G4VBW4_SCHMA Loading...

Putative alpha-actinin

AlphaFold DB , UniProt , Accession G4VBW4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 906 aa.

						>G4VBW4_SCHMA|G4VBW4
MAIYDYEGPVDDDDDVESNKDVPIDPAWELQQKKTFTAWCNSHLRNVNKQINVIENDFRDGVMLIKLLEVISGESLPSPERGMMRFHKIANVNKALDFIQSKGVKLVSIGAEEIVDGNPKMTLGMIWTIILRFAIQDIQIEDSSAKEGLLLWCQRQTAPYKNVCVENFHTSFKDGLAFCAIIHRNRPHLIDYSQLKKGDHVKNLNLAFEIAEKHLDIPKMLDPEDMASRKNCDEQSVMAYLSSYYHVFSGSHKTDIAATRIANNLRMIRENQNLEECYETNSTTLLSWINMKLREFGQRDPQTSVSAVEGLQQKFRLYYRQEKPSKLQEKARLETTYNTLQTRLRLNNKSPYVPANGHLITDVAKNWSSLEQADKIYEEWLLEELQRLERLEYLAKKFEVKCSTHEAWTNGKPEALASNDFRSAMLSEMRAFQKKHEAFQSDMTAHHARIEHIQALTEELNKLNHFNINAFNQRCDTIITTWDEMRKLSSQREREISKALTALEEIDQLHLDFAKRAAPFNNWMEQTEEDLRDTFIVHTMPEVERLITAHQAFENTLDEAENESRQLQLCAQKVEEIASEYKLVNATQNPYTNIKPHELPQRWNMIRELTKKRSTLLNRERERQLANEKLRREFAQKAEAFNSSIETHRAEIVKVSMESHSSLEDQRNHLQKLEEELNRHQDKLNELEHVNQALEDAYVFENPYTVYSMPTLRVAWEQLFTLLHYSVNEIDNQILTRDSRGLTAEQMNDLRTCFKHFDKNNTGRLEPNEFKACLVSLGYNFRDDIKNSLPNLSSGSRGSVCAETDFSRIVNEVDPGHTGYISFDAFLNFMTRDNVDEATEEQLIQSFKTLGGDKGYITAQDIKERLSAGDAEYCLQNMPVLNGPRGDSGALDYERFAYSICGRKPT
					

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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	39.1	Very low	37.9	Very low	242 Å²	242	152.7 Å²	152.7	100%	1.192	80%	0.799	S	S	*	*				0	74.1	0	-75.9	175.7	179.9	0	0	106.3
2	A	36.2	Very low	37.6	Very low	82 Å²	82	151.9 Å²	151.9	68%	0.678	80%	0.796	S	S	*	*			cis	75.6	77.1	34.9	0	0	0	0	0	114.1
3	I	42.6	Very low	37.2	Very low	168 Å²	168	151.6 Å²	151.6	86%	0.862	80%	0.796	S	S	*	*			trans	-139.1	77.5	157.9	-57	177.9	0	0	0	103.9
4	Y	43.2	Very low	37	Very low	211 Å²	211	151.4 Å²	151.4	83%	0.827	80%	0.796	S	S	*	*				59.8	100.1	103.8	-82.2	-75.9	0	0	0	113.6	Y6	Y4-Y6 PolarHBondContact O-N 3.07Å
5	D	41.7	Very low	36.7	Very low	165 Å²	165	152.6 Å²	152.6	88%	0.882	80%	0.803	S	S	*	*			trans	-49.6	125.4	157.2	-61	-51.7	0	0	0	109.7
6	Y	35.4	Very low	36.7	Very low	206 Å²	206	150.4 Å²	150.4	81%	0.808	80%	0.797	S	S	*	*			trans	-112	89.9	168.6	-170.9	-95.5	0	0	0	107.5	Y4 G8	Y4-Y6 PolarHBondContact O-N 3.07Å; Y6-G8 PolarHBondContact O-N 3.27Å
7	E	39.3	Very low	36.5	Very low	191 Å²	191	152.2 Å²	152.2	89%	0.893	80%	0.8	S	S	*	*			trans	-66.6	105	156.1	-73.1	179.7	161.3	0	0	106.9
8	G	34.7	Very low	36.4	Very low	45 Å²	45	147.8 Å²	147.8	46%	0.464	78%	0.784	S	S	.	*			trans	-72.2	150.6	168.8	0	0	0	0	0	110.5	Y6	Y6-G8 PolarHBondContact O-N 3.27Å
9	P	35.3	Very low	36.2	Very low	99 Å²	99	147.5 Å²	147.5	64%	0.643	78%	0.783	S	S	*	*			trans	-71.1	143	-161.2	-2.4	18.6	0	0	0	111.9	D11	P9-D11 PolarHBondContact O-N 2.84Å
10	V	34.6	Very low	36.2	Very low	125 Å²	125	148.6 Å²	148.6	76%	0.758	78%	0.78	S	S	*	*			trans	-65.1	108	152.7	178.8	0	0	0	0	106.1	D12	V10-D12 PolarHBondContact O-N 3.33Å
11	D	34.9	Very low	36.4	Very low	146 Å²	146	148.8 Å²	148.8	78%	0.781	78%	0.782	S	S	*	*			trans	-72.3	83.8	168.4	-77.5	-30.8	0	0	0	108.4	P9 D13	P9-D11 PolarHBondContact O-N 2.84Å; D11-D13 PolarHBondContact O-N 3.37Å
12	D	34.2	Very low	36.6	Very low	143 Å²	143	142 Å²	142	77%	0.765	75%	0.754	S	S	*	*			trans	-78	87.9	149.4	-86.2	-33.7	0	0	0	106.7	V10	V10-D12 PolarHBondContact O-N 3.33Å
13	D	32.6	Very low	37.1	Very low	148 Å²	148	143.6 Å²	143.6	79%	0.791	76%	0.757	S	S	*	*			trans	-174.2	95.8	160.2	-93.4	-29.1	0	0	0	109.3	D11	D11-D13 PolarHBondContact O-N 3.37Å
14	D	33.9	Very low	37.7	Very low	149 Å²	149	137.6 Å²	137.6	80%	0.797	73%	0.727	S	S	*	*			trans	-166.7	64.8	143.2	-98.7	-19.4	0	0	0	108.4	V16	D14-V16 HydrophobicContact CB-CG2 4.1Å; D14-V16 PolarHBondContact O-N 3.5Å
15	D	32.3	Very low	38.6	Very low	169 Å²	169	132.4 Å²	132.4	90%	0.904	71%	0.713	S	S	*	*			trans	-60.7	80.4	146.5	-91.2	-34.8	0	0	0	107.2	E17	D15-E17 PolarHBondContact O-N 3.13Å
16	V	37	Very low	40	Very low	117 Å²	117	129.3 Å²	129.3	71%	0.709	70%	0.702	S	S	*	*			trans	-72.4	83.3	167.2	-176.5	0	0	0	0	106.7	D14 S18	D14-V16 HydrophobicContact CB-CG2 4.1Å; D14-V16 PolarHBondContact O-N 3.5Å; V16-S18 PolarHBondContact O-N 3.17Å; V16-S18 VanDerWaalsContact O-N 3.08Å
17	E	33.7	Very low	41.7	Very low	181 Å²	181	121 Å²	121	85%	0.846	68%	0.676	S	S	*	*			trans	-43.9	115.6	163.6	-133.5	176.9	-171.1	0	0	107.8	D15 N19	D15-E17 PolarHBondContact O-N 3.13Å; E17-N19 PolarHBondContact O-N 3.17Å
18	S	33.7	Very low	43.5	Very low	74 Å²	74	117 Å²	117	52%	0.517	65%	0.653	S	S	.	*			trans	-59.6	100.5	-174.1	69	0	0	0	0	109.4	V16 K20	V16-S18 PolarHBondContact O-N 3.17Å; V16-S18 VanDerWaalsContact O-N 3.08Å; S18-K20 PolarHBondContact O-N 3.5Å; S18-K20 WeakPolarHBondContact OG-CD 3.48Å; S18-K20 WeakPolarHBondContact OG-CE 2.94Å
19	N	32.7	Very low	45.7	Very low	142 Å²	142	117 Å²	117	76%	0.759	64%	0.641	S	S	*	*			trans	-74	79.2	176.4	-143.4	-10.5	0	0	0	108	E17 D21	E17-N19 PolarHBondContact O-N 3.17Å; N19-D21 VanDerWaalsContact C-N 3.3Å; N19-D21 PolarHBondContact O-N 3.42Å
20	K	37.4	Very low	48.1	Very low	169 Å²	169	116.7 Å²	116.7	74%	0.735	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-0.5	-166	-87.5	178.2	179.1	171.2	0	115.3	S18	S18-K20 PolarHBondContact O-N 3.5Å; S18-K20 WeakPolarHBondContact OG-CD 3.48Å; S18-K20 WeakPolarHBondContact OG-CE 2.94Å
21	D	40.1	Very low	50.5	Low	153 Å²	153	111.1 Å²	111.1	82%	0.818	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.1	23.2	-171.2	-71.2	-41.9	0	0	0	115.9	N19 P23	N19-D21 VanDerWaalsContact C-N 3.3Å; N19-D21 PolarHBondContact O-N 3.42Å; D21-P23 WeakPolarHBondContact O-CD 3.04Å
22	V	43.2	Very low	53	Low	98 Å²	98	105.1 Å²	105.1	59%	0.594	57%	0.566	S	S	*	*			trans	-81.6	119.3	171.8	-173.4	0	0	0	0	110.2	I24	V22-I24 PolarHBondContact O-N 3.07Å
23	P	47.4	Very low	55.7	Low	116 Å²	116	100.1 Å²	100.1	75%	0.753	54%	0.538	S	S	*	.			trans	-61.4	124	174.3	-17.8	30.7	0	0	0	110.1	D21 D25	D21-P23 WeakPolarHBondContact O-CD 3.04Å; P23-D25 PolarHBondContact O-N 3.49Å
24	I	53.8	Low	58.4	Low	42 Å²	42	97 Å²	97	22%	0.215	52%	0.517	C	S	.	.			trans	-53.8	113.9	170.1	-66.4	-133.7	0	0	0	108.1	V22 P26 W28 E29 K120	V22-I24 PolarHBondContact O-N 3.07Å; I24-P26 WeakPolarHBondContact O-CD 2.82Å; I24-W28 HydrophobicContact CB-CZ2 3.68Å; I24-W28 VanDerWaalsContact CB-NE1 3.33Å; I24-W28 HydrophobicContact CD1-CH2 4.39Å; I24-W28 HydrophobicContact CD1-CZ2 3.58Å; I24-W28 HydrophobicContact CG1-CZ2 3.57Å; I24-W28 HydrophobicContact CG2-CZ2 3.91Å; I24-E29 HydrophobicContact CG2-CB 3.97Å; I24-E29 HydrophobicContact CG2-CG 4.46Å; I24-E29 WeakPolarHBondContact CG2-OE2 3.23Å; I24-K120 HydrophobicContact CD1-CB 4.41Å; I24-K120 HydrophobicContact CD1-CD 3.54Å; I24-K120 HydrophobicContact CD1-CG 3.76Å; I24-K120 HydrophobicContact CG1-CD 4.38Å
25	D	61.9	Low	61.1	Low	103 Å²	103	89.9 Å²	89.9	55%	0.551	48%	0.479	S	S	*	.			trans	-55	106.3	176	174.5	-0.5	0	0	0	109.6	P23 A27 W28	P23-D25 PolarHBondContact O-N 3.49Å; D25-A27 CarbonylContact O-C 3.57Å; D25-A27 PolarHBondContact O-N 2.73Å; D25-A27 WeakPolarHBondContact OD1-CB 3.39Å; D25-A27 PolarHBondContact OD1-N 2.76Å; D25-W28 PolarHBondContact O-N 3.36Å; D25-W28 PolarHBondContact O-NE1 3.13Å
26	P	71.4	Confident	64.1	Low	100 Å²	100	81.8 Å²	81.8	65%	0.649	44%	0.436	S	S	*	.	H	α-helix	trans	-48.3	-25.9	-168.5	-28.2	34.3	0	0	0	115.3	I24 L30	I24-P26 WeakPolarHBondContact O-CD 2.82Å; P26-L30 PolarHBondContact O-N 3.09Å
27	A	71.7	Confident	66.8	Low	31 Å²	31	77.1 Å²	77.1	26%	0.256	41%	0.408	S	S	.	.	H	α-helix	trans	-60.9	-45.7	173.9	0	0	0	0	0	114	D25 E29 L30 Q31 R229	D25-A27 CarbonylContact O-C 3.57Å; D25-A27 PolarHBondContact O-N 2.73Å; D25-A27 WeakPolarHBondContact OD1-CB 3.39Å; D25-A27 PolarHBondContact OD1-N 2.76Å; A27-E29 VanDerWaalsContact C-N 3.32Å; A27-E29 PolarHBondContact O-N 3Å; A27-L30 PolarHBondContact O-N 2.96Å; A27-Q31 PolarHBondContact O-N 3Å; A27-R229 PolarHBondContact O-NH1 3.29Å; A27-R229 PolarHBondContact O-NH2 3.31Å
28	W	76.5	Confident	69.6	Low	108 Å²	108	69.5 Å²	69.5	41%	0.409	38%	0.376	S	S	.	.	H	α-helix	trans	-67.1	-33.2	-177.5	68.6	-11.9	0	0	0	112.6	I24 D25 Q31 Q32	I24-W28 HydrophobicContact CB-CZ2 3.68Å; I24-W28 VanDerWaalsContact CB-NE1 3.33Å; I24-W28 HydrophobicContact CD1-CH2 4.39Å; I24-W28 HydrophobicContact CD1-CZ2 3.58Å; I24-W28 HydrophobicContact CG1-CZ2 3.57Å; I24-W28 HydrophobicContact CG2-CZ2 3.91Å; D25-W28 PolarHBondContact O-N 3.36Å; D25-W28 PolarHBondContact O-NE1 3.13Å; W28-Q31 PolarHBondContact O-N 3.41Å; W28-Q32 WeakPolarHBondContact O-CG 2.95Å; W28-Q32 PolarHBondContact O-N 3.1Å
29	E	82.2	Confident	72.5	Confident	44 Å²	44	66.1 Å²	66.1	21%	0.206	35%	0.352	C	S	.	.	H	α-helix	trans	-71.6	-41.8	-176.1	-173.7	-170.3	142.4	0	0	108.1	I24 A27 Q31 Q32 K33 P119 L123	I24-E29 HydrophobicContact CG2-CB 3.97Å; I24-E29 HydrophobicContact CG2-CG 4.46Å; I24-E29 WeakPolarHBondContact CG2-OE2 3.23Å; A27-E29 VanDerWaalsContact C-N 3.32Å; A27-E29 PolarHBondContact O-N 3Å; E29-Q31 VanDerWaalsContact C-N 3.31Å; E29-Q31 PolarHBondContact O-N 3.3Å; E29-Q32 PolarHBondContact O-N 3.41Å; E29-K33 HydrophobicContact CG-CD 4.48Å; E29-K33 WeakPolarHBondContact O-CB 3.28Å; E29-K33 VanDerWaalsContact O-CG 3.27Å; E29-K33 WeakPolarHBondContact O-CG 3.4Å; E29-K33 PolarHBondContact O-N 3.45Å; E29-K33 WeakPolarHBondContact OE1-CE 3.49Å; E29-K33 IonicContact OE1-NZ 2.76Å; E29-K33 PolarHBondContact OE1-NZ 3Å; E29-P119 WeakPolarHBondContact OE1-CB 3.45Å; E29-L123 HydrophobicContact CG-CD1 3.8Å
30	L	84.2	Confident	75.4	Confident	93 Å²	93	59.4 Å²	59.4	49%	0.487	32%	0.315	S	S	.	.	H	α-helix	trans	-61.7	-39.6	175.1	-171.6	65.3	0	0	0	112.1	P26 A27 K34	P26-L30 PolarHBondContact O-N 3.09Å; A27-L30 PolarHBondContact O-N 2.96Å; L30-K34 WeakPolarHBondContact O-CG 3.38Å; L30-K34 PolarHBondContact O-N 3.44Å; L30-K34 VanDerWaalsContact O-N 3.16Å
31	Q	84.8	Confident	78.1	Confident	7 Å²	7	53.1 Å²	53.1	3%	0.033	29%	0.29	C	S	.	.	H	α-helix	trans	-68.2	-49.4	178.1	-176.1	59.6	56.7	0	0	111.3	A27 W28 E29 K33 K34 T35 D233	A27-Q31 PolarHBondContact O-N 3Å; W28-Q31 PolarHBondContact O-N 3.41Å; E29-Q31 VanDerWaalsContact C-N 3.31Å; E29-Q31 PolarHBondContact O-N 3.3Å; Q31-K33 VanDerWaalsContact C-N 3.3Å; Q31-K33 PolarHBondContact O-N 3.45Å; Q31-K34 PolarHBondContact O-N 3.44Å; Q31-K34 VanDerWaalsContact O-N 3.15Å; Q31-T35 PolarHBondContact NE2-OG1 2.77Å; Q31-T35 PolarHBondContact O-N 3.23Å; Q31-T35 PolarHBondContact O-OG1 2.93Å; Q31-T35 VanDerWaalsContact O-OG1 3.12Å; Q31-D233 HydrophobicContact CG-CB 4.44Å
32	Q	88.8	Confident	80.6	Confident	20 Å²	20	46.6 Å²	46.6	9%	0.093	26%	0.256	C	S	.	.	H	α-helix	trans	-58.9	-41.3	177.2	-74.5	-174	-5.5	0	0	111.8	W28 E29 K34 T35 F36 L123 D233	W28-Q32 WeakPolarHBondContact O-CG 2.95Å; W28-Q32 PolarHBondContact O-N 3.1Å; E29-Q32 PolarHBondContact O-N 3.41Å; Q32-K34 PolarHBondContact O-N 3.12Å; Q32-T35 PolarHBondContact O-N 3.48Å; Q32-F36 HydrophobicContact CB-CD2 4.5Å; Q32-F36 HydrophobicContact CB-CE2 4.3Å; Q32-F36 HydrophobicContact CG-CZ 4.37Å; Q32-F36 VanDerWaalsContact O-CB 3.24Å; Q32-F36 WeakPolarHBondContact O-CB 3.21Å; Q32-F36 VanDerWaalsContact O-CG 3.31Å; Q32-F36 WeakPolarHBondContact O-CG 3.4Å; Q32-F36 PolarHBondContact O-N 2.89Å; Q32-L123 HydrophobicContact CB-CD1 4.18Å; Q32-L123 HydrophobicContact CB-CD2 4.25Å; Q32-D233 WeakPolarHBondContact CG-OD2 3.35Å; Q32-D233 PolarHBondContact NE2-OD1 3.26Å; Q32-D233 PolarHBondContact NE2-OD2 3.29Å
33	K	90.8	Very high	82.9	Confident	38 Å²	38	44.3 Å²	44.3	17%	0.165	24%	0.239	C	C	.	.	H	α-helix	trans	-56.7	-50.1	173.8	-77.9	179.9	-177.8	178.8	0	111.7	E29 Q31 T37 I54 E55 L123	E29-K33 HydrophobicContact CG-CD 4.48Å; E29-K33 WeakPolarHBondContact O-CB 3.28Å; E29-K33 VanDerWaalsContact O-CG 3.27Å; E29-K33 WeakPolarHBondContact O-CG 3.4Å; E29-K33 PolarHBondContact O-N 3.45Å; E29-K33 WeakPolarHBondContact OE1-CE 3.49Å; E29-K33 IonicContact OE1-NZ 2.76Å; E29-K33 PolarHBondContact OE1-NZ 3Å; Q31-K33 VanDerWaalsContact C-N 3.3Å; Q31-K33 PolarHBondContact O-N 3.45Å; K33-T37 WeakPolarHBondContact O-CB 3.21Å; K33-T37 PolarHBondContact O-N 2.83Å; K33-T37 PolarHBondContact O-OG1 3.49Å; K33-I54 HydrophobicContact CB-CG2 4.44Å; K33-I54 HydrophobicContact CG-CG2 3.99Å; K33-E55 WeakPolarHBondContact CE-OE1 3.43Å; K33-E55 IonicContact NZ-OE1 3.67Å; K33-E55 PolarHBondContact NZ-OE1 3.39Å; K33-E55 IonicContact NZ-OE2 3.26Å; K33-L123 HydrophobicContact CG-CD1 4.1Å; K33-L123 HydrophobicContact CG-CD2 3.98Å; K33-L123 HydrophobicContact CG-CG 4.48Å
34	K	89	Confident	85	Confident	82 Å²	82	38.8 Å²	38.8	36%	0.357	20%	0.203	S	C	.	.	H	α-helix	trans	-58.9	-51.2	178	-73.3	179.1	180	178.1	0	111	L30 Q31 Q32 A38 D222 D225	L30-K34 WeakPolarHBondContact O-CG 3.38Å; L30-K34 PolarHBondContact O-N 3.44Å; L30-K34 VanDerWaalsContact O-N 3.16Å; Q31-K34 PolarHBondContact O-N 3.44Å; Q31-K34 VanDerWaalsContact O-N 3.15Å; Q32-K34 PolarHBondContact O-N 3.12Å; K34-A38 WeakPolarHBondContact O-CB 3.49Å; K34-A38 PolarHBondContact O-N 3.04Å; K34-D222 IonicContact NZ-OD2 2.71Å; K34-D222 PolarHBondContact NZ-OD2 3.17Å; K34-D225 IonicContact NZ-OD2 2.78Å; K34-D225 PolarHBondContact NZ-OD2 3.5Å
35	T	91	Very high	86.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.9	-48.3	-174.2	-56	0	0	0	0	112.4	Q31 Q32 T37 A38 W39 M220 L221 S236 A239	Q31-T35 PolarHBondContact NE2-OG1 2.77Å; Q31-T35 PolarHBondContact O-N 3.23Å; Q31-T35 PolarHBondContact O-OG1 2.93Å; Q31-T35 VanDerWaalsContact O-OG1 3.12Å; Q32-T35 PolarHBondContact O-N 3.48Å; T35-T37 PolarHBondContact O-N 3.12Å; T35-A38 PolarHBondContact O-N 3.12Å; T35-W39 PolarHBondContact O-N 3.18Å; T35-M220 VanDerWaalsContact CA-O 3.22Å; T35-M220 WeakPolarHBondContact CA-O 3.41Å; T35-M220 WeakPolarHBondContact CB-O 3.44Å; T35-M220 HydrophobicContact CG2-CB 3.91Å; T35-M220 HydrophobicContact CG2-CE 3.59Å; T35-M220 PolarHBondContact OG1-O 2.63Å; T35-L221 HydrophobicContact CG2-CD2 4.17Å; T35-L221 WeakPolarHBondContact OG1-CD2 3.43Å; T35-S236 WeakPolarHBondContact CG2-O 3.29Å; T35-A239 HydrophobicContact CG2-CB 4.47Å
36	F	94.4	Very high	87.8	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-69.2	-34.5	-179.5	-66.3	-2.9	0	0	0	111.8	Q32 W39 C40 I54 L123 I126 W127 I130 Q235 A239	Q32-F36 HydrophobicContact CB-CD2 4.5Å; Q32-F36 HydrophobicContact CB-CE2 4.3Å; Q32-F36 HydrophobicContact CG-CZ 4.37Å; Q32-F36 VanDerWaalsContact O-CB 3.24Å; Q32-F36 WeakPolarHBondContact O-CB 3.21Å; Q32-F36 VanDerWaalsContact O-CG 3.31Å; Q32-F36 WeakPolarHBondContact O-CG 3.4Å; Q32-F36 PolarHBondContact O-N 2.89Å; F36-W39 PolarHBondContact O-N 3.42Å; F36-C40 WeakPolarHBondContact O-CB 3.34Å; F36-C40 PolarHBondContact O-N 3Å; F36-C40 PolarHBondContact O-SG 3.16Å; F36-I54 HydrophobicContact CB-CD1 3.67Å; F36-L123 HydrophobicContact CD2-CB 4.4Å; F36-L123 HydrophobicContact CD2-CD2 3.69Å; F36-L123 HydrophobicContact CE2-CB 4.37Å; F36-L123 HydrophobicContact CE2-CD2 4.35Å; F36-L123 WeakPolarHBondContact CE2-O 2.67Å; F36-I126 HydrophobicContact CB-CG2 3.86Å; F36-I126 HydrophobicContact CD2-CB 4.18Å; F36-I126 HydrophobicContact CD2-CG2 4.02Å; F36-I126 HydrophobicContact CG-CG2 4.03Å; F36-W127 HydrophobicContact CE1-CE3 4.17Å; F36-W127 HydrophobicContact CE2-CB 3.91Å; F36-W127 HydrophobicContact CZ-CB 3.98Å; F36-W127 HydrophobicContact CZ-CD2 4.44Å; F36-W127 AromaticContact CZ-CE3 3.83Å; F36-W127 HydrophobicContact CZ-CE3 3.83Å; F36-I130 HydrophobicContact CD1-CD1 3.6Å; F36-I130 HydrophobicContact CE1-CD1 3.83Å; F36-I130 HydrophobicContact CG-CD1 4.11Å; F36-I130 HydrophobicContact CZ-CD1 4.49Å; F36-Q235 HydrophobicContact CZ-CB 4.16Å; F36-A239 HydrophobicContact CE1-CB 4.49Å
37	T	93.9	Very high	88.7	Confident	19 Å²	19	39.5 Å²	39.5	12%	0.117	20%	0.196	C	C	.	.	H	α-helix	trans	-62.2	-46.8	172.9	-58.2	0	0	0	0	110.9	K33 T35 W39 C40 N41 I51	K33-T37 WeakPolarHBondContact O-CB 3.21Å; K33-T37 PolarHBondContact O-N 2.83Å; K33-T37 PolarHBondContact O-OG1 3.49Å; T35-T37 PolarHBondContact O-N 3.12Å; T37-W39 PolarHBondContact O-N 3.01Å; T37-C40 PolarHBondContact O-N 2.84Å; T37-N41 WeakPolarHBondContact O-CB 3.05Å; T37-N41 PolarHBondContact O-N 3.21Å; T37-N41 PolarHBondContact O-ND2 3.37Å; T37-I51 HydrophobicContact CG2-CD1 4.17Å; T37-I51 HydrophobicContact CG2-CG1 4.05Å
38	A	92.8	Very high	89.6	Confident	21 Å²	21	45.6 Å²	45.6	17%	0.174	22%	0.224	C	C	.	.	H	α-helix	trans	-63.2	-40	177.9	0	0	0	0	0	112.3	K34 T35 N41 S42 M220	K34-A38 WeakPolarHBondContact O-CB 3.49Å; K34-A38 PolarHBondContact O-N 3.04Å; T35-A38 PolarHBondContact O-N 3.12Å; A38-N41 PolarHBondContact O-N 3.4Å; A38-S42 PolarHBondContact O-N 3.22Å; A38-M220 HydrophobicContact CB-CB 4.13Å; A38-M220 HydrophobicContact CB-CG 3.77Å
39	W	94.2	Very high	90.4	Very high	3 Å²	3	44.3 Å²	44.3	1%	0.011	22%	0.221	C	C	.	.	H	α-helix	trans	-62.2	-48.8	173.7	-171.3	81.3	0	0	0	112.3	T35 F36 T37 N41 S42 H43 L67 I71 I129 I130 A134 M220	T35-W39 PolarHBondContact O-N 3.18Å; F36-W39 PolarHBondContact O-N 3.42Å; T37-W39 PolarHBondContact O-N 3.01Å; W39-N41 VanDerWaalsContact C-N 3.28Å; W39-N41 PolarHBondContact O-N 3.43Å; W39-S42 PolarHBondContact O-N 3.43Å; W39-S42 VanDerWaalsContact O-N 3.13Å; W39-S42 PolarHBondContact O-OG 3.29Å; W39-H43 AromaticContact CD2-CD2 3.96Å; W39-H43 AromaticContact CE2-CD2 3.73Å; W39-H43 AromaticContact CE2-NE2 3.43Å; W39-H43 AromaticContact CZ2-CD2 3.87Å; W39-H43 AromaticContact CZ2-NE2 3.49Å; W39-H43 WeakPolarHBondContact CZ2-NE2 3.45Å; W39-H43 AromaticContact NE1-NE2 3.61Å; W39-H43 PolarHBondContact O-CD2 2.78Å; W39-H43 VanDerWaalsContact O-CD2 3.31Å; W39-H43 PolarHBondContact O-N 3.06Å; W39-L67 HydrophobicContact CZ3-CD2 4.48Å; W39-I71 HydrophobicContact CH2-CD1 3.39Å; W39-I71 HydrophobicContact CZ2-CD1 4.23Å; W39-I71 HydrophobicContact CZ3-CD1 3.75Å; W39-I129 HydrophobicContact CH2-CG2 4.09Å; W39-I129 HydrophobicContact CZ3-CG2 4.32Å; W39-I130 HydrophobicContact CD2-CD1 3.91Å; W39-I130 HydrophobicContact CD2-CG1 3.61Å; W39-I130 HydrophobicContact CE3-CD1 3.92Å; W39-I130 HydrophobicContact CE3-CG1 3.56Å; W39-I130 HydrophobicContact CG-CD1 4.19Å; W39-I130 HydrophobicContact CG-CG1 4.33Å; W39-I130 HydrophobicContact CH2-CB 4.43Å; W39-I130 HydrophobicContact CH2-CG1 3.62Å; W39-I130 HydrophobicContact CZ2-CB 4.38Å; W39-I130 HydrophobicContact CZ2-CG1 3.73Å; W39-I130 HydrophobicContact CZ3-CD1 4.37Å; W39-I130 HydrophobicContact CZ3-CG1 3.56Å; W39-A134 HydrophobicContact CZ2-CB 4.14Å; W39-M220 HydrophobicContact CB-CE 3.52Å; W39-M220 HydrophobicContact CB-SD 4.22Å; W39-M220 HydrophobicContact CG-CE 4.03Å
40	C	94.6	Very high	90.9	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.1	-42.7	177.1	-69.4	0	0	0	0	111.2	F36 T37 S42 H43 L44 I51 F58 L67	F36-C40 WeakPolarHBondContact O-CB 3.34Å; F36-C40 PolarHBondContact O-N 3Å; F36-C40 PolarHBondContact O-SG 3.16Å; T37-C40 PolarHBondContact O-N 2.84Å; C40-S42 VanDerWaalsContact C-N 3.32Å; C40-S42 PolarHBondContact O-N 2.9Å; C40-H43 PolarHBondContact O-N 2.99Å; C40-L44 HydrophobicContact CB-CD1 4.37Å; C40-L44 WeakPolarHBondContact O-CB 3.33Å; C40-L44 VanDerWaalsContact O-CG 3.27Å; C40-L44 WeakPolarHBondContact O-CG 3.39Å; C40-L44 PolarHBondContact O-N 3.08Å; C40-I51 HydrophobicContact CB-CD1 3.72Å; C40-I51 HydrophobicContact CB-CG1 4.26Å; C40-F58 HydrophobicContact CB-CZ 4.22Å; C40-L67 HydrophobicContact CB-CD1 4.32Å; C40-L67 HydrophobicContact CB-CD2 4.31Å
41	N	94.3	Very high	91.4	Very high	38 Å²	38	44.6 Å²	44.6	20%	0.203	22%	0.22	C	C	.	.	H	α-helix	trans	-66.5	-30.4	178	-74.9	-22	0	0	0	113.3	T37 A38 W39 H43 L44 R45 Q50 I51	T37-N41 WeakPolarHBondContact O-CB 3.05Å; T37-N41 PolarHBondContact O-N 3.21Å; T37-N41 PolarHBondContact O-ND2 3.37Å; A38-N41 PolarHBondContact O-N 3.4Å; W39-N41 VanDerWaalsContact C-N 3.28Å; W39-N41 PolarHBondContact O-N 3.43Å; N41-H43 PolarHBondContact O-N 3.1Å; N41-L44 PolarHBondContact O-N 3.15Å; N41-R45 WeakPolarHBondContact O-CB 3.23Å; N41-R45 PolarHBondContact O-N 2.8Å; N41-Q50 VanDerWaalsContact OD1-CA 3.31Å; N41-Q50 WeakPolarHBondContact OD1-CA 3.3Å; N41-I51 PolarHBondContact ND2-O 3.31Å; N41-I51 VanDerWaalsContact OD1-CG1 3.29Å; N41-I51 WeakPolarHBondContact OD1-CG1 3.09Å; N41-I51 PolarHBondContact OD1-N 3.49Å; N41-I51 PolarHBondContact OD1-O 3.24Å
42	S	91	Very high	91.8	Very high	16 Å²	16	50.1 Å²	50.1	11%	0.112	25%	0.25	C	S	.	.	H	α-helix	trans	-64.5	-28.3	176.1	82.1	0	0	0	0	112.8	A38 W39 C40 R45	A38-S42 PolarHBondContact O-N 3.22Å; W39-S42 PolarHBondContact O-N 3.43Å; W39-S42 VanDerWaalsContact O-N 3.13Å; W39-S42 PolarHBondContact O-OG 3.29Å; C40-S42 VanDerWaalsContact C-N 3.32Å; C40-S42 PolarHBondContact O-N 2.9Å; S42-R45 WeakPolarHBondContact O-CG 3.38Å; S42-R45 PolarHBondContact O-NE 3.14Å
43	H	91.6	Very high	91.9	Very high	50 Å²	50	52.1 Å²	52.1	23%	0.231	26%	0.263	C	S	.	.	H	α-helix	trans	-88.3	-45.9	172.6	-67.5	-74.6	0	0	0	111.8	W39 C40 N41 R45 N46 L67 V70 I71	W39-H43 AromaticContact CD2-CD2 3.96Å; W39-H43 AromaticContact CE2-CD2 3.73Å; W39-H43 AromaticContact CE2-NE2 3.43Å; W39-H43 AromaticContact CZ2-CD2 3.87Å; W39-H43 AromaticContact CZ2-NE2 3.49Å; W39-H43 WeakPolarHBondContact CZ2-NE2 3.45Å; W39-H43 AromaticContact NE1-NE2 3.61Å; W39-H43 PolarHBondContact O-CD2 2.78Å; W39-H43 VanDerWaalsContact O-CD2 3.31Å; W39-H43 PolarHBondContact O-N 3.06Å; C40-H43 PolarHBondContact O-N 2.99Å; N41-H43 PolarHBondContact O-N 3.1Å; H43-R45 VanDerWaalsContact C-N 3.26Å; H43-R45 PolarHBondContact O-N 2.75Å; H43-N46 VanDerWaalsContact O-CB 3.31Å; H43-N46 WeakPolarHBondContact O-CB 2.95Å; H43-N46 PolarHBondContact O-N 3.35Å; H43-N46 VanDerWaalsContact O-N 3.08Å; H43-L67 HydrophobicContact CB-CD1 3.9Å; H43-V70 HydrophobicContact CB-CG1 4.21Å; H43-I71 HydrophobicContact CB-CG1 4.15Å
44	L	92.8	Very high	92	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.6	-24.8	-176.5	-70.6	166.7	0	0	0	113.8	C40 N41 N46 V47 N48 K49 I51 M63 K66 L67	C40-L44 HydrophobicContact CB-CD1 4.37Å; C40-L44 WeakPolarHBondContact O-CB 3.33Å; C40-L44 VanDerWaalsContact O-CG 3.27Å; C40-L44 WeakPolarHBondContact O-CG 3.39Å; C40-L44 PolarHBondContact O-N 3.08Å; N41-L44 PolarHBondContact O-N 3.15Å; L44-N46 PolarHBondContact O-N 3.27Å; L44-V47 HydrophobicContact CD2-CG2 4.37Å; L44-V47 CarbonylContact O-C 3.54Å; L44-V47 WeakPolarHBondContact O-CG2 3.13Å; L44-V47 PolarHBondContact O-N 3.44Å; L44-N48 PolarHBondContact O-N 3.34Å; L44-K49 CarbonylContact C-O 3.53Å; L44-K49 HydrophobicContact CB-CB 4.36Å; L44-K49 VanDerWaalsContact CB-O 3.25Å; L44-K49 WeakPolarHBondContact CB-O 3.39Å; L44-K49 HydrophobicContact CD2-CB 4.49Å; L44-K49 PolarHBondContact O-N 3.39Å; L44-I51 HydrophobicContact CD1-CG1 4.47Å; L44-I51 HydrophobicContact CD1-CG2 4.11Å; L44-M63 HydrophobicContact CD1-CE 3.59Å; L44-M63 HydrophobicContact CD2-CE 4.11Å; L44-M63 HydrophobicContact CG-CE 4.39Å; L44-K66 HydrophobicContact CD2-CB 4.49Å; L44-L67 HydrophobicContact CD2-CB 4.16Å; L44-L67 HydrophobicContact CD2-CD1 4.42Å; L44-L67 HydrophobicContact CG-CD1 4.04Å
45	R	90.2	Very high	91.9	Very high	103 Å²	103	48.1 Å²	48.1	39%	0.389	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-57.8	-29.7	172.6	71.2	-175.1	178.8	154.7	8.3	112.7	N41 S42 H43 V47 N48 K49 D216	N41-R45 WeakPolarHBondContact O-CB 3.23Å; N41-R45 PolarHBondContact O-N 2.8Å; S42-R45 WeakPolarHBondContact O-CG 3.38Å; S42-R45 PolarHBondContact O-NE 3.14Å; H43-R45 VanDerWaalsContact C-N 3.26Å; H43-R45 PolarHBondContact O-N 2.75Å; R45-V47 PolarHBondContact O-N 3.4Å; R45-V47 VanDerWaalsContact O-N 3.16Å; R45-N48 PolarHBondContact O-N 3.17Å; R45-K49 PolarHBondContact N-O 2.89Å; R45-D216 IonicContact CZ-OD1 2.89Å; R45-D216 IonicContact CZ-OD2 3.34Å; R45-D216 IonicContact NH1-OD1 2.89Å; R45-D216 PolarHBondContact NH1-OD1 3.19Å; R45-D216 IonicContact NH1-OD2 4Å; R45-D216 PolarHBondContact NH1-OD2 3.48Å; R45-D216 PolarHBondContact NH2-O 2.79Å; R45-D216 IonicContact NH2-OD1 2.88Å; R45-D216 PolarHBondContact NH2-OD1 3.39Å; R45-D216 IonicContact NH2-OD2 2.72Å; R45-D216 PolarHBondContact NH2-OD2 3.16Å
46	N	84.4	Confident	92	Very high	111 Å²	111	52 Å²	52	59%	0.594	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-65.5	-18.3	177.9	-63.8	-13.4	0	0	0	112.7	H43 L44 V70	H43-N46 VanDerWaalsContact O-CB 3.31Å; H43-N46 WeakPolarHBondContact O-CB 2.95Å; H43-N46 PolarHBondContact O-N 3.35Å; H43-N46 VanDerWaalsContact O-N 3.08Å; L44-N46 PolarHBondContact O-N 3.27Å; N46-V70 HydrophobicContact CB-CG1 4.4Å
47	V	89.6	Confident	92	Very high	46 Å²	46	54.5 Å²	54.5	28%	0.279	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-118.3	20.3	176.3	-66.5	0	0	0	0	112.1	L44 R45 K49 K66 V70	L44-V47 HydrophobicContact CD2-CG2 4.37Å; L44-V47 CarbonylContact O-C 3.54Å; L44-V47 WeakPolarHBondContact O-CG2 3.13Å; L44-V47 PolarHBondContact O-N 3.44Å; R45-V47 PolarHBondContact O-N 3.4Å; R45-V47 VanDerWaalsContact O-N 3.16Å; V47-K49 VanDerWaalsContact C-N 3.28Å; V47-K49 HydrophobicContact CG2-CB 4.48Å; V47-K49 HydrophobicContact CG2-CG 4.34Å; V47-K49 PolarHBondContact O-N 3.33Å; V47-K66 HydrophobicContact CG2-CG 4Å; V47-V70 HydrophobicContact CB-CG2 4.29Å; V47-V70 HydrophobicContact CG1-CG2 3.43Å; V47-V70 VanDerWaalsContact CG1-CG2 3.43Å; V47-V70 HydrophobicContact CG2-CG2 3.83Å
48	N	91	Very high	92.1	Very high	158 Å²	158	53.7 Å²	53.7	85%	0.845	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	38.3	179.8	-62.4	-45.5	0	0	0	113.9	L44 R45	L44-N48 PolarHBondContact O-N 3.34Å; R45-N48 PolarHBondContact O-N 3.17Å
49	K	91.9	Very high	92.1	Very high	82 Å²	82	56.5 Å²	56.5	36%	0.357	28%	0.282	S	S	.	.			trans	-123.2	160	173.5	-57.4	-162.5	177.3	-166.4	0	111.3	L44 R45 V47 M63 K66	L44-K49 CarbonylContact C-O 3.53Å; L44-K49 HydrophobicContact CB-CB 4.36Å; L44-K49 VanDerWaalsContact CB-O 3.25Å; L44-K49 WeakPolarHBondContact CB-O 3.39Å; L44-K49 HydrophobicContact CD2-CB 4.49Å; L44-K49 PolarHBondContact O-N 3.39Å; R45-K49 PolarHBondContact N-O 2.89Å; V47-K49 VanDerWaalsContact C-N 3.28Å; V47-K49 HydrophobicContact CG2-CB 4.48Å; V47-K49 HydrophobicContact CG2-CG 4.34Å; V47-K49 PolarHBondContact O-N 3.33Å; K49-M63 HydrophobicContact CB-CE 3.77Å; K49-M63 HydrophobicContact CB-SD 4.25Å; K49-M63 HydrophobicContact CD-CE 4.24Å; K49-M63 HydrophobicContact CD-SD 3.63Å; K49-K66 HydrophobicContact CD-CG 4.23Å
50	Q	93.4	Very high	92	Very high	141 Å²	141	59.2 Å²	59.2	66%	0.659	30%	0.296	S	S	*	.			trans	-151.6	154.5	176.2	63.7	-176.4	-17.6	0	0	111	N41	N41-Q50 VanDerWaalsContact OD1-CA 3.31Å; N41-Q50 WeakPolarHBondContact OD1-CA 3.3Å
51	I	94.1	Very high	91.9	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	30%	0.296	C	S	.	.			trans	-114.1	149.1	170	58.4	162.2	0	0	0	109.8	T37 C40 N41 L44 I54 D57 F58 M63	T37-I51 HydrophobicContact CG2-CD1 4.17Å; T37-I51 HydrophobicContact CG2-CG1 4.05Å; C40-I51 HydrophobicContact CB-CD1 3.72Å; C40-I51 HydrophobicContact CB-CG1 4.26Å; N41-I51 PolarHBondContact ND2-O 3.31Å; N41-I51 VanDerWaalsContact OD1-CG1 3.29Å; N41-I51 WeakPolarHBondContact OD1-CG1 3.09Å; N41-I51 PolarHBondContact OD1-N 3.49Å; N41-I51 PolarHBondContact OD1-O 3.24Å; L44-I51 HydrophobicContact CD1-CG1 4.47Å; L44-I51 HydrophobicContact CD1-CG2 4.11Å; I51-I54 HydrophobicContact CD1-CB 4.4Å; I51-I54 HydrophobicContact CD1-CG1 4.04Å; I51-D57 HydrophobicContact CB-CB 3.89Å; I51-D57 HydrophobicContact CG2-CB 3.71Å; I51-F58 HydrophobicContact CD1-CD2 4.49Å; I51-F58 HydrophobicContact CD1-CE2 3.66Å; I51-F58 HydrophobicContact CD1-CZ 3.71Å; I51-F58 HydrophobicContact CG2-CE1 4.44Å; I51-M63 HydrophobicContact CG2-CB 4.22Å; I51-M63 HydrophobicContact CG2-CE 3.53Å; I51-M63 HydrophobicContact CG2-CG 4.24Å
52	N	93.1	Very high	91.9	Very high	124 Å²	124	59.3 Å²	59.3	66%	0.663	30%	0.298	S	S	*	.	S	Bend	trans	-111.7	-43.9	179.6	-60.4	-53.8	0	0	0	111.9	D57	N52-D57 PolarHBondContact N-OD2 2.79Å
53	V	92.2	Very high	92	Very high	61 Å²	61	59.8 Å²	59.8	37%	0.37	30%	0.299	S	S	.	.			trans	-128.4	103.3	-178.2	-177.4	0	0	0	0	108.2	E55 N56 D57	V53-E55 VanDerWaalsContact C-N 3.3Å; V53-E55 HydrophobicContact CG1-CG 3.94Å; V53-E55 PolarHBondContact O-N 2.82Å; V53-N56 HydrophobicContact CB-CB 4.2Å; V53-N56 HydrophobicContact CG1-CB 4.12Å; V53-N56 WeakPolarHBondContact CG1-ND2 3.27Å; V53-N56 PolarHBondContact O-N 3.19Å; V53-D57 PolarHBondContact N-OD2 3.46Å; V53-D57 PolarHBondContact O-N 3.35Å
54	I	92.2	Very high	92.1	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-56.8	-39.3	-167.5	-160.7	169.2	0	0	0	113.5	K33 F36 I51 N56 F58 T122 L123 I126	K33-I54 HydrophobicContact CB-CG2 4.44Å; K33-I54 HydrophobicContact CG-CG2 3.99Å; F36-I54 HydrophobicContact CB-CD1 3.67Å; I51-I54 HydrophobicContact CD1-CB 4.4Å; I51-I54 HydrophobicContact CD1-CG1 4.04Å; I54-N56 VanDerWaalsContact C-N 3.28Å; I54-N56 PolarHBondContact O-N 3.22Å; I54-F58 HydrophobicContact CD1-CE2 4.16Å; I54-F58 HydrophobicContact CG1-CD2 3.66Å; I54-F58 HydrophobicContact CG1-CE2 3.52Å; I54-F58 WeakPolarHBondContact O-CD2 2.8Å; I54-T122 HydrophobicContact CG1-CG2 4.49Å; I54-L123 HydrophobicContact CD1-CD2 4.38Å; I54-L123 HydrophobicContact CG2-CD2 4.16Å; I54-I126 HydrophobicContact CD1-CG1 4.05Å; I54-I126 HydrophobicContact CD1-CG2 4.47Å
55	E	88.5	Confident	92.1	Very high	36 Å²	36	57.6 Å²	57.6	17%	0.168	29%	0.289	C	S	.	.	H	α-helix	trans	-72.8	-16	178.1	62.9	-95.6	-133.6	0	0	114.2	K33 V53 R59 G117 P119	K33-E55 WeakPolarHBondContact CE-OE1 3.43Å; K33-E55 IonicContact NZ-OE1 3.67Å; K33-E55 PolarHBondContact NZ-OE1 3.39Å; K33-E55 IonicContact NZ-OE2 3.26Å; V53-E55 VanDerWaalsContact C-N 3.3Å; V53-E55 HydrophobicContact CG1-CG 3.94Å; V53-E55 PolarHBondContact O-N 2.82Å; E55-R59 WeakPolarHBondContact O-CD 3.15Å; E55-R59 WeakPolarHBondContact O-CG 3.34Å; E55-G117 WeakPolarHBondContact O-CA 3.13Å; E55-P119 HydrophobicContact CB-CB 4.36Å
56	N	92.4	Very high	92.3	Very high	82 Å²	82	55.6 Å²	55.6	44%	0.439	28%	0.283	S	S	.	.	H	α-helix	trans	-103.2	-42.7	-179.8	-75	-35.1	0	0	0	112.3	V53 I54 F58 R59	V53-N56 HydrophobicContact CB-CB 4.2Å; V53-N56 HydrophobicContact CG1-CB 4.12Å; V53-N56 WeakPolarHBondContact CG1-ND2 3.27Å; V53-N56 PolarHBondContact O-N 3.19Å; I54-N56 VanDerWaalsContact C-N 3.28Å; I54-N56 PolarHBondContact O-N 3.22Å; N56-F58 VanDerWaalsContact C-N 3.31Å; N56-F58 PolarHBondContact O-N 3.26Å; N56-R59 VanDerWaalsContact O-CB 3.31Å; N56-R59 WeakPolarHBondContact O-CB 3.16Å; N56-R59 VanDerWaalsContact O-CG 3.25Å; N56-R59 WeakPolarHBondContact O-CG 3.4Å; N56-R59 PolarHBondContact O-N 3.37Å
57	D	94.8	Very high	92.7	Very high	52 Å²	52	50.3 Å²	50.3	28%	0.278	26%	0.255	S	S	.	.	H	α-helix	trans	-78.2	-17.2	-170.8	-64.1	-30.4	0	0	0	113.1	I51 N52 V53	I51-D57 HydrophobicContact CB-CB 3.89Å; I51-D57 HydrophobicContact CG2-CB 3.71Å; N52-D57 PolarHBondContact N-OD2 2.79Å; V53-D57 PolarHBondContact N-OD2 3.46Å; V53-D57 PolarHBondContact O-N 3.35Å
58	F	94.8	Very high	92.9	Very high	1 Å²	1	48.1 Å²	48.1	0%	0.004	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-6.1	171.5	-72.1	-49.2	0	0	0	114.3	C40 I51 I54 N56 D60 G61 M63 L64 L67 T122 I126	C40-F58 HydrophobicContact CB-CZ 4.22Å; I51-F58 HydrophobicContact CD1-CD2 4.49Å; I51-F58 HydrophobicContact CD1-CE2 3.66Å; I51-F58 HydrophobicContact CD1-CZ 3.71Å; I51-F58 HydrophobicContact CG2-CE1 4.44Å; I54-F58 HydrophobicContact CD1-CE2 4.16Å; I54-F58 HydrophobicContact CG1-CD2 3.66Å; I54-F58 HydrophobicContact CG1-CE2 3.52Å; I54-F58 WeakPolarHBondContact O-CD2 2.8Å; N56-F58 VanDerWaalsContact C-N 3.31Å; N56-F58 PolarHBondContact O-N 3.26Å; F58-D60 PolarHBondContact O-N 2.88Å; F58-D60 VanDerWaalsContact O-N 3.14Å; F58-G61 PolarHBondContact O-N 2.83Å; F58-M63 HydrophobicContact CD1-CB 3.88Å; F58-M63 HydrophobicContact CE1-CB 3.92Å; F58-L64 HydrophobicContact CD1-CB 3.81Å; F58-L64 HydrophobicContact CD1-CD1 4.45Å; F58-L64 HydrophobicContact CE1-CB 4.27Å; F58-L64 HydrophobicContact CE1-CD1 4.49Å; F58-L67 HydrophobicContact CE1-CD2 4.34Å; F58-L67 HydrophobicContact CZ-CD2 3.95Å; F58-T122 HydrophobicContact CD2-CG2 4.3Å; F58-I126 HydrophobicContact CD2-CD1 4.03Å; F58-I126 HydrophobicContact CD2-CG1 4.42Å; F58-I126 HydrophobicContact CE2-CD1 3.49Å; F58-I126 VanDerWaalsContact CE2-CD1 3.49Å; F58-I126 HydrophobicContact CE2-CG1 4.05Å; F58-I126 HydrophobicContact CZ-CD1 3.95Å
59	R	93.9	Very high	93	Very high	80 Å²	80	42.3 Å²	42.3	30%	0.302	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-23.8	-173.7	-66.6	-179.9	63.7	173.9	6.4	114.4	E55 N56 K88 I114 V115	E55-R59 WeakPolarHBondContact O-CD 3.15Å; E55-R59 WeakPolarHBondContact O-CG 3.34Å; N56-R59 VanDerWaalsContact O-CB 3.31Å; N56-R59 WeakPolarHBondContact O-CB 3.16Å; N56-R59 VanDerWaalsContact O-CG 3.25Å; N56-R59 WeakPolarHBondContact O-CG 3.4Å; N56-R59 PolarHBondContact O-N 3.37Å; R59-K88 WeakPolarHBondContact O-CB 3.36Å; R59-I114 WeakPolarHBondContact CG-O 2.79Å; R59-V115 VanDerWaalsContact CZ-O 3.3Å; R59-V115 PolarHBondContact NE-O 2.84Å; R59-V115 PolarHBondContact NH2-O 2.94Å; R59-V115 WeakPolarHBondContact O-CG2 3Å
60	D	92	Very high	93	Very high	60 Å²	60	40.1 Å²	40.1	32%	0.321	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-5.1	178.6	71.7	6.3	0	0	0	114	F58 V62 K88 N91	F58-D60 PolarHBondContact O-N 2.88Å; F58-D60 VanDerWaalsContact O-N 3.14Å; D60-V62 PolarHBondContact O-N 3.44Å; D60-V62 WeakPolarHBondContact OD1-CB 3.34Å; D60-V62 PolarHBondContact OD1-N 3.44Å; D60-K88 HydrophobicContact CB-CD 4.28Å; D60-K88 HydrophobicContact CB-CG 4.2Å; D60-N91 WeakPolarHBondContact O-CB 3.32Å; D60-N91 PolarHBondContact O-ND2 3.21Å; D60-N91 VanDerWaalsContact O-ND2 3.07Å
61	G	92.3	Very high	92.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	71.3	-9.6	-177.4	0	0	0	0	0	115.6	F58 L64 I65	F58-G61 PolarHBondContact O-N 2.83Å; G61-L64 PolarHBondContact O-N 2.75Å; G61-I65 WeakPolarHBondContact O-CG1 3.39Å; G61-I65 PolarHBondContact O-N 2.85Å
62	V	93	Very high	92.5	Very high	41 Å²	41	36.3 Å²	36.3	25%	0.248	19%	0.189	C	C	.	.	H	α-helix	trans	-70.7	-45	-173.5	178.9	0	0	0	0	111.1	D60 L64 K66 P79	D60-V62 PolarHBondContact O-N 3.44Å; D60-V62 WeakPolarHBondContact OD1-CB 3.34Å; D60-V62 PolarHBondContact OD1-N 3.44Å; V62-L64 VanDerWaalsContact C-N 3.29Å; V62-L64 PolarHBondContact O-N 2.79Å; V62-K66 PolarHBondContact O-N 2.8Å; V62-K66 VanDerWaalsContact O-N 3.16Å; V62-P79 HydrophobicContact CG1-CG 4.39Å; V62-P79 HydrophobicContact CG2-CB 4.13Å
63	M	93.5	Very high	92.1	Very high	25 Å²	25	33.8 Å²	33.8	12%	0.123	19%	0.192	C	C	.	.	H	α-helix	trans	-67.6	-32.5	176.6	-72.4	-59.1	-71.9	0	0	112	L44 K49 I51 F58 K66 L67	L44-M63 HydrophobicContact CD1-CE 3.59Å; L44-M63 HydrophobicContact CD2-CE 4.11Å; L44-M63 HydrophobicContact CG-CE 4.39Å; K49-M63 HydrophobicContact CB-CE 3.77Å; K49-M63 HydrophobicContact CB-SD 4.25Å; K49-M63 HydrophobicContact CD-CE 4.24Å; K49-M63 HydrophobicContact CD-SD 3.63Å; I51-M63 HydrophobicContact CG2-CB 4.22Å; I51-M63 HydrophobicContact CG2-CE 3.53Å; I51-M63 HydrophobicContact CG2-CG 4.24Å; F58-M63 HydrophobicContact CD1-CB 3.88Å; F58-M63 HydrophobicContact CE1-CB 3.92Å; M63-K66 PolarHBondContact O-N 3.35Å; M63-L67 WeakPolarHBondContact O-CB 3.29Å; M63-L67 PolarHBondContact O-N 3.45Å
64	L	93.7	Very high	91.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-68.7	-47.4	178.3	-178	62.8	0	0	0	111.7	F58 G61 V62 K66 L67 L68 A95 M125 I126 I129	F58-L64 HydrophobicContact CD1-CB 3.81Å; F58-L64 HydrophobicContact CD1-CD1 4.45Å; F58-L64 HydrophobicContact CE1-CB 4.27Å; F58-L64 HydrophobicContact CE1-CD1 4.49Å; G61-L64 PolarHBondContact O-N 2.75Å; V62-L64 VanDerWaalsContact C-N 3.29Å; V62-L64 PolarHBondContact O-N 2.79Å; L64-K66 VanDerWaalsContact C-N 3.26Å; L64-K66 PolarHBondContact O-N 3.2Å; L64-L67 WeakPolarHBondContact O-CB 3.49Å; L64-L67 PolarHBondContact O-N 3.13Å; L64-L68 WeakPolarHBondContact O-CG 3.48Å; L64-L68 PolarHBondContact O-N 3.25Å; L64-A95 HydrophobicContact CB-CB 4.48Å; L64-A95 HydrophobicContact CD2-CB 3.51Å; L64-A95 HydrophobicContact CG-CB 3.7Å; L64-M125 HydrophobicContact CD1-CE 3.58Å; L64-M125 HydrophobicContact CD1-SD 4.25Å; L64-M125 HydrophobicContact CD2-CE 3.66Å; L64-M125 HydrophobicContact CD2-SD 3.61Å; L64-M125 HydrophobicContact CG-CE 4.24Å; L64-I126 HydrophobicContact CD1-CD1 4.3Å; L64-I129 HydrophobicContact CD1-CD1 3.89Å
65	I	94	Very high	91.5	Very high	4 Å²	4	40.5 Å²	40.5	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-56	-46.4	173.6	-71.2	166.6	0	0	0	109.6	G61 L67 L68 E69 L76 P79 N91 K94 A95	G61-I65 WeakPolarHBondContact O-CG1 3.39Å; G61-I65 PolarHBondContact O-N 2.85Å; I65-L67 VanDerWaalsContact C-N 3.33Å; I65-L67 PolarHBondContact O-N 3.47Å; I65-L68 PolarHBondContact O-N 2.79Å; I65-E69 WeakPolarHBondContact O-CG 2.82Å; I65-E69 PolarHBondContact O-N 2.68Å; I65-L76 HydrophobicContact CG2-CB 3.85Å; I65-L76 HydrophobicContact CG2-CD2 4.14Å; I65-P79 HydrophobicContact CD1-CB 3.96Å; I65-N91 HydrophobicContact CD1-CB 4.22Å; I65-K94 HydrophobicContact CD1-CB 4.29Å; I65-A95 HydrophobicContact CG1-CB 4.11Å
66	K	93	Very high	91.6	Very high	62 Å²	62	39 Å²	39	27%	0.27	23%	0.226	S	C	.	.	H	α-helix	trans	-66.7	-36.4	-177	-163.9	62.8	-172.4	165.8	0	112.9	L44 V47 K49 V62 M63 L64 E69 V70	L44-K66 HydrophobicContact CD2-CB 4.49Å; V47-K66 HydrophobicContact CG2-CG 4Å; K49-K66 HydrophobicContact CD-CG 4.23Å; V62-K66 PolarHBondContact O-N 2.8Å; V62-K66 VanDerWaalsContact O-N 3.16Å; M63-K66 PolarHBondContact O-N 3.35Å; L64-K66 VanDerWaalsContact C-N 3.26Å; L64-K66 PolarHBondContact O-N 3.2Å; K66-E69 VanDerWaalsContact CD-OE2 3.23Å; K66-E69 WeakPolarHBondContact CD-OE2 3.26Å; K66-E69 IonicContact NZ-OE2 3.95Å; K66-E69 PolarHBondContact NZ-OE2 3.09Å; K66-V70 VanDerWaalsContact O-CG2 3.3Å; K66-V70 WeakPolarHBondContact O-CG2 3.04Å; K66-V70 PolarHBondContact O-N 3.38Å
67	L	94.4	Very high	91.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.4	-47.5	173	179.6	67.8	0	0	0	110.9	W39 C40 H43 L44 F58 M63 L64 I65 E69 V70 I71 I126	W39-L67 HydrophobicContact CZ3-CD2 4.48Å; C40-L67 HydrophobicContact CB-CD1 4.32Å; C40-L67 HydrophobicContact CB-CD2 4.31Å; H43-L67 HydrophobicContact CB-CD1 3.9Å; L44-L67 HydrophobicContact CD2-CB 4.16Å; L44-L67 HydrophobicContact CD2-CD1 4.42Å; L44-L67 HydrophobicContact CG-CD1 4.04Å; F58-L67 HydrophobicContact CE1-CD2 4.34Å; F58-L67 HydrophobicContact CZ-CD2 3.95Å; M63-L67 WeakPolarHBondContact O-CB 3.29Å; M63-L67 PolarHBondContact O-N 3.45Å; L64-L67 WeakPolarHBondContact O-CB 3.49Å; L64-L67 PolarHBondContact O-N 3.13Å; I65-L67 VanDerWaalsContact C-N 3.33Å; I65-L67 PolarHBondContact O-N 3.47Å; L67-E69 PolarHBondContact O-N 3.08Å; L67-V70 PolarHBondContact O-N 3.28Å; L67-I71 HydrophobicContact CD1-CD1 3.6Å; L67-I71 HydrophobicContact CD1-CG1 4.27Å; L67-I71 HydrophobicContact CD2-CD1 4.41Å; L67-I71 HydrophobicContact CG-CD1 3.65Å; L67-I71 WeakPolarHBondContact O-CG1 3.34Å; L67-I71 PolarHBondContact O-N 3.49Å; L67-I126 HydrophobicContact CD2-CD1 4.34Å
68	L	93.7	Very high	91	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.5	-40.4	179.8	-71.2	170.5	0	0	0	112.8	L64 I65 V70 I71 S72 L76 A95 F98 I99 I129 F133	L64-L68 WeakPolarHBondContact O-CG 3.48Å; L64-L68 PolarHBondContact O-N 3.25Å; I65-L68 PolarHBondContact O-N 2.79Å; L68-V70 VanDerWaalsContact C-N 3.32Å; L68-V70 PolarHBondContact O-N 2.81Å; L68-I71 PolarHBondContact O-N 3.16Å; L68-S72 VanDerWaalsContact O-CB 3.28Å; L68-S72 WeakPolarHBondContact O-CB 3.44Å; L68-S72 PolarHBondContact O-N 3.19Å; L68-S72 PolarHBondContact O-OG 3.03Å; L68-L76 HydrophobicContact CB-CD1 4.39Å; L68-L76 HydrophobicContact CB-CD2 3.96Å; L68-L76 HydrophobicContact CD1-CD2 4.08Å; L68-A95 HydrophobicContact CD1-CB 3.62Å; L68-F98 HydrophobicContact CB-CD1 4.12Å; L68-F98 HydrophobicContact CB-CE1 4.23Å; L68-F98 HydrophobicContact CD1-CD1 4.11Å; L68-F98 HydrophobicContact CD2-CD1 4.31Å; L68-F98 HydrophobicContact CG-CD1 4.42Å; L68-I99 HydrophobicContact CD1-CD1 4.02Å; L68-I99 HydrophobicContact CD1-CG1 3.93Å; L68-I99 HydrophobicContact CD2-CD1 4.15Å; L68-I99 HydrophobicContact CD2-CG1 3.78Å; L68-I129 HydrophobicContact CD2-CD1 4.08Å; L68-I129 HydrophobicContact CD2-CG1 4.29Å; L68-I129 HydrophobicContact CD2-CG2 4.17Å; L68-F133 HydrophobicContact CD2-CE2 4.2Å
69	E	92.9	Very high	90.7	Very high	35 Å²	35	43.3 Å²	43.3	16%	0.164	26%	0.263	C	S	.	.	H	α-helix	trans	-58.9	-44.3	174.3	-70.4	-177.6	159.7	0	0	111.7	I65 K66 L67 G73 E74 L76	I65-E69 WeakPolarHBondContact O-CG 2.82Å; I65-E69 PolarHBondContact O-N 2.68Å; K66-E69 VanDerWaalsContact CD-OE2 3.23Å; K66-E69 WeakPolarHBondContact CD-OE2 3.26Å; K66-E69 IonicContact NZ-OE2 3.95Å; K66-E69 PolarHBondContact NZ-OE2 3.09Å; L67-E69 PolarHBondContact O-N 3.08Å; E69-G73 WeakPolarHBondContact O-CA 3.4Å; E69-G73 PolarHBondContact O-N 3.33Å; E69-E74 VanDerWaalsContact CA-O 3.29Å; E69-E74 WeakPolarHBondContact CA-O 3.04Å; E69-E74 WeakPolarHBondContact CG-O 3.44Å; E69-L76 HydrophobicContact CG-CB 3.94Å; E69-L76 HydrophobicContact CG-CD1 3.75Å; E69-L76 HydrophobicContact CG-CG 4.37Å; E69-L76 PolarHBondContact OE1-N 2.98Å
70	V	91.5	Very high	90.5	Very high	37 Å²	37	43.8 Å²	43.8	22%	0.224	27%	0.269	C	S	.	.	H	α-helix	trans	-69	-39.2	-177.4	173.1	0	0	0	0	111.9	H43 N46 V47 K66 L67 L68	H43-V70 HydrophobicContact CB-CG1 4.21Å; N46-V70 HydrophobicContact CB-CG1 4.4Å; V47-V70 HydrophobicContact CB-CG2 4.29Å; V47-V70 HydrophobicContact CG1-CG2 3.43Å; V47-V70 VanDerWaalsContact CG1-CG2 3.43Å; V47-V70 HydrophobicContact CG2-CG2 3.83Å; K66-V70 VanDerWaalsContact O-CG2 3.3Å; K66-V70 WeakPolarHBondContact O-CG2 3.04Å; K66-V70 PolarHBondContact O-N 3.38Å; L67-V70 PolarHBondContact O-N 3.28Å; L68-V70 VanDerWaalsContact C-N 3.32Å; L68-V70 PolarHBondContact O-N 2.81Å
71	I	90.1	Very high	90	Very high	31 Å²	31	52.5 Å²	52.5	16%	0.159	30%	0.297	C	S	.	.	H	α-helix	trans	-77.3	-39.7	-177.2	-65.4	168.6	0	0	0	111.3	W39 H43 L67 L68 I129 F133	W39-I71 HydrophobicContact CH2-CD1 3.39Å; W39-I71 HydrophobicContact CZ2-CD1 4.23Å; W39-I71 HydrophobicContact CZ3-CD1 3.75Å; H43-I71 HydrophobicContact CB-CG1 4.15Å; L67-I71 HydrophobicContact CD1-CD1 3.6Å; L67-I71 HydrophobicContact CD1-CG1 4.27Å; L67-I71 HydrophobicContact CD2-CD1 4.41Å; L67-I71 HydrophobicContact CG-CD1 3.65Å; L67-I71 WeakPolarHBondContact O-CG1 3.34Å; L67-I71 PolarHBondContact O-N 3.49Å; L68-I71 PolarHBondContact O-N 3.16Å; I71-I129 HydrophobicContact CD1-CG2 4.29Å; I71-F133 HydrophobicContact CG2-CB 3.33Å; I71-F133 HydrophobicContact CG2-CD1 3.79Å; I71-F133 HydrophobicContact CG2-CD2 4.33Å; I71-F133 HydrophobicContact CG2-CG 3.58Å
72	S	86.9	Confident	89.3	Confident	30 Å²	30	53.7 Å²	53.7	21%	0.21	31%	0.31	C	S	.	.	H	α-helix	trans	-83	-23	-178.7	64.2	0	0	0	0	113.8	L68 E74 F98	L68-S72 VanDerWaalsContact O-CB 3.28Å; L68-S72 WeakPolarHBondContact O-CB 3.44Å; L68-S72 PolarHBondContact O-N 3.19Å; L68-S72 PolarHBondContact O-OG 3.03Å; S72-E74 PolarHBondContact O-N 3.46Å; S72-E74 PolarHBondContact OG-N 3.14Å; S72-F98 WeakPolarHBondContact OG-CZ 3.21Å
73	G	84.3	Confident	88.8	Confident	71 Å²	71	59.5 Å²	59.5	73%	0.732	34%	0.336	S	S	*	.			trans	74	2.9	-169.2	0	0	0	0	0	113.9	E69	E69-G73 WeakPolarHBondContact O-CA 3.4Å; E69-G73 PolarHBondContact O-N 3.33Å
74	E	88.1	Confident	88.5	Confident	89 Å²	89	64.2 Å²	64.2	42%	0.416	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-101.9	150.2	-177.9	-68.4	178	-165.1	0	0	112.1	E69 S72 F98 K102	E69-E74 VanDerWaalsContact CA-O 3.29Å; E69-E74 WeakPolarHBondContact CA-O 3.04Å; E69-E74 WeakPolarHBondContact CG-O 3.44Å; S72-E74 PolarHBondContact O-N 3.46Å; S72-E74 PolarHBondContact OG-N 3.14Å; E74-F98 HydrophobicContact CB-CE2 4.26Å; E74-F98 HydrophobicContact CB-CZ 4.2Å; E74-F98 WeakPolarHBondContact OE2-CE2 3.07Å; E74-K102 IonicContact OE1-NZ 3.93Å; E74-K102 PolarHBondContact OE1-NZ 2.9Å; E74-K102 VanDerWaalsContact OE2-CE 3.26Å; E74-K102 WeakPolarHBondContact OE2-CE 3.46Å; E74-K102 IonicContact OE2-NZ 2.7Å; E74-K102 PolarHBondContact OE2-NZ 2.82Å
75	S	85	Confident	88.4	Confident	114 Å²	114	69.7 Å²	69.7	80%	0.797	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-84.4	126.3	177.6	-175	0	0	0	0	110.2
76	L	89.4	Confident	88.2	Confident	6 Å²	6	75.1 Å²	75.1	3%	0.031	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-95.8	160.8	176.8	-88.5	73.5	0	0	0	111.1	I65 L68 E69 S78 F98	I65-L76 HydrophobicContact CG2-CB 3.85Å; I65-L76 HydrophobicContact CG2-CD2 4.14Å; L68-L76 HydrophobicContact CB-CD1 4.39Å; L68-L76 HydrophobicContact CB-CD2 3.96Å; L68-L76 HydrophobicContact CD1-CD2 4.08Å; E69-L76 HydrophobicContact CG-CB 3.94Å; E69-L76 HydrophobicContact CG-CD1 3.75Å; E69-L76 HydrophobicContact CG-CG 4.37Å; E69-L76 PolarHBondContact OE1-N 2.98Å; L76-S78 PolarHBondContact O-N 2.81Å; L76-F98 HydrophobicContact CD1-CD1 4.04Å; L76-F98 HydrophobicContact CD1-CD2 3.73Å; L76-F98 HydrophobicContact CD1-CE1 3.96Å; L76-F98 HydrophobicContact CD1-CE2 3.66Å; L76-F98 HydrophobicContact CD1-CG 3.92Å; L76-F98 HydrophobicContact CD1-CZ 3.77Å; L76-F98 HydrophobicContact CD2-CB 3.83Å; L76-F98 HydrophobicContact CD2-CD1 4.06Å; L76-F98 HydrophobicContact CD2-CD2 4.25Å; L76-F98 HydrophobicContact CD2-CG 3.77Å; L76-F98 HydrophobicContact CG-CB 4.26Å; L76-F98 HydrophobicContact CG-CD1 4.38Å; L76-F98 HydrophobicContact CG-CD2 3.83Å; L76-F98 HydrophobicContact CG-CE2 4.26Å; L76-F98 HydrophobicContact CG-CG 3.89Å
77	P	88	Confident	88	Confident	79 Å²	79	74 Å²	74	51%	0.513	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-56	132.6	172.9	-23.9	33.7	0	0	0	111.3	K94	P77-K94 HydrophobicContact CB-CD 4.25Å
78	S	86.8	Confident	88	Confident	99 Å²	99	76.8 Å²	76.8	69%	0.692	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-55.5	139.4	-178.2	-68.4	0	0	0	0	112.1	L76 K94	L76-S78 PolarHBondContact O-N 2.81Å; S78-K94 PolarHBondContact O-NZ 3.47Å
79	P	89	Confident	88	Confident	46 Å²	46	78 Å²	78	30%	0.299	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-68.4	145.6	-178.6	25.6	-32.9	0	0	0	112.5	V62 I65 N91	V62-P79 HydrophobicContact CG1-CG 4.39Å; V62-P79 HydrophobicContact CG2-CB 4.13Å; I65-P79 HydrophobicContact CD1-CB 3.96Å; P79-N91 WeakPolarHBondContact CA-OD1 3.28Å
80	E	88.5	Confident	88	Confident	90 Å²	90	78 Å²	78	42%	0.421	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-62.7	131.9	166.4	-60	-52.7	139.4	0	0	109.9	H87 A90 N91 K94	E80-H87 HydrophobicContact CB-CB 4.24Å; E80-A90 HydrophobicContact CG-CB 4.13Å; E80-N91 WeakPolarHBondContact CB-OD1 3.49Å; E80-N91 PolarHBondContact N-OD1 3.45Å; E80-N91 PolarHBondContact O-ND2 2.94Å; E80-K94 IonicContact OE1-NZ 2.71Å; E80-K94 PolarHBondContact OE1-NZ 3.46Å
81	R	82.9	Confident	88.2	Confident	243 Å²	243	76.4 Å²	76.4	92%	0.917	41%	0.414	S	S	*	.			trans	-87.5	-3.6	-174.8	-62.3	-177.5	180	-178.2	-0.1	114.2
82	G	76	Confident	88.4	Confident	26 Å²	26	74.9 Å²	74.9	27%	0.268	41%	0.406	S	S	.	.			trans	-76.5	149.9	-174.2	0	0	0	0	0	113.6	H87	G82-H87 WeakPolarHBondContact CA-ND1 3.42Å; G82-H87 VanDerWaalsContact O-CB 3.23Å; G82-H87 WeakPolarHBondContact O-CB 3.15Å
83	M	82.7	Confident	88.7	Confident	163 Å²	163	76.6 Å²	76.6	80%	0.803	41%	0.413	S	S	*	.			trans	-90.5	-13.5	-175.1	-64.1	-63	-70.5	0	0	114.4
84	M	87.1	Confident	89.2	Confident	124 Å²	124	75.3 Å²	75.3	61%	0.611	39%	0.387	S	S	*	.	S	Bend	trans	-70.6	152.2	-178.4	-56	-178.5	74.7	0	0	112	F86 H87 K88	M84-F86 VanDerWaalsContact C-N 3.26Å; M84-F86 HydrophobicContact CB-CD1 3.78Å; M84-F86 HydrophobicContact CB-CE1 3.66Å; M84-F86 HydrophobicContact CE-CE1 4.23Å; M84-F86 HydrophobicContact CG-CE1 4.22Å; M84-F86 PolarHBondContact O-N 2.91Å; M84-F86 VanDerWaalsContact O-N 3.13Å; M84-F86 HydrophobicContact SD-CE1 3.68Å; M84-F86 HydrophobicContact SD-CZ 4.49Å; M84-H87 PolarHBondContact N-ND1 3.31Å; M84-H87 WeakPolarHBondContact O-CB 3.3Å; M84-H87 PolarHBondContact O-N 2.61Å; M84-K88 PolarHBondContact O-N 3.32Å
85	R	91.1	Very high	89.4	Confident	114 Å²	114	71 Å²	71	43%	0.43	37%	0.367	S	S	.	.	H	α-helix	trans	-50	-41.4	-176.9	-174.8	176	177.7	-93.7	3.6	113.3	H87 K88 I89 V115 D116	R85-H87 VanDerWaalsContact C-N 3.33Å; R85-H87 PolarHBondContact O-N 2.72Å; R85-K88 WeakPolarHBondContact O-CB 3.38Å; R85-K88 PolarHBondContact O-N 2.55Å; R85-K88 VanDerWaalsContact O-N 3.17Å; R85-I89 HydrophobicContact CG-CD1 4.09Å; R85-I89 HydrophobicContact CG-CG1 4.49Å; R85-I89 WeakPolarHBondContact O-CG1 3.32Å; R85-I89 PolarHBondContact O-N 3.14Å; R85-V115 HydrophobicContact CG-CG1 3.88Å; R85-D116 IonicContact CZ-OD1 3.48Å; R85-D116 IonicContact CZ-OD2 2.73Å; R85-D116 IonicContact NE-OD1 2.88Å; R85-D116 PolarHBondContact NE-OD1 3.06Å; R85-D116 IonicContact NE-OD2 2.74Å; R85-D116 VanDerWaalsContact NH2-CG 3.35Å; R85-D116 IonicContact NH2-OD1 3.23Å; R85-D116 PolarHBondContact NH2-OD1 3.23Å; R85-D116 IonicContact NH2-OD2 3.82Å; R85-D116 PolarHBondContact NH2-OD2 3.23Å
86	F	89.9	Confident	89.8	Confident	119 Å²	119	66 Å²	66	52%	0.522	33%	0.331	S	S	.	.	H	α-helix	trans	-66.9	-30	-179	77	-93.3	0	0	0	113.7	M84 K88 I89 A90	M84-F86 VanDerWaalsContact C-N 3.26Å; M84-F86 HydrophobicContact CB-CD1 3.78Å; M84-F86 HydrophobicContact CB-CE1 3.66Å; M84-F86 HydrophobicContact CE-CE1 4.23Å; M84-F86 HydrophobicContact CG-CE1 4.22Å; M84-F86 PolarHBondContact O-N 2.91Å; M84-F86 VanDerWaalsContact O-N 3.13Å; M84-F86 HydrophobicContact SD-CE1 3.68Å; M84-F86 HydrophobicContact SD-CZ 4.49Å; F86-K88 VanDerWaalsContact C-N 3.34Å; F86-I89 PolarHBondContact O-N 3.03Å; F86-A90 WeakPolarHBondContact O-CB 2.98Å; F86-A90 PolarHBondContact O-N 3.37Å
87	H	90.6	Very high	90	Very high	39 Å²	39	70.3 Å²	70.3	18%	0.181	35%	0.354	C	S	.	.	H	α-helix	trans	-67	-39.4	173.3	-59.2	112	0	0	0	111	E80 G82 M84 R85 A90 N91	E80-H87 HydrophobicContact CB-CB 4.24Å; G82-H87 WeakPolarHBondContact CA-ND1 3.42Å; G82-H87 VanDerWaalsContact O-CB 3.23Å; G82-H87 WeakPolarHBondContact O-CB 3.15Å; M84-H87 PolarHBondContact N-ND1 3.31Å; M84-H87 WeakPolarHBondContact O-CB 3.3Å; M84-H87 PolarHBondContact O-N 2.61Å; R85-H87 VanDerWaalsContact C-N 3.33Å; R85-H87 PolarHBondContact O-N 2.72Å; H87-A90 WeakPolarHBondContact O-CB 3.07Å; H87-A90 PolarHBondContact O-N 3.24Å; H87-N91 PolarHBondContact O-N 3.15Å
88	K	93.8	Very high	90.2	Very high	57 Å²	57	67.6 Å²	67.6	25%	0.248	33%	0.334	C	S	.	.	H	α-helix	trans	-62.8	-44.2	175.2	-59	-171.6	177.9	-171	0	111.3	R59 D60 M84 R85 F86 A90 N91 V92 V115	R59-K88 WeakPolarHBondContact O-CB 3.36Å; D60-K88 HydrophobicContact CB-CD 4.28Å; D60-K88 HydrophobicContact CB-CG 4.2Å; M84-K88 PolarHBondContact O-N 3.32Å; R85-K88 WeakPolarHBondContact O-CB 3.38Å; R85-K88 PolarHBondContact O-N 2.55Å; R85-K88 VanDerWaalsContact O-N 3.17Å; F86-K88 VanDerWaalsContact C-N 3.34Å; K88-A90 VanDerWaalsContact C-N 3.34Å; K88-A90 PolarHBondContact O-N 3.49Å; K88-N91 PolarHBondContact O-N 3.46Å; K88-V92 WeakPolarHBondContact O-CG2 3.49Å; K88-V92 PolarHBondContact O-N 2.84Å; K88-V115 HydrophobicContact CB-CG1 3.77Å; K88-V115 HydrophobicContact CB-CG2 3.89Å; K88-V115 HydrophobicContact CD-CG1 4.24Å
89	I	92.9	Very high	90.3	Very high	26 Å²	26	62.9 Å²	62.9	13%	0.133	30%	0.301	C	S	.	.	H	α-helix	trans	-60.8	-44.5	174.6	-63.4	169.6	0	0	0	110.2	R85 F86 N91 V92 N93 A111 E112 V115	R85-I89 HydrophobicContact CG-CD1 4.09Å; R85-I89 HydrophobicContact CG-CG1 4.49Å; R85-I89 WeakPolarHBondContact O-CG1 3.32Å; R85-I89 PolarHBondContact O-N 3.14Å; F86-I89 PolarHBondContact O-N 3.03Å; I89-N91 VanDerWaalsContact C-N 3.32Å; I89-N91 PolarHBondContact O-N 3.22Å; I89-V92 PolarHBondContact O-N 3.03Å; I89-N93 WeakPolarHBondContact O-CB 3.36Å; I89-N93 PolarHBondContact O-N 3.43Å; I89-N93 PolarHBondContact O-ND2 3.14Å; I89-A111 HydrophobicContact CG2-CB 4.04Å; I89-E112 HydrophobicContact CD1-CG 4.24Å; I89-V115 HydrophobicContact CB-CG2 4.41Å; I89-V115 HydrophobicContact CG1-CB 4.15Å; I89-V115 HydrophobicContact CG1-CG1 4.19Å; I89-V115 HydrophobicContact CG1-CG2 3.79Å
90	A	93.4	Very high	90.4	Very high	35 Å²	35	65.6 Å²	65.6	29%	0.289	31%	0.31	S	S	.	.	H	α-helix	trans	-59.8	-41	177.2	0	0	0	0	0	112.6	E80 F86 H87 K88 N93 K94	E80-A90 HydrophobicContact CG-CB 4.13Å; F86-A90 WeakPolarHBondContact O-CB 2.98Å; F86-A90 PolarHBondContact O-N 3.37Å; H87-A90 WeakPolarHBondContact O-CB 3.07Å; H87-A90 PolarHBondContact O-N 3.24Å; K88-A90 VanDerWaalsContact C-N 3.34Å; K88-A90 PolarHBondContact O-N 3.49Å; A90-N93 PolarHBondContact O-N 2.86Å; A90-K94 WeakPolarHBondContact O-CG 3.35Å; A90-K94 PolarHBondContact O-N 3.34Å; A90-K94 VanDerWaalsContact O-N 3.09Å
91	N	95.3	Very high	90.4	Very high	3 Å²	3	65.5 Å²	65.5	2%	0.016	32%	0.319	C	S	.	.	H	α-helix	trans	-66.4	-43.3	175.7	-71.3	-17.7	0	0	0	112.6	D60 I65 P79 E80 H87 K88 I89 K94 A95	D60-N91 WeakPolarHBondContact O-CB 3.32Å; D60-N91 PolarHBondContact O-ND2 3.21Å; D60-N91 VanDerWaalsContact O-ND2 3.07Å; I65-N91 HydrophobicContact CD1-CB 4.22Å; P79-N91 WeakPolarHBondContact CA-OD1 3.28Å; E80-N91 WeakPolarHBondContact CB-OD1 3.49Å; E80-N91 PolarHBondContact N-OD1 3.45Å; E80-N91 PolarHBondContact O-ND2 2.94Å; H87-N91 PolarHBondContact O-N 3.15Å; K88-N91 PolarHBondContact O-N 3.46Å; I89-N91 VanDerWaalsContact C-N 3.32Å; I89-N91 PolarHBondContact O-N 3.22Å; N91-K94 PolarHBondContact O-N 2.7Å; N91-A95 PolarHBondContact O-N 3.47Å
92	V	94.2	Very high	90.6	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-64.7	-41.4	176	175.6	0	0	0	0	110.7	K88 I89 K94 A95 L96 A111 I114 V115	K88-V92 WeakPolarHBondContact O-CG2 3.49Å; K88-V92 PolarHBondContact O-N 2.84Å; I89-V92 PolarHBondContact O-N 3.03Å; V92-K94 PolarHBondContact O-N 3.39Å; V92-A95 WeakPolarHBondContact O-CA 3.44Å; V92-A95 WeakPolarHBondContact O-CB 3.48Å; V92-A95 PolarHBondContact O-N 2.92Å; V92-A95 VanDerWaalsContact O-N 3.07Å; V92-L96 HydrophobicContact CG1-CD1 4.01Å; V92-L96 HydrophobicContact CG1-CG 4.05Å; V92-L96 WeakPolarHBondContact O-CG 3.23Å; V92-L96 PolarHBondContact O-N 3.48Å; V92-A111 HydrophobicContact CB-CB 3.98Å; V92-A111 HydrophobicContact CG1-CB 3.66Å; V92-I114 HydrophobicContact CG1-CB 3.94Å; V92-I114 HydrophobicContact CG1-CG1 4.09Å; V92-I114 HydrophobicContact CG1-CG2 4.17Å; V92-I114 HydrophobicContact CG2-CB 4.41Å; V92-I114 HydrophobicContact CG2-CG2 4.09Å; V92-V115 HydrophobicContact CB-CG2 4.36Å; V92-V115 HydrophobicContact CG2-CG2 3.8Å
93	N	94.5	Very high	90.8	Very high	66 Å²	66	58.3 Å²	58.3	35%	0.353	31%	0.306	S	S	.	.	H	α-helix	trans	-58.3	-45.2	175.2	-79.7	-28.6	0	0	0	112.3	I89 A90 A95 L96 D97 A111	I89-N93 WeakPolarHBondContact O-CB 3.36Å; I89-N93 PolarHBondContact O-N 3.43Å; I89-N93 PolarHBondContact O-ND2 3.14Å; A90-N93 PolarHBondContact O-N 2.86Å; N93-A95 PolarHBondContact O-N 3.12Å; N93-L96 PolarHBondContact O-N 2.85Å; N93-L96 VanDerWaalsContact O-N 3.09Å; N93-D97 WeakPolarHBondContact O-CB 3.32Å; N93-D97 PolarHBondContact O-N 3.28Å; N93-A111 WeakPolarHBondContact OD1-CB 3.2Å
94	K	93.9	Very high	90.7	Very high	43 Å²	43	51.3 Å²	51.3	19%	0.187	27%	0.273	C	S	.	.	H	α-helix	trans	-54	-39.2	174.6	-73.2	170.3	179.8	173.9	0	112.2	I65 P77 S78 E80 A90 N91 V92 F98	I65-K94 HydrophobicContact CD1-CB 4.29Å; P77-K94 HydrophobicContact CB-CD 4.25Å; S78-K94 PolarHBondContact O-NZ 3.47Å; E80-K94 IonicContact OE1-NZ 2.71Å; E80-K94 PolarHBondContact OE1-NZ 3.46Å; A90-K94 WeakPolarHBondContact O-CG 3.35Å; A90-K94 PolarHBondContact O-N 3.34Å; A90-K94 VanDerWaalsContact O-N 3.09Å; N91-K94 PolarHBondContact O-N 2.7Å; V92-K94 PolarHBondContact O-N 3.39Å; K94-F98 PolarHBondContact O-N 2.72Å
95	A	93.3	Very high	90.4	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-72.4	-43.3	176.2	0	0	0	0	0	112.7	L64 I65 L68 N91 V92 N93 F98 I99	L64-A95 HydrophobicContact CB-CB 4.48Å; L64-A95 HydrophobicContact CD2-CB 3.51Å; L64-A95 HydrophobicContact CG-CB 3.7Å; I65-A95 HydrophobicContact CG1-CB 4.11Å; L68-A95 HydrophobicContact CD1-CB 3.62Å; N91-A95 PolarHBondContact O-N 3.47Å; V92-A95 WeakPolarHBondContact O-CA 3.44Å; V92-A95 WeakPolarHBondContact O-CB 3.48Å; V92-A95 PolarHBondContact O-N 2.92Å; V92-A95 VanDerWaalsContact O-N 3.07Å; N93-A95 PolarHBondContact O-N 3.12Å; A95-F98 PolarHBondContact O-N 3.35Å; A95-I99 WeakPolarHBondContact O-CG1 3.05Å; A95-I99 PolarHBondContact O-N 2.82Å
96	L	93.1	Very high	89.9	Confident	8 Å²	8	50.3 Å²	50.3	4%	0.042	27%	0.269	C	S	.	.	H	α-helix	trans	-65.4	-40.2	178.6	-62.9	-179.1	0	0	0	112.1	V92 N93 F98 I99 Q100 L106 I109 A111 M125	V92-L96 HydrophobicContact CG1-CD1 4.01Å; V92-L96 HydrophobicContact CG1-CG 4.05Å; V92-L96 WeakPolarHBondContact O-CG 3.23Å; V92-L96 PolarHBondContact O-N 3.48Å; N93-L96 PolarHBondContact O-N 2.85Å; N93-L96 VanDerWaalsContact O-N 3.09Å; L96-F98 VanDerWaalsContact C-N 3.31Å; L96-F98 PolarHBondContact O-N 3.09Å; L96-I99 HydrophobicContact CD2-CD1 4.45Å; L96-I99 PolarHBondContact O-N 3.22Å; L96-I99 VanDerWaalsContact O-N 3.16Å; L96-Q100 PolarHBondContact O-N 2.87Å; L96-L106 HydrophobicContact CB-CD1 3.86Å; L96-L106 HydrophobicContact CD2-CD1 3.84Å; L96-L106 HydrophobicContact CG-CD1 4.32Å; L96-I109 HydrophobicContact CD2-CG2 4.3Å; L96-A111 HydrophobicContact CD1-CB 3.97Å; L96-M125 HydrophobicContact CD2-CG 4.21Å; L96-M125 HydrophobicContact CD2-SD 3.79Å
97	D	91.9	Very high	89.2	Confident	96 Å²	96	49.9 Å²	49.9	51%	0.513	28%	0.276	S	S	.	.	H	α-helix	trans	-61.3	-40.9	176	-67.8	-20.4	0	0	0	111.1	N93 Q100 S101	N93-D97 WeakPolarHBondContact O-CB 3.32Å; N93-D97 PolarHBondContact O-N 3.28Å; D97-Q100 PolarHBondContact O-N 2.67Å; D97-S101 PolarHBondContact O-N 3.43Å
98	F	92.8	Very high	88.7	Confident	22 Å²	22	52.6 Å²	52.6	10%	0.096	30%	0.299	C	S	.	.	H	α-helix	trans	-64.6	-40.9	174.1	-178.3	-96.5	0	0	0	112.1	L68 S72 E74 L76 K94 A95 L96 S101 K102 F133	L68-F98 HydrophobicContact CB-CD1 4.12Å; L68-F98 HydrophobicContact CB-CE1 4.23Å; L68-F98 HydrophobicContact CD1-CD1 4.11Å; L68-F98 HydrophobicContact CD2-CD1 4.31Å; L68-F98 HydrophobicContact CG-CD1 4.42Å; S72-F98 WeakPolarHBondContact OG-CZ 3.21Å; E74-F98 HydrophobicContact CB-CE2 4.26Å; E74-F98 HydrophobicContact CB-CZ 4.2Å; E74-F98 WeakPolarHBondContact OE2-CE2 3.07Å; L76-F98 HydrophobicContact CD1-CD1 4.04Å; L76-F98 HydrophobicContact CD1-CD2 3.73Å; L76-F98 HydrophobicContact CD1-CE1 3.96Å; L76-F98 HydrophobicContact CD1-CE2 3.66Å; L76-F98 HydrophobicContact CD1-CG 3.92Å; L76-F98 HydrophobicContact CD1-CZ 3.77Å; L76-F98 HydrophobicContact CD2-CB 3.83Å; L76-F98 HydrophobicContact CD2-CD1 4.06Å; L76-F98 HydrophobicContact CD2-CD2 4.25Å; L76-F98 HydrophobicContact CD2-CG 3.77Å; L76-F98 HydrophobicContact CG-CB 4.26Å; L76-F98 HydrophobicContact CG-CD1 4.38Å; L76-F98 HydrophobicContact CG-CD2 3.83Å; L76-F98 HydrophobicContact CG-CE2 4.26Å; L76-F98 HydrophobicContact CG-CG 3.89Å; K94-F98 PolarHBondContact O-N 2.72Å; A95-F98 PolarHBondContact O-N 3.35Å; L96-F98 VanDerWaalsContact C-N 3.31Å; L96-F98 PolarHBondContact O-N 3.09Å; F98-S101 PolarHBondContact O-N 2.81Å; F98-S101 PolarHBondContact O-OG 3.31Å; F98-K102 HydrophobicContact CE1-CG 4.28Å; F98-K102 VanDerWaalsContact CZ-CE 3.49Å; F98-K102 HydrophobicContact CZ-CG 4.39Å; F98-K102 WeakPolarHBondContact O-CG 3.06Å; F98-K102 PolarHBondContact O-N 3.41Å; F98-F133 HydrophobicContact CE1-CZ 4.13Å
99	I	90.3	Very high	88.2	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-43.1	176.5	-67.1	162.2	0	0	0	110.4	L68 A95 L96 S101 K102 V104 L106 I129	L68-I99 HydrophobicContact CD1-CD1 4.02Å; L68-I99 HydrophobicContact CD1-CG1 3.93Å; L68-I99 HydrophobicContact CD2-CD1 4.15Å; L68-I99 HydrophobicContact CD2-CG1 3.78Å; A95-I99 WeakPolarHBondContact O-CG1 3.05Å; A95-I99 PolarHBondContact O-N 2.82Å; L96-I99 HydrophobicContact CD2-CD1 4.45Å; L96-I99 PolarHBondContact O-N 3.22Å; L96-I99 VanDerWaalsContact O-N 3.16Å; I99-S101 PolarHBondContact O-N 3.44Å; I99-K102 PolarHBondContact O-N 3.16Å; I99-V104 HydrophobicContact CG2-CB 3.68Å; I99-V104 HydrophobicContact CG2-CG1 3.7Å; I99-V104 HydrophobicContact CG2-CG2 4.03Å; I99-V104 WeakPolarHBondContact O-CB 3.41Å; I99-L106 HydrophobicContact CG2-CD1 4.39Å; I99-L106 HydrophobicContact CG2-CD2 3.95Å; I99-L106 HydrophobicContact CG2-CG 4.31Å; I99-I129 HydrophobicContact CD1-CD1 3.68Å; I99-I129 HydrophobicContact CD1-CG1 3.69Å; I99-I129 HydrophobicContact CG1-CG1 4.23Å
100	Q	89.8	Confident	87.9	Confident	103 Å²	103	51.4 Å²	51.4	48%	0.481	30%	0.303	S	S	.	.	H	α-helix	trans	-63.8	-39.4	176.7	-74.4	-176.7	-13.7	0	0	112.8	L96 D97 K102 G103 L106	L96-Q100 PolarHBondContact O-N 2.87Å; D97-Q100 PolarHBondContact O-N 2.67Å; Q100-K102 PolarHBondContact O-N 2.87Å; Q100-G103 PolarHBondContact O-N 3.09Å; Q100-L106 HydrophobicContact CG-CD1 3.72Å; Q100-L106 HydrophobicContact CG-CG 4.05Å
101	S	89.7	Confident	87.9	Confident	88 Å²	88	50.1 Å²	50.1	62%	0.615	29%	0.292	S	S	*	.	H	α-helix	trans	-63.8	-22.3	177.7	79	0	0	0	0	112.9	D97 F98 I99 G103	D97-S101 PolarHBondContact O-N 3.43Å; F98-S101 PolarHBondContact O-N 2.81Å; F98-S101 PolarHBondContact O-OG 3.31Å; I99-S101 PolarHBondContact O-N 3.44Å; S101-G103 PolarHBondContact O-N 2.65Å
102	K	85.4	Confident	87.7	Confident	53 Å²	53	55.3 Å²	55.3	23%	0.23	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	12	172.5	-61.7	-63.9	178.5	-170.5	0	114.1	E74 F98 I99 Q100 R132 F133	E74-K102 IonicContact OE1-NZ 3.93Å; E74-K102 PolarHBondContact OE1-NZ 2.9Å; E74-K102 VanDerWaalsContact OE2-CE 3.26Å; E74-K102 WeakPolarHBondContact OE2-CE 3.46Å; E74-K102 IonicContact OE2-NZ 2.7Å; E74-K102 PolarHBondContact OE2-NZ 2.82Å; F98-K102 HydrophobicContact CE1-CG 4.28Å; F98-K102 VanDerWaalsContact CZ-CE 3.49Å; F98-K102 HydrophobicContact CZ-CG 4.39Å; F98-K102 WeakPolarHBondContact O-CG 3.06Å; F98-K102 PolarHBondContact O-N 3.41Å; I99-K102 PolarHBondContact O-N 3.16Å; Q100-K102 PolarHBondContact O-N 2.87Å; K102-R132 PolarHBondContact O-NE 3.21Å; K102-R132 PolarHBondContact O-NH2 3.07Å; K102-F133 HydrophobicContact CB-CZ 4.34Å; K102-F133 HydrophobicContact CG-CE1 4.49Å; K102-F133 HydrophobicContact CG-CZ 3.98Å
103	G	80.8	Confident	87.6	Confident	66 Å²	66	58.9 Å²	58.9	68%	0.68	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.6	15.4	174	0	0	0	0	0	114.5	Q100 S101	Q100-G103 PolarHBondContact O-N 3.09Å; S101-G103 PolarHBondContact O-N 2.65Å
104	V	81.9	Confident	87.5	Confident	16 Å²	16	55.7 Å²	55.7	10%	0.097	32%	0.316	C	S	.	.			trans	-92.7	125.1	-178.7	176.3	0	0	0	0	110.9	I99 L106 T128 R132	I99-V104 HydrophobicContact CG2-CB 3.68Å; I99-V104 HydrophobicContact CG2-CG1 3.7Å; I99-V104 HydrophobicContact CG2-CG2 4.03Å; I99-V104 WeakPolarHBondContact O-CB 3.41Å; V104-L106 HydrophobicContact CG1-CD2 4.15Å; V104-L106 PolarHBondContact O-N 2.76Å; V104-T128 HydrophobicContact CG1-CG2 3.12Å; V104-R132 HydrophobicContact CG2-CB 3.68Å; V104-R132 HydrophobicContact CG2-CG 3.49Å; V104-R132 VanDerWaalsContact CG2-CG 3.49Å
105	K	79.4	Confident	87.5	Confident	193 Å²	193	53.8 Å²	53.8	84%	0.839	31%	0.308	S	S	*	.			trans	-82.5	103.2	171.9	-71	-176.7	-179.2	176.6	0	110.6	V107	K105-V107 PolarHBondContact O-N 2.71Å; K105-V107 VanDerWaalsContact O-N 3.17Å
106	L	80.6	Confident	87.4	Confident	23 Å²	23	57.8 Å²	57.8	12%	0.12	33%	0.33	C	S	.	.			trans	-80	89.6	173.4	-64	175.5	0	0	0	110.5	L96 I99 Q100 V104 I109 T128	L96-L106 HydrophobicContact CB-CD1 3.86Å; L96-L106 HydrophobicContact CD2-CD1 3.84Å; L96-L106 HydrophobicContact CG-CD1 4.32Å; I99-L106 HydrophobicContact CG2-CD1 4.39Å; I99-L106 HydrophobicContact CG2-CD2 3.95Å; I99-L106 HydrophobicContact CG2-CG 4.31Å; Q100-L106 HydrophobicContact CG-CD1 3.72Å; Q100-L106 HydrophobicContact CG-CG 4.05Å; V104-L106 HydrophobicContact CG1-CD2 4.15Å; V104-L106 PolarHBondContact O-N 2.76Å; L106-I109 HydrophobicContact CD2-CD1 4.21Å; L106-T128 HydrophobicContact CD2-CG2 4.33Å
107	V	76	Confident	87.3	Confident	111 Å²	111	58.2 Å²	58.2	67%	0.673	34%	0.336	S	S	*	.			trans	-87.9	125	175.5	-174.6	0	0	0	0	109.2	K105 I109	K105-V107 PolarHBondContact O-N 2.71Å; K105-V107 VanDerWaalsContact O-N 3.17Å; V107-I109 VanDerWaalsContact C-N 3.26Å; V107-I109 PolarHBondContact O-N 2.69Å
108	S	79.1	Confident	87.3	Confident	95 Å²	95	56 Å²	56	66%	0.664	32%	0.324	S	S	*	.	S	Bend	trans	66.2	9.6	176.5	-53.5	0	0	0	0	117.3	M121	S108-M121 WeakPolarHBondContact O-CE 3.07Å
109	I	84.5	Confident	87.1	Confident	26 Å²	26	56.8 Å²	56.8	13%	0.133	33%	0.332	C	S	.	.			trans	-103.2	105.9	174.9	-60.1	164.3	0	0	0	109.2	L96 L106 V107 I114 M125	L96-I109 HydrophobicContact CD2-CG2 4.3Å; L106-I109 HydrophobicContact CD2-CD1 4.21Å; V107-I109 VanDerWaalsContact C-N 3.26Å; V107-I109 PolarHBondContact O-N 2.69Å; I109-I114 HydrophobicContact CG2-CD1 4.22Å; I109-I114 HydrophobicContact CG2-CG1 4.48Å; I109-M125 HydrophobicContact CD1-CB 4.18Å; I109-M125 HydrophobicContact CG2-CB 4.06Å; I109-M125 HydrophobicContact CG2-CG 4.39Å
110	G	86.8	Confident	87	Confident	33 Å²	33	62.5 Å²	62.5	34%	0.34	36%	0.356	S	S	.	.			trans	-102.5	150	173.9	0	0	0	0	0	112.2	E112 E113	G110-E112 PolarHBondContact O-N 2.69Å; G110-E113 WeakPolarHBondContact O-CB 3.3Å; G110-E113 PolarHBondContact O-N 3.37Å
111	A	91.9	Very high	87.1	Confident	7 Å²	7	59.8 Å²	59.8	6%	0.058	34%	0.344	C	S	.	.	H	α-helix	trans	-59.2	-31.6	178.4	0	0	0	0	0	113.3	I89 V92 N93 L96 E113 I114 V115	I89-A111 HydrophobicContact CG2-CB 4.04Å; V92-A111 HydrophobicContact CB-CB 3.98Å; V92-A111 HydrophobicContact CG1-CB 3.66Å; N93-A111 WeakPolarHBondContact OD1-CB 3.2Å; L96-A111 HydrophobicContact CD1-CB 3.97Å; A111-E113 PolarHBondContact O-N 2.71Å; A111-I114 PolarHBondContact O-N 3.5Å; A111-V115 VanDerWaalsContact O-CG2 3.28Å; A111-V115 WeakPolarHBondContact O-CG2 3.25Å; A111-V115 PolarHBondContact O-N 2.62Å
112	E	92.2	Very high	87.2	Confident	113 Å²	113	55.6 Å²	55.6	53%	0.528	32%	0.315	S	S	.	.	H	α-helix	trans	-62.2	-42.2	178.2	-59.5	-175.6	169.6	0	0	112.1	I89 G110 I114 V115 D116	I89-E112 HydrophobicContact CD1-CG 4.24Å; G110-E112 PolarHBondContact O-N 2.69Å; E112-I114 VanDerWaalsContact C-N 3.31Å; E112-I114 PolarHBondContact O-N 3Å; E112-V115 PolarHBondContact O-N 2.59Å; E112-D116 WeakPolarHBondContact O-CB 3.47Å; E112-D116 VanDerWaalsContact O-CG 3.27Å; E112-D116 PolarHBondContact O-N 3.47Å
113	E	91.9	Very high	87.5	Confident	74 Å²	74	53.4 Å²	53.4	35%	0.346	31%	0.306	S	S	.	.	H	α-helix	trans	-62.2	-38.3	179.2	-62.9	-66.6	151.7	0	0	112.1	G110 A111 G117 N118 M121	G110-E113 WeakPolarHBondContact O-CB 3.3Å; G110-E113 PolarHBondContact O-N 3.37Å; A111-E113 PolarHBondContact O-N 2.71Å; E113-G117 PolarHBondContact O-N 2.94Å; E113-N118 HydrophobicContact CB-CB 4.32Å; E113-N118 WeakPolarHBondContact O-CB 3.31Å; E113-N118 PolarHBondContact O-N 3.1Å; E113-N118 PolarHBondContact OE2-ND2 3.31Å; E113-M121 HydrophobicContact CB-CB 3.77Å; E113-M121 HydrophobicContact CB-CG 3.77Å; E113-M121 HydrophobicContact CG-CB 4.5Å; E113-M121 HydrophobicContact CG-CG 3.98Å
114	I	93	Very high	88	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-70.9	-44	177.3	-52.1	-58.9	0	0	0	110.3	R59 V92 I109 A111 E112 D116 G117 M121 M125	R59-I114 WeakPolarHBondContact CG-O 2.79Å; V92-I114 HydrophobicContact CG1-CB 3.94Å; V92-I114 HydrophobicContact CG1-CG1 4.09Å; V92-I114 HydrophobicContact CG1-CG2 4.17Å; V92-I114 HydrophobicContact CG2-CB 4.41Å; V92-I114 HydrophobicContact CG2-CG2 4.09Å; I109-I114 HydrophobicContact CG2-CD1 4.22Å; I109-I114 HydrophobicContact CG2-CG1 4.48Å; A111-I114 PolarHBondContact O-N 3.5Å; E112-I114 VanDerWaalsContact C-N 3.31Å; E112-I114 PolarHBondContact O-N 3Å; I114-D116 VanDerWaalsContact C-N 3.3Å; I114-D116 PolarHBondContact O-N 2.74Å; I114-G117 PolarHBondContact O-N 3.44Å; I114-M121 HydrophobicContact CD1-CB 4.38Å; I114-M125 HydrophobicContact CD1-CB 4.17Å; I114-M125 HydrophobicContact CD1-CE 4.19Å; I114-M125 HydrophobicContact CD1-SD 3.88Å; I114-M125 HydrophobicContact CG1-SD 4.02Å; I114-M125 HydrophobicContact CG2-CE 4.34Å
115	V	93.1	Very high	88.5	Confident	3 Å²	3	50.8 Å²	50.8	2%	0.018	28%	0.282	C	S	.	.	H	α-helix	trans	-67.4	-32.6	179.9	173.6	0	0	0	0	112.1	R59 R85 K88 I89 V92 A111 E112 G117	R59-V115 VanDerWaalsContact CZ-O 3.3Å; R59-V115 PolarHBondContact NE-O 2.84Å; R59-V115 PolarHBondContact NH2-O 2.94Å; R59-V115 WeakPolarHBondContact O-CG2 3Å; R85-V115 HydrophobicContact CG-CG1 3.88Å; K88-V115 HydrophobicContact CB-CG1 3.77Å; K88-V115 HydrophobicContact CB-CG2 3.89Å; K88-V115 HydrophobicContact CD-CG1 4.24Å; I89-V115 HydrophobicContact CB-CG2 4.41Å; I89-V115 HydrophobicContact CG1-CB 4.15Å; I89-V115 HydrophobicContact CG1-CG1 4.19Å; I89-V115 HydrophobicContact CG1-CG2 3.79Å; V92-V115 HydrophobicContact CB-CG2 4.36Å; V92-V115 HydrophobicContact CG2-CG2 3.8Å; A111-V115 VanDerWaalsContact O-CG2 3.28Å; A111-V115 WeakPolarHBondContact O-CG2 3.25Å; A111-V115 PolarHBondContact O-N 2.62Å; E112-V115 PolarHBondContact O-N 2.59Å; V115-G117 VanDerWaalsContact C-N 3.26Å
116	D	92.2	Very high	89.2	Confident	83 Å²	83	41.6 Å²	41.6	44%	0.444	24%	0.242	S	C	.	.	H	α-helix	trans	-82.1	-8	178.6	-66.4	-18.2	0	0	0	112.6	R85 E112 I114	R85-D116 IonicContact CZ-OD1 3.48Å; R85-D116 IonicContact CZ-OD2 2.73Å; R85-D116 IonicContact NE-OD1 2.88Å; R85-D116 PolarHBondContact NE-OD1 3.06Å; R85-D116 IonicContact NE-OD2 2.74Å; R85-D116 VanDerWaalsContact NH2-CG 3.35Å; R85-D116 IonicContact NH2-OD1 3.23Å; R85-D116 PolarHBondContact NH2-OD1 3.23Å; R85-D116 IonicContact NH2-OD2 3.82Å; R85-D116 PolarHBondContact NH2-OD2 3.23Å; E112-D116 WeakPolarHBondContact O-CB 3.47Å; E112-D116 VanDerWaalsContact O-CG 3.27Å; E112-D116 PolarHBondContact O-N 3.47Å; I114-D116 VanDerWaalsContact C-N 3.3Å; I114-D116 PolarHBondContact O-N 2.74Å
117	G	90.1	Very high	89.8	Confident	17 Å²	17	42.2 Å²	42.2	18%	0.175	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	33.5	173.1	0	0	0	0	0	113.3	E55 E113 I114 V115 P119	E55-G117 WeakPolarHBondContact O-CA 3.13Å; E113-G117 PolarHBondContact O-N 2.94Å; I114-G117 PolarHBondContact O-N 3.44Å; V115-G117 VanDerWaalsContact C-N 3.26Å; G117-P119 VanDerWaalsContact O-CD 3.25Å; G117-P119 WeakPolarHBondContact O-CD 3.21Å
118	N	91.1	Very high	90.5	Very high	50 Å²	50	38.4 Å²	38.4	27%	0.267	22%	0.22	S	C	.	.			trans	-69.8	112	175.7	-175.3	-26.4	0	0	0	109.4	E113 K120 M121 T122	E113-N118 HydrophobicContact CB-CB 4.32Å; E113-N118 WeakPolarHBondContact O-CB 3.31Å; E113-N118 PolarHBondContact O-N 3.1Å; E113-N118 PolarHBondContact OE2-ND2 3.31Å; N118-K120 VanDerWaalsContact C-N 3.34Å; N118-K120 PolarHBondContact O-N 3.43Å; N118-K120 PolarHBondContact OD1-N 3.47Å; N118-K120 VanDerWaalsContact OD1-N 3.16Å; N118-M121 HydrophobicContact CB-CB 4.2Å; N118-M121 HydrophobicContact CB-CG 4.22Å; N118-M121 PolarHBondContact O-N 3.01Å; N118-M121 PolarHBondContact OD1-N 3.41Å; N118-T122 WeakPolarHBondContact O-CB 3.35Å; N118-T122 PolarHBondContact O-N 2.87Å; N118-T122 PolarHBondContact O-OG1 3.23Å
119	P	90.3	Very high	91.1	Very high	39 Å²	39	33.9 Å²	33.9	25%	0.253	19%	0.188	S	C	.	.	H	α-helix	trans	-64.5	-38.5	-173.3	25.5	-33.5	0	0	0	111.9	E29 E55 G117 T122 L123	E29-P119 WeakPolarHBondContact OE1-CB 3.45Å; E55-P119 HydrophobicContact CB-CB 4.36Å; G117-P119 VanDerWaalsContact O-CD 3.25Å; G117-P119 WeakPolarHBondContact O-CD 3.21Å; P119-T122 PolarHBondContact O-N 3.16Å; P119-L123 WeakPolarHBondContact O-CB 3.26Å; P119-L123 VanDerWaalsContact O-CG 3.23Å; P119-L123 WeakPolarHBondContact O-CG 3.02Å; P119-L123 PolarHBondContact O-N 3.45Å
120	K	88.4	Confident	91.5	Very high	119 Å²	119	32.6 Å²	32.6	52%	0.517	18%	0.182	S	C	.	.	H	α-helix	trans	-62.9	-46.8	-179.7	-176.1	178.7	-179.6	170	0	111.5	I24 N118 G124	I24-K120 HydrophobicContact CD1-CB 4.41Å; I24-K120 HydrophobicContact CD1-CD 3.54Å; I24-K120 HydrophobicContact CD1-CG 3.76Å; I24-K120 HydrophobicContact CG1-CD 4.38Å; N118-K120 VanDerWaalsContact C-N 3.34Å; N118-K120 PolarHBondContact O-N 3.43Å; N118-K120 PolarHBondContact OD1-N 3.47Å; N118-K120 VanDerWaalsContact OD1-N 3.16Å; K120-G124 PolarHBondContact O-N 3.37Å
121	M	91.1	Very high	91.7	Very high	46 Å²	46	34 Å²	34	23%	0.227	18%	0.181	C	C	.	.	H	α-helix	trans	-70.2	-34.5	179.8	-61.5	-55.9	-158.4	0	0	112	S108 E113 I114 N118 G124 M125	S108-M121 WeakPolarHBondContact O-CE 3.07Å; E113-M121 HydrophobicContact CB-CB 3.77Å; E113-M121 HydrophobicContact CB-CG 3.77Å; E113-M121 HydrophobicContact CG-CB 4.5Å; E113-M121 HydrophobicContact CG-CG 3.98Å; I114-M121 HydrophobicContact CD1-CB 4.38Å; N118-M121 HydrophobicContact CB-CB 4.2Å; N118-M121 HydrophobicContact CB-CG 4.22Å; N118-M121 PolarHBondContact O-N 3.01Å; N118-M121 PolarHBondContact OD1-N 3.41Å; M121-G124 PolarHBondContact O-N 3.16Å; M121-M125 WeakPolarHBondContact O-CB 3.04Å; M121-M125 PolarHBondContact O-N 3.18Å
122	T	92.2	Very high	91.5	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.006	19%	0.191	C	C	.	.	H	α-helix	trans	-67.8	-46.9	177.5	-54.3	0	0	0	0	111	I54 F58 N118 P119 G124 M125 I126	I54-T122 HydrophobicContact CG1-CG2 4.49Å; F58-T122 HydrophobicContact CD2-CG2 4.3Å; N118-T122 WeakPolarHBondContact O-CB 3.35Å; N118-T122 PolarHBondContact O-N 2.87Å; N118-T122 PolarHBondContact O-OG1 3.23Å; P119-T122 PolarHBondContact O-N 3.16Å; T122-G124 PolarHBondContact O-N 3.13Å; T122-M125 PolarHBondContact O-N 2.93Å; T122-I126 WeakPolarHBondContact O-CG1 3.17Å; T122-I126 PolarHBondContact O-N 3.4Å
123	L	91.7	Very high	91.4	Very high	6 Å²	6	33.5 Å²	33.5	3%	0.031	17%	0.174	C	C	.	.	H	α-helix	trans	-62.4	-41.8	175	-67.9	173.4	0	0	0	111.7	E29 Q32 K33 F36 I54 P119 M125 I126 W127	E29-L123 HydrophobicContact CG-CD1 3.8Å; Q32-L123 HydrophobicContact CB-CD1 4.18Å; Q32-L123 HydrophobicContact CB-CD2 4.25Å; K33-L123 HydrophobicContact CG-CD1 4.1Å; K33-L123 HydrophobicContact CG-CD2 3.98Å; K33-L123 HydrophobicContact CG-CG 4.48Å; F36-L123 HydrophobicContact CD2-CB 4.4Å; F36-L123 HydrophobicContact CD2-CD2 3.69Å; F36-L123 HydrophobicContact CE2-CB 4.37Å; F36-L123 HydrophobicContact CE2-CD2 4.35Å; F36-L123 WeakPolarHBondContact CE2-O 2.67Å; I54-L123 HydrophobicContact CD1-CD2 4.38Å; I54-L123 HydrophobicContact CG2-CD2 4.16Å; P119-L123 WeakPolarHBondContact O-CB 3.26Å; P119-L123 VanDerWaalsContact O-CG 3.23Å; P119-L123 WeakPolarHBondContact O-CG 3.02Å; P119-L123 PolarHBondContact O-N 3.45Å; L123-M125 PolarHBondContact O-N 3.33Å; L123-I126 PolarHBondContact O-N 3.2Å; L123-W127 WeakPolarHBondContact O-CB 3.43Å; L123-W127 PolarHBondContact O-N 2.76Å
124	G	90.6	Very high	91.2	Very high	28 Å²	28	30.3 Å²	30.3	29%	0.289	16%	0.161	S	C	.	.	H	α-helix	trans	-60.6	-41.1	175.5	0	0	0	0	0	113.4	K120 M121 T122 T128	K120-G124 PolarHBondContact O-N 3.37Å; M121-G124 PolarHBondContact O-N 3.16Å; T122-G124 PolarHBondContact O-N 3.13Å; G124-T128 PolarHBondContact O-N 3.45Å; G124-T128 PolarHBondContact O-OG1 3.01Å
125	M	93	Very high	91	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.6	-48.9	174.3	-177.9	-169.6	67.7	0	0	111.7	L64 L96 I109 I114 M121 T122 L123 W127 T128 I129	L64-M125 HydrophobicContact CD1-CE 3.58Å; L64-M125 HydrophobicContact CD1-SD 4.25Å; L64-M125 HydrophobicContact CD2-CE 3.66Å; L64-M125 HydrophobicContact CD2-SD 3.61Å; L64-M125 HydrophobicContact CG-CE 4.24Å; L96-M125 HydrophobicContact CD2-CG 4.21Å; L96-M125 HydrophobicContact CD2-SD 3.79Å; I109-M125 HydrophobicContact CD1-CB 4.18Å; I109-M125 HydrophobicContact CG2-CB 4.06Å; I109-M125 HydrophobicContact CG2-CG 4.39Å; I114-M125 HydrophobicContact CD1-CB 4.17Å; I114-M125 HydrophobicContact CD1-CE 4.19Å; I114-M125 HydrophobicContact CD1-SD 3.88Å; I114-M125 HydrophobicContact CG1-SD 4.02Å; I114-M125 HydrophobicContact CG2-CE 4.34Å; M121-M125 WeakPolarHBondContact O-CB 3.04Å; M121-M125 PolarHBondContact O-N 3.18Å; T122-M125 PolarHBondContact O-N 2.93Å; L123-M125 PolarHBondContact O-N 3.33Å; M125-W127 VanDerWaalsContact C-N 3.34Å; M125-W127 PolarHBondContact O-N 2.78Å; M125-T128 WeakPolarHBondContact O-CB 2.66Å; M125-T128 PolarHBondContact O-N 3.19Å; M125-T128 VanDerWaalsContact O-N 3.14Å; M125-I129 HydrophobicContact CG-CD1 4.36Å; M125-I129 WeakPolarHBondContact O-CG1 3.15Å; M125-I129 PolarHBondContact O-N 2.77Å; M125-I129 VanDerWaalsContact O-N 3.07Å
126	I	93.7	Very high	90.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.5	-40	-179.7	-61.7	-62.7	0	0	0	111.2	F36 I54 F58 L64 L67 T122 L123 T128 I129 I130	F36-I126 HydrophobicContact CB-CG2 3.86Å; F36-I126 HydrophobicContact CD2-CB 4.18Å; F36-I126 HydrophobicContact CD2-CG2 4.02Å; F36-I126 HydrophobicContact CG-CG2 4.03Å; I54-I126 HydrophobicContact CD1-CG1 4.05Å; I54-I126 HydrophobicContact CD1-CG2 4.47Å; F58-I126 HydrophobicContact CD2-CD1 4.03Å; F58-I126 HydrophobicContact CD2-CG1 4.42Å; F58-I126 HydrophobicContact CE2-CD1 3.49Å; F58-I126 VanDerWaalsContact CE2-CD1 3.49Å; F58-I126 HydrophobicContact CE2-CG1 4.05Å; F58-I126 HydrophobicContact CZ-CD1 3.95Å; L64-I126 HydrophobicContact CD1-CD1 4.3Å; L67-I126 HydrophobicContact CD2-CD1 4.34Å; T122-I126 WeakPolarHBondContact O-CG1 3.17Å; T122-I126 PolarHBondContact O-N 3.4Å; L123-I126 PolarHBondContact O-N 3.2Å; I126-T128 VanDerWaalsContact C-N 3.29Å; I126-T128 PolarHBondContact O-N 3.01Å; I126-I129 HydrophobicContact CD1-CD1 4.21Å; I126-I129 WeakPolarHBondContact O-CB 3.42Å; I126-I129 PolarHBondContact O-N 3.22Å; I126-I130 HydrophobicContact CG2-CD1 3.98Å; I126-I130 HydrophobicContact CG2-CG1 4.4Å; I126-I130 WeakPolarHBondContact O-CG1 3.14Å; I126-I130 PolarHBondContact O-N 2.67Å
127	W	92.5	Very high	90.1	Very high	36 Å²	36	36 Å²	36	14%	0.136	19%	0.188	C	C	.	.	H	α-helix	trans	-57.4	-43.4	172.6	173.3	-114.3	0	0	0	112.1	F36 L123 M125 I129 I130 L131 I135 Q235 M238	F36-W127 HydrophobicContact CE1-CE3 4.17Å; F36-W127 HydrophobicContact CE2-CB 3.91Å; F36-W127 HydrophobicContact CZ-CB 3.98Å; F36-W127 HydrophobicContact CZ-CD2 4.44Å; F36-W127 AromaticContact CZ-CE3 3.83Å; F36-W127 HydrophobicContact CZ-CE3 3.83Å; L123-W127 WeakPolarHBondContact O-CB 3.43Å; L123-W127 PolarHBondContact O-N 2.76Å; M125-W127 VanDerWaalsContact C-N 3.34Å; M125-W127 PolarHBondContact O-N 2.78Å; W127-I129 VanDerWaalsContact C-N 3.29Å; W127-I129 PolarHBondContact O-N 3.03Å; W127-I130 HydrophobicContact CE3-CB 4.46Å; W127-I130 HydrophobicContact CE3-CG2 4.44Å; W127-I130 HydrophobicContact CZ3-CG2 4.31Å; W127-I130 PolarHBondContact O-N 2.65Å; W127-L131 HydrophobicContact CZ2-CD1 4.39Å; W127-L131 WeakPolarHBondContact O-CB 2.87Å; W127-L131 PolarHBondContact O-N 2.84Å; W127-I135 HydrophobicContact CH2-CD1 4.19Å; W127-I135 HydrophobicContact CZ3-CD1 4.42Å; W127-Q235 HydrophobicContact CD2-CB 4.07Å; W127-Q235 HydrophobicContact CD2-CG 3.88Å; W127-Q235 HydrophobicContact CE3-CB 3.68Å; W127-Q235 HydrophobicContact CE3-CG 4.01Å; W127-Q235 HydrophobicContact CH2-CB 3.94Å; W127-Q235 HydrophobicContact CH2-CG 3.94Å; W127-Q235 HydrophobicContact CZ2-CB 4.31Å; W127-Q235 HydrophobicContact CZ2-CG 3.81Å; W127-Q235 HydrophobicContact CZ3-CB 3.61Å; W127-Q235 HydrophobicContact CZ3-CG 4.04Å; W127-Q235 WeakPolarHBondContact CZ3-O 3.47Å; W127-M238 HydrophobicContact CH2-CB 4.09Å; W127-M238 HydrophobicContact CH2-CE 4.05Å; W127-M238 HydrophobicContact CH2-SD 4.05Å; W127-M238 HydrophobicContact CZ2-CE 4.48Å; W127-M238 HydrophobicContact CZ3-CB 4.49Å
