8	58%	0.577	48%	0.476	S	S	*	.			trans	-56	120.9	173	0	0	0	0	0	109.4	L1080	L1080-G1082 PolarHBondContact O-N 3.02Å
1083	A	28.8	Very low	30.2	Very low	76 Å²	76	78.5 Å²	78.5	63%	0.628	45%	0.454	S	S	*	.	S	Bend	trans	-43.4	135.1	-163.5	0	0	0	0	0	115.3	T1081	T1081-A1083 PolarHBondContact O-N 3.15Å; T1081-A1083 VanDerWaalsContact O-N 3.11Å
1084	G	29.3	Very low	30.3	Very low	27 Å²	27	70.5 Å²	70.5	28%	0.278	43%	0.432	S	S	.	.	S	Bend	trans	84.6	101.8	176.5	0	0	0	0	0	113.5	R1086	G1084-R1086 PolarHBondContact O-N 3.01Å
1085	G	25.5	Very low	30.4	Very low	49 Å²	49	71.4 Å²	71.4	51%	0.505	43%	0.428	S	S	.	.			trans	-56.1	113.3	159.3	0	0	0	0	0	108.4	E1087	G1085-E1087 PolarHBondContact O-N 3.45Å
1086	R	27.9	Very low	30.3	Very low	115 Å²	115	73.7 Å²	73.7	43%	0.434	43%	0.432	S	S	.	.			trans	-75	96.4	174.2	-72.3	-177.2	176.1	-169.5	-3.2	107.8	G1084 I1088	G1084-R1086 PolarHBondContact O-N 3.01Å; R1086-I1088 VanDerWaalsContact C-N 3.26Å; R1086-I1088 HydrophobicContact CB-CG1 4.06Å; R1086-I1088 PolarHBondContact O-N 3Å
1087	E	26.6	Very low	30.1	Very low	136 Å²	136	76.4 Å²	76.4	64%	0.636	44%	0.439	S	S	*	.			trans	-64.5	97.1	156.3	-76.5	176.6	177.5	0	0	107.6	R850 G1085 N1089	R850-E1087 PolarHBondContact NH1-O 3.1Å; R850-E1087 VanDerWaalsContact NH1-O 3.17Å; R850-E1087 PolarHBondContact NH2-O 3.39Å; G1085-E1087 PolarHBondContact O-N 3.45Å; E1087-N1089 PolarHBondContact O-N 3.15Å
1088	I	27	Very low	29.6	Very low	80 Å²	80	79.7 Å²	79.7	41%	0.41	46%	0.456	S	S	.	.			trans	-84.4	97.6	173.1	-62.7	172.9	0	0	0	105.2	A536 R1086 L1092	A536-I1088 HydrophobicContact CB-CD1 3.71Å; R1086-I1088 VanDerWaalsContact C-N 3.26Å; R1086-I1088 HydrophobicContact CB-CG1 4.06Å; R1086-I1088 PolarHBondContact O-N 3Å; I1088-L1092 HydrophobicContact CG2-CB 4.34Å; I1088-L1092 HydrophobicContact CG2-CD1 4.06Å
1089	N	25.6	Very low	29.2	Very low	52 Å²	52	86.5 Å²	86.5	28%	0.278	48%	0.482	S	S	.	.			trans	-51.5	128.7	168.4	-176.4	-60.5	0	0	0	108.6	E624 E1087 L1091 L1092	E624-N1089 PolarHBondContact OE1-ND2 3.34Å; E1087-N1089 PolarHBondContact O-N 3.15Å; N1089-L1091 PolarHBondContact O-N 2.85Å; N1089-L1091 WeakPolarHBondContact OD1-CB 3.47Å; N1089-L1091 WeakPolarHBondContact OD1-CD1 3.4Å; N1089-L1091 WeakPolarHBondContact OD1-CG 3.46Å; N1089-L1091 PolarHBondContact OD1-N 3.21Å; N1089-L1092 PolarHBondContact O-N 3.23Å
1090	P	23.4	Very low	28.5	Very low	36 Å²	36	89.7 Å²	89.7	23%	0.234	50%	0.495	C	S	.	.	G	3₁₀ helix	trans	-59.7	-12.3	-172.3	-28.4	36.8	0	0	0	115.9	I583 L1092	I583-P1090 HydrophobicContact CG2-CG 4.31Å; P1090-L1092 PolarHBondContact O-N 3.08Å
1091	L	26.8	Very low	27.8	Very low	66 Å²	66	97.9 Å²	97.9	35%	0.346	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	-68.6	6.5	177.4	-68.9	167.8	0	0	0	115	A627 Q696 N1089	A627-L1091 HydrophobicContact CB-CD1 4.15Å; A627-L1091 HydrophobicContact CB-CD2 4.25Å; A627-L1091 HydrophobicContact CB-CG 4.44Å; Q696-L1091 VanDerWaalsContact OE1-CD2 3.26Å; N1089-L1091 PolarHBondContact O-N 2.85Å; N1089-L1091 WeakPolarHBondContact OD1-CB 3.47Å; N1089-L1091 WeakPolarHBondContact OD1-CD1 3.4Å; N1089-L1091 WeakPolarHBondContact OD1-CG 3.46Å; N1089-L1091 PolarHBondContact OD1-N 3.21Å
