A0A077Z9N8_TRITR Loading...

AMP-activated protein kinase glycogen-binding domain-containing protein

Non-catalytic subunit of AMP-activated protein kinase (AMPK), an energy sensor protein kinase that plays a key role in regulating cellular energy metabolism. In response to reduction of intracellular ATP levels, AMPK activates energy-producing pathways and inhibits energy-consuming processes: inhibits protein, carbohydrate and lipid biosynthesis, as well as cell growth and proliferation. AMPK acts via direct phosphorylation of metabolic enzymes, and by longer-term effects via phosphorylation of transcription regulators. Also acts as a regulator of cellular polarity by remodeling the actin cytoskeleton; probably by indirectly activating myosin. Beta non-catalytic subunit acts as a scaffold on which the AMPK complex assembles, via its C-terminus that bridges alpha (PRKAA1 or PRKAA2) and gamma subunits (PRKAG1, PRKAG2 or PRKAG3).

AlphaFold DB , UniProt , Accession A0A077Z9N8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,072 aa.

						>A0A077Z9N8_TRITR|A0A077Z9N8
MAHLRTGKMSSNGYGEMNLIDSLVHWFAKSQKIITAMQQRWKQHGLPLEEFDCGEVRDCEEEMLRFVQDIRNLQSSCSVLNASLETKDRELSELRLAHLTALEEKVKSQRALEDHLSYCKKSVADSRADDNWEDFNALKKLYEDNLLLSAELDGKLSKKNEELCVAANRLETAEKERANFISEVNETKNRCRELEEQLRSSKADLERHRNHLEKAAESVRSLERCCTEAENRCKELKNELDQKTAEVFSLQDNIRDLQQQLGSARKIGEEAEQRNDEPEAMVRTIKYTMAHDDGMQANIPQNSERPMSYADMERHCESLNTLLHEKDAEVKELQHTVRLLQQEMCSDHPESDSMQQRSSELEAQLESAKNEIGRLTADHEASKEYDAAVKRCDEMGQRQKELEAAMERKEVEVETLQANMEDLEEKIRCANKRGDDAQWRCGELEAELEKANREIQSLKADLKEQEKNIEKLNIYEDMVNRCGELDRALKQKEEEVCKLQSSMEGLQDALRCAHKRGDDAQWRCGELEADLGRARDELGRLRSRLTEVEDSNKRLDKLYNDTKWRNGELEAMLRNKDGEIYHLKNALDNLENEKKWLLSEMDKLGARCKELENRSSVSENAEGLKAELASLTTENERMKIQIDKHYKAARTSPDHTLNQVSREEAYDELSSELYKLHQKKYSLEKEMSEVQTELFSYQQNQLKLMEERKGLEDELTRTRESAGRLEWFNGELEAQKRSLEQQLADKNNEIQNLKEQIYNYNSNGQIPAELVSKINYLETELRNTHDSLRDASDKAKWYKGEVDYFRQELSNCHGRIQWLESELNRVHGLLNKQKDSGVSDQWDKLEAEKNCLLEELNTLRDQLREEGDKRRWYQGEKEYFSNMSQDLAAQLQSLRISFETRGEQPDDRLIREQLERQLREMTDKAKWYEGEKEHFKSELTNCAQRCHELERICDQIAHLPDDTFWVQKQPYVDRNRWNLCQWKEIRKNPTRRILFETKLPDAHQIYLCLSCFNWECALLMNRRNDGTWYLWVDVPAGRHEFRFMQDGQWHSSGDYYSCWNDYGSDNNWIVID
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.9	Very low	30.9	Very low	252 Å²	252	147 Å²	147	100%	1.241	80%	0.796	S	S	*	*				0	55	0	-61.8	178	-176.3	0	0	111.4
2	A	33	Very low	30.9	Very low	92 Å²	92	147.1 Å²	147.1	76%	0.76	80%	0.796	S	S	*	*			trans	-148.5	-0.8	-175.5	0	0	0	0	0	116.3
3	H	28.3	Very low	30.9	Very low	190 Å²	190	139.5 Å²	139.5	88%	0.88	77%	0.773	S	S	*	*			trans	-106.4	30.4	-168.9	-73.3	-63.8	0	0	0	115.4
4	L	30.7	Very low	31	Very low	170 Å²	170	142 Å²	142	89%	0.89	77%	0.767	S	S	*	*			trans	-121.8	67	179.6	-79.1	165.4	0	0	0	111.4