128	T	91	Very high	89.7	Confident	30 Å²	30	35.2 Å²	35.2	18%	0.184	18%	0.18	C	C	.	.	H	α-helix	trans	-63.3	-37.8	179.1	-49.1	0	0	0	0	111.6	V104 L106 G124 M125 I126 R132	V104-T128 HydrophobicContact CG1-CG2 3.12Å; L106-T128 HydrophobicContact CD2-CG2 4.33Å; G124-T128 PolarHBondContact O-N 3.45Å; G124-T128 PolarHBondContact O-OG1 3.01Å; M125-T128 WeakPolarHBondContact O-CB 2.66Å; M125-T128 PolarHBondContact O-N 3.19Å; M125-T128 VanDerWaalsContact O-N 3.14Å; I126-T128 VanDerWaalsContact C-N 3.29Å; I126-T128 PolarHBondContact O-N 3.01Å; T128-R132 WeakPolarHBondContact O-CB 3.11Å; T128-R132 PolarHBondContact O-N 3.38Å
129	I	91.9	Very high	89	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.8	-46.8	174.2	-63.1	168.6	0	0	0	110.6	W39 L64 L68 I71 I99 M125 I126 W127 L131 R132 F133	W39-I129 HydrophobicContact CH2-CG2 4.09Å; W39-I129 HydrophobicContact CZ3-CG2 4.32Å; L64-I129 HydrophobicContact CD1-CD1 3.89Å; L68-I129 HydrophobicContact CD2-CD1 4.08Å; L68-I129 HydrophobicContact CD2-CG1 4.29Å; L68-I129 HydrophobicContact CD2-CG2 4.17Å; I71-I129 HydrophobicContact CD1-CG2 4.29Å; I99-I129 HydrophobicContact CD1-CD1 3.68Å; I99-I129 HydrophobicContact CD1-CG1 3.69Å; I99-I129 HydrophobicContact CG1-CG1 4.23Å; M125-I129 HydrophobicContact CG-CD1 4.36Å; M125-I129 WeakPolarHBondContact O-CG1 3.15Å; M125-I129 PolarHBondContact O-N 2.77Å; M125-I129 VanDerWaalsContact O-N 3.07Å; I126-I129 HydrophobicContact CD1-CD1 4.21Å; I126-I129 WeakPolarHBondContact O-CB 3.42Å; I126-I129 PolarHBondContact O-N 3.22Å; W127-I129 VanDerWaalsContact C-N 3.29Å; W127-I129 PolarHBondContact O-N 3.03Å; I129-L131 VanDerWaalsContact C-N 3.34Å; I129-L131 PolarHBondContact O-N 2.77Å; I129-R132 PolarHBondContact O-N 2.71Å; I129-F133 HydrophobicContact CG2-CD2 3.84Å; I129-F133 HydrophobicContact CG2-CE2 4.36Å; I129-F133 WeakPolarHBondContact O-CD2 3.06Å; I129-F133 PolarHBondContact O-N 3.35Å
130	I	92.4	Very high	88.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58.7	-48.1	176.9	-67.6	168.8	0	0	0	110.3	F36 W39 I126 W127 R132 A134 I135 A239	F36-I130 HydrophobicContact CD1-CD1 3.6Å; F36-I130 HydrophobicContact CE1-CD1 3.83Å; F36-I130 HydrophobicContact CG-CD1 4.11Å; F36-I130 HydrophobicContact CZ-CD1 4.49Å; W39-I130 HydrophobicContact CD2-CD1 3.91Å; W39-I130 HydrophobicContact CD2-CG1 3.61Å; W39-I130 HydrophobicContact CE3-CD1 3.92Å; W39-I130 HydrophobicContact CE3-CG1 3.56Å; W39-I130 HydrophobicContact CG-CD1 4.19Å; W39-I130 HydrophobicContact CG-CG1 4.33Å; W39-I130 HydrophobicContact CH2-CB 4.43Å; W39-I130 HydrophobicContact CH2-CG1 3.62Å; W39-I130 HydrophobicContact CZ2-CB 4.38Å; W39-I130 HydrophobicContact CZ2-CG1 3.73Å; W39-I130 HydrophobicContact CZ3-CD1 4.37Å; W39-I130 HydrophobicContact CZ3-CG1 3.56Å; I126-I130 HydrophobicContact CG2-CD1 3.98Å; I126-I130 HydrophobicContact CG2-CG1 4.4Å; I126-I130 WeakPolarHBondContact O-CG1 3.14Å; I126-I130 PolarHBondContact O-N 2.67Å; W127-I130 HydrophobicContact CE3-CB 4.46Å; W127-I130 HydrophobicContact CE3-CG2 4.44Å; W127-I130 HydrophobicContact CZ3-CG2 4.31Å; W127-I130 PolarHBondContact O-N 2.65Å; I130-R132 VanDerWaalsContact C-N 3.33Å; I130-R132 PolarHBondContact O-N 3.29Å; I130-A134 HydrophobicContact CG2-CB 4.32Å; I130-A134 WeakPolarHBondContact O-CA 3.24Å; I130-A134 VanDerWaalsContact O-CB 3.29Å; I130-A134 WeakPolarHBondContact O-CB 2.85Å; I130-A134 PolarHBondContact O-N 3.07Å; I130-I135 HydrophobicContact CG2-CD1 4.18Å; I130-I135 PolarHBondContact O-N 3Å; I130-A239 HydrophobicContact CD1-CB 4.23Å; I130-A239 HydrophobicContact CG2-CB 3.97Å
131	L	90.7	Very high	87.3	Confident	63 Å²	63	39.8 Å²	39.8	33%	0.33	20%	0.199	S	C	.	.	I	π-helix	trans	-57.3	-48.3	179.8	-176.2	64.9	0	0	0	110.5	W127 I129 I135 Q136	W127-L131 HydrophobicContact CZ2-CD1 4.39Å; W127-L131 WeakPolarHBondContact O-CB 2.87Å; W127-L131 PolarHBondContact O-N 2.84Å; I129-L131 VanDerWaalsContact C-N 3.34Å; I129-L131 PolarHBondContact O-N 2.77Å; L131-I135 HydrophobicContact CD1-CB 4.31Å; L131-I135 HydrophobicContact CD1-CG2 4.29Å; L131-I135 PolarHBondContact O-N 2.73Å; L131-Q136 VanDerWaalsContact O-CB 3.31Å; L131-Q136 WeakPolarHBondContact O-CB 3.36Å; L131-Q136 PolarHBondContact O-N 3.28Å
132	R	89.1	Confident	86.4	Confident	67 Å²	67	46.2 Å²	46.2	25%	0.253	23%	0.234	S	C	.	.	I	π-helix	trans	-67.7	-50.6	-178.3	-179	57.5	173.5	144.9	-3.3	113.2	K102 V104 T128 I129 I130 Q136	K102-R132 PolarHBondContact O-NE 3.21Å; K102-R132 PolarHBondContact O-NH2 3.07Å; V104-R132 HydrophobicContact CG2-CB 3.68Å; V104-R132 HydrophobicContact CG2-CG 3.49Å; V104-R132 VanDerWaalsContact CG2-CG 3.49Å; T128-R132 WeakPolarHBondContact O-CB 3.11Å; T128-R132 PolarHBondContact O-N 3.38Å; I129-R132 PolarHBondContact O-N 2.71Å; I130-R132 VanDerWaalsContact C-N 3.33Å; I130-R132 PolarHBondContact O-N 3.29Å; R132-Q136 VanDerWaalsContact NH1-CD 3.27Å; R132-Q136 WeakPolarHBondContact O-CB 3.2Å
133	F	89.4	Confident	85.5	Confident	42 Å²	42	47.6 Å²	47.6	18%	0.184	24%	0.243	C	C	.	.	I	π-helix	trans	-96.7	-17.5	-166.7	-70.7	-83.5	0	0	0	114.4	L68 I71 F98 K102 I129	L68-F133 HydrophobicContact CD2-CE2 4.2Å; I71-F133 HydrophobicContact CG2-CB 3.33Å; I71-F133 HydrophobicContact CG2-CD1 3.79Å; I71-F133 HydrophobicContact CG2-CD2 4.33Å; I71-F133 HydrophobicContact CG2-CG 3.58Å; F98-F133 HydrophobicContact CE1-CZ 4.13Å; K102-F133 HydrophobicContact CB-CZ 4.34Å; K102-F133 HydrophobicContact CG-CE1 4.49Å; K102-F133 HydrophobicContact CG-CZ 3.98Å; I129-F133 HydrophobicContact CG2-CD2 3.84Å; I129-F133 HydrophobicContact CG2-CE2 4.36Å; I129-F133 WeakPolarHBondContact O-CD2 3.06Å; I129-F133 PolarHBondContact O-N 3.35Å
134	A	88.6	Confident	85.2	Confident	7 Å²	7	50.1 Å²	50.1	6%	0.058	26%	0.262	C	S	.	.	I	π-helix	trans	-113.2	-25.8	179.4	0	0	0	0	0	113.5	W39 I130 H246	W39-A134 HydrophobicContact CZ2-CB 4.14Å; I130-A134 HydrophobicContact CG2-CB 4.32Å; I130-A134 WeakPolarHBondContact O-CA 3.24Å; I130-A134 VanDerWaalsContact O-CB 3.29Å; I130-A134 WeakPolarHBondContact O-CB 2.85Å; I130-A134 PolarHBondContact O-N 3.07Å; A134-H246 PolarHBondContact O-NE2 2.93Å
135	I	88.6	Confident	84.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.256	C	S	.	.	I	π-helix	trans	-114.4	-41.5	-172.2	-58.8	177.5	0	0	0	112.1	W127 I130 L131 D137 I138 A145 M238	W127-I135 HydrophobicContact CH2-CD1 4.19Å; W127-I135 HydrophobicContact CZ3-CD1 4.42Å; I130-I135 HydrophobicContact CG2-CD1 4.18Å; I130-I135 PolarHBondContact O-N 3Å; L131-I135 HydrophobicContact CD1-CB 4.31Å; L131-I135 HydrophobicContact CD1-CG2 4.29Å; L131-I135 PolarHBondContact O-N 2.73Å; I135-D137 PolarHBondContact O-N 3.3Å; I135-D137 VanDerWaalsContact O-N 3.11Å; I135-I138 VanDerWaalsContact O-CB 3.23Å; I135-I138 WeakPolarHBondContact O-CB 2.73Å; I135-I138 VanDerWaalsContact O-CG1 3.25Å; I135-I138 WeakPolarHBondContact O-CG1 3.21Å; I135-I138 PolarHBondContact O-N 3.4Å; I135-A145 HydrophobicContact CG2-CB 4.3Å; I135-A145 WeakPolarHBondContact O-CB 2.99Å; I135-M238 HydrophobicContact CD1-CB 4.05Å; I135-M238 HydrophobicContact CD1-CE 3.97Å; I135-M238 HydrophobicContact CG2-CE 4.35Å
136	Q	85.4	Confident	84.6	Confident	88 Å²	88	54.3 Å²	54.3	41%	0.411	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-29.4	-169	-167.5	164.4	-3.9	0	0	114.3	L131 R132 I138	L131-Q136 VanDerWaalsContact O-CB 3.31Å; L131-Q136 WeakPolarHBondContact O-CB 3.36Å; L131-Q136 PolarHBondContact O-N 3.28Å; R132-Q136 VanDerWaalsContact NH1-CD 3.27Å; R132-Q136 WeakPolarHBondContact O-CB 3.2Å; Q136-I138 PolarHBondContact O-N 3.47Å
137	D	80.8	Confident	84.4	Confident	117 Å²	117	59.6 Å²	59.6	63%	0.626	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	2.2	179.3	-60.9	-14.5	0	0	0	113.2	I135 Q139	I135-D137 PolarHBondContact O-N 3.3Å; I135-D137 VanDerWaalsContact O-N 3.11Å; D137-Q139 VanDerWaalsContact C-N 3.35Å; D137-Q139 PolarHBondContact O-N 2.98Å; D137-Q139 VanDerWaalsContact O-N 3.09Å
138	I	81.4	Confident	84.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.294	C	S	.	.			trans	-82.1	82.5	174.8	-54.9	-179.3	0	0	0	108.5	I135 Q136 I140 A145 L149 Y245	I135-I138 VanDerWaalsContact O-CB 3.23Å; I135-I138 WeakPolarHBondContact O-CB 2.73Å; I135-I138 VanDerWaalsContact O-CG1 3.25Å; I135-I138 WeakPolarHBondContact O-CG1 3.21Å; I135-I138 PolarHBondContact O-N 3.4Å; Q136-I138 PolarHBondContact O-N 3.47Å; I138-I140 HydrophobicContact CG2-CD1 4.29Å; I138-A145 WeakPolarHBondContact O-CA 3.29Å; I138-L149 HydrophobicContact CD1-CB 4.4Å; I138-L149 HydrophobicContact CD1-CD1 3.99Å; I138-L149 HydrophobicContact CG2-CB 4.37Å; I138-Y245 HydrophobicContact CB-CE1 4.19Å; I138-Y245 HydrophobicContact CD1-CD1 3.48Å; I138-Y245 VanDerWaalsContact CD1-CD1 3.48Å; I138-Y245 HydrophobicContact CD1-CE1 3.93Å; I138-Y245 HydrophobicContact CD1-CG 3.84Å; I138-Y245 HydrophobicContact CG1-CD1 3.66Å; I138-Y245 HydrophobicContact CG1-CE1 3.57Å; I138-Y245 HydrophobicContact CG1-CG 4.4Å; I138-Y245 HydrophobicContact CG2-CD1 4.31Å; I138-Y245 HydrophobicContact CG2-CD2 4.28Å; I138-Y245 HydrophobicContact CG2-CE1 3.89Å; I138-Y245 HydrophobicContact CG2-CE2 3.89Å; I138-Y245 HydrophobicContact CG2-CG 4.48Å
139	Q	75.4	Confident	84.2	Confident	158 Å²	158	56.4 Å²	56.4	74%	0.738	29%	0.285	S	S	*	.			trans	-97.4	115.6	171.4	-74.3	-176.4	-24.1	0	0	110.2	D137	D137-Q139 VanDerWaalsContact C-N 3.35Å; D137-Q139 PolarHBondContact O-N 2.98Å; D137-Q139 VanDerWaalsContact O-N 3.09Å
140	I	72.1	Confident	84.3	Confident	26 Å²	26	58 Å²	58	13%	0.133	29%	0.293	C	S	.	.			trans	-126	109.5	172.5	-65.1	173.1	0	0	0	105.6	I138 S143 G148 L151 W152 Y245	I138-I140 HydrophobicContact CG2-CD1 4.29Å; I140-S143 PolarHBondContact O-OG 3.41Å; I140-G148 WeakPolarHBondContact CD1-O 3.42Å; I140-L151 HydrophobicContact CG2-CD2 3.92Å; I140-L151 HydrophobicContact CG2-CG 4.48Å; I140-W152 HydrophobicContact CD1-CB 3.57Å; I140-W152 HydrophobicContact CD1-CG 4.21Å; I140-Y245 HydrophobicContact CD1-CE2 3.95Å
141	E	70.8	Confident	84.2	Confident	121 Å²	121	59.8 Å²	59.8	57%	0.565	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	-163.2	-171.9	-58.2	170.1	-179.9	0	0	110.7	S143 R155	E141-S143 PolarHBondContact O-N 2.99Å; E141-R155 VanDerWaalsContact CD-NH2 3.26Å; E141-R155 IonicContact OE1-CZ 3.56Å; E141-R155 IonicContact OE1-NH1 3.46Å; E141-R155 PolarHBondContact OE1-NH1 3.26Å; E141-R155 IonicContact OE1-NH2 2.79Å; E141-R155 PolarHBondContact OE1-NH2 3.47Å; E141-R155 IonicContact OE2-NH2 3.53Å; E141-R155 PolarHBondContact OE2-NH2 3.5Å
142	D	72.4	Confident	84.2	Confident	181 Å²	181	57.8 Å²	57.8	97%	0.968	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	27.4	-178.4	-56.3	-44.1	0	0	0	112.9
143	S	74.4	Confident	84.4	Confident	29 Å²	29	54.6 Å²	54.6	20%	0.203	28%	0.279	C	S	.	.			trans	-94.2	151.4	-175.8	71.2	0	0	0	0	112.5	I140 E141 G148	I140-S143 PolarHBondContact O-OG 3.41Å; E141-S143 PolarHBondContact O-N 2.99Å; S143-G148 VanDerWaalsContact OG-CA 3.24Å; S143-G148 WeakPolarHBondContact OG-CA 2.83Å; S143-G148 PolarHBondContact OG-N 3.18Å
144	S	84.3	Confident	84.6	Confident	60 Å²	60	56 Å²	56	42%	0.42	29%	0.286	S	S	.	.			trans	-62.2	155.9	172.7	68.4	0	0	0	0	110.6	K146 E147 G148	S144-K146 PolarHBondContact O-N 2.95Å; S144-K146 VanDerWaalsContact O-N 3.07Å; S144-E147 WeakPolarHBondContact CB-OE2 3.11Å; S144-E147 PolarHBondContact N-OE2 3.22Å; S144-E147 CarbonylContact O-C 3.48Å; S144-E147 WeakPolarHBondContact O-CA 2.84Å; S144-E147 WeakPolarHBondContact O-CB 3.18Å; S144-E147 PolarHBondContact O-N 3.42Å; S144-E147 VanDerWaalsContact OG-CG 3.27Å; S144-E147 WeakPolarHBondContact OG-CG 3.18Å; S144-E147 PolarHBondContact OG-OE2 3.46Å; S144-G148 PolarHBondContact O-N 2.87Å
145	A	83.8	Confident	84.7	Confident	20 Å²	20	61.4 Å²	61.4	17%	0.165	31%	0.305	C	S	.	.	H	α-helix	trans	-52.5	-37.6	-176.9	0	0	0	0	0	115.2	I135 I138 L149	I135-A145 HydrophobicContact CG2-CB 4.3Å; I135-A145 WeakPolarHBondContact O-CB 2.99Å; I138-A145 WeakPolarHBondContact O-CA 3.29Å; A145-L149 PolarHBondContact O-N 3.35Å
146	K	88.5	Confident	84.8	Confident	95 Å²	95	62.9 Å²	62.9	41%	0.413	31%	0.312	S	S	.	.	H	α-helix	trans	-67.9	-45.1	175.8	174.4	177.1	161.8	171.2	0	111.3	S144 L149 L150 F168 E234 M238	S144-K146 PolarHBondContact O-N 2.95Å; S144-K146 VanDerWaalsContact O-N 3.07Å; K146-L149 PolarHBondContact O-N 3.17Å; K146-L150 PolarHBondContact O-N 3.31Å; K146-L150 VanDerWaalsContact O-N 3.08Å; K146-F168 HydrophobicContact CG-CE2 3.85Å; K146-E234 WeakPolarHBondContact CE-OE1 3.36Å; K146-E234 IonicContact NZ-OE1 2.7Å; K146-E234 PolarHBondContact NZ-OE1 3.04Å; K146-E234 IonicContact NZ-OE2 3.37Å; K146-M238 HydrophobicContact CB-CE 4.11Å; K146-M238 HydrophobicContact CD-CE 4.16Å; K146-M238 HydrophobicContact CD-SD 4.33Å; K146-M238 HydrophobicContact CG-CE 3.8Å; K146-M238 HydrophobicContact CG-SD 4.37Å
147	E	88.7	Confident	85.2	Confident	111 Å²	111	58.8 Å²	58.8	52%	0.519	29%	0.293	S	S	.	.	H	α-helix	trans	-66.9	-39.2	177.2	-70.3	166.1	153.3	0	0	111.3	S144 L149 L150 L151	S144-E147 WeakPolarHBondContact CB-OE2 3.11Å; S144-E147 PolarHBondContact N-OE2 3.22Å; S144-E147 CarbonylContact O-C 3.48Å; S144-E147 WeakPolarHBondContact O-CA 2.84Å; S144-E147 WeakPolarHBondContact O-CB 3.18Å; S144-E147 PolarHBondContact O-N 3.42Å; S144-E147 VanDerWaalsContact OG-CG 3.27Å; S144-E147 WeakPolarHBondContact OG-CG 3.18Å; S144-E147 PolarHBondContact OG-OE2 3.46Å; E147-L149 PolarHBondContact O-N 3.49Å; E147-L150 WeakPolarHBondContact O-CB 3.19Å; E147-L150 PolarHBondContact O-N 2.8Å; E147-L150 VanDerWaalsContact O-N 3.16Å; E147-L151 VanDerWaalsContact O-CB 3.25Å; E147-L151 WeakPolarHBondContact O-CB 3.31Å; E147-L151 PolarHBondContact O-N 3.46Å
148	G	88.7	Confident	85.7	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58.7	-48.2	174.3	0	0	0	0	0	111.5	I140 S143 S144 L150 L151 W152	I140-G148 WeakPolarHBondContact CD1-O 3.42Å; S143-G148 VanDerWaalsContact OG-CA 3.24Å; S143-G148 WeakPolarHBondContact OG-CA 2.83Å; S143-G148 PolarHBondContact OG-N 3.18Å; S144-G148 PolarHBondContact O-N 2.87Å; G148-L150 VanDerWaalsContact C-N 3.32Å; G148-L150 PolarHBondContact O-N 3Å; G148-L151 PolarHBondContact O-N 3.26Å; G148-W152 WeakPolarHBondContact O-CB 3.49Å; G148-W152 PolarHBondContact O-N 3.34Å
149	L	91.8	Very high	86.1	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61.5	-39.3	175	-178.1	60.6	0	0	0	112.2	I138 A145 K146 E147 W152 C153 F168 L241 Y245	I138-L149 HydrophobicContact CD1-CB 4.4Å; I138-L149 HydrophobicContact CD1-CD1 3.99Å; I138-L149 HydrophobicContact CG2-CB 4.37Å; A145-L149 PolarHBondContact O-N 3.35Å; K146-L149 PolarHBondContact O-N 3.17Å; E147-L149 PolarHBondContact O-N 3.49Å; L149-W152 HydrophobicContact CD1-CE3 4.17Å; L149-W152 WeakPolarHBondContact O-CB 3.13Å; L149-W152 PolarHBondContact O-N 3Å; L149-C153 PolarHBondContact O-N 2.99Å; L149-C153 VanDerWaalsContact O-N 3.09Å; L149-C153 PolarHBondContact O-SG 3.39Å; L149-C153 VanDerWaalsContact O-SG 3.38Å; L149-F168 HydrophobicContact CB-CZ 4.2Å; L149-F168 HydrophobicContact CD2-CE1 4.28Å; L149-F168 HydrophobicContact CD2-CZ 4.23Å; L149-F168 HydrophobicContact CG-CE1 4.14Å; L149-F168 HydrophobicContact CG-CZ 4.05Å; L149-L241 HydrophobicContact CD2-CB 4.44Å; L149-Y245 HydrophobicContact CD1-CD2 4.48Å; L149-Y245 HydrophobicContact CD1-CG 4.33Å
150	L	92.8	Very high	87	Confident	33 Å²	33	54.2 Å²	54.2	17%	0.173	29%	0.286	C	S	.	.	H	α-helix	trans	-66.9	-45.9	178	-174.8	64.4	0	0	0	111.3	K146 E147 G148 W152 C153 Q154 V165 F168	K146-L150 PolarHBondContact O-N 3.31Å; K146-L150 VanDerWaalsContact O-N 3.08Å; E147-L150 WeakPolarHBondContact O-CB 3.19Å; E147-L150 PolarHBondContact O-N 2.8Å; E147-L150 VanDerWaalsContact O-N 3.16Å; G148-L150 VanDerWaalsContact C-N 3.32Å; G148-L150 PolarHBondContact O-N 3Å; L150-W152 VanDerWaalsContact C-N 3.29Å; L150-W152 PolarHBondContact O-N 3.41Å; L150-C153 WeakPolarHBondContact O-CB 3.49Å; L150-C153 PolarHBondContact O-N 3.03Å; L150-C153 VanDerWaalsContact O-N 3.12Å; L150-Q154 WeakPolarHBondContact O-CG 3.4Å; L150-Q154 PolarHBondContact O-N 3.38Å; L150-V165 HydrophobicContact CD1-CG1 3.84Å; L150-F168 HydrophobicContact CB-CE1 4.41Å; L150-F168 HydrophobicContact CB-CE2 3.99Å; L150-F168 HydrophobicContact CB-CZ 3.63Å; L150-F168 HydrophobicContact CD1-CD1 4.47Å; L150-F168 HydrophobicContact CD1-CE1 4.11Å; L150-F168 HydrophobicContact CD1-CE2 4.23Å; L150-F168 HydrophobicContact CD1-CZ 3.99Å; L150-F168 HydrophobicContact CG-CZ 4.4Å
151	L	90.1	Very high	87.8	Confident	38 Å²	38	63.2 Å²	63.2	20%	0.199	33%	0.325	C	S	.	.	H	α-helix	trans	-60.9	-39.6	177	-178.9	61	0	0	0	110.9	I140 E147 G148 Q154 R155	I140-L151 HydrophobicContact CG2-CD2 3.92Å; I140-L151 HydrophobicContact CG2-CG 4.48Å; E147-L151 VanDerWaalsContact O-CB 3.25Å; E147-L151 WeakPolarHBondContact O-CB 3.31Å; E147-L151 PolarHBondContact O-N 3.46Å; G148-L151 PolarHBondContact O-N 3.26Å; L151-Q154 PolarHBondContact O-N 2.95Å; L151-R155 WeakPolarHBondContact O-CB 3.41Å; L151-R155 WeakPolarHBondContact O-CG 3.3Å; L151-R155 PolarHBondContact O-N 3.23Å
152	W	91.4	Very high	88.7	Confident	20 Å²	20	60.6 Å²	60.6	8%	0.076	32%	0.315	C	S	.	.	H	α-helix	trans	-58.5	-51.3	171.2	179.7	82	0	0	0	111.4	I140 G148 L149 L150 Q154 R155 Q156 I181 Y245 F248	I140-W152 HydrophobicContact CD1-CB 3.57Å; I140-W152 HydrophobicContact CD1-CG 4.21Å; G148-W152 WeakPolarHBondContact O-CB 3.49Å; G148-W152 PolarHBondContact O-N 3.34Å; L149-W152 HydrophobicContact CD1-CE3 4.17Å; L149-W152 WeakPolarHBondContact O-CB 3.13Å; L149-W152 PolarHBondContact O-N 3Å; L150-W152 VanDerWaalsContact C-N 3.29Å; L150-W152 PolarHBondContact O-N 3.41Å; W152-Q154 VanDerWaalsContact C-N 3.3Å; W152-Q154 PolarHBondContact O-N 3.3Å; W152-R155 PolarHBondContact O-N 2.99Å; W152-R155 VanDerWaalsContact O-N 3.16Å; W152-Q156 HydrophobicContact CD2-CG 3.9Å; W152-Q156 HydrophobicContact CE3-CG 4.42Å; W152-Q156 HydrophobicContact CG-CG 4.35Å; W152-Q156 HydrophobicContact CH2-CG 4.31Å; W152-Q156 HydrophobicContact CZ2-CG 3.78Å; W152-Q156 VanDerWaalsContact O-CG 3.26Å; W152-Q156 WeakPolarHBondContact O-CG 3.45Å; W152-Q156 PolarHBondContact O-N 2.95Å; W152-I181 HydrophobicContact CH2-CG2 3.63Å; W152-I181 HydrophobicContact CZ2-CG2 4.38Å; W152-I181 HydrophobicContact CZ3-CD1 4.34Å; W152-I181 HydrophobicContact CZ3-CG2 4.2Å; W152-Y245 HydrophobicContact CB-CD2 4.32Å; W152-Y245 HydrophobicContact CB-CE2 4.46Å; W152-Y245 AromaticContact CD1-CD2 3.74Å; W152-Y245 AromaticContact CD1-CE2 3.72Å; W152-Y245 AromaticContact CD2-CD2 3.63Å; W152-Y245 HydrophobicContact CD2-CD2 3.63Å; W152-Y245 HydrophobicContact CD2-CE2 4.37Å; W152-Y245 AromaticContact CE2-CD2 3.74Å; W152-Y245 HydrophobicContact CE3-CD2 4.16Å; W152-Y245 AromaticContact CG-CD2 3.67Å; W152-Y245 HydrophobicContact CG-CD2 3.67Å; W152-Y245 AromaticContact CG-CE2 3.95Å; W152-Y245 HydrophobicContact CG-CE2 3.95Å; W152-Y245 HydrophobicContact CZ2-CD2 4.39Å; W152-Y245 AromaticContact NE1-CD2 3.77Å; W152-F248 HydrophobicContact CH2-CD2 4.18Å; W152-F248 HydrophobicContact CZ2-CB 4.04Å; W152-F248 HydrophobicContact CZ2-CD2 4.2Å
153	C	93.2	Very high	89.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.1	-42.4	177.7	-68.2	0	0	0	0	112.1	L149 L150 Q156 T157 V165 F172 I181	L149-C153 PolarHBondContact O-N 2.99Å; L149-C153 VanDerWaalsContact O-N 3.09Å; L149-C153 PolarHBondContact O-SG 3.39Å; L149-C153 VanDerWaalsContact O-SG 3.38Å; L150-C153 WeakPolarHBondContact O-CB 3.49Å; L150-C153 PolarHBondContact O-N 3.03Å; L150-C153 VanDerWaalsContact O-N 3.12Å; C153-Q156 PolarHBondContact O-N 3.17Å; C153-T157 WeakPolarHBondContact O-CB 3.49Å; C153-T157 WeakPolarHBondContact O-CG2 3.08Å; C153-T157 PolarHBondContact O-N 3.46Å; C153-T157 PolarHBondContact O-OG1 2.73Å; C153-V165 HydrophobicContact CB-CG1 4.03Å; C153-F172 HydrophobicContact CB-CZ 4.06Å; C153-I181 HydrophobicContact CB-CD1 4.41Å
154	Q	93.2	Very high	90.5	Very high	73 Å²	73	55.5 Å²	55.5	34%	0.341	29%	0.292	S	S	.	.	H	α-helix	trans	-60.7	-45.5	175.5	-73.5	171.5	-12.2	0	0	111.7	L150 L151 W152 Q156 T157 A158 V165	L150-Q154 WeakPolarHBondContact O-CG 3.4Å; L150-Q154 PolarHBondContact O-N 3.38Å; L151-Q154 PolarHBondContact O-N 2.95Å; W152-Q154 VanDerWaalsContact C-N 3.3Å; W152-Q154 PolarHBondContact O-N 3.3Å; Q154-Q156 PolarHBondContact O-N 3.49Å; Q154-T157 CarbonylContact O-C 3.32Å; Q154-T157 PolarHBondContact O-N 3.04Å; Q154-T157 PolarHBondContact O-OG1 3.46Å; Q154-A158 WeakPolarHBondContact O-CA 3Å; Q154-A158 WeakPolarHBondContact O-CB 3.36Å; Q154-A158 PolarHBondContact O-N 3.35Å; Q154-V165 HydrophobicContact CG-CB 4.08Å; Q154-V165 HydrophobicContact CG-CG1 4.37Å; Q154-V165 WeakPolarHBondContact CG-O 3.38Å; Q154-V165 PolarHBondContact NE2-O 2.74Å
155	R	90.3	Very high	91	Very high	120 Å²	120	53 Å²	53	45%	0.453	27%	0.274	S	S	.	.	H	α-helix	trans	-64	-40.4	177.2	-74.3	178.4	178.1	-173.1	-2.3	112.7	E141 L151 W152 T157	E141-R155 VanDerWaalsContact CD-NH2 3.26Å; E141-R155 IonicContact OE1-CZ 3.56Å; E141-R155 IonicContact OE1-NH1 3.46Å; E141-R155 PolarHBondContact OE1-NH1 3.26Å; E141-R155 IonicContact OE1-NH2 2.79Å; E141-R155 PolarHBondContact OE1-NH2 3.47Å; E141-R155 IonicContact OE2-NH2 3.53Å; E141-R155 PolarHBondContact OE2-NH2 3.5Å; L151-R155 WeakPolarHBondContact O-CB 3.41Å; L151-R155 WeakPolarHBondContact O-CG 3.3Å; L151-R155 PolarHBondContact O-N 3.23Å; W152-R155 PolarHBondContact O-N 2.99Å; W152-R155 VanDerWaalsContact O-N 3.16Å; R155-T157 VanDerWaalsContact C-N 3.27Å; R155-T157 PolarHBondContact O-N 2.65Å
156	Q	91.4	Very high	91.4	Very high	30 Å²	30	58.4 Å²	58.4	14%	0.14	30%	0.295	C	S	.	.	H	α-helix	trans	-65.7	-33	177.2	-66.8	-61.3	-30.1	0	0	112.1	W152 C153 Q154 I181 R184 N185	W152-Q156 HydrophobicContact CD2-CG 3.9Å; W152-Q156 HydrophobicContact CE3-CG 4.42Å; W152-Q156 HydrophobicContact CG-CG 4.35Å; W152-Q156 HydrophobicContact CH2-CG 4.31Å; W152-Q156 HydrophobicContact CZ2-CG 3.78Å; W152-Q156 VanDerWaalsContact O-CG 3.26Å; W152-Q156 WeakPolarHBondContact O-CG 3.45Å; W152-Q156 PolarHBondContact O-N 2.95Å; C153-Q156 PolarHBondContact O-N 3.17Å; Q154-Q156 PolarHBondContact O-N 3.49Å; Q156-I181 HydrophobicContact CB-CG1 3.97Å; Q156-R184 WeakPolarHBondContact O-CG 3.37Å; Q156-N185 PolarHBondContact OE1-ND2 2.8Å
157	T	92.8	Very high	91.5	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.018	28%	0.284	C	S	.	.	H	α-helix	trans	-99.3	-12.2	-175.3	57.5	0	0	0	0	114.4	C153 Q154 R155 P159 Y160 V163 V165 A180 I181	C153-T157 WeakPolarHBondContact O-CB 3.49Å; C153-T157 WeakPolarHBondContact O-CG2 3.08Å; C153-T157 PolarHBondContact O-N 3.46Å; C153-T157 PolarHBondContact O-OG1 2.73Å; Q154-T157 CarbonylContact O-C 3.32Å; Q154-T157 PolarHBondContact O-N 3.04Å; Q154-T157 PolarHBondContact O-OG1 3.46Å; R155-T157 VanDerWaalsContact C-N 3.27Å; R155-T157 PolarHBondContact O-N 2.65Å; T157-P159 VanDerWaalsContact C-N 3.29Å; T157-P159 VanDerWaalsContact O-N 3.1Å; T157-Y160 WeakPolarHBondContact O-CB 3.31Å; T157-Y160 WeakPolarHBondContact O-CD2 3.26Å; T157-Y160 PolarHBondContact O-N 2.75Å; T157-V163 HydrophobicContact CG2-CG1 3.94Å; T157-V165 HydrophobicContact CG2-CG2 4.13Å; T157-V165 WeakPolarHBondContact OG1-CG2 3.09Å; T157-A180 HydrophobicContact CG2-CB 3.94Å; T157-I181 HydrophobicContact CG2-CD1 4.47Å; T157-I181 HydrophobicContact CG2-CG1 3.84Å
158	A	91.4	Very high	91.7	Very high	81 Å²	81	50.3 Å²	50.3	67%	0.669	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	-35.9	-179.3	0	0	0	0	0	115.3	Q154 Y160	Q154-A158 WeakPolarHBondContact O-CA 3Å; Q154-A158 WeakPolarHBondContact O-CB 3.36Å; Q154-A158 PolarHBondContact O-N 3.35Å; A158-Y160 PolarHBondContact O-N 3.48Å
159	P	91	Very high	91.6	Very high	70 Å²	70	52.8 Å²	52.8	46%	0.455	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-14.8	175.5	-22	35	0	0	0	115.1	T157	T157-P159 VanDerWaalsContact C-N 3.29Å; T157-P159 VanDerWaalsContact O-N 3.1Å
160	Y	93.5	Very high	91.4	Very high	27 Å²	27	55.6 Å²	55.6	11%	0.106	29%	0.289	C	S	.	.			trans	-101	97	-171.4	-59	-95.1	0	0	0	110.9	T157 A158 N162 V163 A180 H183 R184 Y192	T157-Y160 WeakPolarHBondContact O-CB 3.31Å; T157-Y160 WeakPolarHBondContact O-CD2 3.26Å; T157-Y160 PolarHBondContact O-N 2.75Å; A158-Y160 PolarHBondContact O-N 3.48Å; Y160-N162 PolarHBondContact O-N 3.26Å; Y160-V163 PolarHBondContact O-N 2.71Å; Y160-A180 HydrophobicContact CD1-CB 4Å; Y160-A180 HydrophobicContact CD2-CB 3.68Å; Y160-A180 HydrophobicContact CE1-CB 4.17Å; Y160-A180 HydrophobicContact CE2-CB 3.86Å; Y160-A180 HydrophobicContact CG-CB 3.72Å; Y160-A180 PolarHBondContact OH-O 3.48Å; Y160-H183 HydrophobicContact CE1-CB 4.47Å; Y160-H183 AromaticContact CE1-ND1 3.43Å; Y160-H183 WeakPolarHBondContact CE1-ND1 3.32Å; Y160-H183 AromaticContact CZ-ND1 3.52Å; Y160-H183 WeakPolarHBondContact OH-CB 3.23Å; Y160-H183 PolarHBondContact OH-ND1 3.39Å; Y160-R184 HydrophobicContact CE2-CB 4.13Å; Y160-R184 WeakPolarHBondContact OH-CA 2.67Å; Y160-R184 PolarHBondContact OH-N 3.42Å; Y160-Y192 AromaticContact CD1-CD1 3.72Å; Y160-Y192 HydrophobicContact CD1-CD1 3.72Å; Y160-Y192 HydrophobicContact CD1-CD2 4.16Å; Y160-Y192 AromaticContact CD1-CE1 3.44Å; Y160-Y192 HydrophobicContact CD1-CE1 3.44Å; Y160-Y192 VanDerWaalsContact CD1-CE1 3.44Å; Y160-Y192 AromaticContact CD1-CE2 3.92Å; Y160-Y192 HydrophobicContact CD1-CE2 3.92Å; Y160-Y192 HydrophobicContact CD1-CG 4.08Å; Y160-Y192 AromaticContact CD1-CZ 3.55Å; Y160-Y192 AromaticContact CE1-CD1 3.92Å; Y160-Y192 HydrophobicContact CE1-CD1 3.92Å; Y160-Y192 AromaticContact CE1-CD2 3.89Å; Y160-Y192 HydrophobicContact CE1-CD2 3.89Å; Y160-Y192 HydrophobicContact CE1-CE1 4.08Å; Y160-Y192 HydrophobicContact CE1-CE2 4.06Å; Y160-Y192 AromaticContact CE1-CG 3.84Å; Y160-Y192 HydrophobicContact CE1-CG 3.84Å; Y160-Y192 HydrophobicContact CG-CE1 4.41Å
161	K	88.9	Confident	91.4	Very high	215 Å²	215	54.8 Å²	54.8	94%	0.935	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-23	-173.7	-62.2	-176.3	179.5	-178.3	0	115.4
162	N	90.8	Very high	91.6	Very high	67 Å²	67	53 Å²	53	36%	0.358	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	1.9	-179.3	58.9	-48.6	0	0	0	113.6	Y160 L176 Y192	Y160-N162 PolarHBondContact O-N 3.26Å; N162-L176 WeakPolarHBondContact ND2-CD1 3.12Å; N162-Y192 PolarHBondContact ND2-OH 3.37Å; N162-Y192 VanDerWaalsContact ND2-OH 3.08Å; N162-Y192 PolarHBondContact OD1-OH 2.98Å
163	V	92.5	Very high	91.5	Very high	18 Å²	18	54.3 Å²	54.3	11%	0.109	28%	0.283	C	S	.	.			trans	-120.5	127.9	-179.8	-178.5	0	0	0	0	109.5	T157 Y160 V165 L176 A177 A180 Y192	T157-V163 HydrophobicContact CG2-CG1 3.94Å; Y160-V163 PolarHBondContact O-N 2.71Å; V163-V165 HydrophobicContact CG1-CG2 3.89Å; V163-L176 HydrophobicContact CG2-CB 3.8Å; V163-A177 HydrophobicContact CG1-CB 3.79Å; V163-A180 HydrophobicContact CG2-CB 4.24Å; V163-Y192 WeakPolarHBondContact CG2-OH 3.33Å
164	C	92.3	Very high	91.4	Very high	85 Å²	85	55.3 Å²	55.3	57%	0.574	29%	0.288	S	S	*	.			trans	-128.1	114.5	170	-166.4	0	0	0	0	108.1	E166	C164-E166 PolarHBondContact SG-OE1 3.25Å; C164-E166 VanDerWaalsContact SG-OE1 3.39Å
165	V	92.9	Very high	91.4	Very high	7 Å²	7	51.8 Å²	51.8	4%	0.042	27%	0.272	C	S	.	.			trans	-100.3	107.2	-179.4	-177.9	0	0	0	0	109.7	L150 C153 Q154 T157 V163 F172 A177	L150-V165 HydrophobicContact CD1-CG1 3.84Å; C153-V165 HydrophobicContact CB-CG1 4.03Å; Q154-V165 HydrophobicContact CG-CB 4.08Å; Q154-V165 HydrophobicContact CG-CG1 4.37Å; Q154-V165 WeakPolarHBondContact CG-O 3.38Å; Q154-V165 PolarHBondContact NE2-O 2.74Å; T157-V165 HydrophobicContact CG2-CG2 4.13Å; T157-V165 WeakPolarHBondContact OG1-CG2 3.09Å; V163-V165 HydrophobicContact CG1-CG2 3.89Å; V165-F172 HydrophobicContact CG1-CE2 3.69Å; V165-F172 HydrophobicContact CG1-CZ 3.69Å; V165-F172 HydrophobicContact CG2-CZ 4.31Å; V165-A177 HydrophobicContact CG2-CB 4.14Å
166	E	92.6	Very high	91.6	Very high	133 Å²	133	46.1 Å²	46.1	62%	0.621	25%	0.25	S	S	*	.			trans	-115.3	-24.2	-179.8	-67	173.9	-172.1	0	0	112.4	C164 S171	C164-E166 PolarHBondContact SG-OE1 3.25Å; C164-E166 VanDerWaalsContact SG-OE1 3.39Å; E166-S171 PolarHBondContact N-OG 2.85Å
167	N	92.1	Very high	91.8	Very high	34 Å²	34	44.7 Å²	44.7	18%	0.182	24%	0.244	C	C	.	.			trans	-155.7	163.7	-174.6	53	54.9	0	0	0	111.2	H169 T170 S171 F172	N167-H169 VanDerWaalsContact C-N 3.31Å; N167-H169 PolarHBondContact ND2-CE1 2.76Å; N167-H169 PolarHBondContact O-N 3.26Å; N167-H169 PolarHBondContact OD1-N 3.42Å; N167-H169 PolarHBondContact OD1-ND1 3.12Å; N167-T170 VanDerWaalsContact CG-OG1 3.32Å; N167-T170 PolarHBondContact ND2-OG1 2.72Å; N167-T170 VanDerWaalsContact ND2-OG1 3.09Å; N167-T170 PolarHBondContact OD1-N 2.81Å; N167-T170 PolarHBondContact OD1-OG1 3.33Å; N167-S171 PolarHBondContact N-OG 2.84Å; N167-S171 VanDerWaalsContact O-CB 3.23Å; N167-S171 WeakPolarHBondContact O-CB 3.46Å; N167-S171 PolarHBondContact O-OG 2.97Å; N167-S171 VanDerWaalsContact O-OG 3.09Å; N167-S171 PolarHBondContact OD1-N 3.13Å; N167-S171 PolarHBondContact OD1-OG 2.86Å; N167-F172 WeakPolarHBondContact O-CD2 3.43Å; N167-F172 WeakPolarHBondContact O-CE2 3.41Å
168	F	91.9	Very high	91.9	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.009	24%	0.243	C	C	.	.	S	Bend	trans	-83.7	3.2	179.6	-66.7	-64.3	0	0	0	114.5	K146 L149 L150 F172 E234 V237 M238 L241	K146-F168 HydrophobicContact CG-CE2 3.85Å; L149-F168 HydrophobicContact CB-CZ 4.2Å; L149-F168 HydrophobicContact CD2-CE1 4.28Å; L149-F168 HydrophobicContact CD2-CZ 4.23Å; L149-F168 HydrophobicContact CG-CE1 4.14Å; L149-F168 HydrophobicContact CG-CZ 4.05Å; L150-F168 HydrophobicContact CB-CE1 4.41Å; L150-F168 HydrophobicContact CB-CE2 3.99Å; L150-F168 HydrophobicContact CB-CZ 3.63Å; L150-F168 HydrophobicContact CD1-CD1 4.47Å; L150-F168 HydrophobicContact CD1-CE1 4.11Å; L150-F168 HydrophobicContact CD1-CE2 4.23Å; L150-F168 HydrophobicContact CD1-CZ 3.99Å; L150-F168 HydrophobicContact CG-CZ 4.4Å; F168-F172 HydrophobicContact CD1-CE2 4.15Å; F168-E234 HydrophobicContact CB-CB 4.42Å; F168-E234 HydrophobicContact CB-CG 3.89Å; F168-V237 HydrophobicContact CB-CG1 4.41Å; F168-V237 WeakPolarHBondContact O-CB 3.46Å; F168-V237 WeakPolarHBondContact O-CG1 3.28Å; F168-V237 WeakPolarHBondContact O-CG2 3.44Å; F168-M238 HydrophobicContact CB-CG 3.95Å; F168-M238 HydrophobicContact CD1-CG 3.91Å; F168-M238 HydrophobicContact CD2-CG 3.52Å; F168-M238 HydrophobicContact CD2-SD 3.78Å; F168-M238 HydrophobicContact CE1-CG 4.25Å; F168-M238 HydrophobicContact CE2-CE 4.45Å; F168-M238 HydrophobicContact CE2-CG 3.9Å; F168-M238 HydrophobicContact CE2-SD 4.09Å; F168-M238 HydrophobicContact CG-CG 3.51Å; F168-M238 HydrophobicContact CG-SD 4.35Å; F168-M238 HydrophobicContact CZ-CG 4.23Å; F168-L241 HydrophobicContact CD1-CD1 3.59Å; F168-L241 HydrophobicContact CE1-CD1 3.81Å
169	H	85.7	Confident	92.2	Very high	53 Å²	53	40.7 Å²	40.7	25%	0.245	21%	0.211	C	C	.	.	S	Bend	trans	-107	-76.5	177.7	51.3	81.8	0	0	0	111.9	N167 S171 C232	N167-H169 VanDerWaalsContact C-N 3.31Å; N167-H169 PolarHBondContact ND2-CE1 2.76Å; N167-H169 PolarHBondContact O-N 3.26Å; N167-H169 PolarHBondContact OD1-N 3.42Å; N167-H169 PolarHBondContact OD1-ND1 3.12Å; H169-S171 PolarHBondContact O-N 3.18Å; H169-C232 VanDerWaalsContact CB-O 3.29Å; H169-C232 WeakPolarHBondContact CB-O 3.47Å
170	T	89.1	Confident	92.4	Very high	59 Å²	59	37.3 Å²	37.3	36%	0.362	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-75.1	-28.1	-169.4	40.3	0	0	0	0	113.2	N167 F172 K173	N167-T170 VanDerWaalsContact CG-OG1 3.32Å; N167-T170 PolarHBondContact ND2-OG1 2.72Å; N167-T170 VanDerWaalsContact ND2-OG1 3.09Å; N167-T170 PolarHBondContact OD1-N 2.81Å; N167-T170 PolarHBondContact OD1-OG1 3.33Å; T170-F172 VanDerWaalsContact C-N 3.25Å; T170-F172 PolarHBondContact O-N 3.02Å; T170-K173 WeakPolarHBondContact O-CB 3.37Å; T170-K173 PolarHBondContact O-N 2.57Å
171	S	92.7	Very high	92.4	Very high	16 Å²	16	36.1 Å²	36.1	11%	0.112	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-69.7	-22.4	-175.3	-49	0	0	0	0	113.8	E166 N167 H169	E166-S171 PolarHBondContact N-OG 2.85Å; N167-S171 PolarHBondContact N-OG 2.84Å; N167-S171 VanDerWaalsContact O-CB 3.23Å; N167-S171 WeakPolarHBondContact O-CB 3.46Å; N167-S171 PolarHBondContact O-OG 2.97Å; N167-S171 VanDerWaalsContact O-OG 3.09Å; N167-S171 PolarHBondContact OD1-N 3.13Å; N167-S171 PolarHBondContact OD1-OG 2.86Å; H169-S171 PolarHBondContact O-N 3.18Å
172	F	92.9	Very high	92.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-100.3	-1.3	-177.9	-69	-89.2	0	0	0	113.1	C153 V165 N167 F168 T170 D174 G175 A177 F178 I181 M226 V237 L241	C153-F172 HydrophobicContact CB-CZ 4.06Å; V165-F172 HydrophobicContact CG1-CE2 3.69Å; V165-F172 HydrophobicContact CG1-CZ 3.69Å; V165-F172 HydrophobicContact CG2-CZ 4.31Å; N167-F172 WeakPolarHBondContact O-CD2 3.43Å; N167-F172 WeakPolarHBondContact O-CE2 3.41Å; F168-F172 HydrophobicContact CD1-CE2 4.15Å; T170-F172 VanDerWaalsContact C-N 3.25Å; T170-F172 PolarHBondContact O-N 3.02Å; F172-D174 PolarHBondContact O-N 2.84Å; F172-G175 PolarHBondContact O-N 3.47Å; F172-A177 HydrophobicContact CD1-CB 3.58Å; F172-A177 HydrophobicContact CE1-CB 3.74Å; F172-A177 HydrophobicContact CG-CB 4.32Å; F172-F178 HydrophobicContact CB-CD2 4.37Å; F172-F178 HydrophobicContact CB-CE2 3.78Å; F172-F178 HydrophobicContact CB-CZ 4.31Å; F172-F178 HydrophobicContact CD1-CD1 4.5Å; F172-F178 HydrophobicContact CD1-CD2 4.14Å; F172-F178 HydrophobicContact CD1-CE1 4.28Å; F172-F178 AromaticContact CD1-CE2 3.92Å; F172-F178 HydrophobicContact CD1-CE2 3.92Å; F172-F178 HydrophobicContact CD1-CG 4.42Å; F172-F178 AromaticContact CD1-CZ 3.98Å; F172-F178 HydrophobicContact CD1-CZ 3.98Å; F172-F178 HydrophobicContact CG-CE2 4.25Å; F172-F178 HydrophobicContact CG-CZ 4.42Å; F172-I181 HydrophobicContact CE1-CD1 4.16Å; F172-M226 HydrophobicContact CB-CE 4.43Å; F172-V237 HydrophobicContact CB-CG1 4.37Å; F172-V237 HydrophobicContact CD2-CG1 4.08Å; F172-V237 HydrophobicContact CG-CG1 4.16Å; F172-L241 HydrophobicContact CD1-CD1 4.24Å; F172-L241 HydrophobicContact CD1-CD2 4.23Å; F172-L241 HydrophobicContact CD2-CD1 4.3Å; F172-L241 HydrophobicContact CE1-CD1 3.68Å; F172-L241 HydrophobicContact CE1-CD2 3.62Å; F172-L241 HydrophobicContact CE1-CG 4.25Å; F172-L241 HydrophobicContact CE2-CD1 3.74Å; F172-L241 HydrophobicContact CZ-CD1 3.4Å; F172-L241 HydrophobicContact CZ-CD2 4.11Å; F172-L241 HydrophobicContact CZ-CG 4.4Å
173	K	90.7	Very high	92.9	Very high	48 Å²	48	25 Å²	25	21%	0.209	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-33.6	-170	-179.7	173.2	176.5	179.9	0	114.3	T170 G175 A227 R229	T170-K173 WeakPolarHBondContact O-CB 3.37Å; T170-K173 PolarHBondContact O-N 2.57Å; K173-G175 VanDerWaalsContact C-N 3.26Å; K173-G175 PolarHBondContact O-N 3.26Å; K173-A227 WeakPolarHBondContact CE-O 3.49Å; K173-R229 VanDerWaalsContact CE-O 3.23Å; K173-R229 WeakPolarHBondContact CE-O 3.44Å; K173-R229 PolarHBondContact NZ-O 3.45Å
174	D	90.8	Very high	92.8	Very high	20 Å²	20	30.6 Å²	30.6	11%	0.107	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-1.7	-178.6	65.1	10.6	0	0	0	113.6	F172 L176 K197 N203	F172-D174 PolarHBondContact O-N 2.84Å; D174-L176 PolarHBondContact O-N 3.41Å; D174-L176 WeakPolarHBondContact OD1-CB 3.48Å; D174-L176 PolarHBondContact OD1-N 3.2Å; D174-K197 WeakPolarHBondContact OD2-CE 3.34Å; D174-N203 WeakPolarHBondContact O-CB 3.28Å; D174-N203 PolarHBondContact O-ND2 3Å
175	G	92.6	Very high	92.6	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	73.5	-10.1	-178.2	0	0	0	0	0	115.2	F172 K173 A177 F178 C179	F172-G175 PolarHBondContact O-N 3.47Å; K173-G175 VanDerWaalsContact C-N 3.26Å; K173-G175 PolarHBondContact O-N 3.26Å; G175-A177 VanDerWaalsContact C-N 3.33Å; G175-A177 PolarHBondContact O-N 2.91Å; G175-F178 PolarHBondContact O-N 3.37Å; G175-C179 PolarHBondContact O-N 3.18Å; G175-C179 PolarHBondContact O-SG 2.77Å
176	L	95.2	Very high	92.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-68.3	-33.4	-174.5	-69.2	175.8	0	0	0	112.4	N162 V163 D174 C179 A180 Y192 L195 K197	N162-L176 WeakPolarHBondContact ND2-CD1 3.12Å; V163-L176 HydrophobicContact CG2-CB 3.8Å; D174-L176 PolarHBondContact O-N 3.41Å; D174-L176 WeakPolarHBondContact OD1-CB 3.48Å; D174-L176 PolarHBondContact OD1-N 3.2Å; L176-C179 PolarHBondContact O-N 3.11Å; L176-A180 VanDerWaalsContact O-CB 3.25Å; L176-A180 WeakPolarHBondContact O-CB 3.05Å; L176-A180 PolarHBondContact O-N 3.24Å; L176-Y192 PolarHBondContact O-OH 3.2Å; L176-L195 HydrophobicContact CD2-CB 3.79Å; L176-L195 HydrophobicContact CD2-CD1 4.39Å; L176-K197 HydrophobicContact CD1-CB 3.86Å; L176-K197 HydrophobicContact CD1-CG 3.97Å
177	A	95.5	Very high	92.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.9	-44.7	176.5	0	0	0	0	0	112.2	V163 V165 F172 G175 A180 I181	V163-A177 HydrophobicContact CG1-CB 3.79Å; V165-A177 HydrophobicContact CG2-CB 4.14Å; F172-A177 HydrophobicContact CD1-CB 3.58Å; F172-A177 HydrophobicContact CE1-CB 3.74Å; F172-A177 HydrophobicContact CG-CB 4.32Å; G175-A177 VanDerWaalsContact C-N 3.33Å; G175-A177 PolarHBondContact O-N 2.91Å; A177-A180 PolarHBondContact O-N 3.38Å; A177-I181 WeakPolarHBondContact O-CG1 3.44Å; A177-I181 PolarHBondContact O-N 3.49Å
178	F	95.7	Very high	92	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.6	-46.6	175.3	-73.2	-71	0	0	0	111.6	F172 G175 A180 I181 I182 L204 A207 F208 L221 M226 V237 Y240 L241 Y244	F172-F178 HydrophobicContact CB-CD2 4.37Å; F172-F178 HydrophobicContact CB-CE2 3.78Å; F172-F178 HydrophobicContact CB-CZ 4.31Å; F172-F178 HydrophobicContact CD1-CD1 4.5Å; F172-F178 HydrophobicContact CD1-CD2 4.14Å; F172-F178 HydrophobicContact CD1-CE1 4.28Å; F172-F178 AromaticContact CD1-CE2 3.92Å; F172-F178 HydrophobicContact CD1-CE2 3.92Å; F172-F178 HydrophobicContact CD1-CG 4.42Å; F172-F178 AromaticContact CD1-CZ 3.98Å; F172-F178 HydrophobicContact CD1-CZ 3.98Å; F172-F178 HydrophobicContact CG-CE2 4.25Å; F172-F178 HydrophobicContact CG-CZ 4.42Å; G175-F178 PolarHBondContact O-N 3.37Å; F178-A180 VanDerWaalsContact C-N 3.27Å; F178-A180 PolarHBondContact O-N 3.43Å; F178-I181 PolarHBondContact O-N 3.15Å; F178-I182 WeakPolarHBondContact O-CG1 3.41Å; F178-I182 PolarHBondContact O-N 3.21Å; F178-I182 VanDerWaalsContact O-N 3.09Å; F178-L204 HydrophobicContact CD2-CD2 3.97Å; F178-L204 HydrophobicContact CE2-CD2 4.21Å; F178-A207 HydrophobicContact CB-CB 3.65Å; F178-F208 HydrophobicContact CD1-CE1 4.35Å; F178-F208 AromaticContact CD2-CE1 3.84Å; F178-F208 HydrophobicContact CD2-CE1 3.84Å; F178-F208 HydrophobicContact CD2-CZ 4.36Å; F178-F208 HydrophobicContact CE1-CE1 4.44Å; F178-F208 AromaticContact CE2-CE1 3.93Å; F178-F208 HydrophobicContact CE2-CE1 3.93Å; F178-F208 HydrophobicContact CE2-CZ 4.14Å; F178-F208 HydrophobicContact CG-CE1 4.06Å; F178-F208 HydrophobicContact CZ-CE1 4.24Å; F178-L221 HydrophobicContact CZ-CD1 3.99Å; F178-M226 HydrophobicContact CE2-CE 4.05Å; F178-V237 HydrophobicContact CZ-CG1 4.39Å; F178-Y240 HydrophobicContact CD1-CD1 4.49Å; F178-Y240 HydrophobicContact CD1-CE1 4.48Å; F178-Y240 AromaticContact CE1-CD1 3.64Å; F178-Y240 HydrophobicContact CE1-CD1 3.64Å; F178-Y240 HydrophobicContact CE1-CE1 4.03Å; F178-Y240 AromaticContact CZ-CD1 3.89Å; F178-Y240 HydrophobicContact CZ-CD1 3.89Å; F178-Y240 HydrophobicContact CZ-CE1 4.42Å; F178-L241 HydrophobicContact CD1-CD2 4.07Å; F178-L241 HydrophobicContact CE1-CD2 3.56Å; F178-L241 HydrophobicContact CE1-CG 4.07Å; F178-L241 HydrophobicContact CZ-CD2 4.36Å; F178-Y244 AromaticContact CD1-CE2 3.98Å; F178-Y244 HydrophobicContact CD1-CE2 3.98Å; F178-Y244 HydrophobicContact CE1-CE2 4.14Å
179	C	95.9	Very high	91.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.5	-38.4	175.7	-67.3	0	0	0	0	112.2	G175 L176 I182 H183 I190 Y192 L195 N203	G175-C179 PolarHBondContact O-N 3.18Å; G175-C179 PolarHBondContact O-SG 2.77Å; L176-C179 PolarHBondContact O-N 3.11Å; C179-I182 PolarHBondContact O-N 3.26Å; C179-H183 VanDerWaalsContact O-CB 3.24Å; C179-H183 WeakPolarHBondContact O-CB 3.21Å; C179-H183 PolarHBondContact O-N 3.43Å; C179-I190 HydrophobicContact CB-CD1 4.06Å; C179-I190 HydrophobicContact CB-CG2 4.49Å; C179-Y192 HydrophobicContact CB-CD2 4.13Å; C179-Y192 HydrophobicContact CB-CE2 3.9Å; C179-L195 HydrophobicContact CB-CD1 3.44Å; C179-L195 VanDerWaalsContact CB-CD1 3.44Å; C179-N203 PolarHBondContact SG-O 3.47Å
180	A	95.8	Very high	92.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-68.1	-42.1	-179.7	0	0	0	0	0	111.9	T157 Y160 V163 L176 A177 F178 H183 R184 Y192	T157-A180 HydrophobicContact CG2-CB 3.94Å; Y160-A180 HydrophobicContact CD1-CB 4Å; Y160-A180 HydrophobicContact CD2-CB 3.68Å; Y160-A180 HydrophobicContact CE1-CB 4.17Å; Y160-A180 HydrophobicContact CE2-CB 3.86Å; Y160-A180 HydrophobicContact CG-CB 3.72Å; Y160-A180 PolarHBondContact OH-O 3.48Å; V163-A180 HydrophobicContact CG2-CB 4.24Å; L176-A180 VanDerWaalsContact O-CB 3.25Å; L176-A180 WeakPolarHBondContact O-CB 3.05Å; L176-A180 PolarHBondContact O-N 3.24Å; A177-A180 PolarHBondContact O-N 3.38Å; F178-A180 VanDerWaalsContact C-N 3.27Å; F178-A180 PolarHBondContact O-N 3.43Å; A180-H183 PolarHBondContact O-N 3.26Å; A180-R184 VanDerWaalsContact O-CB 3.22Å; A180-R184 WeakPolarHBondContact O-CB 3.19Å; A180-R184 PolarHBondContact O-N 3.28Å; A180-Y192 HydrophobicContact CB-CE2 3.69Å
181	I	94.7	Very high	92.3	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-45.7	175.5	-67.5	168.5	0	0	0	110.5	W152 C153 Q156 T157 F172 A177 F178 R184 N185 L241 F248	W152-I181 HydrophobicContact CH2-CG2 3.63Å; W152-I181 HydrophobicContact CZ2-CG2 4.38Å; W152-I181 HydrophobicContact CZ3-CD1 4.34Å; W152-I181 HydrophobicContact CZ3-CG2 4.2Å; C153-I181 HydrophobicContact CB-CD1 4.41Å; Q156-I181 HydrophobicContact CB-CG1 3.97Å; T157-I181 HydrophobicContact CG2-CD1 4.47Å; T157-I181 HydrophobicContact CG2-CG1 3.84Å; F172-I181 HydrophobicContact CE1-CD1 4.16Å; A177-I181 WeakPolarHBondContact O-CG1 3.44Å; A177-I181 PolarHBondContact O-N 3.49Å; F178-I181 PolarHBondContact O-N 3.15Å; I181-R184 PolarHBondContact O-N 2.96Å; I181-N185 PolarHBondContact O-N 3.38Å; I181-N185 PolarHBondContact O-ND2 3.01Å; I181-L241 HydrophobicContact CD1-CD2 3.97Å; I181-F248 HydrophobicContact CG2-CD2 4.09Å; I181-F248 HydrophobicContact CG2-CE2 3.95Å
182	I	94	Very high	92.3	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64	-49.7	176.9	-64.8	167.7	0	0	0	110.5	F178 C179 R184 N185 R186 L189 I190 A207 I210 L215 Y244	F178-I182 WeakPolarHBondContact O-CG1 3.41Å; F178-I182 PolarHBondContact O-N 3.21Å; F178-I182 VanDerWaalsContact O-N 3.09Å; C179-I182 PolarHBondContact O-N 3.26Å; I182-R184 VanDerWaalsContact C-N 3.27Å; I182-R184 PolarHBondContact O-N 3.44Å; I182-N185 PolarHBondContact O-N 2.91Å; I182-R186 CarbonylContact O-C 3.56Å; I182-R186 WeakPolarHBondContact O-CA 3.32Å; I182-R186 PolarHBondContact O-N 3.33Å; I182-L189 HydrophobicContact CG2-CB 4.26Å; I182-L189 HydrophobicContact CG2-CD1 4.34Å; I182-I190 HydrophobicContact CB-CD1 3.7Å; I182-I190 HydrophobicContact CD1-CD1 4.03Å; I182-I190 HydrophobicContact CG1-CD1 4.47Å; I182-I190 HydrophobicContact CG2-CD1 3.6Å; I182-I190 HydrophobicContact CG2-CG1 4.05Å; I182-A207 HydrophobicContact CD1-CB 4.09Å; I182-A207 WeakPolarHBondContact CD1-O 3.49Å; I182-I210 HydrophobicContact CD1-CG2 4.45Å; I182-I210 HydrophobicContact CG2-CG2 3.91Å; I182-L215 HydrophobicContact CG1-CD1 4.16Å; I182-Y244 HydrophobicContact CD1-CE1 3.84Å; I182-Y244 HydrophobicContact CG1-CD1 4.35Å; I182-Y244 HydrophobicContact CG1-CE1 3.64Å
183	H	94.5	Very high	92.1	Very high	50 Å²	50	42.8 Å²	42.8	23%	0.231	21%	0.21	C	C	.	.	H	α-helix	trans	-62.9	-33.2	-179.4	-178.6	-105.9	0	0	0	112.1	Y160 C179 A180 N185 P187 I190 Y192	Y160-H183 HydrophobicContact CE1-CB 4.47Å; Y160-H183 AromaticContact CE1-ND1 3.43Å; Y160-H183 WeakPolarHBondContact CE1-ND1 3.32Å; Y160-H183 AromaticContact CZ-ND1 3.52Å; Y160-H183 WeakPolarHBondContact OH-CB 3.23Å; Y160-H183 PolarHBondContact OH-ND1 3.39Å; C179-H183 VanDerWaalsContact O-CB 3.24Å; C179-H183 WeakPolarHBondContact O-CB 3.21Å; C179-H183 PolarHBondContact O-N 3.43Å; A180-H183 PolarHBondContact O-N 3.26Å; H183-N185 PolarHBondContact O-N 3.5Å; H183-P187 PolarHBondContact CD2-O 3.33Å; H183-P187 WeakPolarHBondContact O-CA 3.29Å; H183-P187 WeakPolarHBondContact O-CD 3.39Å; H183-P187 VanDerWaalsContact O-CG 3.27Å; H183-P187 WeakPolarHBondContact O-CG 3.47Å; H183-P187 VanDerWaalsContact O-N 3.15Å; H183-I190 HydrophobicContact CB-CB 4.37Å; H183-I190 PolarHBondContact CD2-O 2.8Å; H183-Y192 HydrophobicContact CB-CD2 4.19Å
184	R	91.2	Very high	92.1	Very high	134 Å²	134	47.1 Å²	47.1	51%	0.506	23%	0.231	S	C	.	.	H	α-helix	trans	-64.4	-41.5	178	-177.7	59.6	173.7	174.2	0.5	112.1	Q156 Y160 A180 I181 I182	Q156-R184 WeakPolarHBondContact O-CG 3.37Å; Y160-R184 HydrophobicContact CE2-CB 4.13Å; Y160-R184 WeakPolarHBondContact OH-CA 2.67Å; Y160-R184 PolarHBondContact OH-N 3.42Å; A180-R184 VanDerWaalsContact O-CB 3.22Å; A180-R184 WeakPolarHBondContact O-CB 3.19Å; A180-R184 PolarHBondContact O-N 3.28Å; I181-R184 PolarHBondContact O-N 2.96Å; I182-R184 VanDerWaalsContact C-N 3.27Å; I182-R184 PolarHBondContact O-N 3.44Å
185	N	88.5	Confident	92.1	Very high	49 Å²	49	47.5 Å²	47.5	26%	0.262	23%	0.233	S	C	.	.	H	α-helix	trans	-91.7	-30.5	-176.1	-68.2	-79.2	0	0	0	112.7	Q156 I181 I182 H183 F248	Q156-N185 PolarHBondContact OE1-ND2 2.8Å; I181-N185 PolarHBondContact O-N 3.38Å; I181-N185 PolarHBondContact O-ND2 3.01Å; I182-N185 PolarHBondContact O-N 2.91Å; H183-N185 PolarHBondContact O-N 3.5Å; N185-F248 HydrophobicContact CB-CB 4.47Å; N185-F248 HydrophobicContact CB-CD1 3.44Å; N185-F248 VanDerWaalsContact CB-CD1 3.44Å; N185-F248 HydrophobicContact CB-CD2 4.05Å; N185-F248 HydrophobicContact CB-CE1 3.48Å; N185-F248 VanDerWaalsContact CB-CE1 3.48Å; N185-F248 HydrophobicContact CB-CE2 4.05Å; N185-F248 HydrophobicContact CB-CG 3.74Å; N185-F248 HydrophobicContact CB-CZ 3.78Å
186	R	88.4	Confident	91.9	Very high	130 Å²	130	54 Å²	54	49%	0.491	26%	0.262	S	S	.	.			trans	-138.9	75.5	-179.5	-61.7	-66	-177.2	-176	0.9	110.4	I182 H188 L189 L215 F248	I182-R186 CarbonylContact O-C 3.56Å; I182-R186 WeakPolarHBondContact O-CA 3.32Å; I182-R186 PolarHBondContact O-N 3.33Å; R186-H188 PolarHBondContact O-N 3.16Å; R186-H188 VanDerWaalsContact O-N 3.1Å; R186-L189 HydrophobicContact CB-CB 4.49Å; R186-L189 HydrophobicContact CB-CD1 3.53Å; R186-L189 HydrophobicContact CB-CG 3.86Å; R186-L189 HydrophobicContact CG-CD1 4.04Å; R186-L189 PolarHBondContact O-N 3Å; R186-L189 VanDerWaalsContact O-N 3.09Å; R186-L215 HydrophobicContact CG-CD2 4.23Å; R186-F248 HydrophobicContact CG-CE1 4.04Å
187	P	86.8	Confident	91.5	Very high	74 Å²	74	60.4 Å²	60.4	48%	0.481	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-57.3	-31.9	-173.2	-23.8	30.6	0	0	0	114.5	H183 L189	H183-P187 PolarHBondContact CD2-O 3.33Å; H183-P187 WeakPolarHBondContact O-CA 3.29Å; H183-P187 WeakPolarHBondContact O-CD 3.39Å; H183-P187 VanDerWaalsContact O-CG 3.27Å; H183-P187 WeakPolarHBondContact O-CG 3.47Å; H183-P187 VanDerWaalsContact O-N 3.15Å; P187-L189 PolarHBondContact O-N 3.43Å
188	H	89	Confident	91.1	Very high	146 Å²	146	63.4 Å²	63.4	68%	0.676	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-71.1	-11.5	-177.9	62.1	-86.8	0	0	0	114.4	R186	R186-H188 PolarHBondContact O-N 3.16Å; R186-H188 VanDerWaalsContact O-N 3.1Å
189	L	90.7	Very high	90.9	Very high	33 Å²	33	66.6 Å²	66.6	17%	0.173	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-86	-26.5	-177.5	-64.2	-179.3	0	0	0	113.2	I182 R186 P187 I210 H214 L215	I182-L189 HydrophobicContact CG2-CB 4.26Å; I182-L189 HydrophobicContact CG2-CD1 4.34Å; R186-L189 HydrophobicContact CB-CB 4.49Å; R186-L189 HydrophobicContact CB-CD1 3.53Å; R186-L189 HydrophobicContact CB-CG 3.86Å; R186-L189 HydrophobicContact CG-CD1 4.04Å; R186-L189 PolarHBondContact O-N 3Å; R186-L189 VanDerWaalsContact O-N 3.09Å; P187-L189 PolarHBondContact O-N 3.43Å; L189-I210 HydrophobicContact CB-CG2 3.81Å; L189-I210 HydrophobicContact CD1-CG2 3.93Å; L189-I210 HydrophobicContact CG-CG2 4.4Å; L189-I210 VanDerWaalsContact O-CD1 3.29Å; L189-I210 WeakPolarHBondContact O-CD1 2.9Å; L189-H214 HydrophobicContact CD1-CB 3.86Å; L189-H214 HydrophobicContact CD2-CB 3.96Å; L189-L215 HydrophobicContact CD1-CD2 4.1Å
190	I	91.3	Very high	90.8	Very high	5 Å²	5	69.5 Å²	69.5	3%	0.026	35%	0.351	C	S	.	.			trans	-132.7	124.9	-175	-69	-178.1	0	0	0	109.3	C179 I182 H183 Y192 L195 I210	C179-I190 HydrophobicContact CB-CD1 4.06Å; C179-I190 HydrophobicContact CB-CG2 4.49Å; I182-I190 HydrophobicContact CB-CD1 3.7Å; I182-I190 HydrophobicContact CD1-CD1 4.03Å; I182-I190 HydrophobicContact CG1-CD1 4.47Å; I182-I190 HydrophobicContact CG2-CD1 3.6Å; I182-I190 HydrophobicContact CG2-CG1 4.05Å; H183-I190 HydrophobicContact CB-CB 4.37Å; H183-I190 PolarHBondContact CD2-O 2.8Å; I190-Y192 PolarHBondContact O-N 2.65Å; I190-Y192 VanDerWaalsContact O-N 3.12Å; I190-L195 HydrophobicContact CG2-CD1 4.05Å; I190-I210 HydrophobicContact CD1-CD1 3.91Å; I190-I210 HydrophobicContact CG1-CD1 3.3Å
191	D	91.5	Very high	90.7	Very high	84 Å²	84	72.1 Å²	72.1	45%	0.449	37%	0.367	S	S	.	.			trans	-80.8	90.2	162.9	-174.3	-6.4	0	0	0	109.3	S193 Q194	D191-S193 PolarHBondContact O-N 3.49Å; D191-S193 VanDerWaalsContact O-N 3.16Å; D191-S193 WeakPolarHBondContact OD1-CB 3.35Å; D191-S193 PolarHBondContact OD1-N 2.92Å; D191-S193 PolarHBondContact OD1-OG 2.77Å; D191-Q194 HydrophobicContact CB-CG 4.39Å; D191-Q194 PolarHBondContact O-N 3.17Å; D191-Q194 WeakPolarHBondContact OD2-CG 2.89Å; D191-Q194 PolarHBondContact OD2-NE2 3.14Å
192	Y	91.9	Very high	90.6	Very high	23 Å²	23	78.4 Å²	78.4	9%	0.09	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-62.6	-24.9	-174.3	-164.3	-88.1	0	0	0	112.5	Y160 N162 V163 L176 C179 A180 H183 I190 Q194 L195	Y160-Y192 AromaticContact CD1-CD1 3.72Å; Y160-Y192 HydrophobicContact CD1-CD1 3.72Å; Y160-Y192 HydrophobicContact CD1-CD2 4.16Å; Y160-Y192 AromaticContact CD1-CE1 3.44Å; Y160-Y192 HydrophobicContact CD1-CE1 3.44Å; Y160-Y192 VanDerWaalsContact CD1-CE1 3.44Å; Y160-Y192 AromaticContact CD1-CE2 3.92Å; Y160-Y192 HydrophobicContact CD1-CE2 3.92Å; Y160-Y192 HydrophobicContact CD1-CG 4.08Å; Y160-Y192 AromaticContact CD1-CZ 3.55Å; Y160-Y192 AromaticContact CE1-CD1 3.92Å; Y160-Y192 HydrophobicContact CE1-CD1 3.92Å; Y160-Y192 AromaticContact CE1-CD2 3.89Å; Y160-Y192 HydrophobicContact CE1-CD2 3.89Å; Y160-Y192 HydrophobicContact CE1-CE1 4.08Å; Y160-Y192 HydrophobicContact CE1-CE2 4.06Å; Y160-Y192 AromaticContact CE1-CG 3.84Å; Y160-Y192 HydrophobicContact CE1-CG 3.84Å; Y160-Y192 HydrophobicContact CG-CE1 4.41Å; N162-Y192 PolarHBondContact ND2-OH 3.37Å; N162-Y192 VanDerWaalsContact ND2-OH 3.08Å; N162-Y192 PolarHBondContact OD1-OH 2.98Å; V163-Y192 WeakPolarHBondContact CG2-OH 3.33Å; L176-Y192 PolarHBondContact O-OH 3.2Å; C179-Y192 HydrophobicContact CB-CD2 4.13Å; C179-Y192 HydrophobicContact CB-CE2 3.9Å; A180-Y192 HydrophobicContact CB-CE2 3.69Å; H183-Y192 HydrophobicContact CB-CD2 4.19Å; I190-Y192 PolarHBondContact O-N 2.65Å; I190-Y192 VanDerWaalsContact O-N 3.12Å; Y192-Q194 PolarHBondContact O-N 2.89Å; Y192-L195 HydrophobicContact CD2-CD1 3.73Å; Y192-L195 HydrophobicContact CE2-CD1 3.96Å; Y192-L195 HydrophobicContact CG-CD1 4.23Å; Y192-L195 PolarHBondContact O-N 2.81Å
193	S	89.4	Confident	90.7	Very high	102 Å²	102	78.5 Å²	78.5	71%	0.713	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-67.9	-21.3	-176.9	74.2	0	0	0	0	113.8	D191	D191-S193 PolarHBondContact O-N 3.49Å; D191-S193 VanDerWaalsContact O-N 3.16Å; D191-S193 WeakPolarHBondContact OD1-CB 3.35Å; D191-S193 PolarHBondContact OD1-N 2.92Å; D191-S193 PolarHBondContact OD1-OG 2.77Å
194	Q	90.1	Very high	90.7	Very high	139 Å²	139	76.1 Å²	76.1	65%	0.65	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-87.5	-7.5	-179.6	-60.7	-173.6	22.2	0	0	113.6	D191 Y192	D191-Q194 HydrophobicContact CB-CG 4.39Å; D191-Q194 PolarHBondContact O-N 3.17Å; D191-Q194 WeakPolarHBondContact OD2-CG 2.89Å; D191-Q194 PolarHBondContact OD2-NE2 3.14Å; Y192-Q194 PolarHBondContact O-N 2.89Å
195	L	91.4	Very high	90.9	Very high	27 Å²	27	72.3 Å²	72.3	14%	0.141	37%	0.373	C	S	.	.			trans	-80.8	137.7	-175	-55.8	179.6	0	0	0	111.5	L176 C179 I190 Y192 L206	L176-L195 HydrophobicContact CD2-CB 3.79Å; L176-L195 HydrophobicContact CD2-CD1 4.39Å; C179-L195 HydrophobicContact CB-CD1 3.44Å; C179-L195 VanDerWaalsContact CB-CD1 3.44Å; I190-L195 HydrophobicContact CG2-CD1 4.05Å; Y192-L195 HydrophobicContact CD2-CD1 3.73Å; Y192-L195 HydrophobicContact CE2-CD1 3.96Å; Y192-L195 HydrophobicContact CG-CD1 4.23Å; Y192-L195 PolarHBondContact O-N 2.81Å; L195-L206 HydrophobicContact CD2-CD2 3.57Å
196	K	89.5	Confident	91.2	Very high	138 Å²	138	72.7 Å²	72.7	60%	0.6	38%	0.375	S	S	*	.			trans	-119.4	138.2	179.3	-66.9	-178.6	-178.4	177.5	0	110.2	G198 D199 N203	K196-G198 PolarHBondContact O-N 3.47Å; K196-D199 PolarHBondContact O-N 2.99Å; K196-D199 VanDerWaalsContact O-N 3.13Å; K196-N203 PolarHBondContact O-ND2 2.91Å
197	K	86.4	Confident	91.6	Very high	134 Å²	134	66.5 Å²	66.5	58%	0.583	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-26.4	179.8	-170.6	167.4	-175	170.2	0	113.9	D174 L176 H200	D174-K197 WeakPolarHBondContact OD2-CE 3.34Å; L176-K197 HydrophobicContact CD1-CB 3.86Å; L176-K197 HydrophobicContact CD1-CG 3.97Å; K197-H200 PolarHBondContact O-CD2 2.81Å; K197-H200 PolarHBondContact O-NE2 3.07Å
198	G	87.5	Confident	92	Very high	63 Å²	63	63 Å²	63	65%	0.649	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-16.8	178.4	0	0	0	0	0	115	K196 H200	K196-G198 PolarHBondContact O-N 3.47Å; G198-H200 VanDerWaalsContact C-N 3.33Å; G198-H200 PolarHBondContact O-N 3.21Å
199	D	91.4	Very high	92.2	Very high	66 Å²	66	60.8 Å²	60.8	35%	0.353	32%	0.319	S	S	.	.			trans	-94.5	51.7	-171.2	-65.2	-16.3	0	0	0	111.4	K196 V201 K202 N203	K196-D199 PolarHBondContact O-N 2.99Å; K196-D199 VanDerWaalsContact O-N 3.13Å; D199-V201 PolarHBondContact O-N 2.7Å; D199-K202 HydrophobicContact CB-CB 4.04Å; D199-K202 HydrophobicContact CB-CD 4.35Å; D199-K202 WeakPolarHBondContact O-CB 3.09Å; D199-K202 PolarHBondContact O-N 2.81Å; D199-N203 VanDerWaalsContact O-CG 3.29Å; D199-N203 PolarHBondContact O-N 2.97Å; D199-N203 PolarHBondContact O-ND2 3.11Å
200	H	92.7	Very high	92.4	Very high	62 Å²	62	60 Å²	60	29%	0.287	31%	0.314	S	S	.	.	H	α-helix	trans	-49.5	-55.6	-169.4	-57.7	171.3	0	0	0	113.2	K197 G198 K202 N203 L204 A227	K197-H200 PolarHBondContact O-CD2 2.81Å; K197-H200 PolarHBondContact O-NE2 3.07Å; G198-H200 VanDerWaalsContact C-N 3.33Å; G198-H200 PolarHBondContact O-N 3.21Å; H200-K202 VanDerWaalsContact C-N 3.28Å; H200-K202 PolarHBondContact O-N 3.2Å; H200-N203 PolarHBondContact O-N 2.63Å; H200-L204 WeakPolarHBondContact O-CB 3.39Å; H200-L204 VanDerWaalsContact O-CG 3.31Å; H200-L204 WeakPolarHBondContact O-CG 3.49Å; H200-L204 PolarHBondContact O-N 3.16Å; H200-A227 HydrophobicContact CB-CB 3.82Å
201	V	93.2	Very high	92.5	Very high	55 Å²	55	59.8 Å²	59.8	33%	0.333	31%	0.313	S	S	.	.	H	α-helix	trans	-62.8	-36.7	-176.7	178	0	0	0	0	111	D199 N205 P223 E224 A227	D199-V201 PolarHBondContact O-N 2.7Å; V201-N205 WeakPolarHBondContact CG1-ND2 3.47Å; V201-N205 WeakPolarHBondContact O-CB 3.45Å; V201-N205 PolarHBondContact O-N 3.13Å; V201-N205 PolarHBondContact O-ND2 2.78Å; V201-P223 HydrophobicContact CG1-CB 4.23Å; V201-E224 HydrophobicContact CG1-CG 4.34Å; V201-A227 HydrophobicContact CG2-CB 3.49Å; V201-A227 VanDerWaalsContact CG2-CB 3.49Å
202	K	94.1	Very high	92.6	Very high	133 Å²	133	60.1 Å²	60.1	58%	0.578	31%	0.312	S	S	*	.	H	α-helix	trans	-69.3	-44.3	178.4	-174.7	-175.1	173	-171.9	0	111.3	D199 H200 L206	D199-K202 HydrophobicContact CB-CB 4.04Å; D199-K202 HydrophobicContact CB-CD 4.35Å; D199-K202 WeakPolarHBondContact O-CB 3.09Å; D199-K202 PolarHBondContact O-N 2.81Å; H200-K202 VanDerWaalsContact C-N 3.28Å; H200-K202 PolarHBondContact O-N 3.2Å; K202-L206 WeakPolarHBondContact O-CB 3.28Å; K202-L206 PolarHBondContact O-N 2.88Å
203	N	95.6	Very high	92.6	Very high	1 Å²	1	66.9 Å²	66.9	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-63.2	-45	178.3	-62.5	-20.9	0	0	0	111	D174 C179 K196 D199 H200 L206 A207	D174-N203 WeakPolarHBondContact O-CB 3.28Å; D174-N203 PolarHBondContact O-ND2 3Å; C179-N203 PolarHBondContact SG-O 3.47Å; K196-N203 PolarHBondContact O-ND2 2.91Å; D199-N203 VanDerWaalsContact O-CG 3.29Å; D199-N203 PolarHBondContact O-N 2.97Å; D199-N203 PolarHBondContact O-ND2 3.11Å; H200-N203 PolarHBondContact O-N 2.63Å; N203-L206 PolarHBondContact O-N 3.39Å; N203-A207 PolarHBondContact O-N 3Å
204	L	94.6	Very high	92.7	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-62.6	-49.4	177.4	-71.8	166.4	0	0	0	111.8	F178 H200 L206 A207 F208 P223 M226 A227	F178-L204 HydrophobicContact CD2-CD2 3.97Å; F178-L204 HydrophobicContact CE2-CD2 4.21Å; H200-L204 WeakPolarHBondContact O-CB 3.39Å; H200-L204 VanDerWaalsContact O-CG 3.31Å; H200-L204 WeakPolarHBondContact O-CG 3.49Å; H200-L204 PolarHBondContact O-N 3.16Å; L204-L206 VanDerWaalsContact C-N 3.32Å; L204-L206 PolarHBondContact O-N 3.2Å; L204-A207 PolarHBondContact O-N 3.37Å; L204-F208 HydrophobicContact CB-CE2 4.23Å; L204-F208 HydrophobicContact CB-CZ 4.31Å; L204-F208 HydrophobicContact CD2-CE1 4.17Å; L204-F208 HydrophobicContact CD2-CE2 4.31Å; L204-F208 HydrophobicContact CD2-CZ 3.65Å; L204-F208 WeakPolarHBondContact O-CB 3.16Å; L204-F208 WeakPolarHBondContact O-CD1 3.04Å; L204-F208 WeakPolarHBondContact O-CG 3.43Å; L204-F208 PolarHBondContact O-N 2.87Å; L204-P223 HydrophobicContact CB-CB 3.79Å; L204-P223 HydrophobicContact CB-CG 4.2Å; L204-P223 HydrophobicContact CD1-CB 4.49Å; L204-M226 HydrophobicContact CD1-CB 3.86Å; L204-M226 HydrophobicContact CD2-CE 4.38Å; L204-M226 HydrophobicContact CD2-SD 4.09Å; L204-A227 HydrophobicContact CD1-CB 4.39Å
205	N	95.1	Very high	92.6	Very high	54 Å²	54	61.1 Å²	61.1	29%	0.289	30%	0.304	S	S	.	.	H	α-helix	trans	-56.6	-46.4	176.4	-87.2	-66	0	0	0	111.7	V201 A207 F208 E209 P223	V201-N205 WeakPolarHBondContact CG1-ND2 3.47Å; V201-N205 WeakPolarHBondContact O-CB 3.45Å; V201-N205 PolarHBondContact O-N 3.13Å; V201-N205 PolarHBondContact O-ND2 2.78Å; N205-A207 PolarHBondContact O-N 3.11Å; N205-F208 PolarHBondContact O-N 3.31Å; N205-E209 VanDerWaalsContact O-CB 3.3Å; N205-E209 WeakPolarHBondContact O-CB 3.47Å; N205-E209 VanDerWaalsContact O-CG 3.32Å; N205-E209 WeakPolarHBondContact O-CG 3.4Å; N205-E209 PolarHBondContact O-N 3.41Å; N205-P223 HydrophobicContact CB-CG 4.49Å; N205-P223 WeakPolarHBondContact OD1-CG 3.46Å
206	L	95.2	Very high	92.4	Very high	58 Å²	58	64.6 Å²	64.6	30%	0.304	32%	0.323	S	S	.	.	H	α-helix	trans	-58.7	-49	177.9	179.2	67.9	0	0	0	111.6	L195 K202 N203 L204 F208 I210	L195-L206 HydrophobicContact CD2-CD2 3.57Å; K202-L206 WeakPolarHBondContact O-CB 3.28Å; K202-L206 PolarHBondContact O-N 2.88Å; N203-L206 PolarHBondContact O-N 3.39Å; L204-L206 VanDerWaalsContact C-N 3.32Å; L204-L206 PolarHBondContact O-N 3.2Å; L206-F208 VanDerWaalsContact C-N 3.35Å; L206-F208 PolarHBondContact O-N 3.34Å; L206-I210 HydrophobicContact CD1-CD1 3.61Å; L206-I210 HydrophobicContact CD1-CG1 4.34Å; L206-I210 HydrophobicContact CG-CD1 3.85Å; L206-I210 WeakPolarHBondContact O-CB 3.48Å; L206-I210 WeakPolarHBondContact O-CD1 3.46Å; L206-I210 VanDerWaalsContact O-CG1 3.25Å; L206-I210 WeakPolarHBondContact O-CG1 3.43Å; L206-I210 PolarHBondContact O-N 3.49Å; L206-I210 VanDerWaalsContact O-N 3.09Å
207	A	95.3	Very high	92.5	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.2	-45.3	179.8	0	0	0	0	0	111.9	F178 I182 N203 L204 N205 I210 A211	F178-A207 HydrophobicContact CB-CB 3.65Å; I182-A207 HydrophobicContact CD1-CB 4.09Å; I182-A207 WeakPolarHBondContact CD1-O 3.49Å; N203-A207 PolarHBondContact O-N 3Å; L204-A207 PolarHBondContact O-N 3.37Å; N205-A207 PolarHBondContact O-N 3.11Å; A207-I210 PolarHBondContact O-N 3.45Å; A207-A211 WeakPolarHBondContact O-CB 3.27Å; A207-A211 PolarHBondContact O-N 3.15Å
208	F	95.5	Very high	92.7	Very high	1 Å²	1	53.1 Å²	53.1	0%	0.004	28%	0.276	C	S	.	.	H	α-helix	trans	-73.9	-37.3	-175.2	-58.8	-10.6	0	0	0	112.1	F178 L204 N205 L206 A211 E212 K219 L221 P223 M226 Y240	F178-F208 HydrophobicContact CD1-CE1 4.35Å; F178-F208 AromaticContact CD2-CE1 3.84Å; F178-F208 HydrophobicContact CD2-CE1 3.84Å; F178-F208 HydrophobicContact CD2-CZ 4.36Å; F178-F208 HydrophobicContact CE1-CE1 4.44Å; F178-F208 AromaticContact CE2-CE1 3.93Å; F178-F208 HydrophobicContact CE2-CE1 3.93Å; F178-F208 HydrophobicContact CE2-CZ 4.14Å; F178-F208 HydrophobicContact CG-CE1 4.06Å; F178-F208 HydrophobicContact CZ-CE1 4.24Å; L204-F208 HydrophobicContact CB-CE2 4.23Å; L204-F208 HydrophobicContact CB-CZ 4.31Å; L204-F208 HydrophobicContact CD2-CE1 4.17Å; L204-F208 HydrophobicContact CD2-CE2 4.31Å; L204-F208 HydrophobicContact CD2-CZ 3.65Å; L204-F208 WeakPolarHBondContact O-CB 3.16Å; L204-F208 WeakPolarHBondContact O-CD1 3.04Å; L204-F208 WeakPolarHBondContact O-CG 3.43Å; L204-F208 PolarHBondContact O-N 2.87Å; N205-F208 PolarHBondContact O-N 3.31Å; L206-F208 VanDerWaalsContact C-N 3.35Å; L206-F208 PolarHBondContact O-N 3.34Å; F208-A211 PolarHBondContact O-N 3.3Å; F208-E212 WeakPolarHBondContact O-CB 3.43Å; F208-E212 PolarHBondContact O-N 3.3Å; F208-K219 HydrophobicContact CB-CD 4.41Å; F208-K219 HydrophobicContact CB-CG 4.09Å; F208-L221 HydrophobicContact CE2-CB 3.73Å; F208-L221 WeakPolarHBondContact CE2-O 3.46Å; F208-L221 HydrophobicContact CZ-CB 3.85Å; F208-L221 HydrophobicContact CZ-CD1 4.26Å; F208-P223 HydrophobicContact CD2-CG 3.68Å; F208-P223 HydrophobicContact CE2-CG 3.87Å; F208-M226 HydrophobicContact CE2-SD 4.25Å; F208-M226 HydrophobicContact CZ-SD 3.79Å; F208-Y240 AromaticContact CD1-CE1 3.53Å; F208-Y240 HydrophobicContact CD1-CE1 3.53Å; F208-Y240 HydrophobicContact CE1-CD1 4.23Å; F208-Y240 AromaticContact CE1-CE1 3.45Å; F208-Y240 HydrophobicContact CE1-CE1 3.45Å; F208-Y240 VanDerWaalsContact CE1-CE1 3.45Å; F208-Y240 HydrophobicContact CG-CE1 4.33Å; F208-Y240 HydrophobicContact CZ-CE1 4.15Å
209	E	94.5	Very high	92.9	Very high	99 Å²	99	54 Å²	54	46%	0.463	26%	0.262	S	S	.	.	H	α-helix	trans	-62.2	-42.2	172.7	-80	178	-179.4	0	0	112.4	N205 E212 K213 K219	N205-E209 VanDerWaalsContact O-CB 3.3Å; N205-E209 WeakPolarHBondContact O-CB 3.47Å; N205-E209 VanDerWaalsContact O-CG 3.32Å; N205-E209 WeakPolarHBondContact O-CG 3.4Å; N205-E209 PolarHBondContact O-N 3.41Å; E209-E212 PolarHBondContact O-N 3.18Å; E209-K213 VanDerWaalsContact O-CB 3.23Å; E209-K213 WeakPolarHBondContact O-CB 3.08Å; E209-K213 PolarHBondContact O-N 3.35Å; E209-K219 IonicContact OE1-NZ 3.49Å
210	I	94.5	Very high	92.8	Very high	16 Å²	16	51 Å²	51	8%	0.082	25%	0.246	C	C	.	.	H	α-helix	trans	-68.7	-39.6	178.1	-70.8	170.9	0	0	0	110.7	I182 L189 I190 L206 A207 E212 H214	I182-I210 HydrophobicContact CD1-CG2 4.45Å; I182-I210 HydrophobicContact CG2-CG2 3.91Å; L189-I210 HydrophobicContact CB-CG2 3.81Å; L189-I210 HydrophobicContact CD1-CG2 3.93Å; L189-I210 HydrophobicContact CG-CG2 4.4Å; L189-I210 VanDerWaalsContact O-CD1 3.29Å; L189-I210 WeakPolarHBondContact O-CD1 2.9Å; I190-I210 HydrophobicContact CD1-CD1 3.91Å; I190-I210 HydrophobicContact CG1-CD1 3.3Å; L206-I210 HydrophobicContact CD1-CD1 3.61Å; L206-I210 HydrophobicContact CD1-CG1 4.34Å; L206-I210 HydrophobicContact CG-CD1 3.85Å; L206-I210 WeakPolarHBondContact O-CB 3.48Å; L206-I210 WeakPolarHBondContact O-CD1 3.46Å; L206-I210 VanDerWaalsContact O-CG1 3.25Å; L206-I210 WeakPolarHBondContact O-CG1 3.43Å; L206-I210 PolarHBondContact O-N 3.49Å; L206-I210 VanDerWaalsContact O-N 3.09Å; A207-I210 PolarHBondContact O-N 3.45Å; I210-E212 PolarHBondContact O-N 3.14Å; I210-H214 WeakPolarHBondContact O-CB 3.48Å; I210-H214 PolarHBondContact O-N 2.86Å
211	A	93.8	Very high	92.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.3	-47.6	175.7	0	0	0	0	0	111.5	A207 F208 L215 D216 I217 Y244	A207-A211 WeakPolarHBondContact O-CB 3.27Å; A207-A211 PolarHBondContact O-N 3.15Å; F208-A211 PolarHBondContact O-N 3.3Å; A211-L215 CarbonylContact O-C 3.44Å; A211-L215 VanDerWaalsContact O-CA 3.3Å; A211-L215 WeakPolarHBondContact O-CA 3.31Å; A211-L215 VanDerWaalsContact O-CB 3.29Å; A211-L215 WeakPolarHBondContact O-CB 3.43Å; A211-L215 PolarHBondContact O-N 2.73Å; A211-D216 PolarHBondContact O-N 3.31Å; A211-I217 CarbonylContact C-O 3.47Å; A211-I217 VanDerWaalsContact C-O 3.3Å; A211-I217 HydrophobicContact CB-CB 3.97Å; A211-I217 HydrophobicContact CB-CG2 4.38Å; A211-I217 PolarHBondContact O-N 3.08Å; A211-Y244 HydrophobicContact CB-CE1 3.96Å; A211-Y244 WeakPolarHBondContact CB-OH 3.41Å
212	E	93.8	Very high	92.6	Very high	91 Å²	91	48.1 Å²	48.1	43%	0.425	23%	0.23	S	C	.	.	H	α-helix	trans	-66.7	-47.1	-179.4	-176.5	172	-124	0	0	111.7	F208 E209 I210 I217 K219	F208-E212 WeakPolarHBondContact O-CB 3.43Å; F208-E212 PolarHBondContact O-N 3.3Å; E209-E212 PolarHBondContact O-N 3.18Å; I210-E212 PolarHBondContact O-N 3.14Å; E212-I217 WeakPolarHBondContact CA-O 3.47Å; E212-I217 PolarHBondContact N-O 3.3Å; E212-I217 VanDerWaalsContact N-O 3.09Å; E212-K219 HydrophobicContact CB-CG 4.22Å; E212-K219 WeakPolarHBondContact OE2-CE 3.32Å; E212-K219 IonicContact OE2-NZ 3.48Å
213	K	91.8	Very high	92.4	Very high	166 Å²	166	42.5 Å²	42.5	72%	0.722	21%	0.207	S	C	*	.	H	α-helix	trans	-75.7	-34.6	-173.5	-173	177.2	176.7	-176.1	0	113.9	E209	E209-K213 VanDerWaalsContact O-CB 3.23Å; E209-K213 WeakPolarHBondContact O-CB 3.08Å; E209-K213 PolarHBondContact O-N 3.35Å
214	H	90.5	Very high	92	Very high	102 Å²	102	48.9 Å²	48.9	47%	0.472	24%	0.237	S	C	.	.	H	α-helix	trans	-119.3	-20.3	-168.8	-66	-71.7	0	0	0	114.5	L189 I210	L189-H214 HydrophobicContact CD1-CB 3.86Å; L189-H214 HydrophobicContact CD2-CB 3.96Å; I210-H214 WeakPolarHBondContact O-CB 3.48Å; I210-H214 PolarHBondContact O-N 2.86Å
215	L	88.9	Confident	91.5	Very high	18 Å²	18	50.3 Å²	50.3	9%	0.094	25%	0.245	C	C	.	.	H	α-helix	trans	-113	-3.1	-179.8	-51.5	177.4	0	0	0	112.5	I182 R186 L189 A211 I217 Y244 V247 F248	I182-L215 HydrophobicContact CG1-CD1 4.16Å; R186-L215 HydrophobicContact CG-CD2 4.23Å; L189-L215 HydrophobicContact CD1-CD2 4.1Å; A211-L215 CarbonylContact O-C 3.44Å; A211-L215 VanDerWaalsContact O-CA 3.3Å; A211-L215 WeakPolarHBondContact O-CA 3.31Å; A211-L215 VanDerWaalsContact O-CB 3.29Å; A211-L215 WeakPolarHBondContact O-CB 3.43Å; A211-L215 PolarHBondContact O-N 2.73Å; L215-I217 HydrophobicContact CB-CD1 3.91Å; L215-I217 HydrophobicContact CB-CG1 3.99Å; L215-I217 HydrophobicContact CD1-CD1 4.28Å; L215-I217 PolarHBondContact O-N 3.48Å; L215-Y244 HydrophobicContact CD1-CD1 4.34Å; L215-Y244 HydrophobicContact CD1-CE1 4.07Å; L215-V247 HydrophobicContact CB-CG1 4.47Å; L215-F248 HydrophobicContact CD1-CE1 4.18Å; L215-F248 HydrophobicContact CD1-CE2 4.26Å; L215-F248 HydrophobicContact CD1-CZ 3.49Å; L215-F248 VanDerWaalsContact CD1-CZ 3.49Å; L215-F248 HydrophobicContact CD2-CE1 3.95Å; L215-F248 HydrophobicContact CD2-CZ 4.08Å; L215-F248 HydrophobicContact CG-CZ 4.45Å
216	D	86.5	Confident	91.1	Very high	99 Å²	99	48 Å²	48	53%	0.529	23%	0.232	S	C	.	.			trans	56.5	32.2	-176	-164.6	33.1	0	0	0	113.2	R45 A211	R45-D216 IonicContact CZ-OD1 2.89Å; R45-D216 IonicContact CZ-OD2 3.34Å; R45-D216 IonicContact NH1-OD1 2.89Å; R45-D216 PolarHBondContact NH1-OD1 3.19Å; R45-D216 IonicContact NH1-OD2 4Å; R45-D216 PolarHBondContact NH1-OD2 3.48Å; R45-D216 PolarHBondContact NH2-O 2.79Å; R45-D216 IonicContact NH2-OD1 2.88Å; R45-D216 PolarHBondContact NH2-OD1 3.39Å; R45-D216 IonicContact NH2-OD2 2.72Å; R45-D216 PolarHBondContact NH2-OD2 3.16Å; A211-D216 PolarHBondContact O-N 3.31Å
217	I	90.7	Very high	90.7	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.021	22%	0.224	C	C	.	.			trans	-102.6	111	176.2	-59.8	173.2	0	0	0	107.9	A211 E212 L215 Y240 Y244 V247	A211-I217 CarbonylContact C-O 3.47Å; A211-I217 VanDerWaalsContact C-O 3.3Å; A211-I217 HydrophobicContact CB-CB 3.97Å; A211-I217 HydrophobicContact CB-CG2 4.38Å; A211-I217 PolarHBondContact O-N 3.08Å; E212-I217 WeakPolarHBondContact CA-O 3.47Å; E212-I217 PolarHBondContact N-O 3.3Å; E212-I217 VanDerWaalsContact N-O 3.09Å; L215-I217 HydrophobicContact CB-CD1 3.91Å; L215-I217 HydrophobicContact CB-CG1 3.99Å; L215-I217 HydrophobicContact CD1-CD1 4.28Å; L215-I217 PolarHBondContact O-N 3.48Å; I217-Y240 HydrophobicContact CG2-CD2 4.27Å; I217-Y240 HydrophobicContact CG2-CE2 3.57Å; I217-Y244 HydrophobicContact CD1-CD1 3.68Å; I217-Y244 HydrophobicContact CD1-CD2 4.31Å; I217-Y244 HydrophobicContact CD1-CE1 4Å; I217-Y244 HydrophobicContact CD1-CG 3.88Å; I217-Y244 HydrophobicContact CG2-CE2 4.45Å; I217-V247 HydrophobicContact CD1-CB 4.25Å; I217-V247 HydrophobicContact CD1-CG2 3.92Å; I217-V247 HydrophobicContact CG1-CG2 3.92Å
218	P	90.6	Very high	90	Very high	27 Å²	27	50.2 Å²	50.2	18%	0.175	25%	0.253	C	S	.	.			trans	-66.2	157.6	-174.3	26.7	-33.1	0	0	0	112	M220 Y240	P218-M220 HydrophobicContact CG-CG 4.24Å; P218-M220 WeakPolarHBondContact O-CG 3.47Å; P218-M220 PolarHBondContact O-N 3.27Å; P218-Y240 WeakPolarHBondContact O-CE2 3.44Å
219	K	92	Very high	89.1	Confident	82 Å²	82	52.4 Å²	52.4	36%	0.357	26%	0.262	S	S	.	.			trans	-72.2	99.6	176	-59.4	-175.9	178	166.8	0	110.6	F208 E209 E212	F208-K219 HydrophobicContact CB-CD 4.41Å; F208-K219 HydrophobicContact CB-CG 4.09Å; E209-K219 IonicContact OE1-NZ 3.49Å; E212-K219 HydrophobicContact CB-CG 4.22Å; E212-K219 WeakPolarHBondContact OE2-CE 3.32Å; E212-K219 IonicContact OE2-NZ 3.48Å
220	M	91	Very high	88.2	Confident	4 Å²	4	56.3 Å²	56.3	2%	0.02	28%	0.277	C	S	.	.			trans	-96.4	-15.4	-178.4	-57.8	176.2	39.9	0	0	113.5	T35 A38 W39 P218 A239 Y240	T35-M220 VanDerWaalsContact CA-O 3.22Å; T35-M220 WeakPolarHBondContact CA-O 3.41Å; T35-M220 WeakPolarHBondContact CB-O 3.44Å; T35-M220 HydrophobicContact CG2-CB 3.91Å; T35-M220 HydrophobicContact CG2-CE 3.59Å; T35-M220 PolarHBondContact OG1-O 2.63Å; A38-M220 HydrophobicContact CB-CB 4.13Å; A38-M220 HydrophobicContact CB-CG 3.77Å; W39-M220 HydrophobicContact CB-CE 3.52Å; W39-M220 HydrophobicContact CB-SD 4.22Å; W39-M220 HydrophobicContact CG-CE 4.03Å; P218-M220 HydrophobicContact CG-CG 4.24Å; P218-M220 WeakPolarHBondContact O-CG 3.47Å; P218-M220 PolarHBondContact O-N 3.27Å; M220-A239 HydrophobicContact CE-CB 4.15Å; M220-Y240 HydrophobicContact CB-CD2 3.62Å; M220-Y240 HydrophobicContact CB-CE2 4.01Å; M220-Y240 HydrophobicContact CB-CG 4.27Å; M220-Y240 HydrophobicContact CE-CD2 4.41Å; M220-Y240 HydrophobicContact CG-CD2 3.76Å; M220-Y240 HydrophobicContact CG-CE2 4.01Å; M220-Y240 HydrophobicContact SD-CD2 3.67Å; M220-Y240 HydrophobicContact SD-CE2 4.3Å
221	L	91.2	Very high	87.1	Confident	9 Å²	9	60.1 Å²	60.1	5%	0.047	30%	0.298	C	S	.	.	S	Bend	trans	-118.1	148.6	-180	-62.1	175.2	0	0	0	110.1	T35 F178 F208 M226 V237 Y240	T35-L221 HydrophobicContact CG2-CD2 4.17Å; T35-L221 WeakPolarHBondContact OG1-CD2 3.43Å; F178-L221 HydrophobicContact CZ-CD1 3.99Å; F208-L221 HydrophobicContact CE2-CB 3.73Å; F208-L221 WeakPolarHBondContact CE2-O 3.46Å; F208-L221 HydrophobicContact CZ-CB 3.85Å; F208-L221 HydrophobicContact CZ-CD1 4.26Å; L221-M226 HydrophobicContact CB-CG 4.44Å; L221-M226 HydrophobicContact CB-SD 3.7Å; L221-M226 HydrophobicContact CD1-CE 4.12Å; L221-M226 HydrophobicContact CD1-SD 3.53Å; L221-M226 VanDerWaalsContact CD1-SD 3.53Å; L221-M226 HydrophobicContact CG-SD 4.12Å; L221-V237 HydrophobicContact CD1-CG2 4.15Å; L221-Y240 HydrophobicContact CD1-CD1 3.47Å; L221-Y240 VanDerWaalsContact CD1-CD1 3.47Å; L221-Y240 HydrophobicContact CD1-CE1 4.31Å; L221-Y240 HydrophobicContact CD1-CG 3.99Å; L221-Y240 HydrophobicContact CG-CD1 3.94Å; L221-Y240 HydrophobicContact CG-CG 4.16Å
222	D	88.7	Confident	86.4	Confident	46 Å²	46	60.7 Å²	60.7	25%	0.246	30%	0.302	C	S	.	.			trans	-98.5	117.2	179	-175.8	-45.4	0	0	0	109.2	K34 E224 D225 M226	K34-D222 IonicContact NZ-OD2 2.71Å; K34-D222 PolarHBondContact NZ-OD2 3.17Å; D222-E224 PolarHBondContact O-N 3.08Å; D222-E224 WeakPolarHBondContact OD1-CB 3.37Å; D222-E224 PolarHBondContact OD1-N 3.46Å; D222-D225 HydrophobicContact CB-CB 3.96Å; D222-D225 PolarHBondContact O-N 3.06Å; D222-D225 PolarHBondContact OD1-N 3.4Å; D222-M226 WeakPolarHBondContact O-CG 3.4Å; D222-M226 PolarHBondContact O-N 2.93Å
223	P	90.8	Very high	86	Confident	15 Å²	15	57.6 Å²	57.6	10%	0.097	29%	0.288	C	S	.	.	H	α-helix	trans	-56.3	-34	-177.9	-31.5	39.4	0	0	0	114.7	V201 L204 N205 F208 A227	V201-P223 HydrophobicContact CG1-CB 4.23Å; L204-P223 HydrophobicContact CB-CB 3.79Å; L204-P223 HydrophobicContact CB-CG 4.2Å; L204-P223 HydrophobicContact CD1-CB 4.49Å; N205-P223 HydrophobicContact CB-CG 4.49Å; N205-P223 WeakPolarHBondContact OD1-CG 3.46Å; F208-P223 HydrophobicContact CD2-CG 3.68Å; F208-P223 HydrophobicContact CE2-CG 3.87Å; P223-A227 VanDerWaalsContact O-CB 3.31Å; P223-A227 WeakPolarHBondContact O-CB 3.47Å; P223-A227 PolarHBondContact O-N 3.41Å; P223-A227 VanDerWaalsContact O-N 3.12Å
224	E	87.7	Confident	85.9	Confident	136 Å²	136	52.7 Å²	52.7	64%	0.636	27%	0.268	S	S	*	.	H	α-helix	trans	-76.7	-42.6	-177.9	-61.6	-176.8	175.7	0	0	110.8	V201 D222 A227 S228	V201-E224 HydrophobicContact CG1-CG 4.34Å; D222-E224 PolarHBondContact O-N 3.08Å; D222-E224 WeakPolarHBondContact OD1-CB 3.37Å; D222-E224 PolarHBondContact OD1-N 3.46Å; E224-A227 PolarHBondContact O-N 2.94Å; E224-S228 VanDerWaalsContact O-CB 3.29Å; E224-S228 WeakPolarHBondContact O-CB 3.48Å; E224-S228 PolarHBondContact O-N 3.16Å; E224-S228 PolarHBondContact O-OG 3.4Å
225	D	84.4	Confident	85.9	Confident	30 Å²	30	50.4 Å²	50.4	16%	0.16	26%	0.257	C	S	.	.	H	α-helix	trans	-61.3	-43.7	174.4	-82.6	-49.1	0	0	0	111.1	K34 D222 S228 R229	K34-D225 IonicContact NZ-OD2 2.78Å; K34-D225 PolarHBondContact NZ-OD2 3.5Å; D222-D225 HydrophobicContact CB-CB 3.96Å; D222-D225 PolarHBondContact O-N 3.06Å; D222-D225 PolarHBondContact OD1-N 3.4Å; D225-S228 PolarHBondContact O-OG 3.33Å; D225-R229 WeakPolarHBondContact O-CB 3.12Å; D225-R229 VanDerWaalsContact O-CD 3.27Å; D225-R229 WeakPolarHBondContact O-CD 3.33Å; D225-R229 WeakPolarHBondContact O-CG 3.13Å; D225-R229 PolarHBondContact O-N 3.03Å; D225-R229 IonicContact OD1-CZ 3.56Å; D225-R229 IonicContact OD1-NE 3.89Å; D225-R229 PolarHBondContact OD1-NE 2.81Å; D225-R229 IonicContact OD1-NH2 3.25Å; D225-R229 PolarHBondContact OD1-NH2 3.17Å; D225-R229 IonicContact OD2-NH2 3.05Å
226	M	86.7	Confident	86.1	Confident	4 Å²	4	49.6 Å²	49.6	2%	0.02	25%	0.253	C	S	.	.	H	α-helix	trans	-65.8	-44.2	178.3	-74.1	-166.7	75.8	0	0	112.6	F172 F178 L204 F208 L221 D222 C232 V237	F172-M226 HydrophobicContact CB-CE 4.43Å; F178-M226 HydrophobicContact CE2-CE 4.05Å; L204-M226 HydrophobicContact CD1-CB 3.86Å; L204-M226 HydrophobicContact CD2-CE 4.38Å; L204-M226 HydrophobicContact CD2-SD 4.09Å; F208-M226 HydrophobicContact CE2-SD 4.25Å; F208-M226 HydrophobicContact CZ-SD 3.79Å; L221-M226 HydrophobicContact CB-CG 4.44Å; L221-M226 HydrophobicContact CB-SD 3.7Å; L221-M226 HydrophobicContact CD1-CE 4.12Å; L221-M226 HydrophobicContact CD1-SD 3.53Å; L221-M226 VanDerWaalsContact CD1-SD 3.53Å; L221-M226 HydrophobicContact CG-SD 4.12Å; D222-M226 WeakPolarHBondContact O-CG 3.4Å; D222-M226 PolarHBondContact O-N 2.93Å; M226-C232 HydrophobicContact CE-CB 4.46Å; M226-V237 HydrophobicContact CE-CG2 4.03Å
227	A	85.6	Confident	86.4	Confident	15 Å²	15	44.9 Å²	44.9	12%	0.124	23%	0.228	C	C	.	.	H	α-helix	trans	-71.8	-34.7	-175.9	0	0	0	0	0	113.1	K173 H200 V201 L204 P223 E224	K173-A227 WeakPolarHBondContact CE-O 3.49Å; H200-A227 HydrophobicContact CB-CB 3.82Å; V201-A227 HydrophobicContact CG2-CB 3.49Å; V201-A227 VanDerWaalsContact CG2-CB 3.49Å; L204-A227 HydrophobicContact CD1-CB 4.39Å; P223-A227 VanDerWaalsContact O-CB 3.31Å; P223-A227 WeakPolarHBondContact O-CB 3.47Å; P223-A227 PolarHBondContact O-N 3.41Å; P223-A227 VanDerWaalsContact O-N 3.12Å; E224-A227 PolarHBondContact O-N 2.94Å
228	S	81.5	Confident	86.5	Confident	90 Å²	90	44.9 Å²	44.9	63%	0.629	23%	0.228	S	C	*	.	H	α-helix	trans	-79.6	-33.7	-174.5	59.7	0	0	0	0	113.8	E224 D225	E224-S228 VanDerWaalsContact O-CB 3.29Å; E224-S228 WeakPolarHBondContact O-CB 3.48Å; E224-S228 PolarHBondContact O-N 3.16Å; E224-S228 PolarHBondContact O-OG 3.4Å; D225-S228 PolarHBondContact O-OG 3.33Å
229	R	77.1	Confident	86.6	Confident	47 Å²	47	43.6 Å²	43.6	18%	0.177	22%	0.22	C	C	.	.	S	Bend	trans	-78.5	151.2	-172	-68.5	173.2	-170	-149.3	5.8	113.2	A27 K173 D225	A27-R229 PolarHBondContact O-NH1 3.29Å; A27-R229 PolarHBondContact O-NH2 3.31Å; K173-R229 VanDerWaalsContact CE-O 3.23Å; K173-R229 WeakPolarHBondContact CE-O 3.44Å; K173-R229 PolarHBondContact NZ-O 3.45Å; D225-R229 WeakPolarHBondContact O-CB 3.12Å; D225-R229 VanDerWaalsContact O-CD 3.27Å; D225-R229 WeakPolarHBondContact O-CD 3.33Å; D225-R229 WeakPolarHBondContact O-CG 3.13Å; D225-R229 PolarHBondContact O-N 3.03Å; D225-R229 IonicContact OD1-CZ 3.56Å; D225-R229 IonicContact OD1-NE 3.89Å; D225-R229 PolarHBondContact OD1-NE 2.81Å; D225-R229 IonicContact OD1-NH2 3.25Å; D225-R229 PolarHBondContact OD1-NH2 3.17Å; D225-R229 IonicContact OD2-NH2 3.05Å
230	K	74.2	Confident	86.7	Confident	181 Å²	181	39.7 Å²	39.7	79%	0.787	20%	0.203	S	C	*	.	S	Bend	trans	-64	-50.9	176.7	-171.8	179.1	178.3	-175.4	0	111
231	N	72.1	Confident	86.9	Confident	97 Å²	97	39.5 Å²	39.5	52%	0.519	20%	0.202	S	C	.	.	S	Bend	trans	-125.2	129.7	176.4	-64.1	-14.9	0	0	0	108.7