1092	L	27.2	Very low	27.1	Very low	56 Å²	56	100 Å²	100	29%	0.293	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-103.2	2.6	-173	-67.1	171.8	0	0	0	115.6	I22 I1088 N1089 P1090	I22-L1092 HydrophobicContact CB-CD2 4.24Å; I22-L1092 HydrophobicContact CG1-CD2 3.64Å; I1088-L1092 HydrophobicContact CG2-CB 4.34Å; I1088-L1092 HydrophobicContact CG2-CD1 4.06Å; N1089-L1092 PolarHBondContact O-N 3.23Å; P1090-L1092 PolarHBondContact O-N 3.08Å
1093	E	26	Very low	26.9	Very low	79 Å²	79	105 Å²	105	37%	0.369	57%	0.574	S	S	.	*			trans	-104	110.8	175	-88.1	166.6	-156.3	0	0	112.6	K527 Y591 K631	K527-E1093 WeakPolarHBondContact CE-OE1 3.23Å; K527-E1093 IonicContact NZ-OE1 2.78Å; K527-E1093 PolarHBondContact NZ-OE1 3.1Å; K527-E1093 IonicContact NZ-OE2 3.79Å; K527-E1093 PolarHBondContact NZ-OE2 3.32Å; Y591-E1093 PolarHBondContact OH-OE2 3.12Å; K631-E1093 PolarHBondContact NZ-O 2.88Å
1094	V	27.5	Very low	26.7	Very low	70 Å²	70	109.8 Å²	109.8	42%	0.424	58%	0.584	S	S	.	*			trans	-133.1	124.7	162.7	178.2	0	0	0	0	108.1	K18 I22	K18-V1094 HydrophobicContact CD-CG2 3.75Å; I22-V1094 HydrophobicContact CD1-CG2 4.25Å
1095	D	27.4	Very low	26.7	Very low	130 Å²	130	113.8 Å²	113.8	70%	0.695	61%	0.608	S	S	*	*			trans	-56.7	129.9	-177.7	-73.8	-68.6	0	0	0	114.6	M1097	D1095-M1097 VanDerWaalsContact C-N 3.3Å; D1095-M1097 HydrophobicContact CB-CG 4.43Å; D1095-M1097 PolarHBondContact O-N 3.31Å
1096	E	27.5	Very low	26.9	Very low	147 Å²	147	122.9 Å²	122.9	69%	0.687	64%	0.643	S	S	*	*			trans	-88.9	66.9	152.4	-72.3	-172.6	142.5	0	0	109.7	K542	K542-E1096 IonicContact NZ-OE2 3.98Å; K542-E1096 PolarHBondContact NZ-OE2 3.43Å; K542-E1096 VanDerWaalsContact NZ-OE2 3.14Å
1097	M	25.3	Very low	26.8	Very low	124 Å²	124	123.3 Å²	123.3	61%	0.611	65%	0.654	S	S	*	*			trans	-87.6	145.8	152.8	-69.6	-170.6	72.5	0	0	108.9	D1095	D1095-M1097 VanDerWaalsContact C-N 3.3Å; D1095-M1097 HydrophobicContact CB-CG 4.43Å; D1095-M1097 PolarHBondContact O-N 3.31Å
1098	L	26	Very low	26.8	Very low	159 Å²	159	122.6 Å²	122.6	83%	0.832	66%	0.655	S	S	*	*			trans	87.3	70	179.6	-49.2	174.5	0	0	0	117.5
1099	E	26.1	Very low	26.8	Very low	197 Å²	197	124.9 Å²	124.9	92%	0.921	67%	0.668	S	S	*	*			trans	-137.9	82.6	142.2	-78.4	-163.9	167.2	0	0	109.1
1100	D	25.8	Very low	26.9	Very low	168 Å²	168	129.2 Å²	129.2	90%	0.898	69%	0.691	S	S	*	*			trans	-152.8	39.9	170.4	-141.2	9	0	0	0	113.2
1101	E	29.5	Very low	27.1	Very low	201 Å²	201	135.1 Å²	135.1	94%	0.939	72%	0.72	S	S	*	*			trans	-140.1	130.9	156.7	-66.9	-168.1	173.7	0	0	106.1
1102	G	27.6	Very low	27.1	Very low	76 Å²	76	139.7 Å²	139.7	78%	0.784	75%	0.745	S	S	*	*			cis	158.3	69.5	8	0	0	0	0	0	109	Q1104	G1102-Q1104 PolarHBondContact O-N 2.95Å
1103	D	28	Very low	27.1	Very low	161 Å²	161	145.6 Å²	145.6	86%	0.861	78%	0.777	S	S	*	*			trans	-95.9	80	-173.6	-152.2	1.8	0	0	0	112
1104	Q	25.8	Very low	27.2	Very low	177 Å²	177	150.8 Å²	150.8	83%	0.827	81%	0.808	S	S	*	*			trans	-113.8	125	159.3	-72.2	-172	8.7	0	0	108.9	G1102	G1102-Q1104 PolarHBondContact O-N 2.95Å
1105	S	27.5	Very low	27.2	Very low	111 Å²	111	157.5 Å²	157.5	78%	0.776	84%	0.84	S	S	*	*			trans	78.1	90.2	172.5	68.7	0	0	0	0	118.8
1106	L	29.5	Very low	27.1	Very low	239 Å²	239	160 Å²	160	100%	1.251	85%	0.853	S	S	*	*				-160.6	0	98.9	-107.2	162.1	0	0	0	113.6

Retrieved 1,106 of 1,106 residues in 1583.4 ms (Link to these results)

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