5	R	32.8	Very low	31.3	Very low	239 Å²	239	137.1 Å²	137.1	90%	0.902	76%	0.763	S	S	*	*	S	Bend	trans	-169.4	52.7	171.6	-114.8	172.7	-154.3	-154.8	5.8	116.7
6	T	32.9	Very low	31.8	Very low	126 Å²	126	138.6 Å²	138.6	77%	0.773	76%	0.762	S	S	*	*			trans	-166.2	107.2	154.3	36	0	0	0	0	109.8	K8	T6-K8 PolarHBondContact O-N 2.69Å
7	G	28	Very low	32.2	Very low	67 Å²	67	135.9 Å²	135.9	69%	0.691	74%	0.744	S	S	*	*			trans	-79.7	50.6	176.8	0	0	0	0	0	113.3	M9	G7-M9 PolarHBondContact O-N 2.85Å
8	K	32.3	Very low	33.2	Very low	183 Å²	183	133.7 Å²	133.7	80%	0.796	73%	0.731	S	S	*	*			trans	-82.7	112.4	171.5	-75.9	-170.1	172.8	-171.5	0	109	T6 S10	T6-K8 PolarHBondContact O-N 2.69Å; K8-S10 PolarHBondContact O-N 3.25Å
9	M	27	Very low	34	Very low	126 Å²	126	131.1 Å²	131.1	62%	0.621	72%	0.716	S	S	*	*			trans	-70.4	87.8	156.8	-74.2	-171.1	62.8	0	0	107.7	G7 S11	G7-M9 PolarHBondContact O-N 2.85Å; M9-S11 PolarHBondContact O-N 3.01Å
10	S	30.5	Very low	34.9	Very low	83 Å²	83	125.9 Å²	125.9	58%	0.58	69%	0.687	S	S	*	*			trans	-58.6	121.6	171.7	155.8	0	0	0	0	109.2	K8 N12	K8-S10 PolarHBondContact O-N 3.25Å; S10-N12 PolarHBondContact O-N 3.34Å; S10-N12 PolarHBondContact OG-N 3.16Å
11	S	33.9	Very low	35.9	Very low	89 Å²	89	125 Å²	125	62%	0.622	68%	0.682	S	S	*	*	S	Bend	trans	-65.4	1.1	-179.8	49.5	0	0	0	0	114.9	M9 G13 Y14	M9-S11 PolarHBondContact O-N 3.01Å; S11-G13 PolarHBondContact O-N 3.45Å; S11-Y14 VanDerWaalsContact O-CD2 3.31Å; S11-Y14 WeakPolarHBondContact O-CD2 3.23Å
12	N	30.7	Very low	37	Very low	148 Å²	148	116.2 Å²	116.2	79%	0.791	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	46.5	179.5	-62.7	2.9	0	0	0	112.8	S10	S10-N12 PolarHBondContact O-N 3.34Å; S10-N12 PolarHBondContact OG-N 3.16Å
13	G	30.5	Very low	38	Very low	49 Å²	49	113.8 Å²	113.8	51%	0.505	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-120.4	7.5	-176.6	0	0	0	0	0	115.3	S11 G15 E16	S11-G13 PolarHBondContact O-N 3.45Å; G13-G15 PolarHBondContact O-N 2.82Å; G13-E16 PolarHBondContact O-N 2.82Å
14	Y	32.3	Very low	39.6	Very low	174 Å²	174	107.7 Å²	107.7	68%	0.682	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	1.5	-173.1	-82.2	-84.8	0	0	0	115.9	S11 E16 M17	S11-Y14 VanDerWaalsContact O-CD2 3.31Å; S11-Y14 WeakPolarHBondContact O-CD2 3.23Å; Y14-E16 VanDerWaalsContact C-N 3.34Å; Y14-E16 PolarHBondContact O-N 2.77Å; Y14-M17 HydrophobicContact CD1-SD 3.71Å; Y14-M17 HydrophobicContact CE1-CE 4.36Å; Y14-M17 HydrophobicContact CE1-SD 3.68Å
15	G	35.9	Very low	40.9	Very low	69 Å²	69	106 Å²	106	71%	0.711	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-20	174.3	0	0	0	0	0	115.1	G13	G13-G15 PolarHBondContact O-N 2.82Å
16	E	39.5	Very low	42.3	Very low	161 Å²	161	99.2 Å²	99.2	75%	0.752	56%	0.557	S	S	*	*	S	Bend	trans	-91.7	-15.1	-176.6	-67.5	-179.1	153.4	0	0	113.9	G13 Y14 N18 L19	G13-E16 PolarHBondContact O-N 2.82Å; Y14-E16 VanDerWaalsContact C-N 3.34Å; Y14-E16 PolarHBondContact O-N 2.77Å; E16-N18 VanDerWaalsContact C-N 3.25Å; E16-N18 PolarHBondContact O-N 2.8Å; E16-L19 PolarHBondContact O-N 2.87Å