232	C	78.9	Confident	86.9	Confident	12 Å²	12	39.1 Å²	39.1	8%	0.081	20%	0.199	C	C	.	.			trans	-73.9	155.8	168.8	-60.1	0	0	0	0	109.9	H169 M226 E234 V237	H169-C232 VanDerWaalsContact CB-O 3.29Å; H169-C232 WeakPolarHBondContact CB-O 3.47Å; M226-C232 HydrophobicContact CE-CB 4.46Å; C232-E234 PolarHBondContact O-N 2.99Å; C232-V237 HydrophobicContact CB-CG2 4.2Å
233	D	85.4	Confident	87	Confident	25 Å²	25	37.9 Å²	37.9	13%	0.134	19%	0.194	C	C	.	.			trans	-69.4	117.8	173.4	175	60.8	0	0	0	110.4	Q31 Q32 Q235 S236 V237	Q31-D233 HydrophobicContact CG-CB 4.44Å; Q32-D233 WeakPolarHBondContact CG-OD2 3.35Å; Q32-D233 PolarHBondContact NE2-OD1 3.26Å; Q32-D233 PolarHBondContact NE2-OD2 3.29Å; D233-Q235 VanDerWaalsContact C-N 3.34Å; D233-Q235 PolarHBondContact O-N 3.03Å; D233-S236 PolarHBondContact O-N 3.39Å; D233-S236 WeakPolarHBondContact OD2-CB 3.3Å; D233-S236 PolarHBondContact OD2-N 2.89Å; D233-S236 PolarHBondContact OD2-OG 3.04Å; D233-V237 WeakPolarHBondContact O-CG2 3.4Å; D233-V237 PolarHBondContact O-N 3.33Å
234	E	90	Very high	87.1	Confident	63 Å²	63	37.2 Å²	37.2	29%	0.294	19%	0.19	S	C	.	.	H	α-helix	trans	-61.2	-41	-177.2	162.2	166.7	-155.4	0	0	111.9	K146 F168 C232 S236 V237 M238	K146-E234 WeakPolarHBondContact CE-OE1 3.36Å; K146-E234 IonicContact NZ-OE1 2.7Å; K146-E234 PolarHBondContact NZ-OE1 3.04Å; K146-E234 IonicContact NZ-OE2 3.37Å; F168-E234 HydrophobicContact CB-CB 4.42Å; F168-E234 HydrophobicContact CB-CG 3.89Å; C232-E234 PolarHBondContact O-N 2.99Å; E234-S236 VanDerWaalsContact C-N 3.35Å; E234-S236 PolarHBondContact O-N 3.49Å; E234-V237 PolarHBondContact O-N 3.28Å; E234-M238 HydrophobicContact CG-CG 4.23Å; E234-M238 HydrophobicContact CG-SD 3.74Å; E234-M238 WeakPolarHBondContact O-CB 3.3Å; E234-M238 VanDerWaalsContact O-CG 3.31Å; E234-M238 WeakPolarHBondContact O-CG 3.14Å; E234-M238 PolarHBondContact O-N 3.19Å
235	Q	91.2	Very high	87.3	Confident	55 Å²	55	32.1 Å²	32.1	26%	0.257	17%	0.165	S	C	.	.	H	α-helix	trans	-62.6	-43.8	-179.1	-65.3	-173.5	-11.5	0	0	111.3	F36 W127 D233 V237 M238 A239	F36-Q235 HydrophobicContact CZ-CB 4.16Å; W127-Q235 HydrophobicContact CD2-CB 4.07Å; W127-Q235 HydrophobicContact CD2-CG 3.88Å; W127-Q235 HydrophobicContact CE3-CB 3.68Å; W127-Q235 HydrophobicContact CE3-CG 4.01Å; W127-Q235 HydrophobicContact CH2-CB 3.94Å; W127-Q235 HydrophobicContact CH2-CG 3.94Å; W127-Q235 HydrophobicContact CZ2-CB 4.31Å; W127-Q235 HydrophobicContact CZ2-CG 3.81Å; W127-Q235 HydrophobicContact CZ3-CB 3.61Å; W127-Q235 HydrophobicContact CZ3-CG 4.04Å; W127-Q235 WeakPolarHBondContact CZ3-O 3.47Å; D233-Q235 VanDerWaalsContact C-N 3.34Å; D233-Q235 PolarHBondContact O-N 3.03Å; Q235-V237 PolarHBondContact O-N 3.33Å; Q235-M238 PolarHBondContact O-N 3.39Å; Q235-A239 WeakPolarHBondContact O-CB 3.34Å; Q235-A239 PolarHBondContact O-N 3.41Å
236	S	91.6	Very high	87.3	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.2	-42	177.5	-62.8	0	0	0	0	112.2	T35 D233 E234 Y240	T35-S236 WeakPolarHBondContact CG2-O 3.29Å; D233-S236 PolarHBondContact O-N 3.39Å; D233-S236 WeakPolarHBondContact OD2-CB 3.3Å; D233-S236 PolarHBondContact OD2-N 2.89Å; D233-S236 PolarHBondContact OD2-OG 3.04Å; E234-S236 VanDerWaalsContact C-N 3.35Å; E234-S236 PolarHBondContact O-N 3.49Å; S236-Y240 PolarHBondContact O-N 2.96Å; S236-Y240 VanDerWaalsContact O-N 3.14Å
237	V	93	Very high	87.3	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-69.5	-42.1	178.3	176.6	0	0	0	0	111.5	F168 F172 F178 L221 M226 C232 D233 E234 Q235 Y240 L241	F168-V237 HydrophobicContact CB-CG1 4.41Å; F168-V237 WeakPolarHBondContact O-CB 3.46Å; F168-V237 WeakPolarHBondContact O-CG1 3.28Å; F168-V237 WeakPolarHBondContact O-CG2 3.44Å; F172-V237 HydrophobicContact CB-CG1 4.37Å; F172-V237 HydrophobicContact CD2-CG1 4.08Å; F172-V237 HydrophobicContact CG-CG1 4.16Å; F178-V237 HydrophobicContact CZ-CG1 4.39Å; L221-V237 HydrophobicContact CD1-CG2 4.15Å; M226-V237 HydrophobicContact CE-CG2 4.03Å; C232-V237 HydrophobicContact CB-CG2 4.2Å; D233-V237 WeakPolarHBondContact O-CG2 3.4Å; D233-V237 PolarHBondContact O-N 3.33Å; E234-V237 PolarHBondContact O-N 3.28Å; Q235-V237 PolarHBondContact O-N 3.33Å; V237-Y240 PolarHBondContact O-N 2.91Å; V237-L241 HydrophobicContact CG1-CD1 3.64Å; V237-L241 HydrophobicContact CG1-CG 4.21Å; V237-L241 WeakPolarHBondContact O-CB 3.2Å; V237-L241 WeakPolarHBondContact O-CG 3.44Å; V237-L241 PolarHBondContact O-N 2.83Å
238	M	93.4	Very high	87.3	Confident	4 Å²	4	37.8 Å²	37.8	2%	0.02	19%	0.192	C	C	.	.	H	α-helix	trans	-60.6	-46.1	175.4	-75.7	178.1	64.9	0	0	111.9	W127 I135 K146 F168 E234 Q235 Y240 L241 S242	W127-M238 HydrophobicContact CH2-CB 4.09Å; W127-M238 HydrophobicContact CH2-CE 4.05Å; W127-M238 HydrophobicContact CH2-SD 4.05Å; W127-M238 HydrophobicContact CZ2-CE 4.48Å; W127-M238 HydrophobicContact CZ3-CB 4.49Å; I135-M238 HydrophobicContact CD1-CB 4.05Å; I135-M238 HydrophobicContact CD1-CE 3.97Å; I135-M238 HydrophobicContact CG2-CE 4.35Å; K146-M238 HydrophobicContact CB-CE 4.11Å; K146-M238 HydrophobicContact CD-CE 4.16Å; K146-M238 HydrophobicContact CD-SD 4.33Å; K146-M238 HydrophobicContact CG-CE 3.8Å; K146-M238 HydrophobicContact CG-SD 4.37Å; F168-M238 HydrophobicContact CB-CG 3.95Å; F168-M238 HydrophobicContact CD1-CG 3.91Å; F168-M238 HydrophobicContact CD2-CG 3.52Å; F168-M238 HydrophobicContact CD2-SD 3.78Å; F168-M238 HydrophobicContact CE1-CG 4.25Å; F168-M238 HydrophobicContact CE2-CE 4.45Å; F168-M238 HydrophobicContact CE2-CG 3.9Å; F168-M238 HydrophobicContact CE2-SD 4.09Å; F168-M238 HydrophobicContact CG-CG 3.51Å; F168-M238 HydrophobicContact CG-SD 4.35Å; F168-M238 HydrophobicContact CZ-CG 4.23Å; E234-M238 HydrophobicContact CG-CG 4.23Å; E234-M238 HydrophobicContact CG-SD 3.74Å; E234-M238 WeakPolarHBondContact O-CB 3.3Å; E234-M238 VanDerWaalsContact O-CG 3.31Å; E234-M238 WeakPolarHBondContact O-CG 3.14Å; E234-M238 PolarHBondContact O-N 3.19Å; Q235-M238 PolarHBondContact O-N 3.39Å; M238-Y240 VanDerWaalsContact C-N 3.27Å; M238-Y240 PolarHBondContact O-N 3.38Å; M238-L241 PolarHBondContact O-N 2.8Å; M238-S242 WeakPolarHBondContact O-CB 3.39Å; M238-S242 PolarHBondContact O-N 3.43Å
239	A	92.5	Very high	87	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-56.7	-44.7	176.2	0	0	0	0	0	110.8	T35 F36 I130 M220 Q235 S242	T35-A239 HydrophobicContact CG2-CB 4.47Å; F36-A239 HydrophobicContact CE1-CB 4.49Å; I130-A239 HydrophobicContact CD1-CB 4.23Å; I130-A239 HydrophobicContact CG2-CB 3.97Å; M220-A239 HydrophobicContact CE-CB 4.15Å; Q235-A239 WeakPolarHBondContact O-CB 3.34Å; Q235-A239 PolarHBondContact O-N 3.41Å; A239-S242 PolarHBondContact O-N 3.43Å; A239-S242 PolarHBondContact O-OG 3.23Å
240	Y	94.5	Very high	86.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-68.3	-44.5	179.7	-164.9	-135.5	0	0	0	113.1	F178 F208 I217 P218 M220 L221 S236 V237 M238 S242 S243 Y244	F178-Y240 HydrophobicContact CD1-CD1 4.49Å; F178-Y240 HydrophobicContact CD1-CE1 4.48Å; F178-Y240 AromaticContact CE1-CD1 3.64Å; F178-Y240 HydrophobicContact CE1-CD1 3.64Å; F178-Y240 HydrophobicContact CE1-CE1 4.03Å; F178-Y240 AromaticContact CZ-CD1 3.89Å; F178-Y240 HydrophobicContact CZ-CD1 3.89Å; F178-Y240 HydrophobicContact CZ-CE1 4.42Å; F208-Y240 AromaticContact CD1-CE1 3.53Å; F208-Y240 HydrophobicContact CD1-CE1 3.53Å; F208-Y240 HydrophobicContact CE1-CD1 4.23Å; F208-Y240 AromaticContact CE1-CE1 3.45Å; F208-Y240 HydrophobicContact CE1-CE1 3.45Å; F208-Y240 VanDerWaalsContact CE1-CE1 3.45Å; F208-Y240 HydrophobicContact CG-CE1 4.33Å; F208-Y240 HydrophobicContact CZ-CE1 4.15Å; I217-Y240 HydrophobicContact CG2-CD2 4.27Å; I217-Y240 HydrophobicContact CG2-CE2 3.57Å; P218-Y240 WeakPolarHBondContact O-CE2 3.44Å; M220-Y240 HydrophobicContact CB-CD2 3.62Å; M220-Y240 HydrophobicContact CB-CE2 4.01Å; M220-Y240 HydrophobicContact CB-CG 4.27Å; M220-Y240 HydrophobicContact CE-CD2 4.41Å; M220-Y240 HydrophobicContact CG-CD2 3.76Å; M220-Y240 HydrophobicContact CG-CE2 4.01Å; M220-Y240 HydrophobicContact SD-CD2 3.67Å; M220-Y240 HydrophobicContact SD-CE2 4.3Å; L221-Y240 HydrophobicContact CD1-CD1 3.47Å; L221-Y240 VanDerWaalsContact CD1-CD1 3.47Å; L221-Y240 HydrophobicContact CD1-CE1 4.31Å; L221-Y240 HydrophobicContact CD1-CG 3.99Å; L221-Y240 HydrophobicContact CG-CD1 3.94Å; L221-Y240 HydrophobicContact CG-CG 4.16Å; S236-Y240 PolarHBondContact O-N 2.96Å; S236-Y240 VanDerWaalsContact O-N 3.14Å; V237-Y240 PolarHBondContact O-N 2.91Å; M238-Y240 VanDerWaalsContact C-N 3.27Å; M238-Y240 PolarHBondContact O-N 3.38Å; Y240-S242 VanDerWaalsContact C-N 3.29Å; Y240-S242 PolarHBondContact O-N 3.45Å; Y240-S243 WeakPolarHBondContact O-CB 3.47Å; Y240-S243 PolarHBondContact O-N 3.36Å; Y240-S243 VanDerWaalsContact O-N 3.14Å; Y240-Y244 AromaticContact CD1-CE2 3.88Å; Y240-Y244 HydrophobicContact CD1-CE2 3.88Å; Y240-Y244 HydrophobicContact CD2-CE2 4.45Å; Y240-Y244 AromaticContact CE1-CE2 3.53Å; Y240-Y244 HydrophobicContact CE1-CE2 3.53Å; Y240-Y244 HydrophobicContact CE2-CE2 4.14Å; Y240-Y244 HydrophobicContact CG-CE2 4.35Å; Y240-Y244 AromaticContact CZ-CE2 3.69Å; Y240-Y244 WeakPolarHBondContact O-CD2 3.35Å; Y240-Y244 PolarHBondContact O-N 3.37Å; Y240-Y244 PolarHBondContact OH-OH 3.29Å
241	L	94.3	Very high	85.5	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.4	-32.4	177.2	-73.5	167.9	0	0	0	112.7	L149 F168 F172 F178 I181 V237 M238 S243 Y244 Y245	L149-L241 HydrophobicContact CD2-CB 4.44Å; F168-L241 HydrophobicContact CD1-CD1 3.59Å; F168-L241 HydrophobicContact CE1-CD1 3.81Å; F172-L241 HydrophobicContact CD1-CD1 4.24Å; F172-L241 HydrophobicContact CD1-CD2 4.23Å; F172-L241 HydrophobicContact CD2-CD1 4.3Å; F172-L241 HydrophobicContact CE1-CD1 3.68Å; F172-L241 HydrophobicContact CE1-CD2 3.62Å; F172-L241 HydrophobicContact CE1-CG 4.25Å; F172-L241 HydrophobicContact CE2-CD1 3.74Å; F172-L241 HydrophobicContact CZ-CD1 3.4Å; F172-L241 HydrophobicContact CZ-CD2 4.11Å; F172-L241 HydrophobicContact CZ-CG 4.4Å; F178-L241 HydrophobicContact CD1-CD2 4.07Å; F178-L241 HydrophobicContact CE1-CD2 3.56Å; F178-L241 HydrophobicContact CE1-CG 4.07Å; F178-L241 HydrophobicContact CZ-CD2 4.36Å; I181-L241 HydrophobicContact CD1-CD2 3.97Å; V237-L241 HydrophobicContact CG1-CD1 3.64Å; V237-L241 HydrophobicContact CG1-CG 4.21Å; V237-L241 WeakPolarHBondContact O-CB 3.2Å; V237-L241 WeakPolarHBondContact O-CG 3.44Å; V237-L241 PolarHBondContact O-N 2.83Å; M238-L241 PolarHBondContact O-N 2.8Å; L241-S243 PolarHBondContact O-N 3.3Å; L241-Y244 WeakPolarHBondContact O-CB 3.46Å; L241-Y244 PolarHBondContact O-N 3.23Å; L241-Y244 VanDerWaalsContact O-N 3.13Å; L241-Y245 PolarHBondContact O-N 3.08Å
242	S	92.1	Very high	85.1	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.9	-36.7	174	79.7	0	0	0	0	111.8	M238 A239 Y240 Y245 H246	M238-S242 WeakPolarHBondContact O-CB 3.39Å; M238-S242 PolarHBondContact O-N 3.43Å; A239-S242 PolarHBondContact O-N 3.43Å; A239-S242 PolarHBondContact O-OG 3.23Å; Y240-S242 VanDerWaalsContact C-N 3.29Å; Y240-S242 PolarHBondContact O-N 3.45Å; S242-Y245 WeakPolarHBondContact O-CB 3.36Å; S242-Y245 PolarHBondContact O-N 3.48Å; S242-H246 PolarHBondContact O-CD2 3.21Å; S242-H246 PolarHBondContact O-N 2.76Å
243	S	91.2	Very high	84.3	Confident	20 Å²	20	35.5 Å²	35.5	14%	0.14	19%	0.191	C	C	.	.	H	α-helix	trans	-64.7	-40.5	174.7	-54.6	0	0	0	0	112	Y240 L241 V247	Y240-S243 WeakPolarHBondContact O-CB 3.47Å; Y240-S243 PolarHBondContact O-N 3.36Å; Y240-S243 VanDerWaalsContact O-N 3.14Å; L241-S243 PolarHBondContact O-N 3.3Å; S243-V247 WeakPolarHBondContact O-CG2 3.41Å; S243-V247 PolarHBondContact O-N 3.36Å
244	Y	92.6	Very high	83.5	Confident	1 Å²	1	35.7 Å²	35.7	0%	0.004	19%	0.193	C	C	.	.	H	α-helix	trans	-63.8	-41.7	172.4	-75.9	-87.4	0	0	0	112.1	F178 I182 A211 L215 I217 Y240 L241 V247 F248	F178-Y244 AromaticContact CD1-CE2 3.98Å; F178-Y244 HydrophobicContact CD1-CE2 3.98Å; F178-Y244 HydrophobicContact CE1-CE2 4.14Å; I182-Y244 HydrophobicContact CD1-CE1 3.84Å; I182-Y244 HydrophobicContact CG1-CD1 4.35Å; I182-Y244 HydrophobicContact CG1-CE1 3.64Å; A211-Y244 HydrophobicContact CB-CE1 3.96Å; A211-Y244 WeakPolarHBondContact CB-OH 3.41Å; L215-Y244 HydrophobicContact CD1-CD1 4.34Å; L215-Y244 HydrophobicContact CD1-CE1 4.07Å; I217-Y244 HydrophobicContact CD1-CD1 3.68Å; I217-Y244 HydrophobicContact CD1-CD2 4.31Å; I217-Y244 HydrophobicContact CD1-CE1 4Å; I217-Y244 HydrophobicContact CD1-CG 3.88Å; I217-Y244 HydrophobicContact CG2-CE2 4.45Å; Y240-Y244 AromaticContact CD1-CE2 3.88Å; Y240-Y244 HydrophobicContact CD1-CE2 3.88Å; Y240-Y244 HydrophobicContact CD2-CE2 4.45Å; Y240-Y244 AromaticContact CE1-CE2 3.53Å; Y240-Y244 HydrophobicContact CE1-CE2 3.53Å; Y240-Y244 HydrophobicContact CE2-CE2 4.14Å; Y240-Y244 HydrophobicContact CG-CE2 4.35Å; Y240-Y244 AromaticContact CZ-CE2 3.69Å; Y240-Y244 WeakPolarHBondContact O-CD2 3.35Å; Y240-Y244 PolarHBondContact O-N 3.37Å; Y240-Y244 PolarHBondContact OH-OH 3.29Å; L241-Y244 WeakPolarHBondContact O-CB 3.46Å; L241-Y244 PolarHBondContact O-N 3.23Å; L241-Y244 VanDerWaalsContact O-N 3.13Å; Y244-V247 PolarHBondContact O-N 3.14Å; Y244-F248 HydrophobicContact CD1-CD2 4.49Å; Y244-F248 AromaticContact CD1-CE2 3.8Å; Y244-F248 HydrophobicContact CD1-CE2 3.8Å; Y244-F248 WeakPolarHBondContact O-CB 3.17Å; Y244-F248 VanDerWaalsContact O-CD2 3.31Å; Y244-F248 WeakPolarHBondContact O-CD2 3.45Å; Y244-F248 PolarHBondContact O-N 2.89Å
245	Y	90.7	Very high	82.4	Confident	30 Å²	30	37.4 Å²	37.4	12%	0.118	20%	0.204	C	C	.	.	H	α-helix	trans	-57.8	-51.8	176.9	177	-94.8	0	0	0	111	I138 I140 L149 W152 L241 S242 V247 F248 S249	I138-Y245 HydrophobicContact CB-CE1 4.19Å; I138-Y245 HydrophobicContact CD1-CD1 3.48Å; I138-Y245 VanDerWaalsContact CD1-CD1 3.48Å; I138-Y245 HydrophobicContact CD1-CE1 3.93Å; I138-Y245 HydrophobicContact CD1-CG 3.84Å; I138-Y245 HydrophobicContact CG1-CD1 3.66Å; I138-Y245 HydrophobicContact CG1-CE1 3.57Å; I138-Y245 HydrophobicContact CG1-CG 4.4Å; I138-Y245 HydrophobicContact CG2-CD1 4.31Å; I138-Y245 HydrophobicContact CG2-CD2 4.28Å; I138-Y245 HydrophobicContact CG2-CE1 3.89Å; I138-Y245 HydrophobicContact CG2-CE2 3.89Å; I138-Y245 HydrophobicContact CG2-CG 4.48Å; I140-Y245 HydrophobicContact CD1-CE2 3.95Å; L149-Y245 HydrophobicContact CD1-CD2 4.48Å; L149-Y245 HydrophobicContact CD1-CG 4.33Å; W152-Y245 HydrophobicContact CB-CD2 4.32Å; W152-Y245 HydrophobicContact CB-CE2 4.46Å; W152-Y245 AromaticContact CD1-CD2 3.74Å; W152-Y245 AromaticContact CD1-CE2 3.72Å; W152-Y245 AromaticContact CD2-CD2 3.63Å; W152-Y245 HydrophobicContact CD2-CD2 3.63Å; W152-Y245 HydrophobicContact CD2-CE2 4.37Å; W152-Y245 AromaticContact CE2-CD2 3.74Å; W152-Y245 HydrophobicContact CE3-CD2 4.16Å; W152-Y245 AromaticContact CG-CD2 3.67Å; W152-Y245 HydrophobicContact CG-CD2 3.67Å; W152-Y245 AromaticContact CG-CE2 3.95Å; W152-Y245 HydrophobicContact CG-CE2 3.95Å; W152-Y245 HydrophobicContact CZ2-CD2 4.39Å; W152-Y245 AromaticContact NE1-CD2 3.77Å; L241-Y245 PolarHBondContact O-N 3.08Å; S242-Y245 WeakPolarHBondContact O-CB 3.36Å; S242-Y245 PolarHBondContact O-N 3.48Å; Y245-V247 VanDerWaalsContact C-N 3.3Å; Y245-V247 PolarHBondContact O-N 3.43Å; Y245-F248 PolarHBondContact O-N 3.11Å; Y245-S249 WeakPolarHBondContact O-CA 3.32Å; Y245-S249 WeakPolarHBondContact O-CB 3.25Å; Y245-S249 PolarHBondContact O-N 2.43Å; Y245-S249 PolarHBondContact O-OG 3.37Å
246	H	85.7	Confident	81.2	Confident	74 Å²	74	38.7 Å²	38.7	34%	0.343	21%	0.212	S	C	.	.	H	α-helix	trans	-60.6	-39.2	-178.8	-73.2	-56.4	0	0	0	112.8	A134 S242 S249	A134-H246 PolarHBondContact O-NE2 2.93Å; S242-H246 PolarHBondContact O-CD2 3.21Å; S242-H246 PolarHBondContact O-N 2.76Å; H246-S249 PolarHBondContact O-OG 3.06Å
247	V	85.4	Confident	80.3	Confident	70 Å²	70	38.9 Å²	38.9	42%	0.424	21%	0.214	S	C	.	.	H	α-helix	trans	-67.4	-39.9	177	171.7	0	0	0	0	112.2	L215 I217 S243 Y244 Y245	L215-V247 HydrophobicContact CB-CG1 4.47Å; I217-V247 HydrophobicContact CD1-CB 4.25Å; I217-V247 HydrophobicContact CD1-CG2 3.92Å; I217-V247 HydrophobicContact CG1-CG2 3.92Å; S243-V247 WeakPolarHBondContact O-CG2 3.41Å; S243-V247 PolarHBondContact O-N 3.36Å; Y244-V247 PolarHBondContact O-N 3.14Å; Y245-V247 VanDerWaalsContact C-N 3.3Å; Y245-V247 PolarHBondContact O-N 3.43Å
248	F	86.1	Confident	79.5	Confident	24 Å²	24	39.4 Å²	39.4	11%	0.105	22%	0.218	C	C	.	.	H	α-helix	trans	-92.3	-17.8	-175.7	-65.1	-41.8	0	0	0	114.9	W152 I181 N185 R186 L215 Y244 Y245 G250	W152-F248 HydrophobicContact CH2-CD2 4.18Å; W152-F248 HydrophobicContact CZ2-CB 4.04Å; W152-F248 HydrophobicContact CZ2-CD2 4.2Å; I181-F248 HydrophobicContact CG2-CD2 4.09Å; I181-F248 HydrophobicContact CG2-CE2 3.95Å; N185-F248 HydrophobicContact CB-CB 4.47Å; N185-F248 HydrophobicContact CB-CD1 3.44Å; N185-F248 VanDerWaalsContact CB-CD1 3.44Å; N185-F248 HydrophobicContact CB-CD2 4.05Å; N185-F248 HydrophobicContact CB-CE1 3.48Å; N185-F248 VanDerWaalsContact CB-CE1 3.48Å; N185-F248 HydrophobicContact CB-CE2 4.05Å; N185-F248 HydrophobicContact CB-CG 3.74Å; N185-F248 HydrophobicContact CB-CZ 3.78Å; R186-F248 HydrophobicContact CG-CE1 4.04Å; L215-F248 HydrophobicContact CD1-CE1 4.18Å; L215-F248 HydrophobicContact CD1-CE2 4.26Å; L215-F248 HydrophobicContact CD1-CZ 3.49Å; L215-F248 VanDerWaalsContact CD1-CZ 3.49Å; L215-F248 HydrophobicContact CD2-CE1 3.95Å; L215-F248 HydrophobicContact CD2-CZ 4.08Å; L215-F248 HydrophobicContact CG-CZ 4.45Å; Y244-F248 HydrophobicContact CD1-CD2 4.49Å; Y244-F248 AromaticContact CD1-CE2 3.8Å; Y244-F248 HydrophobicContact CD1-CE2 3.8Å; Y244-F248 WeakPolarHBondContact O-CB 3.17Å; Y244-F248 VanDerWaalsContact O-CD2 3.31Å; Y244-F248 WeakPolarHBondContact O-CD2 3.45Å; Y244-F248 PolarHBondContact O-N 2.89Å; Y245-F248 PolarHBondContact O-N 3.11Å; F248-G250 VanDerWaalsContact C-N 3.31Å; F248-G250 PolarHBondContact O-N 3.29Å
249	S	74.9	Confident	78.5	Confident	8 Å²	8	43.1 Å²	43.1	6%	0.056	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-9.1	178.8	70.9	0	0	0	0	114.5	Y245 H246 S251 H252 K253	Y245-S249 WeakPolarHBondContact O-CA 3.32Å; Y245-S249 WeakPolarHBondContact O-CB 3.25Å; Y245-S249 PolarHBondContact O-N 2.43Å; Y245-S249 PolarHBondContact O-OG 3.37Å; H246-S249 PolarHBondContact O-OG 3.06Å; S249-S251 PolarHBondContact O-N 3.4Å; S249-H252 WeakPolarHBondContact O-CB 3.17Å; S249-H252 PolarHBondContact O-N 3.47Å; S249-K253 PolarHBondContact O-N 3.2Å
250	G	61.9	Low	77.8	Confident	40 Å²	40	47.1 Å²	47.1	41%	0.412	26%	0.256	S	S	.	.	H	α-helix	trans	-52.6	-34	-175.2	0	0	0	0	0	114.2	F248	F248-G250 VanDerWaalsContact C-N 3.31Å; F248-G250 PolarHBondContact O-N 3.29Å
251	S	58.8	Low	77.1	Confident	85 Å²	85	47.2 Å²	47.2	59%	0.594	26%	0.256	S	S	*	.	H	α-helix	trans	-68.6	-33.4	176	-63.1	0	0	0	0	113.9	S249 K253 T254 D255	S249-S251 PolarHBondContact O-N 3.4Å; S251-K253 VanDerWaalsContact C-N 3.35Å; S251-K253 PolarHBondContact O-N 3.23Å; S251-T254 PolarHBondContact O-N 2.91Å; S251-T254 PolarHBondContact O-OG1 2.79Å; S251-D255 PolarHBondContact O-N 3.4Å
252	H	62.1	Low	76.4	Confident	121 Å²	121	48.5 Å²	48.5	56%	0.56	27%	0.267	S	S	*	.	H	α-helix	trans	-71.2	-33.6	-179.1	-161.8	-75.3	0	0	0	111.7	S249 T254 D255 I256	S249-H252 WeakPolarHBondContact O-CB 3.17Å; S249-H252 PolarHBondContact O-N 3.47Å; H252-T254 VanDerWaalsContact C-N 3.33Å; H252-T254 PolarHBondContact O-N 3.36Å; H252-D255 PolarHBondContact O-N 2.98Å; H252-I256 VanDerWaalsContact ND1-CD1 3.27Å; H252-I256 WeakPolarHBondContact ND1-CD1 3.37Å; H252-I256 WeakPolarHBondContact O-CG1 3.27Å; H252-I256 PolarHBondContact O-N 2.91Å
253	K	64	Low	75.5	Confident	125 Å²	125	52 Å²	52	54%	0.543	29%	0.286	S	S	.	.	H	α-helix	trans	-63.9	-38.8	175.7	-68.7	-174.2	177.9	-177.8	0	111.7	S249 S251 A257 T849	S249-K253 PolarHBondContact O-N 3.2Å; S251-K253 VanDerWaalsContact C-N 3.35Å; S251-K253 PolarHBondContact O-N 3.23Å; K253-A257 WeakPolarHBondContact O-CB 3.37Å; K253-A257 PolarHBondContact O-N 3.15Å; K253-A257 VanDerWaalsContact O-N 3.14Å; K253-T849 HydrophobicContact CB-CG2 4.28Å
254	T	67.9	Low	74.9	Confident	28 Å²	28	52.1 Å²	52.1	17%	0.172	29%	0.285	C	S	.	.	H	α-helix	trans	-68.5	-36	177.7	48.9	0	0	0	0	112.9	S251 H252 A257 A258 T849	S251-T254 PolarHBondContact O-N 2.91Å; S251-T254 PolarHBondContact O-OG1 2.79Å; H252-T254 VanDerWaalsContact C-N 3.33Å; H252-T254 PolarHBondContact O-N 3.36Å; T254-A257 PolarHBondContact O-N 3.2Å; T254-A258 WeakPolarHBondContact O-CB 3.49Å; T254-A258 PolarHBondContact O-N 3.04Å; T254-T849 HydrophobicContact CG2-CG2 4.16Å
255	D	66.3	Low	74.4	Confident	100 Å²	100	52.2 Å²	52.2	54%	0.535	29%	0.285	S	S	.	.	H	α-helix	trans	-71.4	-40.2	-179.8	-66.5	-14.8	0	0	0	112	S251 H252 A257 A258 T259	S251-D255 PolarHBondContact O-N 3.4Å; H252-D255 PolarHBondContact O-N 2.98Å; D255-A257 VanDerWaalsContact C-N 3.34Å; D255-A258 PolarHBondContact O-N 3Å; D255-T259 WeakPolarHBondContact O-CB 3.48Å; D255-T259 PolarHBondContact O-N 3.16Å; D255-T259 PolarHBondContact O-OG1 3.22Å
256	I	66.9	Low	73.9	Confident	82 Å²	82	57.6 Å²	57.6	42%	0.421	31%	0.305	S	S	.	.	H	α-helix	trans	-60.8	-46.2	172.5	-66.2	168.3	0	0	0	110.1	H252 A258 T259 R260	H252-I256 VanDerWaalsContact ND1-CD1 3.27Å; H252-I256 WeakPolarHBondContact ND1-CD1 3.37Å; H252-I256 WeakPolarHBondContact O-CG1 3.27Å; H252-I256 PolarHBondContact O-N 2.91Å; I256-A258 PolarHBondContact O-N 3.35Å; I256-T259 PolarHBondContact O-N 2.86Å; I256-R260 PolarHBondContact O-N 3.41Å
257	A	72.2	Confident	73.6	Confident	4 Å²	4	55.6 Å²	55.6	3%	0.033	30%	0.297	C	S	.	.	H	α-helix	trans	-61.5	-43	178.9	0	0	0	0	0	112.2	K253 T254 D255 R260 I261 T849 L850	K253-A257 WeakPolarHBondContact O-CB 3.37Å; K253-A257 PolarHBondContact O-N 3.15Å; K253-A257 VanDerWaalsContact O-N 3.14Å; T254-A257 PolarHBondContact O-N 3.2Å; D255-A257 VanDerWaalsContact C-N 3.34Å; A257-R260 PolarHBondContact O-N 2.83Å; A257-I261 WeakPolarHBondContact O-CG1 3.42Å; A257-I261 PolarHBondContact O-N 3.27Å; A257-I261 VanDerWaalsContact O-N 3.11Å; A257-T849 HydrophobicContact CB-CG2 3.94Å; A257-L850 HydrophobicContact CB-CD1 3.73Å
258	A	75.2	Confident	73.4	Confident	12 Å²	12	52.9 Å²	52.9	10%	0.099	28%	0.28	C	S	.	.	H	α-helix	trans	-62.5	-42.5	175.9	0	0	0	0	0	112	T254 D255 I256 R260 I261 A262 L850 L866	T254-A258 WeakPolarHBondContact O-CB 3.49Å; T254-A258 PolarHBondContact O-N 3.04Å; D255-A258 PolarHBondContact O-N 3Å; I256-A258 PolarHBondContact O-N 3.35Å; A258-R260 PolarHBondContact O-N 2.93Å; A258-I261 PolarHBondContact O-N 2.79Å; A258-A262 PolarHBondContact O-N 3.43Å; A258-L850 HydrophobicContact CB-CD1 4.48Å; A258-L866 HydrophobicContact CB-CD2 4.17Å
259	T	73.3	Confident	73.3	Confident	81 Å²	81	55.2 Å²	55.2	50%	0.497	29%	0.288	S	S	.	.	H	α-helix	trans	-62.5	-42.2	177.2	-55	0	0	0	0	111.7	D255 I256 I261 A262 N263	D255-T259 WeakPolarHBondContact O-CB 3.48Å; D255-T259 PolarHBondContact O-N 3.16Å; D255-T259 PolarHBondContact O-OG1 3.22Å; I256-T259 PolarHBondContact O-N 2.86Å; T259-I261 PolarHBondContact O-N 3.01Å; T259-A262 PolarHBondContact O-N 3.14Å; T259-N263 PolarHBondContact O-N 3.46Å
260	R	77.4	Confident	73.8	Confident	85 Å²	85	58 Å²	58	32%	0.321	30%	0.3	S	S	.	.	H	α-helix	trans	-63.6	-40	177.6	-166.3	-178.5	-64.4	156.2	-11.6	112.2	I256 A257 A258 N264 S846	I256-R260 PolarHBondContact O-N 3.41Å; A257-R260 PolarHBondContact O-N 2.83Å; A258-R260 PolarHBondContact O-N 2.93Å; R260-N264 PolarHBondContact O-N 3.4Å; R260-N264 PolarHBondContact O-ND2 3.4Å; R260-N264 VanDerWaalsContact O-ND2 3.1Å; R260-S846 WeakPolarHBondContact CD-OG 3.35Å; R260-S846 PolarHBondContact NH1-OG 3.38Å
261	I	81	Confident	74.9	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-64.7	-48.3	174.8	-68.8	165.1	0	0	0	110.4	A257 A258 T259 N263 N264 L265 L843 F847 L850 L866	A257-I261 WeakPolarHBondContact O-CG1 3.42Å; A257-I261 PolarHBondContact O-N 3.27Å; A257-I261 VanDerWaalsContact O-N 3.11Å; A258-I261 PolarHBondContact O-N 2.79Å; T259-I261 PolarHBondContact O-N 3.01Å; I261-N263 VanDerWaalsContact C-N 3.32Å; I261-N263 PolarHBondContact O-N 2.96Å; I261-N264 PolarHBondContact O-N 2.86Å; I261-L265 HydrophobicContact CG2-CD1 3.79Å; I261-L265 HydrophobicContact CG2-CG 4.15Å; I261-L265 WeakPolarHBondContact O-CG 3.31Å; I261-L265 PolarHBondContact O-N 3.39Å; I261-L843 HydrophobicContact CG1-CD1 4.11Å; I261-F847 HydrophobicContact CD1-CD1 3.65Å; I261-F847 HydrophobicContact CD1-CD2 4.32Å; I261-F847 HydrophobicContact CD1-CE1 3.67Å; I261-F847 HydrophobicContact CD1-CE2 4.34Å; I261-F847 HydrophobicContact CD1-CG 3.97Å; I261-F847 HydrophobicContact CD1-CZ 4.01Å; I261-F847 HydrophobicContact CG1-CD1 4.48Å; I261-F847 HydrophobicContact CG1-CD2 4.44Å; I261-F847 HydrophobicContact CG1-CE1 4.22Å; I261-F847 HydrophobicContact CG1-CE2 4.18Å; I261-F847 HydrophobicContact CG1-CZ 4.05Å; I261-F847 HydrophobicContact CG2-CE1 4.07Å; I261-F847 HydrophobicContact CG2-CZ 3.78Å; I261-L850 HydrophobicContact CD1-CD1 3.42Å; I261-L850 VanDerWaalsContact CD1-CD1 3.42Å; I261-L850 HydrophobicContact CD1-CD2 4.24Å; I261-L850 HydrophobicContact CD1-CG 4.39Å; I261-L866 HydrophobicContact CB-CD2 4.19Å; I261-L866 HydrophobicContact CG2-CD1 3.91Å; I261-L866 HydrophobicContact CG2-CD2 3.98Å
262	A	78.5	Confident	76.3	Confident	27 Å²	27	56 Å²	56	22%	0.223	27%	0.271	C	S	.	.	H	α-helix	trans	-58.3	-42.7	-179.6	0	0	0	0	0	112.4	A258 T259 L265 R266	A258-A262 PolarHBondContact O-N 3.43Å; T259-A262 PolarHBondContact O-N 3.14Å; A262-L265 PolarHBondContact O-N 2.99Å; A262-R266 PolarHBondContact O-N 3.38Å
263	N	74.5	Confident	77.5	Confident	75 Å²	75	54.6 Å²	54.6	40%	0.401	27%	0.267	S	S	.	.	H	α-helix	trans	-62.7	-42.8	176.5	-74.8	-22.4	0	0	0	112.5	T259 I261 R266 M267	T259-N263 PolarHBondContact O-N 3.46Å; I261-N263 VanDerWaalsContact C-N 3.32Å; I261-N263 PolarHBondContact O-N 2.96Å; N263-R266 PolarHBondContact O-N 3.42Å; N263-M267 PolarHBondContact O-N 3.4Å; N263-M267 VanDerWaalsContact O-N 3.14Å
264	N	78.2	Confident	78.7	Confident	21 Å²	21	50.4 Å²	50.4	11%	0.112	25%	0.251	C	S	.	.	H	α-helix	trans	-63.6	-43.8	175.6	-91.9	-82.7	0	0	0	112	R260 I261 R266 M267 I268 L843	R260-N264 PolarHBondContact O-N 3.4Å; R260-N264 PolarHBondContact O-ND2 3.4Å; R260-N264 VanDerWaalsContact O-ND2 3.1Å; I261-N264 PolarHBondContact O-N 2.86Å; N264-R266 PolarHBondContact O-N 3.04Å; N264-M267 PolarHBondContact O-N 3.4Å; N264-I268 WeakPolarHBondContact O-CD1 3.28Å; N264-I268 VanDerWaalsContact O-CG1 3.23Å; N264-I268 WeakPolarHBondContact O-CG1 3.35Å; N264-I268 PolarHBondContact O-N 2.93Å; N264-L843 HydrophobicContact CB-CD1 4.1Å
265	L	81.5	Confident	79.8	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.016	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-41.7	177.6	-69.2	177	0	0	0	112.4	I261 A262 I268 R269 D870 Y873 F896	I261-L265 HydrophobicContact CG2-CD1 3.79Å; I261-L265 HydrophobicContact CG2-CG 4.15Å; I261-L265 WeakPolarHBondContact O-CG 3.31Å; I261-L265 PolarHBondContact O-N 3.39Å; A262-L265 PolarHBondContact O-N 2.99Å; L265-I268 HydrophobicContact CD2-CD1 4.35Å; L265-I268 PolarHBondContact O-N 3.48Å; L265-R269 WeakPolarHBondContact O-CG 3.25Å; L265-R269 PolarHBondContact O-N 2.87Å; L265-D870 HydrophobicContact CD1-CB 3.68Å; L265-Y873 HydrophobicContact CD2-CD1 3.55Å; L265-Y873 HydrophobicContact CD2-CE1 3.71Å; L265-F896 HydrophobicContact CD2-CZ 4.32Å
266	R	79.8	Confident	80.9	Confident	143 Å²	143	53.4 Å²	53.4	54%	0.54	26%	0.259	S	S	.	.	H	α-helix	trans	-58.1	-50.4	175	-176.8	178.6	69.4	-156.9	-1.3	111.1	A262 N263 N264 I268 R269 E270	A262-R266 PolarHBondContact O-N 3.38Å; N263-R266 PolarHBondContact O-N 3.42Å; N264-R266 PolarHBondContact O-N 3.04Å; R266-I268 VanDerWaalsContact C-N 3.3Å; R266-I268 PolarHBondContact O-N 3.47Å; R266-R269 PolarHBondContact O-N 2.76Å; R266-E270 WeakPolarHBondContact CG-OE1 3.38Å; R266-E270 IonicContact NE-OE1 2.73Å; R266-E270 WeakPolarHBondContact O-CG 3.38Å; R266-E270 PolarHBondContact O-N 3.31Å
267	M	80.2	Confident	82.1	Confident	32 Å²	32	52.5 Å²	52.5	16%	0.158	26%	0.259	C	S	.	.	H	α-helix	trans	-56.8	-43	178.2	180	-169	73.7	0	0	112.3	N263 N264 E270 N271 N347	N263-M267 PolarHBondContact O-N 3.4Å; N263-M267 VanDerWaalsContact O-N 3.14Å; N264-M267 PolarHBondContact O-N 3.4Å; M267-E270 PolarHBondContact O-N 3.4Å; M267-N271 PolarHBondContact O-N 3.48Å; M267-N271 VanDerWaalsContact O-N 3.13Å; M267-N347 HydrophobicContact CE-CB 4.33Å; M267-N347 HydrophobicContact SD-CB 3.96Å; M267-N347 PolarHBondContact SD-ND2 2.91Å; M267-N347 PolarHBondContact SD-OD1 2.94Å
268	I	81.4	Confident	83	Confident	13 Å²	13	52.3 Å²	52.3	7%	0.067	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-47.6	178.4	-64.2	156.8	0	0	0	111.2	N264 L265 R266 E270 N271 Q272 Y873 I900	N264-I268 WeakPolarHBondContact O-CD1 3.28Å; N264-I268 VanDerWaalsContact O-CG1 3.23Å; N264-I268 WeakPolarHBondContact O-CG1 3.35Å; N264-I268 PolarHBondContact O-N 2.93Å; L265-I268 HydrophobicContact CD2-CD1 4.35Å; L265-I268 PolarHBondContact O-N 3.48Å; R266-I268 VanDerWaalsContact C-N 3.3Å; R266-I268 PolarHBondContact O-N 3.47Å; I268-E270 VanDerWaalsContact C-N 3.33Å; I268-E270 PolarHBondContact O-N 3.5Å; I268-N271 PolarHBondContact O-N 2.98Å; I268-Q272 HydrophobicContact CG2-CG 4.38Å; I268-Q272 WeakPolarHBondContact O-CG 3.46Å; I268-Q272 PolarHBondContact O-N 3.33Å; I268-Y873 WeakPolarHBondContact CG2-OH 3.46Å; I268-I900 HydrophobicContact CD1-CB 4.19Å; I268-I900 HydrophobicContact CD1-CD1 3.74Å; I268-I900 HydrophobicContact CD1-CG1 3.9Å; I268-I900 HydrophobicContact CD1-CG2 3.28Å; I268-I900 HydrophobicContact CG1-CG2 3.99Å
269	R	83.5	Confident	83.8	Confident	74 Å²	74	56.4 Å²	56.4	28%	0.279	28%	0.275	S	S	.	.	H	α-helix	trans	-60.8	-42.6	179.3	-74.2	177.6	177.6	151.2	2.5	112.2	L265 R266 N271 Q272 N273 G869 D870 Y873	L265-R269 WeakPolarHBondContact O-CG 3.25Å; L265-R269 PolarHBondContact O-N 2.87Å; R266-R269 PolarHBondContact O-N 2.76Å; R269-N271 VanDerWaalsContact C-N 3.3Å; R269-N271 PolarHBondContact O-N 3.18Å; R269-Q272 PolarHBondContact O-N 3.18Å; R269-N273 PolarHBondContact O-N 3.39Å; R269-N273 PolarHBondContact O-ND2 3.04Å; R269-N273 PolarHBondContact O-OD1 3.1Å; R269-G869 PolarHBondContact NH2-O 2.76Å; R269-D870 IonicContact CZ-OD1 3.47Å; R269-D870 IonicContact NH1-OD1 2.83Å; R269-D870 PolarHBondContact NH1-OD1 3.43Å; R269-D870 IonicContact NH2-OD1 3.43Å; R269-Y873 HydrophobicContact CG-CE2 4.35Å
270	E	85	Confident	84.6	Confident	66 Å²	66	56.3 Å²	56.3	31%	0.308	27%	0.274	S	S	.	.	H	α-helix	trans	-63.2	-38.5	177.7	-67.1	175.1	-166.5	0	0	112	R266 M267 I268 N273 L274 R343	R266-E270 WeakPolarHBondContact CG-OE1 3.38Å; R266-E270 IonicContact NE-OE1 2.73Å; R266-E270 WeakPolarHBondContact O-CG 3.38Å; R266-E270 PolarHBondContact O-N 3.31Å; M267-E270 PolarHBondContact O-N 3.4Å; I268-E270 VanDerWaalsContact C-N 3.33Å; I268-E270 PolarHBondContact O-N 3.5Å; E270-N273 PolarHBondContact O-N 3.16Å; E270-L274 WeakPolarHBondContact O-CG 3.34Å; E270-L274 PolarHBondContact O-N 3.09Å; E270-L274 VanDerWaalsContact O-N 3.15Å; E270-R343 IonicContact OE2-CZ 3.94Å; E270-R343 IonicContact OE2-NH1 3.42Å; E270-R343 PolarHBondContact OE2-NH1 3.29Å; E270-R343 IonicContact OE2-NH2 3.98Å; E270-R343 PolarHBondContact OE2-NH2 3.29Å
271	N	86.2	Confident	85.3	Confident	5 Å²	5	53.4 Å²	53.4	3%	0.027	27%	0.265	C	S	.	.	H	α-helix	trans	-66.4	-43.3	174.5	-67.6	-9.5	0	0	0	111.6	M267 I268 R269 N273 L274 E275 L340	M267-N271 PolarHBondContact O-N 3.48Å; M267-N271 VanDerWaalsContact O-N 3.13Å; I268-N271 PolarHBondContact O-N 2.98Å; R269-N271 VanDerWaalsContact C-N 3.3Å; R269-N271 PolarHBondContact O-N 3.18Å; N271-N273 VanDerWaalsContact C-N 3.31Å; N271-N273 PolarHBondContact O-N 3.2Å; N271-L274 WeakPolarHBondContact O-CB 3.41Å; N271-L274 PolarHBondContact O-N 3.13Å; N271-L274 VanDerWaalsContact O-N 3.14Å; N271-E275 WeakPolarHBondContact O-CG 3.48Å; N271-E275 PolarHBondContact O-N 3.42Å; N271-L340 HydrophobicContact CB-CD1 4.21Å
272	Q	86.6	Confident	85.8	Confident	79 Å²	79	53.4 Å²	53.4	37%	0.369	27%	0.265	S	S	.	.	H	α-helix	trans	-59.6	-40	175.4	-72.8	179.4	-36.9	0	0	112.1	I268 R269 L274 E275 E276 Y873	I268-Q272 HydrophobicContact CG2-CG 4.38Å; I268-Q272 WeakPolarHBondContact O-CG 3.46Å; I268-Q272 PolarHBondContact O-N 3.33Å; R269-Q272 PolarHBondContact O-N 3.18Å; Q272-L274 VanDerWaalsContact C-N 3.35Å; Q272-L274 PolarHBondContact O-N 3.17Å; Q272-E275 WeakPolarHBondContact O-CB 3.28Å; Q272-E275 PolarHBondContact O-N 3.42Å; Q272-E276 PolarHBondContact O-N 3.02Å; Q272-Y873 PolarHBondContact NE2-OH 3.24Å; Q272-Y873 PolarHBondContact OE1-OH 3.42Å
273	N	88.8	Confident	86.5	Confident	91 Å²	91	55.5 Å²	55.5	49%	0.487	28%	0.275	S	S	.	.	H	α-helix	trans	-64.3	-38.6	175.7	-68.7	-13.9	0	0	0	112.2	R269 E270 N271 C277	R269-N273 PolarHBondContact O-N 3.39Å; R269-N273 PolarHBondContact O-ND2 3.04Å; R269-N273 PolarHBondContact O-OD1 3.1Å; E270-N273 PolarHBondContact O-N 3.16Å; N271-N273 VanDerWaalsContact C-N 3.31Å; N271-N273 PolarHBondContact O-N 3.2Å; N273-C277 WeakPolarHBondContact O-CB 3.35Å; N273-C277 PolarHBondContact O-N 3.42Å; N273-C277 PolarHBondContact O-SG 3.15Å
274	L	89.4	Confident	87.4	Confident	37 Å²	37	55.1 Å²	55.1	19%	0.194	28%	0.276	C	S	.	.	H	α-helix	trans	-67.7	-39.3	175.7	-72	170.9	0	0	0	111.7	E270 N271 Q272 C277 Y278 T336 T339 L340	E270-L274 WeakPolarHBondContact O-CG 3.34Å; E270-L274 PolarHBondContact O-N 3.09Å; E270-L274 VanDerWaalsContact O-N 3.15Å; N271-L274 WeakPolarHBondContact O-CB 3.41Å; N271-L274 PolarHBondContact O-N 3.13Å; N271-L274 VanDerWaalsContact O-N 3.14Å; Q272-L274 VanDerWaalsContact C-N 3.35Å; Q272-L274 PolarHBondContact O-N 3.17Å; L274-C277 PolarHBondContact O-N 3.37Å; L274-Y278 WeakPolarHBondContact O-CB 3.29Å; L274-Y278 PolarHBondContact O-N 2.97Å; L274-T336 HydrophobicContact CB-CG2 4.5Å; L274-T336 HydrophobicContact CD2-CG2 4.05Å; L274-T339 HydrophobicContact CD1-CG2 4.27Å; L274-L340 HydrophobicContact CB-CB 4.35Å; L274-L340 HydrophobicContact CB-CD1 4.1Å; L274-L340 HydrophobicContact CD1-CD1 4.5Å
275	E	89.7	Confident	88.2	Confident	64 Å²	64	54.1 Å²	54.1	30%	0.299	27%	0.271	S	S	.	.	H	α-helix	trans	-59.4	-51.2	172.7	-71.4	173.7	-171.3	0	0	111	N271 Q272 C277 Y278 E279 L340 Y352	N271-E275 WeakPolarHBondContact O-CG 3.48Å; N271-E275 PolarHBondContact O-N 3.42Å; Q272-E275 WeakPolarHBondContact O-CB 3.28Å; Q272-E275 PolarHBondContact O-N 3.42Å; E275-C277 VanDerWaalsContact C-N 3.35Å; E275-C277 PolarHBondContact O-N 3.46Å; E275-Y278 WeakPolarHBondContact O-CB 3.45Å; E275-Y278 PolarHBondContact O-N 3.19Å; E275-Y278 VanDerWaalsContact O-N 3.16Å; E275-E279 PolarHBondContact O-N 2.82Å; E275-L340 HydrophobicContact CB-CD2 4.45Å; E275-L340 HydrophobicContact CG-CD1 4.14Å; E275-L340 HydrophobicContact CG-CD2 3.57Å; E275-L340 HydrophobicContact CG-CG 4.49Å; E275-Y352 HydrophobicContact CB-CE2 4.19Å; E275-Y352 HydrophobicContact CG-CD2 3.72Å; E275-Y352 HydrophobicContact CG-CE2 3.78Å; E275-Y352 HydrophobicContact CG-CG 4.38Å
276	E	90.1	Very high	88.8	Confident	127 Å²	127	54.7 Å²	54.7	59%	0.593	27%	0.274	S	S	*	.	H	α-helix	trans	-61.5	-40.8	178.3	-174.9	179.9	-176.3	0	0	112.3	Q272 Y278 E279 T280	Q272-E276 PolarHBondContact O-N 3.02Å; E276-Y278 VanDerWaalsContact C-N 3.35Å; E276-Y278 PolarHBondContact O-N 3.31Å; E276-E279 PolarHBondContact O-N 3.05Å; E276-T280 VanDerWaalsContact O-CB 3.32Å; E276-T280 WeakPolarHBondContact O-CB 3.48Å; E276-T280 PolarHBondContact O-N 3.18Å; E276-T280 PolarHBondContact O-OG1 3.09Å
277	C	90.7	Very high	89.6	Confident	62 Å²	62	51.7 Å²	51.7	42%	0.419	28%	0.275	S	S	.	.	H	α-helix	trans	-61.5	-42.9	174.9	-75.7	0	0	0	0	111.7	N273 L274 E275 N281 T336	N273-C277 WeakPolarHBondContact O-CB 3.35Å; N273-C277 PolarHBondContact O-N 3.42Å; N273-C277 PolarHBondContact O-SG 3.15Å; L274-C277 PolarHBondContact O-N 3.37Å; E275-C277 VanDerWaalsContact C-N 3.35Å; E275-C277 PolarHBondContact O-N 3.46Å; C277-N281 WeakPolarHBondContact O-CB 3.35Å; C277-N281 PolarHBondContact O-N 3.29Å; C277-T336 HydrophobicContact CB-CG2 4.39Å
278	Y	92.3	Very high	90.3	Very high	1 Å²	1	51.4 Å²	51.4	0%	0.004	27%	0.272	C	S	.	.	H	α-helix	trans	-63.5	-46.7	176.6	-178.8	-83.2	0	0	0	111.4	L274 E275 E276 S282 L333 Y337 Y352 P354 H358 I360	L274-Y278 WeakPolarHBondContact O-CB 3.29Å; L274-Y278 PolarHBondContact O-N 2.97Å; E275-Y278 WeakPolarHBondContact O-CB 3.45Å; E275-Y278 PolarHBondContact O-N 3.19Å; E275-Y278 VanDerWaalsContact O-N 3.16Å; E276-Y278 VanDerWaalsContact C-N 3.35Å; E276-Y278 PolarHBondContact O-N 3.31Å; Y278-S282 VanDerWaalsContact O-CB 3.25Å; Y278-S282 WeakPolarHBondContact O-CB 3.34Å; Y278-S282 PolarHBondContact O-N 3.06Å; Y278-S282 PolarHBondContact O-OG 3.47Å; Y278-L333 HydrophobicContact CD1-CD1 4.47Å; Y278-L333 HydrophobicContact CD2-CD1 3.49Å; Y278-L333 VanDerWaalsContact CD2-CD1 3.49Å; Y278-L333 HydrophobicContact CD2-CG 3.96Å; Y278-L333 HydrophobicContact CE2-CD1 3.64Å; Y278-L333 HydrophobicContact CE2-CD2 4.33Å; Y278-L333 HydrophobicContact CE2-CG 3.67Å; Y278-L333 HydrophobicContact CG-CD1 3.95Å; Y278-L333 WeakPolarHBondContact O-CD1 3.37Å; Y278-Y337 HydrophobicContact CD2-CD2 4.28Å; Y278-Y337 AromaticContact CE2-CD2 3.82Å; Y278-Y337 HydrophobicContact CE2-CD2 3.82Å; Y278-Y337 HydrophobicContact CE2-CG 4.12Å; Y278-Y352 AromaticContact CD1-CE1 3.71Å; Y278-Y352 HydrophobicContact CD1-CE1 3.71Å; Y278-Y352 HydrophobicContact CE1-CE1 4.15Å; Y278-Y352 HydrophobicContact CG-CE1 4.12Å; Y278-P354 HydrophobicContact CD1-CG 4.35Å; Y278-P354 HydrophobicContact CE1-CB 3.71Å; Y278-P354 HydrophobicContact CE1-CG 3.5Å; Y278-P354 VanDerWaalsContact CE1-CG 3.5Å; Y278-H358 WeakPolarHBondContact CE1-O 3.43Å; Y278-H358 PolarHBondContact OH-O 3.04Å; Y278-I360 HydrophobicContact CE2-CG1 4.23Å; Y278-I360 PolarHBondContact OH-N 2.82Å
279	E	91	Very high	91	Very high	97 Å²	97	50.8 Å²	50.8	45%	0.453	27%	0.269	S	S	.	.	H	α-helix	trans	-63.6	-44.2	179.1	-69.3	-153	172.8	0	0	112.3	E275 E276 S282 T283 Y352	E275-E279 PolarHBondContact O-N 2.82Å; E276-E279 PolarHBondContact O-N 3.05Å; E279-S282 PolarHBondContact O-OG 3.37Å; E279-T283 VanDerWaalsContact O-CB 3.26Å; E279-T283 WeakPolarHBondContact O-CB 3.39Å; E279-T283 PolarHBondContact O-N 3.26Å; E279-T283 PolarHBondContact O-OG1 2.91Å; E279-Y352 WeakPolarHBondContact CG-OH 3.27Å; E279-Y352 PolarHBondContact OE1-OH 3.37Å
280	T	91.6	Very high	91.5	Very high	79 Å²	79	51 Å²	51	49%	0.485	28%	0.275	S	S	.	.	H	α-helix	trans	-64.1	-47.5	179.5	-59	0	0	0	0	111.4	E276 T284	E276-T280 VanDerWaalsContact O-CB 3.32Å; E276-T280 WeakPolarHBondContact O-CB 3.48Å; E276-T280 PolarHBondContact O-N 3.18Å; E276-T280 PolarHBondContact O-OG1 3.09Å; T280-T284 WeakPolarHBondContact O-CB 3.5Å; T280-T284 PolarHBondContact O-N 3.01Å; T280-T284 PolarHBondContact O-OG1 2.83Å
281	N	90.6	Very high	92.1	Very high	25 Å²	25	51.7 Å²	51.7	13%	0.134	28%	0.279	C	S	.	.	H	α-helix	trans	-68.3	-45.2	-178.4	-169.6	15.4	0	0	0	111.1	C277 T283 T284 L285 E329 L333	C277-N281 WeakPolarHBondContact O-CB 3.35Å; C277-N281 PolarHBondContact O-N 3.29Å; N281-T283 PolarHBondContact O-N 3.27Å; N281-T284 PolarHBondContact O-N 3.43Å; N281-L285 VanDerWaalsContact O-CB 3.24Å; N281-L285 WeakPolarHBondContact O-CB 3.16Å; N281-L285 PolarHBondContact O-N 2.91Å; N281-E329 PolarHBondContact ND2-O 2.88Å; N281-L333 HydrophobicContact CB-CD1 3.94Å
282	S	92.5	Very high	92.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.5	-44.2	177	60.6	0	0	0	0	112	Y278 E279 L286 H358	Y278-S282 VanDerWaalsContact O-CB 3.25Å; Y278-S282 WeakPolarHBondContact O-CB 3.34Å; Y278-S282 PolarHBondContact O-N 3.06Å; Y278-S282 PolarHBondContact O-OG 3.47Å; E279-S282 PolarHBondContact O-OG 3.37Å; S282-L286 VanDerWaalsContact O-CB 3.29Å; S282-L286 WeakPolarHBondContact O-CB 3.48Å; S282-L286 VanDerWaalsContact O-CG 3.26Å; S282-L286 WeakPolarHBondContact O-CG 3.47Å; S282-L286 PolarHBondContact O-N 2.7Å; S282-H358 PolarHBondContact OG-ND1 3.25Å; S282-H358 VanDerWaalsContact OG-ND1 3.08Å
283	T	93.6	Very high	92.9	Very high	71 Å²	71	50.2 Å²	50.2	44%	0.436	27%	0.273	S	S	.	.	H	α-helix	trans	-62.7	-46.8	178.5	-57.4	0	0	0	0	111.8	E279 N281 S287 H358	E279-T283 VanDerWaalsContact O-CB 3.26Å; E279-T283 WeakPolarHBondContact O-CB 3.39Å; E279-T283 PolarHBondContact O-N 3.26Å; E279-T283 PolarHBondContact O-OG1 2.91Å; N281-T283 PolarHBondContact O-N 3.27Å; T283-S287 VanDerWaalsContact O-CB 3.25Å; T283-S287 WeakPolarHBondContact O-CB 3.42Å; T283-S287 PolarHBondContact O-N 3.37Å; T283-H358 PolarHBondContact OG1-CE1 3.43Å; T283-H358 VanDerWaalsContact OG1-CE1 3.26Å
284	T	93.8	Very high	93.2	Very high	68 Å²	68	54.2 Å²	54.2	42%	0.417	28%	0.282	S	S	.	.	H	α-helix	trans	-64.4	-45.1	-179.2	-57.5	0	0	0	0	111.1	T280 N281 S287 W288	T280-T284 WeakPolarHBondContact O-CB 3.5Å; T280-T284 PolarHBondContact O-N 3.01Å; T280-T284 PolarHBondContact O-OG1 2.83Å; N281-T284 PolarHBondContact O-N 3.43Å; T284-S287 PolarHBondContact O-N 3.38Å; T284-W288 WeakPolarHBondContact O-CB 3.21Å; T284-W288 PolarHBondContact O-N 3.48Å
285	L	94.4	Very high	93.4	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-48.1	179.4	-177.4	61.6	0	0	0	111.6	N281 S287 W288 I289 K326 K330 V363 W367	N281-L285 VanDerWaalsContact O-CB 3.24Å; N281-L285 WeakPolarHBondContact O-CB 3.16Å; N281-L285 PolarHBondContact O-N 2.91Å; L285-S287 VanDerWaalsContact C-N 3.35Å; L285-S287 PolarHBondContact O-N 2.95Å; L285-W288 HydrophobicContact CD1-CE3 4.44Å; L285-W288 PolarHBondContact O-N 3.38Å; L285-I289 HydrophobicContact CD1-CD1 4.38Å; L285-I289 HydrophobicContact CG-CD1 4.05Å; L285-I289 VanDerWaalsContact O-CG1 3.29Å; L285-I289 WeakPolarHBondContact O-CG1 3.35Å; L285-I289 PolarHBondContact O-N 2.99Å; L285-K326 HydrophobicContact CD1-CB 4.19Å; L285-K326 HydrophobicContact CD1-CD 4.32Å; L285-K330 HydrophobicContact CD2-CB 3.81Å; L285-K330 HydrophobicContact CD2-CG 4.34Å; L285-V363 HydrophobicContact CD2-CG1 3.73Å; L285-W367 HydrophobicContact CD1-CZ3 4.16Å
286	L	94.3	Very high	93.6	Very high	15 Å²	15	53.3 Å²	53.3	8%	0.079	28%	0.276	C	S	.	.	H	α-helix	trans	-63.1	-39.6	177.8	-74	170.1	0	0	0	112.2	S282 W288 I289 N290 G357 V363 N366	S282-L286 VanDerWaalsContact O-CB 3.29Å; S282-L286 WeakPolarHBondContact O-CB 3.48Å; S282-L286 VanDerWaalsContact O-CG 3.26Å; S282-L286 WeakPolarHBondContact O-CG 3.47Å; S282-L286 PolarHBondContact O-N 2.7Å; L286-W288 VanDerWaalsContact C-N 3.35Å; L286-I289 PolarHBondContact O-N 3.4Å; L286-N290 WeakPolarHBondContact O-CB 3.4Å; L286-N290 PolarHBondContact O-N 3.41Å; L286-N290 PolarHBondContact O-ND2 2.9Å; L286-G357 WeakPolarHBondContact CD1-O 3.47Å; L286-V363 HydrophobicContact CD1-CG2 4.26Å; L286-V363 HydrophobicContact CD2-CG2 4.1Å; L286-V363 HydrophobicContact CG-CG2 4.16Å; L286-N366 HydrophobicContact CD2-CB 4.06Å
287	S	94.9	Very high	93.7	Very high	80 Å²	80	49.6 Å²	49.6	56%	0.559	27%	0.272	S	S	*	.	H	α-helix	trans	-60.4	-45.6	174.5	-179.8	0	0	0	0	111.4	T283 T284 L285 N290 M291	T283-S287 VanDerWaalsContact O-CB 3.25Å; T283-S287 WeakPolarHBondContact O-CB 3.42Å; T283-S287 PolarHBondContact O-N 3.37Å; T284-S287 PolarHBondContact O-N 3.38Å; L285-S287 VanDerWaalsContact C-N 3.35Å; L285-S287 PolarHBondContact O-N 2.95Å; S287-N290 PolarHBondContact O-N 3.49Å; S287-M291 WeakPolarHBondContact O-CB 3.33Å; S287-M291 PolarHBondContact O-N 3.33Å
288	W	96.4	Very high	93.7	Very high	26 Å²	26	53 Å²	53	10%	0.098	28%	0.282	C	S	.	.	H	α-helix	trans	-63.7	-44.5	176.8	178.4	87.2	0	0	0	112.4	T284 L285 L286 N290 M291 K292 Y318 E322 K326 W367 L370	T284-W288 WeakPolarHBondContact O-CB 3.21Å; T284-W288 PolarHBondContact O-N 3.48Å; L285-W288 HydrophobicContact CD1-CE3 4.44Å; L285-W288 PolarHBondContact O-N 3.38Å; L286-W288 VanDerWaalsContact C-N 3.35Å; W288-N290 PolarHBondContact O-N 2.93Å; W288-M291 WeakPolarHBondContact O-CB 3.38Å; W288-M291 PolarHBondContact O-N 3.21Å; W288-K292 HydrophobicContact CD2-CG 4.15Å; W288-K292 HydrophobicContact CH2-CG 4.34Å; W288-K292 HydrophobicContact CZ2-CG 3.84Å; W288-K292 PolarHBondContact O-N 3.46Å; W288-Y318 AromaticContact CH2-CE2 3.74Å; W288-Y318 HydrophobicContact CH2-CE2 3.74Å; W288-Y318 HydrophobicContact CZ2-CD2 4.22Å; W288-Y318 AromaticContact CZ2-CE2 3.61Å; W288-Y318 HydrophobicContact CZ2-CE2 3.61Å; W288-E322 HydrophobicContact CZ2-CB 4.37Å; W288-K326 HydrophobicContact CD2-CB 4.44Å; W288-K326 HydrophobicContact CD2-CD 4.08Å; W288-K326 HydrophobicContact CD2-CG 3.73Å; W288-K326 HydrophobicContact CE3-CB 4.03Å; W288-K326 HydrophobicContact CE3-CD 4.31Å; W288-K326 HydrophobicContact CE3-CG 3.83Å; W288-K326 HydrophobicContact CG-CD 4.27Å; W288-K326 HydrophobicContact CG-CG 4.38Å; W288-K326 HydrophobicContact CH2-CB 3.82Å; W288-K326 HydrophobicContact CH2-CG 3.82Å; W288-K326 HydrophobicContact CZ2-CB 4.24Å; W288-K326 HydrophobicContact CZ2-CG 3.71Å; W288-K326 HydrophobicContact CZ3-CB 3.71Å; W288-K326 HydrophobicContact CZ3-CG 3.88Å; W288-W367 HydrophobicContact CZ3-CH2 4.48Å; W288-W367 AromaticContact CZ3-CZ3 3.97Å; W288-W367 HydrophobicContact CZ3-CZ3 3.97Å; W288-L370 HydrophobicContact CE3-CD2 4.37Å; W288-L370 HydrophobicContact CH2-CD2 3.88Å; W288-L370 HydrophobicContact CZ3-CD2 3.44Å; W288-L370 VanDerWaalsContact CZ3-CD2 3.44Å
289	I	95.6	Very high	93.6	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-57.7	-49.2	175.9	-67.7	165.5	0	0	0	110.2	L285 L286 M291 K292 L293 N366 W367 L370	L285-I289 HydrophobicContact CD1-CD1 4.38Å; L285-I289 HydrophobicContact CG-CD1 4.05Å; L285-I289 VanDerWaalsContact O-CG1 3.29Å; L285-I289 WeakPolarHBondContact O-CG1 3.35Å; L285-I289 PolarHBondContact O-N 2.99Å; L286-I289 PolarHBondContact O-N 3.4Å; I289-M291 VanDerWaalsContact C-N 3.3Å; I289-M291 PolarHBondContact O-N 3.05Å; I289-K292 PolarHBondContact O-N 2.91Å; I289-L293 HydrophobicContact CG2-CD1 3.84Å; I289-L293 HydrophobicContact CG2-CG 4.22Å; I289-L293 WeakPolarHBondContact O-CB 3.47Å; I289-L293 WeakPolarHBondContact O-CG 3.39Å; I289-L293 PolarHBondContact O-N 2.98Å; I289-N366 HydrophobicContact CD1-CB 4.24Å; I289-N366 HydrophobicContact CG2-CB 4.03Å; I289-W367 HydrophobicContact CD1-CE3 4.11Å; I289-W367 HydrophobicContact CG1-CE3 4.39Å; I289-L370 HydrophobicContact CG1-CD2 4.25Å; I289-L370 HydrophobicContact CG2-CB 4.19Å
290	N	94.8	Very high	93.5	Very high	77 Å²	77	59.3 Å²	59.3	41%	0.412	31%	0.31	S	S	.	.	H	α-helix	trans	-64	-33.6	179.6	-76.8	-55.5	0	0	0	113.1	L286 S287 W288 R294	L286-N290 WeakPolarHBondContact O-CB 3.4Å; L286-N290 PolarHBondContact O-N 3.41Å; L286-N290 PolarHBondContact O-ND2 2.9Å; S287-N290 PolarHBondContact O-N 3.49Å; W288-N290 PolarHBondContact O-N 2.93Å; N290-R294 WeakPolarHBondContact O-CG 3.4Å; N290-R294 PolarHBondContact O-N 3.19Å; N290-R294 PolarHBondContact O-NE 2.97Å
291	M	96.3	Very high	93.3	Very high	82 Å²	82	60.2 Å²	60.2	40%	0.404	32%	0.317	S	S	.	.	H	α-helix	trans	-64.1	-49	172.3	-176.5	-167.4	73.9	0	0	111.1	S287 W288 I289 R294 E295	S287-M291 WeakPolarHBondContact O-CB 3.33Å; S287-M291 PolarHBondContact O-N 3.33Å; W288-M291 WeakPolarHBondContact O-CB 3.38Å; W288-M291 PolarHBondContact O-N 3.21Å; I289-M291 VanDerWaalsContact C-N 3.3Å; I289-M291 PolarHBondContact O-N 3.05Å; M291-R294 WeakPolarHBondContact O-CB 3.46Å; M291-R294 PolarHBondContact O-N 3.16Å; M291-E295 PolarHBondContact O-N 3.4Å
292	K	95.4	Very high	93.3	Very high	9 Å²	9	61.5 Å²	61.5	4%	0.039	32%	0.322	C	S	.	.	H	α-helix	trans	-67.1	-37.1	-179.4	-70.3	-62.6	-178.4	-177.9	0	113.3	W288 I289 R294 E295 F296 Y318 E322 L370	W288-K292 HydrophobicContact CD2-CG 4.15Å; W288-K292 HydrophobicContact CH2-CG 4.34Å; W288-K292 HydrophobicContact CZ2-CG 3.84Å; W288-K292 PolarHBondContact O-N 3.46Å; I289-K292 PolarHBondContact O-N 2.91Å; K292-R294 VanDerWaalsContact C-N 3.26Å; K292-R294 PolarHBondContact O-N 3.04Å; K292-E295 VanDerWaalsContact CD-OE2 3.29Å; K292-E295 WeakPolarHBondContact CD-OE2 3.5Å; K292-E295 IonicContact NZ-OE1 3.13Å; K292-E295 IonicContact NZ-OE2 3.81Å; K292-E295 PolarHBondContact NZ-OE2 3.49Å; K292-E295 WeakPolarHBondContact O-CB 3.47Å; K292-E295 PolarHBondContact O-N 3.42Å; K292-E295 VanDerWaalsContact O-N 3.16Å; K292-F296 HydrophobicContact CB-CE2 4.18Å; K292-F296 HydrophobicContact CD-CZ 4.45Å; K292-F296 WeakPolarHBondContact O-CD2 3.35Å; K292-F296 WeakPolarHBondContact O-CG 3.25Å; K292-F296 PolarHBondContact O-N 3.3Å; K292-Y318 HydrophobicContact CD-CD2 4.13Å; K292-Y318 HydrophobicContact CD-CE2 4.03Å; K292-Y318 HydrophobicContact CG-CE2 4.17Å; K292-E322 WeakPolarHBondContact CE-OE2 3.49Å; K292-E322 IonicContact NZ-OE2 2.89Å; K292-E322 PolarHBondContact NZ-OE2 2.65Å; K292-L370 HydrophobicContact CB-CD1 3.62Å
293	L	95	Very high	92.9	Very high	43 Å²	43	66.6 Å²	66.6	23%	0.225	35%	0.354	C	S	.	.	H	α-helix	trans	-58.4	-38.5	171.9	-74.8	173.2	0	0	0	112.3	I289 G297 L370 A373	I289-L293 HydrophobicContact CG2-CD1 3.84Å; I289-L293 HydrophobicContact CG2-CG 4.22Å; I289-L293 WeakPolarHBondContact O-CB 3.47Å; I289-L293 WeakPolarHBondContact O-CG 3.39Å; I289-L293 PolarHBondContact O-N 2.98Å; L293-G297 PolarHBondContact O-N 3.01Å; L293-L370 HydrophobicContact CD2-CB 4.46Å; L293-L370 HydrophobicContact CD2-CD1 4.47Å; L293-A373 HydrophobicContact CD2-CB 3.65Å
294	R	95	Very high	92.6	Very high	176 Å²	176	65.3 Å²	65.3	66%	0.664	35%	0.348	S	S	*	.	H	α-helix	trans	-69.4	-41	174.6	-72.2	-176.4	-66.6	-176.8	0.8	112.2	N290 M291 K292 G297 Q298	N290-R294 WeakPolarHBondContact O-CG 3.4Å; N290-R294 PolarHBondContact O-N 3.19Å; N290-R294 PolarHBondContact O-NE 2.97Å; M291-R294 WeakPolarHBondContact O-CB 3.46Å; M291-R294 PolarHBondContact O-N 3.16Å; K292-R294 VanDerWaalsContact C-N 3.26Å; K292-R294 PolarHBondContact O-N 3.04Å; R294-G297 PolarHBondContact O-N 3.43Å; R294-Q298 PolarHBondContact O-N 2.92Å
295	E	93.4	Very high	92.5	Very high	74 Å²	74	62.9 Å²	62.9	35%	0.346	33%	0.333	S	S	.	.	H	α-helix	trans	-60.3	-51	176.8	-170	179.5	168.3	0	0	111	M291 K292 G297 Q298	M291-E295 PolarHBondContact O-N 3.4Å; K292-E295 VanDerWaalsContact CD-OE2 3.29Å; K292-E295 WeakPolarHBondContact CD-OE2 3.5Å; K292-E295 IonicContact NZ-OE1 3.13Å; K292-E295 IonicContact NZ-OE2 3.81Å; K292-E295 PolarHBondContact NZ-OE2 3.49Å; K292-E295 WeakPolarHBondContact O-CB 3.47Å; K292-E295 PolarHBondContact O-N 3.42Å; K292-E295 VanDerWaalsContact O-N 3.16Å; E295-G297 VanDerWaalsContact C-N 3.25Å; E295-G297 PolarHBondContact O-N 2.96Å; E295-Q298 PolarHBondContact O-N 3.43Å; E295-Q298 VanDerWaalsContact O-N 3.14Å
296	F	94.2	Very high	92.3	Very high	8 Å²	8	66.9 Å²	66.9	4%	0.035	36%	0.36	C	S	.	.	H	α-helix	trans	-70.7	-19.5	178.3	-60.5	-31.5	0	0	0	113.8	K292 Q298 F315 Y318 L370 A373 D374 Y377	K292-F296 HydrophobicContact CB-CE2 4.18Å; K292-F296 HydrophobicContact CD-CZ 4.45Å; K292-F296 WeakPolarHBondContact O-CD2 3.35Å; K292-F296 WeakPolarHBondContact O-CG 3.25Å; K292-F296 PolarHBondContact O-N 3.3Å; F296-Q298 VanDerWaalsContact C-N 3.31Å; F296-F315 AromaticContact CE1-CD2 3.96Å; F296-F315 HydrophobicContact CE1-CD2 3.96Å; F296-F315 AromaticContact CE1-CE2 3.92Å; F296-F315 HydrophobicContact CE1-CE2 3.92Å; F296-F315 HydrophobicContact CZ-CD2 4.39Å; F296-F315 HydrophobicContact CZ-CE2 4.13Å; F296-Y318 AromaticContact CE2-CE1 3.98Å; F296-Y318 HydrophobicContact CE2-CE1 3.98Å; F296-Y318 HydrophobicContact CE2-CE2 4.23Å; F296-Y318 AromaticContact CE2-CZ 3.74Å; F296-Y318 AromaticContact CZ-CD1 3.82Å; F296-Y318 HydrophobicContact CZ-CD1 3.82Å; F296-Y318 HydrophobicContact CZ-CD2 4.17Å; F296-Y318 AromaticContact CZ-CE1 3.58Å; F296-Y318 HydrophobicContact CZ-CE1 3.58Å; F296-Y318 AromaticContact CZ-CE2 3.92Å; F296-Y318 HydrophobicContact CZ-CE2 3.92Å; F296-Y318 HydrophobicContact CZ-CG 4.12Å; F296-Y318 AromaticContact CZ-CZ 3.62Å; F296-L370 HydrophobicContact CD2-CD1 4.03Å; F296-L370 HydrophobicContact CE2-CD1 3.82Å; F296-A373 HydrophobicContact CB-CB 4.21Å; F296-A373 HydrophobicContact CD2-CB 4.34Å; F296-D374 HydrophobicContact CD2-CB 4.04Å; F296-D374 HydrophobicContact CE2-CB 3.7Å; F296-D374 HydrophobicContact CZ-CB 4.28Å; F296-Y377 HydrophobicContact CB-CD2 4.21Å; F296-Y377 HydrophobicContact CB-CG 4.2Å; F296-Y377 AromaticContact CD1-CD1 3.68Å; F296-Y377 HydrophobicContact CD1-CD1 3.68Å; F296-Y377 HydrophobicContact CD1-CD2 4.06Å; F296-Y377 HydrophobicContact CD1-CE1 4.06Å; F296-Y377 HydrophobicContact CD1-CE2 4.44Å; F296-Y377 AromaticContact CD1-CG 3.65Å; F296-Y377 HydrophobicContact CD1-CG 3.65Å; F296-Y377 HydrophobicContact CE1-CD1 4.02Å; F296-Y377 HydrophobicContact CE1-CE1 4.28Å; F296-Y377 HydrophobicContact CE1-CG 4.43Å; F296-Y377 HydrophobicContact CG-CG 4.21Å
297	G	90.9	Very high	92.1	Very high	49 Å²	49	67.7 Å²	67.7	51%	0.505	37%	0.369	S	S	.	.	H	α-helix	trans	-69.9	-25.1	171	0	0	0	0	0	113.9	L293 R294 E295 R299	L293-G297 PolarHBondContact O-N 3.01Å; R294-G297 PolarHBondContact O-N 3.43Å; E295-G297 VanDerWaalsContact C-N 3.25Å; E295-G297 PolarHBondContact O-N 2.96Å; G297-R299 PolarHBondContact O-N 3.31Å
298	Q	90.6	Very high	92	Very high	132 Å²	132	63.9 Å²	63.9	62%	0.617	34%	0.342	S	S	*	.			trans	-86.6	100.8	-178.8	-69	177	-0.8	0	0	110.8	R294 E295 F296	R294-Q298 PolarHBondContact O-N 2.92Å; E295-Q298 PolarHBondContact O-N 3.43Å; E295-Q298 VanDerWaalsContact O-N 3.14Å; F296-Q298 VanDerWaalsContact C-N 3.31Å
299	R	91.7	Very high	91.7	Very high	120 Å²	120	67.2 Å²	67.2	45%	0.453	36%	0.359	S	S	.	.			trans	-121.1	55	-174.8	-70.3	178.6	-70.7	167.2	-1.4	111.3	G297 I376 Y377 W380	G297-R299 PolarHBondContact O-N 3.31Å; R299-I376 VanDerWaalsContact NH1-CG2 3.26Å; R299-Y377 HydrophobicContact CG-CD2 4.15Å; R299-Y377 HydrophobicContact CG-CE2 4.5Å; R299-W380 VanDerWaalsContact C-CZ2 3.48Å; R299-W380 HydrophobicContact CB-CD2 3.82Å; R299-W380 HydrophobicContact CB-CE3 4.39Å; R299-W380 HydrophobicContact CB-CG 4.08Å; R299-W380 HydrophobicContact CB-CZ2 4.08Å; R299-W380 HydrophobicContact CG-CB 4.47Å; R299-W380 HydrophobicContact CG-CD2 3.73Å; R299-W380 HydrophobicContact CG-CE3 4.02Å; R299-W380 HydrophobicContact CG-CG 3.9Å
300	D	88.8	Confident	91.5	Very high	111 Å²	111	68.9 Å²	68.9	59%	0.594	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-73	131.6	-177.3	-65.1	-39.4	0	0	0	111	Q302 W380	D300-Q302 PolarHBondContact O-N 3.44Å; D300-Q302 PolarHBondContact O-NE2 3.49Å; D300-W380 WeakPolarHBondContact O-CZ2 3.28Å
301	P	87	Confident	91.4	Very high	99 Å²	99	67 Å²	67	64%	0.643	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-55.4	133.3	177.9	-25.6	33.9	0	0	0	112.4
302	Q	89.8	Confident	91.1	Very high	51 Å²	51	64.6 Å²	64.6	24%	0.238	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-93.9	163	-179.7	-60	-57.9	-53	0	0	111	D300 A307 V308 L311 E384 R387 L388	D300-Q302 PolarHBondContact O-N 3.44Å; D300-Q302 PolarHBondContact O-NE2 3.49Å; Q302-A307 HydrophobicContact CB-CB 4.37Å; Q302-V308 HydrophobicContact CB-CG2 3.72Å; Q302-V308 HydrophobicContact CG-CG2 3.83Å; Q302-L311 HydrophobicContact CG-CD1 4.14Å; Q302-E384 HydrophobicContact CB-CG 4.42Å; Q302-E384 PolarHBondContact N-OE1 2.95Å; Q302-R387 PolarHBondContact O-NH2 3.42Å; Q302-L388 HydrophobicContact CB-CD1 4.06Å
303	T	84.7	Confident	90.8	Very high	108 Å²	108	68.6 Å²	68.6	66%	0.663	37%	0.373	S	S	*	.	S	Bend	trans	-106.6	-12.7	-176	55.2	0	0	0	0	114.3
304	S	88.4	Confident	90.7	Very high	44 Å²	44	73 Å²	73	31%	0.308	39%	0.39	S	S	.	.	S	Bend	trans	-150.7	149.6	-177.1	65.2	0	0	0	0	111.8	S306 A307 V308 L388	S304-S306 PolarHBondContact O-N 3.34Å; S304-A307 WeakPolarHBondContact O-CB 3.32Å; S304-A307 PolarHBondContact O-N 3.09Å; S304-A307 VanDerWaalsContact O-N 3.1Å; S304-A307 PolarHBondContact OG-N 3.49Å; S304-V308 PolarHBondContact O-N 3.4Å; S304-L388 WeakPolarHBondContact O-CD1 3.36Å
305	V	90.1	Very high	90.6	Very high	17 Å²	17	65.4 Å²	65.4	10%	0.103	36%	0.362	C	S	.	.	H	α-helix	trans	-54.8	-44.1	176.6	173.3	0	0	0	0	110.7	A307 V308 E309 L385 L388 E389	V305-A307 VanDerWaalsContact C-N 3.26Å; V305-A307 PolarHBondContact O-N 3.29Å; V305-V308 PolarHBondContact O-N 3.08Å; V305-E309 HydrophobicContact CG1-CG 4.19Å; V305-E309 WeakPolarHBondContact O-CG 3.48Å; V305-E309 PolarHBondContact O-N 3.14Å; V305-L385 HydrophobicContact CG1-CD1 3.81Å; V305-L388 HydrophobicContact CG2-CB 3.84Å; V305-E389 HydrophobicContact CG2-CG 4.18Å
306	S	90.4	Very high	90.4	Very high	83 Å²	83	66.2 Å²	66.2	58%	0.58	36%	0.362	S	S	*	.	H	α-helix	trans	-57.9	-32.9	178.5	-177.3	0	0	0	0	114	S304 E309 G310	S304-S306 PolarHBondContact O-N 3.34Å; S306-E309 WeakPolarHBondContact CA-OE2 3.16Å; S306-G310 PolarHBondContact O-N 3.25Å; S306-G310 VanDerWaalsContact O-N 3.09Å
307	A	91.2	Very high	90.1	Very high	32 Å²	32	69.1 Å²	69.1	26%	0.264	38%	0.377	S	S	.	.	H	α-helix	trans	-68.4	-41.7	175.3	0	0	0	0	0	111.8	Q302 S304 V305 G310 L311	Q302-A307 HydrophobicContact CB-CB 4.37Å; S304-A307 WeakPolarHBondContact O-CB 3.32Å; S304-A307 PolarHBondContact O-N 3.09Å; S304-A307 VanDerWaalsContact O-N 3.1Å; S304-A307 PolarHBondContact OG-N 3.49Å; V305-A307 VanDerWaalsContact C-N 3.26Å; V305-A307 PolarHBondContact O-N 3.29Å; A307-G310 PolarHBondContact O-N 3.46Å; A307-L311 PolarHBondContact O-N 2.92Å
308	V	91.7	Very high	90.2	Very high	0 Å²	0	67 Å²	67	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-69.1	-41	177.2	-178.5	0	0	0	0	111.1	Q302 S304 V305 G310 L311 Q312 L381 E384 L385 L388	Q302-V308 HydrophobicContact CB-CG2 3.72Å; Q302-V308 HydrophobicContact CG-CG2 3.83Å; S304-V308 PolarHBondContact O-N 3.4Å; V305-V308 PolarHBondContact O-N 3.08Å; V308-G310 VanDerWaalsContact C-N 3.25Å; V308-G310 PolarHBondContact O-N 3.1Å; V308-L311 CarbonylContact O-C 3.3Å; V308-L311 WeakPolarHBondContact O-CA 3.39Å; V308-L311 WeakPolarHBondContact O-CB 3.22Å; V308-L311 PolarHBondContact O-N 3.34Å; V308-Q312 HydrophobicContact CG1-CG 4.48Å; V308-Q312 PolarHBondContact O-N 3.1Å; V308-L381 HydrophobicContact CG1-CD2 4.2Å; V308-E384 HydrophobicContact CG2-CG 3.8Å; V308-L385 HydrophobicContact CB-CD1 4.2Å; V308-L385 HydrophobicContact CG1-CB 4.06Å; V308-L385 HydrophobicContact CG1-CD1 4.08Å; V308-L388 HydrophobicContact CG2-CD1 3.47Å; V308-L388 VanDerWaalsContact CG2-CD1 3.47Å
309	E	89.8	Confident	90.1	Very high	96 Å²	96	63 Å²	63	45%	0.449	33%	0.334	S	S	.	.	H	α-helix	trans	-56.8	-40.5	172.8	-70.4	176.3	152.3	0	0	111.6	V305 S306 L311 Q312 Q313	V305-E309 HydrophobicContact CG1-CG 4.19Å; V305-E309 WeakPolarHBondContact O-CG 3.48Å; V305-E309 PolarHBondContact O-N 3.14Å; S306-E309 WeakPolarHBondContact CA-OE2 3.16Å; E309-L311 VanDerWaalsContact C-N 3.34Å; E309-L311 PolarHBondContact O-N 2.92Å; E309-Q312 PolarHBondContact O-N 3.4Å; E309-Q313 PolarHBondContact O-N 2.93Å
310	G	91.7	Very high	89.6	Confident	36 Å²	36	63.2 Å²	63.2	37%	0.371	34%	0.335	S	S	.	.	H	α-helix	trans	-62.1	-37.9	173.6	0	0	0	0	0	113.5	S306 A307 V308 K314	S306-G310 PolarHBondContact O-N 3.25Å; S306-G310 VanDerWaalsContact O-N 3.09Å; A307-G310 PolarHBondContact O-N 3.46Å; V308-G310 VanDerWaalsContact C-N 3.25Å; V308-G310 PolarHBondContact O-N 3.1Å; G310-K314 WeakPolarHBondContact O-CG 3.44Å; G310-K314 PolarHBondContact O-N 3.37Å
311	L	92.6	Very high	89.4	Confident	36 Å²	36	63.6 Å²	63.6	19%	0.188	33%	0.333	C	S	.	.	H	α-helix	trans	-70.4	-42.5	173.9	-66	175.4	0	0	0	111.7	Q302 A307 V308 E309 Q313 K314 F315 W380 L381	Q302-L311 HydrophobicContact CG-CD1 4.14Å; A307-L311 PolarHBondContact O-N 2.92Å; V308-L311 CarbonylContact O-C 3.3Å; V308-L311 WeakPolarHBondContact O-CA 3.39Å; V308-L311 WeakPolarHBondContact O-CB 3.22Å; V308-L311 PolarHBondContact O-N 3.34Å; E309-L311 VanDerWaalsContact C-N 3.34Å; E309-L311 PolarHBondContact O-N 2.92Å; L311-Q313 VanDerWaalsContact C-N 3.28Å; L311-Q313 PolarHBondContact O-N 2.92Å; L311-K314 WeakPolarHBondContact O-CB 3.43Å; L311-K314 PolarHBondContact O-N 3.43Å; L311-F315 WeakPolarHBondContact O-CB 3.47Å; L311-F315 PolarHBondContact O-N 3.43Å; L311-W380 HydrophobicContact CD1-CH2 4.13Å; L311-W380 HydrophobicContact CD1-CZ3 4.19Å; L311-L381 HydrophobicContact CB-CD2 3.65Å; L311-L381 HydrophobicContact CD1-CD2 4.19Å
312	Q	90.7	Very high	89.6	Confident	32 Å²	32	62.7 Å²	62.7	15%	0.15	32%	0.32	C	S	.	.	H	α-helix	trans	-58.9	-40.4	174.3	-74.8	-174.1	-4.9	0	0	111.5	V308 E309 K314 F315 R316 L381	V308-Q312 HydrophobicContact CG1-CG 4.48Å; V308-Q312 PolarHBondContact O-N 3.1Å; E309-Q312 PolarHBondContact O-N 3.4Å; Q312-K314 PolarHBondContact O-N 2.96Å; Q312-F315 WeakPolarHBondContact O-CB 3.34Å; Q312-F315 PolarHBondContact O-N 3.34Å; Q312-R316 WeakPolarHBondContact O-CG 3.4Å; Q312-R316 PolarHBondContact O-N 3.11Å; Q312-L381 HydrophobicContact CG-CB 4.31Å; Q312-L381 HydrophobicContact CG-CD1 4.21Å; Q312-L381 HydrophobicContact CG-CD2 4.5Å
313	Q	89.7	Confident	89.6	Confident	94 Å²	94	61.1 Å²	61.1	44%	0.439	31%	0.312	S	S	.	.	H	α-helix	trans	-64	-41.2	176.8	-174	59.5	20.1	0	0	112.3	E309 L311 F315 R316 L317	E309-Q313 PolarHBondContact O-N 2.93Å; L311-Q313 VanDerWaalsContact C-N 3.28Å; L311-Q313 PolarHBondContact O-N 2.92Å; Q313-F315 VanDerWaalsContact C-N 3.33Å; Q313-R316 PolarHBondContact O-N 2.88Å; Q313-L317 WeakPolarHBondContact O-CG 3.16Å; Q313-L317 PolarHBondContact O-N 2.98Å; Q313-L317 VanDerWaalsContact O-N 3.09Å
314	K	91.9	Very high	89.7	Confident	135 Å²	135	57.5 Å²	57.5	59%	0.587	29%	0.291	S	S	*	.	H	α-helix	trans	-63.2	-41.7	173.1	-70.4	177	-178.2	178.6	0	111.6	G310 L311 Q312 L317 Y318	G310-K314 WeakPolarHBondContact O-CG 3.44Å; G310-K314 PolarHBondContact O-N 3.37Å; L311-K314 WeakPolarHBondContact O-CB 3.43Å; L311-K314 PolarHBondContact O-N 3.43Å; Q312-K314 PolarHBondContact O-N 2.96Å; K314-L317 WeakPolarHBondContact O-CB 3.47Å; K314-L317 PolarHBondContact O-N 3.02Å; K314-Y318 PolarHBondContact O-N 3.35Å
315	F	92.9	Very high	89.7	Confident	16 Å²	16	58 Å²	58	7%	0.07	30%	0.295	C	S	.	.	H	α-helix	trans	-64.5	-39.1	177.8	-169.4	-111	0	0	0	112.5	F296 L311 Q312 Q313 L317 Y318 Y319 D374 Y377 E378 L381	F296-F315 AromaticContact CE1-CD2 3.96Å; F296-F315 HydrophobicContact CE1-CD2 3.96Å; F296-F315 AromaticContact CE1-CE2 3.92Å; F296-F315 HydrophobicContact CE1-CE2 3.92Å; F296-F315 HydrophobicContact CZ-CD2 4.39Å; F296-F315 HydrophobicContact CZ-CE2 4.13Å; L311-F315 WeakPolarHBondContact O-CB 3.47Å; L311-F315 PolarHBondContact O-N 3.43Å; Q312-F315 WeakPolarHBondContact O-CB 3.34Å; Q312-F315 PolarHBondContact O-N 3.34Å; Q313-F315 VanDerWaalsContact C-N 3.33Å; F315-L317 PolarHBondContact O-N 3.46Å; F315-Y318 HydrophobicContact CD2-CD1 4.3Å; F315-Y318 HydrophobicContact CE2-CD1 4.33Å; F315-Y318 WeakPolarHBondContact O-CB 3.49Å; F315-Y318 PolarHBondContact O-N 3.26Å; F315-Y319 HydrophobicContact CD1-CD2 4Å; F315-Y319 HydrophobicContact CD1-CE2 4.21Å; F315-Y319 HydrophobicContact CD2-CD2 4.44Å; F315-Y319 HydrophobicContact CD2-CE2 4.45Å; F315-Y319 AromaticContact CE1-CD2 3.68Å; F315-Y319 HydrophobicContact CE1-CD2 3.68Å; F315-Y319 AromaticContact CE1-CE2 3.44Å; F315-Y319 HydrophobicContact CE1-CE2 3.44Å; F315-Y319 VanDerWaalsContact CE1-CE2 3.44Å; F315-Y319 HydrophobicContact CE2-CD2 4.15Å; F315-Y319 AromaticContact CE2-CE2 3.72Å; F315-Y319 HydrophobicContact CE2-CE2 3.72Å; F315-Y319 HydrophobicContact CG-CD2 4.41Å; F315-Y319 AromaticContact CZ-CD2 3.83Å; F315-Y319 HydrophobicContact CZ-CD2 3.83Å; F315-Y319 AromaticContact CZ-CE2 3.22Å; F315-Y319 HydrophobicContact CZ-CE2 3.22Å; F315-Y319 PolarHBondContact O-N 3.44Å; F315-D374 HydrophobicContact CE2-CB 4.33Å; F315-D374 HydrophobicContact CZ-CB 4.47Å; F315-D374 WeakPolarHBondContact CZ-O 3.44Å; F315-Y377 AromaticContact CD2-CD1 3.52Å; F315-Y377 HydrophobicContact CD2-CD1 3.52Å; F315-Y377 AromaticContact CD2-CE1 3.76Å; F315-Y377 HydrophobicContact CD2-CE1 3.76Å; F315-Y377 AromaticContact CE2-CD1 3.49Å; F315-Y377 HydrophobicContact CE2-CD1 3.49Å; F315-Y377 VanDerWaalsContact CE2-CD1 3.49Å; F315-Y377 HydrophobicContact CE2-CE1 4.22Å; F315-Y377 HydrophobicContact CE2-CG 4.44Å; F315-Y377 HydrophobicContact CG-CD1 4.31Å; F315-Y377 HydrophobicContact CG-CE1 4.35Å; F315-Y377 HydrophobicContact CZ-CD1 4.23Å; F315-E378 HydrophobicContact CE1-CB 3.64Å; F315-E378 HydrophobicContact CE1-CG 3.79Å; F315-E378 HydrophobicContact CZ-CB 3.69Å; F315-E378 HydrophobicContact CZ-CG 4.35Å; F315-L381 HydrophobicContact CB-CD1 3.99Å; F315-L381 HydrophobicContact CD1-CD1 4.19Å; F315-L381 HydrophobicContact CG-CD1 4Å
316	R	88.6	Confident	89.8	Confident	91 Å²	91	58.7 Å²	58.7	34%	0.343	30%	0.296	S	S	.	.	H	α-helix	trans	-60.8	-42.5	171.5	-75.2	174.8	175.1	164	-2.5	111.9	Q312 Q313 Y319 R320 E695	Q312-R316 WeakPolarHBondContact O-CG 3.4Å; Q312-R316 PolarHBondContact O-N 3.11Å; Q313-R316 PolarHBondContact O-N 2.88Å; R316-Y319 PolarHBondContact O-N 3.14Å; R316-R320 WeakPolarHBondContact O-CB 3.47Å; R316-R320 PolarHBondContact O-N 3.21Å; R316-E695 IonicContact CZ-OE2 3.21Å; R316-E695 IonicContact NE-OE2 3.99Å; R316-E695 IonicContact NH2-OE2 2.78Å; R316-E695 PolarHBondContact NH2-OE2 3.01Å
317	L	89	Confident	89.8	Confident	69 Å²	69	56.2 Å²	56.2	36%	0.361	28%	0.276	S	S	.	.	H	α-helix	trans	-63.9	-41.9	175.4	-70.4	172.4	0	0	0	111.9	Q313 K314 F315 Y319 R320 Q321	Q313-L317 WeakPolarHBondContact O-CG 3.16Å; Q313-L317 PolarHBondContact O-N 2.98Å; Q313-L317 VanDerWaalsContact O-N 3.09Å; K314-L317 WeakPolarHBondContact O-CB 3.47Å; K314-L317 PolarHBondContact O-N 3.02Å; F315-L317 PolarHBondContact O-N 3.46Å; L317-Y319 PolarHBondContact O-N 3.22Å; L317-R320 PolarHBondContact O-N 2.94Å; L317-Q321 PolarHBondContact O-N 2.71Å
318	Y	92.8	Very high	89.5	Confident	4 Å²	4	59.7 Å²	59.7	2%	0.016	29%	0.287	C	S	.	.	I	π-helix	trans	-56	-49.6	173.3	162.2	-98.8	0	0	0	111.5	W288 K292 F296 K314 F315 E322 K323 D374	W288-Y318 AromaticContact CH2-CE2 3.74Å; W288-Y318 HydrophobicContact CH2-CE2 3.74Å; W288-Y318 HydrophobicContact CZ2-CD2 4.22Å; W288-Y318 AromaticContact CZ2-CE2 3.61Å; W288-Y318 HydrophobicContact CZ2-CE2 3.61Å; K292-Y318 HydrophobicContact CD-CD2 4.13Å; K292-Y318 HydrophobicContact CD-CE2 4.03Å; K292-Y318 HydrophobicContact CG-CE2 4.17Å; F296-Y318 AromaticContact CE2-CE1 3.98Å; F296-Y318 HydrophobicContact CE2-CE1 3.98Å; F296-Y318 HydrophobicContact CE2-CE2 4.23Å; F296-Y318 AromaticContact CE2-CZ 3.74Å; F296-Y318 AromaticContact CZ-CD1 3.82Å; F296-Y318 HydrophobicContact CZ-CD1 3.82Å; F296-Y318 HydrophobicContact CZ-CD2 4.17Å; F296-Y318 AromaticContact CZ-CE1 3.58Å; F296-Y318 HydrophobicContact CZ-CE1 3.58Å; F296-Y318 AromaticContact CZ-CE2 3.92Å; F296-Y318 HydrophobicContact CZ-CE2 3.92Å; F296-Y318 HydrophobicContact CZ-CG 4.12Å; F296-Y318 AromaticContact CZ-CZ 3.62Å; K314-Y318 PolarHBondContact O-N 3.35Å; F315-Y318 HydrophobicContact CD2-CD1 4.3Å; F315-Y318 HydrophobicContact CE2-CD1 4.33Å; F315-Y318 WeakPolarHBondContact O-CB 3.49Å; F315-Y318 PolarHBondContact O-N 3.26Å; Y318-E322 HydrophobicContact CD2-CB 4.22Å; Y318-E322 PolarHBondContact O-N 3Å; Y318-K323 HydrophobicContact CE1-CB 4.3Å; Y318-K323 HydrophobicContact CE1-CD 3.99Å; Y318-K323 HydrophobicContact CE2-CB 4.2Å; Y318-K323 WeakPolarHBondContact O-CB 3.48Å; Y318-K323 PolarHBondContact O-N 3.48Å; Y318-D374 HydrophobicContact CE1-CB 4.27Å
319	Y	87.8	Confident	89.4	Confident	49 Å²	49	61.9 Å²	61.9	19%	0.192	30%	0.297	C	S	.	.	I	π-helix	trans	-68.1	-36.1	179.5	-98.2	-81.1	0	0	0	113.8	F315 R316 L317 K323 P324 D374	F315-Y319 HydrophobicContact CD1-CD2 4Å; F315-Y319 HydrophobicContact CD1-CE2 4.21Å; F315-Y319 HydrophobicContact CD2-CD2 4.44Å; F315-Y319 HydrophobicContact CD2-CE2 4.45Å; F315-Y319 AromaticContact CE1-CD2 3.68Å; F315-Y319 HydrophobicContact CE1-CD2 3.68Å; F315-Y319 AromaticContact CE1-CE2 3.44Å; F315-Y319 HydrophobicContact CE1-CE2 3.44Å; F315-Y319 VanDerWaalsContact CE1-CE2 3.44Å; F315-Y319 HydrophobicContact CE2-CD2 4.15Å; F315-Y319 AromaticContact CE2-CE2 3.72Å; F315-Y319 HydrophobicContact CE2-CE2 3.72Å; F315-Y319 HydrophobicContact CG-CD2 4.41Å; F315-Y319 AromaticContact CZ-CD2 3.83Å; F315-Y319 HydrophobicContact CZ-CD2 3.83Å; F315-Y319 AromaticContact CZ-CE2 3.22Å; F315-Y319 HydrophobicContact CZ-CE2 3.22Å; F315-Y319 PolarHBondContact O-N 3.44Å; R316-Y319 PolarHBondContact O-N 3.14Å; L317-Y319 PolarHBondContact O-N 3.22Å; Y319-K323 HydrophobicContact CD1-CD 4.22Å; Y319-K323 HydrophobicContact CE1-CD 4.05Å; Y319-P324 VanDerWaalsContact O-CD 3.31Å; Y319-P324 WeakPolarHBondContact O-CD 3.4Å; Y319-P324 WeakPolarHBondContact O-CG 3.41Å; Y319-D374 HydrophobicContact CE2-CB 4.4Å; Y319-D374 PolarHBondContact OH-OD1 3.31Å; Y319-D374 PolarHBondContact OH-OD2 2.86Å
320	R	81.2	Confident	89.5	Confident	124 Å²	124	58.9 Å²	58.9	47%	0.468	28%	0.283	S	S	.	.	I	π-helix	trans	-82.5	-32.1	-174.2	-171.5	177.7	-174.6	-159.8	-6.8	113.5	R316 L317 N685 E688	R316-R320 WeakPolarHBondContact O-CB 3.47Å; R316-R320 PolarHBondContact O-N 3.21Å; L317-R320 PolarHBondContact O-N 2.94Å; R320-N685 PolarHBondContact NH2-OD1 3.43Å; R320-E688 IonicContact CZ-OE2 3.47Å; R320-E688 IonicContact NE-OE2 3.33Å; R320-E688 PolarHBondContact NE-OE2 3.15Å; R320-E688 IonicContact NH2-OE2 2.84Å; R320-E688 PolarHBondContact NH2-OE2 3.4Å
321	Q	85.5	Confident	89.2	Confident	120 Å²	120	57.7 Å²	57.7	56%	0.561	27%	0.269	S	S	*	.	I	π-helix	trans	-123.7	-53.6	-169.1	-61.3	-178.7	-0.6	0	0	112.4	L317	L317-Q321 PolarHBondContact O-N 2.71Å
322	E	90.8	Very high	88.9	Confident	79 Å²	79	63.9 Å²	63.9	37%	0.369	29%	0.29	S	S	.	.	I	π-helix	trans	-72.7	-52.9	-171.9	-62.6	-177.1	-159	0	0	112.5	W288 K292 Y318 S325 K326	W288-E322 HydrophobicContact CZ2-CB 4.37Å; K292-E322 WeakPolarHBondContact CE-OE2 3.49Å; K292-E322 IonicContact NZ-OE2 2.89Å; K292-E322 PolarHBondContact NZ-OE2 2.65Å; Y318-E322 HydrophobicContact CD2-CB 4.22Å; Y318-E322 PolarHBondContact O-N 3Å; E322-S325 PolarHBondContact O-N 2.89Å; E322-K326 WeakPolarHBondContact O-CG 3.39Å; E322-K326 PolarHBondContact O-N 2.79Å; E322-K326 VanDerWaalsContact O-N 3.14Å
323	K	90.9	Very high	88.9	Confident	18 Å²	18	62.4 Å²	62.4	8%	0.078	28%	0.284	C	S	.	.	H	α-helix	trans	-61.8	-44.5	-174.8	-175.3	177.4	179.3	173.4	0	112.9	Y318 Y319 S325 K326 L327 W367 D374	Y318-K323 HydrophobicContact CE1-CB 4.3Å; Y318-K323 HydrophobicContact CE1-CD 3.99Å; Y318-K323 HydrophobicContact CE2-CB 4.2Å; Y318-K323 WeakPolarHBondContact O-CB 3.48Å; Y318-K323 PolarHBondContact O-N 3.48Å; Y319-K323 HydrophobicContact CD1-CD 4.22Å; Y319-K323 HydrophobicContact CE1-CD 4.05Å; K323-S325 PolarHBondContact O-N 3.37Å; K323-K326 PolarHBondContact O-N 2.8Å; K323-K326 VanDerWaalsContact O-N 3.16Å; K323-L327 PolarHBondContact O-N 3.03Å; K323-W367 HydrophobicContact CG-CH2 4.48Å; K323-D374 IonicContact NZ-OD2 2.62Å; K323-D374 PolarHBondContact NZ-OD2 3.3Å
324	P	86.4	Confident	88.7	Confident	33 Å²	33	60.3 Å²	60.3	21%	0.214	27%	0.274	C	S	.	.	H	α-helix	trans	-61.1	-41.9	177.5	-25.7	36.1	0	0	0	113.3	Y319 K326 L327 Q328	Y319-P324 VanDerWaalsContact O-CD 3.31Å; Y319-P324 WeakPolarHBondContact O-CD 3.4Å; Y319-P324 WeakPolarHBondContact O-CG 3.41Å; P324-K326 VanDerWaalsContact C-N 3.29Å; P324-K326 PolarHBondContact O-N 3.41Å; P324-L327 WeakPolarHBondContact O-CB 3.27Å; P324-L327 PolarHBondContact O-N 3.37Å; P324-Q328 PolarHBondContact O-N 3.45Å; P324-Q328 VanDerWaalsContact O-N 3.08Å
325	S	88.7	Confident	88.3	Confident	55 Å²	55	55.2 Å²	55.2	39%	0.385	25%	0.254	S	S	.	.	H	α-helix	trans	-62	-37.9	175.9	178.5	0	0	0	0	111.8	E322 K323 Q328 E329	E322-S325 PolarHBondContact O-N 2.89Å; K323-S325 PolarHBondContact O-N 3.37Å; S325-Q328 WeakPolarHBondContact O-CB 3.49Å; S325-Q328 PolarHBondContact O-N 3.37Å; S325-E329 PolarHBondContact O-N 3.22Å; S325-E329 VanDerWaalsContact O-N 3.11Å
326	K	92	Very high	88	Confident	31 Å²	31	55.2 Å²	55.2	14%	0.135	26%	0.255	C	S	.	.	H	α-helix	trans	-75.6	-28.9	178.4	-64.7	-62	-179.8	-162.2	0	113.4	L285 W288 E322 K323 P324 Q328 E329 K330 W367	L285-K326 HydrophobicContact CD1-CB 4.19Å; L285-K326 HydrophobicContact CD1-CD 4.32Å; W288-K326 HydrophobicContact CD2-CB 4.44Å; W288-K326 HydrophobicContact CD2-CD 4.08Å; W288-K326 HydrophobicContact CD2-CG 3.73Å; W288-K326 HydrophobicContact CE3-CB 4.03Å; W288-K326 HydrophobicContact CE3-CD 4.31Å; W288-K326 HydrophobicContact CE3-CG 3.83Å; W288-K326 HydrophobicContact CG-CD 4.27Å; W288-K326 HydrophobicContact CG-CG 4.38Å; W288-K326 HydrophobicContact CH2-CB 3.82Å; W288-K326 HydrophobicContact CH2-CG 3.82Å; W288-K326 HydrophobicContact CZ2-CB 4.24Å; W288-K326 HydrophobicContact CZ2-CG 3.71Å; W288-K326 HydrophobicContact CZ3-CB 3.71Å; W288-K326 HydrophobicContact CZ3-CG 3.88Å; E322-K326 WeakPolarHBondContact O-CG 3.39Å; E322-K326 PolarHBondContact O-N 2.79Å; E322-K326 VanDerWaalsContact O-N 3.14Å; K323-K326 PolarHBondContact O-N 2.8Å; K323-K326 VanDerWaalsContact O-N 3.16Å; P324-K326 VanDerWaalsContact C-N 3.29Å; P324-K326 PolarHBondContact O-N 3.41Å; K326-Q328 VanDerWaalsContact C-N 3.34Å; K326-E329 VanDerWaalsContact CD-OE2 3.22Å; K326-E329 WeakPolarHBondContact CD-OE2 3.44Å; K326-E329 IonicContact NZ-OE1 2.86Å; K326-E329 PolarHBondContact NZ-OE1 2.83Å; K326-E329 IonicContact NZ-OE2 3.72Å; K326-E329 PolarHBondContact NZ-OE2 2.89Å; K326-E329 PolarHBondContact O-N 3.48Å; K326-K330 PolarHBondContact O-N 3.09Å; K326-W367 HydrophobicContact CB-CH2 4.2Å; K326-W367 HydrophobicContact CB-CZ3 4.15Å
327	L	90	Very high	88	Confident	31 Å²	31	53.5 Å²	53.5	16%	0.162	25%	0.249	C	C	.	.	H	α-helix	trans	-64.6	-40.4	169.7	-177.4	63.5	0	0	0	111.1	K323 P324 K330 A331 W367 E717	K323-L327 PolarHBondContact O-N 3.03Å; P324-L327 WeakPolarHBondContact O-CB 3.27Å; P324-L327 PolarHBondContact O-N 3.37Å; L327-K330 WeakPolarHBondContact O-CB 3.2Å; L327-K330 PolarHBondContact O-N 3.5Å; L327-A331 PolarHBondContact O-N 3.22Å; L327-W367 HydrophobicContact CB-CH2 4.01Å; L327-W367 HydrophobicContact CB-CZ2 4Å; L327-W367 HydrophobicContact CD1-CH2 4.39Å; L327-W367 HydrophobicContact CD1-CZ2 3.71Å; L327-W367 HydrophobicContact CG-CZ2 4.43Å; L327-E717 HydrophobicContact CD2-CB 3.85Å; L327-E717 HydrophobicContact CD2-CG 4.21Å
328	Q	85.5	Confident	87.6	Confident	105 Å²	105	52.7 Å²	52.7	49%	0.491	25%	0.245	S	C	.	.	H	α-helix	trans	-62.6	-42.5	172.5	-68.6	174.9	-2.2	0	0	112	P324 S325 K326 K330 A331 R332	P324-Q328 PolarHBondContact O-N 3.45Å; P324-Q328 VanDerWaalsContact O-N 3.08Å; S325-Q328 WeakPolarHBondContact O-CB 3.49Å; S325-Q328 PolarHBondContact O-N 3.37Å; K326-Q328 VanDerWaalsContact C-N 3.34Å; Q328-K330 VanDerWaalsContact C-N 3.32Å; Q328-K330 PolarHBondContact O-N 3.42Å; Q328-A331 PolarHBondContact O-N 2.82Å; Q328-R332 WeakPolarHBondContact O-CB 3.46Å; Q328-R332 PolarHBondContact O-N 3.38Å
329	E	89.8	Confident	87.1	Confident	46 Å²	46	53.9 Å²	53.9	22%	0.215	25%	0.253	C	S	.	.	H	α-helix	trans	-59.4	-40.9	173.9	-76	176	-152.6	0	0	112.2	N281 S325 K326 R332 L333	N281-E329 PolarHBondContact ND2-O 2.88Å; S325-E329 PolarHBondContact O-N 3.22Å; S325-E329 VanDerWaalsContact O-N 3.11Å; K326-E329 VanDerWaalsContact CD-OE2 3.22Å; K326-E329 WeakPolarHBondContact CD-OE2 3.44Å; K326-E329 IonicContact NZ-OE1 2.86Å; K326-E329 PolarHBondContact NZ-OE1 2.83Å; K326-E329 IonicContact NZ-OE2 3.72Å; K326-E329 PolarHBondContact NZ-OE2 2.89Å; K326-E329 PolarHBondContact O-N 3.48Å; E329-R332 PolarHBondContact O-N 3.48Å; E329-L333 PolarHBondContact O-N 3.1Å
330	K	91.4	Very high	87	Confident	33 Å²	33	51.5 Å²	51.5	14%	0.143	24%	0.244	C	C	.	.	H	α-helix	trans	-61.8	-47.7	174.3	-178.8	-175.4	172.7	-65.5	0	111.9	L285 K326 L327 Q328 R332 L333 E334 V363 W367	L285-K330 HydrophobicContact CD2-CB 3.81Å; L285-K330 HydrophobicContact CD2-CG 4.34Å; K326-K330 PolarHBondContact O-N 3.09Å; L327-K330 WeakPolarHBondContact O-CB 3.2Å; L327-K330 PolarHBondContact O-N 3.5Å; Q328-K330 VanDerWaalsContact C-N 3.32Å; Q328-K330 PolarHBondContact O-N 3.42Å; K330-R332 VanDerWaalsContact C-N 3.33Å; K330-R332 PolarHBondContact O-N 3.46Å; K330-L333 WeakPolarHBondContact O-CB 3.39Å; K330-L333 PolarHBondContact O-N 3.18Å; K330-E334 IonicContact NZ-OE1 3.31Å; K330-E334 PolarHBondContact NZ-OE1 3.03Å; K330-E334 PolarHBondContact O-N 3.05Å; K330-V363 HydrophobicContact CG-CG1 4.46Å; K330-W367 HydrophobicContact CD-CB 4.29Å; K330-W367 HydrophobicContact CD-CD2 3.72Å; K330-W367 HydrophobicContact CD-CE3 4.01Å; K330-W367 HydrophobicContact CD-CG 3.82Å
331	A	85.7	Confident	87	Confident	11 Å²	11	47.3 Å²	47.3	9%	0.091	23%	0.229	C	C	.	.	H	α-helix	trans	-62.7	-40.5	176.7	0	0	0	0	0	111.6	L327 Q328 L333 E334 T335	L327-A331 PolarHBondContact O-N 3.22Å; Q328-A331 PolarHBondContact O-N 2.82Å; A331-L333 VanDerWaalsContact C-N 3.29Å; A331-L333 PolarHBondContact O-N 3.33Å; A331-E334 PolarHBondContact O-N 2.89Å; A331-T335 WeakPolarHBondContact O-CG2 3.45Å; A331-T335 PolarHBondContact O-N 2.78Å; A331-T335 PolarHBondContact O-OG1 2.86Å
332	R	86.4	Confident	86.5	Confident	165 Å²	165	42.3 Å²	42.3	62%	0.623	21%	0.207	S	C	*	.	H	α-helix	trans	-61.9	-36.1	174.5	-171.5	176.8	177.5	-174.7	-1	112.5	Q328 E329 K330 T335 T336	Q328-R332 WeakPolarHBondContact O-CB 3.46Å; Q328-R332 PolarHBondContact O-N 3.38Å; E329-R332 PolarHBondContact O-N 3.48Å; K330-R332 VanDerWaalsContact C-N 3.33Å; K330-R332 PolarHBondContact O-N 3.46Å; R332-T335 VanDerWaalsContact CA-OG1 3.24Å; R332-T335 WeakPolarHBondContact CA-OG1 3.39Å; R332-T335 PolarHBondContact O-OG1 3.4Å; R332-T336 VanDerWaalsContact O-CB 3.31Å; R332-T336 WeakPolarHBondContact O-CB 3.46Å; R332-T336 PolarHBondContact O-N 2.79Å; R332-T336 PolarHBondContact O-OG1 3.34Å
333	L	89.2	Confident	86	Confident	2 Å²	2	41 Å²	41	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-63.3	-47.3	176.2	-172.1	73.2	0	0	0	111.3	Y278 N281 E329 K330 A331 T336 Y337 V363	Y278-L333 HydrophobicContact CD1-CD1 4.47Å; Y278-L333 HydrophobicContact CD2-CD1 3.49Å; Y278-L333 VanDerWaalsContact CD2-CD1 3.49Å; Y278-L333 HydrophobicContact CD2-CG 3.96Å; Y278-L333 HydrophobicContact CE2-CD1 3.64Å; Y278-L333 HydrophobicContact CE2-CD2 4.33Å; Y278-L333 HydrophobicContact CE2-CG 3.67Å; Y278-L333 HydrophobicContact CG-CD1 3.95Å; Y278-L333 WeakPolarHBondContact O-CD1 3.37Å; N281-L333 HydrophobicContact CB-CD1 3.94Å; E329-L333 PolarHBondContact O-N 3.1Å; K330-L333 WeakPolarHBondContact O-CB 3.39Å; K330-L333 PolarHBondContact O-N 3.18Å; A331-L333 VanDerWaalsContact C-N 3.29Å; A331-L333 PolarHBondContact O-N 3.33Å; L333-T336 PolarHBondContact O-N 2.68Å; L333-Y337 PolarHBondContact O-N 2.98Å; L333-Y337 VanDerWaalsContact O-N 3.07Å; L333-V363 HydrophobicContact CD2-CB 4.38Å; L333-V363 HydrophobicContact CD2-CG1 4.13Å; L333-V363 HydrophobicContact CD2-CG2 3.86Å
334	E	87.3	Confident	85.4	Confident	50 Å²	50	40.6 Å²	40.6	23%	0.234	20%	0.197	C	C	.	.	H	α-helix	trans	-62.7	-44.1	178.5	-70.1	171.8	-169.4	0	0	111.9	K330 A331 Y337 N338 I360	K330-E334 IonicContact NZ-OE1 3.31Å; K330-E334 PolarHBondContact NZ-OE1 3.03Å; K330-E334 PolarHBondContact O-N 3.05Å; A331-E334 PolarHBondContact O-N 2.89Å; E334-Y337 PolarHBondContact O-N 3.34Å; E334-N338 VanDerWaalsContact O-CG 3.27Å; E334-N338 PolarHBondContact O-N 3.22Å; E334-N338 PolarHBondContact O-ND2 3.47Å; E334-I360 HydrophobicContact CG-CD1 4.49Å; E334-I360 HydrophobicContact CG-CG2 4.05Å
335	T	83	Confident	84.9	Confident	27 Å²	27	43.6 Å²	43.6	17%	0.166	20%	0.204	C	C	.	.	H	α-helix	trans	-66.2	-41.4	177.4	50.7	0	0	0	0	112.7	A331 R332 Y337 N338 T339 N728	A331-T335 WeakPolarHBondContact O-CG2 3.45Å; A331-T335 PolarHBondContact O-N 2.78Å; A331-T335 PolarHBondContact O-OG1 2.86Å; R332-T335 VanDerWaalsContact CA-OG1 3.24Å; R332-T335 WeakPolarHBondContact CA-OG1 3.39Å; R332-T335 PolarHBondContact O-OG1 3.4Å; T335-Y337 VanDerWaalsContact C-N 3.34Å; T335-Y337 PolarHBondContact O-N 2.93Å; T335-N338 PolarHBondContact O-N 3.27Å; T335-T339 WeakPolarHBondContact O-CB 3.35Å; T335-T339 PolarHBondContact O-N 3.18Å; T335-T339 PolarHBondContact O-OG1 3.12Å; T335-T339 VanDerWaalsContact O-OG1 3.05Å; T335-N728 WeakPolarHBondContact CB-OD1 3.23Å; T335-N728 HydrophobicContact CG2-CB 3.53Å; T335-N728 PolarHBondContact O-OD1 3.09Å
336	T	86.5	Confident	83.9	Confident	16 Å²	16	42.3 Å²	42.3	10%	0.098	19%	0.193	C	C	.	.	H	α-helix	trans	-59.8	-45	175.3	-57.7	0	0	0	0	111	L274 C277 R332 L333 L340	L274-T336 HydrophobicContact CB-CG2 4.5Å; L274-T336 HydrophobicContact CD2-CG2 4.05Å; C277-T336 HydrophobicContact CB-CG2 4.39Å; R332-T336 VanDerWaalsContact O-CB 3.31Å; R332-T336 WeakPolarHBondContact O-CB 3.46Å; R332-T336 PolarHBondContact O-N 2.79Å; R332-T336 PolarHBondContact O-OG1 3.34Å; L333-T336 PolarHBondContact O-N 2.68Å; T336-L340 WeakPolarHBondContact O-CB 3.12Å; T336-L340 PolarHBondContact O-N 2.95Å
337	Y	87.9	Confident	82.9	Confident	55 Å²	55	43.8 Å²	43.8	22%	0.216	20%	0.202	C	C	.	.	H	α-helix	trans	-63.6	-47.1	177.4	-179.6	-96.8	0	0	0	112.6	Y278 L333 E334 T335 T339 L340 Q341 Y352 P354 I360	Y278-Y337 HydrophobicContact CD2-CD2 4.28Å; Y278-Y337 AromaticContact CE2-CD2 3.82Å; Y278-Y337 HydrophobicContact CE2-CD2 3.82Å; Y278-Y337 HydrophobicContact CE2-CG 4.12Å; L333-Y337 PolarHBondContact O-N 2.98Å; L333-Y337 VanDerWaalsContact O-N 3.07Å; E334-Y337 PolarHBondContact O-N 3.34Å; T335-Y337 VanDerWaalsContact C-N 3.34Å; T335-Y337 PolarHBondContact O-N 2.93Å; Y337-T339 VanDerWaalsContact C-N 3.32Å; Y337-T339 PolarHBondContact O-N 3.39Å; Y337-L340 PolarHBondContact O-N 3.18Å; Y337-Q341 HydrophobicContact CD1-CG 3.99Å; Y337-Q341 HydrophobicContact CE1-CG 3.68Å; Y337-Q341 HydrophobicContact CE2-CG 4.26Å; Y337-Q341 VanDerWaalsContact CE2-NE2 3.34Å; Y337-Q341 HydrophobicContact CG-CG 4.44Å; Y337-Q341 WeakPolarHBondContact O-CG 3.37Å; Y337-Q341 PolarHBondContact O-N 2.77Å; Y337-Q341 PolarHBondContact OH-NE2 3.05Å; Y337-Q341 VanDerWaalsContact OH-NE2 3.15Å; Y337-Y352 HydrophobicContact CD2-CD1 4.17Å; Y337-Y352 HydrophobicContact CE2-CD1 4.17Å; Y337-P354 HydrophobicContact CD2-CG 4.47Å; Y337-P354 HydrophobicContact CE2-CG 4.08Å; Y337-I360 HydrophobicContact CD1-CD1 3.21Å; Y337-I360 HydrophobicContact CD1-CG1 4.33Å; Y337-I360 HydrophobicContact CD2-CD1 4.17Å; Y337-I360 HydrophobicContact CE1-CD1 3.81Å; Y337-I360 HydrophobicContact CG-CD1 3.41Å; Y337-I360 VanDerWaalsContact CG-CD1 3.41Å; Y337-I360 HydrophobicContact CG-CG1 4.23Å
338	N	81.5	Confident	81.8	Confident	52 Å²	52	47.6 Å²	47.6	28%	0.278	22%	0.222	S	C	.	.	H	α-helix	trans	-61	-43	179.5	-72.2	-19.8	0	0	0	111.6	E334 T335 Q341 T342	E334-N338 VanDerWaalsContact O-CG 3.27Å; E334-N338 PolarHBondContact O-N 3.22Å; E334-N338 PolarHBondContact O-ND2 3.47Å; T335-N338 PolarHBondContact O-N 3.27Å; N338-Q341 PolarHBondContact O-N 3.47Å; N338-T342 WeakPolarHBondContact O-CB 3.44Å; N338-T342 PolarHBondContact O-N 2.98Å; N338-T342 PolarHBondContact O-OG1 3.36Å
339	T	82.7	Confident	81.1	Confident	29 Å²	29	44.4 Å²	44.4	18%	0.178	21%	0.207	C	C	.	.	H	α-helix	trans	-62.4	-45.3	175.5	-63.7	0	0	0	0	111.5	L274 T335 Y337 T342 R343 N728 N732	L274-T339 HydrophobicContact CD1-CG2 4.27Å; T335-T339 WeakPolarHBondContact O-CB 3.35Å; T335-T339 PolarHBondContact O-N 3.18Å; T335-T339 PolarHBondContact O-OG1 3.12Å; T335-T339 VanDerWaalsContact O-OG1 3.05Å; Y337-T339 VanDerWaalsContact C-N 3.32Å; Y337-T339 PolarHBondContact O-N 3.39Å; T339-T342 PolarHBondContact O-N 3.42Å; T339-R343 WeakPolarHBondContact O-CB 3.2Å; T339-R343 WeakPolarHBondContact O-CG 3.16Å; T339-R343 PolarHBondContact O-N 2.73Å; T339-N728 PolarHBondContact OG1-OD1 3.41Å; T339-N728 VanDerWaalsContact OG1-OD1 3.05Å; T339-N732 WeakPolarHBondContact CA-OD1 3.46Å
340	L	84.5	Confident	80.3	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-45.9	177.3	177.6	60.2	0	0	0	112.2	N271 L274 E275 T336 Y337 T342 R343 L344 Y352	N271-L340 HydrophobicContact CB-CD1 4.21Å; L274-L340 HydrophobicContact CB-CB 4.35Å; L274-L340 HydrophobicContact CB-CD1 4.1Å; L274-L340 HydrophobicContact CD1-CD1 4.5Å; E275-L340 HydrophobicContact CB-CD2 4.45Å; E275-L340 HydrophobicContact CG-CD1 4.14Å; E275-L340 HydrophobicContact CG-CD2 3.57Å; E275-L340 HydrophobicContact CG-CG 4.49Å; T336-L340 WeakPolarHBondContact O-CB 3.12Å; T336-L340 PolarHBondContact O-N 2.95Å; Y337-L340 PolarHBondContact O-N 3.18Å; L340-T342 VanDerWaalsContact C-N 3.34Å; L340-T342 PolarHBondContact O-N 3.37Å; L340-R343 PolarHBondContact O-N 2.68Å; L340-L344 HydrophobicContact CD1-CD1 3.94Å; L340-L344 HydrophobicContact CD1-CG 4.1Å; L340-L344 HydrophobicContact CG-CD1 4Å; L340-L344 VanDerWaalsContact O-CG 3.31Å; L340-L344 WeakPolarHBondContact O-CG 3.28Å; L340-L344 PolarHBondContact O-N 3.42Å; L340-Y352 HydrophobicContact CD2-CD1 3.54Å; L340-Y352 HydrophobicContact CD2-CD2 4.17Å; L340-Y352 HydrophobicContact CD2-CE1 4.14Å; L340-Y352 HydrophobicContact CD2-CG 3.56Å; L340-Y352 HydrophobicContact CG-CG 4.45Å
341	Q	81.9	Confident	79.6	Confident	36 Å²	36	48.7 Å²	48.7	17%	0.168	24%	0.244	C	C	.	.	H	α-helix	trans	-59.7	-45.4	176.4	-71.3	-61.7	-14.3	0	0	111.7	Y337 N338 R343 L344 R345 Y352	Y337-Q341 HydrophobicContact CD1-CG 3.99Å; Y337-Q341 HydrophobicContact CE1-CG 3.68Å; Y337-Q341 HydrophobicContact CE2-CG 4.26Å; Y337-Q341 VanDerWaalsContact CE2-NE2 3.34Å; Y337-Q341 HydrophobicContact CG-CG 4.44Å; Y337-Q341 WeakPolarHBondContact O-CG 3.37Å; Y337-Q341 PolarHBondContact O-N 2.77Å; Y337-Q341 PolarHBondContact OH-NE2 3.05Å; Y337-Q341 VanDerWaalsContact OH-NE2 3.15Å; N338-Q341 PolarHBondContact O-N 3.47Å; Q341-R343 PolarHBondContact O-N 2.94Å; Q341-L344 PolarHBondContact O-N 3.45Å; Q341-R345 VanDerWaalsContact O-CB 3.3Å; Q341-R345 WeakPolarHBondContact O-CB 3.34Å; Q341-R345 PolarHBondContact O-N 3.04Å; Q341-Y352 PolarHBondContact NE2-O 3.44Å
342	T	74.1	Confident	79.5	Confident	14 Å²	14	49.1 Å²	49.1	9%	0.086	24%	0.244	C	C	.	.	H	α-helix	trans	-60.5	-46.9	177.9	-59.1	0	0	0	0	110.5	N338 T339 L340 L344 R345 L346 N732 L735	N338-T342 WeakPolarHBondContact O-CB 3.44Å; N338-T342 PolarHBondContact O-N 2.98Å; N338-T342 PolarHBondContact O-OG1 3.36Å; T339-T342 PolarHBondContact O-N 3.42Å; L340-T342 VanDerWaalsContact C-N 3.34Å; L340-T342 PolarHBondContact O-N 3.37Å; T342-L344 PolarHBondContact O-N 3.14Å; T342-R345 PolarHBondContact O-N 2.97Å; T342-L346 HydrophobicContact CG2-CD1 3.85Å; T342-L346 HydrophobicContact CG2-CG 4.33Å; T342-L346 WeakPolarHBondContact O-CB 3.33Å; T342-L346 VanDerWaalsContact O-CG 3.24Å; T342-L346 WeakPolarHBondContact O-CG 3.39Å; T342-L346 PolarHBondContact O-N 2.92Å; T342-N732 WeakPolarHBondContact CB-OD1 3.13Å; T342-N732 HydrophobicContact CG2-CB 4.46Å; T342-N732 PolarHBondContact OG1-OD1 3.06Å; T342-L735 HydrophobicContact CG2-CD2 4.11Å
343	R	80.5	Confident	79.5	Confident	53 Å²	53	46.5 Å²	46.5	20%	0.2	25%	0.246	C	C	.	.	H	α-helix	trans	-60.1	-43.9	176.6	-78.8	-175.8	149.8	-146.1	-10.8	113.4	E270 T339 L340 Q341 N347 L735	E270-R343 IonicContact OE2-CZ 3.94Å; E270-R343 IonicContact OE2-NH1 3.42Å; E270-R343 PolarHBondContact OE2-NH1 3.29Å; E270-R343 IonicContact OE2-NH2 3.98Å; E270-R343 PolarHBondContact OE2-NH2 3.29Å; T339-R343 WeakPolarHBondContact O-CB 3.2Å; T339-R343 WeakPolarHBondContact O-CG 3.16Å; T339-R343 PolarHBondContact O-N 2.73Å; L340-R343 PolarHBondContact O-N 2.68Å; Q341-R343 PolarHBondContact O-N 2.94Å; R343-N347 PolarHBondContact O-N 2.87Å; R343-N347 PolarHBondContact O-ND2 3.47Å; R343-L735 HydrophobicContact CG-CD1 4.4Å; R343-L735 HydrophobicContact CG-CD2 3.39Å; R343-L735 HydrophobicContact CG-CG 4.47Å
344	L	78.1	Confident	79.4	Confident	9 Å²	9	46.8 Å²	46.8	5%	0.047	25%	0.248	C	C	.	.	H	α-helix	trans	-66.3	-42.8	179.3	-69.7	170.5	0	0	0	111.1	L340 Q341 T342 N347 N348 K349	L340-L344 HydrophobicContact CD1-CD1 3.94Å; L340-L344 HydrophobicContact CD1-CG 4.1Å; L340-L344 HydrophobicContact CG-CD1 4Å; L340-L344 VanDerWaalsContact O-CG 3.31Å; L340-L344 WeakPolarHBondContact O-CG 3.28Å; L340-L344 PolarHBondContact O-N 3.42Å; Q341-L344 PolarHBondContact O-N 3.45Å; T342-L344 PolarHBondContact O-N 3.14Å; L344-N347 CarbonylContact O-C 3.56Å; L344-N347 PolarHBondContact O-N 3.36Å; L344-N348 PolarHBondContact O-N 3.35Å; L344-K349 HydrophobicContact CB-CB 4.29Å; L344-K349 HydrophobicContact CD2-CB 3.89Å; L344-K349 HydrophobicContact CD2-CD 4.12Å; L344-K349 PolarHBondContact O-N 3.45Å
345	R	76.6	Confident	79.3	Confident	96 Å²	96	46.9 Å²	46.9	36%	0.362	26%	0.257	S	S	.	.	H	α-helix	trans	-60.9	-47.1	176.1	-177.9	-179.3	65.1	-174.2	6.5	112.5	Q341 T342 N347 N348 D824	Q341-R345 VanDerWaalsContact O-CB 3.3Å; Q341-R345 WeakPolarHBondContact O-CB 3.34Å; Q341-R345 PolarHBondContact O-N 3.04Å; T342-R345 PolarHBondContact O-N 2.97Å; R345-N347 PolarHBondContact O-N 3.12Å; R345-N348 PolarHBondContact O-N 3.09Å; R345-N348 VanDerWaalsContact O-N 3.11Å; R345-D824 IonicContact CZ-OD2 3.58Å; R345-D824 IonicContact NH1-OD2 2.61Å; R345-D824 PolarHBondContact NH1-OD2 3.15Å; R345-D824 VanDerWaalsContact NH1-OD2 3.13Å; R345-D824 IonicContact NH2-OD1 3.62Å; R345-D824 IonicContact NH2-OD2 2.75Å; R345-D824 PolarHBondContact NH2-OD2 3.16Å
346	L	67.9	Low	79.2	Confident	28 Å²	28	53.3 Å²	53.3	15%	0.147	29%	0.291	C	S	.	.	H	α-helix	trans	-62.9	-22.9	179.7	-70.2	170.7	0	0	0	113.1	T342 L735 T736	T342-L346 HydrophobicContact CG2-CD1 3.85Å; T342-L346 HydrophobicContact CG2-CG 4.33Å; T342-L346 WeakPolarHBondContact O-CB 3.33Å; T342-L346 VanDerWaalsContact O-CG 3.24Å; T342-L346 WeakPolarHBondContact O-CG 3.39Å; T342-L346 PolarHBondContact O-N 2.92Å; L346-L735 HydrophobicContact CD1-CD2 4.05Å; L346-L735 HydrophobicContact CD1-CG 3.99Å; L346-T736 HydrophobicContact CD2-CG2 4.05Å
347	N	69.9	Low	79.2	Confident	61 Å²	61	54.2 Å²	54.2	33%	0.326	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	18.4	178.9	-63.9	-55.8	0	0	0	112.8	M267 R343 L344 R345 K349	M267-N347 HydrophobicContact CE-CB 4.33Å; M267-N347 HydrophobicContact SD-CB 3.96Å; M267-N347 PolarHBondContact SD-ND2 2.91Å; M267-N347 PolarHBondContact SD-OD1 2.94Å; R343-N347 PolarHBondContact O-N 2.87Å; R343-N347 PolarHBondContact O-ND2 3.47Å; L344-N347 CarbonylContact O-C 3.56Å; L344-N347 PolarHBondContact O-N 3.36Å; R345-N347 PolarHBondContact O-N 3.12Å; N347-K349 HydrophobicContact CB-CG 4.31Å; N347-K349 WeakPolarHBondContact O-CG 3.4Å; N347-K349 PolarHBondContact O-N 2.99Å; N347-K349 VanDerWaalsContact O-N 3.1Å
348	N	68.3	Low	79.2	Confident	111 Å²	111	54 Å²	54	59%	0.594	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	32.6	179.8	-66.8	-34.8	0	0	0	114.1	L344 R345 E837	L344-N348 PolarHBondContact O-N 3.35Å; R345-N348 PolarHBondContact O-N 3.09Å; R345-N348 VanDerWaalsContact O-N 3.11Å; N348-E837 PolarHBondContact ND2-OE1 3.45Å
349	K	69.4	Low	79.6	Confident	38 Å²	38	54.5 Å²	54.5	17%	0.165	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-96.4	156.1	176.6	-61.3	-161.3	-179	-159.9	0	111.4	L344 N347 I900	L344-K349 HydrophobicContact CB-CB 4.29Å; L344-K349 HydrophobicContact CD2-CB 3.89Å; L344-K349 HydrophobicContact CD2-CD 4.12Å; L344-K349 PolarHBondContact O-N 3.45Å; N347-K349 HydrophobicContact CB-CG 4.31Å; N347-K349 WeakPolarHBondContact O-CG 3.4Å; N347-K349 PolarHBondContact O-N 2.99Å; N347-K349 VanDerWaalsContact O-N 3.1Å; K349-I900 WeakPolarHBondContact CE-O 3.4Å; K349-I900 PolarHBondContact NZ-O 3.23Å
350	S	72.7	Confident	79.8	Confident	82 Å²	82	55 Å²	55	57%	0.573	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-55.6	141.5	172.5	-61.1	0	0	0	0	111.3
351	P	77.8	Confident	80.1	Confident	87 Å²	87	59.6 Å²	59.6	57%	0.565	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-64.3	144.9	177.8	26.9	-34.3	0	0	0	111.1
352	Y	84.2	Confident	80.5	Confident	20 Å²	20	60 Å²	60	8%	0.078	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-69	132.6	176	173.5	-111.4	0	0	0	110.4	E275 Y278 E279 Y337 L340 Q341 P354	E275-Y352 HydrophobicContact CB-CE2 4.19Å; E275-Y352 HydrophobicContact CG-CD2 3.72Å; E275-Y352 HydrophobicContact CG-CE2 3.78Å; E275-Y352 HydrophobicContact CG-CG 4.38Å; Y278-Y352 AromaticContact CD1-CE1 3.71Å; Y278-Y352 HydrophobicContact CD1-CE1 3.71Å; Y278-Y352 HydrophobicContact CE1-CE1 4.15Å; Y278-Y352 HydrophobicContact CG-CE1 4.12Å; E279-Y352 WeakPolarHBondContact CG-OH 3.27Å; E279-Y352 PolarHBondContact OE1-OH 3.37Å; Y337-Y352 HydrophobicContact CD2-CD1 4.17Å; Y337-Y352 HydrophobicContact CE2-CD1 4.17Å; L340-Y352 HydrophobicContact CD2-CD1 3.54Å; L340-Y352 HydrophobicContact CD2-CD2 4.17Å; L340-Y352 HydrophobicContact CD2-CE1 4.14Å; L340-Y352 HydrophobicContact CD2-CG 3.56Å; L340-Y352 HydrophobicContact CG-CG 4.45Å; Q341-Y352 PolarHBondContact NE2-O 3.44Å; Y352-P354 HydrophobicContact CD1-CG 4.18Å; Y352-P354 HydrophobicContact CE1-CB 4.32Å; Y352-P354 HydrophobicContact CE1-CG 3.69Å
353	V	86.2	Confident	81.3	Confident	111 Å²	111	59.4 Å²	59.4	67%	0.673	34%	0.335	S	S	*	.			trans	-122.1	109.7	176.8	-177	0	0	0	0	108.2
354	P	87	Confident	81.8	Confident	7 Å²	7	58.9 Å²	58.9	5%	0.045	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-57.9	159.8	175.5	-25.5	33	0	0	0	113.6	Y278 Y337 Y352 H358 L359	Y278-P354 HydrophobicContact CD1-CG 4.35Å; Y278-P354 HydrophobicContact CE1-CB 3.71Å; Y278-P354 HydrophobicContact CE1-CG 3.5Å; Y278-P354 VanDerWaalsContact CE1-CG 3.5Å; Y337-P354 HydrophobicContact CD2-CG 4.47Å; Y337-P354 HydrophobicContact CE2-CG 4.08Å; Y352-P354 HydrophobicContact CD1-CG 4.18Å; Y352-P354 HydrophobicContact CE1-CB 4.32Å; Y352-P354 HydrophobicContact CE1-CG 3.69Å; P354-H358 HydrophobicContact CB-CB 4.18Å; P354-H358 WeakPolarHBondContact CB-O 3.4Å; P354-L359 HydrophobicContact CB-CD2 4.39Å; P354-L359 HydrophobicContact CG-CD2 4.25Å
355	A	85.1	Confident	82.4	Confident	52 Å²	52	65.6 Å²	65.6	43%	0.43	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-56.5	152.6	169.1	0	0	0	0	0	112.2	G357 H358	A355-G357 PolarHBondContact O-N 3.09Å; A355-H358 WeakPolarHBondContact O-CB 3.39Å; A355-H358 PolarHBondContact O-N 3.45Å
356	N	81.5	Confident	83.2	Confident	163 Å²	163	63 Å²	63	87%	0.872	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	129.8	178	-69.7	-34.7	0	0	0	111.3	H358	N356-H358 VanDerWaalsContact C-N 3.31Å
357	G	85.1	Confident	84.5	Confident	35 Å²	35	62.2 Å²	62.2	36%	0.361	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	-8.6	-176.2	0	0	0	0	0	114.5	L286 A355 D362	L286-G357 WeakPolarHBondContact CD1-O 3.47Å; A355-G357 PolarHBondContact O-N 3.09Å; G357-D362 VanDerWaalsContact C-OD2 3.3Å; G357-D362 WeakPolarHBondContact CA-OD2 3.28Å; G357-D362 PolarHBondContact N-OD2 3.28Å; G357-D362 WeakPolarHBondContact O-CB 3.47Å
358	H	89.2	Confident	85.6	Confident	49 Å²	49	62.6 Å²	62.6	23%	0.227	37%	0.367	C	S	.	.			trans	-107.8	15.3	177.9	-66.9	-113.4	0	0	0	112.3	Y278 S282 T283 P354 A355 N356	Y278-H358 WeakPolarHBondContact CE1-O 3.43Å; Y278-H358 PolarHBondContact OH-O 3.04Å; S282-H358 PolarHBondContact OG-ND1 3.25Å; S282-H358 VanDerWaalsContact OG-ND1 3.08Å; T283-H358 PolarHBondContact OG1-CE1 3.43Å; T283-H358 VanDerWaalsContact OG1-CE1 3.26Å; P354-H358 HydrophobicContact CB-CB 4.18Å; P354-H358 WeakPolarHBondContact CB-O 3.4Å; A355-H358 WeakPolarHBondContact O-CB 3.39Å; A355-H358 PolarHBondContact O-N 3.45Å; N356-H358 VanDerWaalsContact C-N 3.31Å
359	L	88.2	Confident	86.9	Confident	63 Å²	63	59.6 Å²	59.6	33%	0.33	36%	0.355	S	S	.	.	S	Bend	trans	-67.7	150.1	172.3	-63.3	167.9	0	0	0	109.7	P354 T361 D362 V363	P354-L359 HydrophobicContact CB-CD2 4.39Å; P354-L359 HydrophobicContact CG-CD2 4.25Å; L359-T361 WeakPolarHBondContact CB-OG1 3.44Å; L359-T361 PolarHBondContact O-N 3.12Å; L359-T361 VanDerWaalsContact O-N 3.14Å; L359-D362 HydrophobicContact CB-CB 4.44Å; L359-D362 WeakPolarHBondContact CB-OD2 3.42Å; L359-D362 PolarHBondContact N-OD2 3.27Å; L359-D362 WeakPolarHBondContact O-CA 3.5Å; L359-D362 WeakPolarHBondContact O-CB 3.4Å; L359-D362 PolarHBondContact O-N 3.42Å; L359-V363 PolarHBondContact O-N 2.95Å
360	I	88.7	Confident	88.1	Confident	39 Å²	39	57.8 Å²	57.8	20%	0.2	35%	0.347	C	S	.	.	H	α-helix	trans	-52.8	-38.5	173.9	-68.3	-179	0	0	0	111	Y278 E334 Y337 D362 V363 A364	Y278-I360 HydrophobicContact CE2-CG1 4.23Å; Y278-I360 PolarHBondContact OH-N 2.82Å; E334-I360 HydrophobicContact CG-CD1 4.49Å; E334-I360 HydrophobicContact CG-CG2 4.05Å; Y337-I360 HydrophobicContact CD1-CD1 3.21Å; Y337-I360 HydrophobicContact CD1-CG1 4.33Å; Y337-I360 HydrophobicContact CD2-CD1 4.17Å; Y337-I360 HydrophobicContact CE1-CD1 3.81Å; Y337-I360 HydrophobicContact CG-CD1 3.41Å; Y337-I360 VanDerWaalsContact CG-CD1 3.41Å; Y337-I360 HydrophobicContact CG-CG1 4.23Å; I360-D362 VanDerWaalsContact C-N 3.32Å; I360-D362 PolarHBondContact O-N 3.46Å; I360-V363 PolarHBondContact O-N 3.01Å; I360-A364 WeakPolarHBondContact O-CB 3.21Å; I360-A364 PolarHBondContact O-N 2.9Å
361	T	89.5	Confident	89.1	Confident	98 Å²	98	58 Å²	58	60%	0.601	34%	0.339	S	S	*	.	H	α-helix	trans	-63.6	-36.7	176.7	51.7	0	0	0	0	112.8	L359 K365	L359-T361 WeakPolarHBondContact CB-OG1 3.44Å; L359-T361 PolarHBondContact O-N 3.12Å; L359-T361 VanDerWaalsContact O-N 3.14Å; T361-K365 WeakPolarHBondContact O-CB 3.35Å; T361-K365 PolarHBondContact O-N 3.41Å
362	D	90.3	Very high	89.8	Confident	43 Å²	43	60 Å²	60	23%	0.23	34%	0.34	C	S	.	.	H	α-helix	trans	-69.8	-42.3	177.1	-63.4	-36.3	0	0	0	110.5	G357 L359 I360 K365 N366	G357-D362 VanDerWaalsContact C-OD2 3.3Å; G357-D362 WeakPolarHBondContact CA-OD2 3.28Å; G357-D362 PolarHBondContact N-OD2 3.28Å; G357-D362 WeakPolarHBondContact O-CB 3.47Å; L359-D362 HydrophobicContact CB-CB 4.44Å; L359-D362 WeakPolarHBondContact CB-OD2 3.42Å; L359-D362 PolarHBondContact N-OD2 3.27Å; L359-D362 WeakPolarHBondContact O-CA 3.5Å; L359-D362 WeakPolarHBondContact O-CB 3.4Å; L359-D362 PolarHBondContact O-N 3.42Å; I360-D362 VanDerWaalsContact C-N 3.32Å; I360-D362 PolarHBondContact O-N 3.46Å; D362-K365 PolarHBondContact O-N 3.27Å; D362-N366 PolarHBondContact O-N 2.96Å; D362-N366 PolarHBondContact O-ND2 3.01Å
363	V	90.7	Very high	90.3	Very high	3 Å²	3	60 Å²	60	2%	0.018	35%	0.345	C	S	.	.	H	α-helix	trans	-61.9	-46.3	175.1	177.7	0	0	0	0	110.8	L285 L286 K330 L333 L359 I360 K365 N366 W367	L285-V363 HydrophobicContact CD2-CG1 3.73Å; L286-V363 HydrophobicContact CD1-CG2 4.26Å; L286-V363 HydrophobicContact CD2-CG2 4.1Å; L286-V363 HydrophobicContact CG-CG2 4.16Å; K330-V363 HydrophobicContact CG-CG1 4.46Å; L333-V363 HydrophobicContact CD2-CB 4.38Å; L333-V363 HydrophobicContact CD2-CG1 4.13Å; L333-V363 HydrophobicContact CD2-CG2 3.86Å; L359-V363 PolarHBondContact O-N 2.95Å; I360-V363 PolarHBondContact O-N 3.01Å; V363-K365 VanDerWaalsContact C-N 3.34Å; V363-K365 PolarHBondContact O-N 2.97Å; V363-N366 PolarHBondContact O-N 3.36Å; V363-W367 WeakPolarHBondContact O-CB 3.33Å; V363-W367 PolarHBondContact O-N 3.36Å
364	A	90.5	Very high	90.6	Very high	42 Å²	42	54.9 Å²	54.9	35%	0.347	31%	0.314	S	S	.	.	H	α-helix	trans	-60.6	-41.7	177.1	0	0	0	0	0	112.2	I360 W367 S368	I360-A364 WeakPolarHBondContact O-CB 3.21Å; I360-A364 PolarHBondContact O-N 2.9Å; A364-W367 PolarHBondContact O-N 3.09Å; A364-S368 PolarHBondContact O-N 2.87Å
365	K	92.2	Very high	90.8	Very high	150 Å²	150	60.3 Å²	60.3	65%	0.652	34%	0.337	S	S	*	.	H	α-helix	trans	-63.3	-46.8	175.6	-178	-176.8	176.3	-175.4	0	112.1	T361 D362 V363 W367 S368 S369	T361-K365 WeakPolarHBondContact O-CB 3.35Å; T361-K365 PolarHBondContact O-N 3.41Å; D362-K365 PolarHBondContact O-N 3.27Å; V363-K365 VanDerWaalsContact C-N 3.34Å; V363-K365 PolarHBondContact O-N 2.97Å; K365-W367 VanDerWaalsContact C-N 3.31Å; K365-W367 PolarHBondContact O-N 3.22Å; K365-S368 PolarHBondContact O-N 3.48Å; K365-S369 PolarHBondContact O-N 3.29Å; K365-S369 VanDerWaalsContact O-N 3.1Å; K365-S369 PolarHBondContact O-OG 3.43Å
366	N	93.7	Very high	91.2	Very high	41 Å²	41	60.9 Å²	60.9	22%	0.219	33%	0.332	C	S	.	.	H	α-helix	trans	-64.2	-37.8	177.9	-80	-78.7	0	0	0	111.8	L286 I289 D362 V363 S369 L370	L286-N366 HydrophobicContact CD2-CB 4.06Å; I289-N366 HydrophobicContact CD1-CB 4.24Å; I289-N366 HydrophobicContact CG2-CB 4.03Å; D362-N366 PolarHBondContact O-N 2.96Å; D362-N366 PolarHBondContact O-ND2 3.01Å; V363-N366 PolarHBondContact O-N 3.36Å; N366-S369 WeakPolarHBondContact O-CB 3.44Å; N366-S369 PolarHBondContact O-N 2.95Å; N366-L370 PolarHBondContact O-N 3.41Å
367	W	94.5	Very high	91.8	Very high	11 Å²	11	53.9 Å²	53.9	4%	0.042	29%	0.293	C	S	.	.	H	α-helix	trans	-62.2	-44.2	174.4	-171.6	-87.4	0	0	0	112.2	L285 W288 I289 K323 K326 L327 K330 V363 A364 K365 S369 L370 E371	L285-W367 HydrophobicContact CD1-CZ3 4.16Å; W288-W367 HydrophobicContact CZ3-CH2 4.48Å; W288-W367 AromaticContact CZ3-CZ3 3.97Å; W288-W367 HydrophobicContact CZ3-CZ3 3.97Å; I289-W367 HydrophobicContact CD1-CE3 4.11Å; I289-W367 HydrophobicContact CG1-CE3 4.39Å; K323-W367 HydrophobicContact CG-CH2 4.48Å; K326-W367 HydrophobicContact CB-CH2 4.2Å; K326-W367 HydrophobicContact CB-CZ3 4.15Å; L327-W367 HydrophobicContact CB-CH2 4.01Å; L327-W367 HydrophobicContact CB-CZ2 4Å; L327-W367 HydrophobicContact CD1-CH2 4.39Å; L327-W367 HydrophobicContact CD1-CZ2 3.71Å; L327-W367 HydrophobicContact CG-CZ2 4.43Å; K330-W367 HydrophobicContact CD-CB 4.29Å; K330-W367 HydrophobicContact CD-CD2 3.72Å; K330-W367 HydrophobicContact CD-CE3 4.01Å; K330-W367 HydrophobicContact CD-CG 3.82Å; V363-W367 WeakPolarHBondContact O-CB 3.33Å; V363-W367 PolarHBondContact O-N 3.36Å; A364-W367 PolarHBondContact O-N 3.09Å; K365-W367 VanDerWaalsContact C-N 3.31Å; K365-W367 PolarHBondContact O-N 3.22Å; W367-S369 VanDerWaalsContact C-N 3.34Å; W367-S369 PolarHBondContact O-N 3.46Å; W367-L370 HydrophobicContact CE3-CD2 4.47Å; W367-L370 HydrophobicContact CZ3-CD2 4.48Å; W367-L370 VanDerWaalsContact O-CB 3.3Å; W367-L370 WeakPolarHBondContact O-CB 3.39Å; W367-L370 PolarHBondContact O-N 3.23Å; W367-L370 VanDerWaalsContact O-N 3.08Å; W367-E371 PolarHBondContact NE1-OE1 2.95Å; W367-E371 PolarHBondContact O-N 2.92Å
368	S	93.5	Very high	92.1	Very high	69 Å²	69	56.2 Å²	56.2	48%	0.483	30%	0.295	S	S	.	.	H	α-helix	trans	-62.8	-38.6	175.2	-177.4	0	0	0	0	112.6	A364 K365 L370 E371 Q372	A364-S368 PolarHBondContact O-N 2.87Å; K365-S368 PolarHBondContact O-N 3.48Å; S368-L370 VanDerWaalsContact C-N 3.28Å; S368-L370 PolarHBondContact O-N 2.99Å; S368-E371 PolarHBondContact O-N 3.33Å; S368-Q372 PolarHBondContact O-N 3.48Å
369	S	94.5	Very high	92.2	Very high	49 Å²	49	58.3 Å²	58.3	34%	0.343	31%	0.305	S	S	.	.	H	α-helix	trans	-61.4	-36.1	172.3	-60.4	0	0	0	0	112.5	K365 N366 W367 Q372 A373	K365-S369 PolarHBondContact O-N 3.29Å; K365-S369 VanDerWaalsContact O-N 3.1Å; K365-S369 PolarHBondContact O-OG 3.43Å; N366-S369 WeakPolarHBondContact O-CB 3.44Å; N366-S369 PolarHBondContact O-N 2.95Å; W367-S369 VanDerWaalsContact C-N 3.34Å; W367-S369 PolarHBondContact O-N 3.46Å; S369-Q372 PolarHBondContact O-N 2.98Å; S369-A373 WeakPolarHBondContact O-CB 3.41Å; S369-A373 PolarHBondContact O-N 3.34Å
370	L	95.6	Very high	92.5	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-65.7	-45.5	175.5	179.3	66.4	0	0	0	111.5	W288 I289 K292 L293 F296 N366 W367 S368 Q372 A373 D374	W288-L370 HydrophobicContact CE3-CD2 4.37Å; W288-L370 HydrophobicContact CH2-CD2 3.88Å; W288-L370 HydrophobicContact CZ3-CD2 3.44Å; W288-L370 VanDerWaalsContact CZ3-CD2 3.44Å; I289-L370 HydrophobicContact CG1-CD2 4.25Å; I289-L370 HydrophobicContact CG2-CB 4.19Å; K292-L370 HydrophobicContact CB-CD1 3.62Å; L293-L370 HydrophobicContact CD2-CB 4.46Å; L293-L370 HydrophobicContact CD2-CD1 4.47Å; F296-L370 HydrophobicContact CD2-CD1 4.03Å; F296-L370 HydrophobicContact CE2-CD1 3.82Å; N366-L370 PolarHBondContact O-N 3.41Å; W367-L370 HydrophobicContact CE3-CD2 4.47Å; W367-L370 HydrophobicContact CZ3-CD2 4.48Å; W367-L370 VanDerWaalsContact O-CB 3.3Å; W367-L370 WeakPolarHBondContact O-CB 3.39Å; W367-L370 PolarHBondContact O-N 3.23Å; W367-L370 VanDerWaalsContact O-N 3.08Å; S368-L370 VanDerWaalsContact C-N 3.28Å; S368-L370 PolarHBondContact O-N 2.99Å; L370-Q372 PolarHBondContact O-N 3.39Å; L370-A373 PolarHBondContact O-N 2.98Å; L370-A373 VanDerWaalsContact O-N 3.13Å; L370-D374 VanDerWaalsContact O-CG 3.27Å; L370-D374 PolarHBondContact O-N 3.46Å
371	E	92.2	Very high	92.7	Very high	86 Å²	86	55.1 Å²	55.1	40%	0.402	29%	0.286	S	S	.	.	H	α-helix	trans	-64.6	-24.4	175.9	-69	175.8	160.1	0	0	113.4	W367 S368 D374	W367-E371 PolarHBondContact NE1-OE1 2.95Å; W367-E371 PolarHBondContact O-N 2.92Å; S368-E371 PolarHBondContact O-N 3.33Å; E371-D374 VanDerWaalsContact CA-OD1 3.32Å; E371-D374 WeakPolarHBondContact CA-OD1 3.48Å
372	Q	93.4	Very high	92.7	Very high	128 Å²	128	54.5 Å²	54.5	60%	0.598	28%	0.279	S	S	*	.	H	α-helix	trans	-79	-42.1	171.1	-171.4	176	17.9	0	0	111.1	S368 S369 L370 I376	S368-Q372 PolarHBondContact O-N 3.48Å; S369-Q372 PolarHBondContact O-N 2.98Å; L370-Q372 PolarHBondContact O-N 3.39Å; Q372-I376 HydrophobicContact CG-CD1 4Å; Q372-I376 WeakPolarHBondContact O-CD1 3.49Å; Q372-I376 VanDerWaalsContact O-CG1 3.28Å; Q372-I376 WeakPolarHBondContact O-CG1 3.45Å; Q372-I376 PolarHBondContact O-N 2.98Å; Q372-I376 VanDerWaalsContact O-N 3.14Å
373	A	94.7	Very high	92.7	Very high	21 Å²	21	58.6 Å²	58.6	17%	0.174	30%	0.297	C	S	.	.	H	α-helix	trans	-67.7	-40.8	-178.2	0	0	0	0	0	112.4	L293 F296 S369 L370 I376 Y377	L293-A373 HydrophobicContact CD2-CB 3.65Å; F296-A373 HydrophobicContact CB-CB 4.21Å; F296-A373 HydrophobicContact CD2-CB 4.34Å; S369-A373 WeakPolarHBondContact O-CB 3.41Å; S369-A373 PolarHBondContact O-N 3.34Å; L370-A373 PolarHBondContact O-N 2.98Å; L370-A373 VanDerWaalsContact O-N 3.13Å; A373-I376 PolarHBondContact O-N 3.23Å; A373-Y377 WeakPolarHBondContact O-CB 3.45Å; A373-Y377 PolarHBondContact O-N 3.43Å
374	D	93	Very high	92.7	Very high	3 Å²	3	59.1 Å²	59.1	2%	0.016	30%	0.299	C	S	.	.	H	α-helix	trans	-65.6	-40.2	178.2	62.9	19.9	0	0	0	111.9	F296 F315 Y318 Y319 K323 L370 E371 Y377 E378	F296-D374 HydrophobicContact CD2-CB 4.04Å; F296-D374 HydrophobicContact CE2-CB 3.7Å; F296-D374 HydrophobicContact CZ-CB 4.28Å; F315-D374 HydrophobicContact CE2-CB 4.33Å; F315-D374 HydrophobicContact CZ-CB 4.47Å; F315-D374 WeakPolarHBondContact CZ-O 3.44Å; Y318-D374 HydrophobicContact CE1-CB 4.27Å; Y319-D374 HydrophobicContact CE2-CB 4.4Å; Y319-D374 PolarHBondContact OH-OD1 3.31Å; Y319-D374 PolarHBondContact OH-OD2 2.86Å; K323-D374 IonicContact NZ-OD2 2.62Å; K323-D374 PolarHBondContact NZ-OD2 3.3Å; L370-D374 VanDerWaalsContact O-CG 3.27Å; L370-D374 PolarHBondContact O-N 3.46Å; E371-D374 VanDerWaalsContact CA-OD1 3.32Å; E371-D374 WeakPolarHBondContact CA-OD1 3.48Å; D374-Y377 WeakPolarHBondContact O-CB 3.44Å; D374-Y377 PolarHBondContact O-N 3.43Å; D374-E378 PolarHBondContact O-N 2.83Å
375	K	90.2	Very high	92.7	Very high	122 Å²	122	58.4 Å²	58.4	53%	0.53	29%	0.289	S	S	.	.	H	α-helix	trans	-61.2	-47.4	174.2	-178.9	177.8	176.4	-179.7	0	111.9	Y377 E378 E379	K375-Y377 PolarHBondContact O-N 3.25Å; K375-E378 PolarHBondContact O-N 3.5Å; K375-E379 WeakPolarHBondContact CE-OE1 3.23Å; K375-E379 WeakPolarHBondContact O-CG 3.48Å; K375-E379 PolarHBondContact O-N 2.92Å
376	I	93.2	Very high	92.5	Very high	64 Å²	64	57.5 Å²	57.5	33%	0.328	29%	0.287	S	S	.	.	H	α-helix	trans	-62.5	-35.3	177	-69.1	168	0	0	0	110.9	R299 Q372 A373 W380	R299-I376 VanDerWaalsContact NH1-CG2 3.26Å; Q372-I376 HydrophobicContact CG-CD1 4Å; Q372-I376 WeakPolarHBondContact O-CD1 3.49Å; Q372-I376 VanDerWaalsContact O-CG1 3.28Å; Q372-I376 WeakPolarHBondContact O-CG1 3.45Å; Q372-I376 PolarHBondContact O-N 2.98Å; Q372-I376 VanDerWaalsContact O-N 3.14Å; A373-I376 PolarHBondContact O-N 3.23Å; I376-W380 WeakPolarHBondContact O-CB 3.48Å; I376-W380 PolarHBondContact O-N 3.28Å
377	Y	95.1	Very high	92.4	Very high	15 Å²	15	58.2 Å²	58.2	6%	0.059	29%	0.287	C	S	.	.	H	α-helix	trans	-70.9	-39.9	177.5	-172.4	-100.4	0	0	0	112.2	F296 R299 F315 A373 D374 K375 W380 L381	F296-Y377 HydrophobicContact CB-CD2 4.21Å; F296-Y377 HydrophobicContact CB-CG 4.2Å; F296-Y377 AromaticContact CD1-CD1 3.68Å; F296-Y377 HydrophobicContact CD1-CD1 3.68Å; F296-Y377 HydrophobicContact CD1-CD2 4.06Å; F296-Y377 HydrophobicContact CD1-CE1 4.06Å; F296-Y377 HydrophobicContact CD1-CE2 4.44Å; F296-Y377 AromaticContact CD1-CG 3.65Å; F296-Y377 HydrophobicContact CD1-CG 3.65Å; F296-Y377 HydrophobicContact CE1-CD1 4.02Å; F296-Y377 HydrophobicContact CE1-CE1 4.28Å; F296-Y377 HydrophobicContact CE1-CG 4.43Å; F296-Y377 HydrophobicContact CG-CG 4.21Å; R299-Y377 HydrophobicContact CG-CD2 4.15Å; R299-Y377 HydrophobicContact CG-CE2 4.5Å; F315-Y377 AromaticContact CD2-CD1 3.52Å; F315-Y377 HydrophobicContact CD2-CD1 3.52Å; F315-Y377 AromaticContact CD2-CE1 3.76Å; F315-Y377 HydrophobicContact CD2-CE1 3.76Å; F315-Y377 AromaticContact CE2-CD1 3.49Å; F315-Y377 HydrophobicContact CE2-CD1 3.49Å; F315-Y377 VanDerWaalsContact CE2-CD1 3.49Å; F315-Y377 HydrophobicContact CE2-CE1 4.22Å; F315-Y377 HydrophobicContact CE2-CG 4.44Å; F315-Y377 HydrophobicContact CG-CD1 4.31Å; F315-Y377 HydrophobicContact CG-CE1 4.35Å; F315-Y377 HydrophobicContact CZ-CD1 4.23Å; A373-Y377 WeakPolarHBondContact O-CB 3.45Å; A373-Y377 PolarHBondContact O-N 3.43Å; D374-Y377 WeakPolarHBondContact O-CB 3.44Å; D374-Y377 PolarHBondContact O-N 3.43Å; K375-Y377 PolarHBondContact O-N 3.25Å; Y377-W380 HydrophobicContact CD2-CE3 4.07Å; Y377-W380 HydrophobicContact CD2-CZ3 4.47Å; Y377-W380 AromaticContact CE2-CE3 3.85Å; Y377-W380 HydrophobicContact CE2-CE3 3.85Å; Y377-W380 AromaticContact CE2-CZ3 3.79Å; Y377-W380 HydrophobicContact CE2-CZ3 3.79Å; Y377-W380 PolarHBondContact O-N 3.32Å; Y377-L381 HydrophobicContact CD1-CD1 3.8Å; Y377-L381 HydrophobicContact CD1-CG 4.22Å; Y377-L381 HydrophobicContact CE1-CD1 3.53Å; Y377-L381 HydrophobicContact CE1-CD2 4.36Å; Y377-L381 HydrophobicContact CE1-CG 3.97Å; Y377-L381 WeakPolarHBondContact O-CG 3.49Å; Y377-L381 PolarHBondContact O-N 3.2Å
378	E	92.2	Very high	92.3	Very high	84 Å²	84	58 Å²	58	39%	0.393	29%	0.287	S	S	.	.	H	α-helix	trans	-60.4	-48.2	172.7	-171.2	171.4	-162.1	0	0	111.7	F315 D374 K375 W380 L381 L382	F315-E378 HydrophobicContact CE1-CB 3.64Å; F315-E378 HydrophobicContact CE1-CG 3.79Å; F315-E378 HydrophobicContact CZ-CB 3.69Å; F315-E378 HydrophobicContact CZ-CG 4.35Å; D374-E378 PolarHBondContact O-N 2.83Å; K375-E378 PolarHBondContact O-N 3.5Å; E378-W380 VanDerWaalsContact C-N 3.33Å; E378-W380 PolarHBondContact O-N 3.14Å; E378-L381 PolarHBondContact O-N 3.09Å; E378-L382 WeakPolarHBondContact O-CG 3.45Å; E378-L382 PolarHBondContact O-N 3.12Å; E378-L382 VanDerWaalsContact O-N 3.09Å
379	E	90.7	Very high	92	Very high	94 Å²	94	59 Å²	59	44%	0.439	28%	0.284	S	S	.	.	H	α-helix	trans	-57.2	-46.7	175.6	-72.6	171.5	-176.8	0	0	110.8	K375 L381 L382 E383	K375-E379 WeakPolarHBondContact CE-OE1 3.23Å; K375-E379 WeakPolarHBondContact O-CG 3.48Å; K375-E379 PolarHBondContact O-N 2.92Å; E379-L381 PolarHBondContact O-N 3.23Å; E379-L382 PolarHBondContact O-N 3.12Å; E379-E383 WeakPolarHBondContact O-CG 3.47Å; E379-E383 PolarHBondContact O-N 3.08Å
380	W	94.6	Very high	91.8	Very high	31 Å²	31	63.1 Å²	63.1	12%	0.117	29%	0.291	C	S	.	.	H	α-helix	trans	-61.4	-42.2	176.6	173	75.3	0	0	0	113	R299 D300 L311 I376 Y377 E378 L382 E383 E384	R299-W380 VanDerWaalsContact C-CZ2 3.48Å; R299-W380 HydrophobicContact CB-CD2 3.82Å; R299-W380 HydrophobicContact CB-CE3 4.39Å; R299-W380 HydrophobicContact CB-CG 4.08Å; R299-W380 HydrophobicContact CB-CZ2 4.08Å; R299-W380 HydrophobicContact CG-CB 4.47Å; R299-W380 HydrophobicContact CG-CD2 3.73Å; R299-W380 HydrophobicContact CG-CE3 4.02Å; R299-W380 HydrophobicContact CG-CG 3.9Å; D300-W380 WeakPolarHBondContact O-CZ2 3.28Å; L311-W380 HydrophobicContact CD1-CH2 4.13Å; L311-W380 HydrophobicContact CD1-CZ3 4.19Å; I376-W380 WeakPolarHBondContact O-CB 3.48Å; I376-W380 PolarHBondContact O-N 3.28Å; Y377-W380 HydrophobicContact CD2-CE3 4.07Å; Y377-W380 HydrophobicContact CD2-CZ3 4.47Å; Y377-W380 AromaticContact CE2-CE3 3.85Å; Y377-W380 HydrophobicContact CE2-CE3 3.85Å; Y377-W380 AromaticContact CE2-CZ3 3.79Å; Y377-W380 HydrophobicContact CE2-CZ3 3.79Å; Y377-W380 PolarHBondContact O-N 3.32Å; E378-W380 VanDerWaalsContact C-N 3.33Å; E378-W380 PolarHBondContact O-N 3.14Å; W380-L382 VanDerWaalsContact C-N 3.3Å; W380-L382 PolarHBondContact O-N 3.44Å; W380-E383 PolarHBondContact O-N 3.06Å; W380-E384 HydrophobicContact CZ2-CG 4.35Å; W380-E384 VanDerWaalsContact O-CB 3.23Å; W380-E384 WeakPolarHBondContact O-CB 3.44Å; W380-E384 PolarHBondContact O-N 2.92Å
381	L	92.4	Very high	91.5	Very high	3 Å²	3	63.6 Å²	63.6	2%	0.016	29%	0.294	C	S	.	.	H	α-helix	trans	-60.7	-40.1	177.3	-77.6	173.6	0	0	0	111.9	V308 L311 Q312 F315 Y377 E378 E379 L385	V308-L381 HydrophobicContact CG1-CD2 4.2Å; L311-L381 HydrophobicContact CB-CD2 3.65Å; L311-L381 HydrophobicContact CD1-CD2 4.19Å; Q312-L381 HydrophobicContact CG-CB 4.31Å; Q312-L381 HydrophobicContact CG-CD1 4.21Å; Q312-L381 HydrophobicContact CG-CD2 4.5Å; F315-L381 HydrophobicContact CB-CD1 3.99Å; F315-L381 HydrophobicContact CD1-CD1 4.19Å; F315-L381 HydrophobicContact CG-CD1 4Å; Y377-L381 HydrophobicContact CD1-CD1 3.8Å; Y377-L381 HydrophobicContact CD1-CG 4.22Å; Y377-L381 HydrophobicContact CE1-CD1 3.53Å; Y377-L381 HydrophobicContact CE1-CD2 4.36Å; Y377-L381 HydrophobicContact CE1-CG 3.97Å; Y377-L381 WeakPolarHBondContact O-CG 3.49Å; Y377-L381 PolarHBondContact O-N 3.2Å; E378-L381 PolarHBondContact O-N 3.09Å; E379-L381 PolarHBondContact O-N 3.23Å; L381-L385 WeakPolarHBondContact O-CB 3.43Å; L381-L385 PolarHBondContact O-N 3.42Å
382	L	89.4	Confident	91.4	Very high	86 Å²	86	64.9 Å²	64.9	45%	0.45	30%	0.3	S	S	.	.	H	α-helix	trans	-70.3	-45.2	178.4	-67.9	172.9	0	0	0	111.7	E378 E379 W380 E384 L385 Q386	E378-L382 WeakPolarHBondContact O-CG 3.45Å; E378-L382 PolarHBondContact O-N 3.12Å; E378-L382 VanDerWaalsContact O-N 3.09Å; E379-L382 PolarHBondContact O-N 3.12Å; W380-L382 VanDerWaalsContact C-N 3.3Å; W380-L382 PolarHBondContact O-N 3.44Å; L382-E384 VanDerWaalsContact C-N 3.31Å; L382-E384 PolarHBondContact O-N 2.96Å; L382-L385 PolarHBondContact O-N 3.37Å; L382-Q386 WeakPolarHBondContact O-CG 3.18Å; L382-Q386 PolarHBondContact O-N 2.66Å
383	E	90	Very high	91.1	Very high	129 Å²	129	65.4 Å²	65.4	60%	0.603	30%	0.297	S	S	*	.	H	α-helix	trans	-60.8	-41.2	175.9	-73.3	-178.2	172.1	0	0	111.7	E379 W380 Q386 R387	E379-E383 WeakPolarHBondContact O-CG 3.47Å; E379-E383 PolarHBondContact O-N 3.08Å; W380-E383 PolarHBondContact O-N 3.06Å; E383-Q386 PolarHBondContact O-N 3.32Å; E383-R387 WeakPolarHBondContact O-CB 3.3Å; E383-R387 PolarHBondContact O-N 3.34Å
384	E	91.9	Very high	91	Very high	13 Å²	13	64.6 Å²	64.6	6%	0.061	29%	0.29	C	S	.	.	H	α-helix	trans	-70.1	-37.7	180	-174	64.1	179.2	0	0	112.1	Q302 V308 W380 L382 R387 L388	Q302-E384 HydrophobicContact CB-CG 4.42Å; Q302-E384 PolarHBondContact N-OE1 2.95Å; V308-E384 HydrophobicContact CG2-CG 3.8Å; W380-E384 HydrophobicContact CZ2-CG 4.35Å; W380-E384 VanDerWaalsContact O-CB 3.23Å; W380-E384 WeakPolarHBondContact O-CB 3.44Å; W380-E384 PolarHBondContact O-N 2.92Å; L382-E384 VanDerWaalsContact C-N 3.31Å; L382-E384 PolarHBondContact O-N 2.96Å; E384-R387 PolarHBondContact O-N 3.2Å; E384-R387 IonicContact OE1-CZ 3.26Å; E384-R387 IonicContact OE1-NE 2.65Å; E384-R387 PolarHBondContact OE1-NE 3.28Å; E384-R387 IonicContact OE1-NH2 2.89Å; E384-R387 PolarHBondContact OE1-NH2 3.36Å; E384-R387 IonicContact OE2-CZ 3.48Å; E384-R387 IonicContact OE2-NE 3.14Å; E384-R387 PolarHBondContact OE2-NE 3.14Å; E384-R387 IonicContact OE2-NH2 2.75Å; E384-L388 HydrophobicContact CG-CD1 4.34Å; E384-L388 WeakPolarHBondContact O-CG 3.35Å; E384-L388 PolarHBondContact O-N 3.43Å
385	L	89.4	Confident	90.9	Very high	28 Å²	28	65.5 Å²	65.5	15%	0.147	30%	0.298	C	S	.	.	H	α-helix	trans	-60.3	-49.5	172.2	-170.3	73.1	0	0	0	110.7	V305 V308 L381 L382 R387 L388 E389	V305-L385 HydrophobicContact CG1-CD1 3.81Å; V308-L385 HydrophobicContact CB-CD1 4.2Å; V308-L385 HydrophobicContact CG1-CB 4.06Å; V308-L385 HydrophobicContact CG1-CD1 4.08Å; L381-L385 WeakPolarHBondContact O-CB 3.43Å; L381-L385 PolarHBondContact O-N 3.42Å; L382-L385 PolarHBondContact O-N 3.37Å; L385-R387 VanDerWaalsContact C-N 3.31Å; L385-R387 PolarHBondContact O-N 3.08Å; L385-L388 PolarHBondContact O-N 3.26Å; L385-E389 WeakPolarHBondContact O-CG 3.49Å; L385-E389 PolarHBondContact O-N 3.38Å
386	Q	88.4	Confident	90.9	Very high	130 Å²	130	67.1 Å²	67.1	61%	0.607	31%	0.305	S	S	*	.	H	α-helix	trans	-60.7	-39.8	177.5	-71.5	176.4	8.2	0	0	112.2	L382 E383 R390	L382-Q386 WeakPolarHBondContact O-CG 3.18Å; L382-Q386 PolarHBondContact O-N 2.66Å; E383-Q386 PolarHBondContact O-N 3.32Å; Q386-R390 VanDerWaalsContact O-CB 3.27Å; Q386-R390 WeakPolarHBondContact O-CB 3.49Å; Q386-R390 PolarHBondContact O-N 3.16Å
387	R	92.2	Very high	90.8	Very high	56 Å²	56	67.6 Å²	67.6	21%	0.211	31%	0.305	C	S	.	.	H	α-helix	trans	-60.6	-45.6	176.5	-170.8	-172.5	70.6	80.5	5.3	111	Q302 E383 E384 L385 L391 L463	Q302-R387 PolarHBondContact O-NH2 3.42Å; E383-R387 WeakPolarHBondContact O-CB 3.3Å; E383-R387 PolarHBondContact O-N 3.34Å; E384-R387 PolarHBondContact O-N 3.2Å; E384-R387 IonicContact OE1-CZ 3.26Å; E384-R387 IonicContact OE1-NE 2.65Å; E384-R387 PolarHBondContact OE1-NE 3.28Å; E384-R387 IonicContact OE1-NH2 2.89Å; E384-R387 PolarHBondContact OE1-NH2 3.36Å; E384-R387 IonicContact OE2-CZ 3.48Å; E384-R387 IonicContact OE2-NE 3.14Å; E384-R387 PolarHBondContact OE2-NE 3.14Å; E384-R387 IonicContact OE2-NH2 2.75Å; L385-R387 VanDerWaalsContact C-N 3.31Å; L385-R387 PolarHBondContact O-N 3.08Å; R387-L391 WeakPolarHBondContact O-CG 3.44Å; R387-L391 PolarHBondContact O-N 2.86Å; R387-L463 PolarHBondContact NH1-O 3.4Å
388	L	90.9	Very high	90.7	Very high	8 Å²	8	67 Å²	67	4%	0.042	30%	0.302	C	S	.	.	H	α-helix	trans	-71.7	-42.6	-178.3	-70.7	170.4	0	0	0	112.7	Q302 S304 V305 V308 E384 L385 R390 L391 E392	Q302-L388 HydrophobicContact CB-CD1 4.06Å; S304-L388 WeakPolarHBondContact O-CD1 3.36Å; V305-L388 HydrophobicContact CG2-CB 3.84Å; V308-L388 HydrophobicContact CG2-CD1 3.47Å; V308-L388 VanDerWaalsContact CG2-CD1 3.47Å; E384-L388 HydrophobicContact CG-CD1 4.34Å; E384-L388 WeakPolarHBondContact O-CG 3.35Å; E384-L388 PolarHBondContact O-N 3.43Å; L385-L388 PolarHBondContact O-N 3.26Å; L388-R390 VanDerWaalsContact C-N 3.29Å; L388-R390 PolarHBondContact O-N 3.14Å; L388-L391 HydrophobicContact CD2-CD1 4.31Å; L388-L391 WeakPolarHBondContact O-CB 3.42Å; L388-L391 PolarHBondContact O-N 3.36Å; L388-L391 VanDerWaalsContact O-N 3.16Å; L388-E392 PolarHBondContact O-N 2.92Å
389	E	88	Confident	90.7	Very high	90 Å²	90	67.2 Å²	67.2	42%	0.421	30%	0.304	S	S	.	.	H	α-helix	trans	-59.3	-42	173.2	-74	-174.8	165.6	0	0	111.5	V305 L385 E392 Y393	V305-E389 HydrophobicContact CG2-CG 4.18Å; L385-E389 WeakPolarHBondContact O-CG 3.49Å; L385-E389 PolarHBondContact O-N 3.38Å; E389-E392 PolarHBondContact O-N 2.89Å; E389-Y393 WeakPolarHBondContact O-CB 3.45Å; E389-Y393 PolarHBondContact O-N 2.88Å
390	R	89.5	Confident	90.7	Very high	134 Å²	134	66.8 Å²	66.8	51%	0.506	31%	0.307	S	S	.	.	H	α-helix	trans	-63	-43.2	174.7	-175.8	174.2	-175.4	158.8	1.5	111.5	Q386 L388 Y393 L394 E459 L463	Q386-R390 VanDerWaalsContact O-CB 3.27Å; Q386-R390 WeakPolarHBondContact O-CB 3.49Å; Q386-R390 PolarHBondContact O-N 3.16Å; L388-R390 VanDerWaalsContact C-N 3.29Å; L388-R390 PolarHBondContact O-N 3.14Å; R390-Y393 PolarHBondContact O-N 3.14Å; R390-L394 HydrophobicContact CG-CD1 3.86Å; R390-L394 HydrophobicContact CG-CG 4.19Å; R390-L394 WeakPolarHBondContact O-CB 3.45Å; R390-L394 WeakPolarHBondContact O-CG 3.26Å; R390-L394 PolarHBondContact O-N 3.32Å; R390-E459 IonicContact CZ-OE1 2.75Å; R390-E459 VanDerWaalsContact CZ-OE1 3.25Å; R390-E459 IonicContact NE-OE1 2.94Å; R390-E459 PolarHBondContact NE-OE1 2.94Å; R390-E459 IonicContact NH2-OE1 2.74Å; R390-E459 PolarHBondContact NH2-OE1 2.94Å; R390-L463 HydrophobicContact CG-CD1 4.12Å
391	L	90.5	Very high	90.5	Very high	10 Å²	10	67.9 Å²	67.9	5%	0.052	31%	0.313	C	S	.	.	H	α-helix	trans	-60.5	-45.6	176.5	-80.5	176	0	0	0	112	R387 L388 L394 A395 L460 L463 H465	R387-L391 WeakPolarHBondContact O-CG 3.44Å; R387-L391 PolarHBondContact O-N 2.86Å; L388-L391 HydrophobicContact CD2-CD1 4.31Å; L388-L391 WeakPolarHBondContact O-CB 3.42Å; L388-L391 PolarHBondContact O-N 3.36Å; L388-L391 VanDerWaalsContact O-N 3.16Å; L391-L394 PolarHBondContact O-N 3.39Å; L391-A395 VanDerWaalsContact O-CB 3.25Å; L391-A395 WeakPolarHBondContact O-CB 3.42Å; L391-A395 PolarHBondContact O-N 3.31Å; L391-L460 HydrophobicContact CD2-CD2 4.1Å; L391-L463 HydrophobicContact CD2-CB 3.52Å; L391-L463 HydrophobicContact CD2-CD1 4.06Å; L391-L463 HydrophobicContact CD2-CG 4.46Å; L391-L463 HydrophobicContact CG-CB 4.2Å; L391-L463 HydrophobicContact CG-CD1 4.45Å; L391-H465 HydrophobicContact CD2-CB 3.97Å
392	E	88.8	Confident	90.5	Very high	114 Å²	114	67.8 Å²	67.8	53%	0.533	31%	0.312	S	S	.	.	H	α-helix	trans	-62.4	-44.4	177	-73.9	-174.5	-179.3	0	0	111.9	L388 E389 A395 K396	L388-E392 PolarHBondContact O-N 2.92Å; E389-E392 PolarHBondContact O-N 2.89Å; E392-A395 PolarHBondContact O-N 3.48Å; E392-K396 WeakPolarHBondContact O-CB 3.41Å; E392-K396 PolarHBondContact O-N 3.47Å
393	Y	88.6	Confident	90.7	Very high	138 Å²	138	65.8 Å²	65.8	54%	0.541	31%	0.305	S	S	.	.	H	α-helix	trans	-60.9	-48.4	175.5	170	-106.3	0	0	0	112.1	E389 R390 K396 K397	E389-Y393 WeakPolarHBondContact O-CB 3.45Å; E389-Y393 PolarHBondContact O-N 2.88Å; R390-Y393 PolarHBondContact O-N 3.14Å; Y393-K396 PolarHBondContact O-N 3.42Å; Y393-K397 HydrophobicContact CE1-CD 4.17Å; Y393-K397 VanDerWaalsContact O-CB 3.29Å; Y393-K397 WeakPolarHBondContact O-CB 3.46Å; Y393-K397 PolarHBondContact O-N 2.91Å
394	L	92.2	Very high	90.6	Very high	5 Å²	5	62.8 Å²	62.8	3%	0.026	30%	0.296	C	S	.	.	H	α-helix	trans	-63.9	-42.5	179.1	-71.3	173.8	0	0	0	111.6	R390 L391 K397 F398 L456 E459 L460 L463	R390-L394 HydrophobicContact CG-CD1 3.86Å; R390-L394 HydrophobicContact CG-CG 4.19Å; R390-L394 WeakPolarHBondContact O-CB 3.45Å; R390-L394 WeakPolarHBondContact O-CG 3.26Å; R390-L394 PolarHBondContact O-N 3.32Å; L391-L394 PolarHBondContact O-N 3.39Å; L394-K397 PolarHBondContact O-N 3.44Å; L394-F398 WeakPolarHBondContact O-CB 3.33Å; L394-F398 PolarHBondContact O-N 3.09Å; L394-L456 HydrophobicContact CD2-CD2 3.7Å; L394-E459 HydrophobicContact CD1-CB 4.42Å; L394-E459 HydrophobicContact CD1-CG 3.77Å; L394-E459 WeakPolarHBondContact CD2-OE2 3.31Å; L394-L460 HydrophobicContact CB-CD2 3.73Å; L394-L460 HydrophobicContact CB-CG 4.19Å; L394-L463 HydrophobicContact CD1-CD1 3.71Å
395	A	90.8	Very high	90.6	Very high	21 Å²	21	62.3 Å²	62.3	17%	0.174	29%	0.294	C	S	.	.	H	α-helix	trans	-62.3	-44.8	177	0	0	0	0	0	111.4	L391 E392 K397 F398 E399 F471	L391-A395 VanDerWaalsContact O-CB 3.25Å; L391-A395 WeakPolarHBondContact O-CB 3.42Å; L391-A395 PolarHBondContact O-N 3.31Å; E392-A395 PolarHBondContact O-N 3.48Å; A395-K397 PolarHBondContact O-N 3.13Å; A395-F398 PolarHBondContact O-N 3.24Å; A395-E399 WeakPolarHBondContact O-CB 3.39Å; A395-E399 PolarHBondContact O-N 2.94Å; A395-F471 HydrophobicContact CB-CZ 4.07Å
396	K	90.4	Very high	90.7	Very high	156 Å²	156	64.2 Å²	64.2	68%	0.678	30%	0.302	S	S	*	.	H	α-helix	trans	-63.4	-40.5	175	-172	176.1	-176.8	177.6	0	112	E392 Y393 E399 V400	E392-K396 WeakPolarHBondContact O-CB 3.41Å; E392-K396 PolarHBondContact O-N 3.47Å; Y393-K396 PolarHBondContact O-N 3.42Å; K396-E399 PolarHBondContact O-N 2.86Å; K396-V400 WeakPolarHBondContact O-CG2 3.41Å; K396-V400 PolarHBondContact O-N 3.45Å
397	K	90.8	Very high	90.8	Very high	75 Å²	75	61.5 Å²	61.5	33%	0.326	30%	0.301	S	S	.	.	H	α-helix	trans	-66.6	-41.4	177.3	-171.1	174.9	-178.2	175	0	111.9	Y393 L394 A395 K401 L456	Y393-K397 HydrophobicContact CE1-CD 4.17Å; Y393-K397 VanDerWaalsContact O-CB 3.29Å; Y393-K397 WeakPolarHBondContact O-CB 3.46Å; Y393-K397 PolarHBondContact O-N 2.91Å; L394-K397 PolarHBondContact O-N 3.44Å; A395-K397 PolarHBondContact O-N 3.13Å; K397-K401 WeakPolarHBondContact O-CB 3.39Å; K397-K401 WeakPolarHBondContact O-CG 3.39Å; K397-K401 PolarHBondContact O-N 3.36Å; K397-L456 HydrophobicContact CD-CD1 4.45Å; K397-L456 HydrophobicContact CD-CD2 4.13Å; K397-L456 HydrophobicContact CG-CD1 4.08Å
398	F	93.1	Very high	90.6	Very high	2 Å²	2	60.1 Å²	60.1	1%	0.009	30%	0.296	C	S	.	.	H	α-helix	trans	-59.3	-49.8	172.2	176.8	-87.9	0	0	0	110.4	L394 A395 V400 K401 C402 I453 L456 T457 L460 F471 R474	L394-F398 WeakPolarHBondContact O-CB 3.33Å; L394-F398 PolarHBondContact O-N 3.09Å; A395-F398 PolarHBondContact O-N 3.24Å; F398-V400 PolarHBondContact O-N 3.39Å; F398-K401 PolarHBondContact O-N 2.92Å; F398-C402 HydrophobicContact CE1-CB 4.37Å; F398-C402 VanDerWaalsContact CE1-SG 3.55Å; F398-C402 WeakPolarHBondContact CE2-SG 3.31Å; F398-C402 WeakPolarHBondContact CZ-SG 3.47Å; F398-C402 WeakPolarHBondContact O-CB 3.42Å; F398-C402 PolarHBondContact O-N 2.86Å; F398-C402 PolarHBondContact O-SG 3.19Å; F398-C402 VanDerWaalsContact O-SG 3.36Å; F398-I453 HydrophobicContact CE2-CG2 4Å; F398-L456 HydrophobicContact CB-CD1 4.49Å; F398-L456 HydrophobicContact CD2-CB 4.37Å; F398-T457 VanDerWaalsContact CE2-OG1 3.32Å; F398-T457 WeakPolarHBondContact CE2-OG1 3.37Å; F398-L460 HydrophobicContact CB-CD1 4.08Å; F398-L460 HydrophobicContact CD2-CD1 4.37Å; F398-L460 HydrophobicContact CG-CD1 4.24Å; F398-F471 AromaticContact CD1-CD1 3.52Å; F398-F471 HydrophobicContact CD1-CD1 3.52Å; F398-F471 AromaticContact CD1-CE1 3.83Å; F398-F471 HydrophobicContact CD1-CE1 3.83Å; F398-F471 AromaticContact CE1-CD1 3.49Å; F398-F471 HydrophobicContact CE1-CD1 3.49Å; F398-F471 VanDerWaalsContact CE1-CD1 3.49Å; F398-F471 HydrophobicContact CE1-CE1 4.2Å; F398-F471 HydrophobicContact CE1-CG 4.48Å; F398-F471 HydrophobicContact CG-CD1 4.11Å; F398-F471 HydrophobicContact CG-CE1 4.44Å; F398-F471 HydrophobicContact CZ-CB 4.28Å; F398-F471 HydrophobicContact CZ-CD1 4.04Å; F398-R474 HydrophobicContact CZ-CB 4.25Å
399	E	92	Very high	90.6	Very high	89 Å²	89	60.4 Å²	60.4	42%	0.416	30%	0.298	S	S	.	.	H	α-helix	trans	-56.2	-48.7	179	-174.2	57.5	-131.6	0	0	112.1	A395 K396 S403 R474	A395-E399 WeakPolarHBondContact O-CB 3.39Å; A395-E399 PolarHBondContact O-N 2.94Å; K396-E399 PolarHBondContact O-N 2.86Å; E399-S403 WeakPolarHBondContact O-CB 3.47Å; E399-S403 PolarHBondContact O-N 3.42Å; E399-S403 PolarHBondContact O-OG 3.24Å; E399-S403 PolarHBondContact OE1-OG 3.35Å; E399-S403 VanDerWaalsContact OE1-OG 3.07Å; E399-R474 IonicContact OE1-CZ 2.9Å; E399-R474 IonicContact OE1-NH1 2.7Å; E399-R474 PolarHBondContact OE1-NH1 3.37Å; E399-R474 IonicContact OE1-NH2 2.84Å; E399-R474 PolarHBondContact OE1-NH2 2.89Å; E399-R474 IonicContact OE2-CZ 2.82Å; E399-R474 IonicContact OE2-NH1 2.62Å; E399-R474 PolarHBondContact OE2-NH1 3.27Å
400	V	91	Very high	90.7	Very high	84 Å²	84	62.7 Å²	62.7	51%	0.509	31%	0.313	S	S	.	.	H	α-helix	trans	-63.1	-45.8	178.1	172	0	0	0	0	110.9	K396 F398 T404	K396-V400 WeakPolarHBondContact O-CG2 3.41Å; K396-V400 PolarHBondContact O-N 3.45Å; F398-V400 PolarHBondContact O-N 3.39Å; V400-T404 VanDerWaalsContact O-CB 3.25Å; V400-T404 WeakPolarHBondContact O-CB 3.36Å; V400-T404 PolarHBondContact O-N 2.96Å; V400-T404 PolarHBondContact O-OG1 3.43Å
401	K	90.8	Very high	90.6	Very high	55 Å²	55	57.9 Å²	57.9	24%	0.239	31%	0.306	C	S	.	.	H	α-helix	trans	-67.7	-44.1	-178.3	-76.9	-171.5	-173	-73.4	0	112.7	K397 F398 T404 H405 I453 L456	K397-K401 WeakPolarHBondContact O-CB 3.39Å; K397-K401 WeakPolarHBondContact O-CG 3.39Å; K397-K401 PolarHBondContact O-N 3.36Å; F398-K401 PolarHBondContact O-N 2.92Å; K401-T404 PolarHBondContact O-N 2.95Å; K401-H405 WeakPolarHBondContact O-CB 3.31Å; K401-H405 PolarHBondContact O-N 3.35Å; K401-I453 HydrophobicContact CB-CD1 4.43Å; K401-I453 HydrophobicContact CB-CG1 4Å; K401-L456 HydrophobicContact CD-CD1 3.64Å
402	C	92.2	Very high	90.6	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63	-49.8	176	-69.8	0	0	0	0	110.4	F398 T404 H405 E406 I478	F398-C402 HydrophobicContact CE1-CB 4.37Å; F398-C402 VanDerWaalsContact CE1-SG 3.55Å; F398-C402 WeakPolarHBondContact CE2-SG 3.31Å; F398-C402 WeakPolarHBondContact CZ-SG 3.47Å; F398-C402 WeakPolarHBondContact O-CB 3.42Å; F398-C402 PolarHBondContact O-N 2.86Å; F398-C402 PolarHBondContact O-SG 3.19Å; F398-C402 VanDerWaalsContact O-SG 3.36Å; C402-T404 VanDerWaalsContact C-N 3.3Å; C402-T404 PolarHBondContact O-N 3.38Å; C402-H405 PolarHBondContact O-N 3.12Å; C402-H405 VanDerWaalsContact O-N 3.11Å; C402-E406 WeakPolarHBondContact O-CB 3.37Å; C402-E406 VanDerWaalsContact O-CG 3.27Å; C402-E406 WeakPolarHBondContact O-CG 3.46Å; C402-E406 PolarHBondContact O-N 2.99Å; C402-I478 HydrophobicContact CB-CD1 3.99Å
403	S	92.6	Very high	90.5	Very high	45 Å²	45	55 Å²	55	32%	0.315	29%	0.293	S	S	.	.	H	α-helix	trans	-59.7	-39.2	177	-61.9	0	0	0	0	112.5	E399 A407 R474	E399-S403 WeakPolarHBondContact O-CB 3.47Å; E399-S403 PolarHBondContact O-N 3.42Å; E399-S403 PolarHBondContact O-OG 3.24Å; E399-S403 PolarHBondContact OE1-OG 3.35Å; E399-S403 VanDerWaalsContact OE1-OG 3.07Å; S403-A407 WeakPolarHBondContact O-CB 3.42Å; S403-A407 PolarHBondContact O-N 3.07Å; S403-R474 PolarHBondContact OG-NH2 3.45Å; S403-R474 VanDerWaalsContact OG-NH2 3.13Å
404	T	88.7	Confident	90.5	Very high	66 Å²	66	54.5 Å²	54.5	41%	0.405	30%	0.296	S	S	.	.	H	α-helix	trans	-69.2	-38.7	176.6	-54.1	0	0	0	0	111.7	V400 K401 C402 W408	V400-T404 VanDerWaalsContact O-CB 3.25Å; V400-T404 WeakPolarHBondContact O-CB 3.36Å; V400-T404 PolarHBondContact O-N 2.96Å; V400-T404 PolarHBondContact O-OG1 3.43Å; K401-T404 PolarHBondContact O-N 2.95Å; C402-T404 VanDerWaalsContact C-N 3.3Å; C402-T404 PolarHBondContact O-N 3.38Å; T404-W408 WeakPolarHBondContact O-CB 3.26Å; T404-W408 PolarHBondContact O-N 3.5Å
405	H	91	Very high	90.2	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.009	32%	0.315	C	S	.	.	H	α-helix	trans	-69	-46.4	176.2	-176.7	83.9	0	0	0	111.2	K401 C402 A407 W408 T409 I453 I478	K401-H405 WeakPolarHBondContact O-CB 3.31Å; K401-H405 PolarHBondContact O-N 3.35Å; C402-H405 PolarHBondContact O-N 3.12Å; C402-H405 VanDerWaalsContact O-N 3.11Å; H405-A407 VanDerWaalsContact C-N 3.35Å; H405-A407 PolarHBondContact O-N 2.94Å; H405-W408 AromaticContact CE1-CE3 3.9Å; H405-W408 AromaticContact CE1-CZ3 3.9Å; H405-W408 CarbonylContact O-C 3.55Å; H405-W408 WeakPolarHBondContact O-CA 3.13Å; H405-W408 WeakPolarHBondContact O-CB 3.37Å; H405-W408 PolarHBondContact O-N 3.27Å; H405-W408 VanDerWaalsContact O-N 3.11Å; H405-T409 PolarHBondContact CD2-OG1 2.83Å; H405-T409 PolarHBondContact NE2-OG1 2.99Å; H405-T409 WeakPolarHBondContact O-CB 3.48Å; H405-T409 PolarHBondContact O-N 3.43Å; H405-T409 PolarHBondContact O-OG1 3.27Å; H405-I453 HydrophobicContact CB-CD1 3.91Å; H405-I478 VanDerWaalsContact CD2-CG2 3.42Å; H405-I478 WeakPolarHBondContact CD2-CG2 3.4Å
406	E	91.5	Very high	90	Very high	69 Å²	69	56.3 Å²	56.3	32%	0.322	31%	0.309	S	S	.	.	H	α-helix	trans	-60.5	-42.6	175.2	-71.2	164.1	176.2	0	0	111.4	C402 W408 T409 N410 R474 I478	C402-E406 WeakPolarHBondContact O-CB 3.37Å; C402-E406 VanDerWaalsContact O-CG 3.27Å; C402-E406 WeakPolarHBondContact O-CG 3.46Å; C402-E406 PolarHBondContact O-N 2.99Å; E406-W408 VanDerWaalsContact C-N 3.29Å; E406-W408 PolarHBondContact O-N 2.86Å; E406-T409 PolarHBondContact O-N 3.4Å; E406-N410 WeakPolarHBondContact O-CB 3.29Å; E406-N410 PolarHBondContact O-N 3.13Å; E406-R474 IonicContact OE1-CZ 3.86Å; E406-R474 IonicContact OE1-NE 3.17Å; E406-R474 PolarHBondContact OE1-NE 2.97Å; E406-R474 IonicContact OE1-NH2 3.84Å; E406-R474 IonicContact OE2-CZ 3.95Å; E406-R474 IonicContact OE2-NE 3.9Å; E406-R474 IonicContact OE2-NH2 3.96Å; E406-R474 PolarHBondContact OE2-NH2 3Å; E406-I478 HydrophobicContact CG-CD1 4.46Å; E406-I478 HydrophobicContact CG-CG1 4.39Å
407	A	90.6	Very high	89.7	Confident	72 Å²	72	52 Å²	52	60%	0.595	30%	0.303	S	S	*	.	H	α-helix	trans	-62.8	-35.5	174	0	0	0	0	0	112.4	S403 H405	S403-A407 WeakPolarHBondContact O-CB 3.42Å; S403-A407 PolarHBondContact O-N 3.07Å; H405-A407 VanDerWaalsContact C-N 3.35Å; H405-A407 PolarHBondContact O-N 2.94Å
408	W	89.6	Confident	89.4	Confident	28 Å²	28	50.6 Å²	50.6	11%	0.106	30%	0.303	C	S	.	.	H	α-helix	trans	-67.4	-50.9	170.8	174.9	91.3	0	0	0	110	T404 H405 E406 N410 K412 D442 M443 H446 W482 M485	T404-W408 WeakPolarHBondContact O-CB 3.26Å; T404-W408 PolarHBondContact O-N 3.5Å; H405-W408 AromaticContact CE1-CE3 3.9Å; H405-W408 AromaticContact CE1-CZ3 3.9Å; H405-W408 CarbonylContact O-C 3.55Å; H405-W408 WeakPolarHBondContact O-CA 3.13Å; H405-W408 WeakPolarHBondContact O-CB 3.37Å; H405-W408 PolarHBondContact O-N 3.27Å; H405-W408 VanDerWaalsContact O-N 3.11Å; E406-W408 VanDerWaalsContact C-N 3.29Å; E406-W408 PolarHBondContact O-N 2.86Å; W408-N410 VanDerWaalsContact C-N 3.26Å; W408-N410 PolarHBondContact O-N 3.03Å; W408-K412 VanDerWaalsContact C-NZ 3.34Å; W408-K412 HydrophobicContact CD2-CD 3.83Å; W408-K412 HydrophobicContact CE3-CD 4.1Å; W408-K412 HydrophobicContact CG-CD 4.36Å; W408-K412 HydrophobicContact CH2-CD 4.18Å; W408-K412 HydrophobicContact CZ2-CD 3.94Å; W408-K412 HydrophobicContact CZ3-CD 4.27Å; W408-K412 VanDerWaalsContact NE1-CE 3.28Å; W408-K412 VanDerWaalsContact NE1-NZ 3.12Å; W408-K412 WeakPolarHBondContact O-CD 3.32Å; W408-K412 WeakPolarHBondContact O-CE 3.33Å; W408-K412 WeakPolarHBondContact O-CG 3.49Å; W408-K412 PolarHBondContact O-NZ 3.11Å; W408-D442 PolarHBondContact NE1-OD2 3.49Å; W408-M443 HydrophobicContact CH2-CG 4.48Å; W408-H446 AromaticContact CD1-CE1 3.15Å; W408-H446 AromaticContact CD1-ND1 3.87Å; W408-H446 AromaticContact CD1-NE2 3.46Å; W408-H446 AromaticContact CD2-CE1 3.42Å; W408-H446 VanDerWaalsContact CD2-CE1 3.42Å; W408-H446 AromaticContact CD2-ND1 3.31Å; W408-H446 VanDerWaalsContact CD2-ND1 3.31Å; W408-H446 AromaticContact CE2-CD2 3.87Å; W408-H446 AromaticContact CE2-CE1 3.52Å; W408-H446 AromaticContact CE2-CG 3.68Å; W408-H446 AromaticContact CE2-ND1 3.45Å; W408-H446 AromaticContact CE2-NE2 3.83Å; W408-H446 AromaticContact CE3-ND1 3.65Å; W408-H446 AromaticContact CG-CE1 3.23Å; W408-H446 AromaticContact CG-ND1 3.66Å; W408-H446 HydrophobicContact CH2-CB 4.09Å; W408-H446 HydrophobicContact CZ2-CB 4.08Å; W408-H446 AromaticContact CZ2-CG 3.79Å; W408-H446 AromaticContact CZ2-ND1 3.95Å; W408-H446 HydrophobicContact CZ3-CB 4.44Å; W408-H446 AromaticContact NE1-CD2 3.74Å; W408-H446 AromaticContact NE1-CE1 3.33Å; W408-H446 PolarHBondContact NE1-CE1 3.29Å; W408-H446 VanDerWaalsContact NE1-CE1 3.33Å; W408-H446 AromaticContact NE1-CG 4Å; W408-H446 AromaticContact NE1-ND1 3.76Å; W408-H446 AromaticContact NE1-NE2 3.35Å; W408-H446 PolarHBondContact NE1-NE2 3.39Å; W408-W482 HydrophobicContact CH2-CE3 4.36Å; W408-W482 AromaticContact CH2-CZ3 3.68Å; W408-W482 HydrophobicContact CH2-CZ3 3.68Å; W408-W482 HydrophobicContact CZ3-CE3 4.2Å; W408-W482 AromaticContact CZ3-CZ3 3.89Å; W408-W482 HydrophobicContact CZ3-CZ3 3.89Å; W408-M485 HydrophobicContact CE3-CE 4.43Å; W408-M485 HydrophobicContact CH2-CE 3.43Å; W408-M485 VanDerWaalsContact CH2-CE 3.43Å; W408-M485 HydrophobicContact CZ2-CE 4.27Å; W408-M485 HydrophobicContact CZ3-CE 3.55Å; W408-M485 HydrophobicContact CZ3-SD 4.19Å
409	T	89.5	Confident	88.7	Confident	13 Å²	13	55.8 Å²	55.8	8%	0.08	33%	0.331	C	S	.	.	H	α-helix	trans	-62.6	-30.3	-176.6	-61.6	0	0	0	0	113.2	H405 E406 G411 K412 P413 T481 M485	H405-T409 PolarHBondContact CD2-OG1 2.83Å; H405-T409 PolarHBondContact NE2-OG1 2.99Å; H405-T409 WeakPolarHBondContact O-CB 3.48Å; H405-T409 PolarHBondContact O-N 3.43Å; H405-T409 PolarHBondContact O-OG1 3.27Å; E406-T409 PolarHBondContact O-N 3.4Å; T409-G411 PolarHBondContact O-N 2.99Å; T409-K412 WeakPolarHBondContact O-CB 3.4Å; T409-K412 PolarHBondContact O-N 3.31Å; T409-P413 VanDerWaalsContact O-CD 3.3Å; T409-P413 WeakPolarHBondContact O-CD 3.39Å; T409-T481 HydrophobicContact CG2-CG2 3.3Å; T409-M485 HydrophobicContact CG2-SD 3.77Å
410	N	90.9	Very high	88	Confident	138 Å²	138	54.1 Å²	54.1	74%	0.738	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	121.8	-178.4	-172.5	25.9	0	0	0	112.8	E406 W408 K412	E406-N410 WeakPolarHBondContact O-CB 3.29Å; E406-N410 PolarHBondContact O-N 3.13Å; W408-N410 VanDerWaalsContact C-N 3.26Å; W408-N410 PolarHBondContact O-N 3.03Å; N410-K412 PolarHBondContact O-N 3.41Å
411	G	87.8	Confident	87.1	Confident	34 Å²	34	51 Å²	51	35%	0.351	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.8	-6.3	179.8	0	0	0	0	0	115.4	T409 E414 A415	T409-G411 PolarHBondContact O-N 2.99Å; G411-E414 VanDerWaalsContact C-OE2 3.26Å; G411-E414 WeakPolarHBondContact CA-OE2 3.29Å; G411-A415 VanDerWaalsContact O-CB 3.28Å; G411-A415 WeakPolarHBondContact O-CB 3.38Å; G411-A415 PolarHBondContact O-N 3.33Å
412	K	89.9	Confident	85.8	Confident	43 Å²	43	57.7 Å²	57.7	19%	0.187	33%	0.328	C	S	.	.	H	α-helix	trans	-70.4	-45.3	179.9	-69.8	-173.9	155.9	80.3	0	113	W408 T409 N410 E414 A415 L416 F439 M485	W408-K412 VanDerWaalsContact C-NZ 3.34Å; W408-K412 HydrophobicContact CD2-CD 3.83Å; W408-K412 HydrophobicContact CE3-CD 4.1Å; W408-K412 HydrophobicContact CG-CD 4.36Å; W408-K412 HydrophobicContact CH2-CD 4.18Å; W408-K412 HydrophobicContact CZ2-CD 3.94Å; W408-K412 HydrophobicContact CZ3-CD 4.27Å; W408-K412 VanDerWaalsContact NE1-CE 3.28Å; W408-K412 VanDerWaalsContact NE1-NZ 3.12Å; W408-K412 WeakPolarHBondContact O-CD 3.32Å; W408-K412 WeakPolarHBondContact O-CE 3.33Å; W408-K412 WeakPolarHBondContact O-CG 3.49Å; W408-K412 PolarHBondContact O-NZ 3.11Å; T409-K412 WeakPolarHBondContact O-CB 3.4Å; T409-K412 PolarHBondContact O-N 3.31Å; N410-K412 PolarHBondContact O-N 3.41Å; K412-E414 VanDerWaalsContact C-N 3.27Å; K412-E414 PolarHBondContact O-N 3.02Å; K412-A415 PolarHBondContact O-N 3.34Å; K412-L416 VanDerWaalsContact O-CG 3.28Å; K412-L416 WeakPolarHBondContact O-CG 3.41Å; K412-L416 PolarHBondContact O-N 2.7Å; K412-F439 HydrophobicContact CD-CE2 3.85Å; K412-F439 HydrophobicContact CG-CE2 4.42Å; K412-M485 HydrophobicContact CB-CE 3.64Å; K412-M485 HydrophobicContact CB-SD 4.11Å; K412-M485 HydrophobicContact CD-CE 3.52Å; K412-M485 HydrophobicContact CG-CE 4.23Å
413	P	87.8	Confident	84.5	Confident	19 Å²	19	60.4 Å²	60.4	12%	0.123	35%	0.347	C	S	.	.	H	α-helix	trans	-53.1	-44.9	173.4	-26.5	35.2	0	0	0	112.3	T409 L416 A417 T481 M485 L488	T409-P413 VanDerWaalsContact O-CD 3.3Å; T409-P413 WeakPolarHBondContact O-CD 3.39Å; P413-L416 PolarHBondContact O-N 3.24Å; P413-A417 PolarHBondContact O-N 3.19Å; P413-T481 HydrophobicContact CG-CG2 4.26Å; P413-M485 HydrophobicContact CG-CG 3.96Å; P413-M485 HydrophobicContact CG-SD 4.49Å; P413-L488 HydrophobicContact CB-CD1 4.21Å; P413-L488 WeakPolarHBondContact O-CD1 3.01Å
414	E	87.5	Confident	83.1	Confident	128 Å²	128	58.5 Å²	58.5	60%	0.598	33%	0.334	S	S	*	.	H	α-helix	trans	-66.9	-40.2	177.7	-61.6	80.4	-178.5	0	0	112.3	G411 K412 A417 S418	G411-E414 VanDerWaalsContact C-OE2 3.26Å; G411-E414 WeakPolarHBondContact CA-OE2 3.29Å; K412-E414 VanDerWaalsContact C-N 3.27Å; K412-E414 PolarHBondContact O-N 3.02Å; E414-A417 PolarHBondContact O-N 2.96Å; E414-S418 PolarHBondContact O-N 2.98Å
415	A	85.1	Confident	81.8	Confident	52 Å²	52	55.5 Å²	55.5	43%	0.43	32%	0.315	S	S	.	.	H	α-helix	trans	-65.5	-39.5	176.7	0	0	0	0	0	112.3	G411 K412 A417 S418 R492	G411-A415 VanDerWaalsContact O-CB 3.28Å; G411-A415 WeakPolarHBondContact O-CB 3.38Å; G411-A415 PolarHBondContact O-N 3.33Å; K412-A415 PolarHBondContact O-N 3.34Å; A415-A417 VanDerWaalsContact C-N 3.29Å; A415-A417 PolarHBondContact O-N 2.86Å; A415-S418 VanDerWaalsContact O-CB 3.28Å; A415-S418 WeakPolarHBondContact O-CB 3.16Å; A415-S418 PolarHBondContact O-N 2.74Å; A415-R492 PolarHBondContact O-NH1 3.36Å
416	L	86.8	Confident	80.4	Confident	12 Å²	12	55.4 Å²	55.4	6%	0.063	32%	0.315	C	S	.	.	H	α-helix	trans	-67.1	-32.3	177.3	-67.5	173.3	0	0	0	112.1	K412 P413 S418 F439 M485 L488	K412-L416 VanDerWaalsContact O-CG 3.28Å; K412-L416 WeakPolarHBondContact O-CG 3.41Å; K412-L416 PolarHBondContact O-N 2.7Å; P413-L416 PolarHBondContact O-N 3.24Å; L416-S418 VanDerWaalsContact C-N 3.3Å; L416-S418 PolarHBondContact O-N 3.01Å; L416-F439 HydrophobicContact CD1-CE1 3.88Å; L416-F439 HydrophobicContact CD1-CZ 3.71Å; L416-F439 HydrophobicContact CD2-CD1 3.89Å; L416-F439 HydrophobicContact CD2-CE1 3.55Å; L416-F439 HydrophobicContact CD2-CE2 4.33Å; L416-F439 HydrophobicContact CD2-CG 4.45Å; L416-F439 HydrophobicContact CD2-CZ 3.8Å; L416-F439 HydrophobicContact CG-CE1 4.23Å; L416-F439 HydrophobicContact CG-CZ 4.07Å; L416-M485 HydrophobicContact CD1-CB 3.98Å; L416-M485 HydrophobicContact CD1-CG 4.27Å; L416-M485 WeakPolarHBondContact CD1-O 3.47Å; L416-L488 HydrophobicContact CB-CB 3.51Å; L416-L488 HydrophobicContact CB-CD1 4.29Å; L416-L488 HydrophobicContact CB-CG 4.48Å; L416-L488 HydrophobicContact CD1-CB 3.82Å; L416-L488 HydrophobicContact CG-CB 4.31Å
417	A	85.3	Confident	78.7	Confident	66 Å²	66	52.1 Å²	52.1	55%	0.545	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-6	175.2	0	0	0	0	0	114.6	P413 E414 A415 L488	P413-A417 PolarHBondContact O-N 3.19Å; E414-A417 PolarHBondContact O-N 2.96Å; A415-A417 VanDerWaalsContact C-N 3.29Å; A415-A417 PolarHBondContact O-N 2.86Å; A417-L488 HydrophobicContact CB-CD2 4.37Å
418	S	85	Confident	77.8	Confident	46 Å²	46	50.2 Å²	50.2	32%	0.322	28%	0.278	S	S	.	.			trans	-75.6	148.8	-174.2	-175.9	0	0	0	0	114.8	E414 A415 L416 D420 R492	E414-S418 PolarHBondContact O-N 2.98Å; A415-S418 VanDerWaalsContact O-CB 3.28Å; A415-S418 WeakPolarHBondContact O-CB 3.16Å; A415-S418 PolarHBondContact O-N 2.74Å; L416-S418 VanDerWaalsContact C-N 3.3Å; L416-S418 PolarHBondContact O-N 3.01Å; S418-D420 WeakPolarHBondContact OG-CB 3.3Å; S418-D420 PolarHBondContact OG-N 2.88Å; S418-R492 PolarHBondContact O-NH1 3.43Å
419	N	77.4	Confident	77	Confident	111 Å²	111	48.9 Å²	48.9	59%	0.594	27%	0.273	S	S	*	.			trans	-100.9	19.5	172.6	-70.1	-53	0	0	0	113.7	F421 R422	N419-F421 HydrophobicContact CB-CE1 4.37Å; N419-F421 PolarHBondContact O-N 2.89Å; N419-F421 VanDerWaalsContact O-N 3.14Å; N419-R422 PolarHBondContact O-N 3.36Å
420	D	77.1	Confident	76.1	Confident	53 Å²	53	50.6 Å²	50.6	28%	0.283	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-51.8	-26.3	-178.6	58.6	-18	0	0	0	116.3	S418 R422 S423 F432 R492	S418-D420 WeakPolarHBondContact OG-CB 3.3Å; S418-D420 PolarHBondContact OG-N 2.88Å; D420-R422 PolarHBondContact O-N 3.42Å; D420-S423 PolarHBondContact O-N 3.21Å; D420-S423 PolarHBondContact O-OG 3.16Å; D420-F432 WeakPolarHBondContact OD2-CE1 3.43Å; D420-R492 VanDerWaalsContact CG-NH2 3.3Å; D420-R492 IonicContact OD1-CZ 3.62Å; D420-R492 VanDerWaalsContact OD1-CZ 3.24Å; D420-R492 IonicContact OD1-NH1 3.45Å; D420-R492 PolarHBondContact OD1-NH1 2.85Å; D420-R492 IonicContact OD1-NH2 3.15Å; D420-R492 PolarHBondContact OD1-NH2 3.39Å; D420-R492 IonicContact OD2-CZ 3.25Å; D420-R492 IonicContact OD2-NH1 2.94Å; D420-R492 IonicContact OD2-NH2 2.79Å; D420-R492 PolarHBondContact OD2-NH2 2.93Å
421	F	72.6	Confident	74.7	Confident	18 Å²	18	45.4 Å²	45.4	8%	0.079	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-60.7	-14.9	179.7	69	-91.1	0	0	0	114.4	N419 S423 A424 M429 F432 E495 I496	N419-F421 HydrophobicContact CB-CE1 4.37Å; N419-F421 PolarHBondContact O-N 2.89Å; N419-F421 VanDerWaalsContact O-N 3.14Å; F421-S423 VanDerWaalsContact C-N 3.3Å; F421-S423 PolarHBondContact O-N 3.44Å; F421-A424 WeakPolarHBondContact O-CB 3.47Å; F421-A424 PolarHBondContact O-N 3.06Å; F421-M429 HydrophobicContact CB-CE 3.66Å; F421-M429 HydrophobicContact CB-SD 3.83Å; F421-M429 HydrophobicContact CD2-CE 4.08Å; F421-M429 HydrophobicContact CD2-SD 4.45Å; F421-M429 HydrophobicContact CG-CE 4.39Å; F421-M429 WeakPolarHBondContact O-CE 3.34Å; F421-F432 VanDerWaalsContact CA-CE2 3.45Å; F421-F432 HydrophobicContact CB-CD2 3.64Å; F421-F432 HydrophobicContact CB-CE2 4.02Å; F421-F432 HydrophobicContact CB-CG 4.11Å; F421-E495 HydrophobicContact CE1-CB 4.02Å; F421-E495 HydrophobicContact CE2-CB 4.2Å; F421-E495 HydrophobicContact CZ-CB 3.73Å; F421-E495 HydrophobicContact CZ-CG 4.21Å; F421-I496 HydrophobicContact CB-CG1 4.33Å
422	R	63.6	Low	74.3	Confident	196 Å²	196	44.7 Å²	44.7	74%	0.74	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-71	-18.6	-178.3	-68.7	-178	177.4	-106.4	-0.5	115	N419 D420	N419-R422 PolarHBondContact O-N 3.36Å; D420-R422 PolarHBondContact O-N 3.42Å
423	S	65.4	Low	73.9	Confident	58 Å²	58	44.4 Å²	44.4	41%	0.406	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-103	15.6	177.1	51.8	0	0	0	0	113.1	D420 F421 N585	D420-S423 PolarHBondContact O-N 3.21Å; D420-S423 PolarHBondContact O-OG 3.16Å; F421-S423 VanDerWaalsContact C-N 3.3Å; F421-S423 PolarHBondContact O-N 3.44Å; S423-N585 WeakPolarHBondContact O-CB 3.47Å; S423-N585 PolarHBondContact O-ND2 3Å; S423-N585 VanDerWaalsContact O-ND2 3.14Å
424	A	63.2	Low	73.1	Confident	5 Å²	5	48.3 Å²	48.3	4%	0.041	26%	0.256	C	S	.	.			trans	-77.1	137.6	-163.7	0	0	0	0	0	115.4	F421 E428 M429 F432 L583	F421-A424 WeakPolarHBondContact O-CB 3.47Å; F421-A424 PolarHBondContact O-N 3.06Å; A424-E428 VanDerWaalsContact C-OE2 3.31Å; A424-E428 WeakPolarHBondContact CA-OE2 3.39Å; A424-E428 HydrophobicContact CB-CB 3.87Å; A424-M429 HydrophobicContact CB-CB 4.27Å; A424-M429 HydrophobicContact CB-CE 3.25Å; A424-F432 HydrophobicContact CB-CD2 3.56Å; A424-F432 HydrophobicContact CB-CE2 3.32Å; A424-L583 VanDerWaalsContact O-CD2 3.29Å; A424-L583 WeakPolarHBondContact O-CD2 3.21Å
425	M	59.5	Low	72.8	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	25%	0.254	C	S	.	.			trans	-67.3	-168.3	152.6	-29.2	172.9	-150.6	0	0	113	E428 M429 L503 N585 A586 Q588	M425-E428 HydrophobicContact CB-CB 3.82Å; M425-E428 HydrophobicContact CB-CG 3.72Å; M425-E428 HydrophobicContact CE-CG 3.69Å; M425-E428 WeakPolarHBondContact CE-OE1 3.26Å; M425-E428 HydrophobicContact CG-CB 4.07Å; M425-E428 VanDerWaalsContact CG-CD 3.4Å; M425-E428 HydrophobicContact CG-CG 3.48Å; M425-E428 VanDerWaalsContact CG-CG 3.48Å; M425-E428 VanDerWaalsContact CG-OE2 3.26Å; M425-E428 WeakPolarHBondContact CG-OE2 3.17Å; M425-E428 PolarHBondContact N-OE2 3.34Å; M425-E428 CarbonylContact O-C 3.56Å; M425-E428 VanDerWaalsContact O-C 3.22Å; M425-E428 WeakPolarHBondContact O-CA 3.48Å; M425-E428 WeakPolarHBondContact O-CB 3.44Å; M425-E428 PolarHBondContact O-N 3.32Å; M425-E428 HydrophobicContact SD-CG 3.81Å; M425-M429 PolarHBondContact O-N 3.32Å; M425-L503 VanDerWaalsContact CA-CD2 3.45Å; M425-L503 WeakPolarHBondContact O-CD1 3.36Å; M425-L503 WeakPolarHBondContact O-CD2 3.41Å; M425-N585 VanDerWaalsContact CE-C 3.42Å; M425-N585 HydrophobicContact CE-CB 3.56Å; M425-N585 WeakPolarHBondContact CE-O 3.36Å; M425-N585 HydrophobicContact CG-CB 3.34Å; M425-N585 WeakPolarHBondContact CG-O 3.22Å; M425-N585 HydrophobicContact SD-CB 4.19Å; M425-A586 HydrophobicContact CB-CB 3.66Å; M425-A586 HydrophobicContact CG-CB 3.76Å; M425-A586 VanDerWaalsContact CG-N 3.31Å; M425-A586 WeakPolarHBondContact SD-CA 3.4Å; M425-A586 HydrophobicContact SD-CB 4.42Å; M425-Q588 HydrophobicContact CE-CB 3.12Å; M425-Q588 HydrophobicContact CE-CG 4.08Å; M425-Q588 HydrophobicContact SD-CB 3.63Å
426	L	63	Low	72.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63	-86	-157.7	163.8	47.9	0	0	0	122.1	M429 R430 L500 L503 E504 I506 D507	L426-M429 CarbonylContact O-C 3.34Å; L426-M429 WeakPolarHBondContact O-CA 3.22Å; L426-M429 WeakPolarHBondContact O-CB 3.3Å; L426-M429 PolarHBondContact O-N 2.97Å; L426-R430 HydrophobicContact CD1-CB 4.14Å; L426-R430 HydrophobicContact CD1-CG 3.53Å; L426-R430 PolarHBondContact O-N 3.19Å; L426-L500 WeakPolarHBondContact CD1-O 3.43Å; L426-L503 HydrophobicContact CB-CB 3.24Å; L426-L503 HydrophobicContact CB-CD2 3.69Å; L426-L503 HydrophobicContact CB-CG 3.88Å; L426-L503 WeakPolarHBondContact CB-O 3.36Å; L426-L503 VanDerWaalsContact CD1-CA 3.5Å; L426-L503 HydrophobicContact CD1-CB 3.21Å; L426-L503 WeakPolarHBondContact CD2-O 3.47Å; L426-L503 VanDerWaalsContact CG-CA 3.43Å; L426-L503 HydrophobicContact CG-CB 3.5Å; L426-L503 WeakPolarHBondContact CG-O 3.38Å; L426-L503 WeakPolarHBondContact O-CB 3.16Å; L426-L503 VanDerWaalsContact O-CD1 3.29Å; L426-L503 WeakPolarHBondContact O-CD1 3.46Å; L426-E504 HydrophobicContact CD1-CB 3.98Å; L426-E504 HydrophobicContact CD1-CG 3.49Å; L426-E504 VanDerWaalsContact CD1-CG 3.49Å; L426-E504 HydrophobicContact CD2-CB 4.38Å; L426-E504 WeakPolarHBondContact CD2-O 3.42Å; L426-E504 VanDerWaalsContact CG-N 3.29Å; L426-I506 HydrophobicContact CB-CB 4.07Å; L426-I506 HydrophobicContact CB-CG2 4.46Å; L426-I506 HydrophobicContact CD2-CB 4.21Å; L426-D507 HydrophobicContact CD2-CB 2.84Å; L426-D507 HydrophobicContact CG-CB 3.84Å
427	S	55.4	Low	72.7	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	cis	67.4	-60.9	42.4	104.6	0	0	0	0	108.2	M429 R430 A431 D507 P590	S427-M429 VanDerWaalsContact C-N 3.32Å; S427-R430 VanDerWaalsContact N-CB 3.31Å; S427-A431 WeakPolarHBondContact O-CA 3.37Å; S427-A431 WeakPolarHBondContact O-CB 3.45Å; S427-A431 PolarHBondContact O-N 3.42Å; S427-D507 WeakPolarHBondContact CA-OD1 3.46Å; S427-D507 WeakPolarHBondContact CB-OD1 3.38Å; S427-P590 WeakPolarHBondContact O-CB 3Å; S427-P590 WeakPolarHBondContact OG-CB 3.39Å; S427-P590 WeakPolarHBondContact OG-CG 3.35Å
428	E	70.7	Confident	72.5	Confident	32 Å²	32	49.1 Å²	49.1	15%	0.15	25%	0.247	C	C	.	.	H	α-helix	trans	-76	-22.5	150.8	-75.9	-176.6	148.6	0	0	111.9	A424 M425 A431 F432 N585	A424-E428 VanDerWaalsContact C-OE2 3.31Å; A424-E428 WeakPolarHBondContact CA-OE2 3.39Å; A424-E428 HydrophobicContact CB-CB 3.87Å; M425-E428 HydrophobicContact CB-CB 3.82Å; M425-E428 HydrophobicContact CB-CG 3.72Å; M425-E428 HydrophobicContact CE-CG 3.69Å; M425-E428 WeakPolarHBondContact CE-OE1 3.26Å; M425-E428 HydrophobicContact CG-CB 4.07Å; M425-E428 VanDerWaalsContact CG-CD 3.4Å; M425-E428 HydrophobicContact CG-CG 3.48Å; M425-E428 VanDerWaalsContact CG-CG 3.48Å; M425-E428 VanDerWaalsContact CG-OE2 3.26Å; M425-E428 WeakPolarHBondContact CG-OE2 3.17Å; M425-E428 PolarHBondContact N-OE2 3.34Å; M425-E428 CarbonylContact O-C 3.56Å; M425-E428 VanDerWaalsContact O-C 3.22Å; M425-E428 WeakPolarHBondContact O-CA 3.48Å; M425-E428 WeakPolarHBondContact O-CB 3.44Å; M425-E428 PolarHBondContact O-N 3.32Å; M425-E428 HydrophobicContact SD-CG 3.81Å; E428-A431 CarbonylContact O-C 3.59Å; E428-F432 VanDerWaalsContact C-N 3.3Å; E428-F432 HydrophobicContact CB-CD2 4.27Å; E428-F432 HydrophobicContact CB-CE2 3.93Å; E428-F432 VanDerWaalsContact O-CA 3.24Å; E428-F432 WeakPolarHBondContact O-CA 3.37Å; E428-F432 WeakPolarHBondContact O-CB 3.47Å; E428-F432 WeakPolarHBondContact O-CD2 3.49Å; E428-F432 WeakPolarHBondContact O-CE2 3.28Å; E428-F432 WeakPolarHBondContact O-CG 3.43Å; E428-F432 PolarHBondContact O-N 3.04Å; E428-N585 PolarHBondContact OE1-ND2 3.1Å; E428-N585 VanDerWaalsContact OE1-ND2 3.17Å; E428-N585 WeakPolarHBondContact OE2-CB 3.24Å; E428-N585 PolarHBondContact OE2-ND2 3.28Å
429	M	74.2	Confident	72.6	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-97.3	-37.4	177.5	-162.4	70.8	62.3	0	0	113.8	F421 A424 M425 L426 S427 A431 F432 Q433 I496 A499 L500 L503	F421-M429 HydrophobicContact CB-CE 3.66Å; F421-M429 HydrophobicContact CB-SD 3.83Å; F421-M429 HydrophobicContact CD2-CE 4.08Å; F421-M429 HydrophobicContact CD2-SD 4.45Å; F421-M429 HydrophobicContact CG-CE 4.39Å; F421-M429 WeakPolarHBondContact O-CE 3.34Å; A424-M429 HydrophobicContact CB-CB 4.27Å; A424-M429 HydrophobicContact CB-CE 3.25Å; M425-M429 PolarHBondContact O-N 3.32Å; L426-M429 CarbonylContact O-C 3.34Å; L426-M429 WeakPolarHBondContact O-CA 3.22Å; L426-M429 WeakPolarHBondContact O-CB 3.3Å; L426-M429 PolarHBondContact O-N 2.97Å; S427-M429 VanDerWaalsContact C-N 3.32Å; M429-A431 VanDerWaalsContact C-N 3.26Å; M429-F432 HydrophobicContact CE-CD2 3.95Å; M429-F432 CarbonylContact O-C 3.47Å; M429-F432 WeakPolarHBondContact O-CA 3.45Å; M429-F432 PolarHBondContact O-N 3.19Å; M429-F432 HydrophobicContact SD-CB 3.86Å; M429-F432 HydrophobicContact SD-CD2 3.8Å; M429-F432 HydrophobicContact SD-CG 4.26Å; M429-Q433 WeakPolarHBondContact O-CB 3.31Å; M429-Q433 PolarHBondContact O-N 3.24Å; M429-I496 WeakPolarHBondContact CG-O 3.47Å; M429-I496 HydrophobicContact SD-CB 4.28Å; M429-I496 HydrophobicContact SD-CG1 4.41Å; M429-I496 HydrophobicContact SD-CG2 4.15Å; M429-A499 HydrophobicContact CB-CB 4.31Å; M429-A499 HydrophobicContact CE-CB 3.12Å; M429-A499 HydrophobicContact CG-CB 3.48Å; M429-A499 VanDerWaalsContact CG-CB 3.48Å; M429-A499 HydrophobicContact SD-CB 3.7Å; M429-L500 HydrophobicContact CG-CB 4.35Å; M429-L500 VanDerWaalsContact O-CD1 3.31Å; M429-L500 WeakPolarHBondContact O-CD1 3.39Å; M429-L503 HydrophobicContact CB-CD1 3.23Å; M429-L503 HydrophobicContact CG-CD1 4.18Å
430	R	70.7	Confident	73	Confident	48 Å²	48	45.3 Å²	45.3	18%	0.181	22%	0.22	C	C	.	.	H	α-helix	trans	-61.7	-39.1	156.5	-75.3	179.2	174.7	156.8	-3.9	108.8	L426 S427 K434 L500 E504 D507	L426-R430 HydrophobicContact CD1-CB 4.14Å; L426-R430 HydrophobicContact CD1-CG 3.53Å; L426-R430 PolarHBondContact O-N 3.19Å; S427-R430 VanDerWaalsContact N-CB 3.31Å; R430-K434 WeakPolarHBondContact O-CA 3.5Å; R430-K434 WeakPolarHBondContact O-CB 3.44Å; R430-K434 WeakPolarHBondContact O-CG 3.14Å; R430-K434 PolarHBondContact O-N 3.47Å; R430-L500 HydrophobicContact CB-CD1 3.81Å; R430-L500 HydrophobicContact CB-CG 4.39Å; R430-L500 HydrophobicContact CG-CD1 3.44Å; R430-L500 VanDerWaalsContact CG-CD1 3.44Å; R430-L500 HydrophobicContact CG-CD2 4.31Å; R430-L500 HydrophobicContact CG-CG 3.51Å; R430-E504 IonicContact CZ-OE1 2.78Å; R430-E504 IonicContact NE-OE1 3.56Å; R430-E504 PolarHBondContact NE-OE1 3.06Å; R430-E504 PolarHBondContact NH1-O 3.02Å; R430-E504 IonicContact NH2-OE1 3.48Å; R430-E504 PolarHBondContact NH2-OE1 3.35Å; R430-E504 IonicContact NH2-OE2 3.5Å; R430-E504 PolarHBondContact NH2-OE2 3.01Å; R430-D507 WeakPolarHBondContact CD-OD2 3.47Å; R430-D507 IonicContact CZ-OD2 2.8Å; R430-D507 IonicContact NE-OD2 3.6Å; R430-D507 IonicContact NH1-OD2 3.35Å; R430-D507 PolarHBondContact NH1-OD2 3.21Å
431	A	61.1	Low	73.4	Confident	30 Å²	30	46.6 Å²	46.6	25%	0.248	23%	0.233	C	C	.	.	H	α-helix	trans	-73.4	-25.4	162.7	0	0	0	0	0	111.7	S427 E428 M429 Q433 K435	S427-A431 WeakPolarHBondContact O-CA 3.37Å; S427-A431 WeakPolarHBondContact O-CB 3.45Å; S427-A431 PolarHBondContact O-N 3.42Å; E428-A431 CarbonylContact O-C 3.59Å; M429-A431 VanDerWaalsContact C-N 3.26Å; A431-Q433 PolarHBondContact O-N 3.03Å; A431-K435 WeakPolarHBondContact O-CA 3.49Å; A431-K435 WeakPolarHBondContact O-CB 3.29Å; A431-K435 PolarHBondContact O-N 3.4Å
432	F	79.7	Confident	74	Confident	18 Å²	18	48.5 Å²	48.5	8%	0.079	24%	0.244	C	C	.	.	H	α-helix	trans	-68.5	-37.3	176.1	-79.7	-52.9	0	0	0	107.4	D420 F421 A424 E428 M429 H436 I496	D420-F432 WeakPolarHBondContact OD2-CE1 3.43Å; F421-F432 VanDerWaalsContact CA-CE2 3.45Å; F421-F432 HydrophobicContact CB-CD2 3.64Å; F421-F432 HydrophobicContact CB-CE2 4.02Å; F421-F432 HydrophobicContact CB-CG 4.11Å; A424-F432 HydrophobicContact CB-CD2 3.56Å; A424-F432 HydrophobicContact CB-CE2 3.32Å; E428-F432 VanDerWaalsContact C-N 3.3Å; E428-F432 HydrophobicContact CB-CD2 4.27Å; E428-F432 HydrophobicContact CB-CE2 3.93Å; E428-F432 VanDerWaalsContact O-CA 3.24Å; E428-F432 WeakPolarHBondContact O-CA 3.37Å; E428-F432 WeakPolarHBondContact O-CB 3.47Å; E428-F432 WeakPolarHBondContact O-CD2 3.49Å; E428-F432 WeakPolarHBondContact O-CE2 3.28Å; E428-F432 WeakPolarHBondContact O-CG 3.43Å; E428-F432 PolarHBondContact O-N 3.04Å; M429-F432 HydrophobicContact CE-CD2 3.95Å; M429-F432 CarbonylContact O-C 3.47Å; M429-F432 WeakPolarHBondContact O-CA 3.45Å; M429-F432 PolarHBondContact O-N 3.19Å; M429-F432 HydrophobicContact SD-CB 3.86Å; M429-F432 HydrophobicContact SD-CD2 3.8Å; M429-F432 HydrophobicContact SD-CG 4.26Å; F432-H436 WeakPolarHBondContact O-CA 3.48Å; F432-H436 WeakPolarHBondContact O-CB 3.17Å; F432-H436 PolarHBondContact O-N 3.13Å; F432-I496 HydrophobicContact CB-CB 4.2Å; F432-I496 HydrophobicContact CB-CD1 3.76Å; F432-I496 HydrophobicContact CB-CG1 3.7Å; F432-I496 HydrophobicContact CB-CG2 3.57Å; F432-I496 WeakPolarHBondContact O-CD1 3.48Å
433	Q	81.8	Confident	75.1	Confident	38 Å²	38	40 Å²	40	18%	0.178	21%	0.214	C	C	.	.	H	α-helix	trans	-74.6	-54.1	-179.1	-169.2	-171.7	45.1	0	0	109.7	M429 A431 K435 H436 E437 I496 S497 L500	M429-Q433 WeakPolarHBondContact O-CB 3.31Å; M429-Q433 PolarHBondContact O-N 3.24Å; A431-Q433 PolarHBondContact O-N 3.03Å; Q433-K435 VanDerWaalsContact C-N 3.29Å; Q433-K435 PolarHBondContact O-N 3.05Å; Q433-H436 CarbonylContact O-C 3.53Å; Q433-H436 WeakPolarHBondContact O-CA 3.46Å; Q433-H436 WeakPolarHBondContact O-CB 3.43Å; Q433-H436 PolarHBondContact O-N 3.33Å; Q433-E437 WeakPolarHBondContact O-CB 3.34Å; Q433-E437 WeakPolarHBondContact O-CG 3.3Å; Q433-E437 PolarHBondContact O-N 3.01Å; Q433-I496 HydrophobicContact CB-CG2 3.5Å; Q433-I496 VanDerWaalsContact CB-CG2 3.5Å; Q433-I496 HydrophobicContact CG-CG2 4.28Å; Q433-S497 PolarHBondContact NE2-OG 2.64Å; Q433-S497 VanDerWaalsContact NE2-OG 3.07Å; Q433-L500 HydrophobicContact CB-CD1 3.34Å; Q433-L500 VanDerWaalsContact CD-CD1 3.49Å; Q433-L500 HydrophobicContact CG-CD1 4.01Å
434	K	70	Confident	76	Confident	100 Å²	100	42.2 Å²	42.2	44%	0.435	23%	0.225	S	C	.	.	H	α-helix	trans	-64.2	-29.8	174	-65.7	175.5	178.2	176.9	0	112.2	R430 H436 A438	R430-K434 WeakPolarHBondContact O-CA 3.5Å; R430-K434 WeakPolarHBondContact O-CB 3.44Å; R430-K434 WeakPolarHBondContact O-CG 3.14Å; R430-K434 PolarHBondContact O-N 3.47Å; K434-H436 VanDerWaalsContact C-N 3.35Å; K434-A438 VanDerWaalsContact O-CA 3.32Å; K434-A438 WeakPolarHBondContact O-CA 3.46Å; K434-A438 WeakPolarHBondContact O-CB 3.46Å; K434-A438 PolarHBondContact O-N 3.43Å
435	K	81.8	Confident	77	Confident	126 Å²	126	45.3 Å²	45.3	55%	0.548	25%	0.25	S	C	.	.	H	α-helix	trans	-74.8	-29.2	171.1	-177.7	-179	-178.8	179.1	0	109.7	A431 Q433 F439	A431-K435 WeakPolarHBondContact O-CA 3.49Å; A431-K435 WeakPolarHBondContact O-CB 3.29Å; A431-K435 PolarHBondContact O-N 3.4Å; Q433-K435 VanDerWaalsContact C-N 3.29Å; Q433-K435 PolarHBondContact O-N 3.05Å; K435-F439 WeakPolarHBondContact O-CA 3.37Å; K435-F439 WeakPolarHBondContact O-CB 3.37Å; K435-F439 PolarHBondContact O-N 3.04Å
436	H	85.5	Confident	78.3	Confident	4 Å²	4	45.8 Å²	45.8	2%	0.019	25%	0.252	C	S	.	.	H	α-helix	trans	-75.2	-44.4	173.1	-164	76	0	0	0	111.2	F432 Q433 K434 F439 Q440 S489 E493 I496	F432-H436 WeakPolarHBondContact O-CA 3.48Å; F432-H436 WeakPolarHBondContact O-CB 3.17Å; F432-H436 PolarHBondContact O-N 3.13Å; Q433-H436 CarbonylContact O-C 3.53Å; Q433-H436 WeakPolarHBondContact O-CA 3.46Å; Q433-H436 WeakPolarHBondContact O-CB 3.43Å; Q433-H436 PolarHBondContact O-N 3.33Å; K434-H436 VanDerWaalsContact C-N 3.35Å; H436-F439 CarbonylContact O-C 3.58Å; H436-F439 WeakPolarHBondContact O-CB 3.36Å; H436-F439 PolarHBondContact O-N 3.26Å; H436-Q440 PolarHBondContact CD2-NE2 3.36Å; H436-Q440 PolarHBondContact NE2-NE2 3.45Å; H436-Q440 VanDerWaalsContact NE2-NE2 3.12Å; H436-Q440 WeakPolarHBondContact O-CB 3.29Å; H436-Q440 VanDerWaalsContact O-CG 3.31Å; H436-Q440 WeakPolarHBondContact O-CG 3.19Å; H436-Q440 PolarHBondContact O-N 3.27Å; H436-S489 PolarHBondContact CE1-O 3.13Å; H436-S489 PolarHBondContact CE1-OG 3.25Å; H436-S489 PolarHBondContact NE2-O 3.26Å; H436-S489 PolarHBondContact NE2-OG 2.92Å; H436-S489 VanDerWaalsContact NE2-OG 3.13Å; H436-E493 VanDerWaalsContact CD2-CA 3.47Å; H436-E493 WeakPolarHBondContact CD2-CA 3.44Å; H436-E493 WeakPolarHBondContact CD2-CB 3.24Å; H436-E493 WeakPolarHBondContact NE2-CB 3.4Å; H436-E493 PolarHBondContact NE2-N 3.43Å; H436-I496 HydrophobicContact CB-CD1 4.02Å
437	E	84.2	Confident	79.5	Confident	91 Å²	91	50 Å²	50	43%	0.425	27%	0.272	S	S	.	.	H	α-helix	trans	-64.8	-43.9	172.2	-70.7	171.1	-177.4	0	0	110.7	Q433 F439 Q440 S441	Q433-E437 WeakPolarHBondContact O-CB 3.34Å; Q433-E437 WeakPolarHBondContact O-CG 3.3Å; Q433-E437 PolarHBondContact O-N 3.01Å; E437-F439 VanDerWaalsContact C-N 3.33Å; E437-Q440 CarbonylContact O-C 3.52Å; E437-Q440 PolarHBondContact O-N 3.06Å; E437-S441 VanDerWaalsContact O-CB 3.27Å; E437-S441 WeakPolarHBondContact O-CB 3.45Å; E437-S441 PolarHBondContact O-N 3.39Å
438	A	79.6	Confident	81	Confident	55 Å²	55	51.9 Å²	51.9	46%	0.455	29%	0.288	S	S	.	.	H	α-helix	trans	-67.3	-34.8	172.5	0	0	0	0	0	110.6	K434 S441 D442	K434-A438 VanDerWaalsContact O-CA 3.32Å; K434-A438 WeakPolarHBondContact O-CA 3.46Å; K434-A438 WeakPolarHBondContact O-CB 3.46Å; K434-A438 PolarHBondContact O-N 3.43Å; A438-S441 PolarHBondContact O-N 2.87Å; A438-D442 WeakPolarHBondContact O-CA 3.38Å; A438-D442 WeakPolarHBondContact O-CB 3.25Å; A438-D442 PolarHBondContact O-N 3.07Å
439	F	87.6	Confident	81.9	Confident	28 Å²	28	54 Å²	54	12%	0.123	29%	0.294	C	S	.	.	H	α-helix	trans	-66.1	-40.7	171.3	174.9	-90.1	0	0	0	111	K412 L416 K435 H436 E437 M443 M485 S489	K412-F439 HydrophobicContact CD-CE2 3.85Å; K412-F439 HydrophobicContact CG-CE2 4.42Å; L416-F439 HydrophobicContact CD1-CE1 3.88Å; L416-F439 HydrophobicContact CD1-CZ 3.71Å; L416-F439 HydrophobicContact CD2-CD1 3.89Å; L416-F439 HydrophobicContact CD2-CE1 3.55Å; L416-F439 HydrophobicContact CD2-CE2 4.33Å; L416-F439 HydrophobicContact CD2-CG 4.45Å; L416-F439 HydrophobicContact CD2-CZ 3.8Å; L416-F439 HydrophobicContact CG-CE1 4.23Å; L416-F439 HydrophobicContact CG-CZ 4.07Å; K435-F439 WeakPolarHBondContact O-CA 3.37Å; K435-F439 WeakPolarHBondContact O-CB 3.37Å; K435-F439 PolarHBondContact O-N 3.04Å; H436-F439 CarbonylContact O-C 3.58Å; H436-F439 WeakPolarHBondContact O-CB 3.36Å; H436-F439 PolarHBondContact O-N 3.26Å; E437-F439 VanDerWaalsContact C-N 3.33Å; F439-M443 HydrophobicContact CE1-CB 4.45Å; F439-M443 HydrophobicContact CE1-SD 3.83Å; F439-M443 HydrophobicContact CZ-SD 4.31Å; F439-M443 WeakPolarHBondContact O-CA 3.36Å; F439-M443 WeakPolarHBondContact O-CB 3.31Å; F439-M443 PolarHBondContact O-N 3Å; F439-M485 HydrophobicContact CE2-CE 4.18Å; F439-M485 HydrophobicContact CZ-CE 3.68Å; F439-S489 WeakPolarHBondContact CD1-OG 3.47Å
440	Q	85.8	Confident	82.7	Confident	48 Å²	48	54.4 Å²	54.4	22%	0.224	30%	0.296	C	S	.	.	H	α-helix	trans	-68.6	-36.2	174.9	-74.7	-178.6	-1.8	0	0	111.8	H436 E437 T444 S489 E493	H436-Q440 PolarHBondContact CD2-NE2 3.36Å; H436-Q440 PolarHBondContact NE2-NE2 3.45Å; H436-Q440 VanDerWaalsContact NE2-NE2 3.12Å; H436-Q440 WeakPolarHBondContact O-CB 3.29Å; H436-Q440 VanDerWaalsContact O-CG 3.31Å; H436-Q440 WeakPolarHBondContact O-CG 3.19Å; H436-Q440 PolarHBondContact O-N 3.27Å; E437-Q440 CarbonylContact O-C 3.52Å; E437-Q440 PolarHBondContact O-N 3.06Å; Q440-T444 WeakPolarHBondContact O-CB 3.36Å; Q440-T444 PolarHBondContact O-N 2.88Å; Q440-T444 PolarHBondContact O-OG1 3.4Å; Q440-S489 WeakPolarHBondContact CG-OG 3.24Å; Q440-E493 PolarHBondContact NE2-OE2 2.91Å
441	S	85.3	Confident	83.7	Confident	80 Å²	80	56.8 Å²	56.8	56%	0.559	31%	0.31	S	S	*	.	H	α-helix	trans	-68.3	-44.7	174.1	-176.2	0	0	0	0	110.9	E437 A438 T444 A445	E437-S441 VanDerWaalsContact O-CB 3.27Å; E437-S441 WeakPolarHBondContact O-CB 3.45Å; E437-S441 PolarHBondContact O-N 3.39Å; A438-S441 PolarHBondContact O-N 2.87Å; S441-T444 CarbonylContact O-C 3.42Å; S441-T444 WeakPolarHBondContact O-CB 3.32Å; S441-T444 PolarHBondContact O-N 3.3Å; S441-A445 PolarHBondContact O-N 3.05Å
442	D	85.3	Confident	85.1	Confident	58 Å²	58	60.2 Å²	60.2	31%	0.31	32%	0.32	S	S	.	.	H	α-helix	trans	-62.5	-45.1	173.2	-179.4	54	0	0	0	110.9	W408 A438 T444 A445 H446	W408-D442 PolarHBondContact NE1-OD2 3.49Å; A438-D442 WeakPolarHBondContact O-CA 3.38Å; A438-D442 WeakPolarHBondContact O-CB 3.25Å; A438-D442 PolarHBondContact O-N 3.07Å; D442-T444 PolarHBondContact O-N 3.15Å; D442-A445 CarbonylContact O-C 3.5Å; D442-A445 WeakPolarHBondContact O-CB 3.35Å; D442-A445 PolarHBondContact O-N 3.32Å; D442-A445 VanDerWaalsContact O-N 3.14Å; D442-H446 WeakPolarHBondContact O-CB 3.27Å; D442-H446 PolarHBondContact O-CD2 2.92Å; D442-H446 PolarHBondContact O-N 3.05Å; D442-H446 IonicContact OD1-CD2 2.92Å; D442-H446 PolarHBondContact OD1-CD2 3.03Å; D442-H446 VanDerWaalsContact OD1-CD2 3.26Å; D442-H446 IonicContact OD1-NE2 2.84Å; D442-H446 PolarHBondContact OD1-NE2 3.47Å
443	M	86.5	Confident	85.7	Confident	19 Å²	19	59.4 Å²	59.4	9%	0.094	32%	0.316	C	S	.	.	H	α-helix	trans	-56.3	-52.9	171.2	-166.4	172.3	80.2	0	0	108.3	W408 F439 A445 H446 H447 W482 R486	W408-M443 HydrophobicContact CH2-CG 4.48Å; F439-M443 HydrophobicContact CE1-CB 4.45Å; F439-M443 HydrophobicContact CE1-SD 3.83Å; F439-M443 HydrophobicContact CZ-SD 4.31Å; F439-M443 WeakPolarHBondContact O-CA 3.36Å; F439-M443 WeakPolarHBondContact O-CB 3.31Å; F439-M443 PolarHBondContact O-N 3Å; M443-A445 VanDerWaalsContact C-N 3.26Å; M443-A445 PolarHBondContact O-N 2.95Å; M443-H446 CarbonylContact O-C 3.22Å; M443-H446 WeakPolarHBondContact O-CA 3.44Å; M443-H446 WeakPolarHBondContact O-CB 3.49Å; M443-H446 PolarHBondContact O-N 3.03Å; M443-H447 PolarHBondContact O-N 2.8Å; M443-W482 HydrophobicContact CB-CH2 4.18Å; M443-W482 HydrophobicContact CG-CH2 3.21Å; M443-W482 HydrophobicContact CG-CZ2 3.9Å; M443-W482 HydrophobicContact CG-CZ3 3.61Å; M443-W482 WeakPolarHBondContact O-CH2 3.48Å; M443-R486 HydrophobicContact CE-CB 4.36Å; M443-R486 HydrophobicContact CE-CG 4.13Å
444	T	86.1	Confident	86.3	Confident	104 Å²	104	61 Å²	61	64%	0.638	32%	0.324	S	S	*	.	H	α-helix	trans	-55.9	-39.6	176.6	-54.5	0	0	0	0	112.7	Q440 S441 D442 H447	Q440-T444 WeakPolarHBondContact O-CB 3.36Å; Q440-T444 PolarHBondContact O-N 2.88Å; Q440-T444 PolarHBondContact O-OG1 3.4Å; S441-T444 CarbonylContact O-C 3.42Å; S441-T444 WeakPolarHBondContact O-CB 3.32Å; S441-T444 PolarHBondContact O-N 3.3Å; D442-T444 PolarHBondContact O-N 3.15Å; T444-H447 VanDerWaalsContact O-CB 3.25Å; T444-H447 WeakPolarHBondContact O-CB 3.38Å; T444-H447 PolarHBondContact O-N 3.02Å
445	A	83.7	Confident	87.4	Confident	69 Å²	69	58.7 Å²	58.7	57%	0.57	32%	0.323	S	S	*	.	H	α-helix	trans	-67.7	-34.3	174.6	0	0	0	0	0	113	S441 D442 M443 H447	S441-A445 PolarHBondContact O-N 3.05Å; D442-A445 CarbonylContact O-C 3.5Å; D442-A445 WeakPolarHBondContact O-CB 3.35Å; D442-A445 PolarHBondContact O-N 3.32Å; D442-A445 VanDerWaalsContact O-N 3.14Å; M443-A445 VanDerWaalsContact C-N 3.26Å; M443-A445 PolarHBondContact O-N 2.95Å; A445-H447 VanDerWaalsContact C-N 3.3Å; A445-H447 PolarHBondContact O-N 3.36Å
446	H	85.7	Confident	87.9	Confident	12 Å²	12	53.1 Å²	53.1	6%	0.056	30%	0.3	C	S	.	.	H	α-helix	trans	-74.2	-17.2	176	-88.6	-110.6	0	0	0	113.5	W408 D442 M443 A448 R449 I450 W482	W408-H446 AromaticContact CD1-CE1 3.15Å; W408-H446 AromaticContact CD1-ND1 3.87Å; W408-H446 AromaticContact CD1-NE2 3.46Å; W408-H446 AromaticContact CD2-CE1 3.42Å; W408-H446 VanDerWaalsContact CD2-CE1 3.42Å; W408-H446 AromaticContact CD2-ND1 3.31Å; W408-H446 VanDerWaalsContact CD2-ND1 3.31Å; W408-H446 AromaticContact CE2-CD2 3.87Å; W408-H446 AromaticContact CE2-CE1 3.52Å; W408-H446 AromaticContact CE2-CG 3.68Å; W408-H446 AromaticContact CE2-ND1 3.45Å; W408-H446 AromaticContact CE2-NE2 3.83Å; W408-H446 AromaticContact CE3-ND1 3.65Å; W408-H446 AromaticContact CG-CE1 3.23Å; W408-H446 AromaticContact CG-ND1 3.66Å; W408-H446 HydrophobicContact CH2-CB 4.09Å; W408-H446 HydrophobicContact CZ2-CB 4.08Å; W408-H446 AromaticContact CZ2-CG 3.79Å; W408-H446 AromaticContact CZ2-ND1 3.95Å; W408-H446 HydrophobicContact CZ3-CB 4.44Å; W408-H446 AromaticContact NE1-CD2 3.74Å; W408-H446 AromaticContact NE1-CE1 3.33Å; W408-H446 PolarHBondContact NE1-CE1 3.29Å; W408-H446 VanDerWaalsContact NE1-CE1 3.33Å; W408-H446 AromaticContact NE1-CG 4Å; W408-H446 AromaticContact NE1-ND1 3.76Å; W408-H446 AromaticContact NE1-NE2 3.35Å; W408-H446 PolarHBondContact NE1-NE2 3.39Å; D442-H446 WeakPolarHBondContact O-CB 3.27Å; D442-H446 PolarHBondContact O-CD2 2.92Å; D442-H446 PolarHBondContact O-N 3.05Å; D442-H446 IonicContact OD1-CD2 2.92Å; D442-H446 PolarHBondContact OD1-CD2 3.03Å; D442-H446 VanDerWaalsContact OD1-CD2 3.26Å; D442-H446 IonicContact OD1-NE2 2.84Å; D442-H446 PolarHBondContact OD1-NE2 3.47Å; M443-H446 CarbonylContact O-C 3.22Å; M443-H446 WeakPolarHBondContact O-CA 3.44Å; M443-H446 WeakPolarHBondContact O-CB 3.49Å; M443-H446 PolarHBondContact O-N 3.03Å; H446-A448 VanDerWaalsContact C-N 3.3Å; H446-A448 PolarHBondContact O-N 3.39Å; H446-R449 PolarHBondContact CE1-NH1 3.08Å; H446-R449 VanDerWaalsContact O-CB 3.28Å; H446-R449 WeakPolarHBondContact O-CB 3.41Å; H446-R449 PolarHBondContact O-N 3.2Å; H446-I450 PolarHBondContact O-N 3.43Å; H446-W482 HydrophobicContact CB-CH2 4.37Å; H446-W482 HydrophobicContact CB-CZ3 4.15Å
447	H	88	Confident	88.2	Confident	88 Å²	88	53.2 Å²	53.2	41%	0.407	30%	0.301	S	S	.	.	H	α-helix	trans	-56.1	-46.3	174.9	-174.2	52	0	0	0	111.6	M443 T444 A445 R449 I450 E451 W482	M443-H447 PolarHBondContact O-N 2.8Å; T444-H447 VanDerWaalsContact O-CB 3.25Å; T444-H447 WeakPolarHBondContact O-CB 3.38Å; T444-H447 PolarHBondContact O-N 3.02Å; A445-H447 VanDerWaalsContact C-N 3.3Å; A445-H447 PolarHBondContact O-N 3.36Å; H447-R449 PolarHBondContact O-N 2.7Å; H447-I450 WeakPolarHBondContact O-CB 3.37Å; H447-I450 PolarHBondContact O-N 3.1Å; H447-E451 IonicContact NE2-OE1 2.75Å; H447-E451 PolarHBondContact O-N 3.3Å; H447-W482 HydrophobicContact CB-CH2 4.45Å; H447-W482 HydrophobicContact CB-CZ2 4.15Å
448	A	87.6	Confident	88.7	Confident	41 Å²	41	54.2 Å²	54.2	34%	0.339	31%	0.305	S	S	.	.	H	α-helix	trans	-60.3	-27.9	176.2	0	0	0	0	0	112.9	H446 H452	H446-A448 VanDerWaalsContact C-N 3.3Å; H446-A448 PolarHBondContact O-N 3.39Å; A448-H452 PolarHBondContact O-N 3.2Å; A448-H452 PolarHBondContact O-ND1 2.89Å
449	R	88.7	Confident	89.2	Confident	77 Å²	77	54 Å²	54	29%	0.291	30%	0.295	S	S	.	.	H	α-helix	trans	-70	-36.3	176.3	-170	175.5	-62.2	175.8	5.1	111.7	H446 H447 H452 I453	H446-R449 PolarHBondContact CE1-NH1 3.08Å; H446-R449 VanDerWaalsContact O-CB 3.28Å; H446-R449 WeakPolarHBondContact O-CB 3.41Å; H446-R449 PolarHBondContact O-N 3.2Å; H447-R449 PolarHBondContact O-N 2.7Å; R449-H452 PolarHBondContact O-N 3.33Å; R449-I453 HydrophobicContact CG-CD1 4.43Å; R449-I453 WeakPolarHBondContact O-CG1 3.4Å; R449-I453 PolarHBondContact O-N 3.01Å
450	I	91.3	Very high	89.4	Confident	9 Å²	9	52.7 Å²	52.7	5%	0.046	29%	0.289	C	S	.	.	H	α-helix	trans	-68	-44.9	176.3	-65.4	172.7	0	0	0	109.8	H446 H447 H452 I453 Q454 I478 I479 W482	H446-I450 PolarHBondContact O-N 3.43Å; H447-I450 WeakPolarHBondContact O-CB 3.37Å; H447-I450 PolarHBondContact O-N 3.1Å; I450-H452 VanDerWaalsContact C-N 3.26Å; I450-H452 PolarHBondContact O-N 2.68Å; I450-I453 PolarHBondContact O-N 3.05Å; I450-Q454 WeakPolarHBondContact O-CG 3.36Å; I450-Q454 PolarHBondContact O-N 3.33Å; I450-I478 HydrophobicContact CG1-CG2 4.37Å; I450-I479 HydrophobicContact CG2-CG1 4.36Å; I450-W482 HydrophobicContact CD1-CB 3.72Å; I450-W482 HydrophobicContact CD1-CD2 3.14Å; I450-W482 HydrophobicContact CD1-CE3 3.26Å; I450-W482 HydrophobicContact CD1-CG 3.35Å; I450-W482 HydrophobicContact CD1-CH2 4.37Å; I450-W482 HydrophobicContact CD1-CZ2 4.34Å; I450-W482 HydrophobicContact CD1-CZ3 3.88Å
451	E	91.6	Very high	89.7	Confident	98 Å²	98	52.5 Å²	52.5	46%	0.458	29%	0.29	S	S	.	.	H	α-helix	trans	-56.9	-41.3	174.2	-65.1	-177.1	136.6	0	0	111.5	H447 Q454 A455	H447-E451 IonicContact NE2-OE1 2.75Å; H447-E451 PolarHBondContact O-N 3.3Å; E451-Q454 PolarHBondContact O-N 3.4Å; E451-A455 WeakPolarHBondContact O-CB 3.34Å; E451-A455 PolarHBondContact O-N 2.93Å
452	H	91.4	Very high	90	Very high	101 Å²	101	56.2 Å²	56.2	47%	0.468	30%	0.295	S	S	.	.	H	α-helix	trans	-64.7	-38.2	174.5	-68.9	160.5	0	0	0	113.7	A448 R449 I450 A455 L456	A448-H452 PolarHBondContact O-N 3.2Å; A448-H452 PolarHBondContact O-ND1 2.89Å; R449-H452 PolarHBondContact O-N 3.33Å; I450-H452 VanDerWaalsContact C-N 3.26Å; I450-H452 PolarHBondContact O-N 2.68Å; H452-A455 PolarHBondContact O-N 2.96Å; H452-L456 WeakPolarHBondContact O-CG 3.48Å; H452-L456 PolarHBondContact O-N 2.92Å
453	I	92.7	Very high	90.1	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-66.3	-42.2	176.9	-71.4	166.6	0	0	0	110	F398 K401 H405 R449 I450 L456 T457 I478	F398-I453 HydrophobicContact CE2-CG2 4Å; K401-I453 HydrophobicContact CB-CD1 4.43Å; K401-I453 HydrophobicContact CB-CG1 4Å; H405-I453 HydrophobicContact CB-CD1 3.91Å; R449-I453 HydrophobicContact CG-CD1 4.43Å; R449-I453 WeakPolarHBondContact O-CG1 3.4Å; R449-I453 PolarHBondContact O-N 3.01Å; I450-I453 PolarHBondContact O-N 3.05Å; I453-L456 PolarHBondContact O-N 3.45Å; I453-T457 PolarHBondContact O-N 2.98Å; I453-T457 PolarHBondContact O-OG1 3.03Å; I453-I478 HydrophobicContact CD1-CD1 4.2Å; I453-I478 HydrophobicContact CG2-CD1 4.44Å
454	Q	93.5	Very high	90.1	Very high	73 Å²	73	60.5 Å²	60.5	34%	0.341	32%	0.319	S	S	.	.	H	α-helix	trans	-60.5	-48.3	174	-69.6	176	-54.1	0	0	111.2	I450 E451 L456 T457 E458 I479	I450-Q454 WeakPolarHBondContact O-CG 3.36Å; I450-Q454 PolarHBondContact O-N 3.33Å; E451-Q454 PolarHBondContact O-N 3.4Å; Q454-L456 PolarHBondContact O-N 3.47Å; Q454-T457 WeakPolarHBondContact O-CB 3.25Å; Q454-T457 PolarHBondContact O-N 2.99Å; Q454-T457 VanDerWaalsContact O-N 3.08Å; Q454-E458 PolarHBondContact O-N 2.96Å; Q454-I479 HydrophobicContact CG-CD1 4.17Å; Q454-I479 VanDerWaalsContact NE2-CD1 3.31Å
455	A	93.6	Very high	90.1	Very high	50 Å²	50	56.4 Å²	56.4	41%	0.413	29%	0.292	S	S	.	.	H	α-helix	trans	-60.2	-41.1	178.4	0	0	0	0	0	113	E451 H452 T457 E458 E459	E451-A455 WeakPolarHBondContact O-CB 3.34Å; E451-A455 PolarHBondContact O-N 2.93Å; H452-A455 PolarHBondContact O-N 2.96Å; A455-T457 VanDerWaalsContact C-N 3.33Å; A455-T457 PolarHBondContact O-N 2.92Å; A455-E458 PolarHBondContact O-N 3.42Å; A455-E459 WeakPolarHBondContact O-CB 3.26Å; A455-E459 PolarHBondContact O-N 3.36Å
456	L	92	Very high	90.2	Very high	10 Å²	10	61 Å²	61	5%	0.052	30%	0.299	C	S	.	.	H	α-helix	trans	-63.6	-38.8	174.3	-74.8	175.1	0	0	0	112.2	L394 K397 F398 K401 H452 I453 Q454 E459 L460	L394-L456 HydrophobicContact CD2-CD2 3.7Å; K397-L456 HydrophobicContact CD-CD1 4.45Å; K397-L456 HydrophobicContact CD-CD2 4.13Å; K397-L456 HydrophobicContact CG-CD1 4.08Å; F398-L456 HydrophobicContact CB-CD1 4.49Å; F398-L456 HydrophobicContact CD2-CB 4.37Å; K401-L456 HydrophobicContact CD-CD1 3.64Å; H452-L456 WeakPolarHBondContact O-CG 3.48Å; H452-L456 PolarHBondContact O-N 2.92Å; I453-L456 PolarHBondContact O-N 3.45Å; Q454-L456 PolarHBondContact O-N 3.47Å; L456-E459 PolarHBondContact O-N 2.85Å; L456-L460 WeakPolarHBondContact O-CB 3.29Å; L456-L460 WeakPolarHBondContact O-CG 3.26Å; L456-L460 PolarHBondContact O-N 2.7Å
457	T	92.9	Very high	90.3	Very high	6 Å²	6	63.7 Å²	63.7	4%	0.037	31%	0.314	C	S	.	.	H	α-helix	trans	-64.6	-44.5	177.8	-52.3	0	0	0	0	110.5	F398 I453 Q454 A455 E459 L460 N461 F471 N472 C475	F398-T457 VanDerWaalsContact CE2-OG1 3.32Å; F398-T457 WeakPolarHBondContact CE2-OG1 3.37Å; I453-T457 PolarHBondContact O-N 2.98Å; I453-T457 PolarHBondContact O-OG1 3.03Å; Q454-T457 WeakPolarHBondContact O-CB 3.25Å; Q454-T457 PolarHBondContact O-N 2.99Å; Q454-T457 VanDerWaalsContact O-N 3.08Å; A455-T457 VanDerWaalsContact C-N 3.33Å; A455-T457 PolarHBondContact O-N 2.92Å; T457-E459 VanDerWaalsContact C-N 3.33Å; T457-E459 PolarHBondContact O-N 3.32Å; T457-L460 PolarHBondContact O-N 3.34Å; T457-N461 WeakPolarHBondContact O-CB 3.49Å; T457-N461 PolarHBondContact O-N 3.27Å; T457-N461 PolarHBondContact O-ND2 3.4Å; T457-N461 PolarHBondContact O-OD1 2.81Å; T457-F471 HydrophobicContact CG2-CB 4.38Å; T457-N472 WeakPolarHBondContact CG2-OD1 3.46Å; T457-C475 HydrophobicContact CG2-CB 4.36Å
458	E	92.9	Very high	90.4	Very high	111 Å²	111	61.7 Å²	61.7	52%	0.519	31%	0.306	S	S	.	.	H	α-helix	trans	-60.9	-39.7	173.6	-70	178.9	-170.9	0	0	112.7	Q454 A455 N461 K462	Q454-E458 PolarHBondContact O-N 2.96Å; A455-E458 PolarHBondContact O-N 3.42Å; E458-N461 PolarHBondContact O-N 3.01Å; E458-K462 VanDerWaalsContact O-CG 3.28Å; E458-K462 WeakPolarHBondContact O-CG 3.37Å; E458-K462 PolarHBondContact O-N 3.43Å
459	E	91.2	Very high	90.6	Very high	52 Å²	52	66 Å²	66	24%	0.243	32%	0.324	C	S	.	.	H	α-helix	trans	-68	-44.4	178.3	-164.4	179.9	172.5	0	0	112.1	R390 L394 A455 L456 T457 N461 K462 L463	R390-E459 IonicContact CZ-OE1 2.75Å; R390-E459 VanDerWaalsContact CZ-OE1 3.25Å; R390-E459 IonicContact NE-OE1 2.94Å; R390-E459 PolarHBondContact NE-OE1 2.94Å; R390-E459 IonicContact NH2-OE1 2.74Å; R390-E459 PolarHBondContact NH2-OE1 2.94Å; L394-E459 HydrophobicContact CD1-CB 4.42Å; L394-E459 HydrophobicContact CD1-CG 3.77Å; L394-E459 WeakPolarHBondContact CD2-OE2 3.31Å; A455-E459 WeakPolarHBondContact O-CB 3.26Å; A455-E459 PolarHBondContact O-N 3.36Å; L456-E459 PolarHBondContact O-N 2.85Å; T457-E459 VanDerWaalsContact C-N 3.33Å; T457-E459 PolarHBondContact O-N 3.32Å; E459-N461 VanDerWaalsContact C-N 3.28Å; E459-N461 PolarHBondContact O-N 3.29Å; E459-K462 PolarHBondContact O-N 3.35Å; E459-L463 PolarHBondContact O-N 3.01Å; E459-L463 VanDerWaalsContact O-N 3.1Å
460	L	92.2	Very high	90.8	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-59.8	-38.4	173.3	-76.2	167.6	0	0	0	112	L391 L394 F398 L456 T457 L463 N464 H465 F471	L391-L460 HydrophobicContact CD2-CD2 4.1Å; L394-L460 HydrophobicContact CB-CD2 3.73Å; L394-L460 HydrophobicContact CB-CG 4.19Å; F398-L460 HydrophobicContact CB-CD1 4.08Å; F398-L460 HydrophobicContact CD2-CD1 4.37Å; F398-L460 HydrophobicContact CG-CD1 4.24Å; L456-L460 WeakPolarHBondContact O-CB 3.29Å; L456-L460 WeakPolarHBondContact O-CG 3.26Å; L456-L460 PolarHBondContact O-N 2.7Å; T457-L460 PolarHBondContact O-N 3.34Å; L460-L463 PolarHBondContact O-N 2.9Å; L460-N464 PolarHBondContact O-N 2.84Å; L460-H465 PolarHBondContact O-N 2.65Å; L460-F471 HydrophobicContact CB-CD2 4.48Å; L460-F471 HydrophobicContact CD1-CD1 4.05Å; L460-F471 HydrophobicContact CD1-CD2 4.06Å; L460-F471 HydrophobicContact CD1-CE1 4.13Å; L460-F471 HydrophobicContact CD1-CE2 4.14Å; L460-F471 HydrophobicContact CD1-CG 4.02Å; L460-F471 HydrophobicContact CD1-CZ 4.17Å; L460-F471 HydrophobicContact CD2-CE2 4.46Å
461	N	91.1	Very high	90.8	Very high	44 Å²	44	64.7 Å²	64.7	24%	0.235	33%	0.327	C	S	.	.	H	α-helix	trans	-66.8	-43.3	175	-70	-17	0	0	0	111.7	T457 E458 E459 L463 N464 I468 N472	T457-N461 WeakPolarHBondContact O-CB 3.49Å; T457-N461 PolarHBondContact O-N 3.27Å; T457-N461 PolarHBondContact O-ND2 3.4Å; T457-N461 PolarHBondContact O-OD1 2.81Å; E458-N461 PolarHBondContact O-N 3.01Å; E459-N461 VanDerWaalsContact C-N 3.28Å; E459-N461 PolarHBondContact O-N 3.29Å; N461-L463 VanDerWaalsContact C-N 3.27Å; N461-L463 PolarHBondContact O-N 2.92Å; N461-N464 PolarHBondContact O-N 2.85Å; N461-I468 VanDerWaalsContact OD1-CG2 3.28Å; N461-I468 WeakPolarHBondContact OD1-CG2 3.43Å; N461-N472 PolarHBondContact ND2-OD1 3.45Å
462	K	91.4	Very high	90.9	Very high	157 Å²	157	62.3 Å²	62.3	68%	0.683	32%	0.318	S	S	*	.	H	α-helix	trans	-60.8	-33.8	176.9	-76.8	168	-175.2	166.2	0	113	E458 E459 N464	E458-K462 VanDerWaalsContact O-CG 3.28Å; E458-K462 WeakPolarHBondContact O-CG 3.37Å; E458-K462 PolarHBondContact O-N 3.43Å; E459-K462 PolarHBondContact O-N 3.35Å; K462-N464 VanDerWaalsContact C-N 3.32Å
463	L	88.7	Confident	91.1	Very high	42 Å²	42	64.1 Å²	64.1	22%	0.22	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	7.5	180	-66.1	175.1	0	0	0	114.1	R387 R390 L391 L394 E459 L460 N461 H465	R387-L463 PolarHBondContact NH1-O 3.4Å; R390-L463 HydrophobicContact CG-CD1 4.12Å; L391-L463 HydrophobicContact CD2-CB 3.52Å; L391-L463 HydrophobicContact CD2-CD1 4.06Å; L391-L463 HydrophobicContact CD2-CG 4.46Å; L391-L463 HydrophobicContact CG-CB 4.2Å; L391-L463 HydrophobicContact CG-CD1 4.45Å; L394-L463 HydrophobicContact CD1-CD1 3.71Å; E459-L463 PolarHBondContact O-N 3.01Å; E459-L463 VanDerWaalsContact O-N 3.1Å; L460-L463 PolarHBondContact O-N 2.9Å; N461-L463 VanDerWaalsContact C-N 3.27Å; N461-L463 PolarHBondContact O-N 2.92Å; L463-H465 PolarHBondContact O-N 3.07Å
464	N	86.6	Confident	91.2	Very high	126 Å²	126	66.5 Å²	66.5	67%	0.674	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	48.6	177.7	-67.8	-41.9	0	0	0	114.2	L460 N461 K462	L460-N464 PolarHBondContact O-N 2.84Å; N461-N464 PolarHBondContact O-N 2.85Å; K462-N464 VanDerWaalsContact C-N 3.32Å
465	H	85.7	Confident	91.2	Very high	18 Å²	18	63.4 Å²	63.4	8%	0.083	32%	0.321	C	S	.	.			trans	-59	141.3	174.4	-166.5	-64.1	0	0	0	111.1	L391 L460 L463 N467 I468 F471	L391-H465 HydrophobicContact CD2-CB 3.97Å; L460-H465 PolarHBondContact O-N 2.65Å; L463-H465 PolarHBondContact O-N 3.07Å; H465-N467 PolarHBondContact ND1-N 2.8Å; H465-N467 VanDerWaalsContact ND1-N 3.14Å; H465-N467 PolarHBondContact O-N 2.9Å; H465-I468 WeakPolarHBondContact O-CD1 3.44Å; H465-I468 WeakPolarHBondContact O-CG1 3.43Å; H465-I468 PolarHBondContact O-N 3.15Å; H465-F471 HydrophobicContact CB-CE2 4.2Å; H465-F471 AromaticContact CD2-CE2 3.77Å; H465-F471 AromaticContact CE1-CE2 3.7Å; H465-F471 AromaticContact CE1-CZ 3.94Å; H465-F471 AromaticContact CG-CE2 3.64Å; H465-F471 AromaticContact ND1-CE2 3.61Å; H465-F471 AromaticContact NE2-CE2 3.82Å; H465-F471 AromaticContact NE2-CZ 3.83Å
466	F	85.1	Confident	91.3	Very high	164 Å²	164	65.7 Å²	65.7	72%	0.719	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-10.3	-178.5	69.4	-92.2	0	0	0	115.5
467	N	87.6	Confident	91.3	Very high	69 Å²	69	69 Å²	69	37%	0.369	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	33.1	-172.4	-160.7	9.5	0	0	0	112.4	H465 N469 A470 F471	H465-N467 PolarHBondContact ND1-N 2.8Å; H465-N467 VanDerWaalsContact ND1-N 3.14Å; H465-N467 PolarHBondContact O-N 2.9Å; N467-N469 PolarHBondContact O-N 3.05Å; N467-N469 VanDerWaalsContact O-N 3.16Å; N467-A470 PolarHBondContact O-N 3.25Å; N467-A470 WeakPolarHBondContact OD1-CB 3.48Å; N467-F471 HydrophobicContact CB-CE2 4.31Å; N467-F471 WeakPolarHBondContact O-CD2 3.38Å; N467-F471 PolarHBondContact O-N 2.97Å
468	I	90	Very high	91.3	Very high	47 Å²	47	69.1 Å²	69.1	24%	0.241	35%	0.348	C	S	.	.	H	α-helix	trans	-46.8	-42.8	178.2	-78.9	154.5	0	0	0	112.8	N461 H465 A470 F471 N472	N461-I468 VanDerWaalsContact OD1-CG2 3.28Å; N461-I468 WeakPolarHBondContact OD1-CG2 3.43Å; H465-I468 WeakPolarHBondContact O-CD1 3.44Å; H465-I468 WeakPolarHBondContact O-CG1 3.43Å; H465-I468 PolarHBondContact O-N 3.15Å; I468-A470 PolarHBondContact O-N 3.05Å; I468-F471 PolarHBondContact O-N 3.36Å; I468-N472 VanDerWaalsContact CG2-ND2 3.34Å; I468-N472 WeakPolarHBondContact CG2-ND2 3.49Å; I468-N472 PolarHBondContact O-N 3.02Å; I468-N472 VanDerWaalsContact O-N 3.1Å; I468-N472 PolarHBondContact O-ND2 2.89Å
469	N	92.2	Very high	91.3	Very high	131 Å²	131	65.9 Å²	65.9	70%	0.701	33%	0.333	S	S	*	.	H	α-helix	trans	-62.1	-40.6	-176.2	-67.2	-26	0	0	0	113	N467 Q473	N467-N469 PolarHBondContact O-N 3.05Å; N467-N469 VanDerWaalsContact O-N 3.16Å; N469-Q473 WeakPolarHBondContact O-CB 3.27Å; N469-Q473 PolarHBondContact O-N 3.33Å; N469-Q473 VanDerWaalsContact O-N 3.13Å
470	A	92.3	Very high	91.4	Very high	39 Å²	39	68 Å²	68	32%	0.322	35%	0.35	S	S	.	.	H	α-helix	trans	-68.4	-38.5	179.5	0	0	0	0	0	112	N467 I468 R474	N467-A470 PolarHBondContact O-N 3.25Å; N467-A470 WeakPolarHBondContact OD1-CB 3.48Å; I468-A470 PolarHBondContact O-N 3.05Å; A470-R474 PolarHBondContact O-N 3.48Å
471	F	93.2	Very high	91.4	Very high	20 Å²	20	69.7 Å²	69.7	9%	0.088	36%	0.361	C	S	.	.	H	α-helix	trans	-64.4	-47.4	177.7	-63.4	-55.9	0	0	0	111.9	A395 F398 T457 L460 H465 N467 I468 Q473 R474 C475	A395-F471 HydrophobicContact CB-CZ 4.07Å; F398-F471 AromaticContact CD1-CD1 3.52Å; F398-F471 HydrophobicContact CD1-CD1 3.52Å; F398-F471 AromaticContact CD1-CE1 3.83Å; F398-F471 HydrophobicContact CD1-CE1 3.83Å; F398-F471 AromaticContact CE1-CD1 3.49Å; F398-F471 HydrophobicContact CE1-CD1 3.49Å; F398-F471 VanDerWaalsContact CE1-CD1 3.49Å; F398-F471 HydrophobicContact CE1-CE1 4.2Å; F398-F471 HydrophobicContact CE1-CG 4.48Å; F398-F471 HydrophobicContact CG-CD1 4.11Å; F398-F471 HydrophobicContact CG-CE1 4.44Å; F398-F471 HydrophobicContact CZ-CB 4.28Å; F398-F471 HydrophobicContact CZ-CD1 4.04Å; T457-F471 HydrophobicContact CG2-CB 4.38Å; L460-F471 HydrophobicContact CB-CD2 4.48Å; L460-F471 HydrophobicContact CD1-CD1 4.05Å; L460-F471 HydrophobicContact CD1-CD2 4.06Å; L460-F471 HydrophobicContact CD1-CE1 4.13Å; L460-F471 HydrophobicContact CD1-CE2 4.14Å; L460-F471 HydrophobicContact CD1-CG 4.02Å; L460-F471 HydrophobicContact CD1-CZ 4.17Å; L460-F471 HydrophobicContact CD2-CE2 4.46Å; H465-F471 HydrophobicContact CB-CE2 4.2Å; H465-F471 AromaticContact CD2-CE2 3.77Å; H465-F471 AromaticContact CE1-CE2 3.7Å; H465-F471 AromaticContact CE1-CZ 3.94Å; H465-F471 AromaticContact CG-CE2 3.64Å; H465-F471 AromaticContact ND1-CE2 3.61Å; H465-F471 AromaticContact NE2-CE2 3.82Å; H465-F471 AromaticContact NE2-CZ 3.83Å; N467-F471 HydrophobicContact CB-CE2 4.31Å; N467-F471 WeakPolarHBondContact O-CD2 3.38Å; N467-F471 PolarHBondContact O-N 2.97Å; I468-F471 PolarHBondContact O-N 3.36Å; F471-Q473 PolarHBondContact O-N 3.45Å; F471-R474 PolarHBondContact O-N 3.44Å; F471-C475 PolarHBondContact O-N 2.96Å; F471-C475 VanDerWaalsContact O-N 3.09Å
472	N	93.2	Very high	91.4	Very high	48 Å²	48	68.7 Å²	68.7	26%	0.257	35%	0.353	S	S	.	.	H	α-helix	trans	-60.8	-47.4	178.4	-70	-35.8	0	0	0	111.7	T457 N461 I468 R474 C475 D476	T457-N472 WeakPolarHBondContact CG2-OD1 3.46Å; N461-N472 PolarHBondContact ND2-OD1 3.45Å; I468-N472 VanDerWaalsContact CG2-ND2 3.34Å; I468-N472 WeakPolarHBondContact CG2-ND2 3.49Å; I468-N472 PolarHBondContact O-N 3.02Å; I468-N472 VanDerWaalsContact O-N 3.1Å; I468-N472 PolarHBondContact O-ND2 2.89Å; N472-R474 VanDerWaalsContact C-N 3.32Å; N472-R474 PolarHBondContact O-N 3.42Å; N472-C475 WeakPolarHBondContact O-CB 3.37Å; N472-C475 PolarHBondContact O-N 3.35Å; N472-D476 PolarHBondContact O-N 3.43Å
473	Q	95.3	Very high	91.3	Very high	138 Å²	138	65.1 Å²	65.1	65%	0.645	34%	0.342	S	S	*	.	H	α-helix	trans	-60.2	-39.9	-179.2	-174.2	179	9.8	0	0	112.9	N469 F471 T477	N469-Q473 WeakPolarHBondContact O-CB 3.27Å; N469-Q473 PolarHBondContact O-N 3.33Å; N469-Q473 VanDerWaalsContact O-N 3.13Å; F471-Q473 PolarHBondContact O-N 3.45Å; Q473-T477 PolarHBondContact O-N 3.42Å; Q473-T477 PolarHBondContact O-OG1 3.03Å
474	R	95.2	Very high	91.4	Very high	52 Å²	52	68 Å²	68	20%	0.196	36%	0.355	C	S	.	.	H	α-helix	trans	-69.4	-40.2	177.7	-168.4	174.4	-176.6	-176.1	-0.7	111.5	F398 E399 S403 E406 A470 F471 N472 T477 I478	F398-R474 HydrophobicContact CZ-CB 4.25Å; E399-R474 IonicContact OE1-CZ 2.9Å; E399-R474 IonicContact OE1-NH1 2.7Å; E399-R474 PolarHBondContact OE1-NH1 3.37Å; E399-R474 IonicContact OE1-NH2 2.84Å; E399-R474 PolarHBondContact OE1-NH2 2.89Å; E399-R474 IonicContact OE2-CZ 2.82Å; E399-R474 IonicContact OE2-NH1 2.62Å; E399-R474 PolarHBondContact OE2-NH1 3.27Å; S403-R474 PolarHBondContact OG-NH2 3.45Å; S403-R474 VanDerWaalsContact OG-NH2 3.13Å; E406-R474 IonicContact OE1-CZ 3.86Å; E406-R474 IonicContact OE1-NE 3.17Å; E406-R474 PolarHBondContact OE1-NE 2.97Å; E406-R474 IonicContact OE1-NH2 3.84Å; E406-R474 IonicContact OE2-CZ 3.95Å; E406-R474 IonicContact OE2-NE 3.9Å; E406-R474 IonicContact OE2-NH2 3.96Å; E406-R474 PolarHBondContact OE2-NH2 3Å; A470-R474 PolarHBondContact O-N 3.48Å; F471-R474 PolarHBondContact O-N 3.44Å; N472-R474 VanDerWaalsContact C-N 3.32Å; N472-R474 PolarHBondContact O-N 3.42Å; R474-T477 PolarHBondContact O-N 3.07Å; R474-I478 PolarHBondContact O-N 2.8Å
475	C	93.9	Very high	91.6	Very high	8 Å²	8	62 Å²	62	5%	0.054	32%	0.322	C	S	.	.	H	α-helix	trans	-60.2	-45.2	174.7	-172.7	0	0	0	0	111.9	T457 F471 N472 T477 I478 I479	T457-C475 HydrophobicContact CG2-CB 4.36Å; F471-C475 PolarHBondContact O-N 2.96Å; F471-C475 VanDerWaalsContact O-N 3.09Å; N472-C475 WeakPolarHBondContact O-CB 3.37Å; N472-C475 PolarHBondContact O-N 3.35Å; C475-T477 VanDerWaalsContact C-N 3.3Å; C475-T477 PolarHBondContact O-N 3.31Å; C475-I478 PolarHBondContact O-N 2.95Å; C475-I479 WeakPolarHBondContact O-CG1 3.43Å; C475-I479 PolarHBondContact O-N 2.95Å; C475-I479 VanDerWaalsContact O-N 3.11Å
476	D	93.8	Very high	91.8	Very high	97 Å²	97	68.7 Å²	68.7	52%	0.519	35%	0.347	S	S	.	.	H	α-helix	trans	-61.9	-38	179.1	-70.2	-21.4	0	0	0	112.6	N472 I479 T480	N472-D476 PolarHBondContact O-N 3.43Å; D476-I479 PolarHBondContact O-N 3.41Å; D476-T480 PolarHBondContact O-N 3.39Å; D476-T480 VanDerWaalsContact O-N 3.08Å; D476-T480 PolarHBondContact O-OG1 2.89Å
477	T	93.8	Very high	91.9	Very high	81 Å²	81	68.7 Å²	68.7	50%	0.497	35%	0.347	S	S	.	.	H	α-helix	trans	-62.8	-45.3	176.8	-56.4	0	0	0	0	111	Q473 R474 C475 I479 T480 T481	Q473-T477 PolarHBondContact O-N 3.42Å; Q473-T477 PolarHBondContact O-OG1 3.03Å; R474-T477 PolarHBondContact O-N 3.07Å; C475-T477 VanDerWaalsContact C-N 3.3Å; C475-T477 PolarHBondContact O-N 3.31Å; T477-I479 PolarHBondContact O-N 2.97Å; T477-T480 PolarHBondContact O-N 2.84Å; T477-T481 PolarHBondContact O-N 3.16Å; T477-T481 VanDerWaalsContact O-N 3.14Å; T477-T481 PolarHBondContact O-OG1 3.5Å
478	I	93	Very high	92.1	Very high	7 Å²	7	67.7 Å²	67.7	4%	0.036	34%	0.341	C	S	.	.	H	α-helix	trans	-60.2	-45.4	177.7	-73.6	171.6	0	0	0	111.6	C402 H405 E406 I450 I453 R474 C475 T480 T481 W482	C402-I478 HydrophobicContact CB-CD1 3.99Å; H405-I478 VanDerWaalsContact CD2-CG2 3.42Å; H405-I478 WeakPolarHBondContact CD2-CG2 3.4Å; E406-I478 HydrophobicContact CG-CD1 4.46Å; E406-I478 HydrophobicContact CG-CG1 4.39Å; I450-I478 HydrophobicContact CG1-CG2 4.37Å; I453-I478 HydrophobicContact CD1-CD1 4.2Å; I453-I478 HydrophobicContact CG2-CD1 4.44Å; R474-I478 PolarHBondContact O-N 2.8Å; C475-I478 PolarHBondContact O-N 2.95Å; I478-T480 VanDerWaalsContact C-N 3.31Å; I478-T480 PolarHBondContact O-N 3.15Å; I478-T481 PolarHBondContact O-N 3.47Å; I478-W482 WeakPolarHBondContact O-CB 3.48Å; I478-W482 PolarHBondContact O-N 3Å; I478-W482 VanDerWaalsContact O-N 3.11Å
479	I	92.6	Very high	92.1	Very high	43 Å²	43	65.5 Å²	65.5	22%	0.221	33%	0.33	C	S	.	.	H	α-helix	trans	-62.1	-41.3	179.2	-65.4	163.7	0	0	0	110.8	I450 Q454 C475 D476 T477 W482 D483	I450-I479 HydrophobicContact CG2-CG1 4.36Å; Q454-I479 HydrophobicContact CG-CD1 4.17Å; Q454-I479 VanDerWaalsContact NE2-CD1 3.31Å; C475-I479 WeakPolarHBondContact O-CG1 3.43Å; C475-I479 PolarHBondContact O-N 2.95Å; C475-I479 VanDerWaalsContact O-N 3.11Å; D476-I479 PolarHBondContact O-N 3.41Å; T477-I479 PolarHBondContact O-N 2.97Å; I479-W482 WeakPolarHBondContact O-CB 3.44Å; I479-W482 PolarHBondContact O-N 3.02Å; I479-D483 PolarHBondContact O-N 2.95Å
480	T	92.9	Very high	91.7	Very high	96 Å²	96	62.6 Å²	62.6	59%	0.589	32%	0.32	S	S	*	.	H	α-helix	trans	-64.7	-44.8	-179.4	-56.6	0	0	0	0	111.9	D476 T477 I478 W482 D483 E484	D476-T480 PolarHBondContact O-N 3.39Å; D476-T480 VanDerWaalsContact O-N 3.08Å; D476-T480 PolarHBondContact O-OG1 2.89Å; T477-T480 PolarHBondContact O-N 2.84Å; I478-T480 VanDerWaalsContact C-N 3.31Å; I478-T480 PolarHBondContact O-N 3.15Å; T480-W482 VanDerWaalsContact C-N 3.31Å; T480-W482 PolarHBondContact O-N 3.08Å; T480-D483 PolarHBondContact O-N 2.91Å; T480-E484 PolarHBondContact O-N 2.7Å
481	T	91.8	Very high	91.4	Very high	37 Å²	37	65.6 Å²	65.6	23%	0.227	33%	0.327	C	S	.	.	H	α-helix	trans	-67.1	-33.1	178.7	-49.6	0	0	0	0	112.5	T409 P413 T477 I478 E484 M485	T409-T481 HydrophobicContact CG2-CG2 3.3Å; P413-T481 HydrophobicContact CG-CG2 4.26Å; T477-T481 PolarHBondContact O-N 3.16Å; T477-T481 VanDerWaalsContact O-N 3.14Å; T477-T481 PolarHBondContact O-OG1 3.5Å; I478-T481 PolarHBondContact O-N 3.47Å; T481-E484 PolarHBondContact O-N 3.26Å; T481-M485 WeakPolarHBondContact O-CG 3.36Å; T481-M485 PolarHBondContact O-N 3.47Å
482	W	91.4	Very high	91.2	Very high	22 Å²	22	65.9 Å²	65.9	8%	0.083	33%	0.327	C	S	.	.	H	α-helix	trans	-59.5	-47.7	175.5	173.9	-102.7	0	0	0	113.1	W408 M443 H446 H447 I450 I478 I479 T480 E484 M485 R486	W408-W482 HydrophobicContact CH2-CE3 4.36Å; W408-W482 AromaticContact CH2-CZ3 3.68Å; W408-W482 HydrophobicContact CH2-CZ3 3.68Å; W408-W482 HydrophobicContact CZ3-CE3 4.2Å; W408-W482 AromaticContact CZ3-CZ3 3.89Å; W408-W482 HydrophobicContact CZ3-CZ3 3.89Å; M443-W482 HydrophobicContact CB-CH2 4.18Å; M443-W482 HydrophobicContact CG-CH2 3.21Å; M443-W482 HydrophobicContact CG-CZ2 3.9Å; M443-W482 HydrophobicContact CG-CZ3 3.61Å; M443-W482 WeakPolarHBondContact O-CH2 3.48Å; H446-W482 HydrophobicContact CB-CH2 4.37Å; H446-W482 HydrophobicContact CB-CZ3 4.15Å; H447-W482 HydrophobicContact CB-CH2 4.45Å; H447-W482 HydrophobicContact CB-CZ2 4.15Å; I450-W482 HydrophobicContact CD1-CB 3.72Å; I450-W482 HydrophobicContact CD1-CD2 3.14Å; I450-W482 HydrophobicContact CD1-CE3 3.26Å; I450-W482 HydrophobicContact CD1-CG 3.35Å; I450-W482 HydrophobicContact CD1-CH2 4.37Å; I450-W482 HydrophobicContact CD1-CZ2 4.34Å; I450-W482 HydrophobicContact CD1-CZ3 3.88Å; I478-W482 WeakPolarHBondContact O-CB 3.48Å; I478-W482 PolarHBondContact O-N 3Å; I478-W482 VanDerWaalsContact O-N 3.11Å; I479-W482 WeakPolarHBondContact O-CB 3.44Å; I479-W482 PolarHBondContact O-N 3.02Å; T480-W482 VanDerWaalsContact C-N 3.31Å; T480-W482 PolarHBondContact O-N 3.08Å; W482-E484 VanDerWaalsContact C-N 3.27Å; W482-E484 PolarHBondContact O-N 2.84Å; W482-M485 PolarHBondContact O-N 3.28Å; W482-R486 PolarHBondContact O-N 3.24Å; W482-R486 VanDerWaalsContact O-N 3.15Å
483	D	89.7	Confident	90.8	Very high	82 Å²	82	67.1 Å²	67.1	44%	0.439	33%	0.332	S	S	.	.	H	α-helix	trans	-64.3	-31.8	-179.2	-78.7	-21.6	0	0	0	112.7	I479 T480	I479-D483 PolarHBondContact O-N 2.95Å; T480-D483 PolarHBondContact O-N 2.91Å
484	E	90.7	Very high	90.1	Very high	104 Å²	104	68.3 Å²	68.3	49%	0.486	33%	0.33	S	S	.	.	H	α-helix	trans	-67.8	-48.3	174.4	-177.3	176.6	-170.8	0	0	112.2	T480 T481 W482 R486 K487 L488	T480-E484 PolarHBondContact O-N 2.7Å; T481-E484 PolarHBondContact O-N 3.26Å; W482-E484 VanDerWaalsContact C-N 3.27Å; W482-E484 PolarHBondContact O-N 2.84Å; E484-R486 VanDerWaalsContact C-N 3.29Å; E484-R486 PolarHBondContact O-N 3.06Å; E484-K487 WeakPolarHBondContact O-CB 3.4Å; E484-K487 PolarHBondContact O-N 3.06Å; E484-K487 VanDerWaalsContact O-N 3.14Å; E484-L488 HydrophobicContact CG-CD1 4.35Å; E484-L488 PolarHBondContact O-N 3Å
485	M	90.7	Very high	89.3	Confident	0 Å²	0	69 Å²	69	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-59.5	-40.1	178.6	-72.4	174.8	54.5	0	0	112.4	W408 T409 K412 P413 L416 F439 T481 W482 K487 L488 S489	W408-M485 HydrophobicContact CE3-CE 4.43Å; W408-M485 HydrophobicContact CH2-CE 3.43Å; W408-M485 VanDerWaalsContact CH2-CE 3.43Å; W408-M485 HydrophobicContact CZ2-CE 4.27Å; W408-M485 HydrophobicContact CZ3-CE 3.55Å; W408-M485 HydrophobicContact CZ3-SD 4.19Å; T409-M485 HydrophobicContact CG2-SD 3.77Å; K412-M485 HydrophobicContact CB-CE 3.64Å; K412-M485 HydrophobicContact CB-SD 4.11Å; K412-M485 HydrophobicContact CD-CE 3.52Å; K412-M485 HydrophobicContact CG-CE 4.23Å; P413-M485 HydrophobicContact CG-CG 3.96Å; P413-M485 HydrophobicContact CG-SD 4.49Å; L416-M485 HydrophobicContact CD1-CB 3.98Å; L416-M485 HydrophobicContact CD1-CG 4.27Å; L416-M485 WeakPolarHBondContact CD1-O 3.47Å; F439-M485 HydrophobicContact CE2-CE 4.18Å; F439-M485 HydrophobicContact CZ-CE 3.68Å; T481-M485 WeakPolarHBondContact O-CG 3.36Å; T481-M485 PolarHBondContact O-N 3.47Å; W482-M485 PolarHBondContact O-N 3.28Å; M485-K487 VanDerWaalsContact C-N 3.25Å; M485-K487 PolarHBondContact O-N 2.75Å; M485-L488 PolarHBondContact O-N 3.35Å; M485-S489 PolarHBondContact O-N 2.89Å
486	R	88.9	Confident	88.4	Confident	157 Å²	157	68.7 Å²	68.7	59%	0.592	33%	0.333	S	S	*	.	H	α-helix	trans	-56.2	-41.9	177.5	-172.3	178.9	-177.1	178.8	3.6	111.7	M443 W482 E484	M443-R486 HydrophobicContact CE-CB 4.36Å; M443-R486 HydrophobicContact CE-CG 4.13Å; W482-R486 PolarHBondContact O-N 3.24Å; W482-R486 VanDerWaalsContact O-N 3.15Å; E484-R486 VanDerWaalsContact C-N 3.29Å; E484-R486 PolarHBondContact O-N 3.06Å
487	K	88.7	Confident	87.7	Confident	165 Å²	165	66.2 Å²	66.2	72%	0.717	32%	0.324	S	S	*	.	H	α-helix	trans	-66.5	-44.3	177.2	-67.6	174.5	-176.6	170.7	0	112.1	E484 M485 S489	E484-K487 WeakPolarHBondContact O-CB 3.4Å; E484-K487 PolarHBondContact O-N 3.06Å; E484-K487 VanDerWaalsContact O-N 3.14Å; M485-K487 VanDerWaalsContact C-N 3.25Å; M485-K487 PolarHBondContact O-N 2.75Å; K487-S489 VanDerWaalsContact C-N 3.34Å
488	L	90.7	Very high	86.7	Confident	47 Å²	47	69.9 Å²	69.9	25%	0.246	33%	0.333	C	S	.	.	H	α-helix	trans	-68.5	-31.8	-179.7	-68.8	168.9	0	0	0	112.7	P413 L416 A417 E484 M485 Q491 R492	P413-L488 HydrophobicContact CB-CD1 4.21Å; P413-L488 WeakPolarHBondContact O-CD1 3.01Å; L416-L488 HydrophobicContact CB-CB 3.51Å; L416-L488 HydrophobicContact CB-CD1 4.29Å; L416-L488 HydrophobicContact CB-CG 4.48Å; L416-L488 HydrophobicContact CD1-CB 3.82Å; L416-L488 HydrophobicContact CG-CB 4.31Å; A417-L488 HydrophobicContact CB-CD2 4.37Å; E484-L488 HydrophobicContact CG-CD1 4.35Å; E484-L488 PolarHBondContact O-N 3Å; M485-L488 PolarHBondContact O-N 3.35Å; L488-Q491 PolarHBondContact O-N 3.49Å; L488-R492 PolarHBondContact O-N 2.78Å
489	S	89.3	Confident	85.7	Confident	1 Å²	1	71.1 Å²	71.1	1%	0.007	35%	0.345	C	S	.	.	H	α-helix	trans	-59.8	-56.1	176.7	-165	0	0	0	0	111.4	H436 F439 Q440 M485 K487 Q491 R492 E493	H436-S489 PolarHBondContact CE1-O 3.13Å; H436-S489 PolarHBondContact CE1-OG 3.25Å; H436-S489 PolarHBondContact NE2-O 3.26Å; H436-S489 PolarHBondContact NE2-OG 2.92Å; H436-S489 VanDerWaalsContact NE2-OG 3.13Å; F439-S489 WeakPolarHBondContact CD1-OG 3.47Å; Q440-S489 WeakPolarHBondContact CG-OG 3.24Å; M485-S489 PolarHBondContact O-N 2.89Å; K487-S489 VanDerWaalsContact C-N 3.34Å; S489-Q491 PolarHBondContact O-N 3.02Å; S489-R492 PolarHBondContact O-N 3.48Å; S489-E493 PolarHBondContact O-N 2.98Å
490	S	85.8	Confident	84.5	Confident	70 Å²	70	70 Å²	70	49%	0.49	34%	0.339	S	S	.	.	H	α-helix	trans	-55.9	-26	-178.1	-57	0	0	0	0	113.9
491	Q	85.7	Confident	83.6	Confident	102 Å²	102	69.7 Å²	69.7	48%	0.477	34%	0.337	S	S	.	.	H	α-helix	trans	-72.9	-43	175.7	-177.8	61.3	25.2	0	0	113.1	L488 S489	L488-Q491 PolarHBondContact O-N 3.49Å; S489-Q491 PolarHBondContact O-N 3.02Å
492	R	87.7	Confident	82.3	Confident	26 Å²	26	70 Å²	70	10%	0.098	34%	0.343	C	S	.	.	H	α-helix	trans	-72.3	-34.2	-173.6	174.9	175.3	179.5	93.4	1.5	113.4	A415 S418 D420 L488 S489 R494 E495 I496	A415-R492 PolarHBondContact O-NH1 3.36Å; S418-R492 PolarHBondContact O-NH1 3.43Å; D420-R492 VanDerWaalsContact CG-NH2 3.3Å; D420-R492 IonicContact OD1-CZ 3.62Å; D420-R492 VanDerWaalsContact OD1-CZ 3.24Å; D420-R492 IonicContact OD1-NH1 3.45Å; D420-R492 PolarHBondContact OD1-NH1 2.85Å; D420-R492 IonicContact OD1-NH2 3.15Å; D420-R492 PolarHBondContact OD1-NH2 3.39Å; D420-R492 IonicContact OD2-CZ 3.25Å; D420-R492 IonicContact OD2-NH1 2.94Å; D420-R492 IonicContact OD2-NH2 2.79Å; D420-R492 PolarHBondContact OD2-NH2 2.93Å; L488-R492 PolarHBondContact O-N 2.78Å; S489-R492 PolarHBondContact O-N 3.48Å; R492-R494 VanDerWaalsContact C-N 3.27Å; R492-R494 PolarHBondContact O-N 2.86Å; R492-E495 PolarHBondContact O-N 3.23Å; R492-I496 HydrophobicContact CG-CD1 3.43Å; R492-I496 VanDerWaalsContact CG-CD1 3.43Å; R492-I496 HydrophobicContact CG-CG1 4.36Å; R492-I496 WeakPolarHBondContact O-CD1 3.49Å; R492-I496 WeakPolarHBondContact O-CG1 3.34Å; R492-I496 PolarHBondContact O-N 3.14Å
493	E	85.7	Confident	81.1	Confident	75 Å²	75	69.1 Å²	69.1	35%	0.35	34%	0.34	S	S	.	.	H	α-helix	trans	-50.3	-45.4	174.5	-165.4	-176.5	157.1	0	0	113.1	H436 Q440 S489 E495 S497	H436-E493 VanDerWaalsContact CD2-CA 3.47Å; H436-E493 WeakPolarHBondContact CD2-CA 3.44Å; H436-E493 WeakPolarHBondContact CD2-CB 3.24Å; H436-E493 WeakPolarHBondContact NE2-CB 3.4Å; H436-E493 PolarHBondContact NE2-N 3.43Å; Q440-E493 PolarHBondContact NE2-OE2 2.91Å; S489-E493 PolarHBondContact O-N 2.98Å; E493-E495 VanDerWaalsContact C-N 3.33Å; E493-E495 PolarHBondContact O-N 3.47Å; E493-S497 PolarHBondContact O-OG 2.95Å
494	R	79.4	Confident	80.2	Confident	163 Å²	163	68.6 Å²	68.6	62%	0.615	34%	0.335	S	S	*	.	H	α-helix	trans	-63.4	-32.7	-174.6	-72.4	-167.2	-75.7	164.5	-8.6	113.4	R492	R492-R494 VanDerWaalsContact C-N 3.27Å; R492-R494 PolarHBondContact O-N 2.86Å
495	E	78.9	Confident	79.1	Confident	67 Å²	67	69.7 Å²	69.7	31%	0.313	34%	0.34	S	S	.	.	H	α-helix	trans	-85.9	-38	-175.5	-75.8	-63.6	127.5	0	0	113.2	F421 R492 E493 S497 K498	F421-E495 HydrophobicContact CE1-CB 4.02Å; F421-E495 HydrophobicContact CE2-CB 4.2Å; F421-E495 HydrophobicContact CZ-CB 3.73Å; F421-E495 HydrophobicContact CZ-CG 4.21Å; R492-E495 PolarHBondContact O-N 3.23Å; E493-E495 VanDerWaalsContact C-N 3.33Å; E493-E495 PolarHBondContact O-N 3.47Å; E495-S497 PolarHBondContact O-N 2.78Å; E495-K498 PolarHBondContact O-N 2.64Å; E495-K498 IonicContact OE1-NZ 2.81Å
496	I	75.8	Confident	78.1	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-64.3	-40.2	-177	-78.6	171.6	0	0	0	113.4	F421 M429 F432 Q433 H436 R492 K498 A499	F421-I496 HydrophobicContact CB-CG1 4.33Å; M429-I496 WeakPolarHBondContact CG-O 3.47Å; M429-I496 HydrophobicContact SD-CB 4.28Å; M429-I496 HydrophobicContact SD-CG1 4.41Å; M429-I496 HydrophobicContact SD-CG2 4.15Å; F432-I496 HydrophobicContact CB-CB 4.2Å; F432-I496 HydrophobicContact CB-CD1 3.76Å; F432-I496 HydrophobicContact CB-CG1 3.7Å; F432-I496 HydrophobicContact CB-CG2 3.57Å; F432-I496 WeakPolarHBondContact O-CD1 3.48Å; Q433-I496 HydrophobicContact CB-CG2 3.5Å; Q433-I496 VanDerWaalsContact CB-CG2 3.5Å; Q433-I496 HydrophobicContact CG-CG2 4.28Å; H436-I496 HydrophobicContact CB-CD1 4.02Å; R492-I496 HydrophobicContact CG-CD1 3.43Å; R492-I496 VanDerWaalsContact CG-CD1 3.43Å; R492-I496 HydrophobicContact CG-CG1 4.36Å; R492-I496 WeakPolarHBondContact O-CD1 3.49Å; R492-I496 WeakPolarHBondContact O-CG1 3.34Å; R492-I496 PolarHBondContact O-N 3.14Å; I496-K498 PolarHBondContact O-N 2.75Å; I496-A499 PolarHBondContact O-N 3.43Å
497	S	79.7	Confident	76.8	Confident	46 Å²	46	62.7 Å²	62.7	32%	0.322	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-25.3	-178.2	-62.6	0	0	0	0	113.2	Q433 E493 E495 L500	Q433-S497 PolarHBondContact NE2-OG 2.64Å; Q433-S497 VanDerWaalsContact NE2-OG 3.07Å; E493-S497 PolarHBondContact O-OG 2.95Å; E495-S497 PolarHBondContact O-N 2.78Å; S497-L500 VanDerWaalsContact O-CB 3.26Å; S497-L500 WeakPolarHBondContact O-CB 3.34Å
498	K	72.6	Confident	76.3	Confident	157 Å²	157	59.7 Å²	59.7	68%	0.683	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-37.2	-178.5	-73	176.8	-177.1	161.2	0	115.2	E495 I496	E495-K498 PolarHBondContact O-N 2.64Å; E495-K498 IonicContact OE1-NZ 2.81Å; I496-K498 PolarHBondContact O-N 2.75Å
499	A	71.1	Confident	75.3	Confident	34 Å²	34	60.6 Å²	60.6	28%	0.281	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-13.1	-176.3	0	0	0	0	0	112.8	M429 I496 T501 A502 L503	M429-A499 HydrophobicContact CB-CB 4.31Å; M429-A499 HydrophobicContact CE-CB 3.12Å; M429-A499 HydrophobicContact CG-CB 3.48Å; M429-A499 VanDerWaalsContact CG-CB 3.48Å; M429-A499 HydrophobicContact SD-CB 3.7Å; I496-A499 PolarHBondContact O-N 3.43Å; A499-T501 PolarHBondContact O-N 3.37Å; A499-A502 PolarHBondContact O-N 3.35Å; A499-L503 WeakPolarHBondContact O-CD1 3.36Å
500	L	67.9	Low	74.6	Confident	19 Å²	19	60.5 Å²	60.5	10%	0.099	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-41.9	-39.1	177.4	-169.2	90.7	0	0	0	113.9	L426 M429 R430 Q433 S497 E504	L426-L500 WeakPolarHBondContact CD1-O 3.43Å; M429-L500 HydrophobicContact CG-CB 4.35Å; M429-L500 VanDerWaalsContact O-CD1 3.31Å; M429-L500 WeakPolarHBondContact O-CD1 3.39Å; R430-L500 HydrophobicContact CB-CD1 3.81Å; R430-L500 HydrophobicContact CB-CG 4.39Å; R430-L500 HydrophobicContact CG-CD1 3.44Å; R430-L500 VanDerWaalsContact CG-CD1 3.44Å; R430-L500 HydrophobicContact CG-CD2 4.31Å; R430-L500 HydrophobicContact CG-CG 3.51Å; Q433-L500 HydrophobicContact CB-CD1 3.34Å; Q433-L500 VanDerWaalsContact CD-CD1 3.49Å; Q433-L500 HydrophobicContact CG-CD1 4.01Å; S497-L500 VanDerWaalsContact O-CB 3.26Å; S497-L500 WeakPolarHBondContact O-CB 3.34Å; L500-E504 WeakPolarHBondContact O-CG 3.48Å
501	T	74.3	Confident	74.2	Confident	90 Å²	90	59.1 Å²	59.1	55%	0.552	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-28.2	-165.6	-49.4	0	0	0	0	114.1	A499 E504	A499-T501 PolarHBondContact O-N 3.37Å; T501-E504 VanDerWaalsContact O-CB 3.31Å; T501-E504 WeakPolarHBondContact O-CB 3.4Å; T501-E504 WeakPolarHBondContact O-CG 3.5Å; T501-E504 PolarHBondContact O-N 2.9Å
502	A	64.6	Low	73.7	Confident	42 Å²	42	57.6 Å²	57.6	35%	0.347	29%	0.289	S	S	.	.	S	Bend	trans	-73.8	-82.1	-164.5	0	0	0	0	0	114.1	A499 E504 Y581	A499-A502 PolarHBondContact O-N 3.35Å; A502-E504 PolarHBondContact O-N 3.24Å; A502-Y581 HydrophobicContact CB-CD1 3.93Å; A502-Y581 HydrophobicContact CB-CE1 3.81Å
503	L	64.8	Low	73.4	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.021	29%	0.285	C	S	.	.	G	3₁₀ helix		37.6	-74.8	113.2	-67.3	-168.2	0	0	0	114.8	M425 L426 M429 A499 E505 I506 L583	M425-L503 VanDerWaalsContact CA-CD2 3.45Å; M425-L503 WeakPolarHBondContact O-CD1 3.36Å; M425-L503 WeakPolarHBondContact O-CD2 3.41Å; L426-L503 HydrophobicContact CB-CB 3.24Å; L426-L503 HydrophobicContact CB-CD2 3.69Å; L426-L503 HydrophobicContact CB-CG 3.88Å; L426-L503 WeakPolarHBondContact CB-O 3.36Å; L426-L503 VanDerWaalsContact CD1-CA 3.5Å; L426-L503 HydrophobicContact CD1-CB 3.21Å; L426-L503 WeakPolarHBondContact CD2-O 3.47Å; L426-L503 VanDerWaalsContact CG-CA 3.43Å; L426-L503 HydrophobicContact CG-CB 3.5Å; L426-L503 WeakPolarHBondContact CG-O 3.38Å; L426-L503 WeakPolarHBondContact O-CB 3.16Å; L426-L503 VanDerWaalsContact O-CD1 3.29Å; L426-L503 WeakPolarHBondContact O-CD1 3.46Å; M429-L503 HydrophobicContact CB-CD1 3.23Å; M429-L503 HydrophobicContact CG-CD1 4.18Å; A499-L503 WeakPolarHBondContact O-CD1 3.36Å; L503-E505 PolarHBondContact O-N 3.46Å; L503-I506 PolarHBondContact O-N 2.92Å; L503-I506 VanDerWaalsContact O-N 3.12Å; L503-L583 HydrophobicContact CD2-CD1 3.15Å; L503-L583 HydrophobicContact CD2-CD2 3.38Å; L503-L583 HydrophobicContact CD2-CG 3.75Å; L503-L583 HydrophobicContact CG-CD2 4.2Å
504	E	72.1	Confident	72.6	Confident	72 Å²	72	53.1 Å²	53.1	34%	0.336	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-48.5	-10.8	-149.9	-71.8	-161.9	136.5	0	0	121	L426 R430 L500 T501 A502	L426-E504 HydrophobicContact CD1-CB 3.98Å; L426-E504 HydrophobicContact CD1-CG 3.49Å; L426-E504 VanDerWaalsContact CD1-CG 3.49Å; L426-E504 HydrophobicContact CD2-CB 4.38Å; L426-E504 WeakPolarHBondContact CD2-O 3.42Å; L426-E504 VanDerWaalsContact CG-N 3.29Å; R430-E504 IonicContact CZ-OE1 2.78Å; R430-E504 IonicContact NE-OE1 3.56Å; R430-E504 PolarHBondContact NE-OE1 3.06Å; R430-E504 PolarHBondContact NH1-O 3.02Å; R430-E504 IonicContact NH2-OE1 3.48Å; R430-E504 PolarHBondContact NH2-OE1 3.35Å; R430-E504 IonicContact NH2-OE2 3.5Å; R430-E504 PolarHBondContact NH2-OE2 3.01Å; L500-E504 WeakPolarHBondContact O-CG 3.48Å; T501-E504 VanDerWaalsContact O-CB 3.31Å; T501-E504 WeakPolarHBondContact O-CB 3.4Å; T501-E504 WeakPolarHBondContact O-CG 3.5Å; T501-E504 PolarHBondContact O-N 2.9Å; A502-E504 PolarHBondContact O-N 3.24Å
505	E	66.5	Low	72.8	Confident	126 Å²	126	51 Å²	51	59%	0.589	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-93.8	-42	180	-178.2	172.5	-172.9	0	0	114.6	L503 D507 Q508	L503-E505 PolarHBondContact O-N 3.46Å; E505-D507 PolarHBondContact O-N 3.29Å; E505-Q508 PolarHBondContact O-N 3.13Å
506	I	69.5	Low	73.1	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-55.7	-27.2	177.3	-71.8	-177	0	0	0	111.3	L426 L503 H510 I577 L583 A586	L426-I506 HydrophobicContact CB-CB 4.07Å; L426-I506 HydrophobicContact CB-CG2 4.46Å; L426-I506 HydrophobicContact CD2-CB 4.21Å; L503-I506 PolarHBondContact O-N 2.92Å; L503-I506 VanDerWaalsContact O-N 3.12Å; I506-H510 WeakPolarHBondContact CG2-CE1 3.32Å; I506-H510 WeakPolarHBondContact CG2-ND1 3.4Å; I506-H510 WeakPolarHBondContact O-CB 3.43Å; I506-H510 PolarHBondContact O-ND1 3.39Å; I506-I577 HydrophobicContact CD1-CB 4.14Å; I506-I577 HydrophobicContact CD1-CG2 3.67Å; I506-I577 HydrophobicContact CG1-CB 3.74Å; I506-I577 HydrophobicContact CG1-CD1 4.5Å; I506-I577 HydrophobicContact CG1-CG2 3.23Å; I506-L583 HydrophobicContact CD1-CD1 3.76Å; I506-A586 HydrophobicContact CD1-CB 3.5Å
507	D	62.1	Low	73.5	Confident	6 Å²	6	52.3 Å²	52.3	3%	0.032	27%	0.267	C	S	.	.	H	α-helix	trans	-70.8	-42.4	-178.1	-151.5	56.2	0	0	0	106	L426 S427 R430 E505 L509 H510 L511 Y591	L426-D507 HydrophobicContact CD2-CB 2.84Å; L426-D507 HydrophobicContact CG-CB 3.84Å; S427-D507 WeakPolarHBondContact CA-OD1 3.46Å; S427-D507 WeakPolarHBondContact CB-OD1 3.38Å; R430-D507 WeakPolarHBondContact CD-OD2 3.47Å; R430-D507 IonicContact CZ-OD2 2.8Å; R430-D507 IonicContact NE-OD2 3.6Å; R430-D507 IonicContact NH1-OD2 3.35Å; R430-D507 PolarHBondContact NH1-OD2 3.21Å; E505-D507 PolarHBondContact O-N 3.29Å; D507-L509 PolarHBondContact O-N 3.44Å; D507-H510 CarbonylContact O-C 3.55Å; D507-H510 WeakPolarHBondContact O-CB 3.34Å; D507-H510 PolarHBondContact O-N 3.41Å; D507-H510 VanDerWaalsContact O-N 3.12Å; D507-L511 WeakPolarHBondContact O-CB 3.37Å; D507-L511 PolarHBondContact O-N 2.93Å; D507-Y591 WeakPolarHBondContact CA-OH 3.35Å; D507-Y591 HydrophobicContact CB-CE1 4.16Å; D507-Y591 HydrophobicContact CB-CE2 3.44Å; D507-Y591 VanDerWaalsContact CB-CE2 3.44Å; D507-Y591 WeakPolarHBondContact CB-OH 3.32Å; D507-Y591 WeakPolarHBondContact O-CE2 3.45Å; D507-Y591 PolarHBondContact O-OH 3.44Å; D507-Y591 VanDerWaalsContact OD1-CE1 3.25Å; D507-Y591 WeakPolarHBondContact OD1-CE1 3.44Å; D507-Y591 WeakPolarHBondContact OD1-CE2 3.44Å; D507-Y591 PolarHBondContact OD1-OH 3.4Å; D507-Y591 VanDerWaalsContact OD2-CE1 3.3Å; D507-Y591 WeakPolarHBondContact OD2-CE1 3.42Å; D507-Y591 PolarHBondContact OD2-OH 2.81Å
508	Q	77.4	Confident	73.7	Confident	103 Å²	103	52 Å²	52	48%	0.481	27%	0.268	S	S	.	.	H	α-helix	trans	-59.3	-31	-166.8	-170.7	57.3	38	0	0	115.3	E505 L511 Y591	E505-Q508 PolarHBondContact O-N 3.13Å; Q508-L511 VanDerWaalsContact O-CB 3.23Å; Q508-L511 WeakPolarHBondContact O-CB 3.43Å; Q508-Y591 PolarHBondContact N-OH 3.15Å
509	L	71.1	Confident	74.3	Confident	65 Å²	65	48.1 Å²	48.1	34%	0.34	26%	0.259	S	S	.	.	H	α-helix	trans	-79.4	-45.9	174.9	-68.5	174	0	0	0	113	D507 L511 D512 V574 I577	D507-L509 PolarHBondContact O-N 3.44Å; L509-L511 PolarHBondContact O-N 3.46Å; L509-D512 PolarHBondContact O-N 3.14Å; L509-D512 VanDerWaalsContact O-N 3.12Å; L509-V574 HydrophobicContact CB-CG2 4.02Å; L509-I577 HydrophobicContact CD1-CD1 3.78Å
510	H	73.5	Confident	75.1	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-53.4	-32.2	171.9	-81.6	158.9	0	0	0	110.7	I506 D507 A514 V574 Q588 N589 P590 Y591	I506-H510 WeakPolarHBondContact CG2-CE1 3.32Å; I506-H510 WeakPolarHBondContact CG2-ND1 3.4Å; I506-H510 WeakPolarHBondContact O-CB 3.43Å; I506-H510 PolarHBondContact O-ND1 3.39Å; D507-H510 CarbonylContact O-C 3.55Å; D507-H510 WeakPolarHBondContact O-CB 3.34Å; D507-H510 PolarHBondContact O-N 3.41Å; D507-H510 VanDerWaalsContact O-N 3.12Å; H510-A514 WeakPolarHBondContact O-CB 3.48Å; H510-A514 PolarHBondContact O-N 3.48Å; H510-V574 HydrophobicContact CB-CG2 4.3Å; H510-V574 WeakPolarHBondContact CD2-CG1 3.49Å; H510-V574 WeakPolarHBondContact CD2-CG2 3.46Å; H510-V574 WeakPolarHBondContact NE2-CG1 3.39Å; H510-Q588 PolarHBondContact CE1-O 2.94Å; H510-Q588 VanDerWaalsContact NE2-C 3.3Å; H510-Q588 PolarHBondContact NE2-O 2.95Å; H510-Q588 VanDerWaalsContact NE2-O 3.1Å; H510-N589 WeakPolarHBondContact CA-ND2 3.33Å; H510-N589 WeakPolarHBondContact CA-OD1 3.38Å; H510-N589 WeakPolarHBondContact CB-OD1 3.42Å; H510-N589 WeakPolarHBondContact CD2-CA 3.44Å; H510-N589 WeakPolarHBondContact CD2-CB 3.41Å; H510-N589 PolarHBondContact CD2-ND2 3Å; H510-N589 PolarHBondContact CD2-OD1 2.89Å; H510-N589 WeakPolarHBondContact NE2-CA 3.17Å; H510-N589 PolarHBondContact NE2-N 3.21Å; H510-N589 PolarHBondContact O-ND2 3.34Å; H510-N589 PolarHBondContact O-OD1 3.48Å; H510-N589 VanDerWaalsContact O-OD1 3.13Å; H510-P590 HydrophobicContact CB-CG 3.61Å; H510-P590 WeakPolarHBondContact CD2-CD 3.46Å; H510-P590 WeakPolarHBondContact CE1-CD 3.43Å; H510-P590 WeakPolarHBondContact ND1-CD 3.47Å; H510-P590 VanDerWaalsContact ND1-CG 3.34Å; H510-P590 WeakPolarHBondContact ND1-CG 3.45Å; H510-P590 WeakPolarHBondContact NE2-CD 3.47Å; H510-Y591 VanDerWaalsContact C-CE2 3.43Å; H510-Y591 HydrophobicContact CB-CD2 3.39Å; H510-Y591 HydrophobicContact CB-CE2 3.37Å; H510-Y591 WeakPolarHBondContact O-CD2 3.31Å
511	L	78.1	Confident	76	Confident	40 Å²	40	46.8 Å²	46.8	21%	0.209	25%	0.247	C	C	.	.	H	α-helix	trans	-63.3	-42.5	177.6	-169.6	65.8	0	0	0	112.3	D507 Q508 L509 A514 K515 Y591	D507-L511 WeakPolarHBondContact O-CB 3.37Å; D507-L511 PolarHBondContact O-N 2.93Å; Q508-L511 VanDerWaalsContact O-CB 3.23Å; Q508-L511 WeakPolarHBondContact O-CB 3.43Å; L509-L511 PolarHBondContact O-N 3.46Å; L511-A514 CarbonylContact O-C 3.56Å; L511-A514 WeakPolarHBondContact O-CB 3.31Å; L511-A514 PolarHBondContact O-N 3.32Å; L511-K515 HydrophobicContact CG-CD 4.32Å; L511-K515 HydrophobicContact CG-CG 4.41Å; L511-K515 WeakPolarHBondContact O-CB 3.24Å; L511-K515 WeakPolarHBondContact O-CG 3.49Å; L511-K515 PolarHBondContact O-N 2.95Å; L511-Y591 VanDerWaalsContact CA-CD2 3.46Å; L511-Y591 HydrophobicContact CB-CD1 4.47Å; L511-Y591 HydrophobicContact CB-CD2 4.24Å; L511-Y591 HydrophobicContact CB-CE1 4.01Å; L511-Y591 HydrophobicContact CB-CE2 3.82Å; L511-Y591 HydrophobicContact CB-CG 4.47Å; L511-Y591 VanDerWaalsContact CB-CZ 3.49Å; L511-Y591 WeakPolarHBondContact CB-OH 3.29Å; L511-Y591 HydrophobicContact CD1-CD1 3.53Å; L511-Y591 HydrophobicContact CD1-CE1 3.23Å; L511-Y591 HydrophobicContact CD1-CG 4.21Å; L511-Y591 HydrophobicContact CG-CE1 4.14Å
512	D	74.7	Confident	76.6	Confident	71 Å²	71	47 Å²	47	38%	0.38	24%	0.244	S	C	.	.	H	α-helix	trans	-76.8	-34.2	-171.9	-73.1	-17.3	0	0	0	111.7	L509 A514 K515	L509-D512 PolarHBondContact O-N 3.14Å; L509-D512 VanDerWaalsContact O-N 3.12Å; D512-A514 VanDerWaalsContact C-N 3.31Å; D512-K515 IonicContact OD1-NZ 2.96Å; D512-K515 PolarHBondContact OD1-NZ 2.68Å
513	F	82.3	Confident	77.7	Confident	1 Å²	1	48.6 Å²	48.6	0%	0.004	24%	0.241	C	C	.	.	H	α-helix	trans	-58	-50.3	166.1	-177.5	-75	0	0	0	109.2	K515 R516 A517 L567 C570 A571 N589 T592 I594 P596 L599	F513-K515 PolarHBondContact O-N 3.31Å; F513-R516 PolarHBondContact O-N 2.75Å; F513-A517 HydrophobicContact CD1-CB 3.63Å; F513-A517 HydrophobicContact CE1-CB 3.48Å; F513-A517 VanDerWaalsContact CE1-CB 3.48Å; F513-A517 HydrophobicContact CZ-CB 4.41Å; F513-A517 WeakPolarHBondContact O-CB 3.47Å; F513-A517 PolarHBondContact O-N 3.37Å; F513-L567 WeakPolarHBondContact CD2-O 3.44Å; F513-L567 HydrophobicContact CE2-CB 4.13Å; F513-L567 WeakPolarHBondContact CE2-O 3.43Å; F513-L567 HydrophobicContact CZ-CB 4.25Å; F513-C570 HydrophobicContact CB-CB 4.09Å; F513-C570 VanDerWaalsContact CB-SG 3.57Å; F513-C570 HydrophobicContact CD2-CB 3.83Å; F513-C570 HydrophobicContact CG-CB 4.42Å; F513-C570 PolarHBondContact N-SG 2.97Å; F513-C570 VanDerWaalsContact N-SG 3.44Å; F513-A571 HydrophobicContact CD2-CB 3.93Å; F513-A571 HydrophobicContact CE2-CB 3.78Å; F513-N589 WeakPolarHBondContact CB-ND2 3.41Å; F513-T592 HydrophobicContact CD1-CG2 3.12Å; F513-T592 HydrophobicContact CE1-CG2 3.43Å; F513-T592 VanDerWaalsContact CE1-CG2 3.43Å; F513-T592 HydrophobicContact CG-CG2 4.11Å; F513-I594 HydrophobicContact CE1-CB 4.48Å; F513-I594 WeakPolarHBondContact CE1-O 3.49Å; F513-P596 HydrophobicContact CE2-CB 4.25Å; F513-P596 HydrophobicContact CE2-CG 3.78Å; F513-P596 HydrophobicContact CZ-CB 4.31Å; F513-P596 HydrophobicContact CZ-CG 3.82Å; F513-L599 HydrophobicContact CZ-CD1 4.48Å
514	A	68.6	Low	78.9	Confident	6 Å²	6	48.4 Å²	48.4	5%	0.05	24%	0.24	C	C	.	.	H	α-helix	trans	-65.4	-37.2	-176.8	0	0	0	0	0	114.6	H510 L511 D512 R516 A517 A518 Y591 T592	H510-A514 WeakPolarHBondContact O-CB 3.48Å; H510-A514 PolarHBondContact O-N 3.48Å; L511-A514 CarbonylContact O-C 3.56Å; L511-A514 WeakPolarHBondContact O-CB 3.31Å; L511-A514 PolarHBondContact O-N 3.32Å; D512-A514 VanDerWaalsContact C-N 3.31Å; A514-R516 PolarHBondContact O-N 3.28Å; A514-A517 PolarHBondContact O-N 3.06Å; A514-A518 WeakPolarHBondContact O-CB 3.37Å; A514-A518 PolarHBondContact O-N 3.37Å; A514-Y591 VanDerWaalsContact CB-C 3.42Å; A514-Y591 HydrophobicContact CB-CG 4.13Å; A514-Y591 WeakPolarHBondContact CB-O 3.37Å; A514-T592 HydrophobicContact CB-CG2 4.2Å
515	K	84.4	Confident	79.5	Confident	117 Å²	117	49.2 Å²	49.2	51%	0.509	24%	0.244	S	C	.	.	H	α-helix	trans	-57	-31.4	175.6	-82.4	173	-175.8	156.3	0	112.7	L511 D512 F513 P519	L511-K515 HydrophobicContact CG-CD 4.32Å; L511-K515 HydrophobicContact CG-CG 4.41Å; L511-K515 WeakPolarHBondContact O-CB 3.24Å; L511-K515 WeakPolarHBondContact O-CG 3.49Å; L511-K515 PolarHBondContact O-N 2.95Å; D512-K515 IonicContact OD1-NZ 2.96Å; D512-K515 PolarHBondContact OD1-NZ 2.68Å; F513-K515 PolarHBondContact O-N 3.31Å; K515-P519 WeakPolarHBondContact O-CD 3.3Å; K515-P519 VanDerWaalsContact O-CG 3.28Å; K515-P519 WeakPolarHBondContact O-CG 3.48Å
516	R	83.6	Confident	80.5	Confident	95 Å²	95	47.6 Å²	47.6	36%	0.358	24%	0.237	S	C	.	.	H	α-helix	trans	-94	-38.5	179.4	-64.8	-179.3	64	173.5	10	112	F513 A514 P519 F520 E563 L567	F513-R516 PolarHBondContact O-N 2.75Å; A514-R516 PolarHBondContact O-N 3.28Å; R516-P519 WeakPolarHBondContact O-CD 3.31Å; R516-P519 WeakPolarHBondContact O-CG 3.34Å; R516-F520 WeakPolarHBondContact O-CB 3.41Å; R516-F520 PolarHBondContact O-N 2.87Å; R516-E563 IonicContact CZ-OE1 3Å; R516-E563 IonicContact NE-OE1 3.09Å; R516-E563 PolarHBondContact NE-OE1 3.12Å; R516-E563 IonicContact NH2-OE1 3.46Å; R516-E563 PolarHBondContact NH2-OE1 3.2Å; R516-E563 VanDerWaalsContact NH2-OE1 3.09Å; R516-E563 IonicContact NH2-OE2 3Å; R516-E563 PolarHBondContact NH2-OE2 3.33Å; R516-L567 HydrophobicContact CB-CD2 3.37Å
517	A	85.3	Confident	81.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-70.7	-36.4	-179.5	0	0	0	0	0	111.5	F513 A514 F520 N521 L567 I594	F513-A517 HydrophobicContact CD1-CB 3.63Å; F513-A517 HydrophobicContact CE1-CB 3.48Å; F513-A517 VanDerWaalsContact CE1-CB 3.48Å; F513-A517 HydrophobicContact CZ-CB 4.41Å; F513-A517 WeakPolarHBondContact O-CB 3.47Å; F513-A517 PolarHBondContact O-N 3.37Å; A514-A517 PolarHBondContact O-N 3.06Å; A517-F520 PolarHBondContact O-N 3.24Å; A517-N521 WeakPolarHBondContact O-CB 3.23Å; A517-N521 PolarHBondContact O-N 2.74Å; A517-L567 HydrophobicContact CB-CD1 3.91Å; A517-L567 HydrophobicContact CB-CD2 3.8Å; A517-L567 HydrophobicContact CB-CG 4.43Å; A517-L567 VanDerWaalsContact N-CD2 3.31Å; A517-I594 HydrophobicContact CB-CB 4.47Å; A517-I594 HydrophobicContact CB-CD1 3.56Å; A517-I594 VanDerWaalsContact O-CD1 3.23Å; A517-I594 WeakPolarHBondContact O-CD1 3.42Å
518	A	82.4	Confident	82.8	Confident	40 Å²	40	49.1 Å²	49.1	33%	0.331	24%	0.244	S	C	.	.	H	α-helix	trans	-59.8	-56.1	178.7	0	0	0	0	0	113.2	A514 F520 N521 N522	A514-A518 WeakPolarHBondContact O-CB 3.37Å; A514-A518 PolarHBondContact O-N 3.37Å; A518-F520 VanDerWaalsContact C-N 3.3Å; A518-F520 PolarHBondContact O-N 2.96Å; A518-N521 PolarHBondContact O-N 3.21Å; A518-N522 VanDerWaalsContact O-CB 3.3Å; A518-N522 WeakPolarHBondContact O-CB 3.34Å; A518-N522 PolarHBondContact O-N 3.37Å; A518-N522 PolarHBondContact O-OD1 3.05Å
519	P	87	Confident	83.3	Confident	76 Å²	76	50.1 Å²	50.1	49%	0.494	25%	0.249	S	C	.	.	H	α-helix	trans	-63.5	-36.1	177.2	24.6	-33.5	0	0	0	112.1	K515 R516 W523	K515-P519 WeakPolarHBondContact O-CD 3.3Å; K515-P519 VanDerWaalsContact O-CG 3.28Å; K515-P519 WeakPolarHBondContact O-CG 3.48Å; R516-P519 WeakPolarHBondContact O-CD 3.31Å; R516-P519 WeakPolarHBondContact O-CG 3.34Å; P519-W523 WeakPolarHBondContact O-CB 3.44Å; P519-W523 PolarHBondContact O-N 3.48Å
520	F	87.8	Confident	84.1	Confident	11 Å²	11	51 Å²	51	5%	0.048	25%	0.254	C	S	.	.	H	α-helix	trans	-66.6	-41.1	176.8	-173.9	-114.1	0	0	0	112.5	R516 A517 A518 W523 M524 A560 E563 L567 L599 W603	R516-F520 WeakPolarHBondContact O-CB 3.41Å; R516-F520 PolarHBondContact O-N 2.87Å; A517-F520 PolarHBondContact O-N 3.24Å; A518-F520 VanDerWaalsContact C-N 3.3Å; A518-F520 PolarHBondContact O-N 2.96Å; F520-W523 HydrophobicContact CD2-CE3 4.33Å; F520-W523 HydrophobicContact CE2-CE3 4.12Å; F520-W523 HydrophobicContact CE2-CZ3 4.21Å; F520-W523 WeakPolarHBondContact O-CB 3.47Å; F520-W523 PolarHBondContact O-N 2.95Å; F520-M524 HydrophobicContact CD1-CE 3.67Å; F520-M524 HydrophobicContact CD1-SD 4.33Å; F520-M524 HydrophobicContact CE1-CE 3.62Å; F520-M524 HydrophobicContact CE1-CG 4.35Å; F520-M524 HydrophobicContact CE1-SD 3.75Å; F520-M524 HydrophobicContact CZ-CG 4.4Å; F520-M524 HydrophobicContact CZ-SD 4.13Å; F520-M524 VanDerWaalsContact O-CG 3.31Å; F520-M524 WeakPolarHBondContact O-CG 3.15Å; F520-M524 PolarHBondContact O-N 3.44Å; F520-A560 HydrophobicContact CE2-CB 4.03Å; F520-A560 WeakPolarHBondContact CE2-O 3.13Å; F520-A560 VanDerWaalsContact CZ-O 3.3Å; F520-A560 WeakPolarHBondContact CZ-O 3.5Å; F520-E563 HydrophobicContact CB-CG 4.23Å; F520-E563 HydrophobicContact CD2-CB 3.92Å; F520-E563 HydrophobicContact CD2-CG 3.91Å; F520-E563 HydrophobicContact CE2-CB 4.13Å; F520-E563 HydrophobicContact CG-CG 4.11Å; F520-L567 HydrophobicContact CB-CD1 4.21Å; F520-L567 HydrophobicContact CD1-CD1 3.68Å; F520-L567 HydrophobicContact CE1-CD1 4.48Å; F520-L567 HydrophobicContact CG-CD1 4.21Å; F520-L599 HydrophobicContact CD1-CD2 4.15Å; F520-L599 HydrophobicContact CE1-CD2 4.18Å; F520-W603 HydrophobicContact CZ-CE3 4.41Å
521	N	86.9	Confident	85	Confident	14 Å²	14	51.7 Å²	51.7	8%	0.075	26%	0.257	C	S	.	.	H	α-helix	trans	-74.6	-38	178.1	-175.1	83.2	0	0	0	112.8	A517 A518 W523 M524 E525 I594 R602	A517-N521 WeakPolarHBondContact O-CB 3.23Å; A517-N521 PolarHBondContact O-N 2.74Å; A518-N521 PolarHBondContact O-N 3.21Å; N521-W523 VanDerWaalsContact C-N 3.29Å; N521-M524 HydrophobicContact CB-CE 4.3Å; N521-M524 CarbonylContact O-C 3.53Å; N521-M524 WeakPolarHBondContact O-CB 3.42Å; N521-M524 PolarHBondContact O-N 3.06Å; N521-M524 VanDerWaalsContact O-N 3.16Å; N521-E525 PolarHBondContact ND2-OE1 2.83Å; N521-E525 WeakPolarHBondContact O-CB 3.35Å; N521-E525 WeakPolarHBondContact O-CG 3.15Å; N521-E525 PolarHBondContact O-N 2.84Å; N521-I594 HydrophobicContact CB-CD1 3.16Å; N521-I594 HydrophobicContact CB-CG1 3.86Å; N521-I594 VanDerWaalsContact CG-CD1 3.5Å; N521-R602 PolarHBondContact OD1-NH1 3.29Å
522	N	85	Confident	85.5	Confident	95 Å²	95	56 Å²	56	51%	0.508	27%	0.271	S	S	.	.	H	α-helix	trans	-61.2	-43.3	169.7	-72.2	-3.7	0	0	0	110.1	A518 M524 E525 Q526	A518-N522 VanDerWaalsContact O-CB 3.3Å; A518-N522 WeakPolarHBondContact O-CB 3.34Å; A518-N522 PolarHBondContact O-N 3.37Å; A518-N522 PolarHBondContact O-OD1 3.05Å; N522-M524 VanDerWaalsContact C-N 3.29Å; N522-M524 PolarHBondContact O-N 3.35Å; N522-E525 PolarHBondContact O-N 3.17Å; N522-Q526 VanDerWaalsContact O-CB 3.23Å; N522-Q526 WeakPolarHBondContact O-CB 3.44Å; N522-Q526 PolarHBondContact O-N 2.92Å
523	W	89.6	Confident	86.1	Confident	75 Å²	75	57 Å²	57	28%	0.284	28%	0.276	S	S	.	.	H	α-helix	trans	-60.4	-41	173.2	174.9	86.9	0	0	0	111.1	P519 F520 N521 T527 F553 L557 A560 W603 I606	P519-W523 WeakPolarHBondContact O-CB 3.44Å; P519-W523 PolarHBondContact O-N 3.48Å; F520-W523 HydrophobicContact CD2-CE3 4.33Å; F520-W523 HydrophobicContact CE2-CE3 4.12Å; F520-W523 HydrophobicContact CE2-CZ3 4.21Å; F520-W523 WeakPolarHBondContact O-CB 3.47Å; F520-W523 PolarHBondContact O-N 2.95Å; N521-W523 VanDerWaalsContact C-N 3.29Å; W523-T527 WeakPolarHBondContact O-CB 3.26Å; W523-T527 PolarHBondContact O-N 3.06Å; W523-T527 PolarHBondContact O-OG1 3.06Å; W523-F553 HydrophobicContact CZ2-CE2 4.34Å; W523-L557 HydrophobicContact CH2-CD2 4.13Å; W523-L557 HydrophobicContact CZ2-CD2 4.43Å; W523-A560 HydrophobicContact CE3-CB 4.19Å; W523-A560 HydrophobicContact CH2-CB 3.23Å; W523-A560 HydrophobicContact CZ2-CB 3.69Å; W523-A560 HydrophobicContact CZ3-CB 3.52Å; W523-W603 HydrophobicContact CH2-CH2 4.24Å; W523-W603 AromaticContact CH2-CZ3 3.68Å; W523-W603 HydrophobicContact CH2-CZ3 3.68Å; W523-W603 HydrophobicContact CZ3-CE3 4.42Å; W523-W603 AromaticContact CZ3-CZ3 3.66Å; W523-W603 HydrophobicContact CZ3-CZ3 3.66Å; W523-I606 HydrophobicContact CZ3-CD1 4.27Å
524	M	88	Confident	86.2	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-66.6	-39.6	174.3	-74.8	-165.2	-67.7	0	0	113.4	F520 N521 N522 E528 L599 R602 I606	F520-M524 HydrophobicContact CD1-CE 3.67Å; F520-M524 HydrophobicContact CD1-SD 4.33Å; F520-M524 HydrophobicContact CE1-CE 3.62Å; F520-M524 HydrophobicContact CE1-CG 4.35Å; F520-M524 HydrophobicContact CE1-SD 3.75Å; F520-M524 HydrophobicContact CZ-CG 4.4Å; F520-M524 HydrophobicContact CZ-SD 4.13Å; F520-M524 VanDerWaalsContact O-CG 3.31Å; F520-M524 WeakPolarHBondContact O-CG 3.15Å; F520-M524 PolarHBondContact O-N 3.44Å; N521-M524 HydrophobicContact CB-CE 4.3Å; N521-M524 CarbonylContact O-C 3.53Å; N521-M524 WeakPolarHBondContact O-CB 3.42Å; N521-M524 PolarHBondContact O-N 3.06Å; N521-M524 VanDerWaalsContact O-N 3.16Å; N522-M524 VanDerWaalsContact C-N 3.29Å; N522-M524 PolarHBondContact O-N 3.35Å; M524-E528 WeakPolarHBondContact O-CB 3.44Å; M524-E528 PolarHBondContact O-N 3.12Å; M524-L599 HydrophobicContact CE-CD2 3.58Å; M524-R602 HydrophobicContact CE-CB 4.45Å; M524-R602 HydrophobicContact SD-CB 3.98Å; M524-I606 HydrophobicContact CB-CD1 3.58Å; M524-I606 HydrophobicContact CG-CD1 3.38Å; M524-I606 HydrophobicContact SD-CD1 4.01Å
525	E	86	Confident	87.1	Confident	89 Å²	89	64.8 Å²	64.8	42%	0.416	32%	0.319	S	S	.	.	H	α-helix	trans	-69.9	-45	178	-79	173.8	-170	0	0	111.5	N521 N522 T527 E528 E529 R602	N521-E525 PolarHBondContact ND2-OE1 2.83Å; N521-E525 WeakPolarHBondContact O-CB 3.35Å; N521-E525 WeakPolarHBondContact O-CG 3.15Å; N521-E525 PolarHBondContact O-N 2.84Å; N522-E525 PolarHBondContact O-N 3.17Å; E525-T527 VanDerWaalsContact C-N 3.35Å; E525-E528 CarbonylContact O-C 3.59Å; E525-E528 WeakPolarHBondContact O-CB 3.21Å; E525-E528 PolarHBondContact O-N 3.41Å; E525-E529 WeakPolarHBondContact O-CB 3.36Å; E525-E529 PolarHBondContact O-N 2.86Å; E525-R602 IonicContact OE1-CZ 2.88Å; E525-R602 IonicContact OE1-NH1 2.68Å; E525-R602 PolarHBondContact OE1-NH1 3.2Å; E525-R602 VanDerWaalsContact OE1-NH1 3.09Å; E525-R602 IonicContact OE1-NH2 2.83Å
526	Q	87.4	Confident	87.2	Confident	92 Å²	92	65.8 Å²	65.8	43%	0.43	33%	0.329	S	S	.	.	H	α-helix	trans	-62.6	-44.8	173.6	-172.2	64.4	50.2	0	0	110.4	N522 E528 E529 D530	N522-Q526 VanDerWaalsContact O-CB 3.23Å; N522-Q526 WeakPolarHBondContact O-CB 3.44Å; N522-Q526 PolarHBondContact O-N 2.92Å; Q526-E528 VanDerWaalsContact C-N 3.29Å; Q526-E528 PolarHBondContact O-N 3.44Å; Q526-E529 PolarHBondContact O-N 3.02Å; Q526-D530 PolarHBondContact NE2-OD1 3.28Å; Q526-D530 WeakPolarHBondContact O-CB 3.24Å; Q526-D530 PolarHBondContact O-N 3.4Å
527	T	91.1	Very high	87.4	Confident	5 Å²	5	61.6 Å²	61.6	3%	0.031	31%	0.313	C	S	.	.	H	α-helix	trans	-60.1	-42.1	174.2	-66.6	0	0	0	0	111	W523 E525 L531 F553 I606	W523-T527 WeakPolarHBondContact O-CB 3.26Å; W523-T527 PolarHBondContact O-N 3.06Å; W523-T527 PolarHBondContact O-OG1 3.06Å; E525-T527 VanDerWaalsContact C-N 3.35Å; T527-L531 HydrophobicContact CG2-CD1 3.58Å; T527-L531 HydrophobicContact CG2-CG 4.19Å; T527-L531 WeakPolarHBondContact O-CB 3.33Å; T527-L531 WeakPolarHBondContact O-CD1 3.25Å; T527-L531 WeakPolarHBondContact O-CG 3.45Å; T527-L531 PolarHBondContact O-N 2.73Å; T527-F553 HydrophobicContact CG2-CE1 4.31Å; T527-F553 HydrophobicContact CG2-CE2 3.92Å; T527-F553 HydrophobicContact CG2-CZ 3.37Å; T527-I606 HydrophobicContact CG2-CD1 4.25Å; T527-I606 HydrophobicContact CG2-CG1 4.32Å; T527-I606 HydrophobicContact CG2-CG2 3.69Å
528	E	89.4	Confident	87.3	Confident	37 Å²	37	67.7 Å²	67.7	17%	0.173	34%	0.342	C	S	.	.	H	α-helix	trans	-66.1	-38.1	176.9	179	174.3	-177.2	0	0	112.1	M524 E525 Q526 R532 R602 L609	M524-E528 WeakPolarHBondContact O-CB 3.44Å; M524-E528 PolarHBondContact O-N 3.12Å; E525-E528 CarbonylContact O-C 3.59Å; E525-E528 WeakPolarHBondContact O-CB 3.21Å; E525-E528 PolarHBondContact O-N 3.41Å; Q526-E528 VanDerWaalsContact C-N 3.29Å; Q526-E528 PolarHBondContact O-N 3.44Å; E528-R532 VanDerWaalsContact CD-NH1 3.31Å; E528-R532 VanDerWaalsContact CG-CZ 3.46Å; E528-R532 VanDerWaalsContact O-CB 3.29Å; E528-R532 WeakPolarHBondContact O-CB 3.49Å; E528-R532 WeakPolarHBondContact O-CG 3.46Å; E528-R532 PolarHBondContact O-N 3.37Å; E528-R532 IonicContact OE1-CZ 2.66Å; E528-R532 IonicContact OE1-NH1 2.83Å; E528-R532 PolarHBondContact OE1-NH1 2.86Å; E528-R532 IonicContact OE1-NH2 3.5Å; E528-R532 PolarHBondContact OE1-NH2 2.89Å; E528-R602 IonicContact OE2-CZ 3.79Å; E528-R602 IonicContact OE2-NH2 3.43Å; E528-R602 PolarHBondContact OE2-NH2 3.38Å; E528-L609 HydrophobicContact CB-CD1 4.45Å; E528-L609 HydrophobicContact CG-CD1 3.96Å
529	E	87.2	Confident	87.5	Confident	124 Å²	124	68.3 Å²	68.3	58%	0.579	34%	0.341	S	S	*	.	H	α-helix	trans	-65.1	-54.5	172.7	-175.1	174.4	176.9	0	0	110.9	E525 Q526 L531 R532 D533	E525-E529 WeakPolarHBondContact O-CB 3.36Å; E525-E529 PolarHBondContact O-N 2.86Å; Q526-E529 PolarHBondContact O-N 3.02Å; E529-L531 VanDerWaalsContact C-N 3.32Å; E529-L531 PolarHBondContact O-N 2.99Å; E529-R532 CarbonylContact O-C 3.58Å; E529-R532 WeakPolarHBondContact O-CA 3.16Å; E529-R532 PolarHBondContact O-N 3.07Å; E529-D533 WeakPolarHBondContact O-CB 3.48Å; E529-D533 PolarHBondContact O-N 3.18Å
530	D	88.6	Confident	87.6	Confident	84 Å²	84	66 Å²	66	45%	0.449	32%	0.324	S	S	.	.	H	α-helix	trans	-60.1	-39.8	-179.2	-66.6	-16.2	0	0	0	112.1	Q526 R532	Q526-D530 PolarHBondContact NE2-OD1 3.28Å; Q526-D530 WeakPolarHBondContact O-CB 3.24Å; Q526-D530 PolarHBondContact O-N 3.4Å; D530-R532 VanDerWaalsContact C-N 3.3Å; D530-R532 PolarHBondContact O-N 3.38Å
531	L	91.2	Very high	87.8	Confident	14 Å²	14	69.1 Å²	69.1	7%	0.073	35%	0.346	C	S	.	.	H	α-helix	trans	-71.6	-26.3	177.3	-69.5	172.9	0	0	0	112.4	T527 E529 F553 I606 L609 R613	T527-L531 HydrophobicContact CG2-CD1 3.58Å; T527-L531 HydrophobicContact CG2-CG 4.19Å; T527-L531 WeakPolarHBondContact O-CB 3.33Å; T527-L531 WeakPolarHBondContact O-CD1 3.25Å; T527-L531 WeakPolarHBondContact O-CG 3.45Å; T527-L531 PolarHBondContact O-N 2.73Å; E529-L531 VanDerWaalsContact C-N 3.32Å; E529-L531 PolarHBondContact O-N 2.99Å; L531-F553 HydrophobicContact CD1-CE1 4.43Å; L531-F553 HydrophobicContact CD2-CE1 4.21Å; L531-I606 HydrophobicContact CD1-CG2 4.31Å; L531-L609 HydrophobicContact CB-CB 4.03Å; L531-L609 HydrophobicContact CD1-CB 3.74Å; L531-R613 HydrophobicContact CD2-CB 3.81Å; L531-R613 HydrophobicContact CD2-CG 3.95Å
532	R	88.1	Confident	88	Confident	131 Å²	131	71.1 Å²	71.1	49%	0.494	36%	0.355	S	S	.	.	H	α-helix	trans	-92	-18.4	176.1	-74.5	-177.2	-177.2	143.3	10.4	113.8	E528 E529 D530 T534 L609	E528-R532 VanDerWaalsContact CD-NH1 3.31Å; E528-R532 VanDerWaalsContact CG-CZ 3.46Å; E528-R532 VanDerWaalsContact O-CB 3.29Å; E528-R532 WeakPolarHBondContact O-CB 3.49Å; E528-R532 WeakPolarHBondContact O-CG 3.46Å; E528-R532 PolarHBondContact O-N 3.37Å; E528-R532 IonicContact OE1-CZ 2.66Å; E528-R532 IonicContact OE1-NH1 2.83Å; E528-R532 PolarHBondContact OE1-NH1 2.86Å; E528-R532 IonicContact OE1-NH2 3.5Å; E528-R532 PolarHBondContact OE1-NH2 2.89Å; E529-R532 CarbonylContact O-C 3.58Å; E529-R532 WeakPolarHBondContact O-CA 3.16Å; E529-R532 PolarHBondContact O-N 3.07Å; D530-R532 VanDerWaalsContact C-N 3.3Å; D530-R532 PolarHBondContact O-N 3.38Å; R532-T534 PolarHBondContact O-N 3.13Å; R532-L609 HydrophobicContact CG-CD1 4.47Å; R532-L609 HydrophobicContact CG-CD2 4.24Å
533	D	87.2	Confident	88.3	Confident	92 Å²	92	66.6 Å²	66.6	49%	0.492	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-57.6	134.4	-175.4	-178.1	32	0	0	0	111	E529 R613	E529-D533 WeakPolarHBondContact O-CB 3.48Å; E529-D533 PolarHBondContact O-N 3.18Å; D533-R613 PolarHBondContact O-NH1 3.36Å; D533-R613 PolarHBondContact O-NH2 3.48Å
534	T	85.2	Confident	88.5	Confident	120 Å²	120	67.7 Å²	67.7	74%	0.736	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-83	127.5	-179	52.7	0	0	0	0	109.9	R532	R532-T534 PolarHBondContact O-N 3.13Å
535	F	87.2	Confident	88.7	Confident	50 Å²	50	75.8 Å²	75.8	22%	0.219	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-99.3	146.1	172.6	53.7	-89.2	0	0	0	110.7	V537 L546 R613 L616 L617 E620	F535-V537 HydrophobicContact CD2-CG1 4.48Å; F535-V537 HydrophobicContact CD2-CG2 4.49Å; F535-L546 HydrophobicContact CB-CD1 3.79Å; F535-L546 HydrophobicContact CD2-CD1 4.12Å; F535-L546 HydrophobicContact CG-CD1 3.96Å; F535-R613 VanDerWaalsContact CD1-CZ 3.5Å; F535-L616 HydrophobicContact CE1-CB 4.45Å; F535-L616 HydrophobicContact CZ-CB 4.27Å; F535-L617 HydrophobicContact CD1-CD2 4.22Å; F535-L617 HydrophobicContact CE1-CD2 3.81Å; F535-L617 HydrophobicContact CE1-CG 4.39Å; F535-L617 HydrophobicContact CE2-CD2 4.26Å; F535-L617 HydrophobicContact CZ-CD2 3.83Å; F535-L617 HydrophobicContact CZ-CG 4.46Å; F535-E620 HydrophobicContact CD2-CG 4.47Å; F535-E620 HydrophobicContact CE2-CB 3.8Å; F535-E620 HydrophobicContact CE2-CG 3.78Å; F535-E620 HydrophobicContact CZ-CB 4.33Å
536	I	86.3	Confident	89.1	Confident	138 Å²	138	74.3 Å²	74.3	71%	0.708	36%	0.364	S	S	*	.			trans	-120.1	124.9	167.7	-58.7	174.5	0	0	0	106.2
537	V	87.5	Confident	89.4	Confident	6 Å²	6	71.1 Å²	71.1	4%	0.036	35%	0.349	C	S	.	.			trans	-133.4	142.2	177.7	-63.2	0	0	0	0	109.4	F535 E542 V543 L546 E620 R623 Q624	F535-V537 HydrophobicContact CD2-CG1 4.48Å; F535-V537 HydrophobicContact CD2-CG2 4.49Å; V537-E542 WeakPolarHBondContact CA-OE2 3.17Å; V537-E542 HydrophobicContact CB-CB 3.92Å; V537-E542 HydrophobicContact CG1-CB 3.81Å; V537-V543 HydrophobicContact CG2-CB 4.25Å; V537-L546 HydrophobicContact CG1-CD1 3.62Å; V537-E620 HydrophobicContact CG2-CG 3.37Å; V537-E620 WeakPolarHBondContact CG2-OE1 3.5Å; V537-R623 PolarHBondContact O-NH2 3.29Å; V537-Q624 HydrophobicContact CG2-CG 4.5Å; V537-Q624 PolarHBondContact O-NE2 3.26Å
538	H	84.3	Confident	89.5	Confident	129 Å²	129	75 Å²	75	60%	0.597	37%	0.374	S	S	*	.			trans	-116.1	-12.5	-177.8	-60.9	-69	0	0	0	112.6	E542 Q624	H538-E542 PolarHBondContact N-OE2 3.33Å; H538-Q624 PolarHBondContact O-OE1 3.13Å
539	T	87.2	Confident	89.6	Confident	53 Å²	53	76.2 Å²	76.2	33%	0.325	39%	0.389	S	S	.	.	S	Bend	trans	-135.6	154.5	-173.9	69.6	0	0	0	0	113	E542 V543	T539-E542 PolarHBondContact N-OE2 3.04Å; T539-E542 PolarHBondContact O-N 3.22Å; T539-E542 VanDerWaalsContact OG1-CG 3.31Å; T539-E542 WeakPolarHBondContact OG1-CG 3.29Å; T539-E542 PolarHBondContact OG1-OE1 3.21Å; T539-E542 VanDerWaalsContact OG1-OE1 3.06Å; T539-V543 PolarHBondContact O-N 2.75Å
540	M	89.1	Confident	90	Very high	26 Å²	26	71 Å²	71	13%	0.128	37%	0.365	C	S	.	.	H	α-helix	trans	-57.2	-44	174.9	-81.9	-63.1	-54.8	0	0	113.7	E542 V543 E544 R621 Q624 L625	M540-E542 VanDerWaalsContact C-N 3.27Å; M540-E542 PolarHBondContact O-N 3.03Å; M540-V543 WeakPolarHBondContact O-CG1 3.41Å; M540-V543 PolarHBondContact O-N 3.13Å; M540-V543 HydrophobicContact SD-CG1 4.3Å; M540-E544 HydrophobicContact CE-CG 4.49Å; M540-E544 WeakPolarHBondContact O-CG 3.25Å; M540-E544 PolarHBondContact O-N 3.36Å; M540-E544 VanDerWaalsContact O-N 3.15Å; M540-R621 HydrophobicContact CE-CG 4.31Å; M540-Q624 HydrophobicContact CG-CB 4.01Å; M540-Q624 VanDerWaalsContact SD-C 3.56Å; M540-Q624 HydrophobicContact SD-CB 3.3Å; M540-Q624 WeakPolarHBondContact SD-CB 3.43Å; M540-L625 HydrophobicContact CE-CD2 3.61Å; M540-L625 HydrophobicContact CE-CG 3.85Å; M540-L625 HydrophobicContact SD-CB 4.47Å; M540-L625 HydrophobicContact SD-CD2 3.86Å; M540-L625 HydrophobicContact SD-CG 3.78Å; M540-L625 PolarHBondContact SD-N 3.49Å
541	P	91.2	Very high	90.1	Very high	78 Å²	78	72.1 Å²	72.1	51%	0.506	37%	0.368	S	S	.	.	H	α-helix	trans	-63.6	-29	178	-25.2	36.4	0	0	0	114	R545	P541-R545 WeakPolarHBondContact O-CG 3.43Å; P541-R545 PolarHBondContact O-N 3.27Å; P541-R545 PolarHBondContact O-NE 2.62Å
542	E	90.9	Very high	90.2	Very high	56 Å²	56	74.3 Å²	74.3	26%	0.262	39%	0.387	S	S	.	.	H	α-helix	trans	-67.2	-47.1	176	-76.4	160.2	-153.8	0	0	112.1	V537 H538 T539 M540 E544 R545 L546	V537-E542 WeakPolarHBondContact CA-OE2 3.17Å; V537-E542 HydrophobicContact CB-CB 3.92Å; V537-E542 HydrophobicContact CG1-CB 3.81Å; H538-E542 PolarHBondContact N-OE2 3.33Å; T539-E542 PolarHBondContact N-OE2 3.04Å; T539-E542 PolarHBondContact O-N 3.22Å; T539-E542 VanDerWaalsContact OG1-CG 3.31Å; T539-E542 WeakPolarHBondContact OG1-CG 3.29Å; T539-E542 PolarHBondContact OG1-OE1 3.21Å; T539-E542 VanDerWaalsContact OG1-OE1 3.06Å; M540-E542 VanDerWaalsContact C-N 3.27Å; M540-E542 PolarHBondContact O-N 3.03Å; E542-E544 PolarHBondContact O-N 3.45Å; E542-R545 PolarHBondContact O-N 3.26Å; E542-L546 PolarHBondContact O-N 2.89Å
543	V	92.3	Very high	90.4	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-67.3	-36.1	179.6	65.7	0	0	0	0	112.1	V537 T539 M540 R545 L546 I547 E620 R621 Q624	V537-V543 HydrophobicContact CG2-CB 4.25Å; T539-V543 PolarHBondContact O-N 2.75Å; M540-V543 WeakPolarHBondContact O-CG1 3.41Å; M540-V543 PolarHBondContact O-N 3.13Å; M540-V543 HydrophobicContact SD-CG1 4.3Å; V543-R545 PolarHBondContact O-N 3.22Å; V543-L546 PolarHBondContact O-N 3.3Å; V543-I547 HydrophobicContact CG2-CD1 4.14Å; V543-I547 WeakPolarHBondContact O-CG1 3.43Å; V543-I547 PolarHBondContact O-N 3.49Å; V543-E620 HydrophobicContact CB-CG 4.43Å; V543-E620 HydrophobicContact CG2-CB 4.1Å; V543-E620 HydrophobicContact CG2-CG 3.87Å; V543-R621 HydrophobicContact CG1-CB 4.39Å; V543-R621 HydrophobicContact CG2-CB 4.05Å; V543-Q624 HydrophobicContact CG1-CB 4.31Å; V543-Q624 HydrophobicContact CG1-CG 4.18Å
544	E	92.8	Very high	90.7	Very high	97 Å²	97	69 Å²	69	45%	0.453	37%	0.365	S	S	.	.	H	α-helix	trans	-64.8	-37.6	176.9	-73.6	-179.6	167.9	0	0	112.8	M540 E542 I547 T548	M540-E544 HydrophobicContact CE-CG 4.49Å; M540-E544 WeakPolarHBondContact O-CG 3.25Å; M540-E544 PolarHBondContact O-N 3.36Å; M540-E544 VanDerWaalsContact O-N 3.15Å; E542-E544 PolarHBondContact O-N 3.45Å; E544-I547 PolarHBondContact O-N 3.16Å; E544-T548 WeakPolarHBondContact O-CB 3.36Å; E544-T548 PolarHBondContact O-N 3.47Å; E544-T548 PolarHBondContact O-OG1 3.45Å
545	R	93.4	Very high	90.9	Very high	170 Å²	170	69.9 Å²	69.9	64%	0.642	37%	0.365	S	S	*	.	H	α-helix	trans	-62.7	-42.8	173.8	-74.6	-175.4	-61.9	-173.1	2.9	111.8	P541 E542 V543 T548 A549	P541-R545 WeakPolarHBondContact O-CG 3.43Å; P541-R545 PolarHBondContact O-N 3.27Å; P541-R545 PolarHBondContact O-NE 2.62Å; E542-R545 PolarHBondContact O-N 3.26Å; V543-R545 PolarHBondContact O-N 3.22Å; R545-T548 PolarHBondContact O-N 3.35Å; R545-A549 PolarHBondContact O-N 2.95Å
546	L	93.5	Very high	91.1	Very high	58 Å²	58	70.3 Å²	70.3	30%	0.304	37%	0.372	S	S	.	.	H	α-helix	trans	-65.2	-41.6	177.5	-67.9	177.2	0	0	0	112.3	F535 V537 E542 V543 A549 H550 L617	F535-L546 HydrophobicContact CB-CD1 3.79Å; F535-L546 HydrophobicContact CD2-CD1 4.12Å; F535-L546 HydrophobicContact CG-CD1 3.96Å; V537-L546 HydrophobicContact CG1-CD1 3.62Å; E542-L546 PolarHBondContact O-N 2.89Å; V543-L546 PolarHBondContact O-N 3.3Å; L546-A549 PolarHBondContact O-N 3.35Å; L546-H550 WeakPolarHBondContact O-CB 3.32Å; L546-H550 PolarHBondContact O-N 2.95Å; L546-L617 HydrophobicContact CB-CD2 3.76Å; L546-L617 HydrophobicContact CD1-CD2 4.24Å
547	I	92.9	Very high	91.2	Very high	25 Å²	25	65 Å²	65	13%	0.128	35%	0.345	C	S	.	.	H	α-helix	trans	-61.1	-45.9	175.9	-71.6	168.3	0	0	0	110.9	V543 E544 A549 H550 Q551 L617 R621	V543-I547 HydrophobicContact CG2-CD1 4.14Å; V543-I547 WeakPolarHBondContact O-CG1 3.43Å; V543-I547 PolarHBondContact O-N 3.49Å; E544-I547 PolarHBondContact O-N 3.16Å; I547-A549 VanDerWaalsContact C-N 3.34Å; I547-A549 PolarHBondContact O-N 3.15Å; I547-H550 PolarHBondContact O-N 2.92Å; I547-Q551 WeakPolarHBondContact O-CG 3.27Å; I547-Q551 PolarHBondContact O-N 3.29Å; I547-L617 HydrophobicContact CG1-CB 3.83Å; I547-R621 HydrophobicContact CD1-CB 3.93Å; I547-R621 HydrophobicContact CD1-CG 4.29Å
548	T	93.7	Very high	91.2	Very high	88 Å²	88	71.1 Å²	71.1	54%	0.54	38%	0.377	S	S	.	.	H	α-helix	trans	-61.9	-42.6	179.6	-55	0	0	0	0	111.3	E544 R545 Q551 A552	E544-T548 WeakPolarHBondContact O-CB 3.36Å; E544-T548 PolarHBondContact O-N 3.47Å; E544-T548 PolarHBondContact O-OG1 3.45Å; R545-T548 PolarHBondContact O-N 3.35Å; T548-Q551 PolarHBondContact O-N 3.22Å; T548-A552 PolarHBondContact O-N 2.79Å; T548-A552 VanDerWaalsContact O-N 3.16Å
549	A	92.8	Very high	91.3	Very high	61 Å²	61	72.7 Å²	72.7	50%	0.504	39%	0.385	S	S	.	.	H	α-helix	trans	-63.3	-41.9	176.2	0	0	0	0	0	112.3	R545 L546 I547 A552 F553	R545-A549 PolarHBondContact O-N 2.95Å; L546-A549 PolarHBondContact O-N 3.35Å; I547-A549 VanDerWaalsContact C-N 3.34Å; I547-A549 PolarHBondContact O-N 3.15Å; A549-A552 PolarHBondContact O-N 2.93Å; A549-F553 PolarHBondContact O-N 2.86Å; A549-F553 VanDerWaalsContact O-N 3.1Å
550	H	93.8	Very high	91.3	Very high	16 Å²	16	70.7 Å²	70.7	7%	0.074	37%	0.374	C	S	.	.	H	α-helix	trans	-64.9	-41.3	178.3	-174.8	76.7	0	0	0	112.5	L546 I547 A552 F553 E554 T610 R613 L617	L546-H550 WeakPolarHBondContact O-CB 3.32Å; L546-H550 PolarHBondContact O-N 2.95Å; I547-H550 PolarHBondContact O-N 2.92Å; H550-A552 VanDerWaalsContact C-N 3.32Å; H550-A552 PolarHBondContact O-N 2.74Å; H550-F553 WeakPolarHBondContact O-CB 3.46Å; H550-F553 PolarHBondContact O-N 2.81Å; H550-E554 IonicContact CD2-OE1 2.68Å; H550-E554 PolarHBondContact CD2-OE1 3.46Å; H550-E554 IonicContact CE1-OE1 3.95Å; H550-E554 IonicContact NE2-OE1 3.94Å; H550-E554 PolarHBondContact NE2-OE1 2.95Å; H550-E554 PolarHBondContact O-N 3.48Å; H550-T610 PolarHBondContact NE2-O 2.98Å; H550-R613 WeakPolarHBondContact ND1-CG 3.26Å; H550-L617 HydrophobicContact CB-CD1 3.63Å
551	Q	92.5	Very high	91.2	Very high	107 Å²	107	72.6 Å²	72.6	50%	0.5	38%	0.382	S	S	.	.	H	α-helix	trans	-62.9	-37.8	175	-73	175.4	-13.6	0	0	112.5	I547 T548 F553 E554 N555	I547-Q551 WeakPolarHBondContact O-CG 3.27Å; I547-Q551 PolarHBondContact O-N 3.29Å; T548-Q551 PolarHBondContact O-N 3.22Å; Q551-F553 VanDerWaalsContact C-N 3.34Å; Q551-E554 PolarHBondContact O-N 3.28Å; Q551-N555 PolarHBondContact O-ND2 2.92Å
552	A	92.8	Very high	91	Very high	59 Å²	59	73.5 Å²	73.5	49%	0.488	38%	0.383	S	S	.	.	H	α-helix	trans	-65.1	-39.4	175.4	0	0	0	0	0	111.8	T548 A549 H550 N555	T548-A552 PolarHBondContact O-N 2.79Å; T548-A552 VanDerWaalsContact O-N 3.16Å; A549-A552 PolarHBondContact O-N 2.93Å; H550-A552 VanDerWaalsContact C-N 3.32Å; H550-A552 PolarHBondContact O-N 2.74Å; A552-N555 PolarHBondContact O-N 3.5Å
553	F	92.5	Very high	90.7	Very high	46 Å²	46	73.4 Å²	73.4	20%	0.202	38%	0.382	C	S	.	.	H	α-helix	trans	-63.2	-43.5	174.5	166.9	-97	0	0	0	112.4	W523 T527 L531 A549 H550 Q551 N555 T556 L557 T610	W523-F553 HydrophobicContact CZ2-CE2 4.34Å; T527-F553 HydrophobicContact CG2-CE1 4.31Å; T527-F553 HydrophobicContact CG2-CE2 3.92Å; T527-F553 HydrophobicContact CG2-CZ 3.37Å; L531-F553 HydrophobicContact CD1-CE1 4.43Å; L531-F553 HydrophobicContact CD2-CE1 4.21Å; A549-F553 PolarHBondContact O-N 2.86Å; A549-F553 VanDerWaalsContact O-N 3.1Å; H550-F553 WeakPolarHBondContact O-CB 3.46Å; H550-F553 PolarHBondContact O-N 2.81Å; Q551-F553 VanDerWaalsContact C-N 3.34Å; F553-N555 PolarHBondContact O-N 3.35Å; F553-N555 VanDerWaalsContact O-N 3.15Å; F553-T556 WeakPolarHBondContact O-CB 3.45Å; F553-T556 PolarHBondContact O-N 3.23Å; F553-T556 PolarHBondContact O-OG1 3.17Å; F553-L557 HydrophobicContact CE1-CD2 4.11Å; F553-L557 HydrophobicContact CZ-CD2 3.82Å; F553-T610 HydrophobicContact CE1-CG2 4.21Å
554	E	91.7	Very high	90.3	Very high	67 Å²	67	73.9 Å²	73.9	31%	0.313	39%	0.386	S	S	.	.	H	α-helix	trans	-56	-33.7	-179.9	-76.6	-179.8	160.7	0	0	112.9	H550 Q551 T556 L557 T610	H550-E554 IonicContact CD2-OE1 2.68Å; H550-E554 PolarHBondContact CD2-OE1 3.46Å; H550-E554 IonicContact CE1-OE1 3.95Å; H550-E554 IonicContact NE2-OE1 3.94Å; H550-E554 PolarHBondContact NE2-OE1 2.95Å; H550-E554 PolarHBondContact O-N 3.48Å; Q551-E554 PolarHBondContact O-N 3.28Å; E554-T556 PolarHBondContact O-N 3.33Å; E554-L557 PolarHBondContact O-N 3.03Å; E554-T610 HydrophobicContact CG-CG2 3.6Å
555	N	90.6	Very high	89.9	Confident	137 Å²	137	76.2 Å²	76.2	73%	0.733	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-10.8	177.5	-63.7	-36.1	0	0	0	114.3	Q551 A552 F553	Q551-N555 PolarHBondContact O-ND2 2.92Å; A552-N555 PolarHBondContact O-N 3.5Å; F553-N555 PolarHBondContact O-N 3.35Å; F553-N555 VanDerWaalsContact O-N 3.15Å
556	T	90.3	Very high	89.5	Confident	59 Å²	59	71.9 Å²	71.9	36%	0.362	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-6.8	-178.3	67.8	0	0	0	0	113.9	F553 E554 D558	F553-T556 WeakPolarHBondContact O-CB 3.45Å; F553-T556 PolarHBondContact O-N 3.23Å; F553-T556 PolarHBondContact O-OG1 3.17Å; E554-T556 PolarHBondContact O-N 3.33Å; T556-D558 PolarHBondContact O-N 3.35Å
557	L	89.4	Confident	89	Confident	27 Å²	27	69.1 Å²	69.1	14%	0.141	36%	0.363	C	S	.	.	H	α-helix	trans	-68.8	-30.4	-170.6	-67.8	175.6	0	0	0	114	W523 F553 E554 E559 A560 E561 W603 I606 T610	W523-L557 HydrophobicContact CH2-CD2 4.13Å; W523-L557 HydrophobicContact CZ2-CD2 4.43Å; F553-L557 HydrophobicContact CE1-CD2 4.11Å; F553-L557 HydrophobicContact CZ-CD2 3.82Å; E554-L557 PolarHBondContact O-N 3.03Å; L557-E559 VanDerWaalsContact C-N 3.33Å; L557-E559 PolarHBondContact O-N 3.32Å; L557-A560 PolarHBondContact O-N 3.32Å; L557-E561 PolarHBondContact O-N 3.14Å; L557-W603 HydrophobicContact CB-CH2 4.33Å; L557-W603 HydrophobicContact CD2-CH2 4.22Å; L557-W603 WeakPolarHBondContact O-CH2 3.46Å; L557-W603 WeakPolarHBondContact O-CZ2 3.24Å; L557-I606 HydrophobicContact CD2-CG2 4.37Å; L557-T610 HydrophobicContact CD1-CG2 4.16Å
558	D	87.3	Confident	88.5	Confident	135 Å²	135	71.9 Å²	71.9	72%	0.722	38%	0.375	S	S	*	.	H	α-helix	trans	-65.2	-36.1	-177.7	-70.4	-24.2	0	0	0	112.5	T556 E561	T556-D558 PolarHBondContact O-N 3.35Å; D558-E561 PolarHBondContact O-N 3.07Å
559	E	87.3	Confident	87.9	Confident	161 Å²	161	72.7 Å²	72.7	75%	0.752	38%	0.376	S	S	*	.	H	α-helix	trans	-68.5	-38.2	178.8	-63.6	-176.9	173.5	0	0	111.7	L557 E561 N562	L557-E559 VanDerWaalsContact C-N 3.33Å; L557-E559 PolarHBondContact O-N 3.32Å; E559-E561 VanDerWaalsContact C-N 3.35Å; E559-E561 PolarHBondContact O-N 3.36Å; E559-N562 PolarHBondContact O-N 2.95Å
560	A	86.4	Confident	87.3	Confident	11 Å²	11	71.3 Å²	71.3	9%	0.091	36%	0.362	C	S	.	.	H	α-helix	trans	-68.1	-32.4	178.2	0	0	0	0	0	112.7	F520 W523 L557 N562 E563 S564 W603	F520-A560 HydrophobicContact CE2-CB 4.03Å; F520-A560 WeakPolarHBondContact CE2-O 3.13Å; F520-A560 VanDerWaalsContact CZ-O 3.3Å; F520-A560 WeakPolarHBondContact CZ-O 3.5Å; W523-A560 HydrophobicContact CE3-CB 4.19Å; W523-A560 HydrophobicContact CH2-CB 3.23Å; W523-A560 HydrophobicContact CZ2-CB 3.69Å; W523-A560 HydrophobicContact CZ3-CB 3.52Å; L557-A560 PolarHBondContact O-N 3.32Å; A560-N562 PolarHBondContact O-N 3.4Å; A560-E563 PolarHBondContact O-N 3.21Å; A560-S564 PolarHBondContact O-N 3.48Å; A560-W603 HydrophobicContact CB-CH2 3.64Å; A560-W603 HydrophobicContact CB-CZ3 3.64Å
561	E	87	Confident	86.5	Confident	66 Å²	66	71.3 Å²	71.3	31%	0.308	37%	0.365	S	S	.	.	H	α-helix	trans	-59.9	-36.7	175.3	-168.6	178.4	143.3	0	0	112	L557 D558 E559 S564 R565 W603	L557-E561 PolarHBondContact O-N 3.14Å; D558-E561 PolarHBondContact O-N 3.07Å; E559-E561 VanDerWaalsContact C-N 3.35Å; E559-E561 PolarHBondContact O-N 3.36Å; E561-S564 WeakPolarHBondContact O-CB 3.25Å; E561-R565 IonicContact OE1-CZ 3.84Å; E561-R565 IonicContact OE1-NH2 2.84Å; E561-R565 PolarHBondContact OE1-NH2 3.35Å; E561-W603 HydrophobicContact CB-CH2 4.39Å; E561-W603 HydrophobicContact CB-CZ2 3.64Å; E561-W603 HydrophobicContact CG-CZ2 4.24Å
562	N	86.4	Confident	85.8	Confident	97 Å²	97	73.2 Å²	73.2	52%	0.519	37%	0.374	S	S	.	.	H	α-helix	trans	-68.6	-39.3	-177.7	-175	53.2	0	0	0	113.2	E559 A560 S564 R565	E559-N562 PolarHBondContact O-N 2.95Å; A560-N562 PolarHBondContact O-N 3.4Å; N562-S564 VanDerWaalsContact C-N 3.32Å; N562-S564 PolarHBondContact O-N 3.49Å; N562-R565 PolarHBondContact O-N 2.96Å
563	E	86.2	Confident	85.1	Confident	55 Å²	55	76.9 Å²	76.9	26%	0.257	38%	0.379	S	S	.	.	H	α-helix	trans	-66.3	-35.4	179	-174.1	59.5	-163	0	0	111.9	R516 F520 A560 R565 Q566 L567	R516-E563 IonicContact CZ-OE1 3Å; R516-E563 IonicContact NE-OE1 3.09Å; R516-E563 PolarHBondContact NE-OE1 3.12Å; R516-E563 IonicContact NH2-OE1 3.46Å; R516-E563 PolarHBondContact NH2-OE1 3.2Å; R516-E563 VanDerWaalsContact NH2-OE1 3.09Å; R516-E563 IonicContact NH2-OE2 3Å; R516-E563 PolarHBondContact NH2-OE2 3.33Å; F520-E563 HydrophobicContact CB-CG 4.23Å; F520-E563 HydrophobicContact CD2-CB 3.92Å; F520-E563 HydrophobicContact CD2-CG 3.91Å; F520-E563 HydrophobicContact CE2-CB 4.13Å; F520-E563 HydrophobicContact CG-CG 4.11Å; A560-E563 PolarHBondContact O-N 3.21Å; E563-R565 VanDerWaalsContact C-N 3.26Å; E563-R565 PolarHBondContact O-N 3.33Å; E563-Q566 PolarHBondContact O-N 3.16Å; E563-Q566 VanDerWaalsContact O-N 3.1Å; E563-L567 PolarHBondContact O-N 2.93Å
564	S	83.3	Confident	84.1	Confident	10 Å²	10	75 Å²	75	7%	0.07	37%	0.371	C	S	.	.	H	α-helix	trans	-54.9	-40.4	174.8	-168	0	0	0	0	112.7	A560 E561 N562 Q566	A560-S564 PolarHBondContact O-N 3.48Å; E561-S564 WeakPolarHBondContact O-CB 3.25Å; N562-S564 VanDerWaalsContact C-N 3.32Å; N562-S564 PolarHBondContact O-N 3.49Å; S564-Q566 VanDerWaalsContact C-N 3.33Å; S564-Q566 PolarHBondContact O-N 3.46Å
565	R	84	Confident	83.2	Confident	146 Å²	146	78.2 Å²	78.2	55%	0.551	39%	0.386	S	S	*	.	H	α-helix	trans	-65.8	-31.6	179.3	-64.3	-177.8	-171.2	173.3	5.4	113	E561 N562 E563	E561-R565 IonicContact OE1-CZ 3.84Å; E561-R565 IonicContact OE1-NH2 2.84Å; E561-R565 PolarHBondContact OE1-NH2 3.35Å; N562-R565 PolarHBondContact O-N 2.96Å; E563-R565 VanDerWaalsContact C-N 3.26Å; E563-R565 PolarHBondContact O-N 3.33Å
566	Q	85.3	Confident	82.3	Confident	78 Å²	78	79.7 Å²	79.7	36%	0.364	39%	0.389	S	S	.	.	H	α-helix	trans	-79.6	-33	-175.2	-71.8	-68.7	-39.8	0	0	113.9	E563 S564 Q568 L569	E563-Q566 PolarHBondContact O-N 3.16Å; E563-Q566 VanDerWaalsContact O-N 3.1Å; S564-Q566 VanDerWaalsContact C-N 3.33Å; S564-Q566 PolarHBondContact O-N 3.46Å; Q566-Q568 VanDerWaalsContact C-N 3.26Å; Q566-Q568 PolarHBondContact O-N 3.41Å; Q566-L569 PolarHBondContact O-N 2.85Å
567	L	83.3	Confident	81.2	Confident	1 Å²	1	79 Å²	79	1%	0.005	38%	0.382	C	S	.	.	H	α-helix	trans	-59.1	-39.7	176.2	-65.1	174.7	0	0	0	111.5	F513 R516 A517 F520 E563 L569 C570 L599	F513-L567 WeakPolarHBondContact CD2-O 3.44Å; F513-L567 HydrophobicContact CE2-CB 4.13Å; F513-L567 WeakPolarHBondContact CE2-O 3.43Å; F513-L567 HydrophobicContact CZ-CB 4.25Å; R516-L567 HydrophobicContact CB-CD2 3.37Å; A517-L567 HydrophobicContact CB-CD1 3.91Å; A517-L567 HydrophobicContact CB-CD2 3.8Å; A517-L567 HydrophobicContact CB-CG 4.43Å; A517-L567 VanDerWaalsContact N-CD2 3.31Å; F520-L567 HydrophobicContact CB-CD1 4.21Å; F520-L567 HydrophobicContact CD1-CD1 3.68Å; F520-L567 HydrophobicContact CE1-CD1 4.48Å; F520-L567 HydrophobicContact CG-CD1 4.21Å; E563-L567 PolarHBondContact O-N 2.93Å; L567-L569 PolarHBondContact O-N 3.47Å; L567-C570 PolarHBondContact O-N 2.99Å; L567-C570 VanDerWaalsContact O-N 3.13Å; L567-L599 HydrophobicContact CB-CD1 3.62Å; L567-L599 HydrophobicContact CD1-CD1 3.66Å; L567-L599 HydrophobicContact CD1-CD2 4.36Å; L567-L599 HydrophobicContact CG-CD1 4.28Å
568	Q	81.9	Confident	80.2	Confident	82 Å²	82	77.9 Å²	77.9	38%	0.383	38%	0.377	S	S	.	.	H	α-helix	trans	-55.1	-36.4	-179.8	-67	-178.4	-17.4	0	0	113.7	Q566 C570	Q566-Q568 VanDerWaalsContact C-N 3.26Å; Q566-Q568 PolarHBondContact O-N 3.41Å; Q568-C570 PolarHBondContact O-N 2.93Å
569	L	81.1	Confident	79.4	Confident	106 Å²	106	76.6 Å²	76.6	56%	0.555	38%	0.379	S	S	*	.	H	α-helix	trans	-70	-27.7	-179.4	-69.5	171	0	0	0	113.9	Q566 L567	Q566-L569 PolarHBondContact O-N 2.85Å; L567-L569 PolarHBondContact O-N 3.47Å
570	C	80.7	Confident	78.6	Confident	32 Å²	32	76 Å²	76	22%	0.216	38%	0.376	C	S	.	.	H	α-helix	trans	-81.4	-26.5	-172.9	-176.2	0	0	0	0	113.9	F513 L567 Q568 Q572	F513-C570 HydrophobicContact CB-CB 4.09Å; F513-C570 VanDerWaalsContact CB-SG 3.57Å; F513-C570 HydrophobicContact CD2-CB 3.83Å; F513-C570 HydrophobicContact CG-CB 4.42Å; F513-C570 PolarHBondContact N-SG 2.97Å; F513-C570 VanDerWaalsContact N-SG 3.44Å; L567-C570 PolarHBondContact O-N 2.99Å; L567-C570 VanDerWaalsContact O-N 3.13Å; Q568-C570 PolarHBondContact O-N 2.93Å; C570-Q572 VanDerWaalsContact C-N 3.3Å; C570-Q572 PolarHBondContact O-N 3.41Å
571	A	75.8	Confident	77.4	Confident	16 Å²	16	80.8 Å²	80.8	13%	0.132	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-71.4	-24	-179.5	0	0	0	0	0	114	F513 K573 V574 P596	F513-A571 HydrophobicContact CD2-CB 3.93Å; F513-A571 HydrophobicContact CE2-CB 3.78Å; A571-K573 PolarHBondContact O-N 3.24Å; A571-V574 PolarHBondContact O-N 3.23Å; A571-P596 HydrophobicContact CB-CB 4.01Å; A571-P596 HydrophobicContact CB-CG 3.15Å
572	Q	78.4	Confident	76.4	Confident	146 Å²	146	86.9 Å²	86.9	68%	0.682	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-64.3	-17.7	-179.3	-67.6	177.9	-11.5	0	0	114.1	C570	C570-Q572 VanDerWaalsContact C-N 3.3Å; C570-Q572 PolarHBondContact O-N 3.41Å
573	K	78.1	Confident	75.2	Confident	136 Å²	136	83.2 Å²	83.2	59%	0.591	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-88.5	-14.8	-176.3	-72.5	-177	176.4	179.4	0	115.8	A571	A571-K573 PolarHBondContact O-N 3.24Å
574	V	71.4	Confident	74.1	Confident	6 Å²	6	86.6 Å²	86.6	4%	0.036	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-28.1	-166.6	129.4	0	0	0	0	112.9	L509 H510 A571 E576 T587	L509-V574 HydrophobicContact CB-CG2 4.02Å; H510-V574 HydrophobicContact CB-CG2 4.3Å; H510-V574 WeakPolarHBondContact CD2-CG1 3.49Å; H510-V574 WeakPolarHBondContact CD2-CG2 3.46Å; H510-V574 WeakPolarHBondContact NE2-CG1 3.39Å; A571-V574 PolarHBondContact O-N 3.23Å; V574-E576 PolarHBondContact O-N 3.43Å; V574-T587 WeakPolarHBondContact CG1-O 3.14Å
575	E	73.7	Confident	73.1	Confident	135 Å²	135	88.4 Å²	88.4	63%	0.631	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-14	-177.5	-61.5	179.1	170.4	0	0	112.2	T587	E575-T587 HydrophobicContact CB-CG2 4.21Å; E575-T587 WeakPolarHBondContact O-CG2 3.43Å
576	E	71.2	Confident	72.2	Confident	169 Å²	169	81.5 Å²	81.5	79%	0.79	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-42.4	-176.5	-166.4	177.3	169.5	0	0	115.1	V574	V574-E576 PolarHBondContact O-N 3.43Å
577	I	67.7	Low	71.3	Confident	43 Å²	43	81 Å²	81	22%	0.221	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-81.3	-23.2	-171.8	-52.3	172.6	0	0	0	113.1	I506 L509 S579	I506-I577 HydrophobicContact CD1-CB 4.14Å; I506-I577 HydrophobicContact CD1-CG2 3.67Å; I506-I577 HydrophobicContact CG1-CB 3.74Å; I506-I577 HydrophobicContact CG1-CD1 4.5Å; I506-I577 HydrophobicContact CG1-CG2 3.23Å; L509-I577 HydrophobicContact CD1-CD1 3.78Å; I577-S579 PolarHBondContact O-N 3.12Å
578	A	67	Low	70.5	Confident	4 Å²	4	86.5 Å²	86.5	3%	0.033	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-55	-33	-171.3	0	0	0	0	0	116.6	E580 L583 A586 T587	A578-E580 VanDerWaalsContact C-N 3.28Å; A578-E580 PolarHBondContact O-N 2.91Å; A578-L583 VanDerWaalsContact O-O 3.06Å; A578-A586 VanDerWaalsContact CB-CA 3.44Å; A578-A586 HydrophobicContact CB-CB 3.62Å; A578-A586 WeakPolarHBondContact CB-O 3.27Å; A578-T587 HydrophobicContact CB-CG2 3.26Å
579	S	71.6	Confident	70.1	Confident	109 Å²	109	83.7 Å²	83.7	76%	0.762	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-74.4	-10	-165.4	-172.3	0	0	0	0	114.3	I577	I577-S579 PolarHBondContact O-N 3.12Å
580	E	70.3	Confident	69.2	Low	148 Å²	148	79.8 Å²	79.8	69%	0.692	40%	0.402	S	S	*	.	S	Bend	trans	-85.9	-51.8	-166.8	-174.6	174.3	168.8	0	0	115.8	A578 K582	A578-E580 VanDerWaalsContact C-N 3.28Å; A578-E580 PolarHBondContact O-N 2.91Å; E580-K582 VanDerWaalsContact C-N 3.26Å; E580-K582 PolarHBondContact O-N 2.83Å; E580-K582 VanDerWaalsContact O-N 3.13Å
581	Y	61.7	Low	68.9	Low	111 Å²	111	80.5 Å²	80.5	44%	0.435	40%	0.4	S	S	.	.	S	Bend	trans	-85.7	22.7	-169.7	-81.2	-103.2	0	0	0	114.5	A502 L583	A502-Y581 HydrophobicContact CB-CD1 3.93Å; A502-Y581 HydrophobicContact CB-CE1 3.81Å; Y581-L583 VanDerWaalsContact CB-CD1 3.49Å; Y581-L583 VanDerWaalsContact CB-CD2 3.5Å; Y581-L583 HydrophobicContact CD2-CD1 4.44Å; Y581-L583 HydrophobicContact CG-CD1 4.25Å; Y581-L583 HydrophobicContact CG-CG 4.44Å; Y581-L583 WeakPolarHBondContact O-CD2 3.43Å; Y581-L583 PolarHBondContact O-N 2.89Å
582	K	65.6	Low	68.9	Low	195 Å²	195	80.2 Å²	80.2	85%	0.848	40%	0.397	S	S	*	.	S	Bend	trans	48.3	27.1	-166.3	-60.5	-176.9	-177.6	178	0	113	E580 V584	E580-K582 VanDerWaalsContact C-N 3.26Å; E580-K582 PolarHBondContact O-N 2.83Å; E580-K582 VanDerWaalsContact O-N 3.13Å; K582-V584 PolarHBondContact O-N 3.24Å
583	L	61.8	Low	68.6	Low	20 Å²	20	80.4 Å²	80.4	11%	0.105	40%	0.403	C	S	.	.			trans	-77.2	91.8	167.5	-34.7	161.7	0	0	0	102.4	A424 L503 I506 A578 Y581 N585 A586	A424-L583 VanDerWaalsContact O-CD2 3.29Å; A424-L583 WeakPolarHBondContact O-CD2 3.21Å; L503-L583 HydrophobicContact CD2-CD1 3.15Å; L503-L583 HydrophobicContact CD2-CD2 3.38Å; L503-L583 HydrophobicContact CD2-CG 3.75Å; L503-L583 HydrophobicContact CG-CD2 4.2Å; I506-L583 HydrophobicContact CD1-CD1 3.76Å; A578-L583 VanDerWaalsContact O-O 3.06Å; Y581-L583 VanDerWaalsContact CB-CD1 3.49Å; Y581-L583 VanDerWaalsContact CB-CD2 3.5Å; Y581-L583 HydrophobicContact CD2-CD1 4.44Å; Y581-L583 HydrophobicContact CG-CD1 4.25Å; Y581-L583 HydrophobicContact CG-CG 4.44Å; Y581-L583 WeakPolarHBondContact O-CD2 3.43Å; Y581-L583 PolarHBondContact O-N 2.89Å; L583-N585 PolarHBondContact O-N 3.46Å; L583-A586 HydrophobicContact CB-CB 3.6Å; L583-A586 HydrophobicContact CD1-CB 3.55Å; L583-A586 HydrophobicContact CG-CB 4.26Å; L583-A586 PolarHBondContact O-N 2.93Å
584	V	63.2	Low	68.6	Low	125 Å²	125	74.7 Å²	74.7	76%	0.758	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-13.9	177.4	-176.2	0	0	0	0	111.8	K582	K582-V584 PolarHBondContact O-N 3.24Å
585	N	61.4	Low	69	Low	49 Å²	49	78.8 Å²	78.8	26%	0.262	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-23	-158.8	-91.8	17.1	0	0	0	112.6	S423 M425 E428 L583 T587 Q588	S423-N585 WeakPolarHBondContact O-CB 3.47Å; S423-N585 PolarHBondContact O-ND2 3Å; S423-N585 VanDerWaalsContact O-ND2 3.14Å; M425-N585 VanDerWaalsContact CE-C 3.42Å; M425-N585 HydrophobicContact CE-CB 3.56Å; M425-N585 WeakPolarHBondContact CE-O 3.36Å; M425-N585 HydrophobicContact CG-CB 3.34Å; M425-N585 WeakPolarHBondContact CG-O 3.22Å; M425-N585 HydrophobicContact SD-CB 4.19Å; E428-N585 PolarHBondContact OE1-ND2 3.1Å; E428-N585 VanDerWaalsContact OE1-ND2 3.17Å; E428-N585 WeakPolarHBondContact OE2-CB 3.24Å; E428-N585 PolarHBondContact OE2-ND2 3.28Å; L583-N585 PolarHBondContact O-N 3.46Å; N585-T587 PolarHBondContact O-N 2.92Å; N585-T587 PolarHBondContact O-OG1 2.84Å; N585-Q588 PolarHBondContact O-N 3.01Å
586	A	66.1	Low	69.2	Low	1 Å²	1	74.2 Å²	74.2	1%	0.008	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	8.4	-152.7	0	0	0	0	0	120.9	M425 I506 A578 L583	M425-A586 HydrophobicContact CB-CB 3.66Å; M425-A586 HydrophobicContact CG-CB 3.76Å; M425-A586 VanDerWaalsContact CG-N 3.31Å; M425-A586 WeakPolarHBondContact SD-CA 3.4Å; M425-A586 HydrophobicContact SD-CB 4.42Å; I506-A586 HydrophobicContact CD1-CB 3.5Å; A578-A586 VanDerWaalsContact CB-CA 3.44Å; A578-A586 HydrophobicContact CB-CB 3.62Å; A578-A586 WeakPolarHBondContact CB-O 3.27Å; L583-A586 HydrophobicContact CB-CB 3.6Å; L583-A586 HydrophobicContact CD1-CB 3.55Å; L583-A586 HydrophobicContact CG-CB 4.26Å; L583-A586 PolarHBondContact O-N 2.93Å
587	T	65.8	Low	69.6	Low	67 Å²	67	71.7 Å²	71.7	41%	0.411	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-12.2	176	52.6	0	0	0	0	112.6	V574 E575 A578 N585	V574-T587 WeakPolarHBondContact CG1-O 3.14Å; E575-T587 HydrophobicContact CB-CG2 4.21Å; E575-T587 WeakPolarHBondContact O-CG2 3.43Å; A578-T587 HydrophobicContact CB-CG2 3.26Å; N585-T587 PolarHBondContact O-N 2.92Å; N585-T587 PolarHBondContact O-OG1 2.84Å
588	Q	66	Low	70.3	Confident	116 Å²	116	72.4 Å²	72.4	54%	0.542	37%	0.368	S	S	.	.	S	Bend	trans	-92.5	135.9	-176.9	-158.1	176	48.4	0	0	111.3	M425 H510 N585 P590	M425-Q588 HydrophobicContact CE-CB 3.12Å; M425-Q588 HydrophobicContact CE-CG 4.08Å; M425-Q588 HydrophobicContact SD-CB 3.63Å; H510-Q588 PolarHBondContact CE1-O 2.94Å; H510-Q588 VanDerWaalsContact NE2-C 3.3Å; H510-Q588 PolarHBondContact NE2-O 2.95Å; H510-Q588 VanDerWaalsContact NE2-O 3.1Å; N585-Q588 PolarHBondContact O-N 3.01Å; Q588-P590 WeakPolarHBondContact O-CD 3.45Å
589	N	73.3	Confident	71.1	Confident	24 Å²	24	72.2 Å²	72.2	13%	0.128	37%	0.367	C	S	.	.			trans	-72.3	108.3	-174.8	-160.7	-28.5	0	0	0	115.2	H510 F513 Y591 T592	H510-N589 WeakPolarHBondContact CA-ND2 3.33Å; H510-N589 WeakPolarHBondContact CA-OD1 3.38Å; H510-N589 WeakPolarHBondContact CB-OD1 3.42Å; H510-N589 WeakPolarHBondContact CD2-CA 3.44Å; H510-N589 WeakPolarHBondContact CD2-CB 3.41Å; H510-N589 PolarHBondContact CD2-ND2 3Å; H510-N589 PolarHBondContact CD2-OD1 2.89Å; H510-N589 WeakPolarHBondContact NE2-CA 3.17Å; H510-N589 PolarHBondContact NE2-N 3.21Å; H510-N589 PolarHBondContact O-ND2 3.34Å; H510-N589 PolarHBondContact O-OD1 3.48Å; H510-N589 VanDerWaalsContact O-OD1 3.13Å; F513-N589 WeakPolarHBondContact CB-ND2 3.41Å; N589-Y591 PolarHBondContact OD1-N 3.36Å; N589-Y591 VanDerWaalsContact OD1-N 3.16Å; N589-T592 HydrophobicContact CB-CG2 3.71Å; N589-T592 WeakPolarHBondContact ND2-CG2 3.45Å; N589-T592 WeakPolarHBondContact OD1-CG2 3.45Å
590	P	62.9	Low	71.7	Confident	23 Å²	23	69.4 Å²	69.4	15%	0.149	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-22.5	-177.1	37.1	-46.1	0	0	0	116.1	S427 H510 Q588 T592	S427-P590 WeakPolarHBondContact O-CB 3Å; S427-P590 WeakPolarHBondContact OG-CB 3.39Å; S427-P590 WeakPolarHBondContact OG-CG 3.35Å; H510-P590 HydrophobicContact CB-CG 3.61Å; H510-P590 WeakPolarHBondContact CD2-CD 3.46Å; H510-P590 WeakPolarHBondContact CE1-CD 3.43Å; H510-P590 WeakPolarHBondContact ND1-CD 3.47Å; H510-P590 VanDerWaalsContact ND1-CG 3.34Å; H510-P590 WeakPolarHBondContact ND1-CG 3.45Å; H510-P590 WeakPolarHBondContact NE2-CD 3.47Å; Q588-P590 WeakPolarHBondContact O-CD 3.45Å; P590-T592 VanDerWaalsContact C-N 3.31Å
591	Y	74	Confident	72.4	Confident	48 Å²	48	68.7 Å²	68.7	19%	0.188	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-0.2	-179	-57.3	-96.6	0	0	0	112.3	D507 Q508 H510 L511 A514 N589	D507-Y591 WeakPolarHBondContact CA-OH 3.35Å; D507-Y591 HydrophobicContact CB-CE1 4.16Å; D507-Y591 HydrophobicContact CB-CE2 3.44Å; D507-Y591 VanDerWaalsContact CB-CE2 3.44Å; D507-Y591 WeakPolarHBondContact CB-OH 3.32Å; D507-Y591 WeakPolarHBondContact O-CE2 3.45Å; D507-Y591 PolarHBondContact O-OH 3.44Å; D507-Y591 VanDerWaalsContact OD1-CE1 3.25Å; D507-Y591 WeakPolarHBondContact OD1-CE1 3.44Å; D507-Y591 WeakPolarHBondContact OD1-CE2 3.44Å; D507-Y591 PolarHBondContact OD1-OH 3.4Å; D507-Y591 VanDerWaalsContact OD2-CE1 3.3Å; D507-Y591 WeakPolarHBondContact OD2-CE1 3.42Å; D507-Y591 PolarHBondContact OD2-OH 2.81Å; Q508-Y591 PolarHBondContact N-OH 3.15Å; H510-Y591 VanDerWaalsContact C-CE2 3.43Å; H510-Y591 HydrophobicContact CB-CD2 3.39Å; H510-Y591 HydrophobicContact CB-CE2 3.37Å; H510-Y591 WeakPolarHBondContact O-CD2 3.31Å; L511-Y591 VanDerWaalsContact CA-CD2 3.46Å; L511-Y591 HydrophobicContact CB-CD1 4.47Å; L511-Y591 HydrophobicContact CB-CD2 4.24Å; L511-Y591 HydrophobicContact CB-CE1 4.01Å; L511-Y591 HydrophobicContact CB-CE2 3.82Å; L511-Y591 HydrophobicContact CB-CG 4.47Å; L511-Y591 VanDerWaalsContact CB-CZ 3.49Å; L511-Y591 WeakPolarHBondContact CB-OH 3.29Å; L511-Y591 HydrophobicContact CD1-CD1 3.53Å; L511-Y591 HydrophobicContact CD1-CE1 3.23Å; L511-Y591 HydrophobicContact CD1-CG 4.21Å; L511-Y591 HydrophobicContact CG-CE1 4.14Å; A514-Y591 VanDerWaalsContact CB-C 3.42Å; A514-Y591 HydrophobicContact CB-CG 4.13Å; A514-Y591 WeakPolarHBondContact CB-O 3.37Å; N589-Y591 PolarHBondContact OD1-N 3.36Å; N589-Y591 VanDerWaalsContact OD1-N 3.16Å
592	T	75	Confident	73.6	Confident	10 Å²	10	66.2 Å²	66.2	6%	0.061	33%	0.332	C	S	.	.			trans	-151.4	109.7	-174	-172.7	0	0	0	0	108.1	F513 A514 N589 P590 I594	F513-T592 HydrophobicContact CD1-CG2 3.12Å; F513-T592 HydrophobicContact CE1-CG2 3.43Å; F513-T592 VanDerWaalsContact CE1-CG2 3.43Å; F513-T592 HydrophobicContact CG-CG2 4.11Å; A514-T592 HydrophobicContact CB-CG2 4.2Å; N589-T592 HydrophobicContact CB-CG2 3.71Å; N589-T592 WeakPolarHBondContact ND2-CG2 3.45Å; N589-T592 WeakPolarHBondContact OD1-CG2 3.45Å; P590-T592 VanDerWaalsContact C-N 3.31Å; T592-I594 PolarHBondContact O-N 3.4Å; T592-I594 VanDerWaalsContact O-N 3.14Å; T592-I594 VanDerWaalsContact OG1-CB 3.26Å; T592-I594 WeakPolarHBondContact OG1-CB 3.35Å; T592-I594 WeakPolarHBondContact OG1-CD1 3.36Å; T592-I594 PolarHBondContact OG1-N 3.48Å
593	N	72	Confident	74.8	Confident	150 Å²	150	57.9 Å²	57.9	80%	0.802	30%	0.295	S	S	*	.			trans	-67.9	-7.8	169.9	-63.8	-28.6	0	0	0	111.6	K595	N593-K595 PolarHBondContact O-N 3.48Å; N593-K595 VanDerWaalsContact O-N 3.08Å
594	I	78	Confident	76.1	Confident	15 Å²	15	61.2 Å²	61.2	8%	0.077	31%	0.313	C	S	.	.			trans	-74.5	102.3	-179	-55	155.2	0	0	0	106.9	F513 A517 N521 T592 L599	F513-I594 HydrophobicContact CE1-CB 4.48Å; F513-I594 WeakPolarHBondContact CE1-O 3.49Å; A517-I594 HydrophobicContact CB-CB 4.47Å; A517-I594 HydrophobicContact CB-CD1 3.56Å; A517-I594 VanDerWaalsContact O-CD1 3.23Å; A517-I594 WeakPolarHBondContact O-CD1 3.42Å; N521-I594 HydrophobicContact CB-CD1 3.16Å; N521-I594 HydrophobicContact CB-CG1 3.86Å; N521-I594 VanDerWaalsContact CG-CD1 3.5Å; T592-I594 PolarHBondContact O-N 3.4Å; T592-I594 VanDerWaalsContact O-N 3.14Å; T592-I594 VanDerWaalsContact OG1-CB 3.26Å; T592-I594 WeakPolarHBondContact OG1-CB 3.35Å; T592-I594 WeakPolarHBondContact OG1-CD1 3.36Å; T592-I594 PolarHBondContact OG1-N 3.48Å; I594-L599 HydrophobicContact CG2-CD1 4.15Å; I594-L599 HydrophobicContact CG2-CD2 3.3Å; I594-L599 HydrophobicContact CG2-CG 3.6Å
595	K	80.9	Confident	77.3	Confident	92 Å²	92	59.6 Å²	59.6	40%	0.4	30%	0.299	S	S	.	.			trans	-72.5	135	175.5	-55.6	-170.8	-158.2	128.4	0	108.4	N593 H597 E598	N593-K595 PolarHBondContact O-N 3.48Å; N593-K595 VanDerWaalsContact O-N 3.08Å; K595-H597 VanDerWaalsContact CB-CE1 3.49Å; K595-H597 WeakPolarHBondContact CB-CE1 3.27Å; K595-H597 WeakPolarHBondContact CD-CE1 3.49Å; K595-H597 PolarHBondContact O-N 3.19Å; K595-E598 HydrophobicContact CB-CB 4.4Å; K595-E598 HydrophobicContact CB-CG 3.95Å; K595-E598 WeakPolarHBondContact CD-OE1 3.23Å; K595-E598 WeakPolarHBondContact CE-OE1 3.44Å; K595-E598 IonicContact NZ-OE1 2.65Å; K595-E598 PolarHBondContact NZ-OE1 2.97Å; K595-E598 PolarHBondContact O-N 3.26Å
596	P	77.1	Confident	78.8	Confident	40 Å²	40	57.4 Å²	57.4	26%	0.26	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-28.7	-178.2	-24.5	29.9	0	0	0	114.1	F513 A571	F513-P596 HydrophobicContact CE2-CB 4.25Å; F513-P596 HydrophobicContact CE2-CG 3.78Å; F513-P596 HydrophobicContact CZ-CB 4.31Å; F513-P596 HydrophobicContact CZ-CG 3.82Å; A571-P596 HydrophobicContact CB-CB 4.01Å; A571-P596 HydrophobicContact CB-CG 3.15Å
597	H	81.3	Confident	80	Confident	116 Å²	116	63.2 Å²	63.2	54%	0.537	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-15.7	178.7	68	-95.8	0	0	0	114.6	K595 P600	K595-H597 VanDerWaalsContact CB-CE1 3.49Å; K595-H597 WeakPolarHBondContact CB-CE1 3.27Å; K595-H597 WeakPolarHBondContact CD-CE1 3.49Å; K595-H597 PolarHBondContact O-N 3.19Å; H597-P600 WeakPolarHBondContact O-CD 3.49Å
598	E	81.2	Confident	81.2	Confident	58 Å²	58	64.2 Å²	64.2	27%	0.271	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-26.3	179.5	-69.5	171.8	-177.6	0	0	111.7	K595 Q601 R602	K595-E598 HydrophobicContact CB-CB 4.4Å; K595-E598 HydrophobicContact CB-CG 3.95Å; K595-E598 WeakPolarHBondContact CD-OE1 3.23Å; K595-E598 WeakPolarHBondContact CE-OE1 3.44Å; K595-E598 IonicContact NZ-OE1 2.65Å; K595-E598 PolarHBondContact NZ-OE1 2.97Å; K595-E598 PolarHBondContact O-N 3.26Å; E598-Q601 WeakPolarHBondContact O-CB 3.47Å; E598-Q601 PolarHBondContact O-N 2.64Å; E598-R602 PolarHBondContact O-N 3.39Å
599	L	83.8	Confident	82.5	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-51.6	-46.6	179.8	-73.3	174.4	0	0	0	114.2	F513 F520 M524 L567 I594 Q601 R602 W603	F513-L599 HydrophobicContact CZ-CD1 4.48Å; F520-L599 HydrophobicContact CD1-CD2 4.15Å; F520-L599 HydrophobicContact CE1-CD2 4.18Å; M524-L599 HydrophobicContact CE-CD2 3.58Å; L567-L599 HydrophobicContact CB-CD1 3.62Å; L567-L599 HydrophobicContact CD1-CD1 3.66Å; L567-L599 HydrophobicContact CD1-CD2 4.36Å; L567-L599 HydrophobicContact CG-CD1 4.28Å; I594-L599 HydrophobicContact CG2-CD1 4.15Å; I594-L599 HydrophobicContact CG2-CD2 3.3Å; I594-L599 HydrophobicContact CG2-CG 3.6Å; L599-Q601 VanDerWaalsContact C-N 3.3Å; L599-Q601 PolarHBondContact O-N 3.03Å; L599-R602 PolarHBondContact O-N 3.42Å; L599-W603 WeakPolarHBondContact O-CB 3.46Å; L599-W603 PolarHBondContact O-N 2.59Å
600	P	83.8	Confident	83.4	Confident	49 Å²	49	58.8 Å²	58.8	32%	0.318	28%	0.283	S	S	.	.	H	α-helix	trans	-65.7	-30.6	177.7	-22.5	35.7	0	0	0	113.7	H597 N604	H597-P600 WeakPolarHBondContact O-CD 3.49Å; P600-N604 PolarHBondContact O-N 2.85Å; P600-N604 PolarHBondContact O-ND2 2.78Å
601	Q	86.1	Confident	84.8	Confident	134 Å²	134	63.1 Å²	63.1	63%	0.626	30%	0.3	S	S	*	.	H	α-helix	trans	-72	-45	178.5	-62	-179.9	-5	0	0	110.6	E598 L599 W603 N604 M605	E598-Q601 WeakPolarHBondContact O-CB 3.47Å; E598-Q601 PolarHBondContact O-N 2.64Å; L599-Q601 VanDerWaalsContact C-N 3.3Å; L599-Q601 PolarHBondContact O-N 3.03Å; Q601-W603 VanDerWaalsContact C-N 3.34Å; Q601-W603 PolarHBondContact O-N 3.11Å; Q601-N604 PolarHBondContact O-N 3.34Å; Q601-M605 PolarHBondContact O-N 3.48Å; Q601-M605 VanDerWaalsContact O-N 3.09Å
602	R	87	Confident	85.7	Confident	59 Å²	59	66.6 Å²	66.6	22%	0.223	32%	0.316	C	S	.	.	H	α-helix	trans	-61.4	-41.7	174.4	-68.8	-164.6	72.6	160.1	9.9	112	N521 M524 E525 E528 E598 L599 N604 M605 I606	N521-R602 PolarHBondContact OD1-NH1 3.29Å; M524-R602 HydrophobicContact CE-CB 4.45Å; M524-R602 HydrophobicContact SD-CB 3.98Å; E525-R602 IonicContact OE1-CZ 2.88Å; E525-R602 IonicContact OE1-NH1 2.68Å; E525-R602 PolarHBondContact OE1-NH1 3.2Å; E525-R602 VanDerWaalsContact OE1-NH1 3.09Å; E525-R602 IonicContact OE1-NH2 2.83Å; E528-R602 IonicContact OE2-CZ 3.79Å; E528-R602 IonicContact OE2-NH2 3.43Å; E528-R602 PolarHBondContact OE2-NH2 3.38Å; E598-R602 PolarHBondContact O-N 3.39Å; L599-R602 PolarHBondContact O-N 3.42Å; R602-N604 VanDerWaalsContact C-N 3.31Å; R602-N604 PolarHBondContact O-N 2.73Å; R602-M605 WeakPolarHBondContact O-CB 3.41Å; R602-M605 PolarHBondContact O-N 3.38Å; R602-M605 VanDerWaalsContact O-N 3.08Å; R602-I606 PolarHBondContact O-N 2.9Å
603	W	89.2	Confident	86.6	Confident	19 Å²	19	67.2 Å²	67.2	7%	0.072	32%	0.317	C	S	.	.	H	α-helix	trans	-57.2	-44.5	175.8	-175.4	-116.5	0	0	0	112.3	F520 W523 L557 A560 E561 L599 Q601 M605 I606 R607	F520-W603 HydrophobicContact CZ-CE3 4.41Å; W523-W603 HydrophobicContact CH2-CH2 4.24Å; W523-W603 AromaticContact CH2-CZ3 3.68Å; W523-W603 HydrophobicContact CH2-CZ3 3.68Å; W523-W603 HydrophobicContact CZ3-CE3 4.42Å; W523-W603 AromaticContact CZ3-CZ3 3.66Å; W523-W603 HydrophobicContact CZ3-CZ3 3.66Å; L557-W603 HydrophobicContact CB-CH2 4.33Å; L557-W603 HydrophobicContact CD2-CH2 4.22Å; L557-W603 WeakPolarHBondContact O-CH2 3.46Å; L557-W603 WeakPolarHBondContact O-CZ2 3.24Å; A560-W603 HydrophobicContact CB-CH2 3.64Å; A560-W603 HydrophobicContact CB-CZ3 3.64Å; E561-W603 HydrophobicContact CB-CH2 4.39Å; E561-W603 HydrophobicContact CB-CZ2 3.64Å; E561-W603 HydrophobicContact CG-CZ2 4.24Å; L599-W603 WeakPolarHBondContact O-CB 3.46Å; L599-W603 PolarHBondContact O-N 2.59Å; Q601-W603 VanDerWaalsContact C-N 3.34Å; Q601-W603 PolarHBondContact O-N 3.11Å; W603-M605 VanDerWaalsContact C-N 3.34Å; W603-M605 PolarHBondContact O-N 3.25Å; W603-I606 PolarHBondContact O-N 3.33Å; W603-R607 PolarHBondContact O-N 3.25Å
604	N	89.6	Confident	87.6	Confident	90 Å²	90	61.8 Å²	61.8	48%	0.481	29%	0.291	S	S	.	.	H	α-helix	trans	-64.5	-35.9	175.3	-71.9	-30.9	0	0	0	112.8	P600 Q601 R602 R607 E608	P600-N604 PolarHBondContact O-N 2.85Å; P600-N604 PolarHBondContact O-ND2 2.78Å; Q601-N604 PolarHBondContact O-N 3.34Å; R602-N604 VanDerWaalsContact C-N 3.31Å; R602-N604 PolarHBondContact O-N 2.73Å; N604-R607 PolarHBondContact O-N 3.35Å; N604-E608 PolarHBondContact O-N 3.1Å
605	M	89.8	Confident	88.4	Confident	92 Å²	92	65.4 Å²	65.4	45%	0.453	31%	0.314	S	S	.	.	H	α-helix	trans	-61.8	-45.9	174.7	179.4	65.2	74.2	0	0	111.8	Q601 R602 W603 R607 E608 L609	Q601-M605 PolarHBondContact O-N 3.48Å; Q601-M605 VanDerWaalsContact O-N 3.09Å; R602-M605 WeakPolarHBondContact O-CB 3.41Å; R602-M605 PolarHBondContact O-N 3.38Å; R602-M605 VanDerWaalsContact O-N 3.08Å; W603-M605 VanDerWaalsContact C-N 3.34Å; W603-M605 PolarHBondContact O-N 3.25Å; M605-R607 VanDerWaalsContact C-N 3.34Å; M605-R607 PolarHBondContact O-N 3.36Å; M605-E608 PolarHBondContact O-N 2.89Å; M605-E608 VanDerWaalsContact O-N 3.16Å; M605-L609 HydrophobicContact CG-CD1 4.1Å; M605-L609 HydrophobicContact CG-CG 4.39Å; M605-L609 WeakPolarHBondContact O-CG 3.42Å; M605-L609 PolarHBondContact O-N 3.45Å; M605-L609 HydrophobicContact SD-CG 4.33Å
606	I	91.9	Very high	88.9	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-58.3	-47.5	177.7	-71.3	173.5	0	0	0	110.3	W523 M524 T527 L531 L557 R602 W603 E608 L609 T610	W523-I606 HydrophobicContact CZ3-CD1 4.27Å; M524-I606 HydrophobicContact CB-CD1 3.58Å; M524-I606 HydrophobicContact CG-CD1 3.38Å; M524-I606 HydrophobicContact SD-CD1 4.01Å; T527-I606 HydrophobicContact CG2-CD1 4.25Å; T527-I606 HydrophobicContact CG2-CG1 4.32Å; T527-I606 HydrophobicContact CG2-CG2 3.69Å; L531-I606 HydrophobicContact CD1-CG2 4.31Å; L557-I606 HydrophobicContact CD2-CG2 4.37Å; R602-I606 PolarHBondContact O-N 2.9Å; W603-I606 PolarHBondContact O-N 3.33Å; I606-E608 PolarHBondContact O-N 3.16Å; I606-L609 PolarHBondContact O-N 2.89Å; I606-L609 VanDerWaalsContact O-N 3.09Å; I606-T610 PolarHBondContact O-N 3.08Å; I606-T610 PolarHBondContact O-OG1 3.49Å
607	R	91.1	Very high	89.7	Confident	123 Å²	123	63.7 Å²	63.7	46%	0.464	31%	0.306	S	S	.	.	H	α-helix	trans	-56	-38.6	177.4	-69	-176.7	70.2	-171.6	5.5	112.9	W603 N604 M605 K611	W603-R607 PolarHBondContact O-N 3.25Å; N604-R607 PolarHBondContact O-N 3.35Å; M605-R607 VanDerWaalsContact C-N 3.34Å; M605-R607 PolarHBondContact O-N 3.36Å; R607-K611 WeakPolarHBondContact O-CG 3.45Å; R607-K611 PolarHBondContact O-N 3.03Å
608	E	92.3	Very high	90.3	Very high	89 Å²	89	61.3 Å²	61.3	42%	0.416	30%	0.297	S	S	.	.	H	α-helix	trans	-73.7	-38.9	177	-71.7	-59.5	122.2	0	0	112.6	N604 M605 I606 K611 K612	N604-E608 PolarHBondContact O-N 3.1Å; M605-E608 PolarHBondContact O-N 2.89Å; M605-E608 VanDerWaalsContact O-N 3.16Å; I606-E608 PolarHBondContact O-N 3.16Å; E608-K611 PolarHBondContact O-N 3.39Å; E608-K611 IonicContact OE1-NZ 2.78Å; E608-K611 PolarHBondContact OE1-NZ 2.97Å; E608-K612 WeakPolarHBondContact O-CG 3.47Å; E608-K612 PolarHBondContact O-N 3.28Å; E608-K612 VanDerWaalsContact O-N 3.07Å
609	L	92.4	Very high	90.8	Very high	19 Å²	19	67.6 Å²	67.6	10%	0.099	32%	0.319	C	S	.	.	H	α-helix	trans	-64.3	-40.2	174.1	-72.7	175	0	0	0	112.1	E528 L531 R532 M605 I606 K611 K612 R613	E528-L609 HydrophobicContact CB-CD1 4.45Å; E528-L609 HydrophobicContact CG-CD1 3.96Å; L531-L609 HydrophobicContact CB-CB 4.03Å; L531-L609 HydrophobicContact CD1-CB 3.74Å; R532-L609 HydrophobicContact CG-CD1 4.47Å; R532-L609 HydrophobicContact CG-CD2 4.24Å; M605-L609 HydrophobicContact CG-CD1 4.1Å; M605-L609 HydrophobicContact CG-CG 4.39Å; M605-L609 WeakPolarHBondContact O-CG 3.42Å; M605-L609 PolarHBondContact O-N 3.45Å; M605-L609 HydrophobicContact SD-CG 4.33Å; I606-L609 PolarHBondContact O-N 2.89Å; I606-L609 VanDerWaalsContact O-N 3.09Å; L609-K611 PolarHBondContact O-N 3.17Å; L609-K612 PolarHBondContact O-N 3.39Å; L609-R613 WeakPolarHBondContact O-CB 3.36Å; L609-R613 PolarHBondContact O-N 2.97Å
610	T	92.7	Very high	91.2	Very high	6 Å²	6	68.7 Å²	68.7	4%	0.037	32%	0.324	C	S	.	.	H	α-helix	trans	-59.1	-47.1	177	-54.4	0	0	0	0	111.2	H550 F553 E554 L557 I606 K612 R613 S614	H550-T610 PolarHBondContact NE2-O 2.98Å; F553-T610 HydrophobicContact CE1-CG2 4.21Å; E554-T610 HydrophobicContact CG-CG2 3.6Å; L557-T610 HydrophobicContact CD1-CG2 4.16Å; I606-T610 PolarHBondContact O-N 3.08Å; I606-T610 PolarHBondContact O-OG1 3.49Å; T610-K612 PolarHBondContact O-N 3.42Å; T610-R613 PolarHBondContact O-N 3.44Å; T610-S614 PolarHBondContact O-N 2.88Å; T610-S614 VanDerWaalsContact O-N 3.12Å
611	K	92.6	Very high	91.7	Very high	115 Å²	115	71.5 Å²	71.5	50%	0.5	33%	0.328	S	S	.	.	H	α-helix	trans	-60.3	-46	174.7	-68.5	174.3	-168.9	165	0	111.8	R607 E608 L609 R613 S614 T615	R607-K611 WeakPolarHBondContact O-CG 3.45Å; R607-K611 PolarHBondContact O-N 3.03Å; E608-K611 PolarHBondContact O-N 3.39Å; E608-K611 IonicContact OE1-NZ 2.78Å; E608-K611 PolarHBondContact OE1-NZ 2.97Å; L609-K611 PolarHBondContact O-N 3.17Å; K611-R613 PolarHBondContact O-N 3.14Å; K611-S614 PolarHBondContact O-N 3.41Å; K611-T615 PolarHBondContact O-N 3.48Å; K611-T615 VanDerWaalsContact O-N 3.14Å
612	K	92.8	Very high	92	Very high	120 Å²	120	71.6 Å²	71.6	52%	0.522	33%	0.328	S	S	.	.	H	α-helix	trans	-60.3	-44.2	178.3	-74.6	176.9	-179.4	179.4	0	111.8	E608 L609 T610 S614 T615 L616	E608-K612 WeakPolarHBondContact O-CG 3.47Å; E608-K612 PolarHBondContact O-N 3.28Å; E608-K612 VanDerWaalsContact O-N 3.07Å; L609-K612 PolarHBondContact O-N 3.39Å; T610-K612 PolarHBondContact O-N 3.42Å; K612-S614 PolarHBondContact O-N 3.1Å; K612-T615 PolarHBondContact O-N 3.27Å; K612-T615 VanDerWaalsContact O-N 3.16Å; K612-T615 PolarHBondContact O-OG1 2.77Å; K612-L616 PolarHBondContact O-N 3.2Å
613	R	93.6	Very high	92.2	Very high	24 Å²	24	74.6 Å²	74.6	9%	0.091	34%	0.34	C	S	.	.	H	α-helix	trans	-59	-45.6	177.7	-176	59.7	162.4	-160.6	-3.3	111.9	L531 D533 F535 H550 L609 T610 K611 T615 L616 L617	L531-R613 HydrophobicContact CD2-CB 3.81Å; L531-R613 HydrophobicContact CD2-CG 3.95Å; D533-R613 PolarHBondContact O-NH1 3.36Å; D533-R613 PolarHBondContact O-NH2 3.48Å; F535-R613 VanDerWaalsContact CD1-CZ 3.5Å; H550-R613 WeakPolarHBondContact ND1-CG 3.26Å; L609-R613 WeakPolarHBondContact O-CB 3.36Å; L609-R613 PolarHBondContact O-N 2.97Å; T610-R613 PolarHBondContact O-N 3.44Å; K611-R613 PolarHBondContact O-N 3.14Å; R613-T615 VanDerWaalsContact C-N 3.31Å; R613-T615 PolarHBondContact O-N 3.27Å; R613-L616 PolarHBondContact O-N 3.11Å; R613-L617 HydrophobicContact CG-CD1 4.18Å; R613-L617 WeakPolarHBondContact O-CG 3.43Å; R613-L617 PolarHBondContact O-N 3.31Å
614	S	93	Very high	92.4	Very high	35 Å²	35	73.7 Å²	73.7	25%	0.245	34%	0.336	C	S	.	.	H	α-helix	trans	-58.1	-41.2	175.3	-172.7	0	0	0	0	112.2	T610 K611 K612 N618	T610-S614 PolarHBondContact O-N 2.88Å; T610-S614 VanDerWaalsContact O-N 3.12Å; K611-S614 PolarHBondContact O-N 3.41Å; K612-S614 PolarHBondContact O-N 3.1Å; S614-N618 PolarHBondContact O-N 2.84Å; S614-N618 VanDerWaalsContact O-N 3.13Å; S614-N618 PolarHBondContact O-ND2 3.32Å
615	T	93.6	Very high	92.5	Very high	92 Å²	92	73.4 Å²	73.4	56%	0.564	33%	0.334	S	S	*	.	H	α-helix	trans	-66.5	-38.5	175.7	62.4	0	0	0	0	113.5	K611 K612 R613 N618 R619	K611-T615 PolarHBondContact O-N 3.48Å; K611-T615 VanDerWaalsContact O-N 3.14Å; K612-T615 PolarHBondContact O-N 3.27Å; K612-T615 VanDerWaalsContact O-N 3.16Å; K612-T615 PolarHBondContact O-OG1 2.77Å; R613-T615 VanDerWaalsContact C-N 3.31Å; R613-T615 PolarHBondContact O-N 3.27Å; T615-N618 PolarHBondContact O-N 2.82Å; T615-R619 PolarHBondContact O-N 3.32Å
616	L	92.6	Very high	92.7	Very high	92 Å²	92	71.4 Å²	71.4	48%	0.482	33%	0.333	S	S	.	.	H	α-helix	trans	-66.5	-44.9	178.3	-72.4	171.4	0	0	0	111.9	F535 K612 R613 N618 R619 E620	F535-L616 HydrophobicContact CE1-CB 4.45Å; F535-L616 HydrophobicContact CZ-CB 4.27Å; K612-L616 PolarHBondContact O-N 3.2Å; R613-L616 PolarHBondContact O-N 3.11Å; L616-N618 VanDerWaalsContact C-N 3.33Å; L616-N618 PolarHBondContact O-N 3.01Å; L616-R619 PolarHBondContact O-N 3.45Å; L616-E620 PolarHBondContact O-N 2.77Å
617	L	93.3	Very high	92.7	Very high	3 Å²	3	72 Å²	72	2%	0.016	34%	0.336	C	S	.	.	H	α-helix	trans	-63.3	-39.5	177.7	-71	171.9	0	0	0	112	F535 L546 I547 H550 R613 E620 R621	F535-L617 HydrophobicContact CD1-CD2 4.22Å; F535-L617 HydrophobicContact CE1-CD2 3.81Å; F535-L617 HydrophobicContact CE1-CG 4.39Å; F535-L617 HydrophobicContact CE2-CD2 4.26Å; F535-L617 HydrophobicContact CZ-CD2 3.83Å; F535-L617 HydrophobicContact CZ-CG 4.46Å; L546-L617 HydrophobicContact CB-CD2 3.76Å; L546-L617 HydrophobicContact CD1-CD2 4.24Å; I547-L617 HydrophobicContact CG1-CB 3.83Å; H550-L617 HydrophobicContact CB-CD1 3.63Å; R613-L617 HydrophobicContact CG-CD1 4.18Å; R613-L617 WeakPolarHBondContact O-CG 3.43Å; R613-L617 PolarHBondContact O-N 3.31Å; L617-E620 PolarHBondContact O-N 3.38Å; L617-R621 PolarHBondContact O-N 3.41Å
618	N	92.8	Very high	92.7	Very high	66 Å²	66	67.4 Å²	67.4	35%	0.353	32%	0.32	S	S	.	.	H	α-helix	trans	-66.3	-41	175.4	-78.2	-53.4	0	0	0	112.4	S614 T615 L616 E620 R621 E622	S614-N618 PolarHBondContact O-N 2.84Å; S614-N618 VanDerWaalsContact O-N 3.13Å; S614-N618 PolarHBondContact O-ND2 3.32Å; T615-N618 PolarHBondContact O-N 2.82Å; L616-N618 VanDerWaalsContact C-N 3.33Å; L616-N618 PolarHBondContact O-N 3.01Å; N618-E620 VanDerWaalsContact C-N 3.32Å; N618-E620 PolarHBondContact O-N 3.31Å; N618-R621 WeakPolarHBondContact O-CB 3.42Å; N618-R621 PolarHBondContact O-N 3.5Å; N618-E622 WeakPolarHBondContact O-CG 3.46Å; N618-E622 PolarHBondContact O-N 3.26Å
619	R	92.7	Very high	92.8	Very high	190 Å²	190	70.1 Å²	70.1	72%	0.717	33%	0.33	S	S	*	.	H	α-helix	trans	-62.6	-39.8	174.6	-174.5	178.8	-179.4	136.3	0.8	112	T615 L616 R621 E622 R623	T615-R619 PolarHBondContact O-N 3.32Å; L616-R619 PolarHBondContact O-N 3.45Å; R619-R621 VanDerWaalsContact C-N 3.35Å; R619-E622 PolarHBondContact O-N 3.12Å; R619-R623 PolarHBondContact O-N 3.24Å
620	E	91.8	Very high	92.9	Very high	24 Å²	24	71 Å²	71	11%	0.112	33%	0.334	C	S	.	.	H	α-helix	trans	-65	-40.5	175.2	-178.5	56.5	-147.6	0	0	111.7	F535 V537 V543 L616 L617 N618 E622 R623 Q624	F535-E620 HydrophobicContact CD2-CG 4.47Å; F535-E620 HydrophobicContact CE2-CB 3.8Å; F535-E620 HydrophobicContact CE2-CG 3.78Å; F535-E620 HydrophobicContact CZ-CB 4.33Å; V537-E620 HydrophobicContact CG2-CG 3.37Å; V537-E620 WeakPolarHBondContact CG2-OE1 3.5Å; V543-E620 HydrophobicContact CB-CG 4.43Å; V543-E620 HydrophobicContact CG2-CB 4.1Å; V543-E620 HydrophobicContact CG2-CG 3.87Å; L616-E620 PolarHBondContact O-N 2.77Å; L617-E620 PolarHBondContact O-N 3.38Å; N618-E620 VanDerWaalsContact C-N 3.32Å; N618-E620 PolarHBondContact O-N 3.31Å; E620-E622 VanDerWaalsContact C-N 3.32Å; E620-E622 PolarHBondContact O-N 3.03Å; E620-R623 VanDerWaalsContact CD-NE 3.31Å; E620-R623 WeakPolarHBondContact O-CB 3.34Å; E620-R623 PolarHBondContact O-N 3.35Å; E620-R623 VanDerWaalsContact O-N 3.16Å; E620-R623 IonicContact OE1-CZ 3.31Å; E620-R623 IonicContact OE1-NE 2.74Å; E620-R623 PolarHBondContact OE1-NE 2.93Å; E620-R623 IonicContact OE1-NH2 3.27Å; E620-R623 PolarHBondContact OE1-NH2 3.3Å; E620-R623 IonicContact OE2-CZ 2.7Å; E620-R623 VanDerWaalsContact OE2-CZ 3.31Å; E620-R623 IonicContact OE2-NE 2.8Å; E620-R623 PolarHBondContact OE2-NE 3.22Å; E620-R623 IonicContact OE2-NH2 3.91Å; E620-R623 PolarHBondContact OE2-NH2 3.16Å; E620-Q624 WeakPolarHBondContact O-CG 3.07Å; E620-Q624 PolarHBondContact O-N 2.74Å; E620-Q624 WeakPolarHBondContact OE1-CG 3.4Å; E620-Q624 PolarHBondContact OE1-NE2 2.61Å
621	R	93.9	Very high	93	Very high	108 Å²	108	71.9 Å²	71.9	41%	0.408	34%	0.337	S	S	.	.	H	α-helix	trans	-59.5	-43.1	173.9	179.3	-176.6	172.4	-140.9	-0.9	111.7	M540 V543 I547 L617 N618 R619 R623 Q624 L625	M540-R621 HydrophobicContact CE-CG 4.31Å; V543-R621 HydrophobicContact CG1-CB 4.39Å; V543-R621 HydrophobicContact CG2-CB 4.05Å; I547-R621 HydrophobicContact CD1-CB 3.93Å; I547-R621 HydrophobicContact CD1-CG 4.29Å; L617-R621 PolarHBondContact O-N 3.41Å; N618-R621 WeakPolarHBondContact O-CB 3.42Å; N618-R621 PolarHBondContact O-N 3.5Å; R619-R621 VanDerWaalsContact C-N 3.35Å; R621-R623 VanDerWaalsContact C-N 3.34Å; R621-R623 PolarHBondContact O-N 3.39Å; R621-Q624 PolarHBondContact O-N 3.24Å; R621-L625 HydrophobicContact CG-CD1 4.24Å; R621-L625 WeakPolarHBondContact O-CB 3.39Å; R621-L625 VanDerWaalsContact O-CG 3.29Å; R621-L625 WeakPolarHBondContact O-CG 3.37Å; R621-L625 PolarHBondContact O-N 3.29Å
622	E	93.6	Very high	93.1	Very high	135 Å²	135	72.3 Å²	72.3	63%	0.631	34%	0.335	S	S	*	.	H	α-helix	trans	-61.1	-41.9	174.4	-71.1	176.7	168.8	0	0	112	N618 R619 E620 L625 A626	N618-E622 WeakPolarHBondContact O-CG 3.46Å; N618-E622 PolarHBondContact O-N 3.26Å; R619-E622 PolarHBondContact O-N 3.12Å; E620-E622 VanDerWaalsContact C-N 3.32Å; E620-E622 PolarHBondContact O-N 3.03Å; E622-L625 PolarHBondContact O-N 3.14Å; E622-A626 PolarHBondContact O-N 3.34Å
623	R	91.9	Very high	93.2	Very high	122 Å²	122	69.7 Å²	69.7	46%	0.46	33%	0.325	S	S	.	.	H	α-helix	trans	-59.9	-49.1	174.9	-173.1	-175.9	76.6	146.5	2.3	111.7	V537 R619 E620 R621 L625 A626 N627	V537-R623 PolarHBondContact O-NH2 3.29Å; R619-R623 PolarHBondContact O-N 3.24Å; E620-R623 VanDerWaalsContact CD-NE 3.31Å; E620-R623 WeakPolarHBondContact O-CB 3.34Å; E620-R623 PolarHBondContact O-N 3.35Å; E620-R623 VanDerWaalsContact O-N 3.16Å; E620-R623 IonicContact OE1-CZ 3.31Å; E620-R623 IonicContact OE1-NE 2.74Å; E620-R623 PolarHBondContact OE1-NE 2.93Å; E620-R623 IonicContact OE1-NH2 3.27Å; E620-R623 PolarHBondContact OE1-NH2 3.3Å; E620-R623 IonicContact OE2-CZ 2.7Å; E620-R623 VanDerWaalsContact OE2-CZ 3.31Å; E620-R623 IonicContact OE2-NE 2.8Å; E620-R623 PolarHBondContact OE2-NE 3.22Å; E620-R623 IonicContact OE2-NH2 3.91Å; E620-R623 PolarHBondContact OE2-NH2 3.16Å; R621-R623 VanDerWaalsContact C-N 3.34Å; R621-R623 PolarHBondContact O-N 3.39Å; R623-L625 VanDerWaalsContact C-N 3.33Å; R623-L625 PolarHBondContact O-N 3.28Å; R623-A626 WeakPolarHBondContact O-CB 3.4Å; R623-A626 PolarHBondContact O-N 2.8Å; R623-A626 VanDerWaalsContact O-N 3.16Å; R623-N627 PolarHBondContact O-N 3.36Å; R623-N627 PolarHBondContact O-OD1 2.73Å
624	Q	91.9	Very high	93.3	Very high	1 Å²	1	68.8 Å²	68.8	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-65.4	-35.8	-179.9	-66.4	-61.2	-20.5	0	0	112.2	V537 H538 M540 V543 E620 R621 A626 N627 E628	V537-Q624 HydrophobicContact CG2-CG 4.5Å; V537-Q624 PolarHBondContact O-NE2 3.26Å; H538-Q624 PolarHBondContact O-OE1 3.13Å; M540-Q624 HydrophobicContact CG-CB 4.01Å; M540-Q624 VanDerWaalsContact SD-C 3.56Å; M540-Q624 HydrophobicContact SD-CB 3.3Å; M540-Q624 WeakPolarHBondContact SD-CB 3.43Å; V543-Q624 HydrophobicContact CG1-CB 4.31Å; V543-Q624 HydrophobicContact CG1-CG 4.18Å; E620-Q624 WeakPolarHBondContact O-CG 3.07Å; E620-Q624 PolarHBondContact O-N 2.74Å; E620-Q624 WeakPolarHBondContact OE1-CG 3.4Å; E620-Q624 PolarHBondContact OE1-NE2 2.61Å; R621-Q624 PolarHBondContact O-N 3.24Å; Q624-A626 VanDerWaalsContact C-N 3.35Å; Q624-N627 PolarHBondContact O-N 3.18Å; Q624-E628 VanDerWaalsContact O-CB 3.28Å; Q624-E628 WeakPolarHBondContact O-CB 3.44Å; Q624-E628 PolarHBondContact O-N 3.1Å
625	L	92.3	Very high	93.4	Very high	84 Å²	84	67.6 Å²	67.6	44%	0.44	31%	0.314	S	S	.	.	H	α-helix	trans	-63.5	-39.3	172.4	-74.9	170.7	0	0	0	112.1	M540 R621 E622 R623 E628 K629	M540-L625 HydrophobicContact CE-CD2 3.61Å; M540-L625 HydrophobicContact CE-CG 3.85Å; M540-L625 HydrophobicContact SD-CB 4.47Å; M540-L625 HydrophobicContact SD-CD2 3.86Å; M540-L625 HydrophobicContact SD-CG 3.78Å; M540-L625 PolarHBondContact SD-N 3.49Å; R621-L625 HydrophobicContact CG-CD1 4.24Å; R621-L625 WeakPolarHBondContact O-CB 3.39Å; R621-L625 VanDerWaalsContact O-CG 3.29Å; R621-L625 WeakPolarHBondContact O-CG 3.37Å; R621-L625 PolarHBondContact O-N 3.29Å; E622-L625 PolarHBondContact O-N 3.14Å; R623-L625 VanDerWaalsContact C-N 3.33Å; R623-L625 PolarHBondContact O-N 3.28Å; L625-E628 PolarHBondContact O-N 3.2Å; L625-K629 PolarHBondContact O-N 3.1Å; L625-K629 VanDerWaalsContact O-N 3.08Å
626	A	93.1	Very high	93.5	Very high	50 Å²	50	70 Å²	70	41%	0.413	32%	0.319	S	S	.	.	H	α-helix	trans	-66.1	-45	175.3	0	0	0	0	0	111.7	E622 R623 Q624 E628 K629 L630	E622-A626 PolarHBondContact O-N 3.34Å; R623-A626 WeakPolarHBondContact O-CB 3.4Å; R623-A626 PolarHBondContact O-N 2.8Å; R623-A626 VanDerWaalsContact O-N 3.16Å; Q624-A626 VanDerWaalsContact C-N 3.35Å; A626-E628 VanDerWaalsContact C-N 3.29Å; A626-E628 PolarHBondContact O-N 3.32Å; A626-K629 WeakPolarHBondContact O-CB 3.41Å; A626-K629 PolarHBondContact O-N 3.03Å; A626-L630 PolarHBondContact O-N 2.97Å
627	N	92.8	Very high	93.6	Very high	14 Å²	14	68.3 Å²	68.3	8%	0.075	31%	0.308	C	S	.	.	H	α-helix	trans	-59.1	-42.4	175.7	-70.4	-1.9	0	0	0	111.6	R623 Q624 K629 L630 R631 V699	R623-N627 PolarHBondContact O-N 3.36Å; R623-N627 PolarHBondContact O-OD1 2.73Å; Q624-N627 PolarHBondContact O-N 3.18Å; N627-K629 VanDerWaalsContact C-N 3.33Å; N627-K629 PolarHBondContact O-N 3.49Å; N627-L630 PolarHBondContact O-N 3.23Å; N627-R631 WeakPolarHBondContact O-CG 3.28Å; N627-R631 PolarHBondContact O-N 3.41Å; N627-V699 HydrophobicContact CB-CG2 3.92Å
628	E	91.9	Very high	93.6	Very high	27 Å²	27	68.2 Å²	68.2	13%	0.126	31%	0.307	C	S	.	.	H	α-helix	trans	-64	-37.5	177.5	-172.6	60.6	-167.6	0	0	112.8	Q624 L625 A626 R631 R632 Y704	Q624-E628 VanDerWaalsContact O-CB 3.28Å; Q624-E628 WeakPolarHBondContact O-CB 3.44Å; Q624-E628 PolarHBondContact O-N 3.1Å; L625-E628 PolarHBondContact O-N 3.2Å; A626-E628 VanDerWaalsContact C-N 3.29Å; A626-E628 PolarHBondContact O-N 3.32Å; E628-R631 IonicContact OE2-NH1 2.65Å; E628-R631 PolarHBondContact OE2-NH1 3.42Å; E628-R632 WeakPolarHBondContact O-CG 3.43Å; E628-R632 PolarHBondContact O-N 2.66Å; E628-R632 IonicContact OE1-CZ 2.69Å; E628-R632 IonicContact OE1-NE 3Å; E628-R632 PolarHBondContact OE1-NE 3.44Å; E628-R632 IonicContact OE1-NH2 3.09Å; E628-R632 PolarHBondContact OE1-NH2 3.23Å; E628-R632 VanDerWaalsContact OE1-NH2 3.08Å; E628-Y704 WeakPolarHBondContact OE1-CE2 3.47Å; E628-Y704 PolarHBondContact OE1-OH 3.06Å
629	K	93.9	Very high	93.7	Very high	146 Å²	146	69.9 Å²	69.9	64%	0.635	31%	0.313	S	S	*	.	H	α-helix	trans	-62.4	-45.4	172.7	-173.7	-173.8	174.7	-169.3	0	111.2	L625 A626 N627 R632 E633	L625-K629 PolarHBondContact O-N 3.1Å; L625-K629 VanDerWaalsContact O-N 3.08Å; A626-K629 WeakPolarHBondContact O-CB 3.41Å; A626-K629 PolarHBondContact O-N 3.03Å; N627-K629 VanDerWaalsContact C-N 3.33Å; N627-K629 PolarHBondContact O-N 3.49Å; K629-R632 PolarHBondContact O-N 3.25Å; K629-E633 WeakPolarHBondContact O-CB 3.47Å; K629-E633 PolarHBondContact O-N 2.93Å
630	L	94.1	Very high	93.7	Very high	36 Å²	36	64 Å²	64	19%	0.188	31%	0.305	C	S	.	.	H	α-helix	trans	-62	-43.8	178	-70.2	172.5	0	0	0	112.1	A626 N627 R632 E633 F634 A693 L694 A697	A626-L630 PolarHBondContact O-N 2.97Å; N627-L630 PolarHBondContact O-N 3.23Å; L630-R632 VanDerWaalsContact C-N 3.33Å; L630-R632 PolarHBondContact O-N 3.07Å; L630-E633 PolarHBondContact O-N 2.92Å; L630-F634 WeakPolarHBondContact O-CB 3.43Å; L630-F634 PolarHBondContact O-N 2.87Å; L630-A693 HydrophobicContact CD1-CB 4.29Å; L630-A693 HydrophobicContact CD2-CB 3.94Å; L630-L694 HydrophobicContact CB-CD2 3.6Å; L630-L694 HydrophobicContact CB-CG 4.17Å; L630-A697 HydrophobicContact CD1-CB 4.33Å
631	R	94.1	Very high	93.8	Very high	26 Å²	26	63 Å²	63	10%	0.098	30%	0.3	C	S	.	.	H	α-helix	trans	-57	-46.7	176.6	-71.9	-176.9	-175.7	109.4	1	111.7	N627 E628 A635 L694 V699 E701 N702 Y704	N627-R631 WeakPolarHBondContact O-CG 3.28Å; N627-R631 PolarHBondContact O-N 3.41Å; E628-R631 IonicContact OE2-NH1 2.65Å; E628-R631 PolarHBondContact OE2-NH1 3.42Å; R631-A635 WeakPolarHBondContact O-CB 3.48Å; R631-A635 PolarHBondContact O-N 3.06Å; R631-L694 HydrophobicContact CG-CD2 4.16Å; R631-V699 HydrophobicContact CG-CG1 3.84Å; R631-V699 VanDerWaalsContact NE-CG1 3.29Å; R631-E701 PolarHBondContact NE-O 3.42Å; R631-N702 PolarHBondContact O-ND2 3.34Å; R631-N702 PolarHBondContact O-OD1 2.96Å; R631-Y704 HydrophobicContact CB-CD2 4.03Å; R631-Y704 HydrophobicContact CB-CE2 4.31Å
632	R	94.8	Very high	93.7	Very high	123 Å²	123	58.8 Å²	58.8	46%	0.464	29%	0.286	S	S	.	.	H	α-helix	trans	-68.3	-40.7	178.8	-69.8	-178.2	-174.3	151.8	6.1	112.6	E628 K629 L630 A635 Q636 Y704	E628-R632 WeakPolarHBondContact O-CG 3.43Å; E628-R632 PolarHBondContact O-N 2.66Å; E628-R632 IonicContact OE1-CZ 2.69Å; E628-R632 IonicContact OE1-NE 3Å; E628-R632 PolarHBondContact OE1-NE 3.44Å; E628-R632 IonicContact OE1-NH2 3.09Å; E628-R632 PolarHBondContact OE1-NH2 3.23Å; E628-R632 VanDerWaalsContact OE1-NH2 3.08Å; K629-R632 PolarHBondContact O-N 3.25Å; L630-R632 VanDerWaalsContact C-N 3.33Å; L630-R632 PolarHBondContact O-N 3.07Å; R632-A635 PolarHBondContact O-N 2.93Å; R632-Q636 WeakPolarHBondContact O-CG 3.47Å; R632-Q636 PolarHBondContact O-N 3.1Å; R632-Y704 HydrophobicContact CG-CD2 3.9Å; R632-Y704 HydrophobicContact CG-CE2 3.74Å; R632-Y704 HydrophobicContact CG-CG 4.36Å; R632-Y704 PolarHBondContact NE-OH 3.47Å; R632-Y704 PolarHBondContact NH2-OH 2.94Å; R632-Y704 VanDerWaalsContact NH2-OH 3.16Å
633	E	95.1	Very high	93.6	Very high	65 Å²	65	55.5 Å²	55.5	30%	0.304	28%	0.278	S	S	.	.	H	α-helix	trans	-61.1	-47.6	176.9	-176.1	175.2	172.8	0	0	111.1	K629 L630 A635 Q636 K637 V690	K629-E633 WeakPolarHBondContact O-CB 3.47Å; K629-E633 PolarHBondContact O-N 2.93Å; L630-E633 PolarHBondContact O-N 2.92Å; E633-A635 PolarHBondContact O-N 3.14Å; E633-Q636 PolarHBondContact O-N 3.27Å; E633-K637 WeakPolarHBondContact O-CG 3.36Å; E633-K637 PolarHBondContact O-N 2.87Å; E633-K637 IonicContact OE1-NZ 3.82Å; E633-V690 HydrophobicContact CB-CG1 4.38Å; E633-V690 HydrophobicContact CG-CG1 4.26Å; E633-V690 HydrophobicContact CG-CG2 4.15Å
634	F	96	Very high	93.6	Very high	6 Å²	6	50.6 Å²	50.6	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-59	-48.4	175.8	-177.7	-92.6	0	0	0	111.3	L630 Q636 K637 A638 L687 V690 N691 L694 N702 T705 Y707 M709	L630-F634 WeakPolarHBondContact O-CB 3.43Å; L630-F634 PolarHBondContact O-N 2.87Å; F634-Q636 PolarHBondContact O-N 3.42Å; F634-K637 PolarHBondContact O-N 3.39Å; F634-A638 HydrophobicContact CD1-CB 4.41Å; F634-A638 HydrophobicContact CE1-CB 4.16Å; F634-A638 WeakPolarHBondContact O-CB 3.29Å; F634-A638 PolarHBondContact O-N 2.88Å; F634-L687 HydrophobicContact CD2-CD2 4.12Å; F634-L687 HydrophobicContact CE2-CD2 4.02Å; F634-V690 HydrophobicContact CB-CG1 3.75Å; F634-V690 HydrophobicContact CD2-CB 4.48Å; F634-V690 HydrophobicContact CD2-CG1 4.29Å; F634-N691 HydrophobicContact CD2-CB 4.25Å; F634-N691 HydrophobicContact CE2-CB 3.87Å; F634-L694 HydrophobicContact CB-CD1 3.68Å; F634-L694 HydrophobicContact CD1-CD1 4.47Å; F634-L694 HydrophobicContact CD2-CD1 4.08Å; F634-L694 HydrophobicContact CG-CD1 3.81Å; F634-N702 WeakPolarHBondContact CD1-ND2 3.02Å; F634-T705 HydrophobicContact CD1-CG2 3.93Å; F634-T705 HydrophobicContact CE1-CG2 4.02Å; F634-Y707 WeakPolarHBondContact CE1-O 3.42Å; F634-M709 HydrophobicContact CE2-SD 4.46Å; F634-M709 HydrophobicContact CZ-CB 4.42Å
635	A	95.3	Very high	93.6	Very high	10 Å²	10	50.7 Å²	50.7	8%	0.083	26%	0.263	C	S	.	.	H	α-helix	trans	-60.5	-43.7	-178.9	0	0	0	0	0	112.7	R631 R632 E633 A638 E639 Y704 T705	R631-A635 WeakPolarHBondContact O-CB 3.48Å; R631-A635 PolarHBondContact O-N 3.06Å; R632-A635 PolarHBondContact O-N 2.93Å; E633-A635 PolarHBondContact O-N 3.14Å; A635-A638 PolarHBondContact O-N 3.31Å; A635-E639 WeakPolarHBondContact O-CB 3.36Å; A635-E639 PolarHBondContact O-N 2.83Å; A635-Y704 VanDerWaalsContact CB-CB 3.47Å; A635-T705 HydrophobicContact CB-CG2 3.89Å
636	Q	95.1	Very high	93.6	Very high	143 Å²	143	50.9 Å²	50.9	67%	0.668	26%	0.261	S	S	*	.	H	α-helix	trans	-63	-45.8	177	-74	176.6	7.2	0	0	112.3	R632 E633 F634 A640	R632-Q636 WeakPolarHBondContact O-CG 3.47Å; R632-Q636 PolarHBondContact O-N 3.1Å; E633-Q636 PolarHBondContact O-N 3.27Å; F634-Q636 PolarHBondContact O-N 3.42Å; Q636-A640 WeakPolarHBondContact O-CB 3.38Å; Q636-A640 PolarHBondContact O-N 3.11Å
637	K	94.5	Very high	93.6	Very high	56 Å²	56	52.3 Å²	52.3	24%	0.243	27%	0.265	C	S	.	.	H	α-helix	trans	-67.5	-38.4	178.3	-68.7	-166.7	-175	-162.6	0	111.7	E633 F634 A640 F641 E686 L687 V690	E633-K637 WeakPolarHBondContact O-CG 3.36Å; E633-K637 PolarHBondContact O-N 2.87Å; E633-K637 IonicContact OE1-NZ 3.82Å; F634-K637 PolarHBondContact O-N 3.39Å; K637-A640 PolarHBondContact O-N 3.09Å; K637-F641 VanDerWaalsContact O-CB 3.27Å; K637-F641 WeakPolarHBondContact O-CB 3.42Å; K637-F641 PolarHBondContact O-N 2.7Å; K637-E686 IonicContact NZ-OE2 3.24Å; K637-E686 PolarHBondContact NZ-OE2 2.7Å; K637-L687 HydrophobicContact CB-CD2 3.51Å; K637-L687 HydrophobicContact CB-CG 3.92Å; K637-V690 HydrophobicContact CD-CG2 4.2Å
638	A	95	Very high	93.6	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.4	-45.5	-179.7	0	0	0	0	0	111.1	F634 A635 F641 N642 L687 L712	F634-A638 HydrophobicContact CD1-CB 4.41Å; F634-A638 HydrophobicContact CE1-CB 4.16Å; F634-A638 WeakPolarHBondContact O-CB 3.29Å; F634-A638 PolarHBondContact O-N 2.88Å; A635-A638 PolarHBondContact O-N 3.31Å; A638-F641 PolarHBondContact O-N 3.03Å; A638-N642 WeakPolarHBondContact O-CB 3.17Å; A638-N642 PolarHBondContact O-N 2.89Å; A638-L687 HydrophobicContact CB-CD2 4.24Å; A638-L712 HydrophobicContact CB-CD1 3.79Å
639	E	93.4	Very high	93.6	Very high	102 Å²	102	57 Å²	57	48%	0.477	28%	0.281	S	S	.	.	H	α-helix	trans	-62.3	-46.7	177.1	-167.2	64.3	-144.8	0	0	111.6	A635 F641 N642 S643 Y707	A635-E639 WeakPolarHBondContact O-CB 3.36Å; A635-E639 PolarHBondContact O-N 2.83Å; E639-F641 VanDerWaalsContact C-N 3.33Å; E639-F641 PolarHBondContact O-N 3.28Å; E639-N642 PolarHBondContact O-N 2.85Å; E639-S643 WeakPolarHBondContact O-CB 3.45Å; E639-S643 PolarHBondContact O-N 3.27Å; E639-Y707 WeakPolarHBondContact OE2-CE2 3.5Å
640	A	92.6	Very high	93.4	Very high	66 Å²	66	53.1 Å²	53.1	55%	0.545	28%	0.276	S	S	.	.	H	α-helix	trans	-62.9	-39.9	178.1	0	0	0	0	0	112.2	Q636 K637 S644	Q636-A640 WeakPolarHBondContact O-CB 3.38Å; Q636-A640 PolarHBondContact O-N 3.11Å; K637-A640 PolarHBondContact O-N 3.09Å; A640-S644 PolarHBondContact O-N 3.35Å; A640-S644 VanDerWaalsContact O-N 3.11Å
641	F	93.9	Very high	93.3	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.018	28%	0.281	C	S	.	.	H	α-helix	trans	-69.4	-45.2	178	-172.9	-110.6	0	0	0	111.9	K637 A638 E639 S643 S644 I645 K683 L684 L687 L712 W716	K637-F641 VanDerWaalsContact O-CB 3.27Å; K637-F641 WeakPolarHBondContact O-CB 3.42Å; K637-F641 PolarHBondContact O-N 2.7Å; A638-F641 PolarHBondContact O-N 3.03Å; E639-F641 VanDerWaalsContact C-N 3.33Å; E639-F641 PolarHBondContact O-N 3.28Å; F641-S643 PolarHBondContact O-N 3.07Å; F641-S644 VanDerWaalsContact O-CB 3.3Å; F641-S644 WeakPolarHBondContact O-CB 3.45Å; F641-S644 PolarHBondContact O-N 3.41Å; F641-S644 VanDerWaalsContact O-N 3.14Å; F641-I645 HydrophobicContact CD1-CD1 3.83Å; F641-I645 HydrophobicContact CE1-CD1 3.51Å; F641-I645 HydrophobicContact CE1-CG1 4.31Å; F641-I645 HydrophobicContact CZ-CD1 4.12Å; F641-I645 PolarHBondContact O-N 2.97Å; F641-K683 HydrophobicContact CD2-CB 3.98Å; F641-K683 HydrophobicContact CE2-CB 4.27Å; F641-L684 HydrophobicContact CE1-CD1 3.74Å; F641-L684 HydrophobicContact CE2-CB 4.15Å; F641-L684 HydrophobicContact CZ-CB 3.91Å; F641-L684 HydrophobicContact CZ-CD1 3.75Å; F641-L684 HydrophobicContact CZ-CG 4.35Å; F641-L687 HydrophobicContact CB-CD1 3.46Å; F641-L687 VanDerWaalsContact CB-CD1 3.46Å; F641-L687 HydrophobicContact CD1-CD1 3.72Å; F641-L687 HydrophobicContact CD2-CD1 4.28Å; F641-L687 HydrophobicContact CG-CD1 3.57Å; F641-L712 HydrophobicContact CD1-CB 4.36Å; F641-L712 HydrophobicContact CD1-CD2 4.35Å; F641-L712 HydrophobicContact CE1-CB 4.44Å; F641-W716 HydrophobicContact CE1-CB 4.38Å; F641-W716 HydrophobicContact CE1-CE3 4.28Å; F641-W716 AromaticContact CE2-CE3 4Å; F641-W716 HydrophobicContact CE2-CE3 4Å; F641-W716 HydrophobicContact CE2-CZ3 4.11Å; F641-W716 HydrophobicContact CZ-CB 4.35Å; F641-W716 AromaticContact CZ-CD2 3.74Å; F641-W716 HydrophobicContact CZ-CD2 3.74Å; F641-W716 AromaticContact CZ-CE3 3.44Å; F641-W716 HydrophobicContact CZ-CE3 3.44Å; F641-W716 VanDerWaalsContact CZ-CE3 3.44Å; F641-W716 HydrophobicContact CZ-CG 4.16Å; F641-W716 HydrophobicContact CZ-CZ3 4.03Å
642	N	92.7	Very high	93.1	Very high	18 Å²	18	53.1 Å²	53.1	10%	0.096	28%	0.276	C	S	.	.	H	α-helix	trans	-63.5	-41.1	177	-170	73.9	0	0	0	112.1	A638 E639 S644 I645 E646 Y707 L712	A638-N642 WeakPolarHBondContact O-CB 3.17Å; A638-N642 PolarHBondContact O-N 2.89Å; E639-N642 PolarHBondContact O-N 2.85Å; N642-S644 VanDerWaalsContact C-N 3.27Å; N642-S644 PolarHBondContact O-N 2.95Å; N642-I645 WeakPolarHBondContact O-CB 3.43Å; N642-I645 PolarHBondContact O-N 3.09Å; N642-I645 VanDerWaalsContact O-N 3.12Å; N642-E646 PolarHBondContact O-N 2.94Å; N642-Y707 HydrophobicContact CB-CD2 4.41Å; N642-Y707 HydrophobicContact CB-CE1 4.27Å; N642-Y707 HydrophobicContact CB-CE2 4.11Å; N642-Y707 VanDerWaalsContact ND2-CZ 3.3Å; N642-Y707 PolarHBondContact ND2-OH 2.89Å; N642-L712 HydrophobicContact CB-CD2 3.98Å
643	S	92.4	Very high	92.7	Very high	67 Å²	67	50.4 Å²	50.4	47%	0.469	27%	0.273	S	S	.	.	H	α-helix	trans	-59.3	-38.9	173.3	-179.6	0	0	0	0	112	E639 F641 T647	E639-S643 WeakPolarHBondContact O-CB 3.45Å; E639-S643 PolarHBondContact O-N 3.27Å; F641-S643 PolarHBondContact O-N 3.07Å; S643-T647 WeakPolarHBondContact O-CB 3.44Å; S643-T647 PolarHBondContact O-N 2.76Å; S643-T647 PolarHBondContact O-OG1 3.08Å
644	S	91.4	Very high	92.3	Very high	18 Å²	18	53.5 Å²	53.5	13%	0.126	29%	0.286	C	S	.	.	H	α-helix	trans	-62.9	-45.4	172.7	-169.9	0	0	0	0	111.7	A640 F641 N642 T647 H648 H680	A640-S644 PolarHBondContact O-N 3.35Å; A640-S644 VanDerWaalsContact O-N 3.11Å; F641-S644 VanDerWaalsContact O-CB 3.3Å; F641-S644 WeakPolarHBondContact O-CB 3.45Å; F641-S644 PolarHBondContact O-N 3.41Å; F641-S644 VanDerWaalsContact O-N 3.14Å; N642-S644 VanDerWaalsContact C-N 3.27Å; N642-S644 PolarHBondContact O-N 2.95Å; S644-T647 PolarHBondContact O-N 3.42Å; S644-H648 PolarHBondContact O-N 3.05Å; S644-H648 PolarHBondContact O-ND1 3.48Å; S644-H648 PolarHBondContact OG-CE1 3.07Å; S644-H680 PolarHBondContact OG-CE1 3.27Å; S644-H680 PolarHBondContact OG-ND1 3Å
645	I	91.8	Very high	91.8	Very high	4 Å²	4	53.4 Å²	53.4	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-57.5	-51.1	177.6	-72	172.9	0	0	0	111	F641 N642 T647 H648 R649 A715 W716 L719	F641-I645 HydrophobicContact CD1-CD1 3.83Å; F641-I645 HydrophobicContact CE1-CD1 3.51Å; F641-I645 HydrophobicContact CE1-CG1 4.31Å; F641-I645 HydrophobicContact CZ-CD1 4.12Å; F641-I645 PolarHBondContact O-N 2.97Å; N642-I645 WeakPolarHBondContact O-CB 3.43Å; N642-I645 PolarHBondContact O-N 3.09Å; N642-I645 VanDerWaalsContact O-N 3.12Å; I645-T647 VanDerWaalsContact C-N 3.31Å; I645-T647 PolarHBondContact O-N 3.36Å; I645-H648 PolarHBondContact O-N 3.5Å; I645-R649 VanDerWaalsContact O-CB 3.31Å; I645-R649 WeakPolarHBondContact O-CB 3.08Å; I645-R649 PolarHBondContact O-N 2.86Å; I645-A715 HydrophobicContact CD1-CB 4.07Å; I645-A715 HydrophobicContact CG2-CB 4.32Å; I645-W716 HydrophobicContact CD1-CB 4.21Å; I645-W716 HydrophobicContact CD1-CE3 4.19Å; I645-W716 HydrophobicContact CG1-CE3 3.94Å; I645-W716 HydrophobicContact CG1-CZ3 4.48Å; I645-L719 HydrophobicContact CG1-CD2 4.4Å; I645-L719 HydrophobicContact CG2-CD2 4.31Å
646	E	92.1	Very high	90.9	Very high	88 Å²	88	54.6 Å²	54.6	41%	0.411	29%	0.293	S	S	.	.	H	α-helix	trans	-64.3	-36.1	-178.5	-71	-59.9	150.3	0	0	112.3	N642 R649 A650	N642-E646 PolarHBondContact O-N 2.94Å; E646-R649 PolarHBondContact O-N 3.12Å; E646-R649 IonicContact OE1-NH1 3.19Å; E646-R649 IonicContact OE2-NH1 3.97Å; E646-A650 WeakPolarHBondContact O-CB 3.33Å; E646-A650 PolarHBondContact O-N 2.9Å
647	T	92.6	Very high	89.9	Confident	80 Å²	80	54.7 Å²	54.7	49%	0.491	30%	0.295	S	S	.	.	H	α-helix	trans	-63.2	-49	175.3	-56	0	0	0	0	111.4	S643 S644 I645 R649 A650 E651	S643-T647 WeakPolarHBondContact O-CB 3.44Å; S643-T647 PolarHBondContact O-N 2.76Å; S643-T647 PolarHBondContact O-OG1 3.08Å; S644-T647 PolarHBondContact O-N 3.42Å; I645-T647 VanDerWaalsContact C-N 3.31Å; I645-T647 PolarHBondContact O-N 3.36Å; T647-R649 VanDerWaalsContact C-N 3.34Å; T647-R649 PolarHBondContact O-N 2.77Å; T647-A650 PolarHBondContact O-N 3.41Å; T647-E651 PolarHBondContact O-N 3.16Å
648	H	92.5	Very high	88.9	Confident	15 Å²	15	55.6 Å²	55.6	7%	0.069	30%	0.301	C	S	.	.	H	α-helix	trans	-67.9	-36.2	179.5	-69.7	67.7	0	0	0	111.3	S644 I645 E651 I652 L677 H680 L719	S644-H648 PolarHBondContact O-N 3.05Å; S644-H648 PolarHBondContact O-ND1 3.48Å; S644-H648 PolarHBondContact OG-CE1 3.07Å; I645-H648 PolarHBondContact O-N 3.5Å; H648-E651 PolarHBondContact O-N 2.73Å; H648-I652 VanDerWaalsContact O-CG1 3.26Å; H648-I652 WeakPolarHBondContact O-CG1 3.11Å; H648-I652 PolarHBondContact O-N 3.46Å; H648-L677 HydrophobicContact CB-CD2 4.03Å; H648-L677 VanDerWaalsContact CD2-CD2 3.41Å; H648-L677 WeakPolarHBondContact CD2-CD2 3.35Å; H648-H680 AromaticContact CE1-CE1 3.47Å; H648-H680 PolarHBondContact CE1-CE1 3.47Å; H648-H680 VanDerWaalsContact CE1-CE1 3.47Å; H648-H680 AromaticContact CE1-ND1 3.75Å; H648-H680 AromaticContact NE2-CE1 3.6Å; H648-H680 AromaticContact NE2-ND1 3.76Å; H648-L719 HydrophobicContact CB-CD1 4.28Å; H648-L719 HydrophobicContact CB-CD2 4.06Å
649	R	92.2	Very high	87.4	Confident	124 Å²	124	58 Å²	58	47%	0.468	32%	0.317	S	S	.	.	H	α-helix	trans	-59	-48.1	174.3	-174	-176.9	-177.6	-176.9	3.2	111.3	I645 E646 T647 E651 I652 V653 L719 L722	I645-R649 VanDerWaalsContact O-CB 3.31Å; I645-R649 WeakPolarHBondContact O-CB 3.08Å; I645-R649 PolarHBondContact O-N 2.86Å; E646-R649 PolarHBondContact O-N 3.12Å; E646-R649 IonicContact OE1-NH1 3.19Å; E646-R649 IonicContact OE2-NH1 3.97Å; T647-R649 VanDerWaalsContact C-N 3.34Å; T647-R649 PolarHBondContact O-N 2.77Å; R649-E651 VanDerWaalsContact C-N 3.3Å; R649-E651 PolarHBondContact O-N 2.98Å; R649-I652 PolarHBondContact O-N 3.41Å; R649-V653 WeakPolarHBondContact O-CG2 3.13Å; R649-V653 PolarHBondContact O-N 3.21Å; R649-V653 VanDerWaalsContact O-N 3.13Å; R649-L719 HydrophobicContact CB-CD1 3.83Å; R649-L722 HydrophobicContact CG-CD2 3.9Å
650	A	90.8	Very high	86.1	Confident	64 Å²	64	61.7 Å²	61.7	53%	0.529	33%	0.334	S	S	.	.	H	α-helix	trans	-63.1	-38.1	176.9	0	0	0	0	0	111.8	E646 T647 K654	E646-A650 WeakPolarHBondContact O-CB 3.33Å; E646-A650 PolarHBondContact O-N 2.9Å; T647-A650 PolarHBondContact O-N 3.41Å; A650-K654 VanDerWaalsContact O-CB 3.3Å; A650-K654 WeakPolarHBondContact O-CB 3.38Å; A650-K654 PolarHBondContact O-N 3.09Å
651	E	90.9	Very high	85.2	Confident	63 Å²	63	60.3 Å²	60.3	29%	0.294	32%	0.321	S	S	.	.	H	α-helix	trans	-67.6	-44	177.6	-166.3	171.1	172.1	0	0	112.8	T647 H648 R649 V653 K654 V655 H669 L673	T647-E651 PolarHBondContact O-N 3.16Å; H648-E651 PolarHBondContact O-N 2.73Å; R649-E651 VanDerWaalsContact C-N 3.3Å; R649-E651 PolarHBondContact O-N 2.98Å; E651-V653 VanDerWaalsContact C-N 3.34Å; E651-V653 PolarHBondContact O-N 2.98Å; E651-K654 WeakPolarHBondContact O-CB 3.25Å; E651-K654 PolarHBondContact O-N 2.66Å; E651-V655 HydrophobicContact CG-CG2 4.32Å; E651-V655 WeakPolarHBondContact O-CG2 3.38Å; E651-V655 PolarHBondContact O-N 3.38Å; E651-H669 IonicContact OE1-CE1 3.31Å; E651-H669 PolarHBondContact OE1-CE1 3.42Å; E651-H669 IonicContact OE1-NE2 3.22Å; E651-H669 PolarHBondContact OE1-NE2 3.09Å; E651-L673 HydrophobicContact CB-CD1 4.49Å; E651-L673 HydrophobicContact CG-CD1 4.04Å; E651-L673 HydrophobicContact CG-CD2 4.35Å
652	I	89.7	Confident	84.7	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-57.6	-49.4	174.9	-68.3	163.4	0	0	0	110.1	H648 R649 K654 V655 S656 L670 L673 L719 L722 L723 S726	H648-I652 VanDerWaalsContact O-CG1 3.26Å; H648-I652 WeakPolarHBondContact O-CG1 3.11Å; H648-I652 PolarHBondContact O-N 3.46Å; R649-I652 PolarHBondContact O-N 3.41Å; I652-K654 VanDerWaalsContact C-N 3.31Å; I652-K654 PolarHBondContact O-N 3.03Å; I652-V655 PolarHBondContact O-N 3.13Å; I652-S656 PolarHBondContact O-N 2.88Å; I652-S656 PolarHBondContact O-OG 3.48Å; I652-L670 HydrophobicContact CG1-CD2 4.49Å; I652-L670 HydrophobicContact CG2-CD2 4.28Å; I652-L673 HydrophobicContact CG1-CD1 4.05Å; I652-L719 HydrophobicContact CD1-CD1 3.65Å; I652-L719 HydrophobicContact CD1-CG 4.33Å; I652-L722 HydrophobicContact CG2-CD2 4.25Å; I652-L722 HydrophobicContact CG2-CG 3.99Å; I652-L723 HydrophobicContact CD1-CB 3.93Å; I652-L723 HydrophobicContact CD1-CD1 3.94Å; I652-L723 HydrophobicContact CD1-CG 4.49Å; I652-L723 HydrophobicContact CG1-CD1 3.89Å; I652-S726 WeakPolarHBondContact CG2-OG 3.45Å
653	V	86.4	Confident	84.2	Confident	66 Å²	66	62.1 Å²	62.1	40%	0.4	33%	0.333	S	S	.	.	H	α-helix	trans	-61.1	-41.8	178.5	173	0	0	0	0	111.1	R649 E651 M657 L722	R649-V653 WeakPolarHBondContact O-CG2 3.13Å; R649-V653 PolarHBondContact O-N 3.21Å; R649-V653 VanDerWaalsContact O-N 3.13Å; E651-V653 VanDerWaalsContact C-N 3.34Å; E651-V653 PolarHBondContact O-N 2.98Å; V653-M657 HydrophobicContact CG1-SD 4.1Å; V653-M657 VanDerWaalsContact O-CG 3.31Å; V653-M657 WeakPolarHBondContact O-CG 3.49Å; V653-M657 PolarHBondContact O-N 3Å; V653-L722 HydrophobicContact CG2-CD2 4.31Å
654	K	86.5	Confident	84	Confident	130 Å²	130	62.2 Å²	62.2	57%	0.565	33%	0.326	S	S	*	.	H	α-helix	trans	-61	-50.4	178.4	-177	-170.6	173.3	-143.3	0	111.2	A650 E651 I652 S656 M657 E658	A650-K654 VanDerWaalsContact O-CB 3.3Å; A650-K654 WeakPolarHBondContact O-CB 3.38Å; A650-K654 PolarHBondContact O-N 3.09Å; E651-K654 WeakPolarHBondContact O-CB 3.25Å; E651-K654 PolarHBondContact O-N 2.66Å; I652-K654 VanDerWaalsContact C-N 3.31Å; I652-K654 PolarHBondContact O-N 3.03Å; K654-S656 VanDerWaalsContact C-N 3.32Å; K654-S656 PolarHBondContact O-N 3.18Å; K654-M657 CarbonylContact O-C 3.51Å; K654-M657 PolarHBondContact O-N 2.87Å; K654-E658 WeakPolarHBondContact CE-OE1 3.23Å; K654-E658 HydrophobicContact CG-CG 4.48Å; K654-E658 IonicContact NZ-OE1 3.37Å; K654-E658 PolarHBondContact NZ-OE1 2.97Å; K654-E658 WeakPolarHBondContact O-CG 3.36Å; K654-E658 PolarHBondContact O-N 3.46Å
655	V	86	Confident	83.8	Confident	4 Å²	4	65.6 Å²	65.6	2%	0.024	34%	0.343	C	S	.	.	H	α-helix	trans	-62	-41.2	-177.4	173.8	0	0	0	0	110.9	E651 I652 M657 E658 Q666 H669 L670	E651-V655 HydrophobicContact CG-CG2 4.32Å; E651-V655 WeakPolarHBondContact O-CG2 3.38Å; E651-V655 PolarHBondContact O-N 3.38Å; I652-V655 PolarHBondContact O-N 3.13Å; V655-M657 PolarHBondContact O-N 3.4Å; V655-E658 PolarHBondContact O-N 3.34Å; V655-Q666 HydrophobicContact CG1-CB 4.17Å; V655-Q666 HydrophobicContact CG1-CG 4.45Å; V655-H669 HydrophobicContact CG1-CB 4.18Å; V655-H669 WeakPolarHBondContact CG2-CD2 3.23Å; V655-L670 HydrophobicContact CB-CD2 3.98Å; V655-L670 HydrophobicContact CG1-CD2 3.75Å; V655-L670 HydrophobicContact CG1-CG 3.9Å
656	S	76.3	Confident	83.6	Confident	35 Å²	35	65.7 Å²	65.7	25%	0.245	34%	0.344	C	S	.	.	H	α-helix	trans	-64.8	-21.9	175.5	-56.8	0	0	0	0	113.6	I652 K654 S726	I652-S656 PolarHBondContact O-N 2.88Å; I652-S656 PolarHBondContact O-OG 3.48Å; K654-S656 VanDerWaalsContact C-N 3.32Å; K654-S656 PolarHBondContact O-N 3.18Å; S656-S726 VanDerWaalsContact OG-CB 3.29Å; S656-S726 WeakPolarHBondContact OG-CB 3.46Å; S656-S726 PolarHBondContact OG-OG 3.18Å
657	M	73.6	Confident	83.4	Confident	145 Å²	145	65.3 Å²	65.3	71%	0.714	34%	0.339	S	S	*	.	H	α-helix	trans	-102.7	-5	180	-66	-172.5	106.6	0	0	114.1	V653 K654 V655	V653-M657 HydrophobicContact CG1-SD 4.1Å; V653-M657 VanDerWaalsContact O-CG 3.31Å; V653-M657 WeakPolarHBondContact O-CG 3.49Å; V653-M657 PolarHBondContact O-N 3Å; K654-M657 CarbonylContact O-C 3.51Å; K654-M657 PolarHBondContact O-N 2.87Å; V655-M657 PolarHBondContact O-N 3.4Å
658	E	74	Confident	83.3	Confident	75 Å²	75	64.8 Å²	64.8	35%	0.35	33%	0.333	S	S	.	.			trans	-65.5	135.4	-179.8	-84.6	175.9	-174.1	0	0	110.7	K654 V655 Q666	K654-E658 WeakPolarHBondContact CE-OE1 3.23Å; K654-E658 HydrophobicContact CG-CG 4.48Å; K654-E658 IonicContact NZ-OE1 3.37Å; K654-E658 PolarHBondContact NZ-OE1 2.97Å; K654-E658 WeakPolarHBondContact O-CG 3.36Å; K654-E658 PolarHBondContact O-N 3.46Å; V655-E658 PolarHBondContact O-N 3.34Å; E658-Q666 PolarHBondContact O-NE2 3.01Å
659	S	63.1	Low	83.2	Confident	50 Å²	50	67.2 Å²	67.2	35%	0.35	34%	0.344	S	S	.	.	S	Bend	trans	-108.7	-9.3	-177.6	54.3	0	0	0	0	114.2	N748	S659-N748 PolarHBondContact O-OD1 3.35Å
660	H	67	Low	83.2	Confident	180 Å²	180	61.3 Å²	61.3	83%	0.833	32%	0.322	S	S	*	.	S	Bend	trans	-100.9	-17.9	-172	-63.4	-59	0	0	0	113.9
661	S	74.2	Confident	83.1	Confident	37 Å²	37	61.1 Å²	61.1	26%	0.259	31%	0.31	S	S	.	.	S	Bend	trans	-90.6	153.7	177.7	59	0	0	0	0	110.8	Q666	S661-Q666 WeakPolarHBondContact OG-CG 3.31Å; S661-Q666 PolarHBondContact OG-NE2 3.25Å
662	S	81.6	Confident	83.2	Confident	42 Å²	42	64.1 Å²	64.1	29%	0.294	32%	0.322	S	S	.	.			trans	-64.9	155.9	170.6	71.4	0	0	0	0	110.8	E664 D665 Q666	S662-E664 PolarHBondContact O-N 3.17Å; S662-D665 PolarHBondContact N-OD2 3.49Å; S662-D665 PolarHBondContact O-N 3.09Å; S662-D665 VanDerWaalsContact O-N 3.13Å; S662-D665 WeakPolarHBondContact OG-CB 3.46Å; S662-D665 PolarHBondContact OG-N 3.06Å; S662-D665 PolarHBondContact OG-OD2 2.75Å; S662-Q666 WeakPolarHBondContact O-CG 3.46Å; S662-Q666 PolarHBondContact O-N 3.36Å
663	L	82.9	Confident	83.2	Confident	17 Å²	17	64.2 Å²	64.2	9%	0.089	32%	0.322	C	S	.	.	H	α-helix	trans	-61.9	-32.8	175.6	-65.9	175.4	0	0	0	110.9	Q666 R667 I730 Q733 I734	L663-Q666 PolarHBondContact O-N 3.49Å; L663-R667 WeakPolarHBondContact O-CB 3.46Å; L663-R667 PolarHBondContact O-N 3.29Å; L663-I730 HydrophobicContact CB-CG2 4.24Å; L663-I730 WeakPolarHBondContact O-CG2 3.39Å; L663-Q733 HydrophobicContact CD1-CB 3.92Å; L663-Q733 HydrophobicContact CD2-CB 4.37Å; L663-I734 HydrophobicContact CB-CD1 4.04Å; L663-I734 HydrophobicContact CB-CG1 3.52Å; L663-I734 HydrophobicContact CD1-CG1 4.01Å; L663-I734 HydrophobicContact CG-CG1 4.4Å
664	E	87.5	Confident	83.4	Confident	69 Å²	69	63.7 Å²	63.7	32%	0.322	32%	0.315	S	S	.	.	H	α-helix	trans	-63	-42.5	173.2	-67.5	86.8	162.7	0	0	112.2	S662 R667 N668 R737	S662-E664 PolarHBondContact O-N 3.17Å; E664-R667 PolarHBondContact O-N 2.65Å; E664-N668 VanDerWaalsContact O-CB 3.3Å; E664-N668 WeakPolarHBondContact O-CB 3.49Å; E664-N668 PolarHBondContact O-N 2.91Å; E664-N668 PolarHBondContact O-ND2 2.93Å; E664-N668 VanDerWaalsContact O-ND2 3.09Å; E664-R737 IonicContact OE1-CZ 2.65Å; E664-R737 IonicContact OE1-NH1 3.59Å; E664-R737 PolarHBondContact OE1-NH1 2.67Å; E664-R737 IonicContact OE1-NH2 3.84Å; E664-R737 PolarHBondContact OE1-NH2 2.9Å; E664-R737 IonicContact OE2-CZ 2.58Å; E664-R737 IonicContact OE2-NH1 3.53Å; E664-R737 PolarHBondContact OE2-NH1 3.47Å
665	D	87.2	Confident	83.5	Confident	90 Å²	90	62.9 Å²	62.9	48%	0.481	31%	0.314	S	S	.	.	H	α-helix	trans	-65.1	-42	176.3	-65.6	-40.3	0	0	0	111.1	S662 N668 H669	S662-D665 PolarHBondContact N-OD2 3.49Å; S662-D665 PolarHBondContact O-N 3.09Å; S662-D665 VanDerWaalsContact O-N 3.13Å; S662-D665 WeakPolarHBondContact OG-CB 3.46Å; S662-D665 PolarHBondContact OG-N 3.06Å; S662-D665 PolarHBondContact OG-OD2 2.75Å; D665-N668 PolarHBondContact O-N 3.06Å; D665-H669 WeakPolarHBondContact O-CB 3.39Å; D665-H669 PolarHBondContact O-N 2.77Å
666	Q	87.6	Confident	83.6	Confident	6 Å²	6	66.3 Å²	66.3	3%	0.028	33%	0.329	C	S	.	.	H	α-helix	trans	-61.6	-47.9	176	-66.1	175.6	-1.6	0	0	111.3	V655 E658 S661 S662 L663 N668 H669 L670 I730	V655-Q666 HydrophobicContact CG1-CB 4.17Å; V655-Q666 HydrophobicContact CG1-CG 4.45Å; E658-Q666 PolarHBondContact O-NE2 3.01Å; S661-Q666 WeakPolarHBondContact OG-CG 3.31Å; S661-Q666 PolarHBondContact OG-NE2 3.25Å; S662-Q666 WeakPolarHBondContact O-CG 3.46Å; S662-Q666 PolarHBondContact O-N 3.36Å; L663-Q666 PolarHBondContact O-N 3.49Å; Q666-N668 PolarHBondContact O-N 3.24Å; Q666-H669 PolarHBondContact O-N 3.06Å; Q666-L670 WeakPolarHBondContact O-CG 3.25Å; Q666-L670 PolarHBondContact O-N 3Å; Q666-I730 HydrophobicContact CB-CD1 3.72Å
667	R	88.3	Confident	84.2	Confident	80 Å²	80	64.6 Å²	64.6	30%	0.302	32%	0.318	S	S	.	.	H	α-helix	trans	-57.6	-48.2	176.1	-177.3	-172.7	-178.6	-95.2	0.6	111.4	L663 E664 H669 L670 Q671 I730 D731 I734	L663-R667 WeakPolarHBondContact O-CB 3.46Å; L663-R667 PolarHBondContact O-N 3.29Å; E664-R667 PolarHBondContact O-N 2.65Å; R667-H669 VanDerWaalsContact C-N 3.29Å; R667-H669 PolarHBondContact O-N 3.15Å; R667-L670 PolarHBondContact O-N 3.27Å; R667-Q671 VanDerWaalsContact CZ-NE2 3.32Å; R667-Q671 WeakPolarHBondContact O-CG 3.42Å; R667-Q671 PolarHBondContact O-N 3Å; R667-I730 HydrophobicContact CB-CG2 3.95Å; R667-D731 WeakPolarHBondContact CD-OD1 3.31Å; R667-D731 IonicContact CZ-OD1 2.86Å; R667-D731 IonicContact NE-OD1 3.56Å; R667-D731 PolarHBondContact NE-OD1 3.47Å; R667-I734 HydrophobicContact CB-CD1 4.39Å
668	N	90.7	Very high	84.8	Confident	69 Å²	69	61.3 Å²	61.3	37%	0.369	30%	0.303	S	S	.	.	H	α-helix	trans	-64.5	-34.5	179.1	-70.2	-25.6	0	0	0	111.8	E664 D665 Q666 K672	E664-N668 VanDerWaalsContact O-CB 3.3Å; E664-N668 WeakPolarHBondContact O-CB 3.49Å; E664-N668 PolarHBondContact O-N 2.91Å; E664-N668 PolarHBondContact O-ND2 2.93Å; E664-N668 VanDerWaalsContact O-ND2 3.09Å; D665-N668 PolarHBondContact O-N 3.06Å; Q666-N668 PolarHBondContact O-N 3.24Å; N668-K672 WeakPolarHBondContact O-CG 3.42Å; N668-K672 PolarHBondContact O-N 3.44Å; N668-K672 VanDerWaalsContact O-N 3.09Å
669	H	91.5	Very high	85.3	Confident	66 Å²	66	64.6 Å²	64.6	31%	0.306	31%	0.312	S	S	.	.	H	α-helix	trans	-68.4	-46	175.6	-167	84.2	0	0	0	111.6	E651 V655 D665 Q666 R667 Q671 K672 L673	E651-H669 IonicContact OE1-CE1 3.31Å; E651-H669 PolarHBondContact OE1-CE1 3.42Å; E651-H669 IonicContact OE1-NE2 3.22Å; E651-H669 PolarHBondContact OE1-NE2 3.09Å; V655-H669 HydrophobicContact CG1-CB 4.18Å; V655-H669 WeakPolarHBondContact CG2-CD2 3.23Å; D665-H669 WeakPolarHBondContact O-CB 3.39Å; D665-H669 PolarHBondContact O-N 2.77Å; Q666-H669 PolarHBondContact O-N 3.06Å; R667-H669 VanDerWaalsContact C-N 3.29Å; R667-H669 PolarHBondContact O-N 3.15Å; H669-Q671 VanDerWaalsContact C-N 3.3Å; H669-Q671 PolarHBondContact O-N 3.13Å; H669-K672 WeakPolarHBondContact O-CB 2.7Å; H669-K672 PolarHBondContact O-N 2.86Å; H669-K672 VanDerWaalsContact O-N 3.14Å; H669-L673 PolarHBondContact O-N 3.45Å
670	L	91.5	Very high	86.4	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.4	-37.7	174.8	-67.6	-174.3	0	0	0	112.2	I652 V655 Q666 R667 K672 L673 E674 L723 V727 I730	I652-L670 HydrophobicContact CG1-CD2 4.49Å; I652-L670 HydrophobicContact CG2-CD2 4.28Å; V655-L670 HydrophobicContact CB-CD2 3.98Å; V655-L670 HydrophobicContact CG1-CD2 3.75Å; V655-L670 HydrophobicContact CG1-CG 3.9Å; Q666-L670 WeakPolarHBondContact O-CG 3.25Å; Q666-L670 PolarHBondContact O-N 3Å; R667-L670 PolarHBondContact O-N 3.27Å; L670-K672 PolarHBondContact O-N 3.48Å; L670-L673 HydrophobicContact CD2-CD1 4.16Å; L670-L673 WeakPolarHBondContact O-CB 3.33Å; L670-L673 PolarHBondContact O-N 3Å; L670-E674 PolarHBondContact O-N 3.17Å; L670-L723 HydrophobicContact CB-CD1 4.1Å; L670-L723 HydrophobicContact CD2-CD1 4.04Å; L670-V727 HydrophobicContact CB-CG2 3.63Å; L670-V727 HydrophobicContact CD1-CG2 3.8Å; L670-V727 HydrophobicContact CG-CG2 4.4Å; L670-I730 HydrophobicContact CD1-CD1 3.49Å; L670-I730 VanDerWaalsContact CD1-CD1 3.49Å; L670-I730 HydrophobicContact CG-CD1 4.36Å
671	Q	89.5	Confident	87.2	Confident	60 Å²	60	59.6 Å²	59.6	28%	0.28	28%	0.284	S	S	.	.	H	α-helix	trans	-64.4	-37.9	174.2	-75.2	-178.7	-20.3	0	0	112.6	R667 H669 E674 E675	R667-Q671 VanDerWaalsContact CZ-NE2 3.32Å; R667-Q671 WeakPolarHBondContact O-CG 3.42Å; R667-Q671 PolarHBondContact O-N 3Å; H669-Q671 VanDerWaalsContact C-N 3.3Å; H669-Q671 PolarHBondContact O-N 3.13Å; Q671-E674 VanDerWaalsContact O-CB 3.29Å; Q671-E674 WeakPolarHBondContact O-CB 3.46Å; Q671-E674 PolarHBondContact O-N 3.29Å; Q671-E675 PolarHBondContact O-N 2.98Å; Q671-E675 VanDerWaalsContact O-N 3.08Å
672	K	91.6	Very high	87.9	Confident	125 Å²	125	63.1 Å²	63.1	54%	0.543	30%	0.299	S	S	.	.	H	α-helix	trans	-64.9	-40.3	172.7	-73	172.2	-177.5	174.4	0	112	N668 H669 L670 E674 E675 E676	N668-K672 WeakPolarHBondContact O-CG 3.42Å; N668-K672 PolarHBondContact O-N 3.44Å; N668-K672 VanDerWaalsContact O-N 3.09Å; H669-K672 WeakPolarHBondContact O-CB 2.7Å; H669-K672 PolarHBondContact O-N 2.86Å; H669-K672 VanDerWaalsContact O-N 3.14Å; L670-K672 PolarHBondContact O-N 3.48Å; K672-E674 VanDerWaalsContact C-N 3.27Å; K672-E674 PolarHBondContact O-N 2.86Å; K672-E675 PolarHBondContact O-N 2.76Å; K672-E676 WeakPolarHBondContact O-CG 3.35Å; K672-E676 PolarHBondContact O-N 3.2Å
673	L	91.3	Very high	88.3	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-61.8	-36.7	173.4	-69.1	175.3	0	0	0	111.5	E651 I652 H669 L670 E676 L677 L723	E651-L673 HydrophobicContact CB-CD1 4.49Å; E651-L673 HydrophobicContact CG-CD1 4.04Å; E651-L673 HydrophobicContact CG-CD2 4.35Å; I652-L673 HydrophobicContact CG1-CD1 4.05Å; H669-L673 PolarHBondContact O-N 3.45Å; L670-L673 HydrophobicContact CD2-CD1 4.16Å; L670-L673 WeakPolarHBondContact O-CB 3.33Å; L670-L673 PolarHBondContact O-N 3Å; L673-E676 PolarHBondContact O-N 3.48Å; L673-L677 WeakPolarHBondContact O-CB 3.15Å; L673-L677 VanDerWaalsContact O-CG 3.31Å; L673-L677 WeakPolarHBondContact O-CG 3.33Å; L673-L677 PolarHBondContact O-N 2.96Å; L673-L723 HydrophobicContact CB-CD1 4.39Å
674	E	89.3	Confident	88.6	Confident	55 Å²	55	65.5 Å²	65.5	26%	0.257	30%	0.304	S	S	.	.	H	α-helix	trans	-59.7	-48.1	173	-162.8	176.5	179.7	0	0	111.6	L670 Q671 K672 E676 L677 N678 L723 H724	L670-E674 PolarHBondContact O-N 3.17Å; Q671-E674 VanDerWaalsContact O-CB 3.29Å; Q671-E674 WeakPolarHBondContact O-CB 3.46Å; Q671-E674 PolarHBondContact O-N 3.29Å; K672-E674 VanDerWaalsContact C-N 3.27Å; K672-E674 PolarHBondContact O-N 2.86Å; E674-E676 VanDerWaalsContact C-N 3.31Å; E674-E676 PolarHBondContact O-N 3.36Å; E674-L677 PolarHBondContact O-N 3.43Å; E674-N678 WeakPolarHBondContact O-CB 3.43Å; E674-N678 VanDerWaalsContact O-CG 3.28Å; E674-N678 PolarHBondContact O-N 2.93Å; E674-N678 PolarHBondContact O-ND2 3.06Å; E674-L723 HydrophobicContact CB-CD2 3.63Å; E674-L723 HydrophobicContact CG-CD2 3.81Å; E674-H724 IonicContact OE1-CE1 2.98Å; E674-H724 PolarHBondContact OE1-CE1 3.22Å; E674-H724 VanDerWaalsContact OE1-CE1 3.27Å
675	E	88.8	Confident	88.7	Confident	114 Å²	114	64.8 Å²	64.8	53%	0.533	30%	0.303	S	S	.	.	H	α-helix	trans	-62	-37.2	176.1	-67.3	178.6	-176.6	0	0	112.6	Q671 K672 R679	Q671-E675 PolarHBondContact O-N 2.98Å; Q671-E675 VanDerWaalsContact O-N 3.08Å; K672-E675 PolarHBondContact O-N 2.76Å; E675-R679 WeakPolarHBondContact O-CG 3.06Å; E675-R679 PolarHBondContact O-N 3.07Å; E675-R679 PolarHBondContact O-NH1 3.4Å
676	E	88.7	Confident	88.9	Confident	75 Å²	75	65.3 Å²	65.3	35%	0.35	30%	0.303	S	S	.	.	H	α-helix	trans	-66.7	-45.9	175.5	-76.1	178.9	-178.8	0	0	112.4	K672 L673 E674 N678 R679 H680	K672-E676 WeakPolarHBondContact O-CG 3.35Å; K672-E676 PolarHBondContact O-N 3.2Å; L673-E676 PolarHBondContact O-N 3.48Å; E674-E676 VanDerWaalsContact C-N 3.31Å; E674-E676 PolarHBondContact O-N 3.36Å; E676-N678 VanDerWaalsContact C-N 3.33Å; E676-N678 PolarHBondContact O-N 3.16Å; E676-R679 WeakPolarHBondContact O-CB 3.37Å; E676-R679 PolarHBondContact O-N 3.49Å; E676-R679 VanDerWaalsContact O-N 3.12Å; E676-H680 PolarHBondContact O-N 3.04Å; E676-H680 VanDerWaalsContact O-N 3.14Å
677	L	87.7	Confident	89.2	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64	-39.6	177.1	-71.1	177.3	0	0	0	111.7	H648 L673 E674 R679 H680 Q681 W716 L719 F720 L723	H648-L677 HydrophobicContact CB-CD2 4.03Å; H648-L677 VanDerWaalsContact CD2-CD2 3.41Å; H648-L677 WeakPolarHBondContact CD2-CD2 3.35Å; L673-L677 WeakPolarHBondContact O-CB 3.15Å; L673-L677 VanDerWaalsContact O-CG 3.31Å; L673-L677 WeakPolarHBondContact O-CG 3.33Å; L673-L677 PolarHBondContact O-N 2.96Å; E674-L677 PolarHBondContact O-N 3.43Å; L677-R679 PolarHBondContact O-N 2.96Å; L677-H680 WeakPolarHBondContact O-CA 3.47Å; L677-H680 WeakPolarHBondContact O-CB 3.47Å; L677-H680 PolarHBondContact O-N 3.1Å; L677-Q681 PolarHBondContact O-N 2.94Å; L677-W716 HydrophobicContact CB-CH2 3.96Å; L677-W716 HydrophobicContact CD2-CH2 3.73Å; L677-W716 HydrophobicContact CD2-CZ3 3.7Å; L677-W716 HydrophobicContact CG-CH2 4.44Å; L677-W716 WeakPolarHBondContact O-CH2 3.47Å; L677-W716 VanDerWaalsContact O-CZ2 3.26Å; L677-W716 WeakPolarHBondContact O-CZ2 3.49Å; L677-L719 HydrophobicContact CD1-CD2 3.91Å; L677-L719 HydrophobicContact CD1-CG 3.99Å; L677-L719 HydrophobicContact CD2-CD2 3.55Å; L677-L719 HydrophobicContact CG-CD2 4.41Å; L677-F720 HydrophobicContact CB-CE1 4.29Å; L677-F720 HydrophobicContact CB-CE2 4.34Å; L677-F720 HydrophobicContact CB-CZ 3.84Å; L677-L723 HydrophobicContact CD1-CD2 4.09Å
678	N	86.2	Confident	89.3	Confident	76 Å²	76	62.4 Å²	62.4	41%	0.406	29%	0.292	S	S	.	.	H	α-helix	trans	-59.1	-34.9	173.9	-75.3	-37	0	0	0	112.3	E674 E676 Q681 F720	E674-N678 WeakPolarHBondContact O-CB 3.43Å; E674-N678 VanDerWaalsContact O-CG 3.28Å; E674-N678 PolarHBondContact O-N 2.93Å; E674-N678 PolarHBondContact O-ND2 3.06Å; E676-N678 VanDerWaalsContact C-N 3.33Å; E676-N678 PolarHBondContact O-N 3.16Å; N678-Q681 VanDerWaalsContact O-CB 3.28Å; N678-Q681 WeakPolarHBondContact O-CB 3.25Å; N678-Q681 PolarHBondContact O-N 3.28Å; N678-F720 WeakPolarHBondContact OD1-CZ 3.32Å
679	R	85.1	Confident	89.4	Confident	143 Å²	143	65.8 Å²	65.8	54%	0.54	31%	0.306	S	S	.	.	H	α-helix	trans	-71.4	-28.3	173.4	-69	-175.1	-69.7	-97.2	11.5	113.3	E675 E676 L677 Q681	E675-R679 WeakPolarHBondContact O-CG 3.06Å; E675-R679 PolarHBondContact O-N 3.07Å; E675-R679 PolarHBondContact O-NH1 3.4Å; E676-R679 WeakPolarHBondContact O-CB 3.37Å; E676-R679 PolarHBondContact O-N 3.49Å; E676-R679 VanDerWaalsContact O-N 3.12Å; L677-R679 PolarHBondContact O-N 2.96Å; R679-Q681 PolarHBondContact O-N 3.37Å
680	H	85.4	Confident	89.5	Confident	34 Å²	34	62.9 Å²	62.9	16%	0.157	29%	0.292	C	S	.	.	H	α-helix	trans	-73.3	-6.7	175.9	-77.2	168.6	0	0	0	114	S644 H648 E676 L677 D682 K683 L684 W716	S644-H680 PolarHBondContact OG-CE1 3.27Å; S644-H680 PolarHBondContact OG-ND1 3Å; H648-H680 AromaticContact CE1-CE1 3.47Å; H648-H680 PolarHBondContact CE1-CE1 3.47Å; H648-H680 VanDerWaalsContact CE1-CE1 3.47Å; H648-H680 AromaticContact CE1-ND1 3.75Å; H648-H680 AromaticContact NE2-CE1 3.6Å; H648-H680 AromaticContact NE2-ND1 3.76Å; E676-H680 PolarHBondContact O-N 3.04Å; E676-H680 VanDerWaalsContact O-N 3.14Å; L677-H680 WeakPolarHBondContact O-CA 3.47Å; L677-H680 WeakPolarHBondContact O-CB 3.47Å; L677-H680 PolarHBondContact O-N 3.1Å; H680-D682 PolarHBondContact O-N 3.09Å; H680-K683 PolarHBondContact CD2-NZ 3.44Å; H680-K683 VanDerWaalsContact CD2-NZ 3.34Å; H680-K683 PolarHBondContact NE2-NZ 3.1Å; H680-K683 WeakPolarHBondContact O-CB 3.37Å; H680-K683 PolarHBondContact O-N 2.84Å; H680-L684 PolarHBondContact O-N 3.34Å; H680-W716 HydrophobicContact CB-CH2 3.59Å; H680-W716 HydrophobicContact CB-CZ2 4.42Å; H680-W716 HydrophobicContact CB-CZ3 4.17Å
681	Q	85.5	Confident	89.6	Confident	92 Å²	92	64.2 Å²	64.2	43%	0.43	30%	0.299	S	S	.	.	H	α-helix	trans	-58.5	-29	172.1	-171.8	151.4	-10.9	0	0	113	L677 N678 R679 K683 L684 N685	L677-Q681 PolarHBondContact O-N 2.94Å; N678-Q681 VanDerWaalsContact O-CB 3.28Å; N678-Q681 WeakPolarHBondContact O-CB 3.25Å; N678-Q681 PolarHBondContact O-N 3.28Å; R679-Q681 PolarHBondContact O-N 3.37Å; Q681-K683 VanDerWaalsContact C-N 3.33Å; Q681-K683 PolarHBondContact O-N 3.34Å; Q681-L684 WeakPolarHBondContact O-CB 3.41Å; Q681-L684 PolarHBondContact O-N 3.03Å; Q681-N685 PolarHBondContact O-N 3.45Å; Q681-N685 PolarHBondContact O-ND2 2.63Å
682	D	87.6	Confident	89.7	Confident	110 Å²	110	64.1 Å²	64.1	59%	0.588	30%	0.299	S	S	*	.	H	α-helix	trans	-64	-37.3	174.2	-69.7	-25.4	0	0	0	112.3	H680 L684 N685 E686	H680-D682 PolarHBondContact O-N 3.09Å; D682-L684 VanDerWaalsContact C-N 3.33Å; D682-L684 PolarHBondContact O-N 3.4Å; D682-N685 WeakPolarHBondContact O-CB 3.29Å; D682-N685 PolarHBondContact O-N 2.96Å; D682-E686 WeakPolarHBondContact O-CG 3.48Å; D682-E686 PolarHBondContact O-N 2.81Å
683	K	89.6	Confident	89.7	Confident	94 Å²	94	59.5 Å²	59.5	41%	0.409	28%	0.284	S	S	.	.	H	α-helix	trans	-66.2	-38	175.8	-63.5	176.6	177.9	169.4	0	111.4	F641 H680 Q681 E686 L687	F641-K683 HydrophobicContact CD2-CB 3.98Å; F641-K683 HydrophobicContact CE2-CB 4.27Å; H680-K683 PolarHBondContact CD2-NZ 3.44Å; H680-K683 VanDerWaalsContact CD2-NZ 3.34Å; H680-K683 PolarHBondContact NE2-NZ 3.1Å; H680-K683 WeakPolarHBondContact O-CB 3.37Å; H680-K683 PolarHBondContact O-N 2.84Å; Q681-K683 VanDerWaalsContact C-N 3.33Å; Q681-K683 PolarHBondContact O-N 3.34Å; K683-E686 PolarHBondContact O-N 2.89Å; K683-L687 PolarHBondContact O-N 3.32Å
684	L	89.9	Confident	89.7	Confident	15 Å²	15	59.9 Å²	59.9	8%	0.079	29%	0.286	C	S	.	.	H	α-helix	trans	-64.4	-44.3	173.8	-176	68.7	0	0	0	110.7	F641 H680 Q681 D682 E686 L687 E688 M709 W716	F641-L684 HydrophobicContact CE1-CD1 3.74Å; F641-L684 HydrophobicContact CE2-CB 4.15Å; F641-L684 HydrophobicContact CZ-CB 3.91Å; F641-L684 HydrophobicContact CZ-CD1 3.75Å; F641-L684 HydrophobicContact CZ-CG 4.35Å; H680-L684 PolarHBondContact O-N 3.34Å; Q681-L684 WeakPolarHBondContact O-CB 3.41Å; Q681-L684 PolarHBondContact O-N 3.03Å; D682-L684 VanDerWaalsContact C-N 3.33Å; D682-L684 PolarHBondContact O-N 3.4Å; L684-E686 VanDerWaalsContact C-N 3.33Å; L684-E686 PolarHBondContact O-N 2.93Å; L684-L687 WeakPolarHBondContact O-CB 3.29Å; L684-L687 PolarHBondContact O-N 2.98Å; L684-E688 WeakPolarHBondContact O-CG 3.3Å; L684-E688 PolarHBondContact O-N 3.43Å; L684-M709 HydrophobicContact CD1-CE 3.46Å; L684-M709 VanDerWaalsContact CD1-CE 3.46Å; L684-M709 HydrophobicContact CG-CE 4.29Å; L684-W716 HydrophobicContact CD2-CG 4.26Å
685	N	89.8	Confident	89.7	Confident	54 Å²	54	60 Å²	60	29%	0.289	29%	0.287	S	S	.	.	H	α-helix	trans	-60.8	-40.3	176	-73	-40.2	0	0	0	112.3	R320 Q681 D682 E688 H689	R320-N685 PolarHBondContact NH2-OD1 3.43Å; Q681-N685 PolarHBondContact O-N 3.45Å; Q681-N685 PolarHBondContact O-ND2 2.63Å; D682-N685 WeakPolarHBondContact O-CB 3.29Å; D682-N685 PolarHBondContact O-N 2.96Å; N685-E688 PolarHBondContact O-N 3.36Å; N685-H689 PolarHBondContact O-N 3.43Å
686	E	91.6	Very high	89.7	Confident	102 Å²	102	59.8 Å²	59.8	48%	0.477	29%	0.289	S	S	.	.	H	α-helix	trans	-63	-42.1	174.1	-77.2	-172.5	-153.3	0	0	112.4	K637 D682 K683 L684 E688 H689 V690	K637-E686 IonicContact NZ-OE2 3.24Å; K637-E686 PolarHBondContact NZ-OE2 2.7Å; D682-E686 WeakPolarHBondContact O-CG 3.48Å; D682-E686 PolarHBondContact O-N 2.81Å; K683-E686 PolarHBondContact O-N 2.89Å; L684-E686 VanDerWaalsContact C-N 3.33Å; L684-E686 PolarHBondContact O-N 2.93Å; E686-E688 VanDerWaalsContact C-N 3.35Å; E686-H689 PolarHBondContact O-N 2.86Å; E686-V690 WeakPolarHBondContact O-CG2 3.36Å; E686-V690 PolarHBondContact O-N 2.58Å; E686-V690 VanDerWaalsContact O-N 3.09Å
687	L	93.4	Very high	89.7	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-62	-42.6	174.7	-91.5	167.8	0	0	0	112	F634 K637 A638 F641 K683 L684 H689 V690 N691 M709 L712	F634-L687 HydrophobicContact CD2-CD2 4.12Å; F634-L687 HydrophobicContact CE2-CD2 4.02Å; K637-L687 HydrophobicContact CB-CD2 3.51Å; K637-L687 HydrophobicContact CB-CG 3.92Å; A638-L687 HydrophobicContact CB-CD2 4.24Å; F641-L687 HydrophobicContact CB-CD1 3.46Å; F641-L687 VanDerWaalsContact CB-CD1 3.46Å; F641-L687 HydrophobicContact CD1-CD1 3.72Å; F641-L687 HydrophobicContact CD2-CD1 4.28Å; F641-L687 HydrophobicContact CG-CD1 3.57Å; K683-L687 PolarHBondContact O-N 3.32Å; L684-L687 WeakPolarHBondContact O-CB 3.29Å; L684-L687 PolarHBondContact O-N 2.98Å; L687-H689 VanDerWaalsContact C-N 3.3Å; L687-H689 PolarHBondContact O-N 3.34Å; L687-V690 PolarHBondContact O-N 3.12Å; L687-N691 WeakPolarHBondContact O-CB 3.18Å; L687-N691 PolarHBondContact O-N 3.07Å; L687-M709 HydrophobicContact CB-CE 4.48Å; L687-M709 HydrophobicContact CB-SD 4.14Å; L687-L712 HydrophobicContact CD1-CD1 4.13Å
688	E	90.9	Very high	89.6	Confident	22 Å²	22	65.4 Å²	65.4	10%	0.103	32%	0.315	C	S	.	.	H	α-helix	trans	-59.7	-41.2	174.5	-73	-170	156.5	0	0	111.8	R320 L684 N685 E686 N691 Q692 M709 R713	R320-E688 IonicContact CZ-OE2 3.47Å; R320-E688 IonicContact NE-OE2 3.33Å; R320-E688 PolarHBondContact NE-OE2 3.15Å; R320-E688 IonicContact NH2-OE2 2.84Å; R320-E688 PolarHBondContact NH2-OE2 3.4Å; L684-E688 WeakPolarHBondContact O-CG 3.3Å; L684-E688 PolarHBondContact O-N 3.43Å; N685-E688 PolarHBondContact O-N 3.36Å; E686-E688 VanDerWaalsContact C-N 3.35Å; E688-N691 PolarHBondContact O-N 2.65Å; E688-Q692 WeakPolarHBondContact O-CB 3.31Å; E688-Q692 PolarHBondContact O-N 3.38Å; E688-M709 HydrophobicContact CG-CE 3.4Å; E688-M709 VanDerWaalsContact CG-CE 3.4Å; E688-M709 HydrophobicContact CG-SD 4.18Å; E688-R713 IonicContact OE1-CZ 3.84Å; E688-R713 VanDerWaalsContact OE1-CZ 3.26Å; E688-R713 IonicContact OE1-NE 3.51Å; E688-R713 PolarHBondContact OE1-NE 3.48Å; E688-R713 IonicContact OE1-NH2 3.78Å; E688-R713 PolarHBondContact OE1-NH2 3.47Å
689	H	92.7	Very high	89.7	Confident	141 Å²	141	62.3 Å²	62.3	65%	0.653	30%	0.298	S	S	*	.	H	α-helix	trans	-64.9	-41.3	177.7	-174.6	-71.7	0	0	0	112	N685 E686 L687 Q692 A693	N685-H689 PolarHBondContact O-N 3.43Å; E686-H689 PolarHBondContact O-N 2.86Å; L687-H689 VanDerWaalsContact C-N 3.3Å; L687-H689 PolarHBondContact O-N 3.34Å; H689-Q692 PolarHBondContact O-N 3Å; H689-A693 PolarHBondContact O-N 2.81Å
690	V	93.7	Very high	89.8	Confident	4 Å²	4	63 Å²	63	2%	0.024	31%	0.305	C	S	.	.	H	α-helix	trans	-68.7	-39.5	176.6	-177.7	0	0	0	0	110.9	E633 F634 K637 E686 L687 Q692 A693 L694	E633-V690 HydrophobicContact CB-CG1 4.38Å; E633-V690 HydrophobicContact CG-CG1 4.26Å; E633-V690 HydrophobicContact CG-CG2 4.15Å; F634-V690 HydrophobicContact CB-CG1 3.75Å; F634-V690 HydrophobicContact CD2-CB 4.48Å; F634-V690 HydrophobicContact CD2-CG1 4.29Å; K637-V690 HydrophobicContact CD-CG2 4.2Å; E686-V690 WeakPolarHBondContact O-CG2 3.36Å; E686-V690 PolarHBondContact O-N 2.58Å; E686-V690 VanDerWaalsContact O-N 3.09Å; L687-V690 PolarHBondContact O-N 3.12Å; V690-Q692 VanDerWaalsContact C-N 3.34Å; V690-A693 PolarHBondContact O-N 3.45Å; V690-L694 PolarHBondContact O-N 3.43Å
691	N	93	Very high	89.9	Confident	28 Å²	28	69.1 Å²	69.1	15%	0.15	33%	0.334	C	S	.	.	H	α-helix	trans	-62	-42	174	-172	77	0	0	0	111.7	F634 L687 E688 A693 L694 E695 M709	F634-N691 HydrophobicContact CD2-CB 4.25Å; F634-N691 HydrophobicContact CE2-CB 3.87Å; L687-N691 WeakPolarHBondContact O-CB 3.18Å; L687-N691 PolarHBondContact O-N 3.07Å; E688-N691 PolarHBondContact O-N 2.65Å; N691-A693 VanDerWaalsContact C-N 3.33Å; N691-A693 PolarHBondContact O-N 2.93Å; N691-L694 WeakPolarHBondContact O-CB 3.17Å; N691-L694 PolarHBondContact O-N 2.94Å; N691-L694 VanDerWaalsContact O-N 3.16Å; N691-E695 PolarHBondContact ND2-OE1 3.06Å; N691-E695 PolarHBondContact O-N 3.47Å; N691-M709 HydrophobicContact CB-CB 4.22Å; N691-M709 HydrophobicContact CB-CG 4.22Å; N691-M709 HydrophobicContact CB-SD 4.35Å
692	Q	90.9	Very high	90.1	Very high	59 Å²	59	66.3 Å²	66.3	28%	0.276	32%	0.322	S	S	.	.	H	α-helix	trans	-60.9	-43.3	174.6	-171.3	62.9	60	0	0	111.1	E688 H689 V690 L694 E695 D696	E688-Q692 WeakPolarHBondContact O-CB 3.31Å; E688-Q692 PolarHBondContact O-N 3.38Å; H689-Q692 PolarHBondContact O-N 3Å; V690-Q692 VanDerWaalsContact C-N 3.34Å; Q692-L694 VanDerWaalsContact C-N 3.27Å; Q692-L694 PolarHBondContact O-N 3.4Å; Q692-E695 PolarHBondContact O-N 3.34Å; Q692-D696 PolarHBondContact NE2-OD1 3.46Å; Q692-D696 WeakPolarHBondContact O-CB 3.43Å; Q692-D696 PolarHBondContact O-N 3.31Å
693	A	91.9	Very high	90.3	Very high	28 Å²	28	66.2 Å²	66.2	23%	0.231	33%	0.327	C	S	.	.	H	α-helix	trans	-63.4	-31.9	176.1	0	0	0	0	0	112.9	L630 H689 V690 N691 A697	L630-A693 HydrophobicContact CD1-CB 4.29Å; L630-A693 HydrophobicContact CD2-CB 3.94Å; H689-A693 PolarHBondContact O-N 2.81Å; V690-A693 PolarHBondContact O-N 3.45Å; N691-A693 VanDerWaalsContact C-N 3.33Å; N691-A693 PolarHBondContact O-N 2.93Å; A693-A697 WeakPolarHBondContact O-CB 3.23Å; A693-A697 PolarHBondContact O-N 3.48Å; A693-A697 VanDerWaalsContact O-N 3.14Å
694	L	91.8	Very high	90.4	Very high	9 Å²	9	66.9 Å²	66.9	5%	0.047	33%	0.328	C	S	.	.	H	α-helix	trans	-68.7	-45.9	172.2	-76.1	168.8	0	0	0	111.7	L630 R631 F634 V690 N691 Q692 A697 Y698 V699	L630-L694 HydrophobicContact CB-CD2 3.6Å; L630-L694 HydrophobicContact CB-CG 4.17Å; R631-L694 HydrophobicContact CG-CD2 4.16Å; F634-L694 HydrophobicContact CB-CD1 3.68Å; F634-L694 HydrophobicContact CD1-CD1 4.47Å; F634-L694 HydrophobicContact CD2-CD1 4.08Å; F634-L694 HydrophobicContact CG-CD1 3.81Å; V690-L694 PolarHBondContact O-N 3.43Å; N691-L694 WeakPolarHBondContact O-CB 3.17Å; N691-L694 PolarHBondContact O-N 2.94Å; N691-L694 VanDerWaalsContact O-N 3.16Å; Q692-L694 VanDerWaalsContact C-N 3.27Å; Q692-L694 PolarHBondContact O-N 3.4Å; L694-A697 CarbonylContact O-C 3.2Å; L694-A697 PolarHBondContact O-N 3.11Å; L694-Y698 PolarHBondContact O-N 3.2Å; L694-Y698 VanDerWaalsContact O-N 3.15Å; L694-V699 HydrophobicContact CB-CB 4.49Å; L694-V699 HydrophobicContact CD2-CB 3.81Å; L694-V699 HydrophobicContact CD2-CG1 3.7Å; L694-V699 PolarHBondContact O-N 3.2Å
695	E	89.2	Confident	90.6	Very high	58 Å²	58	67.1 Å²	67.1	27%	0.271	33%	0.33	S	S	.	.	H	α-helix	trans	-61.3	-46.2	176.4	-72.3	176.5	-163.6	0	0	111.5	R316 N691 Q692 A697 Y698	R316-E695 IonicContact CZ-OE2 3.21Å; R316-E695 IonicContact NE-OE2 3.99Å; R316-E695 IonicContact NH2-OE2 2.78Å; R316-E695 PolarHBondContact NH2-OE2 3.01Å; N691-E695 PolarHBondContact ND2-OE1 3.06Å; N691-E695 PolarHBondContact O-N 3.47Å; Q692-E695 PolarHBondContact O-N 3.34Å; E695-A697 PolarHBondContact O-N 3.42Å; E695-Y698 WeakPolarHBondContact O-CA 3.12Å; E695-Y698 PolarHBondContact O-N 3.29Å
696	D	88.7	Confident	90.8	Very high	109 Å²	109	71 Å²	71	58%	0.583	36%	0.355	S	S	*	.	H	α-helix	trans	-63.3	-28.1	177.1	-65.4	-10	0	0	0	111.9	Q692 Y698	Q692-D696 PolarHBondContact NE2-OD1 3.46Å; Q692-D696 WeakPolarHBondContact O-CB 3.43Å; Q692-D696 PolarHBondContact O-N 3.31Å; D696-Y698 VanDerWaalsContact C-N 3.32Å
697	A	88.5	Confident	90.8	Very high	28 Å²	28	69.1 Å²	69.1	23%	0.231	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	2.3	174.1	0	0	0	0	0	113.7	L630 A693 L694 E695 V699	L630-A697 HydrophobicContact CD1-CB 4.33Å; A693-A697 WeakPolarHBondContact O-CB 3.23Å; A693-A697 PolarHBondContact O-N 3.48Å; A693-A697 VanDerWaalsContact O-N 3.14Å; L694-A697 CarbonylContact O-C 3.2Å; L694-A697 PolarHBondContact O-N 3.11Å; E695-A697 PolarHBondContact O-N 3.42Å; A697-V699 VanDerWaalsContact C-N 3.28Å; A697-V699 HydrophobicContact CB-CG2 4.05Å; A697-V699 PolarHBondContact O-N 3.26Å
698	Y	87.1	Confident	90.7	Very high	166 Å²	166	71.5 Å²	71.5	65%	0.651	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	39.3	-174.9	-62.2	-94.7	0	0	0	113.3	L694 E695 D696 F700	L694-Y698 PolarHBondContact O-N 3.2Å; L694-Y698 VanDerWaalsContact O-N 3.15Å; E695-Y698 WeakPolarHBondContact O-CA 3.12Å; E695-Y698 PolarHBondContact O-N 3.29Å; D696-Y698 VanDerWaalsContact C-N 3.32Å; Y698-F700 HydrophobicContact CD1-CE2 4.35Å; Y698-F700 HydrophobicContact CD1-CZ 4.23Å
699	V	88.1	Confident	90.8	Very high	11 Å²	11	70.5 Å²	70.5	7%	0.067	36%	0.357	C	S	.	.			trans	-108	100.7	177.9	-178.8	0	0	0	0	109.8	N627 R631 L694 A697	N627-V699 HydrophobicContact CB-CG2 3.92Å; R631-V699 HydrophobicContact CG-CG1 3.84Å; R631-V699 VanDerWaalsContact NE-CG1 3.29Å; L694-V699 HydrophobicContact CB-CB 4.49Å; L694-V699 HydrophobicContact CD2-CB 3.81Å; L694-V699 HydrophobicContact CD2-CG1 3.7Å; L694-V699 PolarHBondContact O-N 3.2Å; A697-V699 VanDerWaalsContact C-N 3.28Å; A697-V699 HydrophobicContact CB-CG2 4.05Å; A697-V699 PolarHBondContact O-N 3.26Å
700	F	86.9	Confident	90.6	Very high	157 Å²	157	67.5 Å²	67.5	69%	0.689	35%	0.349	S	S	*	.			trans	-101.3	-15.4	-177.1	-54	-72.3	0	0	0	113.9	Y698	Y698-F700 HydrophobicContact CD1-CE2 4.35Å; Y698-F700 HydrophobicContact CD1-CZ 4.23Å
701	E	86.5	Confident	90.5	Very high	163 Å²	163	70.6 Å²	70.6	76%	0.762	37%	0.369	S	S	*	.			trans	-108.2	130.4	-179.8	-65.3	-176.9	179.1	0	0	111.1	R631	R631-E701 PolarHBondContact NE-O 3.42Å
702	N	90.4	Very high	90.4	Very high	32 Å²	32	69.3 Å²	69.3	17%	0.171	36%	0.362	C	S	.	.			trans	-127.9	100.7	175.9	-165.9	-17.1	0	0	0	110.9	R631 F634 Y704 T705	R631-N702 PolarHBondContact O-ND2 3.34Å; R631-N702 PolarHBondContact O-OD1 2.96Å; F634-N702 WeakPolarHBondContact CD1-ND2 3.02Å; N702-Y704 PolarHBondContact O-N 2.94Å; N702-Y704 WeakPolarHBondContact OD1-CB 3.29Å; N702-Y704 PolarHBondContact OD1-N 3.29Å; N702-Y704 VanDerWaalsContact OD1-N 3.15Å; N702-T705 HydrophobicContact CB-CG2 4.32Å; N702-T705 VanDerWaalsContact O-O 3.13Å
703	P	90.9	Very high	90.4	Very high	108 Å²	108	69.6 Å²	69.6	70%	0.701	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-5.5	-178.4	30.9	-34.7	0	0	0	113.7
704	Y	93.5	Very high	90.2	Very high	108 Å²	108	71.7 Å²	71.7	42%	0.424	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-9.8	-176.3	-62.4	-69.3	0	0	0	114.3	E628 R631 R632 A635 N702	E628-Y704 WeakPolarHBondContact OE1-CE2 3.47Å; E628-Y704 PolarHBondContact OE1-OH 3.06Å; R631-Y704 HydrophobicContact CB-CD2 4.03Å; R631-Y704 HydrophobicContact CB-CE2 4.31Å; R632-Y704 HydrophobicContact CG-CD2 3.9Å; R632-Y704 HydrophobicContact CG-CE2 3.74Å; R632-Y704 HydrophobicContact CG-CG 4.36Å; R632-Y704 PolarHBondContact NE-OH 3.47Å; R632-Y704 PolarHBondContact NH2-OH 2.94Å; R632-Y704 VanDerWaalsContact NH2-OH 3.16Å; A635-Y704 VanDerWaalsContact CB-CB 3.47Å; N702-Y704 PolarHBondContact O-N 2.94Å; N702-Y704 WeakPolarHBondContact OD1-CB 3.29Å; N702-Y704 PolarHBondContact OD1-N 3.29Å; N702-Y704 VanDerWaalsContact OD1-N 3.15Å
705	T	93	Very high	90.1	Very high	21 Å²	21	72.3 Å²	72.3	13%	0.129	38%	0.377	C	S	.	.			trans	-148.7	147	179.9	-176.6	0	0	0	0	111.1	F634 A635 N702 Y707	F634-T705 HydrophobicContact CD1-CG2 3.93Å; F634-T705 HydrophobicContact CE1-CG2 4.02Å; A635-T705 HydrophobicContact CB-CG2 3.89Å; N702-T705 HydrophobicContact CB-CG2 4.32Å; N702-T705 VanDerWaalsContact O-O 3.13Å; T705-Y707 WeakPolarHBondContact OG1-CD2 3.31Å; T705-Y707 PolarHBondContact OG1-N 3.23Å; T705-Y707 VanDerWaalsContact OG1-N 3.1Å
706	V	93.3	Very high	90.1	Very high	134 Å²	134	70.2 Å²	70.2	81%	0.812	37%	0.366	S	S	*	.	S	Bend	trans	-87.8	-13.1	171	-64.6	0	0	0	0	112.2
707	Y	92.4	Very high	90	Very high	63 Å²	63	67.1 Å²	67.1	25%	0.247	35%	0.348	C	S	.	.			trans	-83.1	126.9	-178.1	-57.8	-65.7	0	0	0	110.3	F634 E639 N642 T705 L712	F634-Y707 WeakPolarHBondContact CE1-O 3.42Å; E639-Y707 WeakPolarHBondContact OE2-CE2 3.5Å; N642-Y707 HydrophobicContact CB-CD2 4.41Å; N642-Y707 HydrophobicContact CB-CE1 4.27Å; N642-Y707 HydrophobicContact CB-CE2 4.11Å; N642-Y707 VanDerWaalsContact ND2-CZ 3.3Å; N642-Y707 PolarHBondContact ND2-OH 2.89Å; T705-Y707 WeakPolarHBondContact OG1-CD2 3.31Å; T705-Y707 PolarHBondContact OG1-N 3.23Å; T705-Y707 VanDerWaalsContact OG1-N 3.1Å; Y707-L712 HydrophobicContact CD1-CD2 4.18Å; Y707-L712 HydrophobicContact CG-CD2 4.09Å
708	S	91.6	Very high	90	Very high	52 Å²	52	71.6 Å²	71.6	36%	0.364	37%	0.365	S	S	.	.			trans	-101.6	157.2	168.4	70.3	0	0	0	0	110.5	P710 T711 L712	S708-P710 VanDerWaalsContact C-N 3.32Å; S708-T711 PolarHBondContact N-OG1 3.21Å; S708-T711 PolarHBondContact O-N 3.4Å; S708-T711 PolarHBondContact O-OG1 3.03Å; S708-T711 WeakPolarHBondContact OG-CG2 3.31Å; S708-T711 PolarHBondContact OG-N 3.13Å; S708-T711 PolarHBondContact OG-OG1 2.96Å; S708-L712 PolarHBondContact O-N 3.36Å; S708-L712 VanDerWaalsContact O-N 3.09Å
709	M	92.2	Very high	90.2	Very high	2 Å²	2	64 Å²	64	1%	0.01	34%	0.335	C	S	.	.	H	α-helix	trans	-53.9	-42.5	178.2	-169.8	69.6	-144.4	0	0	113	F634 L684 L687 E688 N691 T711 L712 R713	F634-M709 HydrophobicContact CE2-SD 4.46Å; F634-M709 HydrophobicContact CZ-CB 4.42Å; L684-M709 HydrophobicContact CD1-CE 3.46Å; L684-M709 VanDerWaalsContact CD1-CE 3.46Å; L684-M709 HydrophobicContact CG-CE 4.29Å; L687-M709 HydrophobicContact CB-CE 4.48Å; L687-M709 HydrophobicContact CB-SD 4.14Å; E688-M709 HydrophobicContact CG-CE 3.4Å; E688-M709 VanDerWaalsContact CG-CE 3.4Å; E688-M709 HydrophobicContact CG-SD 4.18Å; N691-M709 HydrophobicContact CB-CB 4.22Å; N691-M709 HydrophobicContact CB-CG 4.22Å; N691-M709 HydrophobicContact CB-SD 4.35Å; M709-T711 PolarHBondContact O-N 3.44Å; M709-L712 PolarHBondContact O-N 3Å; M709-R713 HydrophobicContact CE-CG 3.75Å; M709-R713 WeakPolarHBondContact O-CG 3.31Å; M709-R713 PolarHBondContact O-N 2.81Å; M709-R713 VanDerWaalsContact O-N 3.09Å
710	P	88.9	Confident	90.2	Very high	77 Å²	77	64.3 Å²	64.3	50%	0.5	34%	0.335	S	S	.	.	H	α-helix	trans	-58.5	-42.9	172.7	-26.5	35.8	0	0	0	113.9	S708 L712 R713 V714	S708-P710 VanDerWaalsContact C-N 3.32Å; P710-L712 VanDerWaalsContact C-N 3.35Å; P710-L712 PolarHBondContact O-N 3.33Å; P710-R713 PolarHBondContact O-N 3.45Å; P710-V714 WeakPolarHBondContact O-CG2 3.46Å; P710-V714 PolarHBondContact O-N 3.01Å; P710-V714 VanDerWaalsContact O-N 3.12Å
711	T	91	Very high	90.1	Very high	70 Å²	70	59.4 Å²	59.4	43%	0.429	32%	0.319	S	S	.	.	H	α-helix	trans	-64.6	-38	179.8	58.1	0	0	0	0	112.6	S708 M709 A715	S708-T711 PolarHBondContact N-OG1 3.21Å; S708-T711 PolarHBondContact O-N 3.4Å; S708-T711 PolarHBondContact O-OG1 3.03Å; S708-T711 WeakPolarHBondContact OG-CG2 3.31Å; S708-T711 PolarHBondContact OG-N 3.13Å; S708-T711 PolarHBondContact OG-OG1 2.96Å; M709-T711 PolarHBondContact O-N 3.44Å; T711-A715 PolarHBondContact O-N 2.98Å; T711-A715 VanDerWaalsContact O-N 3.12Å
712	L	92.5	Very high	90.1	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-69.1	-38.5	177.5	-65.6	174.6	0	0	0	112.2	A638 F641 N642 L687 Y707 S708 M709 P710 A715 W716	A638-L712 HydrophobicContact CB-CD1 3.79Å; F641-L712 HydrophobicContact CD1-CB 4.36Å; F641-L712 HydrophobicContact CD1-CD2 4.35Å; F641-L712 HydrophobicContact CE1-CB 4.44Å; N642-L712 HydrophobicContact CB-CD2 3.98Å; L687-L712 HydrophobicContact CD1-CD1 4.13Å; Y707-L712 HydrophobicContact CD1-CD2 4.18Å; Y707-L712 HydrophobicContact CG-CD2 4.09Å; S708-L712 PolarHBondContact O-N 3.36Å; S708-L712 VanDerWaalsContact O-N 3.09Å; M709-L712 PolarHBondContact O-N 3Å; P710-L712 VanDerWaalsContact C-N 3.35Å; P710-L712 PolarHBondContact O-N 3.33Å; L712-A715 PolarHBondContact O-N 3.31Å; L712-W716 WeakPolarHBondContact O-CB 3.45Å; L712-W716 PolarHBondContact O-N 3.18Å
713	R	89.2	Confident	90	Very high	64 Å²	64	52.7 Å²	52.7	24%	0.242	29%	0.288	C	S	.	.	H	α-helix	trans	-62.2	-47	175.2	-74.6	-176.2	179.1	147.9	-0.1	111.8	E688 M709 P710 A715 W716 E717	E688-R713 IonicContact OE1-CZ 3.84Å; E688-R713 VanDerWaalsContact OE1-CZ 3.26Å; E688-R713 IonicContact OE1-NE 3.51Å; E688-R713 PolarHBondContact OE1-NE 3.48Å; E688-R713 IonicContact OE1-NH2 3.78Å; E688-R713 PolarHBondContact OE1-NH2 3.47Å; M709-R713 HydrophobicContact CE-CG 3.75Å; M709-R713 WeakPolarHBondContact O-CG 3.31Å; M709-R713 PolarHBondContact O-N 2.81Å; M709-R713 VanDerWaalsContact O-N 3.09Å; P710-R713 PolarHBondContact O-N 3.45Å; R713-A715 VanDerWaalsContact C-N 3.34Å; R713-A715 PolarHBondContact O-N 3.48Å; R713-W716 WeakPolarHBondContact O-CB 3.36Å; R713-W716 PolarHBondContact O-N 3.42Å; R713-E717 WeakPolarHBondContact O-CG 3.43Å; R713-E717 PolarHBondContact O-N 2.71Å
714	V	88.5	Confident	89.8	Confident	72 Å²	72	50.1 Å²	50.1	44%	0.436	27%	0.266	S	S	.	.	H	α-helix	trans	-60.8	-44.6	178.2	172.3	0	0	0	0	111	P710 W716 E717 Q718	P710-V714 WeakPolarHBondContact O-CG2 3.46Å; P710-V714 PolarHBondContact O-N 3.01Å; P710-V714 VanDerWaalsContact O-N 3.12Å; V714-W716 VanDerWaalsContact C-N 3.31Å; V714-W716 PolarHBondContact O-N 3.47Å; V714-E717 PolarHBondContact O-N 3.06Å; V714-Q718 HydrophobicContact CG1-CG 4.35Å; V714-Q718 WeakPolarHBondContact O-CB 3.46Å; V714-Q718 VanDerWaalsContact O-CG 3.26Å; V714-Q718 WeakPolarHBondContact O-CG 3.49Å; V714-Q718 PolarHBondContact O-N 3Å
715	A	89.2	Confident	89.2	Confident	23 Å²	23	51.1 Å²	51.1	19%	0.19	27%	0.27	C	S	.	.	H	α-helix	trans	-61.6	-39.8	177.4	0	0	0	0	0	112.2	I645 T711 L712 R713 L719	I645-A715 HydrophobicContact CD1-CB 4.07Å; I645-A715 HydrophobicContact CG2-CB 4.32Å; T711-A715 PolarHBondContact O-N 2.98Å; T711-A715 VanDerWaalsContact O-N 3.12Å; L712-A715 PolarHBondContact O-N 3.31Å; R713-A715 VanDerWaalsContact C-N 3.34Å; R713-A715 PolarHBondContact O-N 3.48Å; A715-L719 PolarHBondContact O-N 3.24Å; A715-L719 VanDerWaalsContact O-N 3.12Å
716	W	90.3	Very high	88.9	Confident	14 Å²	14	50.4 Å²	50.4	5%	0.053	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-45	176.1	-178.5	-106.9	0	0	0	113	F641 I645 L677 H680 L684 L712 R713 V714 L719 F720	F641-W716 HydrophobicContact CE1-CB 4.38Å; F641-W716 HydrophobicContact CE1-CE3 4.28Å; F641-W716 AromaticContact CE2-CE3 4Å; F641-W716 HydrophobicContact CE2-CE3 4Å; F641-W716 HydrophobicContact CE2-CZ3 4.11Å; F641-W716 HydrophobicContact CZ-CB 4.35Å; F641-W716 AromaticContact CZ-CD2 3.74Å; F641-W716 HydrophobicContact CZ-CD2 3.74Å; F641-W716 AromaticContact CZ-CE3 3.44Å; F641-W716 HydrophobicContact CZ-CE3 3.44Å; F641-W716 VanDerWaalsContact CZ-CE3 3.44Å; F641-W716 HydrophobicContact CZ-CG 4.16Å; F641-W716 HydrophobicContact CZ-CZ3 4.03Å; I645-W716 HydrophobicContact CD1-CB 4.21Å; I645-W716 HydrophobicContact CD1-CE3 4.19Å; I645-W716 HydrophobicContact CG1-CE3 3.94Å; I645-W716 HydrophobicContact CG1-CZ3 4.48Å; L677-W716 HydrophobicContact CB-CH2 3.96Å; L677-W716 HydrophobicContact CD2-CH2 3.73Å; L677-W716 HydrophobicContact CD2-CZ3 3.7Å; L677-W716 HydrophobicContact CG-CH2 4.44Å; L677-W716 WeakPolarHBondContact O-CH2 3.47Å; L677-W716 VanDerWaalsContact O-CZ2 3.26Å; L677-W716 WeakPolarHBondContact O-CZ2 3.49Å; H680-W716 HydrophobicContact CB-CH2 3.59Å; H680-W716 HydrophobicContact CB-CZ2 4.42Å; H680-W716 HydrophobicContact CB-CZ3 4.17Å; L684-W716 HydrophobicContact CD2-CG 4.26Å; L712-W716 WeakPolarHBondContact O-CB 3.45Å; L712-W716 PolarHBondContact O-N 3.18Å; R713-W716 WeakPolarHBondContact O-CB 3.36Å; R713-W716 PolarHBondContact O-N 3.42Å; V714-W716 VanDerWaalsContact C-N 3.31Å; V714-W716 PolarHBondContact O-N 3.47Å; W716-L719 HydrophobicContact CE3-CD2 4.29Å; W716-L719 HydrophobicContact CZ3-CD2 4.2Å; W716-L719 WeakPolarHBondContact O-CB 3.16Å; W716-L719 PolarHBondContact O-N 2.98Å; W716-F720 HydrophobicContact CD2-CE2 4.33Å; W716-F720 AromaticContact CE2-CE2 3.49Å; W716-F720 VanDerWaalsContact CE2-CE2 3.49Å; W716-F720 HydrophobicContact CH2-CE2 4.18Å; W716-F720 HydrophobicContact CZ2-CD2 4.4Å; W716-F720 AromaticContact CZ2-CE2 3.42Å; W716-F720 HydrophobicContact CZ2-CE2 3.42Å; W716-F720 VanDerWaalsContact CZ2-CE2 3.42Å; W716-F720 HydrophobicContact CZ2-CZ 4.09Å; W716-F720 AromaticContact NE1-CD2 3.99Å; W716-F720 AromaticContact NE1-CE2 3.53Å; W716-F720 PolarHBondContact O-N 3.49Å
717	E	86.4	Confident	88.5	Confident	44 Å²	44	44.8 Å²	44.8	21%	0.206	23%	0.232	C	C	.	.	H	α-helix	trans	-67	-39.1	178.2	-72.8	174.5	-179.4	0	0	112.4	L327 R713 V714 L719 F720 T721	L327-E717 HydrophobicContact CD2-CB 3.85Å; L327-E717 HydrophobicContact CD2-CG 4.21Å; R713-E717 WeakPolarHBondContact O-CG 3.43Å; R713-E717 PolarHBondContact O-N 2.71Å; V714-E717 PolarHBondContact O-N 3.06Å; E717-L719 VanDerWaalsContact C-N 3.27Å; E717-L719 PolarHBondContact O-N 3.4Å; E717-F720 PolarHBondContact O-N 3.25Å; E717-T721 PolarHBondContact O-N 3.32Å; E717-T721 VanDerWaalsContact O-N 3.07Å; E717-T721 PolarHBondContact O-OG1 3.09Å
718	Q	88.3	Confident	87.9	Confident	122 Å²	122	42.5 Å²	42.5	57%	0.57	22%	0.224	S	C	*	.	H	α-helix	trans	-63.1	-35.2	174.4	-74.8	177.2	-0.2	0	0	112	V714 T721 L722	V714-Q718 HydrophobicContact CG1-CG 4.35Å; V714-Q718 WeakPolarHBondContact O-CB 3.46Å; V714-Q718 VanDerWaalsContact O-CG 3.26Å; V714-Q718 WeakPolarHBondContact O-CG 3.49Å; V714-Q718 PolarHBondContact O-N 3Å; Q718-T721 PolarHBondContact O-N 2.91Å; Q718-L722 WeakPolarHBondContact O-CB 3.39Å; Q718-L722 PolarHBondContact O-N 2.92Å
719	L	90.9	Very high	87.3	Confident	5 Å²	5	44 Å²	44	3%	0.026	23%	0.225	C	C	.	.	H	α-helix	trans	-62.9	-46.1	176.3	-176.1	65.8	0	0	0	112.1	I645 H648 R649 I652 L677 A715 W716 E717 T721 L722 L723	I645-L719 HydrophobicContact CG1-CD2 4.4Å; I645-L719 HydrophobicContact CG2-CD2 4.31Å; H648-L719 HydrophobicContact CB-CD1 4.28Å; H648-L719 HydrophobicContact CB-CD2 4.06Å; R649-L719 HydrophobicContact CB-CD1 3.83Å; I652-L719 HydrophobicContact CD1-CD1 3.65Å; I652-L719 HydrophobicContact CD1-CG 4.33Å; L677-L719 HydrophobicContact CD1-CD2 3.91Å; L677-L719 HydrophobicContact CD1-CG 3.99Å; L677-L719 HydrophobicContact CD2-CD2 3.55Å; L677-L719 HydrophobicContact CG-CD2 4.41Å; A715-L719 PolarHBondContact O-N 3.24Å; A715-L719 VanDerWaalsContact O-N 3.12Å; W716-L719 HydrophobicContact CE3-CD2 4.29Å; W716-L719 HydrophobicContact CZ3-CD2 4.2Å; W716-L719 WeakPolarHBondContact O-CB 3.16Å; W716-L719 PolarHBondContact O-N 2.98Å; E717-L719 VanDerWaalsContact C-N 3.27Å; E717-L719 PolarHBondContact O-N 3.4Å; L719-T721 VanDerWaalsContact C-N 3.34Å; L719-T721 PolarHBondContact O-N 2.86Å; L719-L722 PolarHBondContact O-N 3.5Å; L719-L723 PolarHBondContact O-N 3.25Å
720	F	88.1	Confident	86.9	Confident	18 Å²	18	44.1 Å²	44.1	8%	0.079	23%	0.226	C	C	.	.	H	α-helix	trans	-62.8	-41	174.3	-89.5	-79.2	0	0	0	112.5	L677 N678 W716 E717 L722 L723 H724	L677-F720 HydrophobicContact CB-CE1 4.29Å; L677-F720 HydrophobicContact CB-CE2 4.34Å; L677-F720 HydrophobicContact CB-CZ 3.84Å; N678-F720 WeakPolarHBondContact OD1-CZ 3.32Å; W716-F720 HydrophobicContact CD2-CE2 4.33Å; W716-F720 AromaticContact CE2-CE2 3.49Å; W716-F720 VanDerWaalsContact CE2-CE2 3.49Å; W716-F720 HydrophobicContact CH2-CE2 4.18Å; W716-F720 HydrophobicContact CZ2-CD2 4.4Å; W716-F720 AromaticContact CZ2-CE2 3.42Å; W716-F720 HydrophobicContact CZ2-CE2 3.42Å; W716-F720 VanDerWaalsContact CZ2-CE2 3.42Å; W716-F720 HydrophobicContact CZ2-CZ 4.09Å; W716-F720 AromaticContact NE1-CD2 3.99Å; W716-F720 AromaticContact NE1-CE2 3.53Å; W716-F720 PolarHBondContact O-N 3.49Å; E717-F720 PolarHBondContact O-N 3.25Å; F720-L722 VanDerWaalsContact C-N 3.32Å; F720-L722 PolarHBondContact O-N 2.87Å; F720-L723 WeakPolarHBondContact O-CB 3.34Å; F720-L723 PolarHBondContact O-N 2.89Å; F720-H724 PolarHBondContact O-CD2 3.17Å; F720-H724 PolarHBondContact O-N 2.99Å
721	T	83.9	Confident	86.5	Confident	55 Å²	55	43 Å²	43	34%	0.337	22%	0.216	S	C	.	.	H	α-helix	trans	-60.4	-44.4	177.3	-54.9	0	0	0	0	110.9	E717 Q718 L719 Y725	E717-T721 PolarHBondContact O-N 3.32Å; E717-T721 VanDerWaalsContact O-N 3.07Å; E717-T721 PolarHBondContact O-OG1 3.09Å; Q718-T721 PolarHBondContact O-N 2.91Å; L719-T721 VanDerWaalsContact C-N 3.34Å; L719-T721 PolarHBondContact O-N 2.86Å; T721-Y725 WeakPolarHBondContact O-CB 3.3Å; T721-Y725 PolarHBondContact O-N 2.96Å
722	L	87.5	Confident	85.8	Confident	54 Å²	54	40.5 Å²	40.5	28%	0.283	20%	0.2	S	C	.	.	H	α-helix	trans	-62.1	-42	175.8	178.2	65.1	0	0	0	112.2	R649 I652 V653 Q718 L719 F720 Y725 S726	R649-L722 HydrophobicContact CG-CD2 3.9Å; I652-L722 HydrophobicContact CG2-CD2 4.25Å; I652-L722 HydrophobicContact CG2-CG 3.99Å; V653-L722 HydrophobicContact CG2-CD2 4.31Å; Q718-L722 WeakPolarHBondContact O-CB 3.39Å; Q718-L722 PolarHBondContact O-N 2.92Å; L719-L722 PolarHBondContact O-N 3.5Å; F720-L722 VanDerWaalsContact C-N 3.32Å; F720-L722 PolarHBondContact O-N 2.87Å; L722-Y725 PolarHBondContact O-N 3.16Å; L722-S726 WeakPolarHBondContact O-CB 3.16Å; L722-S726 PolarHBondContact O-N 2.87Å; L722-S726 PolarHBondContact O-OG 2.85Å
723	L	88.6	Confident	85	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.3	-52.4	177.7	-178.5	67.3	0	0	0	111.5	I652 L670 L673 E674 L677 L719 F720 Y725 S726 V727	I652-L723 HydrophobicContact CD1-CB 3.93Å; I652-L723 HydrophobicContact CD1-CD1 3.94Å; I652-L723 HydrophobicContact CD1-CG 4.49Å; I652-L723 HydrophobicContact CG1-CD1 3.89Å; L670-L723 HydrophobicContact CB-CD1 4.1Å; L670-L723 HydrophobicContact CD2-CD1 4.04Å; L673-L723 HydrophobicContact CB-CD1 4.39Å; E674-L723 HydrophobicContact CB-CD2 3.63Å; E674-L723 HydrophobicContact CG-CD2 3.81Å; L677-L723 HydrophobicContact CD1-CD2 4.09Å; L719-L723 PolarHBondContact O-N 3.25Å; F720-L723 WeakPolarHBondContact O-CB 3.34Å; F720-L723 PolarHBondContact O-N 2.89Å; L723-Y725 VanDerWaalsContact C-N 3.29Å; L723-Y725 PolarHBondContact O-N 3.37Å; L723-S726 WeakPolarHBondContact O-CB 3.49Å; L723-S726 PolarHBondContact O-N 3.16Å; L723-S726 VanDerWaalsContact O-N 3.15Å; L723-V727 WeakPolarHBondContact O-CG2 3.5Å; L723-V727 PolarHBondContact O-N 3.28Å
724	H	85.7	Confident	84.5	Confident	53 Å²	53	40 Å²	40	25%	0.245	20%	0.201	C	C	.	.	H	α-helix	trans	-62	-37.5	-180	-73.4	-59.2	0	0	0	112.5	E674 F720 N728	E674-H724 IonicContact OE1-CE1 2.98Å; E674-H724 PolarHBondContact OE1-CE1 3.22Å; E674-H724 VanDerWaalsContact OE1-CE1 3.27Å; F720-H724 PolarHBondContact O-CD2 3.17Å; F720-H724 PolarHBondContact O-N 2.99Å; H724-N728 WeakPolarHBondContact O-CB 3.32Å; H724-N728 PolarHBondContact O-N 3.28Å
725	Y	82.3	Confident	83.8	Confident	129 Å²	129	38.5 Å²	38.5	51%	0.506	19%	0.19	S	C	.	.	H	α-helix	trans	-61.6	-46.4	174.5	-170.3	-88.6	0	0	0	111.4	T721 L722 L723 N728 E729	T721-Y725 WeakPolarHBondContact O-CB 3.3Å; T721-Y725 PolarHBondContact O-N 2.96Å; L722-Y725 PolarHBondContact O-N 3.16Å; L723-Y725 VanDerWaalsContact C-N 3.29Å; L723-Y725 PolarHBondContact O-N 3.37Å; Y725-N728 PolarHBondContact O-N 3.19Å; Y725-E729 WeakPolarHBondContact O-CB 3.47Å; Y725-E729 PolarHBondContact O-N 2.98Å
726	S	85.4	Confident	82.7	Confident	6 Å²	6	37.5 Å²	37.5	4%	0.042	18%	0.182	C	C	.	.	H	α-helix	trans	-63.4	-43.5	179.7	-60.2	0	0	0	0	112.5	I652 S656 L722 L723 E729 I730	I652-S726 WeakPolarHBondContact CG2-OG 3.45Å; S656-S726 VanDerWaalsContact OG-CB 3.29Å; S656-S726 WeakPolarHBondContact OG-CB 3.46Å; S656-S726 PolarHBondContact OG-OG 3.18Å; L722-S726 WeakPolarHBondContact O-CB 3.16Å; L722-S726 PolarHBondContact O-N 2.87Å; L722-S726 PolarHBondContact O-OG 2.85Å; L723-S726 WeakPolarHBondContact O-CB 3.49Å; L723-S726 PolarHBondContact O-N 3.16Å; L723-S726 VanDerWaalsContact O-N 3.15Å; S726-E729 PolarHBondContact O-N 3.06Å; S726-I730 PolarHBondContact O-N 2.88Å; S726-I730 VanDerWaalsContact O-N 3.07Å
727	V	86.3	Confident	81.9	Confident	16 Å²	16	37.8 Å²	37.8	10%	0.097	18%	0.183	C	C	.	.	H	α-helix	trans	-59.8	-48	175.1	172.6	0	0	0	0	110.6	L670 L723 E729 I730 D731	L670-V727 HydrophobicContact CB-CG2 3.63Å; L670-V727 HydrophobicContact CD1-CG2 3.8Å; L670-V727 HydrophobicContact CG-CG2 4.4Å; L723-V727 WeakPolarHBondContact O-CG2 3.5Å; L723-V727 PolarHBondContact O-N 3.28Å; V727-E729 VanDerWaalsContact C-N 3.31Å; V727-E729 PolarHBondContact O-N 2.9Å; V727-I730 PolarHBondContact O-N 3.18Å; V727-D731 PolarHBondContact O-N 3.11Å
728	N	78.6	Confident	81.1	Confident	15 Å²	15	40.1 Å²	40.1	8%	0.08	20%	0.196	C	C	.	.	H	α-helix	trans	-64.5	-35.1	179.3	177.6	79.9	0	0	0	112.4	T335 T339 H724 Y725 N732	T335-N728 WeakPolarHBondContact CB-OD1 3.23Å; T335-N728 HydrophobicContact CG2-CB 3.53Å; T335-N728 PolarHBondContact O-OD1 3.09Å; T339-N728 PolarHBondContact OG1-OD1 3.41Å; T339-N728 VanDerWaalsContact OG1-OD1 3.05Å; H724-N728 WeakPolarHBondContact O-CB 3.32Å; H724-N728 PolarHBondContact O-N 3.28Å; Y725-N728 PolarHBondContact O-N 3.19Å; N728-N732 PolarHBondContact ND2-ND2 3.34Å; N728-N732 VanDerWaalsContact ND2-ND2 3.15Å; N728-N732 WeakPolarHBondContact O-CB 3.09Å; N728-N732 PolarHBondContact O-N 3.45Å; N728-N732 PolarHBondContact O-ND2 3.36Å; N728-N732 PolarHBondContact OD1-ND2 3.34Å
729	E	80.4	Confident	80	Confident	84 Å²	84	36.7 Å²	36.7	39%	0.393	19%	0.186	S	C	.	.	H	α-helix	trans	-62.6	-48	174.8	-166	-176.7	160.2	0	0	111	Y725 S726 V727 N732 Q733	Y725-E729 WeakPolarHBondContact O-CB 3.47Å; Y725-E729 PolarHBondContact O-N 2.98Å; S726-E729 PolarHBondContact O-N 3.06Å; V727-E729 VanDerWaalsContact C-N 3.31Å; V727-E729 PolarHBondContact O-N 2.9Å; E729-N732 PolarHBondContact O-N 2.67Å; E729-Q733 VanDerWaalsContact O-CG 3.27Å; E729-Q733 WeakPolarHBondContact O-CG 3.4Å; E729-Q733 PolarHBondContact O-N 3.37Å; E729-Q733 PolarHBondContact OE1-NE2 3.3Å
730	I	83.5	Confident	78.8	Confident	4 Å²	4	37.3 Å²	37.3	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-64.1	-42.9	176.7	-70.6	159.7	0	0	0	111.4	L663 Q666 R667 L670 S726 V727 N732 Q733 I734	L663-I730 HydrophobicContact CB-CG2 4.24Å; L663-I730 WeakPolarHBondContact O-CG2 3.39Å; Q666-I730 HydrophobicContact CB-CD1 3.72Å; R667-I730 HydrophobicContact CB-CG2 3.95Å; L670-I730 HydrophobicContact CD1-CD1 3.49Å; L670-I730 VanDerWaalsContact CD1-CD1 3.49Å; L670-I730 HydrophobicContact CG-CD1 4.36Å; S726-I730 PolarHBondContact O-N 2.88Å; S726-I730 VanDerWaalsContact O-N 3.07Å; V727-I730 PolarHBondContact O-N 3.18Å; I730-N732 VanDerWaalsContact C-N 3.29Å; I730-N732 PolarHBondContact O-N 3.28Å; I730-Q733 WeakPolarHBondContact O-CA 3.19Å; I730-Q733 WeakPolarHBondContact O-CB 3.39Å; I730-Q733 PolarHBondContact O-N 3.38Å; I730-I734 HydrophobicContact CG2-CD1 3.9Å; I730-I734 HydrophobicContact CG2-CG1 4.33Å; I730-I734 WeakPolarHBondContact O-CG1 3.34Å; I730-I734 PolarHBondContact O-N 3.44Å
731	D	80.9	Confident	77.6	Confident	54 Å²	54	39.6 Å²	39.6	29%	0.289	22%	0.217	S	C	.	.	H	α-helix	trans	-59.5	-39.5	176.3	-79.2	-27.3	0	0	0	111.6	R667 V727 Q733 I734 L735	R667-D731 WeakPolarHBondContact CD-OD1 3.31Å; R667-D731 IonicContact CZ-OD1 2.86Å; R667-D731 IonicContact NE-OD1 3.56Å; R667-D731 PolarHBondContact NE-OD1 3.47Å; V727-D731 PolarHBondContact O-N 3.11Å; D731-Q733 VanDerWaalsContact C-N 3.35Å; D731-I734 PolarHBondContact O-N 2.87Å; D731-L735 WeakPolarHBondContact O-CB 3.27Å; D731-L735 PolarHBondContact O-N 3.44Å
732	N	74.3	Confident	76.8	Confident	18 Å²	18	37.7 Å²	37.7	10%	0.096	20%	0.204	C	C	.	.	H	α-helix	trans	-67.4	-34.7	174.5	-79.7	-57.1	0	0	0	112.6	T339 T342 N728 E729 I730 T736	T339-N732 WeakPolarHBondContact CA-OD1 3.46Å; T342-N732 WeakPolarHBondContact CB-OD1 3.13Å; T342-N732 HydrophobicContact CG2-CB 4.46Å; T342-N732 PolarHBondContact OG1-OD1 3.06Å; N728-N732 PolarHBondContact ND2-ND2 3.34Å; N728-N732 VanDerWaalsContact ND2-ND2 3.15Å; N728-N732 WeakPolarHBondContact O-CB 3.09Å; N728-N732 PolarHBondContact O-N 3.45Å; N728-N732 PolarHBondContact O-ND2 3.36Å; N728-N732 PolarHBondContact OD1-ND2 3.34Å; E729-N732 PolarHBondContact O-N 2.67Å; I730-N732 VanDerWaalsContact C-N 3.29Å; I730-N732 PolarHBondContact O-N 3.28Å; N732-T736 WeakPolarHBondContact O-CB 3.16Å; N732-T736 PolarHBondContact O-N 3.25Å; N732-T736 PolarHBondContact O-OG1 2.79Å
733	Q	75.9	Confident	76	Confident	33 Å²	33	38.5 Å²	38.5	15%	0.154	21%	0.212	C	C	.	.	H	α-helix	trans	-68	-41.4	174.1	-68.8	171.4	23	0	0	111.9	L663 E729 I730 D731 T736 R737 R751	L663-Q733 HydrophobicContact CD1-CB 3.92Å; L663-Q733 HydrophobicContact CD2-CB 4.37Å; E729-Q733 VanDerWaalsContact O-CG 3.27Å; E729-Q733 WeakPolarHBondContact O-CG 3.4Å; E729-Q733 PolarHBondContact O-N 3.37Å; E729-Q733 PolarHBondContact OE1-NE2 3.3Å; I730-Q733 WeakPolarHBondContact O-CA 3.19Å; I730-Q733 WeakPolarHBondContact O-CB 3.39Å; I730-Q733 PolarHBondContact O-N 3.38Å; D731-Q733 VanDerWaalsContact C-N 3.35Å; Q733-T736 PolarHBondContact O-N 3.45Å; Q733-R737 PolarHBondContact O-N 3.12Å; Q733-R751 VanDerWaalsContact CG-NH2 3.33Å; Q733-R751 VanDerWaalsContact OE1-CZ 3.23Å
734	I	79.5	Confident	75	Confident	21 Å²	21	41.2 Å²	41.2	11%	0.108	23%	0.234	C	C	.	.	H	α-helix	trans	-61.6	-49.8	174.3	-68.5	169	0	0	0	109.7	L663 R667 I730 D731 T736 R737 D738	L663-I734 HydrophobicContact CB-CD1 4.04Å; L663-I734 HydrophobicContact CB-CG1 3.52Å; L663-I734 HydrophobicContact CD1-CG1 4.01Å; L663-I734 HydrophobicContact CG-CG1 4.4Å; R667-I734 HydrophobicContact CB-CD1 4.39Å; I730-I734 HydrophobicContact CG2-CD1 3.9Å; I730-I734 HydrophobicContact CG2-CG1 4.33Å; I730-I734 WeakPolarHBondContact O-CG1 3.34Å; I730-I734 PolarHBondContact O-N 3.44Å; D731-I734 PolarHBondContact O-N 2.87Å; I734-T736 PolarHBondContact O-N 3.14Å; I734-R737 WeakPolarHBondContact O-CB 3.41Å; I734-R737 PolarHBondContact O-N 3.36Å; I734-R737 VanDerWaalsContact O-N 3.13Å; I734-D738 WeakPolarHBondContact CG2-OD2 3.37Å; I734-D738 WeakPolarHBondContact O-CB 3.47Å; I734-D738 VanDerWaalsContact O-CG 3.28Å; I734-D738 PolarHBondContact O-N 2.89Å
735	L	73.4	Confident	74.3	Confident	40 Å²	40	45.9 Å²	45.9	21%	0.209	26%	0.256	C	S	.	.	H	α-helix	trans	-55.3	-43	177.5	179.6	73.6	0	0	0	111.7	T342 R343 L346 D731 D738 S739	T342-L735 HydrophobicContact CG2-CD2 4.11Å; R343-L735 HydrophobicContact CG-CD1 4.4Å; R343-L735 HydrophobicContact CG-CD2 3.39Å; R343-L735 HydrophobicContact CG-CG 4.47Å; L346-L735 HydrophobicContact CD1-CD2 4.05Å; L346-L735 HydrophobicContact CD1-CG 3.99Å; D731-L735 WeakPolarHBondContact O-CB 3.27Å; D731-L735 PolarHBondContact O-N 3.44Å; L735-D738 PolarHBondContact O-N 3.39Å; L735-S739 VanDerWaalsContact O-CB 3.27Å; L735-S739 WeakPolarHBondContact O-CB 3.43Å; L735-S739 PolarHBondContact O-N 2.87Å; L735-S739 PolarHBondContact O-OG 3.33Å
736	T	67.5	Low	74	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.018	25%	0.25	C	S	.	.	H	α-helix	trans	-67.6	-38.9	179.7	-61.5	0	0	0	0	112.4	L346 N732 Q733 I734 S739 R740 L827	L346-T736 HydrophobicContact CD2-CG2 4.05Å; N732-T736 WeakPolarHBondContact O-CB 3.16Å; N732-T736 PolarHBondContact O-N 3.25Å; N732-T736 PolarHBondContact O-OG1 2.79Å; Q733-T736 PolarHBondContact O-N 3.45Å; I734-T736 PolarHBondContact O-N 3.14Å; T736-S739 PolarHBondContact O-OG 2.74Å; T736-R740 WeakPolarHBondContact O-CG 3.29Å; T736-L827 HydrophobicContact CG2-CD2 3.31Å
737	R	72.2	Confident	73.4	Confident	20 Å²	20	43.6 Å²	43.6	8%	0.075	25%	0.249	C	C	.	.	H	α-helix	trans	-63.8	-50.9	174.2	-179.9	-162.5	67.4	-170.8	0.4	110.4	E664 Q733 I734 R740 G741 L742 M747	E664-R737 IonicContact OE1-CZ 2.65Å; E664-R737 IonicContact OE1-NH1 3.59Å; E664-R737 PolarHBondContact OE1-NH1 2.67Å; E664-R737 IonicContact OE1-NH2 3.84Å; E664-R737 PolarHBondContact OE1-NH2 2.9Å; E664-R737 IonicContact OE2-CZ 2.58Å; E664-R737 IonicContact OE2-NH1 3.53Å; E664-R737 PolarHBondContact OE2-NH1 3.47Å; Q733-R737 PolarHBondContact O-N 3.12Å; I734-R737 WeakPolarHBondContact O-CB 3.41Å; I734-R737 PolarHBondContact O-N 3.36Å; I734-R737 VanDerWaalsContact O-N 3.13Å; R737-R740 PolarHBondContact O-N 3.14Å; R737-G741 PolarHBondContact O-N 3.38Å; R737-L742 HydrophobicContact CG-CB 4.16Å; R737-L742 WeakPolarHBondContact CG-O 3.41Å; R737-L742 PolarHBondContact O-N 3.35Å; R737-M747 HydrophobicContact CB-CG 4.46Å; R737-M747 HydrophobicContact CG-CB 4.19Å; R737-M747 HydrophobicContact CG-CG 4.32Å
738	D	70.8	Confident	72.8	Confident	92 Å²	92	45.8 Å²	45.8	49%	0.492	26%	0.261	S	S	.	.	H	α-helix	trans	-68.2	-38.4	-173.4	-67.2	-4.4	0	0	0	112.1	I734 L735 R740 G741	I734-D738 WeakPolarHBondContact CG2-OD2 3.37Å; I734-D738 WeakPolarHBondContact O-CB 3.47Å; I734-D738 VanDerWaalsContact O-CG 3.28Å; I734-D738 PolarHBondContact O-N 2.89Å; L735-D738 PolarHBondContact O-N 3.39Å; D738-R740 PolarHBondContact O-N 2.83Å; D738-R740 VanDerWaalsContact O-N 3.16Å; D738-G741 PolarHBondContact O-N 2.89Å
739	S	64.9	Low	72.8	Confident	51 Å²	51	49.9 Å²	49.9	36%	0.357	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-17.8	179	72	0	0	0	0	113.5	L735 T736	L735-S739 VanDerWaalsContact O-CB 3.27Å; L735-S739 WeakPolarHBondContact O-CB 3.43Å; L735-S739 PolarHBondContact O-N 2.87Å; L735-S739 PolarHBondContact O-OG 3.33Å; T736-S739 PolarHBondContact O-OG 2.74Å
740	R	65	Low	72.8	Confident	17 Å²	17	46.9 Å²	46.9	6%	0.064	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	4.4	-175.8	-58.2	-164.6	-160.8	-174	4.2	114	T736 R737 D738 L742 L827 N828 T831 V835	T736-R740 WeakPolarHBondContact O-CG 3.29Å; R737-R740 PolarHBondContact O-N 3.14Å; D738-R740 PolarHBondContact O-N 2.83Å; D738-R740 VanDerWaalsContact O-N 3.16Å; R740-L742 HydrophobicContact CB-CD1 4.49Å; R740-L742 HydrophobicContact CB-CG 4.18Å; R740-L742 PolarHBondContact O-N 2.97Å; R740-L827 PolarHBondContact NH1-O 2.61Å; R740-N828 PolarHBondContact NH1-OD1 2.98Å; R740-N828 PolarHBondContact NH2-OD1 2.94Å; R740-T831 WeakPolarHBondContact CD-OG1 3.48Å; R740-T831 PolarHBondContact NH1-OG1 2.89Å; R740-V835 HydrophobicContact CB-CG2 4.43Å; R740-V835 HydrophobicContact CG-CG2 4.36Å
741	G	63.6	Low	72.5	Confident	66 Å²	66	49.8 Å²	49.8	68%	0.68	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	21.6	-178.9	0	0	0	0	0	113.8	R737 D738	R737-G741 PolarHBondContact O-N 3.38Å; D738-G741 PolarHBondContact O-N 2.89Å
742	L	67.2	Low	72.5	Confident	15 Å²	15	51.1 Å²	51.1	8%	0.079	29%	0.29	C	S	.	.			trans	-75.7	133.5	178.6	-71.5	177.2	0	0	0	110.4	R737 R740 Q746 M747 L750 L827 T831	R737-L742 HydrophobicContact CG-CB 4.16Å; R737-L742 WeakPolarHBondContact CG-O 3.41Å; R737-L742 PolarHBondContact O-N 3.35Å; R740-L742 HydrophobicContact CB-CD1 4.49Å; R740-L742 HydrophobicContact CB-CG 4.18Å; R740-L742 PolarHBondContact O-N 2.97Å; L742-Q746 HydrophobicContact CD2-CB 4.12Å; L742-M747 HydrophobicContact CD1-SD 4.09Å; L742-L750 HydrophobicContact CD1-CD1 4.3Å; L742-L827 HydrophobicContact CD1-CD1 3.88Å; L742-L827 HydrophobicContact CD1-CG 4.5Å; L742-T831 HydrophobicContact CD1-CG2 3.68Å; L742-T831 HydrophobicContact CD2-CG2 3.94Å; L742-T831 HydrophobicContact CG-CG2 4.03Å
743	T	70.6	Confident	72.9	Confident	72 Å²	72	51.9 Å²	51.9	44%	0.442	30%	0.296	S	S	.	.			trans	-67.2	156.4	167.9	70	0	0	0	0	110	E745 Q746 M747	T743-E745 PolarHBondContact O-N 3.45Å; T743-Q746 PolarHBondContact O-N 3.09Å; T743-Q746 VanDerWaalsContact OG1-CG 3.29Å; T743-Q746 WeakPolarHBondContact OG1-CG 3.26Å; T743-Q746 PolarHBondContact OG1-N 3.39Å; T743-M747 PolarHBondContact O-N 3.04Å
744	A	67	Low	73.3	Confident	57 Å²	57	50.8 Å²	50.8	47%	0.471	29%	0.291	S	S	.	.	H	α-helix	trans	-56.7	-35.7	175.8	0	0	0	0	0	111.9	N748	A744-N748 WeakPolarHBondContact O-CB 3.49Å; A744-N748 PolarHBondContact O-N 3.02Å
745	E	71.3	Confident	73.5	Confident	151 Å²	151	55.2 Å²	55.2	71%	0.706	31%	0.309	S	S	*	.	H	α-helix	trans	-65.1	-50.4	175.8	-67.2	179.1	169.8	0	0	111.6	T743 M747 N748 D749	T743-E745 PolarHBondContact O-N 3.45Å; E745-M747 VanDerWaalsContact C-N 3.29Å; E745-M747 PolarHBondContact O-N 3.28Å; E745-N748 PolarHBondContact O-N 3.45Å; E745-D749 PolarHBondContact O-N 3.48Å
746	Q	74.8	Confident	74	Confident	81 Å²	81	59.6 Å²	59.6	38%	0.379	33%	0.329	S	S	.	.	H	α-helix	trans	-58.2	-41.4	177.8	-73.8	172	-30	0	0	112.3	L742 T743 N748 D749 L750	L742-Q746 HydrophobicContact CD2-CB 4.12Å; T743-Q746 PolarHBondContact O-N 3.09Å; T743-Q746 VanDerWaalsContact OG1-CG 3.29Å; T743-Q746 WeakPolarHBondContact OG1-CG 3.26Å; T743-Q746 PolarHBondContact OG1-N 3.39Å; Q746-N748 VanDerWaalsContact C-N 3.34Å; Q746-D749 PolarHBondContact O-N 2.97Å; Q746-L750 WeakPolarHBondContact O-CB 3.43Å; Q746-L750 VanDerWaalsContact O-CG 3.31Å; Q746-L750 WeakPolarHBondContact O-CG 3.29Å; Q746-L750 PolarHBondContact O-N 2.81Å
747	M	73.6	Confident	74.9	Confident	6 Å²	6	60.9 Å²	60.9	3%	0.03	33%	0.334	C	S	.	.	H	α-helix	trans	-65.5	-38.9	177.3	-173.4	61.7	170.6	0	0	111.8	R737 L742 T743 E745 R751 F823 L827	R737-M747 HydrophobicContact CB-CG 4.46Å; R737-M747 HydrophobicContact CG-CB 4.19Å; R737-M747 HydrophobicContact CG-CG 4.32Å; L742-M747 HydrophobicContact CD1-SD 4.09Å; T743-M747 PolarHBondContact O-N 3.04Å; E745-M747 VanDerWaalsContact C-N 3.29Å; E745-M747 PolarHBondContact O-N 3.28Å; M747-R751 WeakPolarHBondContact O-CG 3.5Å; M747-R751 PolarHBondContact O-N 3.08Å; M747-F823 HydrophobicContact CE-CE1 3.56Å; M747-F823 HydrophobicContact CE-CZ 4.02Å; M747-F823 HydrophobicContact SD-CE1 4.38Å; M747-F823 HydrophobicContact SD-CZ 4.27Å; M747-L827 HydrophobicContact CE-CD1 4.5Å; M747-L827 HydrophobicContact CE-CD2 3.93Å; M747-L827 HydrophobicContact SD-CD1 3.78Å; M747-L827 HydrophobicContact SD-CD2 4.08Å
748	N	74	Confident	75.5	Confident	62 Å²	62	60.2 Å²	60.2	33%	0.332	33%	0.332	S	S	.	.	H	α-helix	trans	-70.5	-37.3	178.1	-157.4	24.4	0	0	0	111.9	S659 A744 E745 Q746 R751 T752	S659-N748 PolarHBondContact O-OD1 3.35Å; A744-N748 WeakPolarHBondContact O-CB 3.49Å; A744-N748 PolarHBondContact O-N 3.02Å; E745-N748 PolarHBondContact O-N 3.45Å; Q746-N748 VanDerWaalsContact C-N 3.34Å; N748-R751 PolarHBondContact O-N 2.95Å; N748-T752 VanDerWaalsContact O-CB 3.31Å; N748-T752 WeakPolarHBondContact O-CB 3.49Å; N748-T752 PolarHBondContact O-N 2.83Å; N748-T752 PolarHBondContact O-OG1 3.43Å
749	D	78.7	Confident	75.8	Confident	100 Å²	100	63.8 Å²	63.8	54%	0.535	34%	0.343	S	S	.	.	H	α-helix	trans	-62.8	-47.5	174.7	-70.3	-18.1	0	0	0	110.9	E745 Q746 R751 T752 C753	E745-D749 PolarHBondContact O-N 3.48Å; Q746-D749 PolarHBondContact O-N 2.97Å; D749-R751 VanDerWaalsContact C-N 3.34Å; D749-R751 PolarHBondContact O-N 3.02Å; D749-T752 PolarHBondContact O-N 3.05Å; D749-C753 WeakPolarHBondContact O-CB 3.33Å; D749-C753 PolarHBondContact O-N 3.22Å; D749-C753 PolarHBondContact O-SG 2.98Å; D749-C753 VanDerWaalsContact O-SG 3.4Å
750	L	79.7	Confident	76.4	Confident	21 Å²	21	66.8 Å²	66.8	11%	0.11	36%	0.355	C	S	.	.	H	α-helix	trans	-61.8	-40.2	176.6	-71.8	174.8	0	0	0	112.2	L742 Q746 F754 F826 L827 M830	L742-L750 HydrophobicContact CD1-CD1 4.3Å; Q746-L750 WeakPolarHBondContact O-CB 3.43Å; Q746-L750 VanDerWaalsContact O-CG 3.31Å; Q746-L750 WeakPolarHBondContact O-CG 3.29Å; Q746-L750 PolarHBondContact O-N 2.81Å; L750-F754 WeakPolarHBondContact O-CB 3.49Å; L750-F754 PolarHBondContact O-N 2.81Å; L750-F826 HydrophobicContact CB-CE1 4.11Å; L750-F826 HydrophobicContact CD2-CE1 4.04Å; L750-F826 HydrophobicContact CD2-CZ 4.02Å; L750-L827 HydrophobicContact CB-CD1 4.45Å; L750-L827 HydrophobicContact CD1-CD1 3.65Å; L750-M830 HydrophobicContact CD1-CB 4.42Å; L750-M830 HydrophobicContact CD2-CB 4.13Å; L750-M830 HydrophobicContact CD2-CE 4.03Å; L750-M830 HydrophobicContact CD2-CG 4.03Å
751	R	78.7	Confident	76.7	Confident	66 Å²	66	71.7 Å²	71.7	25%	0.249	38%	0.383	C	S	.	.	H	α-helix	trans	-63.5	-44.5	172.5	-80.6	-173.4	-169.6	-138	3.5	112.4	Q733 M747 N748 D749 C753 F754 K755 F823	Q733-R751 VanDerWaalsContact CG-NH2 3.33Å; Q733-R751 VanDerWaalsContact OE1-CZ 3.23Å; M747-R751 WeakPolarHBondContact O-CG 3.5Å; M747-R751 PolarHBondContact O-N 3.08Å; N748-R751 PolarHBondContact O-N 2.95Å; D749-R751 VanDerWaalsContact C-N 3.34Å; D749-R751 PolarHBondContact O-N 3.02Å; R751-C753 VanDerWaalsContact C-N 3.33Å; R751-F754 PolarHBondContact O-N 3.04Å; R751-K755 WeakPolarHBondContact O-CB 3.38Å; R751-K755 PolarHBondContact O-N 3.32Å; R751-F823 HydrophobicContact CB-CE2 4.34Å; R751-F823 HydrophobicContact CB-CZ 4.28Å; R751-F823 HydrophobicContact CG-CE1 3.86Å; R751-F823 HydrophobicContact CG-CE2 3.71Å; R751-F823 HydrophobicContact CG-CZ 3.27Å
752	T	80.9	Confident	77.4	Confident	81 Å²	81	72.3 Å²	72.3	50%	0.497	37%	0.373	S	S	.	.	H	α-helix	trans	-63	-43.9	-179.5	-59.9	0	0	0	0	110.2	N748 D749 H756	N748-T752 VanDerWaalsContact O-CB 3.31Å; N748-T752 WeakPolarHBondContact O-CB 3.49Å; N748-T752 PolarHBondContact O-N 2.83Å; N748-T752 PolarHBondContact O-OG1 3.43Å; D749-T752 PolarHBondContact O-N 3.05Å; T752-H756 WeakPolarHBondContact O-CB 3.33Å; T752-H756 PolarHBondContact O-N 2.96Å
753	C	82.5	Confident	77.9	Confident	35 Å²	35	73.5 Å²	73.5	24%	0.236	39%	0.389	C	S	.	.	H	α-helix	trans	-59.3	-51.8	171.8	-73.3	0	0	0	0	111.4	D749 R751 K755 H756 F757 L777	D749-C753 WeakPolarHBondContact O-CB 3.33Å; D749-C753 PolarHBondContact O-N 3.22Å; D749-C753 PolarHBondContact O-SG 2.98Å; D749-C753 VanDerWaalsContact O-SG 3.4Å; R751-C753 VanDerWaalsContact C-N 3.33Å; C753-K755 PolarHBondContact O-N 2.98Å; C753-H756 WeakPolarHBondContact O-CB 3.1Å; C753-H756 PolarHBondContact O-N 2.83Å; C753-F757 WeakPolarHBondContact O-CD2 3.48Å; C753-F757 PolarHBondContact O-N 3.47Å; C753-L777 HydrophobicContact CB-CD2 4.42Å
754	F	84.4	Confident	78.5	Confident	10 Å²	10	75.6 Å²	75.6	4%	0.044	39%	0.389	C	S	.	.	H	α-helix	trans	-57.6	-48.4	179.9	-173.5	-86.8	0	0	0	112.2	L750 R751 H756 F757 D758 L765 F823 F826	L750-F754 WeakPolarHBondContact O-CB 3.49Å; L750-F754 PolarHBondContact O-N 2.81Å; R751-F754 PolarHBondContact O-N 3.04Å; F754-H756 VanDerWaalsContact C-N 3.3Å; F754-H756 PolarHBondContact O-N 2.81Å; F754-F757 PolarHBondContact O-N 2.73Å; F754-F757 VanDerWaalsContact O-N 3.12Å; F754-D758 HydrophobicContact CE1-CB 4.47Å; F754-D758 PolarHBondContact O-N 2.58Å; F754-L765 HydrophobicContact CD2-CD1 3.41Å; F754-L765 VanDerWaalsContact CD2-CD1 3.41Å; F754-L765 HydrophobicContact CD2-CG 3.87Å; F754-L765 HydrophobicContact CE1-CG 4.25Å; F754-L765 HydrophobicContact CE2-CB 4.35Å; F754-L765 HydrophobicContact CE2-CD1 3.46Å; F754-L765 VanDerWaalsContact CE2-CD1 3.46Å; F754-L765 HydrophobicContact CE2-CG 3.49Å; F754-L765 VanDerWaalsContact CE2-CG 3.49Å; F754-L765 HydrophobicContact CG-CD1 4.12Å; F754-L765 HydrophobicContact CG-CG 4.41Å; F754-L765 HydrophobicContact CZ-CD1 4.19Å; F754-L765 HydrophobicContact CZ-CG 3.71Å; F754-F823 HydrophobicContact CB-CD2 3.7Å; F754-F823 HydrophobicContact CB-CE2 3.93Å; F754-F823 HydrophobicContact CD1-CB 4.36Å; F754-F823 AromaticContact CD1-CD2 3.95Å; F754-F823 HydrophobicContact CD1-CD2 3.95Å; F754-F823 HydrophobicContact CD2-CB 4.43Å; F754-F823 AromaticContact CD2-CD2 3.76Å; F754-F823 HydrophobicContact CD2-CD2 3.76Å; F754-F823 HydrophobicContact CE1-CB 4.11Å; F754-F823 HydrophobicContact CE2-CB 4.16Å; F754-F823 HydrophobicContact CE2-CD2 4.32Å; F754-F823 AromaticContact CG-CD2 3.54Å; F754-F823 HydrophobicContact CG-CD2 3.54Å; F754-F823 HydrophobicContact CG-CE2 4.28Å; F754-F823 HydrophobicContact CG-CG 4.5Å; F754-F823 HydrophobicContact CZ-CB 3.99Å; F754-F826 HydrophobicContact CB-CD1 4.29Å; F754-F826 HydrophobicContact CB-CE1 4.21Å; F754-F826 HydrophobicContact CD2-CB 3.83Å; F754-F826 AromaticContact CD2-CD1 3.74Å; F754-F826 HydrophobicContact CD2-CD1 3.74Å; F754-F826 HydrophobicContact CD2-CD2 4.37Å; F754-F826 HydrophobicContact CD2-CE1 4.4Å; F754-F826 AromaticContact CD2-CG 3.72Å; F754-F826 HydrophobicContact CD2-CG 3.72Å; F754-F826 HydrophobicContact CE2-CB 3.88Å; F754-F826 HydrophobicContact CE2-CG 4.29Å; F754-F826 HydrophobicContact CG-CD1 4.45Å
755	K	82.8	Confident	79.4	Confident	113 Å²	113	73 Å²	73	49%	0.491	37%	0.367	S	S	.	.	H	α-helix	trans	-65.5	-31.5	-179.7	-169.5	175	-178.6	176.4	0	112.8	R751 C753 F757 D758	R751-K755 WeakPolarHBondContact O-CB 3.38Å; R751-K755 PolarHBondContact O-N 3.32Å; C753-K755 PolarHBondContact O-N 2.98Å; K755-F757 PolarHBondContact O-N 3.38Å; K755-D758 PolarHBondContact O-N 2.83Å
756	H	84.3	Confident	80.1	Confident	133 Å²	133	70.9 Å²	70.9	62%	0.616	36%	0.358	S	S	*	.	H	α-helix	trans	-61.5	-32.6	174.7	177.2	-84.9	0	0	0	112.2	T752 C753 F754	T752-H756 WeakPolarHBondContact O-CB 3.33Å; T752-H756 PolarHBondContact O-N 2.96Å; C753-H756 WeakPolarHBondContact O-CB 3.1Å; C753-H756 PolarHBondContact O-N 2.83Å; F754-H756 VanDerWaalsContact C-N 3.3Å; F754-H756 PolarHBondContact O-N 2.81Å
757	F	85.9	Confident	80.5	Confident	29 Å²	29	69.1 Å²	69.1	13%	0.127	35%	0.353	C	S	.	.	H	α-helix	trans	-92.5	-22.7	179.1	-69.2	-80	0	0	0	114	C753 F754 K755 K759 L765 E769 A772 C773 S776	C753-F757 WeakPolarHBondContact O-CD2 3.48Å; C753-F757 PolarHBondContact O-N 3.47Å; F754-F757 PolarHBondContact O-N 2.73Å; F754-F757 VanDerWaalsContact O-N 3.12Å; K755-F757 PolarHBondContact O-N 3.38Å; F757-K759 PolarHBondContact O-N 3.23Å; F757-L765 VanDerWaalsContact C-CD2 3.45Å; F757-L765 HydrophobicContact CB-CD2 3.67Å; F757-E769 HydrophobicContact CB-CB 4.46Å; F757-A772 HydrophobicContact CD1-CB 3.76Å; F757-A772 HydrophobicContact CE1-CB 3.57Å; F757-C773 HydrophobicContact CB-CB 4.27Å; F757-C773 HydrophobicContact CD1-CB 4.46Å; F757-C773 HydrophobicContact CD2-CB 3.49Å; F757-C773 VanDerWaalsContact CD2-CB 3.49Å; F757-C773 VanDerWaalsContact CE2-CA 3.48Å; F757-C773 HydrophobicContact CE2-CB 3.97Å; F757-C773 HydrophobicContact CG-CB 3.81Å; F757-S776 VanDerWaalsContact CE2-OG 3.24Å; F757-S776 WeakPolarHBondContact CE2-OG 3.32Å; F757-S776 WeakPolarHBondContact CZ-OG 3.49Å
758	D	84.9	Confident	81	Confident	7 Å²	7	74.8 Å²	74.8	4%	0.037	38%	0.383	C	S	.	.			trans	-78.3	70.9	172.4	-179.6	18	0	0	0	111	F754 K755 N760 N761 T762 G763 L765	F754-D758 HydrophobicContact CE1-CB 4.47Å; F754-D758 PolarHBondContact O-N 2.58Å; K755-D758 PolarHBondContact O-N 2.83Å; D758-N760 PolarHBondContact O-N 2.95Å; D758-N761 PolarHBondContact O-N 3.5Å; D758-N761 PolarHBondContact OD1-N 3.4Å; D758-N761 VanDerWaalsContact OD1-N 3.12Å; D758-N761 WeakPolarHBondContact OD2-CA 3.46Å; D758-T762 VanDerWaalsContact CG-N 3.34Å; D758-T762 PolarHBondContact OD1-N 3.33Å; D758-T762 PolarHBondContact OD1-OG1 3.04Å; D758-T762 VanDerWaalsContact OD1-OG1 3.07Å; D758-T762 PolarHBondContact OD2-N 3.39Å; D758-G763 WeakPolarHBondContact OD2-CA 3.44Å; D758-G763 PolarHBondContact OD2-N 2.82Å; D758-L765 HydrophobicContact CB-CD2 3.9Å; D758-L765 VanDerWaalsContact N-CD2 3.35Å
759	K	77.1	Confident	81.7	Confident	167 Å²	167	73.4 Å²	73.4	73%	0.726	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.9	-176.2	-67.8	-178.1	-178.9	176.9	0	113.4	F757	F757-K759 PolarHBondContact O-N 3.23Å
760	N	76.9	Confident	82.1	Confident	114 Å²	114	68.6 Å²	68.6	61%	0.61	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-1.1	-176.9	-61.2	-20.8	0	0	0	112.6	D758 T762	D758-N760 PolarHBondContact O-N 2.95Å; N760-T762 HydrophobicContact CB-CG2 3.67Å; N760-T762 PolarHBondContact O-N 2.91Å
761	N	72.9	Confident	82.3	Confident	120 Å²	120	70.8 Å²	70.8	64%	0.642	36%	0.358	S	S	*	.			trans	49.7	41	-174.9	-69.3	-50.8	0	0	0	112.8	D758 G763	D758-N761 PolarHBondContact O-N 3.5Å; D758-N761 PolarHBondContact OD1-N 3.4Å; D758-N761 VanDerWaalsContact OD1-N 3.12Å; D758-N761 WeakPolarHBondContact OD2-CA 3.46Å; N761-G763 VanDerWaalsContact C-N 3.33Å
762	T	77.7	Confident	82.6	Confident	78 Å²	78	69.6 Å²	69.6	48%	0.479	36%	0.362	S	S	.	.	S	Bend	trans	-85.2	-10.3	-179.4	61	0	0	0	0	112.9	D758 N760 R764	D758-T762 VanDerWaalsContact CG-N 3.34Å; D758-T762 PolarHBondContact OD1-N 3.33Å; D758-T762 PolarHBondContact OD1-OG1 3.04Å; D758-T762 VanDerWaalsContact OD1-OG1 3.07Å; D758-T762 PolarHBondContact OD2-N 3.39Å; N760-T762 HydrophobicContact CB-CG2 3.67Å; N760-T762 PolarHBondContact O-N 2.91Å; T762-R764 PolarHBondContact OG1-N 3.31Å; T762-R764 PolarHBondContact OG1-O 3.47Å; T762-R764 VanDerWaalsContact OG1-O 3.13Å
763	G	77.1	Confident	82.8	Confident	41 Å²	41	65.8 Å²	65.8	42%	0.423	34%	0.339	S	S	.	.	S	Bend	trans	73.2	15.7	-169.5	0	0	0	0	0	113	D758 N761	D758-G763 WeakPolarHBondContact OD2-CA 3.44Å; D758-G763 PolarHBondContact OD2-N 2.82Å; N761-G763 VanDerWaalsContact C-N 3.33Å
764	R	83.7	Confident	82.9	Confident	116 Å²	116	64.1 Å²	64.1	44%	0.438	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	145.2	-171.2	-58.1	174.1	-175.1	-157.4	1.1	109.5	T762 Y820 I821	T762-R764 PolarHBondContact OG1-N 3.31Å; T762-R764 PolarHBondContact OG1-O 3.47Å; T762-R764 VanDerWaalsContact OG1-O 3.13Å; R764-Y820 HydrophobicContact CB-CD2 4.18Å; R764-Y820 HydrophobicContact CB-CG 4.49Å; R764-Y820 HydrophobicContact CG-CD2 3.85Å; R764-Y820 HydrophobicContact CG-CE2 4.37Å; R764-Y820 HydrophobicContact CG-CG 4.47Å; R764-Y820 PolarHBondContact NH1-OH 2.87Å; R764-I821 WeakPolarHBondContact CA-O 3.27Å
765	L	85.3	Confident	82.8	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.005	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	130.1	171.7	-65	177.4	0	0	0	110.2	F754 F757 D758 E769 F770 C773 I821	F754-L765 HydrophobicContact CD2-CD1 3.41Å; F754-L765 VanDerWaalsContact CD2-CD1 3.41Å; F754-L765 HydrophobicContact CD2-CG 3.87Å; F754-L765 HydrophobicContact CE1-CG 4.25Å; F754-L765 HydrophobicContact CE2-CB 4.35Å; F754-L765 HydrophobicContact CE2-CD1 3.46Å; F754-L765 VanDerWaalsContact CE2-CD1 3.46Å; F754-L765 HydrophobicContact CE2-CG 3.49Å; F754-L765 VanDerWaalsContact CE2-CG 3.49Å; F754-L765 HydrophobicContact CG-CD1 4.12Å; F754-L765 HydrophobicContact CG-CG 4.41Å; F754-L765 HydrophobicContact CZ-CD1 4.19Å; F754-L765 HydrophobicContact CZ-CG 3.71Å; F757-L765 VanDerWaalsContact C-CD2 3.45Å; F757-L765 HydrophobicContact CB-CD2 3.67Å; D758-L765 HydrophobicContact CB-CD2 3.9Å; D758-L765 VanDerWaalsContact N-CD2 3.35Å; L765-E769 HydrophobicContact CB-CB 4.24Å; L765-E769 HydrophobicContact CD2-CB 3.94Å; L765-F770 HydrophobicContact CB-CB 4.16Å; L765-F770 HydrophobicContact CD1-CB 4.47Å; L765-F770 HydrophobicContact CD1-CD2 4.42Å; L765-C773 HydrophobicContact CD1-CB 4.34Å; L765-I821 PolarHBondContact N-O 2.91Å; L765-I821 PolarHBondContact O-N 3.33Å
766	E	85.5	Confident	82.7	Confident	108 Å²	108	65.1 Å²	65.1	51%	0.505	35%	0.347	S	S	.	.			trans	-67.8	157.4	165.4	-67.8	-173.6	176.4	0	0	110.3	N768 E769 F770	E766-N768 PolarHBondContact O-N 2.77Å; E766-E769 HydrophobicContact CB-CG 4.3Å; E766-E769 PolarHBondContact N-OE2 2.99Å; E766-E769 WeakPolarHBondContact O-CB 3.48Å; E766-E769 PolarHBondContact O-N 3.33Å; E766-F770 PolarHBondContact O-N 3.04Å
767	P	84.2	Confident	82.3	Confident	43 Å²	43	61.7 Å²	61.7	28%	0.279	33%	0.333	S	S	.	.	H	α-helix	trans	-53.2	-35.6	-178.3	-28.8	35.4	0	0	0	113.8	K771 F806 G819	P767-K771 WeakPolarHBondContact O-CB 3.49Å; P767-K771 PolarHBondContact O-N 3.12Å; P767-F806 WeakPolarHBondContact O-CZ 3.15Å; P767-G819 WeakPolarHBondContact CD-O 3.39Å
768	N	83.8	Confident	81.7	Confident	125 Å²	125	62.8 Å²	62.8	67%	0.668	35%	0.353	S	S	*	.	H	α-helix	trans	-71.5	-37.3	176.9	-69	-32.4	0	0	0	112.9	E766 K771 A772	E766-N768 PolarHBondContact O-N 2.77Å; N768-K771 PolarHBondContact O-N 3.32Å; N768-A772 PolarHBondContact O-N 2.75Å
769	E	88.8	Confident	81.2	Confident	33 Å²	33	66 Å²	66	15%	0.154	36%	0.364	C	S	.	.	H	α-helix	trans	-69.2	-40.8	176.3	-62.6	176.7	141.3	0	0	110.6	F757 L765 E766 A772 C773	F757-E769 HydrophobicContact CB-CB 4.46Å; L765-E769 HydrophobicContact CB-CB 4.24Å; L765-E769 HydrophobicContact CD2-CB 3.94Å; E766-E769 HydrophobicContact CB-CG 4.3Å; E766-E769 PolarHBondContact N-OE2 2.99Å; E766-E769 WeakPolarHBondContact O-CB 3.48Å; E766-E769 PolarHBondContact O-N 3.33Å; E769-A772 PolarHBondContact O-N 2.61Å; E769-C773 WeakPolarHBondContact O-CB 3.36Å; E769-C773 PolarHBondContact O-N 3Å
770	F	86.9	Confident	80.5	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-63.5	-41.2	173.1	178.4	-108.3	0	0	0	112.1	L765 E766 A772 C773 L774 F806 I809 V810 V813 I821 F826 F829	L765-F770 HydrophobicContact CB-CB 4.16Å; L765-F770 HydrophobicContact CD1-CB 4.47Å; L765-F770 HydrophobicContact CD1-CD2 4.42Å; E766-F770 PolarHBondContact O-N 3.04Å; F770-A772 VanDerWaalsContact C-N 3.32Å; F770-A772 PolarHBondContact O-N 2.97Å; F770-C773 WeakPolarHBondContact O-CB 3.42Å; F770-C773 PolarHBondContact O-N 2.79Å; F770-L774 HydrophobicContact CD1-CD1 4.05Å; F770-L774 HydrophobicContact CD1-CG 4.48Å; F770-L774 HydrophobicContact CE1-CD1 3.47Å; F770-L774 VanDerWaalsContact CE1-CD1 3.47Å; F770-L774 HydrophobicContact CE1-CG 4.19Å; F770-L774 HydrophobicContact CE2-CD1 4.32Å; F770-L774 HydrophobicContact CE2-CD2 4.33Å; F770-L774 HydrophobicContact CE2-CG 4.26Å; F770-L774 HydrophobicContact CZ-CD1 3.63Å; F770-L774 HydrophobicContact CZ-CD2 4.27Å; F770-L774 HydrophobicContact CZ-CG 4.07Å; F770-L774 WeakPolarHBondContact O-CG 3.31Å; F770-L774 PolarHBondContact O-N 2.94Å; F770-F806 AromaticContact CD1-CE2 3.81Å; F770-F806 HydrophobicContact CD1-CE2 3.81Å; F770-F806 AromaticContact CD1-CZ 3.97Å; F770-F806 HydrophobicContact CD1-CZ 3.97Å; F770-F806 HydrophobicContact CE1-CE2 4.2Å; F770-I809 HydrophobicContact CE1-CG2 3.89Å; F770-I809 HydrophobicContact CZ-CG2 4.22Å; F770-V810 HydrophobicContact CD1-CG2 4.48Å; F770-V813 HydrophobicContact CZ-CG1 4.33Å; F770-V813 HydrophobicContact CZ-CG2 4.12Å; F770-I821 HydrophobicContact CB-CD1 3.49Å; F770-I821 VanDerWaalsContact CB-CD1 3.49Å; F770-I821 HydrophobicContact CD1-CD1 3.27Å; F770-I821 HydrophobicContact CD2-CB 4.41Å; F770-I821 HydrophobicContact CD2-CD1 3.73Å; F770-I821 HydrophobicContact CD2-CG2 3.91Å; F770-I821 HydrophobicContact CE1-CD1 3.79Å; F770-I821 HydrophobicContact CE2-CD1 4.19Å; F770-I821 HydrophobicContact CE2-CG2 4.01Å; F770-I821 HydrophobicContact CG-CD1 3.22Å; F770-I821 HydrophobicContact CG-CG1 4.46Å; F770-I821 HydrophobicContact CZ-CD1 4.23Å; F770-F826 HydrophobicContact CD2-CD2 4.14Å; F770-F826 AromaticContact CE2-CD2 3.83Å; F770-F826 HydrophobicContact CE2-CD2 3.83Å; F770-F829 HydrophobicContact CZ-CD1 4.18Å; F770-F829 HydrophobicContact CZ-CG 4.42Å
771	K	84.7	Confident	80	Confident	66 Å²	66	61.2 Å²	61.2	29%	0.287	35%	0.346	S	S	.	.	H	α-helix	trans	-56.7	-47.5	172.3	-166.8	173.3	-179.6	174.4	0	111.2	P767 N768 C773 L774 V775 F781 F806	P767-K771 WeakPolarHBondContact O-CB 3.49Å; P767-K771 PolarHBondContact O-N 3.12Å; N768-K771 PolarHBondContact O-N 3.32Å; K771-C773 VanDerWaalsContact C-N 3.33Å; K771-C773 PolarHBondContact O-N 3.31Å; K771-L774 PolarHBondContact O-N 2.69Å; K771-V775 WeakPolarHBondContact O-CG2 3.24Å; K771-V775 PolarHBondContact O-N 3.02Å; K771-F781 HydrophobicContact CG-CD2 4.03Å; K771-F781 HydrophobicContact CG-CE2 3.92Å; K771-F806 HydrophobicContact CB-CD2 4.18Å; K771-F806 HydrophobicContact CB-CE1 3.97Å; K771-F806 HydrophobicContact CB-CE2 3.54Å; K771-F806 HydrophobicContact CB-CZ 3.44Å; K771-F806 VanDerWaalsContact CB-CZ 3.44Å; K771-F806 HydrophobicContact CD-CD1 4.01Å; K771-F806 HydrophobicContact CD-CD2 4.3Å; K771-F806 HydrophobicContact CD-CE1 4.14Å; K771-F806 HydrophobicContact CD-CE2 4.44Å; K771-F806 HydrophobicContact CD-CG 4.11Å; K771-F806 HydrophobicContact CD-CZ 4.38Å; K771-F806 HydrophobicContact CG-CD1 4.38Å; K771-F806 HydrophobicContact CG-CD2 3.87Å; K771-F806 HydrophobicContact CG-CE1 4.27Å; K771-F806 HydrophobicContact CG-CE2 3.77Å; K771-F806 HydrophobicContact CG-CG 4.2Å; K771-F806 HydrophobicContact CG-CZ 4Å
772	A	84.5	Confident	79	Confident	42 Å²	42	65.6 Å²	65.6	35%	0.347	35%	0.353	S	S	.	.	H	α-helix	trans	-64.5	-38.2	179.2	0	0	0	0	0	112.2	F757 N768 E769 F770 V775 S776	F757-A772 HydrophobicContact CD1-CB 3.76Å; F757-A772 HydrophobicContact CE1-CB 3.57Å; N768-A772 PolarHBondContact O-N 2.75Å; E769-A772 PolarHBondContact O-N 2.61Å; F770-A772 VanDerWaalsContact C-N 3.32Å; F770-A772 PolarHBondContact O-N 2.97Å; A772-V775 PolarHBondContact O-N 3.25Å; A772-S776 PolarHBondContact O-N 3.34Å
773	C	86	Confident	77.6	Confident	0 Å²	0	65 Å²	65	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-59.7	-50.1	173.7	-171.5	0	0	0	0	111.6	F757 L765 E769 F770 K771 V775 S776 L777	F757-C773 HydrophobicContact CB-CB 4.27Å; F757-C773 HydrophobicContact CD1-CB 4.46Å; F757-C773 HydrophobicContact CD2-CB 3.49Å; F757-C773 VanDerWaalsContact CD2-CB 3.49Å; F757-C773 VanDerWaalsContact CE2-CA 3.48Å; F757-C773 HydrophobicContact CE2-CB 3.97Å; F757-C773 HydrophobicContact CG-CB 3.81Å; L765-C773 HydrophobicContact CD1-CB 4.34Å; E769-C773 WeakPolarHBondContact O-CB 3.36Å; E769-C773 PolarHBondContact O-N 3Å; F770-C773 WeakPolarHBondContact O-CB 3.42Å; F770-C773 PolarHBondContact O-N 2.79Å; K771-C773 VanDerWaalsContact C-N 3.33Å; K771-C773 PolarHBondContact O-N 3.31Å; C773-V775 VanDerWaalsContact C-N 3.35Å; C773-V775 PolarHBondContact O-N 2.7Å; C773-S776 PolarHBondContact O-N 2.72Å; C773-S776 VanDerWaalsContact O-N 3.1Å; C773-S776 PolarHBondContact O-OG 3.34Å; C773-L777 WeakPolarHBondContact O-CG 3.22Å; C773-L777 PolarHBondContact O-N 3Å; C773-L777 VanDerWaalsContact O-N 3.1Å
774	L	83.5	Confident	75.9	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-62	-40.3	178.2	-69.2	-174.6	0	0	0	112.6	F770 K771 S776 L777 G778 Y779 F781 F806 I809 F829 M830	F770-L774 HydrophobicContact CD1-CD1 4.05Å; F770-L774 HydrophobicContact CD1-CG 4.48Å; F770-L774 HydrophobicContact CE1-CD1 3.47Å; F770-L774 VanDerWaalsContact CE1-CD1 3.47Å; F770-L774 HydrophobicContact CE1-CG 4.19Å; F770-L774 HydrophobicContact CE2-CD1 4.32Å; F770-L774 HydrophobicContact CE2-CD2 4.33Å; F770-L774 HydrophobicContact CE2-CG 4.26Å; F770-L774 HydrophobicContact CZ-CD1 3.63Å; F770-L774 HydrophobicContact CZ-CD2 4.27Å; F770-L774 HydrophobicContact CZ-CG 4.07Å; F770-L774 WeakPolarHBondContact O-CG 3.31Å; F770-L774 PolarHBondContact O-N 2.94Å; K771-L774 PolarHBondContact O-N 2.69Å; L774-S776 VanDerWaalsContact C-N 3.3Å; L774-S776 PolarHBondContact O-N 2.81Å; L774-L777 CarbonylContact O-C 3.16Å; L774-L777 PolarHBondContact O-N 3.18Å; L774-G778 PolarHBondContact O-N 3.17Å; L774-Y779 HydrophobicContact CB-CD2 4.17Å; L774-Y779 HydrophobicContact CB-CG 4.23Å; L774-Y779 HydrophobicContact CD2-CD2 3.96Å; L774-Y779 HydrophobicContact CD2-CE2 4.07Å; L774-Y779 HydrophobicContact CD2-CG 4.48Å; L774-Y779 WeakPolarHBondContact O-CB 3.33Å; L774-Y779 WeakPolarHBondContact O-CD2 3.48Å; L774-Y779 PolarHBondContact O-N 3.37Å; L774-F781 HydrophobicContact CB-CE2 3.97Å; L774-F781 HydrophobicContact CB-CZ 3.72Å; L774-F781 HydrophobicContact CD1-CZ 3.71Å; L774-F781 HydrophobicContact CG-CZ 4.39Å; L774-F806 HydrophobicContact CD1-CE2 4.37Å; L774-I809 HydrophobicContact CD1-CG2 4.11Å; L774-F829 HydrophobicContact CD1-CE1 3.88Å; L774-F829 HydrophobicContact CD1-CZ 4.38Å; L774-F829 HydrophobicContact CD2-CD1 3.87Å; L774-F829 HydrophobicContact CD2-CE1 3.54Å; L774-F829 HydrophobicContact CG-CE1 4.39Å; L774-M830 HydrophobicContact CD2-SD 3.96Å
775	V	82.5	Confident	74	Confident	75 Å²	75	71.1 Å²	71.1	46%	0.455	38%	0.377	S	S	.	.	H	α-helix	trans	-60.9	-40.8	174.4	173	0	0	0	0	111.2	K771 A772 C773 L777 G778 F781	K771-V775 WeakPolarHBondContact O-CG2 3.24Å; K771-V775 PolarHBondContact O-N 3.02Å; A772-V775 PolarHBondContact O-N 3.25Å; C773-V775 VanDerWaalsContact C-N 3.35Å; C773-V775 PolarHBondContact O-N 2.7Å; V775-L777 VanDerWaalsContact C-N 3.25Å; V775-L777 PolarHBondContact O-N 3.21Å; V775-G778 PolarHBondContact O-N 3.49Å; V775-G778 VanDerWaalsContact O-N 3.1Å; V775-F781 HydrophobicContact CG2-CD2 3.88Å; V775-F781 HydrophobicContact CG2-CE2 3.85Å
776	S	80.5	Confident	72	Confident	70 Å²	70	80.6 Å²	80.6	49%	0.49	42%	0.418	S	S	.	.	H	α-helix	trans	-66.7	-26.8	177.8	76.3	0	0	0	0	113.9	F757 A772 C773 L774 G778	F757-S776 VanDerWaalsContact CE2-OG 3.24Å; F757-S776 WeakPolarHBondContact CE2-OG 3.32Å; F757-S776 WeakPolarHBondContact CZ-OG 3.49Å; A772-S776 PolarHBondContact O-N 3.34Å; C773-S776 PolarHBondContact O-N 2.72Å; C773-S776 VanDerWaalsContact O-N 3.1Å; C773-S776 PolarHBondContact O-OG 3.34Å; L774-S776 VanDerWaalsContact C-N 3.3Å; L774-S776 PolarHBondContact O-N 2.81Å; S776-G778 VanDerWaalsContact C-N 3.3Å
777	L	76.7	Confident	69.8	Low	60 Å²	60	83.4 Å²	83.4	31%	0.314	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	1.8	175.7	-66.9	165.2	0	0	0	112.7	C753 C773 L774 V775 Y779 F826 M830	C753-L777 HydrophobicContact CB-CD2 4.42Å; C773-L777 WeakPolarHBondContact O-CG 3.22Å; C773-L777 PolarHBondContact O-N 3Å; C773-L777 VanDerWaalsContact O-N 3.1Å; L774-L777 CarbonylContact O-C 3.16Å; L774-L777 PolarHBondContact O-N 3.18Å; V775-L777 VanDerWaalsContact C-N 3.25Å; V775-L777 PolarHBondContact O-N 3.21Å; L777-Y779 HydrophobicContact CB-CD2 4.37Å; L777-F826 HydrophobicContact CD1-CE2 3.94Å; L777-F826 HydrophobicContact CD1-CZ 3.84Å; L777-M830 HydrophobicContact CB-CE 4.45Å; L777-M830 HydrophobicContact CD1-CE 3.74Å; L777-M830 HydrophobicContact CD1-SD 3.88Å; L777-M830 HydrophobicContact CG-CE 4.49Å
778	G	72.2	Confident	67.6	Low	53 Å²	53	85.5 Å²	85.5	55%	0.546	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.5	6	174.1	0	0	0	0	0	116	L774 V775 S776 N780	L774-G778 PolarHBondContact O-N 3.17Å; V775-G778 PolarHBondContact O-N 3.49Å; V775-G778 VanDerWaalsContact O-N 3.1Å; S776-G778 VanDerWaalsContact C-N 3.3Å; G778-N780 PolarHBondContact O-N 3.34Å
779	Y	74	Confident	65.2	Low	73 Å²	73	87.1 Å²	87.1	29%	0.286	46%	0.461	S	S	.	.			trans	-75.7	120.7	175	-70.7	-99.3	0	0	0	111	L774 L777 F829 M830	L774-Y779 HydrophobicContact CB-CD2 4.17Å; L774-Y779 HydrophobicContact CB-CG 4.23Å; L774-Y779 HydrophobicContact CD2-CD2 3.96Å; L774-Y779 HydrophobicContact CD2-CE2 4.07Å; L774-Y779 HydrophobicContact CD2-CG 4.48Å; L774-Y779 WeakPolarHBondContact O-CB 3.33Å; L774-Y779 WeakPolarHBondContact O-CD2 3.48Å; L774-Y779 PolarHBondContact O-N 3.37Å; L777-Y779 HydrophobicContact CB-CD2 4.37Å; Y779-F829 HydrophobicContact CE1-CE1 4.02Å; Y779-F829 HydrophobicContact CE1-CZ 4.07Å; Y779-F829 HydrophobicContact CE2-CE1 4.45Å; Y779-F829 AromaticContact CZ-CE1 3.91Å; Y779-M830 HydrophobicContact CE2-CE 4.18Å; Y779-M830 HydrophobicContact CE2-SD 4.08Å
780	N	63.5	Low	62.5	Low	151 Å²	151	90.9 Å²	90.9	81%	0.807	49%	0.488	S	S	*	.			trans	-99.5	110.6	177.8	-74.8	-38.7	0	0	0	111.2	G778	G778-N780 PolarHBondContact O-N 3.34Å
781	F	65.4	Low	60	Low	31 Å²	31	98 Å²	98	14%	0.136	53%	0.526	C	S	.	.			trans	-87.5	124.6	172.7	-52.7	-68.3	0	0	0	109.9	K771 L774 V775 D783 F806 I809	K771-F781 HydrophobicContact CG-CD2 4.03Å; K771-F781 HydrophobicContact CG-CE2 3.92Å; L774-F781 HydrophobicContact CB-CE2 3.97Å; L774-F781 HydrophobicContact CB-CZ 3.72Å; L774-F781 HydrophobicContact CD1-CZ 3.71Å; L774-F781 HydrophobicContact CG-CZ 4.39Å; V775-F781 HydrophobicContact CG2-CD2 3.88Å; V775-F781 HydrophobicContact CG2-CE2 3.85Å; F781-D783 PolarHBondContact O-N 3.34Å; F781-F806 HydrophobicContact CD1-CB 3.85Å; F781-F806 HydrophobicContact CD1-CD2 4.22Å; F781-F806 HydrophobicContact CD2-CD2 4.47Å; F781-F806 HydrophobicContact CE1-CB 4.17Å; F781-F806 AromaticContact CE1-CD2 3.77Å; F781-F806 HydrophobicContact CE1-CD2 3.77Å; F781-F806 HydrophobicContact CE1-CG 4.47Å; F781-F806 HydrophobicContact CE2-CD2 4.02Å; F781-F806 HydrophobicContact CG-CB 4.21Å; F781-F806 AromaticContact CZ-CD2 3.66Å; F781-F806 HydrophobicContact CZ-CD2 3.66Å; F781-F806 HydrophobicContact CZ-CE2 4.32Å; F781-I809 HydrophobicContact CE1-CD1 3.73Å
782	R	52.9	Low	57.7	Low	211 Å²	211	103.5 Å²	103.5	80%	0.796	56%	0.558	S	S	*	*			trans	-80.4	39.2	-165.8	-142	175.3	179.9	165.2	1.1	114.6
783	D	48.1	Very low	55.4	Low	67 Å²	67	106.4 Å²	106.4	36%	0.358	58%	0.576	S	S	.	*			trans	-98.3	-4.2	-164.3	-75	-26.9	0	0	0	116.3	F781	F781-D783 PolarHBondContact O-N 3.34Å
784	D	42.2	Very low	52.8	Low	150 Å²	150	112.2 Å²	112.2	80%	0.802	62%	0.616	S	S	*	*	S	Bend	trans	-104.1	5.2	-170.1	-69.3	-28.9	0	0	0	117
785	I	42.4	Very low	50.3	Low	134 Å²	134	115.7 Å²	115.7	69%	0.687	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-92	-4.1	-173.8	-56.8	179.2	0	0	0	114
786	K	43.8	Very low	48.1	Very low	200 Å²	200	118 Å²	118	87%	0.87	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-91.8	-3.8	-176	-81.1	-177.2	178.8	173.5	0	116.5
787	N	39	Very low	45.6	Very low	167 Å²	167	126.9 Å²	126.9	89%	0.893	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-101.9	11	-177.2	-78.3	-18.1	0	0	0	115.2
788	S	37.4	Very low	43.3	Very low	88 Å²	88	127.5 Å²	127.5	62%	0.615	72%	0.715	S	S	*	*	S	Bend	trans	-117.5	24.4	-175.6	50.9	0	0	0	0	115.7
789	L	34.3	Very low	41.2	Very low	158 Å²	158	130.9 Å²	130.9	83%	0.827	73%	0.73	S	S	*	*			trans	-137.4	116.3	165.1	-85.1	105.4	0	0	0	111.8
790	P	31.5	Very low	39.1	Very low	113 Å²	113	133.8 Å²	133.8	73%	0.734	76%	0.755	S	S	*	*			trans	-83.1	147.9	171.1	33.1	-29.1	0	0	0	110.4
791	N	34	Very low	37.4	Very low	150 Å²	150	132.5 Å²	132.5	80%	0.802	76%	0.757	S	S	*	*			trans	75.1	92.8	171.6	-60.9	-25.6	0	0	0	117
792	L	36.7	Very low	35.7	Very low	181 Å²	181	135.4 Å²	135.4	95%	0.948	79%	0.786	S	S	*	*				-157	128.1	123.7	-99	131.7	0	0	0	110.3
793	S	36.8	Very low	35.2	Very low	103 Å²	103	130.4 Å²	130.4	72%	0.72	77%	0.772	S	S	*	*			trans	-73.6	134.7	-166.5	42	0	0	0	0	114.5
794	S	31.1	Very low	35.9	Very low	121 Å²	121	129.5 Å²	129.5	85%	0.846	77%	0.769	S	S	*	*			trans	18.8	112.2	142.6	63.5	0	0	0	0	118.6
795	G	31.6	Very low	37.1	Very low	73 Å²	73	125.6 Å²	125.6	75%	0.753	75%	0.748	S	S	*	*			trans	-177.9	110.8	160.6	0	0	0	0	0	113.6
796	S	36.9	Very low	38.9	Very low	124 Å²	124	120 Å²	120	87%	0.867	72%	0.719	S	S	*	*			trans	81.7	91.5	159.3	-63.9	0	0	0	0	120.3
797	R	28.1	Very low	40.5	Very low	257 Å²	257	112.8 Å²	112.8	97%	0.97	69%	0.693	S	S	*	*				22.7	115.7	125.1	-71.1	178.7	178.7	165.7	-0.2	117.8
798	G	27.4	Very low	42.4	Very low	73 Å²	73	110.9 Å²	110.9	75%	0.753	67%	0.674	S	S	*	*			trans	173.5	92	160.2	0	0	0	0	0	111.6	V800	G798-V800 PolarHBondContact O-N 2.85Å; G798-V800 VanDerWaalsContact O-N 3.12Å
799	S	27.2	Very low	44.4	Very low	124 Å²	124	108 Å²	108	87%	0.867	65%	0.651	S	S	*	*			trans	-57.2	102.6	-179.7	173.7	0	0	0	0	113
800	V	29.9	Very low	46.7	Very low	133 Å²	133	101.5 Å²	101.5	81%	0.806	62%	0.618	S	S	*	*			trans	-139.5	98.1	156.7	-176.7	0	0	0	0	106.1	G798 A802	G798-V800 PolarHBondContact O-N 2.85Å; G798-V800 VanDerWaalsContact O-N 3.12Å; V800-A802 PolarHBondContact O-N 2.7Å
801	C	29	Very low	49	Very low	124 Å²	124	99.3 Å²	99.3	84%	0.838	60%	0.6	S	S	*	*			trans	-59.9	106.2	169.9	-100	0	0	0	0	107.7	E803	C801-E803 PolarHBondContact O-N 3.18Å
802	A	29.1	Very low	51	Low	92 Å²	92	96.9 Å²	96.9	76%	0.76	58%	0.584	S	S	*	*			trans	-69.3	100.4	169.8	0	0	0	0	0	107.7	V800 T804	V800-A802 PolarHBondContact O-N 2.7Å; A802-T804 PolarHBondContact O-N 2.97Å
803	E	42.1	Very low	53.1	Low	106 Å²	106	89.1 Å²	89.1	50%	0.495	54%	0.544	S	S	.	.			trans	-57.2	118.2	168.7	-76.1	177.6	157.7	0	0	109.2	C801 R808	C801-E803 PolarHBondContact O-N 3.18Å; E803-R808 HydrophobicContact CB-CG 4.19Å; E803-R808 PolarHBondContact O-NH2 3.39Å; E803-R808 WeakPolarHBondContact OE2-CG 3.49Å
804	T	62.4	Low	55.1	Low	48 Å²	48	84.9 Å²	84.9	29%	0.294	51%	0.514	S	S	.	.			trans	-56.2	147.4	170.9	66.5	0	0	0	0	109.5	A802 F806 S807 R808	A802-T804 PolarHBondContact O-N 2.97Å; T804-F806 PolarHBondContact O-N 3.48Å; T804-F806 VanDerWaalsContact O-N 3.11Å; T804-S807 PolarHBondContact O-N 3.49Å; T804-S807 PolarHBondContact OG1-N 3.32Å; T804-S807 PolarHBondContact OG1-OG 3.45Å; T804-R808 PolarHBondContact O-N 3.5Å
805	D	67.4	Low	57	Low	68 Å²	68	84 Å²	84	36%	0.364	50%	0.504	S	S	.	.	H	α-helix	trans	-57.5	-29.7	-179.4	-67.6	-30.3	0	0	0	111.6	R808 I809	D805-R808 IonicContact OD1-CZ 2.79Å; D805-R808 IonicContact OD1-NH1 3.47Å; D805-R808 PolarHBondContact OD1-NH1 2.73Å; D805-R808 IonicContact OD1-NH2 3.74Å; D805-R808 PolarHBondContact OD1-NH2 3.2Å; D805-I809 WeakPolarHBondContact O-CD1 3.39Å; D805-I809 WeakPolarHBondContact O-CG1 3.28Å; D805-I809 PolarHBondContact O-N 3.05Å
806	F	81.4	Confident	59	Low	17 Å²	17	83.2 Å²	83.2	8%	0.075	50%	0.497	C	S	.	.	H	α-helix	trans	-68.3	-41.3	174.2	-174.1	-108.6	0	0	0	113.2	P767 F770 K771 L774 F781 T804 R808 I809 V810	P767-F806 WeakPolarHBondContact O-CZ 3.15Å; F770-F806 AromaticContact CD1-CE2 3.81Å; F770-F806 HydrophobicContact CD1-CE2 3.81Å; F770-F806 AromaticContact CD1-CZ 3.97Å; F770-F806 HydrophobicContact CD1-CZ 3.97Å; F770-F806 HydrophobicContact CE1-CE2 4.2Å; K771-F806 HydrophobicContact CB-CD2 4.18Å; K771-F806 HydrophobicContact CB-CE1 3.97Å; K771-F806 HydrophobicContact CB-CE2 3.54Å; K771-F806 HydrophobicContact CB-CZ 3.44Å; K771-F806 VanDerWaalsContact CB-CZ 3.44Å; K771-F806 HydrophobicContact CD-CD1 4.01Å; K771-F806 HydrophobicContact CD-CD2 4.3Å; K771-F806 HydrophobicContact CD-CE1 4.14Å; K771-F806 HydrophobicContact CD-CE2 4.44Å; K771-F806 HydrophobicContact CD-CG 4.11Å; K771-F806 HydrophobicContact CD-CZ 4.38Å; K771-F806 HydrophobicContact CG-CD1 4.38Å; K771-F806 HydrophobicContact CG-CD2 3.87Å; K771-F806 HydrophobicContact CG-CE1 4.27Å; K771-F806 HydrophobicContact CG-CE2 3.77Å; K771-F806 HydrophobicContact CG-CG 4.2Å; K771-F806 HydrophobicContact CG-CZ 4Å; L774-F806 HydrophobicContact CD1-CE2 4.37Å; F781-F806 HydrophobicContact CD1-CB 3.85Å; F781-F806 HydrophobicContact CD1-CD2 4.22Å; F781-F806 HydrophobicContact CD2-CD2 4.47Å; F781-F806 HydrophobicContact CE1-CB 4.17Å; F781-F806 AromaticContact CE1-CD2 3.77Å; F781-F806 HydrophobicContact CE1-CD2 3.77Å; F781-F806 HydrophobicContact CE1-CG 4.47Å; F781-F806 HydrophobicContact CE2-CD2 4.02Å; F781-F806 HydrophobicContact CG-CB 4.21Å; F781-F806 AromaticContact CZ-CD2 3.66Å; F781-F806 HydrophobicContact CZ-CD2 3.66Å; F781-F806 HydrophobicContact CZ-CE2 4.32Å; T804-F806 PolarHBondContact O-N 3.48Å; T804-F806 VanDerWaalsContact O-N 3.11Å; F806-R808 VanDerWaalsContact C-N 3.27Å; F806-R808 PolarHBondContact O-N 2.94Å; F806-I809 PolarHBondContact O-N 3.4Å; F806-V810 HydrophobicContact CD1-CG2 3.99Å; F806-V810 HydrophobicContact CD2-CG2 4.42Å; F806-V810 HydrophobicContact CE1-CG2 3.41Å; F806-V810 VanDerWaalsContact CE1-CG2 3.41Å; F806-V810 HydrophobicContact CE2-CG2 3.89Å; F806-V810 HydrophobicContact CG-CG2 4.45Å; F806-V810 HydrophobicContact CZ-CG2 3.31Å; F806-V810 WeakPolarHBondContact O-CG2 3.37Å; F806-V810 PolarHBondContact O-N 2.91Å
807	S	77.4	Confident	60.7	Low	48 Å²	48	83.9 Å²	83.9	34%	0.336	49%	0.486	S	S	.	.	H	α-helix	trans	-61.3	-36.7	177.7	-61.1	0	0	0	0	112.3	T804 N811	T804-S807 PolarHBondContact O-N 3.49Å; T804-S807 PolarHBondContact OG1-N 3.32Å; T804-S807 PolarHBondContact OG1-OG 3.45Å; S807-N811 VanDerWaalsContact O-CG 3.27Å; S807-N811 PolarHBondContact O-N 2.98Å; S807-N811 VanDerWaalsContact O-N 3.09Å; S807-N811 PolarHBondContact O-ND2 3.21Å
808	R	77.8	Confident	63	Low	128 Å²	128	75 Å²	75	48%	0.483	46%	0.461	S	S	.	.	H	α-helix	trans	-65.7	-43.6	174.9	-79.3	-174.4	-106.7	131.1	11.9	111.8	E803 T804 D805 F806 N811 E812	E803-R808 HydrophobicContact CB-CG 4.19Å; E803-R808 PolarHBondContact O-NH2 3.39Å; E803-R808 WeakPolarHBondContact OE2-CG 3.49Å; T804-R808 PolarHBondContact O-N 3.5Å; D805-R808 IonicContact OD1-CZ 2.79Å; D805-R808 IonicContact OD1-NH1 3.47Å; D805-R808 PolarHBondContact OD1-NH1 2.73Å; D805-R808 IonicContact OD1-NH2 3.74Å; D805-R808 PolarHBondContact OD1-NH2 3.2Å; F806-R808 VanDerWaalsContact C-N 3.27Å; F806-R808 PolarHBondContact O-N 2.94Å; R808-N811 PolarHBondContact O-N 3.3Å; R808-E812 PolarHBondContact O-N 3.48Å
809	I	81.2	Confident	65.5	Low	26 Å²	26	73.7 Å²	73.7	13%	0.133	45%	0.447	C	S	.	.	H	α-helix	trans	-62.9	-44.7	177	-69.2	162.9	0	0	0	111.1	F770 L774 F781 D805 F806 N811 E812 V813 F829	F770-I809 HydrophobicContact CE1-CG2 3.89Å; F770-I809 HydrophobicContact CZ-CG2 4.22Å; L774-I809 HydrophobicContact CD1-CG2 4.11Å; F781-I809 HydrophobicContact CE1-CD1 3.73Å; D805-I809 WeakPolarHBondContact O-CD1 3.39Å; D805-I809 WeakPolarHBondContact O-CG1 3.28Å; D805-I809 PolarHBondContact O-N 3.05Å; F806-I809 PolarHBondContact O-N 3.4Å; I809-N811 VanDerWaalsContact C-N 3.34Å; I809-N811 PolarHBondContact O-N 2.89Å; I809-E812 WeakPolarHBondContact O-CB 3.42Å; I809-E812 PolarHBondContact O-N 3.31Å; I809-E812 VanDerWaalsContact O-N 3.12Å; I809-V813 HydrophobicContact CG2-CG2 4.27Å; I809-V813 WeakPolarHBondContact O-CG2 3.27Å; I809-V813 PolarHBondContact O-N 3.44Å; I809-F829 HydrophobicContact CB-CE2 4.27Å; I809-F829 HydrophobicContact CB-CZ 4.44Å; I809-F829 HydrophobicContact CD1-CZ 4.07Å; I809-F829 HydrophobicContact CG1-CE2 4.02Å; I809-F829 HydrophobicContact CG1-CZ 4.08Å; I809-F829 HydrophobicContact CG2-CD2 4Å; I809-F829 HydrophobicContact CG2-CE1 4.19Å; I809-F829 HydrophobicContact CG2-CE2 3.39Å; I809-F829 HydrophobicContact CG2-CZ 3.5Å; I809-F829 VanDerWaalsContact CG2-CZ 3.5Å
810	V	81.4	Confident	68.2	Low	23 Å²	23	71.7 Å²	71.7	14%	0.139	42%	0.421	C	S	.	.	H	α-helix	trans	-62.1	-42.3	178.3	173.2	0	0	0	0	111.6	F770 F806 E812 V813 D814	F770-V810 HydrophobicContact CD1-CG2 4.48Å; F806-V810 HydrophobicContact CD1-CG2 3.99Å; F806-V810 HydrophobicContact CD2-CG2 4.42Å; F806-V810 HydrophobicContact CE1-CG2 3.41Å; F806-V810 VanDerWaalsContact CE1-CG2 3.41Å; F806-V810 HydrophobicContact CE2-CG2 3.89Å; F806-V810 HydrophobicContact CG-CG2 4.45Å; F806-V810 HydrophobicContact CZ-CG2 3.31Å; F806-V810 WeakPolarHBondContact O-CG2 3.37Å; F806-V810 PolarHBondContact O-N 2.91Å; V810-E812 PolarHBondContact O-N 3.25Å; V810-V813 PolarHBondContact O-N 3.45Å; V810-D814 PolarHBondContact O-N 2.94Å
811	N	80.1	Confident	70.7	Confident	67 Å²	67	65.5 Å²	65.5	36%	0.358	38%	0.383	S	S	.	.	H	α-helix	trans	-64.7	-28.7	176.5	-72.5	-16.7	0	0	0	112.8	S807 R808 I809 P815 H817	S807-N811 VanDerWaalsContact O-CG 3.27Å; S807-N811 PolarHBondContact O-N 2.98Å; S807-N811 VanDerWaalsContact O-N 3.09Å; S807-N811 PolarHBondContact O-ND2 3.21Å; R808-N811 PolarHBondContact O-N 3.3Å; I809-N811 VanDerWaalsContact C-N 3.34Å; I809-N811 PolarHBondContact O-N 2.89Å; N811-P815 WeakPolarHBondContact O-CA 3.44Å; N811-H817 PolarHBondContact OD1-CE1 2.87Å
812	E	76.9	Confident	73.2	Confident	99 Å²	99	61.7 Å²	61.7	46%	0.463	36%	0.358	S	S	.	.	H	α-helix	trans	-75.3	-40.9	176.4	-164.3	-174.7	164.6	0	0	112.1	R808 I809 V810 R832	R808-E812 PolarHBondContact O-N 3.48Å; I809-E812 WeakPolarHBondContact O-CB 3.42Å; I809-E812 PolarHBondContact O-N 3.31Å; I809-E812 VanDerWaalsContact O-N 3.12Å; V810-E812 PolarHBondContact O-N 3.25Å; E812-R832 IonicContact OE1-CZ 3.5Å; E812-R832 IonicContact OE1-NH1 3.47Å; E812-R832 PolarHBondContact OE1-NH1 3.42Å; E812-R832 IonicContact OE2-NH1 2.76Å; E812-R832 PolarHBondContact OE2-NH1 2.97Å
813	V	79.1	Confident	75.7	Confident	18 Å²	18	59 Å²	59	11%	0.109	33%	0.329	C	S	.	.	H	α-helix	trans	-82.3	-25.4	-176.5	-178.3	0	0	0	0	112.2	F770 I809 V810 P815 I821 A825 F829	F770-V813 HydrophobicContact CZ-CG1 4.33Å; F770-V813 HydrophobicContact CZ-CG2 4.12Å; I809-V813 HydrophobicContact CG2-CG2 4.27Å; I809-V813 WeakPolarHBondContact O-CG2 3.27Å; I809-V813 PolarHBondContact O-N 3.44Å; V810-V813 PolarHBondContact O-N 3.45Å; V813-P815 VanDerWaalsContact C-CD 3.48Å; V813-I821 HydrophobicContact CG1-CG1 4.2Å; V813-I821 HydrophobicContact CG1-CG2 3.67Å; V813-A825 HydrophobicContact CG1-CB 3.69Å; V813-F829 HydrophobicContact CG2-CB 3.7Å; V813-F829 HydrophobicContact CG2-CD2 3.57Å; V813-F829 HydrophobicContact CG2-CE2 4.47Å; V813-F829 HydrophobicContact CG2-CG 3.77Å
814	D	80.4	Confident	77	Confident	14 Å²	14	56.4 Å²	56.4	8%	0.075	32%	0.319	C	S	.	.			trans	-127.8	66.4	176.4	-177.3	26.6	0	0	0	111.7	V810 G816 H817 T818 G819	V810-D814 PolarHBondContact O-N 2.94Å; D814-G816 PolarHBondContact O-N 3.42Å; D814-G816 VanDerWaalsContact O-N 3.15Å; D814-H817 PolarHBondContact O-N 3.26Å; D814-H817 PolarHBondContact OD1-N 2.9Å; D814-H817 VanDerWaalsContact OD2-C 3.32Å; D814-H817 WeakPolarHBondContact OD2-CA 3.32Å; D814-T818 VanDerWaalsContact CG-N 3.26Å; D814-T818 VanDerWaalsContact CG-OG1 3.27Å; D814-T818 WeakPolarHBondContact OD1-CB 3.42Å; D814-T818 PolarHBondContact OD1-N 3.38Å; D814-T818 PolarHBondContact OD1-OG1 3.17Å; D814-T818 PolarHBondContact OD2-N 3.14Å; D814-T818 PolarHBondContact OD2-OG1 3.31Å; D814-G819 PolarHBondContact OD2-N 3.06Å
815	P	70.4	Confident	77.7	Confident	101 Å²	101	54.9 Å²	54.9	66%	0.656	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-17.4	-178.9	26	-33	0	0	0	112.8	N811 V813 H817	N811-P815 WeakPolarHBondContact O-CA 3.44Å; V813-P815 VanDerWaalsContact C-CD 3.48Å; P815-H817 VanDerWaalsContact C-N 3.34Å
816	G	72.7	Confident	78.4	Confident	58 Å²	58	51.6 Å²	51.6	60%	0.598	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-4.6	174.2	0	0	0	0	0	114.3	D814 T818	D814-G816 PolarHBondContact O-N 3.42Å; D814-G816 VanDerWaalsContact O-N 3.15Å; G816-T818 PolarHBondContact O-N 3.46Å
817	H	72.5	Confident	78.2	Confident	138 Å²	138	50.8 Å²	50.8	64%	0.639	29%	0.29	S	S	*	.			trans	49.9	41.9	-173.4	-59.4	-59.5	0	0	0	112.9	N811 D814 P815 G819	N811-H817 PolarHBondContact OD1-CE1 2.87Å; D814-H817 PolarHBondContact O-N 3.26Å; D814-H817 PolarHBondContact OD1-N 2.9Å; D814-H817 VanDerWaalsContact OD2-C 3.32Å; D814-H817 WeakPolarHBondContact OD2-CA 3.32Å; P815-H817 VanDerWaalsContact C-N 3.34Å; H817-G819 PolarHBondContact O-N 3.07Å
818	T	78.1	Confident	77.8	Confident	71 Å²	71	51.8 Å²	51.8	44%	0.436	29%	0.291	S	S	.	.			trans	-66.2	-20	176.8	63.3	0	0	0	0	112.5	D814 G816 Y820	D814-T818 VanDerWaalsContact CG-N 3.26Å; D814-T818 VanDerWaalsContact CG-OG1 3.27Å; D814-T818 WeakPolarHBondContact OD1-CB 3.42Å; D814-T818 PolarHBondContact OD1-N 3.38Å; D814-T818 PolarHBondContact OD1-OG1 3.17Å; D814-T818 PolarHBondContact OD2-N 3.14Å; D814-T818 PolarHBondContact OD2-OG1 3.31Å; G816-T818 PolarHBondContact O-N 3.46Å; T818-Y820 VanDerWaalsContact C-N 3.3Å; T818-Y820 VanDerWaalsContact O-CD1 3.25Å; T818-Y820 WeakPolarHBondContact O-CD1 3.29Å; T818-Y820 PolarHBondContact OG1-O 3.04Å; T818-Y820 VanDerWaalsContact OG1-O 3.14Å
819	G	79.7	Confident	77.8	Confident	44 Å²	44	46.5 Å²	46.5	45%	0.454	27%	0.272	S	S	.	.	S	Bend	trans	82.9	4.6	177.2	0	0	0	0	0	113.9	P767 D814 H817	P767-G819 WeakPolarHBondContact CD-O 3.39Å; D814-G819 PolarHBondContact OD2-N 3.06Å; H817-G819 PolarHBondContact O-N 3.07Å
820	Y	83	Confident	77.6	Confident	83 Å²	83	47 Å²	47	33%	0.325	27%	0.274	S	S	.	.	S	Bend	trans	-144.2	155.2	177.2	61.4	-93.2	0	0	0	110.6	R764 T818	R764-Y820 HydrophobicContact CB-CD2 4.18Å; R764-Y820 HydrophobicContact CB-CG 4.49Å; R764-Y820 HydrophobicContact CG-CD2 3.85Å; R764-Y820 HydrophobicContact CG-CE2 4.37Å; R764-Y820 HydrophobicContact CG-CG 4.47Å; R764-Y820 PolarHBondContact NH1-OH 2.87Å; T818-Y820 VanDerWaalsContact C-N 3.3Å; T818-Y820 VanDerWaalsContact O-CD1 3.25Å; T818-Y820 WeakPolarHBondContact O-CD1 3.29Å; T818-Y820 PolarHBondContact OG1-O 3.04Å; T818-Y820 VanDerWaalsContact OG1-O 3.14Å
821	I	83.1	Confident	77	Confident	2 Å²	2	46 Å²	46	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	115.8	-177.1	-64.6	158.9	0	0	0	108	R764 L765 F770 V813 A825 F826	R764-I821 WeakPolarHBondContact CA-O 3.27Å; L765-I821 PolarHBondContact N-O 2.91Å; L765-I821 PolarHBondContact O-N 3.33Å; F770-I821 HydrophobicContact CB-CD1 3.49Å; F770-I821 VanDerWaalsContact CB-CD1 3.49Å; F770-I821 HydrophobicContact CD1-CD1 3.27Å; F770-I821 HydrophobicContact CD2-CB 4.41Å; F770-I821 HydrophobicContact CD2-CD1 3.73Å; F770-I821 HydrophobicContact CD2-CG2 3.91Å; F770-I821 HydrophobicContact CE1-CD1 3.79Å; F770-I821 HydrophobicContact CE2-CD1 4.19Å; F770-I821 HydrophobicContact CE2-CG2 4.01Å; F770-I821 HydrophobicContact CG-CD1 3.22Å; F770-I821 HydrophobicContact CG-CG1 4.46Å; F770-I821 HydrophobicContact CZ-CD1 4.23Å; V813-I821 HydrophobicContact CG1-CG1 4.2Å; V813-I821 HydrophobicContact CG1-CG2 3.67Å; I821-A825 HydrophobicContact CG2-CB 4.11Å; I821-F826 HydrophobicContact CG2-CB 4.16Å
822	S	82	Confident	76.4	Confident	45 Å²	45	48.1 Å²	48.1	32%	0.315	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	160.9	175.3	65.9	0	0	0	0	110.9	D824 A825 F826	S822-D824 PolarHBondContact O-N 3.33Å; S822-A825 PolarHBondContact O-N 2.89Å; S822-A825 VanDerWaalsContact O-N 3.1Å; S822-A825 PolarHBondContact OG-N 3.48Å; S822-F826 PolarHBondContact O-N 2.88Å
823	F	80.2	Confident	75.4	Confident	35 Å²	35	49.5 Å²	49.5	15%	0.154	28%	0.282	C	S	.	.	H	α-helix	trans	-57	-37.4	174.2	-177.3	-107	0	0	0	112.1	M747 R751 F754 A825 F826 L827	M747-F823 HydrophobicContact CE-CE1 3.56Å; M747-F823 HydrophobicContact CE-CZ 4.02Å; M747-F823 HydrophobicContact SD-CE1 4.38Å; M747-F823 HydrophobicContact SD-CZ 4.27Å; R751-F823 HydrophobicContact CB-CE2 4.34Å; R751-F823 HydrophobicContact CB-CZ 4.28Å; R751-F823 HydrophobicContact CG-CE1 3.86Å; R751-F823 HydrophobicContact CG-CE2 3.71Å; R751-F823 HydrophobicContact CG-CZ 3.27Å; F754-F823 HydrophobicContact CB-CD2 3.7Å; F754-F823 HydrophobicContact CB-CE2 3.93Å; F754-F823 HydrophobicContact CD1-CB 4.36Å; F754-F823 AromaticContact CD1-CD2 3.95Å; F754-F823 HydrophobicContact CD1-CD2 3.95Å; F754-F823 HydrophobicContact CD2-CB 4.43Å; F754-F823 AromaticContact CD2-CD2 3.76Å; F754-F823 HydrophobicContact CD2-CD2 3.76Å; F754-F823 HydrophobicContact CE1-CB 4.11Å; F754-F823 HydrophobicContact CE2-CB 4.16Å; F754-F823 HydrophobicContact CE2-CD2 4.32Å; F754-F823 AromaticContact CG-CD2 3.54Å; F754-F823 HydrophobicContact CG-CD2 3.54Å; F754-F823 HydrophobicContact CG-CE2 4.28Å; F754-F823 HydrophobicContact CG-CG 4.5Å; F754-F823 HydrophobicContact CZ-CB 3.99Å; F823-A825 PolarHBondContact O-N 2.96Å; F823-F826 HydrophobicContact CD2-CD1 4.03Å; F823-F826 AromaticContact CE2-CD1 3.97Å; F823-F826 HydrophobicContact CE2-CD1 3.97Å; F823-F826 HydrophobicContact CE2-CE1 4.24Å; F823-F826 PolarHBondContact O-N 3.37Å; F823-L827 HydrophobicContact CZ-CD1 4.22Å; F823-L827 VanDerWaalsContact O-CB 3.29Å; F823-L827 WeakPolarHBondContact O-CB 3.41Å; F823-L827 PolarHBondContact O-N 2.93Å
824	D	69.8	Low	74.1	Confident	52 Å²	52	53.8 Å²	53.8	28%	0.278	30%	0.304	S	S	.	.	H	α-helix	trans	-60.6	-43.6	174.6	-76.5	-12.2	0	0	0	112.7	R345 S822 L827 N828	R345-D824 IonicContact CZ-OD2 3.58Å; R345-D824 IonicContact NH1-OD2 2.61Å; R345-D824 PolarHBondContact NH1-OD2 3.15Å; R345-D824 VanDerWaalsContact NH1-OD2 3.13Å; R345-D824 IonicContact NH2-OD1 3.62Å; R345-D824 IonicContact NH2-OD2 2.75Å; R345-D824 PolarHBondContact NH2-OD2 3.16Å; S822-D824 PolarHBondContact O-N 3.33Å; D824-L827 PolarHBondContact O-N 3.31Å; D824-N828 WeakPolarHBondContact O-CB 3.31Å; D824-N828 PolarHBondContact O-N 3.44Å; D824-N828 PolarHBondContact O-ND2 3.37Å
825	A	76.2	Confident	72.7	Confident	15 Å²	15	55.4 Å²	55.4	12%	0.124	31%	0.314	C	S	.	.	H	α-helix	trans	-69.6	-41.3	179.7	0	0	0	0	0	111.1	V813 I821 S822 F823 N828 F829	V813-A825 HydrophobicContact CG1-CB 3.69Å; I821-A825 HydrophobicContact CG2-CB 4.11Å; S822-A825 PolarHBondContact O-N 2.89Å; S822-A825 VanDerWaalsContact O-N 3.1Å; S822-A825 PolarHBondContact OG-N 3.48Å; F823-A825 PolarHBondContact O-N 2.96Å; A825-N828 WeakPolarHBondContact O-CB 3.35Å; A825-N828 PolarHBondContact O-N 3.44Å; A825-F829 PolarHBondContact O-N 2.65Å; A825-F829 VanDerWaalsContact O-N 3.11Å
826	F	82.1	Confident	71.6	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-58.7	-47	170.6	167.3	-101.6	0	0	0	111.4	L750 F754 F770 L777 I821 S822 F823 N828 F829 M830	L750-F826 HydrophobicContact CB-CE1 4.11Å; L750-F826 HydrophobicContact CD2-CE1 4.04Å; L750-F826 HydrophobicContact CD2-CZ 4.02Å; F754-F826 HydrophobicContact CB-CD1 4.29Å; F754-F826 HydrophobicContact CB-CE1 4.21Å; F754-F826 HydrophobicContact CD2-CB 3.83Å; F754-F826 AromaticContact CD2-CD1 3.74Å; F754-F826 HydrophobicContact CD2-CD1 3.74Å; F754-F826 HydrophobicContact CD2-CD2 4.37Å; F754-F826 HydrophobicContact CD2-CE1 4.4Å; F754-F826 AromaticContact CD2-CG 3.72Å; F754-F826 HydrophobicContact CD2-CG 3.72Å; F754-F826 HydrophobicContact CE2-CB 3.88Å; F754-F826 HydrophobicContact CE2-CG 4.29Å; F754-F826 HydrophobicContact CG-CD1 4.45Å; F770-F826 HydrophobicContact CD2-CD2 4.14Å; F770-F826 AromaticContact CE2-CD2 3.83Å; F770-F826 HydrophobicContact CE2-CD2 3.83Å; L777-F826 HydrophobicContact CD1-CE2 3.94Å; L777-F826 HydrophobicContact CD1-CZ 3.84Å; I821-F826 HydrophobicContact CG2-CB 4.16Å; S822-F826 PolarHBondContact O-N 2.88Å; F823-F826 HydrophobicContact CD2-CD1 4.03Å; F823-F826 AromaticContact CE2-CD1 3.97Å; F823-F826 HydrophobicContact CE2-CD1 3.97Å; F823-F826 HydrophobicContact CE2-CE1 4.24Å; F823-F826 PolarHBondContact O-N 3.37Å; F826-N828 PolarHBondContact O-N 3.49Å; F826-F829 WeakPolarHBondContact O-CB 3.49Å; F826-F829 PolarHBondContact O-N 3.03Å; F826-M830 HydrophobicContact CD1-CG 4.45Å; F826-M830 HydrophobicContact CD2-CG 4.08Å; F826-M830 HydrophobicContact CE1-CG 4.08Å; F826-M830 HydrophobicContact CE2-CG 3.64Å; F826-M830 HydrophobicContact CE2-SD 4.01Å; F826-M830 HydrophobicContact CG-CG 4.46Å; F826-M830 HydrophobicContact CZ-CG 3.64Å; F826-M830 HydrophobicContact CZ-SD 4.29Å; F826-M830 WeakPolarHBondContact O-CG 3.21Å; F826-M830 PolarHBondContact O-N 2.82Å
827	L	77.1	Confident	70.6	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-62.4	-44	178.8	-165.4	74.4	0	0	0	110.9	T736 R740 L742 M747 L750 F823 D824 F829 M830 T831	T736-L827 HydrophobicContact CG2-CD2 3.31Å; R740-L827 PolarHBondContact NH1-O 2.61Å; L742-L827 HydrophobicContact CD1-CD1 3.88Å; L742-L827 HydrophobicContact CD1-CG 4.5Å; M747-L827 HydrophobicContact CE-CD1 4.5Å; M747-L827 HydrophobicContact CE-CD2 3.93Å; M747-L827 HydrophobicContact SD-CD1 3.78Å; M747-L827 HydrophobicContact SD-CD2 4.08Å; L750-L827 HydrophobicContact CB-CD1 4.45Å; L750-L827 HydrophobicContact CD1-CD1 3.65Å; F823-L827 HydrophobicContact CZ-CD1 4.22Å; F823-L827 VanDerWaalsContact O-CB 3.29Å; F823-L827 WeakPolarHBondContact O-CB 3.41Å; F823-L827 PolarHBondContact O-N 2.93Å; D824-L827 PolarHBondContact O-N 3.31Å; L827-F829 VanDerWaalsContact C-N 3.27Å; L827-F829 PolarHBondContact O-N 3.24Å; L827-M830 PolarHBondContact O-N 2.9Å; L827-T831 HydrophobicContact CD1-CG2 4.33Å; L827-T831 HydrophobicContact CG-CG2 4.3Å; L827-T831 WeakPolarHBondContact O-CG2 3.21Å; L827-T831 PolarHBondContact O-N 3.4Å; L827-T831 PolarHBondContact O-OG1 3.48Å
828	N	70	Confident	69.6	Low	68 Å²	68	54.4 Å²	54.4	36%	0.364	30%	0.298	S	S	.	.	H	α-helix	trans	-51	-48.4	174.6	-82.2	-22	0	0	0	111.5	R740 D824 A825 F826 R832	R740-N828 PolarHBondContact NH1-OD1 2.98Å; R740-N828 PolarHBondContact NH2-OD1 2.94Å; D824-N828 WeakPolarHBondContact O-CB 3.31Å; D824-N828 PolarHBondContact O-N 3.44Å; D824-N828 PolarHBondContact O-ND2 3.37Å; A825-N828 WeakPolarHBondContact O-CB 3.35Å; A825-N828 PolarHBondContact O-N 3.44Å; F826-N828 PolarHBondContact O-N 3.49Å; N828-R832 PolarHBondContact O-N 3.05Å
829	F	78.1	Confident	68.9	Low	17 Å²	17	53.8 Å²	53.8	8%	0.075	29%	0.294	C	S	.	.	H	α-helix	trans	-63.5	-47.5	179.3	-177.4	-103.4	0	0	0	112.3	F770 L774 Y779 I809 V813 A825 F826 L827 T831	F770-F829 HydrophobicContact CZ-CD1 4.18Å; F770-F829 HydrophobicContact CZ-CG 4.42Å; L774-F829 HydrophobicContact CD1-CE1 3.88Å; L774-F829 HydrophobicContact CD1-CZ 4.38Å; L774-F829 HydrophobicContact CD2-CD1 3.87Å; L774-F829 HydrophobicContact CD2-CE1 3.54Å; L774-F829 HydrophobicContact CG-CE1 4.39Å; Y779-F829 HydrophobicContact CE1-CE1 4.02Å; Y779-F829 HydrophobicContact CE1-CZ 4.07Å; Y779-F829 HydrophobicContact CE2-CE1 4.45Å; Y779-F829 AromaticContact CZ-CE1 3.91Å; I809-F829 HydrophobicContact CB-CE2 4.27Å; I809-F829 HydrophobicContact CB-CZ 4.44Å; I809-F829 HydrophobicContact CD1-CZ 4.07Å; I809-F829 HydrophobicContact CG1-CE2 4.02Å; I809-F829 HydrophobicContact CG1-CZ 4.08Å; I809-F829 HydrophobicContact CG2-CD2 4Å; I809-F829 HydrophobicContact CG2-CE1 4.19Å; I809-F829 HydrophobicContact CG2-CE2 3.39Å; I809-F829 HydrophobicContact CG2-CZ 3.5Å; I809-F829 VanDerWaalsContact CG2-CZ 3.5Å; V813-F829 HydrophobicContact CG2-CB 3.7Å; V813-F829 HydrophobicContact CG2-CD2 3.57Å; V813-F829 HydrophobicContact CG2-CE2 4.47Å; V813-F829 HydrophobicContact CG2-CG 3.77Å; A825-F829 PolarHBondContact O-N 2.65Å; A825-F829 VanDerWaalsContact O-N 3.11Å; F826-F829 WeakPolarHBondContact O-CB 3.49Å; F826-F829 PolarHBondContact O-N 3.03Å; L827-F829 VanDerWaalsContact C-N 3.27Å; L827-F829 PolarHBondContact O-N 3.24Å; F829-T831 VanDerWaalsContact C-N 3.34Å; F829-T831 PolarHBondContact O-N 3.18Å
830	M	75.9	Confident	68.3	Low	37 Å²	37	53 Å²	53	18%	0.182	28%	0.279	C	S	.	.	H	α-helix	trans	-69.2	-29.4	-175.1	-68.5	-58.2	-56.5	0	0	113.8	L750 L774 L777 Y779 F826 L827	L750-M830 HydrophobicContact CD1-CB 4.42Å; L750-M830 HydrophobicContact CD2-CB 4.13Å; L750-M830 HydrophobicContact CD2-CE 4.03Å; L750-M830 HydrophobicContact CD2-CG 4.03Å; L774-M830 HydrophobicContact CD2-SD 3.96Å; L777-M830 HydrophobicContact CB-CE 4.45Å; L777-M830 HydrophobicContact CD1-CE 3.74Å; L777-M830 HydrophobicContact CD1-SD 3.88Å; L777-M830 HydrophobicContact CG-CE 4.49Å; Y779-M830 HydrophobicContact CE2-CE 4.18Å; Y779-M830 HydrophobicContact CE2-SD 4.08Å; F826-M830 HydrophobicContact CD1-CG 4.45Å; F826-M830 HydrophobicContact CD2-CG 4.08Å; F826-M830 HydrophobicContact CE1-CG 4.08Å; F826-M830 HydrophobicContact CE2-CG 3.64Å; F826-M830 HydrophobicContact CE2-SD 4.01Å; F826-M830 HydrophobicContact CG-CG 4.46Å; F826-M830 HydrophobicContact CZ-CG 3.64Å; F826-M830 HydrophobicContact CZ-SD 4.29Å; F826-M830 WeakPolarHBondContact O-CG 3.21Å; F826-M830 PolarHBondContact O-N 2.82Å; L827-M830 PolarHBondContact O-N 2.9Å
831	T	69.1	Low	67.8	Low	3 Å²	3	56 Å²	56	2%	0.018	30%	0.295	C	S	.	.	H	α-helix	trans	-99	-3.1	-176.6	60.1	0	0	0	0	114.1	R740 L742 L827 F829 D833 N834 V835	R740-T831 WeakPolarHBondContact CD-OG1 3.48Å; R740-T831 PolarHBondContact NH1-OG1 2.89Å; L742-T831 HydrophobicContact CD1-CG2 3.68Å; L742-T831 HydrophobicContact CD2-CG2 3.94Å; L742-T831 HydrophobicContact CG-CG2 4.03Å; L827-T831 HydrophobicContact CD1-CG2 4.33Å; L827-T831 HydrophobicContact CG-CG2 4.3Å; L827-T831 WeakPolarHBondContact O-CG2 3.21Å; L827-T831 PolarHBondContact O-N 3.4Å; L827-T831 PolarHBondContact O-OG1 3.48Å; F829-T831 VanDerWaalsContact C-N 3.34Å; F829-T831 PolarHBondContact O-N 3.18Å; T831-D833 PolarHBondContact O-N 3.36Å; T831-D833 VanDerWaalsContact O-N 3.1Å; T831-N834 PolarHBondContact O-N 3.32Å; T831-V835 PolarHBondContact O-N 3.44Å
832	R	66.9	Low	67.4	Low	110 Å²	110	58.4 Å²	58.4	42%	0.415	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-36.5	-171.4	-167.9	-176.9	66.7	-174.6	-5.2	112.8	E812 N828	E812-R832 IonicContact OE1-CZ 3.5Å; E812-R832 IonicContact OE1-NH1 3.47Å; E812-R832 PolarHBondContact OE1-NH1 3.42Å; E812-R832 IonicContact OE2-NH1 2.76Å; E812-R832 PolarHBondContact OE2-NH1 2.97Å; N828-R832 PolarHBondContact O-N 3.05Å
833	D	56.2	Low	67.3	Low	129 Å²	129	56.4 Å²	56.4	69%	0.69	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-12.7	-177.2	-59.8	-13.3	0	0	0	113.1	T831	T831-D833 PolarHBondContact O-N 3.36Å; T831-D833 VanDerWaalsContact O-N 3.1Å
834	N	52.6	Low	67.5	Low	108 Å²	108	55.9 Å²	55.9	58%	0.578	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-10.6	-178.3	-73.7	-13.5	0	0	0	113.9	T831 D836	T831-N834 PolarHBondContact O-N 3.32Å; N834-D836 PolarHBondContact O-N 3.4Å
835	V	50.9	Low	68	Low	47 Å²	47	57.4 Å²	57.4	29%	0.285	30%	0.297	S	S	.	.			trans	-87.3	110.3	179	-173.8	0	0	0	0	107.5	R740 T831 E837	R740-V835 HydrophobicContact CB-CG2 4.43Å; R740-V835 HydrophobicContact CG-CG2 4.36Å; T831-V835 PolarHBondContact O-N 3.44Å; V835-E837 HydrophobicContact CB-CG 4.05Å; V835-E837 HydrophobicContact CG1-CB 4.44Å; V835-E837 HydrophobicContact CG1-CG 3.65Å; V835-E837 PolarHBondContact O-N 3.27Å
836	D	47.4	Very low	68.4	Low	154 Å²	154	56.8 Å²	56.8	82%	0.824	29%	0.291	S	S	*	.			trans	-63.5	76.4	156.5	-85.3	-27.5	0	0	0	107.2	N834 A838	N834-D836 PolarHBondContact O-N 3.4Å; D836-A838 PolarHBondContact O-N 2.9Å
837	E	50.9	Low	68.6	Low	79 Å²	79	56.8 Å²	56.8	37%	0.369	29%	0.291	S	S	.	.			trans	-59.4	116.4	176.7	-70.2	-169.5	160.9	0	0	106.1	N348 V835 T839 Q842	N348-E837 PolarHBondContact ND2-OE1 3.45Å; V835-E837 HydrophobicContact CB-CG 4.05Å; V835-E837 HydrophobicContact CG1-CB 4.44Å; V835-E837 HydrophobicContact CG1-CG 3.65Å; V835-E837 PolarHBondContact O-N 3.27Å; E837-T839 PolarHBondContact O-N 2.95Å; E837-T839 PolarHBondContact O-OG1 3.13Å; E837-Q842 VanDerWaalsContact O-CD 3.22Å; E837-Q842 PolarHBondContact O-NE2 3.42Å; E837-Q842 PolarHBondContact O-OE1 3.33Å
838	A	52.3	Low	69	Low	44 Å²	44	60.2 Å²	60.2	36%	0.364	31%	0.306	S	S	.	.			trans	-64.6	78.9	165.1	0	0	0	0	0	107.5	D836	D836-A838 PolarHBondContact O-N 2.9Å
839	T	62.8	Low	69.6	Low	57 Å²	57	58.4 Å²	58.4	35%	0.35	30%	0.298	S	S	.	.			trans	-60.6	151.2	-178.7	-7.5	0	0	0	0	107.3	E837 E841 Q842 L843	E837-T839 PolarHBondContact O-N 2.95Å; E837-T839 PolarHBondContact O-OG1 3.13Å; T839-E841 PolarHBondContact O-N 3.03Å; T839-Q842 WeakPolarHBondContact O-CA 3.34Å; T839-Q842 WeakPolarHBondContact O-CB 3.42Å; T839-Q842 PolarHBondContact O-N 3.23Å; T839-L843 PolarHBondContact O-N 3.08Å
840	E	68.5	Low	69.7	Low	28 Å²	28	57.6 Å²	57.6	13%	0.131	29%	0.294	C	S	.	.	H	α-helix	trans	-44.3	-41.3	170.7	-175.5	-158.8	103.2	0	0	111.1	Q842 L843 I844 Y898 C901	E840-Q842 PolarHBondContact O-N 3.49Å; E840-L843 PolarHBondContact O-N 3.21Å; E840-I844 HydrophobicContact CG-CD1 4.14Å; E840-I844 WeakPolarHBondContact O-CB 3.23Å; E840-I844 VanDerWaalsContact O-CG1 3.25Å; E840-I844 WeakPolarHBondContact O-CG1 3.41Å; E840-I844 PolarHBondContact O-N 3.24Å; E840-Y898 HydrophobicContact CG-CD1 4.28Å; E840-Y898 HydrophobicContact CG-CE1 4.3Å; E840-Y898 WeakPolarHBondContact OE1-CD1 3.47Å; E840-Y898 WeakPolarHBondContact OE1-CE1 3.39Å; E840-Y898 PolarHBondContact OE1-OH 3.21Å; E840-Y898 VanDerWaalsContact OE1-OH 3.06Å; E840-Y898 WeakPolarHBondContact OE2-CD1 3.43Å; E840-Y898 WeakPolarHBondContact OE2-CE1 3.11Å; E840-C901 HydrophobicContact CB-CB 4.41Å; E840-C901 HydrophobicContact CG-CB 4.36Å
841	E	71.7	Confident	69.7	Low	145 Å²	145	55.9 Å²	55.9	68%	0.678	29%	0.286	S	S	*	.	H	α-helix	trans	-60.4	-40.3	173.6	-63.4	-177.9	178.3	0	0	113.7	T839 I844 Q845	T839-E841 PolarHBondContact O-N 3.03Å; E841-I844 PolarHBondContact O-N 3.47Å; E841-Q845 VanDerWaalsContact O-CB 3.23Å; E841-Q845 WeakPolarHBondContact O-CB 3.37Å; E841-Q845 PolarHBondContact O-N 3.06Å
842	Q	75	Confident	70	Confident	54 Å²	54	58.1 Å²	58.1	25%	0.252	31%	0.31	S	S	.	.	H	α-helix	trans	-68.6	-35.6	176.5	-65.8	-171.2	11.5	0	0	112.1	E837 T839 E840 S846	E837-Q842 VanDerWaalsContact O-CD 3.22Å; E837-Q842 PolarHBondContact O-NE2 3.42Å; E837-Q842 PolarHBondContact O-OE1 3.33Å; T839-Q842 WeakPolarHBondContact O-CA 3.34Å; T839-Q842 WeakPolarHBondContact O-CB 3.42Å; T839-Q842 PolarHBondContact O-N 3.23Å; E840-Q842 PolarHBondContact O-N 3.49Å; Q842-S846 WeakPolarHBondContact O-CB 3.39Å; Q842-S846 PolarHBondContact O-N 2.98Å; Q842-S846 PolarHBondContact O-OG 2.91Å
843	L	80.1	Confident	70.3	Confident	3 Å²	3	58 Å²	58	2%	0.016	32%	0.317	C	S	.	.	H	α-helix	trans	-69.1	-45.1	175.7	-169.6	65.7	0	0	0	110.3	I261 N264 T839 E840 Q845 S846 F847 A897 I900	I261-L843 HydrophobicContact CG1-CD1 4.11Å; N264-L843 HydrophobicContact CB-CD1 4.1Å; T839-L843 PolarHBondContact O-N 3.08Å; E840-L843 PolarHBondContact O-N 3.21Å; L843-Q845 VanDerWaalsContact C-N 3.34Å; L843-Q845 PolarHBondContact O-N 3.24Å; L843-S846 WeakPolarHBondContact O-CB 3.5Å; L843-S846 PolarHBondContact O-N 3.12Å; L843-S846 VanDerWaalsContact O-N 3.16Å; L843-F847 HydrophobicContact CD1-CD2 4.44Å; L843-F847 HydrophobicContact CD1-CE2 3.98Å; L843-F847 HydrophobicContact CD2-CE2 4.35Å; L843-F847 HydrophobicContact CG-CD2 4.11Å; L843-F847 HydrophobicContact CG-CE2 3.84Å; L843-F847 VanDerWaalsContact O-CD2 3.28Å; L843-F847 WeakPolarHBondContact O-CD2 3.47Å; L843-F847 PolarHBondContact O-N 3.35Å; L843-A897 HydrophobicContact CD2-CB 4.02Å; L843-A897 HydrophobicContact CG-CB 4.35Å; L843-I900 HydrophobicContact CD2-CG2 4.43Å
844	I	84.1	Confident	71.2	Confident	24 Å²	24	55.9 Å²	55.9	12%	0.123	30%	0.302	C	S	.	.	H	α-helix	trans	-55	-48.8	171.5	-72.9	171.7	0	0	0	110.5	E840 E841 S846 F847 K848 Y893 E894 A897 Y898	E840-I844 HydrophobicContact CG-CD1 4.14Å; E840-I844 WeakPolarHBondContact O-CB 3.23Å; E840-I844 VanDerWaalsContact O-CG1 3.25Å; E840-I844 WeakPolarHBondContact O-CG1 3.41Å; E840-I844 PolarHBondContact O-N 3.24Å; E841-I844 PolarHBondContact O-N 3.47Å; I844-S846 VanDerWaalsContact C-N 3.28Å; I844-S846 PolarHBondContact O-N 3.49Å; I844-F847 PolarHBondContact O-N 3Å; I844-K848 WeakPolarHBondContact O-CB 3.46Å; I844-K848 PolarHBondContact O-N 3.16Å; I844-Y893 HydrophobicContact CG2-CE2 4.02Å; I844-E894 HydrophobicContact CG2-CG 4.26Å; I844-A897 HydrophobicContact CD1-CB 4.37Å; I844-A897 HydrophobicContact CG1-CB 3.62Å; I844-Y898 HydrophobicContact CD1-CE2 4.33Å
845	Q	81.2	Confident	72.5	Confident	84 Å²	84	53.2 Å²	53.2	39%	0.393	30%	0.3	S	S	.	.	H	α-helix	trans	-65	-33.1	179.6	-173.3	56.6	35.6	0	0	112.1	E841 L843 T849	E841-Q845 VanDerWaalsContact O-CB 3.23Å; E841-Q845 WeakPolarHBondContact O-CB 3.37Å; E841-Q845 PolarHBondContact O-N 3.06Å; L843-Q845 VanDerWaalsContact C-N 3.34Å; L843-Q845 PolarHBondContact O-N 3.24Å; Q845-T849 WeakPolarHBondContact O-CB 3.47Å; Q845-T849 PolarHBondContact O-N 3.44Å; Q845-T849 PolarHBondContact O-OG1 3.09Å
846	S	83.9	Confident	74	Confident	1 Å²	1	54 Å²	54	1%	0.007	30%	0.298	C	S	.	.	H	α-helix	trans	-68.3	-45.9	175.8	-56	0	0	0	0	111.1	R260 Q842 L843 I844 K848 T849 L850	R260-S846 WeakPolarHBondContact CD-OG 3.35Å; R260-S846 PolarHBondContact NH1-OG 3.38Å; Q842-S846 WeakPolarHBondContact O-CB 3.39Å; Q842-S846 PolarHBondContact O-N 2.98Å; Q842-S846 PolarHBondContact O-OG 2.91Å; L843-S846 WeakPolarHBondContact O-CB 3.5Å; L843-S846 PolarHBondContact O-N 3.12Å; L843-S846 VanDerWaalsContact O-N 3.16Å; I844-S846 VanDerWaalsContact C-N 3.28Å; I844-S846 PolarHBondContact O-N 3.49Å; S846-K848 VanDerWaalsContact C-N 3.35Å; S846-K848 PolarHBondContact O-N 3.4Å; S846-T849 WeakPolarHBondContact O-CB 3.29Å; S846-T849 PolarHBondContact O-N 3.16Å; S846-L850 WeakPolarHBondContact O-CD1 3.31Å; S846-L850 PolarHBondContact O-N 3.35Å
847	F	87	Confident	75.9	Confident	1 Å²	1	46.7 Å²	46.7	0%	0.004	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-41.1	174	-80.5	-67.3	0	0	0	112.4	I261 L843 I844 T849 L850 G851 I857 M878 Y893 F896	I261-F847 HydrophobicContact CD1-CD1 3.65Å; I261-F847 HydrophobicContact CD1-CD2 4.32Å; I261-F847 HydrophobicContact CD1-CE1 3.67Å; I261-F847 HydrophobicContact CD1-CE2 4.34Å; I261-F847 HydrophobicContact CD1-CG 3.97Å; I261-F847 HydrophobicContact CD1-CZ 4.01Å; I261-F847 HydrophobicContact CG1-CD1 4.48Å; I261-F847 HydrophobicContact CG1-CD2 4.44Å; I261-F847 HydrophobicContact CG1-CE1 4.22Å; I261-F847 HydrophobicContact CG1-CE2 4.18Å; I261-F847 HydrophobicContact CG1-CZ 4.05Å; I261-F847 HydrophobicContact CG2-CE1 4.07Å; I261-F847 HydrophobicContact CG2-CZ 3.78Å; L843-F847 HydrophobicContact CD1-CD2 4.44Å; L843-F847 HydrophobicContact CD1-CE2 3.98Å; L843-F847 HydrophobicContact CD2-CE2 4.35Å; L843-F847 HydrophobicContact CG-CD2 4.11Å; L843-F847 HydrophobicContact CG-CE2 3.84Å; L843-F847 VanDerWaalsContact O-CD2 3.28Å; L843-F847 WeakPolarHBondContact O-CD2 3.47Å; L843-F847 PolarHBondContact O-N 3.35Å; I844-F847 PolarHBondContact O-N 3Å; F847-T849 VanDerWaalsContact C-N 3.28Å; F847-T849 PolarHBondContact O-N 2.83Å; F847-L850 PolarHBondContact O-N 3.35Å; F847-L850 VanDerWaalsContact O-N 3.17Å; F847-G851 PolarHBondContact O-N 3.04Å; F847-I857 HydrophobicContact CD1-CD1 4.13Å; F847-M878 HydrophobicContact CD1-CE 4.06Å; F847-M878 HydrophobicContact CE1-CE 3.68Å; F847-M878 HydrophobicContact CZ-CE 4.05Å; F847-Y893 HydrophobicContact CB-CD1 4.16Å; F847-Y893 HydrophobicContact CB-CD2 3.5Å; F847-Y893 VanDerWaalsContact CB-CD2 3.5Å; F847-Y893 HydrophobicContact CB-CE2 4.25Å; F847-Y893 HydrophobicContact CB-CG 3.48Å; F847-Y893 VanDerWaalsContact CB-CG 3.48Å; F847-Y893 HydrophobicContact CG-CD2 4.35Å; F847-Y893 HydrophobicContact CG-CG 4.17Å; F847-F896 HydrophobicContact CE2-CD1 4.04Å; F847-F896 HydrophobicContact CE2-CE1 4.24Å; F847-F896 AromaticContact CZ-CD1 3.93Å; F847-F896 HydrophobicContact CZ-CD1 3.93Å; F847-F896 AromaticContact CZ-CE1 3.8Å; F847-F896 HydrophobicContact CZ-CE1 3.8Å
848	K	85.4	Confident	77.6	Confident	72 Å²	72	44.7 Å²	44.7	31%	0.313	25%	0.252	S	S	.	.	H	α-helix	trans	-58.7	-41.1	173.8	-176.3	175.1	174.8	-174.9	0	111.7	I844 S846 G851 G852 D853 Y893	I844-K848 WeakPolarHBondContact O-CB 3.46Å; I844-K848 PolarHBondContact O-N 3.16Å; S846-K848 VanDerWaalsContact C-N 3.35Å; S846-K848 PolarHBondContact O-N 3.4Å; K848-G851 PolarHBondContact O-N 3.41Å; K848-G852 PolarHBondContact O-N 3Å; K848-D853 WeakPolarHBondContact O-CA 3.25Å; K848-D853 PolarHBondContact O-N 3.27Å; K848-Y893 HydrophobicContact CB-CE2 4.34Å
849	T	81	Confident	79.2	Confident	30 Å²	30	44.4 Å²	44.4	18%	0.184	25%	0.249	C	C	.	.	H	α-helix	trans	-64.3	-41.9	175.2	-54.9	0	0	0	0	111.6	K253 T254 A257 Q845 S846 F847 G851 G852	K253-T849 HydrophobicContact CB-CG2 4.28Å; T254-T849 HydrophobicContact CG2-CG2 4.16Å; A257-T849 HydrophobicContact CB-CG2 3.94Å; Q845-T849 WeakPolarHBondContact O-CB 3.47Å; Q845-T849 PolarHBondContact O-N 3.44Å; Q845-T849 PolarHBondContact O-OG1 3.09Å; S846-T849 WeakPolarHBondContact O-CB 3.29Å; S846-T849 PolarHBondContact O-N 3.16Å; F847-T849 VanDerWaalsContact C-N 3.28Å; F847-T849 PolarHBondContact O-N 2.83Å; T849-G851 VanDerWaalsContact C-N 3.34Å; T849-G851 PolarHBondContact O-N 2.78Å; T849-G852 PolarHBondContact O-N 2.89Å
850	L	81.3	Confident	80.3	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.2	-37.7	173.8	-91	86.6	0	0	0	112.9	A257 A258 I261 S846 F847 G852 I857 R865 L866	A257-L850 HydrophobicContact CB-CD1 3.73Å; A258-L850 HydrophobicContact CB-CD1 4.48Å; I261-L850 HydrophobicContact CD1-CD1 3.42Å; I261-L850 VanDerWaalsContact CD1-CD1 3.42Å; I261-L850 HydrophobicContact CD1-CD2 4.24Å; I261-L850 HydrophobicContact CD1-CG 4.39Å; S846-L850 WeakPolarHBondContact O-CD1 3.31Å; S846-L850 PolarHBondContact O-N 3.35Å; F847-L850 PolarHBondContact O-N 3.35Å; F847-L850 VanDerWaalsContact O-N 3.17Å; L850-G852 PolarHBondContact O-N 3.21Å; L850-I857 HydrophobicContact CB-CD1 3.87Å; L850-R865 HydrophobicContact CD2-CB 3.72Å; L850-R865 HydrophobicContact CD2-CG 4.48Å; L850-R865 HydrophobicContact CG-CB 4.32Å; L850-R865 PolarHBondContact O-NH1 2.78Å; L850-L866 HydrophobicContact CD2-CD1 4.47Å; L850-L866 HydrophobicContact CD2-CG 4.17Å
851	G	76.3	Confident	81	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.01	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-5.8	178.7	0	0	0	0	0	114.5	F847 K848 T849 K854	F847-G851 PolarHBondContact O-N 3.04Å; K848-G851 PolarHBondContact O-N 3.41Å; T849-G851 VanDerWaalsContact C-N 3.34Å; T849-G851 PolarHBondContact O-N 2.78Å; G851-K854 WeakPolarHBondContact O-CD 3.23Å; G851-K854 VanDerWaalsContact O-CE 3.29Å; G851-K854 WeakPolarHBondContact O-CE 3.3Å; G851-K854 VanDerWaalsContact O-CG 3.31Å; G851-K854 WeakPolarHBondContact O-CG 3.39Å
852	G	74.8	Confident	81.6	Confident	50 Å²	50	39.6 Å²	39.6	52%	0.515	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	45.7	-174.9	0	0	0	0	0	112.5	K848 T849 L850 K854	K848-G852 PolarHBondContact O-N 3Å; T849-G852 PolarHBondContact O-N 2.89Å; L850-G852 PolarHBondContact O-N 3.21Å; G852-K854 PolarHBondContact O-N 2.99Å; G852-K854 VanDerWaalsContact O-N 3.16Å
853	D	73.1	Confident	82.2	Confident	107 Å²	107	43.1 Å²	43.1	57%	0.572	24%	0.238	S	C	*	.	S	Bend	trans	60.8	18.9	-179.2	-72.2	-48.4	0	0	0	115.4	K848	K848-D853 WeakPolarHBondContact O-CA 3.25Å; K848-D853 PolarHBondContact O-N 3.27Å
854	K	75.9	Confident	82.3	Confident	84 Å²	84	48.7 Å²	48.7	37%	0.365	26%	0.264	S	S	.	.			trans	-80.2	141.3	170.8	-59.5	172.3	-158	156.9	0	108.9	G851 G852 Y856 Y893	G851-K854 WeakPolarHBondContact O-CD 3.23Å; G851-K854 VanDerWaalsContact O-CE 3.29Å; G851-K854 WeakPolarHBondContact O-CE 3.3Å; G851-K854 VanDerWaalsContact O-CG 3.31Å; G851-K854 WeakPolarHBondContact O-CG 3.39Å; G852-K854 PolarHBondContact O-N 2.99Å; G852-K854 VanDerWaalsContact O-N 3.16Å; K854-Y856 HydrophobicContact CB-CD1 4.12Å; K854-Y856 HydrophobicContact CB-CE1 4.05Å; K854-Y856 HydrophobicContact CB-CG 4.49Å; K854-Y856 WeakPolarHBondContact CB-O 3.15Å; K854-Y856 HydrophobicContact CD-CE1 4.29Å; K854-Y856 HydrophobicContact CD-CE2 4.1Å; K854-Y856 HydrophobicContact CG-CE1 4.47Å; K854-Y856 PolarHBondContact O-N 3.37Å; K854-Y893 PolarHBondContact O-OH 3.24Å
855	G	78.6	Confident	82.1	Confident	52 Å²	52	51.9 Å²	51.9	54%	0.536	28%	0.275	S	S	.	.	S	Bend	trans	-69.8	22.3	169.9	0	0	0	0	0	114.4
856	Y	83.2	Confident	82.2	Confident	65 Å²	65	48.6 Å²	48.6	26%	0.255	26%	0.26	S	S	.	.	S	Bend	trans	-156.1	159.5	175.1	64.9	-89.4	0	0	0	109.3	K854 T858 A890	K854-Y856 HydrophobicContact CB-CD1 4.12Å; K854-Y856 HydrophobicContact CB-CE1 4.05Å; K854-Y856 HydrophobicContact CB-CG 4.49Å; K854-Y856 WeakPolarHBondContact CB-O 3.15Å; K854-Y856 HydrophobicContact CD-CE1 4.29Å; K854-Y856 HydrophobicContact CD-CE2 4.1Å; K854-Y856 HydrophobicContact CG-CE1 4.47Å; K854-Y856 PolarHBondContact O-N 3.37Å; Y856-T858 HydrophobicContact CD2-CG2 4.36Å; Y856-T858 HydrophobicContact CE2-CG2 4.16Å; Y856-A890 HydrophobicContact CD2-CB 3.75Å; Y856-A890 HydrophobicContact CG-CB 4.03Å
857	I	86.7	Confident	82.2	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	149.3	174.9	-164.2	167.9	0	0	0	110.1	F847 L850 D861 I862 M878 L891 Y893	F847-I857 HydrophobicContact CD1-CD1 4.13Å; L850-I857 HydrophobicContact CB-CD1 3.87Å; I857-D861 HydrophobicContact CD1-CB 4.3Å; I857-D861 HydrophobicContact CG1-CB 3.7Å; I857-I862 HydrophobicContact CD1-CD1 4.32Å; I857-I862 HydrophobicContact CD1-CG1 3.59Å; I857-I862 HydrophobicContact CG1-CD1 4.48Å; I857-I862 HydrophobicContact CG1-CG1 3.92Å; I857-I862 HydrophobicContact CG2-CD1 4.12Å; I857-I862 HydrophobicContact CG2-CG1 4.48Å; I857-M878 HydrophobicContact CG2-CE 4.33Å; I857-M878 HydrophobicContact CG2-SD 3.55Å; I857-M878 VanDerWaalsContact CG2-SD 3.55Å; I857-L891 HydrophobicContact CG2-CB 3.94Å; I857-L891 PolarHBondContact N-O 3.45Å; I857-L891 WeakPolarHBondContact O-CB 3.44Å; I857-L891 PolarHBondContact O-N 3.06Å; I857-Y893 HydrophobicContact CB-CD1 4.02Å; I857-Y893 HydrophobicContact CG2-CD1 4.03Å
858	T	87.1	Confident	82	Confident	37 Å²	37	55.7 Å²	55.7	23%	0.227	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	161	176	70	0	0	0	0	111.5	Y856 Q860 D861 I862	Y856-T858 HydrophobicContact CD2-CG2 4.36Å; Y856-T858 HydrophobicContact CE2-CG2 4.16Å; T858-Q860 PolarHBondContact O-N 2.84Å; T858-D861 WeakPolarHBondContact CB-OD2 3.25Å; T858-D861 PolarHBondContact N-OD2 3.16Å; T858-D861 PolarHBondContact O-N 2.95Å; T858-D861 VanDerWaalsContact O-N 3.14Å; T858-D861 PolarHBondContact OG1-N 3.42Å; T858-D861 PolarHBondContact OG1-OD2 2.71Å; T858-I862 PolarHBondContact O-N 3.03Å
859	A	86.2	Confident	81.9	Confident	37 Å²	37	54 Å²	54	31%	0.306	32%	0.317	S	S	.	.	H	α-helix	trans	-59.4	-28.8	175	0	0	0	0	0	113.2	K863 L875	A859-K863 WeakPolarHBondContact O-CB 3.4Å; A859-K863 VanDerWaalsContact O-CG 3.26Å; A859-K863 WeakPolarHBondContact O-CG 3.33Å; A859-K863 PolarHBondContact O-N 3.01Å; A859-K863 VanDerWaalsContact O-N 3.13Å; A859-L875 HydrophobicContact CB-CD1 4.48Å; A859-L875 HydrophobicContact CB-CD2 3.58Å
860	Q	84.4	Confident	82.2	Confident	109 Å²	109	53.4 Å²	53.4	51%	0.509	31%	0.313	S	S	.	.	H	α-helix	trans	-69.7	-45.3	175.9	-171.9	65.1	13.9	0	0	111.1	T858 I862 K863 E864	T858-Q860 PolarHBondContact O-N 2.84Å; Q860-I862 PolarHBondContact O-N 3.43Å; Q860-K863 PolarHBondContact O-N 2.79Å; Q860-E864 HydrophobicContact CG-CG 4.31Å; Q860-E864 WeakPolarHBondContact CG-OE1 3.46Å; Q860-E864 PolarHBondContact NE2-OE1 3.28Å; Q860-E864 WeakPolarHBondContact O-CB 3.47Å; Q860-E864 WeakPolarHBondContact O-CG 3.09Å; Q860-E864 PolarHBondContact O-N 3.16Å
861	D	84.1	Confident	82.4	Confident	21 Å²	21	53.6 Å²	53.6	11%	0.112	32%	0.315	C	S	.	.	H	α-helix	trans	-58.7	-37.8	-179.7	-61.5	-49.2	0	0	0	112.1	I857 T858 R865	I857-D861 HydrophobicContact CD1-CB 4.3Å; I857-D861 HydrophobicContact CG1-CB 3.7Å; T858-D861 WeakPolarHBondContact CB-OD2 3.25Å; T858-D861 PolarHBondContact N-OD2 3.16Å; T858-D861 PolarHBondContact O-N 2.95Å; T858-D861 VanDerWaalsContact O-N 3.14Å; T858-D861 PolarHBondContact OG1-N 3.42Å; T858-D861 PolarHBondContact OG1-OD2 2.71Å; D861-R865 PolarHBondContact O-NH1 2.94Å; D861-R865 IonicContact OD1-NH1 3.08Å
862	I	85.2	Confident	83	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-69.6	-53	176.8	-64.7	176.5	0	0	0	110.5	I857 T858 Q860 E864 R865 L866 A871 C874 L875 M878 L891	I857-I862 HydrophobicContact CD1-CD1 4.32Å; I857-I862 HydrophobicContact CD1-CG1 3.59Å; I857-I862 HydrophobicContact CG1-CD1 4.48Å; I857-I862 HydrophobicContact CG1-CG1 3.92Å; I857-I862 HydrophobicContact CG2-CD1 4.12Å; I857-I862 HydrophobicContact CG2-CG1 4.48Å; T858-I862 PolarHBondContact O-N 3.03Å; Q860-I862 PolarHBondContact O-N 3.43Å; I862-E864 VanDerWaalsContact C-N 3.28Å; I862-E864 PolarHBondContact O-N 3.3Å; I862-R865 PolarHBondContact O-N 2.76Å; I862-L866 HydrophobicContact CG2-CD1 3.88Å; I862-L866 WeakPolarHBondContact O-CB 3.45Å; I862-L866 PolarHBondContact O-N 3.38Å; I862-A871 HydrophobicContact CG2-CB 3.72Å; I862-C874 HydrophobicContact CD1-CB 4.29Å; I862-C874 HydrophobicContact CG2-CB 4.14Å; I862-L875 HydrophobicContact CD1-CD2 4.22Å; I862-M878 HydrophobicContact CD1-CE 4.32Å; I862-M878 HydrophobicContact CD1-SD 4.24Å; I862-L891 HydrophobicContact CD1-CD1 3.85Å
863	K	86.6	Confident	83.5	Confident	128 Å²	128	58 Å²	58	56%	0.557	32%	0.321	S	S	*	.	H	α-helix	trans	-65.5	-28.5	-175.3	-75.1	178.2	-177.6	-175.2	0	113.7	A859 Q860 R865 A871 L875	A859-K863 WeakPolarHBondContact O-CB 3.4Å; A859-K863 VanDerWaalsContact O-CG 3.26Å; A859-K863 WeakPolarHBondContact O-CG 3.33Å; A859-K863 PolarHBondContact O-N 3.01Å; A859-K863 VanDerWaalsContact O-N 3.13Å; Q860-K863 PolarHBondContact O-N 2.79Å; K863-R865 VanDerWaalsContact C-N 3.32Å; K863-A871 HydrophobicContact CG-CB 4.1Å; K863-L875 HydrophobicContact CD-CD1 4.47Å; K863-L875 VanDerWaalsContact CE-CD1 3.42Å; K863-L875 HydrophobicContact CG-CD1 4.33Å
864	E	82.9	Confident	84.1	Confident	120 Å²	120	53 Å²	53	56%	0.561	29%	0.294	S	S	*	.	H	α-helix	trans	-72.9	-25.4	178.1	-77	179.2	178	0	0	113.2	Q860 I862	Q860-E864 HydrophobicContact CG-CG 4.31Å; Q860-E864 WeakPolarHBondContact CG-OE1 3.46Å; Q860-E864 PolarHBondContact NE2-OE1 3.28Å; Q860-E864 WeakPolarHBondContact O-CB 3.47Å; Q860-E864 WeakPolarHBondContact O-CG 3.09Å; Q860-E864 PolarHBondContact O-N 3.16Å; I862-E864 VanDerWaalsContact C-N 3.28Å; I862-E864 PolarHBondContact O-N 3.3Å
865	R	79.7	Confident	84.7	Confident	90 Å²	90	51.6 Å²	51.6	34%	0.34	29%	0.29	S	S	.	.	H	α-helix	trans	-119.8	-20.8	-167	-65.4	177.6	176.4	88.9	-2.7	114.5	L850 D861 I862 K863	L850-R865 HydrophobicContact CD2-CB 3.72Å; L850-R865 HydrophobicContact CD2-CG 4.48Å; L850-R865 HydrophobicContact CG-CB 4.32Å; L850-R865 PolarHBondContact O-NH1 2.78Å; D861-R865 PolarHBondContact O-NH1 2.94Å; D861-R865 IonicContact OD1-NH1 3.08Å; I862-R865 PolarHBondContact O-N 2.76Å; K863-R865 VanDerWaalsContact C-N 3.32Å
866	L	83.3	Confident	85	Confident	15 Å²	15	55.5 Å²	55.5	8%	0.079	29%	0.294	C	S	.	.	S	Bend	trans	-106.6	158.4	177.4	-64.6	176	0	0	0	111.2	A258 I261 L850 I862 D870 A871	A258-L866 HydrophobicContact CB-CD2 4.17Å; I261-L866 HydrophobicContact CB-CD2 4.19Å; I261-L866 HydrophobicContact CG2-CD1 3.91Å; I261-L866 HydrophobicContact CG2-CD2 3.98Å; L850-L866 HydrophobicContact CD2-CD1 4.47Å; L850-L866 HydrophobicContact CD2-CG 4.17Å; I862-L866 HydrophobicContact CG2-CD1 3.88Å; I862-L866 WeakPolarHBondContact O-CB 3.45Å; I862-L866 PolarHBondContact O-N 3.38Å; L866-D870 HydrophobicContact CB-CB 4.17Å; L866-A871 HydrophobicContact CB-CB 4.41Å
867	S	83.2	Confident	85.1	Confident	63 Å²	63	56 Å²	56	44%	0.441	30%	0.302	S	S	.	.			trans	-60.1	154.7	172.8	80.8	0	0	0	0	110.5	G869 D870 A871	S867-G869 PolarHBondContact O-N 3.37Å; S867-D870 PolarHBondContact O-N 3.28Å; S867-D870 VanDerWaalsContact O-N 3.12Å; S867-D870 WeakPolarHBondContact OG-CB 3.09Å; S867-D870 PolarHBondContact OG-N 3.18Å; S867-D870 PolarHBondContact OG-OD2 3.26Å; S867-A871 WeakPolarHBondContact O-CB 3.36Å; S867-A871 PolarHBondContact O-N 3.5Å
868	A	83.2	Confident	85.2	Confident	89 Å²	89	56.5 Å²	56.5	74%	0.736	30%	0.304	S	S	*	.	H	α-helix	trans	-54.9	-41	-177.9	0	0	0	0	0	112.7	E872	A868-E872 WeakPolarHBondContact O-CB 3.43Å; A868-E872 PolarHBondContact O-N 3.21Å
869	G	83.6	Confident	85.1	Confident	35 Å²	35	56.7 Å²	56.7	36%	0.361	31%	0.306	S	S	.	.	H	α-helix	trans	-68.4	-43.5	177.8	0	0	0	0	0	112.6	R269 S867 E872 Y873	R269-G869 PolarHBondContact NH2-O 2.76Å; S867-G869 PolarHBondContact O-N 3.37Å; G869-E872 PolarHBondContact O-N 3.21Å; G869-Y873 PolarHBondContact O-N 3.07Å
870	D	86.1	Confident	85.1	Confident	19 Å²	19	59.1 Å²	59.1	10%	0.102	32%	0.317	C	S	.	.	H	α-helix	trans	-65.5	-41.9	178.8	-63.8	-25.6	0	0	0	111.7	L265 R269 L866 S867 E872 Y873 C874	L265-D870 HydrophobicContact CD1-CB 3.68Å; R269-D870 IonicContact CZ-OD1 3.47Å; R269-D870 IonicContact NH1-OD1 2.83Å; R269-D870 PolarHBondContact NH1-OD1 3.43Å; R269-D870 IonicContact NH2-OD1 3.43Å; L866-D870 HydrophobicContact CB-CB 4.17Å; S867-D870 PolarHBondContact O-N 3.28Å; S867-D870 VanDerWaalsContact O-N 3.12Å; S867-D870 WeakPolarHBondContact OG-CB 3.09Å; S867-D870 PolarHBondContact OG-N 3.18Å; S867-D870 PolarHBondContact OG-OD2 3.26Å; D870-E872 PolarHBondContact O-N 3.3Å; D870-Y873 PolarHBondContact O-N 3.19Å; D870-C874 PolarHBondContact O-N 2.84Å; D870-C874 PolarHBondContact O-SG 3.47Å
871	A	86.8	Confident	84.9	Confident	3 Å²	3	55.7 Å²	55.7	3%	0.025	30%	0.302	C	S	.	.	H	α-helix	trans	-60.4	-45.4	174.9	0	0	0	0	0	111.4	I862 K863 L866 S867 Y873 C874 L875	I862-A871 HydrophobicContact CG2-CB 3.72Å; K863-A871 HydrophobicContact CG-CB 4.1Å; L866-A871 HydrophobicContact CB-CB 4.41Å; S867-A871 WeakPolarHBondContact O-CB 3.36Å; S867-A871 PolarHBondContact O-N 3.5Å; A871-Y873 PolarHBondContact O-N 3.09Å; A871-C874 PolarHBondContact O-N 3.5Å; A871-L875 WeakPolarHBondContact O-CB 3.35Å; A871-L875 WeakPolarHBondContact O-CG 3.48Å; A871-L875 PolarHBondContact O-N 2.96Å
872	E	87.8	Confident	84.4	Confident	118 Å²	118	61.6 Å²	61.6	55%	0.551	33%	0.333	S	S	*	.	H	α-helix	trans	-61.2	-43.7	177.8	-176.4	167.4	-158.3	0	0	112.2	A868 G869 D870 L875 Q876	A868-E872 WeakPolarHBondContact O-CB 3.43Å; A868-E872 PolarHBondContact O-N 3.21Å; G869-E872 PolarHBondContact O-N 3.21Å; D870-E872 PolarHBondContact O-N 3.3Å; E872-L875 PolarHBondContact O-N 3.4Å; E872-Q876 WeakPolarHBondContact O-CG 3.34Å; E872-Q876 PolarHBondContact O-N 3.37Å; E872-Q876 PolarHBondContact OE1-NE2 3.18Å
873	Y	85.5	Confident	83.7	Confident	27 Å²	27	63.5 Å²	63.5	11%	0.106	35%	0.353	C	S	.	.	H	α-helix	trans	-63.4	-44	176.8	-177.9	-83.2	0	0	0	112.5	L265 I268 R269 Q272 G869 D870 A871 L875 Q876 N877 F896	L265-Y873 HydrophobicContact CD2-CD1 3.55Å; L265-Y873 HydrophobicContact CD2-CE1 3.71Å; I268-Y873 WeakPolarHBondContact CG2-OH 3.46Å; R269-Y873 HydrophobicContact CG-CE2 4.35Å; Q272-Y873 PolarHBondContact NE2-OH 3.24Å; Q272-Y873 PolarHBondContact OE1-OH 3.42Å; G869-Y873 PolarHBondContact O-N 3.07Å; D870-Y873 PolarHBondContact O-N 3.19Å; A871-Y873 PolarHBondContact O-N 3.09Å; Y873-L875 VanDerWaalsContact C-N 3.32Å; Y873-L875 PolarHBondContact O-N 2.92Å; Y873-Q876 PolarHBondContact O-N 3.39Å; Y873-N877 WeakPolarHBondContact O-CB 3.41Å; Y873-N877 PolarHBondContact O-N 3.22Å; Y873-N877 VanDerWaalsContact O-N 3.16Å; Y873-N877 PolarHBondContact O-ND2 2.9Å; Y873-F896 HydrophobicContact CD1-CZ 4.39Å; Y873-F896 HydrophobicContact CE1-CZ 4.22Å
874	C	86.3	Confident	82.7	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-59	-45.4	173.9	-75	0	0	0	0	111.1	I862 D870 A871 Q876 N877 M878	I862-C874 HydrophobicContact CD1-CB 4.29Å; I862-C874 HydrophobicContact CG2-CB 4.14Å; D870-C874 PolarHBondContact O-N 2.84Å; D870-C874 PolarHBondContact O-SG 3.47Å; A871-C874 PolarHBondContact O-N 3.5Å; C874-Q876 VanDerWaalsContact C-N 3.33Å; C874-Q876 PolarHBondContact O-N 2.89Å; C874-N877 PolarHBondContact O-N 3.03Å; C874-M878 WeakPolarHBondContact O-CA 3.28Å; C874-M878 WeakPolarHBondContact O-CB 3.41Å; C874-M878 PolarHBondContact O-N 3.14Å
875	L	87.4	Confident	81.9	Confident	55 Å²	55	64.5 Å²	64.5	29%	0.288	36%	0.362	S	S	.	.	H	α-helix	trans	-67.5	-31.8	-177.6	-68.6	171.1	0	0	0	113.5	A859 I862 K863 A871 E872 Y873 L891	A859-L875 HydrophobicContact CB-CD1 4.48Å; A859-L875 HydrophobicContact CB-CD2 3.58Å; I862-L875 HydrophobicContact CD1-CD2 4.22Å; K863-L875 HydrophobicContact CD-CD1 4.47Å; K863-L875 VanDerWaalsContact CE-CD1 3.42Å; K863-L875 HydrophobicContact CG-CD1 4.33Å; A871-L875 WeakPolarHBondContact O-CB 3.35Å; A871-L875 WeakPolarHBondContact O-CG 3.48Å; A871-L875 PolarHBondContact O-N 2.96Å; E872-L875 PolarHBondContact O-N 3.4Å; Y873-L875 VanDerWaalsContact C-N 3.32Å; Y873-L875 PolarHBondContact O-N 2.92Å; L875-L891 HydrophobicContact CD2-CD1 3.6Å
876	Q	86.3	Confident	81.1	Confident	135 Å²	135	60.6 Å²	60.6	63%	0.631	35%	0.35	S	S	*	.	H	α-helix	trans	-75.3	-31.4	176.9	-73.2	177.9	4.5	0	0	112.8	E872 Y873 C874	E872-Q876 WeakPolarHBondContact O-CG 3.34Å; E872-Q876 PolarHBondContact O-N 3.37Å; E872-Q876 PolarHBondContact OE1-NE2 3.18Å; Y873-Q876 PolarHBondContact O-N 3.39Å; C874-Q876 VanDerWaalsContact C-N 3.33Å; C874-Q876 PolarHBondContact O-N 2.89Å
877	N	85.2	Confident	80.1	Confident	76 Å²	76	67 Å²	67	41%	0.406	38%	0.384	S	S	.	.	H	α-helix	trans	-108.8	-16.3	-170.8	-65.7	-77.7	0	0	0	114.4	Y873 C874 F896	Y873-N877 WeakPolarHBondContact O-CB 3.41Å; Y873-N877 PolarHBondContact O-N 3.22Å; Y873-N877 VanDerWaalsContact O-N 3.16Å; Y873-N877 PolarHBondContact O-ND2 2.9Å; C874-N877 PolarHBondContact O-N 3.03Å; N877-F896 HydrophobicContact CB-CD2 4.21Å; N877-F896 HydrophobicContact CB-CE2 3.5Å; N877-F896 VanDerWaalsContact CB-CE2 3.5Å; N877-F896 HydrophobicContact CB-CZ 4.38Å
878	M	88.2	Confident	79.3	Confident	9 Å²	9	69 Å²	69	4%	0.044	40%	0.399	C	S	.	.	S	Bend	trans	-83.6	124.2	-180	-169.6	177.6	-69.8	0	0	110.5	F847 I857 I862 C874 L891 D892 F896	F847-M878 HydrophobicContact CD1-CE 4.06Å; F847-M878 HydrophobicContact CE1-CE 3.68Å; F847-M878 HydrophobicContact CZ-CE 4.05Å; I857-M878 HydrophobicContact CG2-CE 4.33Å; I857-M878 HydrophobicContact CG2-SD 3.55Å; I857-M878 VanDerWaalsContact CG2-SD 3.55Å; I862-M878 HydrophobicContact CD1-CE 4.32Å; I862-M878 HydrophobicContact CD1-SD 4.24Å; C874-M878 WeakPolarHBondContact O-CA 3.28Å; C874-M878 WeakPolarHBondContact O-CB 3.41Å; C874-M878 PolarHBondContact O-N 3.14Å; M878-L891 HydrophobicContact CG-CB 3.92Å; M878-L891 HydrophobicContact SD-CB 3.48Å; M878-L891 WeakPolarHBondContact SD-CB 3.25Å; M878-L891 HydrophobicContact SD-CD1 4.13Å; M878-L891 HydrophobicContact SD-CG 4.41Å; M878-D892 WeakPolarHBondContact CG-O 3.38Å; M878-F896 HydrophobicContact CB-CB 4.25Å; M878-F896 HydrophobicContact CB-CD2 4.19Å; M878-F896 HydrophobicContact CB-CG 4.09Å; M878-F896 HydrophobicContact CE-CB 4.28Å; M878-F896 HydrophobicContact CE-CD1 3.5Å; M878-F896 VanDerWaalsContact CE-CD1 3.5Å; M878-F896 HydrophobicContact CE-CE1 4Å; M878-F896 HydrophobicContact CE-CG 4.05Å; M878-F896 HydrophobicContact CG-CB 3.85Å; M878-F896 HydrophobicContact CG-CG 4.14Å
879	P	85.9	Confident	79.1	Confident	42 Å²	42	66.8 Å²	66.8	27%	0.273	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-70.7	152.7	-179	25.6	-28.3	0	0	0	111.9	D892 R895	P879-D892 HydrophobicContact CG-CB 4.24Å; P879-D892 PolarHBondContact O-N 2.75Å; P879-R895 HydrophobicContact CG-CB 3.92Å; P879-R895 HydrophobicContact CG-CG 3.97Å
880	V	84.9	Confident	79.1	Confident	87 Å²	87	65.2 Å²	65.2	53%	0.527	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-74.9	139.1	172.6	-176.9	0	0	0	0	109.5	L891	V880-L891 HydrophobicContact CG2-CD2 4.19Å
881	L	81	Confident	79.3	Confident	38 Å²	38	65.2 Å²	65.2	20%	0.199	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-67.1	136.7	179.1	-164.8	78.9	0	0	0	110.7	R885 G886 A890 D892	L881-R885 HydrophobicContact CD2-CB 4.18Å; L881-G886 WeakPolarHBondContact O-CA 3.31Å; L881-A890 HydrophobicContact CB-CB 4.29Å; L881-A890 PolarHBondContact N-O 3.36Å; L881-D892 HydrophobicContact CD1-CB 3.85Å
882	N	72.4	Confident	79.3	Confident	145 Å²	145	66.6 Å²	66.6	78%	0.775	38%	0.375	S	S	*	.	S	Bend	trans	-73.3	135.3	176.8	-69.4	-38.2	0	0	0	111.8
883	G	71.4	Confident	79.3	Confident	40 Å²	40	61.1 Å²	61.1	41%	0.412	35%	0.349	S	S	.	.	S	Bend	trans	110	-173.1	174.4	0	0	0	0	0	114.3	R885 G886	G883-R885 PolarHBondContact O-N 2.86Å; G883-G886 PolarHBondContact O-N 2.73Å
884	P	66.6	Low	79.3	Confident	110 Å²	110	64 Å²	64	71%	0.714	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-23.5	-171.5	-22.7	31.8	0	0	0	114.4
885	R	64.7	Low	79.2	Confident	159 Å²	159	70.3 Å²	70.3	60%	0.6	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-32.9	176.8	-67.9	-178.8	176.9	174.5	-1.2	112	L881 G883 D887 S888 A890	L881-R885 HydrophobicContact CD2-CB 4.18Å; G883-R885 PolarHBondContact O-N 2.86Å; R885-D887 VanDerWaalsContact C-N 3.34Å; R885-S888 PolarHBondContact O-N 2.69Å; R885-S888 VanDerWaalsContact O-N 3.16Å; R885-A890 HydrophobicContact CB-CB 4.22Å; R885-A890 WeakPolarHBondContact O-CB 3.49Å; R885-A890 PolarHBondContact O-N 3.24Å
886	G	64.2	Low	79.1	Confident	8 Å²	8	67.8 Å²	67.8	8%	0.082	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-62.4	-40.6	174.7	0	0	0	0	0	112.7	L881 G883 S888 G889	L881-G886 WeakPolarHBondContact O-CA 3.31Å; G883-G886 PolarHBondContact O-N 2.73Å; G886-S888 PolarHBondContact O-N 2.87Å; G886-G889 PolarHBondContact O-N 3.43Å
887	D	61.2	Low	78.9	Confident	149 Å²	149	61.3 Å²	61.3	80%	0.797	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-60.5	-20.2	176.2	-60.9	-27	0	0	0	112.7	R885	R885-D887 VanDerWaalsContact C-N 3.34Å
888	S	67.5	Low	78.6	Confident	106 Å²	106	59.9 Å²	59.9	74%	0.741	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-95.3	9.3	176.1	-54.4	0	0	0	0	113.7	R885 G886	R885-S888 PolarHBondContact O-N 2.69Å; R885-S888 VanDerWaalsContact O-N 3.16Å; G886-S888 PolarHBondContact O-N 2.87Å
889	G	78.8	Confident	77.9	Confident	41 Å²	41	63.1 Å²	63.1	42%	0.423	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	21.7	177.6	0	0	0	0	0	115.5	G886	G886-G889 PolarHBondContact O-N 3.43Å
890	A	84.1	Confident	77.2	Confident	3 Å²	3	62.1 Å²	62.1	3%	0.025	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	131	174.8	0	0	0	0	0	111.8	Y856 L881 R885	Y856-A890 HydrophobicContact CD2-CB 3.75Å; Y856-A890 HydrophobicContact CG-CB 4.03Å; L881-A890 HydrophobicContact CB-CB 4.29Å; L881-A890 PolarHBondContact N-O 3.36Å; R885-A890 HydrophobicContact CB-CB 4.22Å; R885-A890 WeakPolarHBondContact O-CB 3.49Å; R885-A890 PolarHBondContact O-N 3.24Å
891	L	88.6	Confident	76.3	Confident	18 Å²	18	59.4 Å²	59.4	9%	0.094	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	147.7	-179.9	-56.9	169.6	0	0	0	111.2	I857 I862 L875 M878 V880	I857-L891 HydrophobicContact CG2-CB 3.94Å; I857-L891 PolarHBondContact N-O 3.45Å; I857-L891 WeakPolarHBondContact O-CB 3.44Å; I857-L891 PolarHBondContact O-N 3.06Å; I862-L891 HydrophobicContact CD1-CD1 3.85Å; L875-L891 HydrophobicContact CD2-CD1 3.6Å; M878-L891 HydrophobicContact CG-CB 3.92Å; M878-L891 HydrophobicContact SD-CB 3.48Å; M878-L891 WeakPolarHBondContact SD-CB 3.25Å; M878-L891 HydrophobicContact SD-CD1 4.13Å; M878-L891 HydrophobicContact SD-CG 4.41Å; V880-L891 HydrophobicContact CG2-CD2 4.19Å
892	D	88.4	Confident	75.1	Confident	33 Å²	33	59.9 Å²	59.9	18%	0.176	35%	0.347	C	S	.	.			trans	-98	93.1	-178.2	-179	-6.9	0	0	0	110.2	M878 P879 L881 E894 R895 F896	M878-D892 WeakPolarHBondContact CG-O 3.38Å; P879-D892 HydrophobicContact CG-CB 4.24Å; P879-D892 PolarHBondContact O-N 2.75Å; L881-D892 HydrophobicContact CD1-CB 3.85Å; D892-E894 VanDerWaalsContact C-N 3.33Å; D892-E894 PolarHBondContact OD1-N 2.98Å; D892-R895 PolarHBondContact OD1-N 3.26Å; D892-R895 WeakPolarHBondContact OD2-CB 3.5Å; D892-F896 PolarHBondContact O-N 2.98Å
893	Y	88	Confident	74.3	Confident	3 Å²	3	61.6 Å²	61.6	1%	0.012	34%	0.343	C	S	.	.	H	α-helix	trans	-74.7	-22.2	179.3	63.5	-103.8	0	0	0	113.1	I844 F847 K848 K854 I857 A897	I844-Y893 HydrophobicContact CG2-CE2 4.02Å; F847-Y893 HydrophobicContact CB-CD1 4.16Å; F847-Y893 HydrophobicContact CB-CD2 3.5Å; F847-Y893 VanDerWaalsContact CB-CD2 3.5Å; F847-Y893 HydrophobicContact CB-CE2 4.25Å; F847-Y893 HydrophobicContact CB-CG 3.48Å; F847-Y893 VanDerWaalsContact CB-CG 3.48Å; F847-Y893 HydrophobicContact CG-CD2 4.35Å; F847-Y893 HydrophobicContact CG-CG 4.17Å; K848-Y893 HydrophobicContact CB-CE2 4.34Å; K854-Y893 PolarHBondContact O-OH 3.24Å; I857-Y893 HydrophobicContact CB-CD1 4.02Å; I857-Y893 HydrophobicContact CG2-CD1 4.03Å; Y893-A897 WeakPolarHBondContact O-CB 3.48Å; Y893-A897 PolarHBondContact O-N 3.43Å
894	E	84.9	Confident	73	Confident	87 Å²	87	68.8 Å²	68.8	41%	0.407	36%	0.363	S	S	.	.	H	α-helix	trans	-69	-51.8	-179.9	-65.9	-176	176.6	0	0	109.1	I844 D892 F896 A897 Y898	I844-E894 HydrophobicContact CG2-CG 4.26Å; D892-E894 VanDerWaalsContact C-N 3.33Å; D892-E894 PolarHBondContact OD1-N 2.98Å; E894-F896 PolarHBondContact O-N 3.39Å; E894-A897 WeakPolarHBondContact O-CB 3.18Å; E894-A897 PolarHBondContact O-N 3.02Å; E894-Y898 HydrophobicContact CB-CE2 4.46Å; E894-Y898 WeakPolarHBondContact O-CD2 3.46Å; E894-Y898 PolarHBondContact O-N 2.7Å
895	R	83.2	Confident	72	Confident	133 Å²	133	66.9 Å²	66.9	50%	0.502	35%	0.35	S	S	.	.	H	α-helix	trans	-61.4	-32.9	177.3	-170.5	170.4	-177.7	176.3	1.7	113	P879 D892 S899	P879-R895 HydrophobicContact CG-CB 3.92Å; P879-R895 HydrophobicContact CG-CG 3.97Å; D892-R895 PolarHBondContact OD1-N 3.26Å; D892-R895 WeakPolarHBondContact OD2-CB 3.5Å; R895-S899 PolarHBondContact O-N 2.74Å
896	F	86.1	Confident	70.9	Confident	1 Å²	1	68.7 Å²	68.7	0%	0.004	38%	0.379	C	S	.	.	H	α-helix	trans	-68.2	-42.3	173.2	179.9	-115.4	0	0	0	112.5	L265 F847 Y873 N877 M878 D892 E894 Y898 S899 I900	L265-F896 HydrophobicContact CD2-CZ 4.32Å; F847-F896 HydrophobicContact CE2-CD1 4.04Å; F847-F896 HydrophobicContact CE2-CE1 4.24Å; F847-F896 AromaticContact CZ-CD1 3.93Å; F847-F896 HydrophobicContact CZ-CD1 3.93Å; F847-F896 AromaticContact CZ-CE1 3.8Å; F847-F896 HydrophobicContact CZ-CE1 3.8Å; Y873-F896 HydrophobicContact CD1-CZ 4.39Å; Y873-F896 HydrophobicContact CE1-CZ 4.22Å; N877-F896 HydrophobicContact CB-CD2 4.21Å; N877-F896 HydrophobicContact CB-CE2 3.5Å; N877-F896 VanDerWaalsContact CB-CE2 3.5Å; N877-F896 HydrophobicContact CB-CZ 4.38Å; M878-F896 HydrophobicContact CB-CB 4.25Å; M878-F896 HydrophobicContact CB-CD2 4.19Å; M878-F896 HydrophobicContact CB-CG 4.09Å; M878-F896 HydrophobicContact CE-CB 4.28Å; M878-F896 HydrophobicContact CE-CD1 3.5Å; M878-F896 VanDerWaalsContact CE-CD1 3.5Å; M878-F896 HydrophobicContact CE-CE1 4Å; M878-F896 HydrophobicContact CE-CG 4.05Å; M878-F896 HydrophobicContact CG-CB 3.85Å; M878-F896 HydrophobicContact CG-CG 4.14Å; D892-F896 PolarHBondContact O-N 2.98Å; E894-F896 PolarHBondContact O-N 3.39Å; F896-Y898 VanDerWaalsContact C-N 3.34Å; F896-Y898 PolarHBondContact O-N 3.01Å; F896-S899 PolarHBondContact O-N 3.48Å; F896-S899 PolarHBondContact O-OG 3.29Å; F896-I900 HydrophobicContact CD1-CD1 3.77Å; F896-I900 HydrophobicContact CD2-CD1 3.93Å; F896-I900 HydrophobicContact CD2-CG1 4.4Å; F896-I900 HydrophobicContact CE1-CD1 3.33Å; F896-I900 HydrophobicContact CE2-CD1 3.46Å; F896-I900 VanDerWaalsContact CE2-CD1 3.46Å; F896-I900 HydrophobicContact CE2-CG1 4.12Å; F896-I900 HydrophobicContact CG-CD1 4.08Å; F896-I900 HydrophobicContact CZ-CD1 3.19Å; F896-I900 HydrophobicContact CZ-CG1 4.3Å; F896-I900 WeakPolarHBondContact O-CB 3.41Å; F896-I900 WeakPolarHBondContact O-CG1 3.43Å; F896-I900 PolarHBondContact O-N 2.93Å; F896-I900 VanDerWaalsContact O-N 3.07Å
897	A	81.7	Confident	71.2	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-61.9	-42.9	174.6	0	0	0	0	0	111.4	L843 I844 Y893 E894 I900 C901	L843-A897 HydrophobicContact CD2-CB 4.02Å; L843-A897 HydrophobicContact CG-CB 4.35Å; I844-A897 HydrophobicContact CD1-CB 4.37Å; I844-A897 HydrophobicContact CG1-CB 3.62Å; Y893-A897 WeakPolarHBondContact O-CB 3.48Å; Y893-A897 PolarHBondContact O-N 3.43Å; E894-A897 WeakPolarHBondContact O-CB 3.18Å; E894-A897 PolarHBondContact O-N 3.02Å; A897-I900 PolarHBondContact O-N 3.07Å; A897-C901 WeakPolarHBondContact O-CB 3.23Å; A897-C901 PolarHBondContact O-N 2.88Å; A897-C901 PolarHBondContact O-SG 3.38Å
898	Y	78	Confident	71.8	Confident	45 Å²	45	67.6 Å²	67.6	18%	0.176	37%	0.373	C	S	.	.	H	α-helix	trans	-58.2	-49.4	173.9	-79.7	-65.6	0	0	0	112.8	E840 I844 E894 F896 I900 C901 G902 R903 P905	E840-Y898 HydrophobicContact CG-CD1 4.28Å; E840-Y898 HydrophobicContact CG-CE1 4.3Å; E840-Y898 WeakPolarHBondContact OE1-CD1 3.47Å; E840-Y898 WeakPolarHBondContact OE1-CE1 3.39Å; E840-Y898 PolarHBondContact OE1-OH 3.21Å; E840-Y898 VanDerWaalsContact OE1-OH 3.06Å; E840-Y898 WeakPolarHBondContact OE2-CD1 3.43Å; E840-Y898 WeakPolarHBondContact OE2-CE1 3.11Å; I844-Y898 HydrophobicContact CD1-CE2 4.33Å; E894-Y898 HydrophobicContact CB-CE2 4.46Å; E894-Y898 WeakPolarHBondContact O-CD2 3.46Å; E894-Y898 PolarHBondContact O-N 2.7Å; F896-Y898 VanDerWaalsContact C-N 3.34Å; F896-Y898 PolarHBondContact O-N 3.01Å; Y898-I900 VanDerWaalsContact C-N 3.3Å; Y898-I900 PolarHBondContact O-N 2.82Å; Y898-C901 PolarHBondContact O-N 3.17Å; Y898-G902 PolarHBondContact O-N 3.44Å; Y898-R903 CarbonylContact C-O 3.49Å; Y898-R903 WeakPolarHBondContact CB-O 3.42Å; Y898-R903 HydrophobicContact CD1-CB 4.25Å; Y898-R903 PolarHBondContact O-N 3.13Å; Y898-R903 VanDerWaalsContact O-N 3.13Å; Y898-R903 VanDerWaalsContact O-O 3.07Å; Y898-P905 HydrophobicContact CD2-CB 3.82Å; Y898-P905 HydrophobicContact CE2-CB 4.14Å; Y898-P905 HydrophobicContact CG-CB 4.16Å
899	S	74.1	Confident	72	Confident	78 Å²	78	65.5 Å²	65.5	55%	0.545	35%	0.352	S	S	.	.	H	α-helix	trans	-63.5	-38.7	-177.9	70	0	0	0	0	112	R895 F896 G902	R895-S899 PolarHBondContact O-N 2.74Å; F896-S899 PolarHBondContact O-N 3.48Å; F896-S899 PolarHBondContact O-OG 3.29Å; S899-G902 PolarHBondContact O-N 2.98Å
900	I	71.4	Confident	71.6	Confident	20 Å²	20	66.9 Å²	66.9	10%	0.103	35%	0.348	C	S	.	.	H	α-helix	trans	-67.3	-39.6	177.2	-77.2	174.9	0	0	0	112.4	I268 K349 L843 F896 A897 Y898 G902	I268-I900 HydrophobicContact CD1-CB 4.19Å; I268-I900 HydrophobicContact CD1-CD1 3.74Å; I268-I900 HydrophobicContact CD1-CG1 3.9Å; I268-I900 HydrophobicContact CD1-CG2 3.28Å; I268-I900 HydrophobicContact CG1-CG2 3.99Å; K349-I900 WeakPolarHBondContact CE-O 3.4Å; K349-I900 PolarHBondContact NZ-O 3.23Å; L843-I900 HydrophobicContact CD2-CG2 4.43Å; F896-I900 HydrophobicContact CD1-CD1 3.77Å; F896-I900 HydrophobicContact CD2-CD1 3.93Å; F896-I900 HydrophobicContact CD2-CG1 4.4Å; F896-I900 HydrophobicContact CE1-CD1 3.33Å; F896-I900 HydrophobicContact CE2-CD1 3.46Å; F896-I900 VanDerWaalsContact CE2-CD1 3.46Å; F896-I900 HydrophobicContact CE2-CG1 4.12Å; F896-I900 HydrophobicContact CG-CD1 4.08Å; F896-I900 HydrophobicContact CZ-CD1 3.19Å; F896-I900 HydrophobicContact CZ-CG1 4.3Å; F896-I900 WeakPolarHBondContact O-CB 3.41Å; F896-I900 WeakPolarHBondContact O-CG1 3.43Å; F896-I900 PolarHBondContact O-N 2.93Å; F896-I900 VanDerWaalsContact O-N 3.07Å; A897-I900 PolarHBondContact O-N 3.07Å; Y898-I900 VanDerWaalsContact C-N 3.3Å; Y898-I900 PolarHBondContact O-N 2.82Å; I900-G902 VanDerWaalsContact C-N 3.28Å
901	C	65.5	Low	70.8	Confident	30 Å²	30	70.9 Å²	70.9	20%	0.203	37%	0.368	C	S	.	.	H	α-helix	trans	-84.5	-2.4	-178.7	-59.6	0	0	0	0	112.6	E840 A897 Y898	E840-C901 HydrophobicContact CB-CB 4.41Å; E840-C901 HydrophobicContact CG-CB 4.36Å; A897-C901 WeakPolarHBondContact O-CB 3.23Å; A897-C901 PolarHBondContact O-N 2.88Å; A897-C901 PolarHBondContact O-SG 3.38Å; Y898-C901 PolarHBondContact O-N 3.17Å
902	G	56.9	Low	69.6	Low	48 Å²	48	74.5 Å²	74.5	50%	0.495	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	16	174.2	0	0	0	0	0	114.9	Y898 S899 I900	Y898-G902 PolarHBondContact O-N 3.44Å; S899-G902 PolarHBondContact O-N 2.98Å; I900-G902 VanDerWaalsContact C-N 3.28Å
903	R	54.7	Low	68.3	Low	182 Å²	182	77.4 Å²	77.4	69%	0.687	40%	0.402	S	S	*	.			trans	-106.9	146.8	175	-72.9	-173.9	178.7	179.4	2.2	110.9	Y898	Y898-R903 CarbonylContact C-O 3.49Å; Y898-R903 WeakPolarHBondContact CB-O 3.42Å; Y898-R903 HydrophobicContact CD1-CB 4.25Å; Y898-R903 PolarHBondContact O-N 3.13Å; Y898-R903 VanDerWaalsContact O-N 3.13Å; Y898-R903 VanDerWaalsContact O-O 3.07Å
904	K	45.1	Very low	66.8	Low	190 Å²	190	83.2 Å²	83.2	83%	0.826	43%	0.432	S	S	*	.			trans	-80	137.7	170.5	-71.6	-178.1	178.7	177.1	0	108.3	T906	K904-T906 PolarHBondContact O-N 3.39Å
905	P	46	Very low	65.3	Low	71 Å²	71	82.8 Å²	82.8	46%	0.461	43%	0.434	S	S	.	.			trans	-57.3	130.7	173	23.5	-31.5	0	0	0	109	Y898	Y898-P905 HydrophobicContact CD2-CB 3.82Å; Y898-P905 HydrophobicContact CE2-CB 4.14Å; Y898-P905 HydrophobicContact CG-CB 4.16Å
906	T	40.5	Very low	63.6	Low	196 Å²	196	78.3 Å²	78.3	100%	1.202	43%	0.428	S	S	*	.			trans	-69.4	0	175.9	46.5	0	0	0	0	112.6	K904	K904-T906 PolarHBondContact O-N 3.39Å

Retrieved 906 of 906 residues in 858.8 ms (Link to these results)

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