17	M	37.6	Very low	43.5	Very low	92 Å²	92	95.8 Å²	95.8	45%	0.453	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-24.6	178.2	-90.3	-178.4	170	0	0	113.8	Y14 L19 I20	Y14-M17 HydrophobicContact CD1-SD 3.71Å; Y14-M17 HydrophobicContact CE1-CE 4.36Å; Y14-M17 HydrophobicContact CE1-SD 3.68Å; M17-L19 PolarHBondContact O-N 3.41Å; M17-I20 PolarHBondContact O-N 2.87Å
18	N	51	Low	45.2	Very low	96 Å²	96	95 Å²	95	51%	0.513	52%	0.518	S	S	.	.	H	α-helix	trans	-59.9	-18.7	-179.6	-117.8	-31.8	0	0	0	113.8	E16 S22	E16-N18 VanDerWaalsContact C-N 3.25Å; E16-N18 PolarHBondContact O-N 2.8Å; N18-S22 WeakPolarHBondContact O-CB 3.4Å; N18-S22 PolarHBondContact O-N 3.14Å; N18-S22 PolarHBondContact O-OG 3.33Å
19	L	47.5	Very low	46.8	Very low	84 Å²	84	92.5 Å²	92.5	44%	0.44	51%	0.507	S	S	.	.	H	α-helix	trans	-69.9	-36.3	-178.3	-119.2	113.1	0	0	0	113.3	E16 M17 L23 L198	E16-L19 PolarHBondContact O-N 2.87Å; M17-L19 PolarHBondContact O-N 3.41Å; L19-L23 HydrophobicContact CD2-CD1 4.48Å; L19-L23 WeakPolarHBondContact O-CB 3.34Å; L19-L23 VanDerWaalsContact O-CD1 3.29Å; L19-L23 WeakPolarHBondContact O-CD1 3.32Å; L19-L23 VanDerWaalsContact O-CG 3.22Å; L19-L23 WeakPolarHBondContact O-CG 3.26Å; L19-L23 PolarHBondContact O-N 3.4Å; L19-L198 HydrophobicContact CD2-CD2 3.88Å
20	I	53.7	Low	48.3	Very low	28 Å²	28	87.9 Å²	87.9	14%	0.144	49%	0.487	C	S	.	.	H	α-helix	trans	-72.6	-48.6	-176.7	-62.9	161.9	0	0	0	109.9	M17 S22 L23 V24 I70	M17-I20 PolarHBondContact O-N 2.87Å; I20-S22 VanDerWaalsContact C-N 3.29Å; I20-S22 PolarHBondContact O-N 3.47Å; I20-L23 WeakPolarHBondContact O-CB 3.25Å; I20-L23 PolarHBondContact O-N 2.78Å; I20-L23 VanDerWaalsContact O-N 3.08Å; I20-V24 WeakPolarHBondContact O-CG2 3.38Å; I20-V24 PolarHBondContact O-N 3.38Å; I20-I70 HydrophobicContact CD1-CG2 3.47Å; I20-I70 VanDerWaalsContact CD1-CG2 3.47Å; I20-I70 HydrophobicContact CG1-CG2 4.12Å
21	D	54.8	Low	49.9	Very low	106 Å²	106	87.5 Å²	87.5	57%	0.567	48%	0.477	S	S	*	.	H	α-helix	trans	-67.5	-33	177.4	-64.9	-38.1	0	0	0	111.4	L23 V24 H25	D21-L23 PolarHBondContact O-N 3.42Å; D21-V24 PolarHBondContact O-N 2.86Å; D21-H25 WeakPolarHBondContact O-CB 3.28Å; D21-H25 PolarHBondContact O-N 2.75Å
22	S	53.9	Low	51.5	Low	68 Å²	68	90.7 Å²	90.7	48%	0.476	48%	0.479	S	S	.	.	H	α-helix	trans	-61.6	-39.3	168.7	-68.2	0	0	0	0	112.9	N18 I20 W26	N18-S22 WeakPolarHBondContact O-CB 3.4Å; N18-S22 PolarHBondContact O-N 3.14Å; N18-S22 PolarHBondContact O-OG 3.33Å; I20-S22 VanDerWaalsContact C-N 3.29Å; I20-S22 PolarHBondContact O-N 3.47Å; S22-W26 WeakPolarHBondContact O-CB 3.27Å; S22-W26 PolarHBondContact O-N 2.79Å
23	L	54.6	Low	53.1	Low	41 Å²	41	88 Å²	88	22%	0.215	46%	0.464	C	S	.	.	H	α-helix	trans	-69.4	-44.2	177.2	-76.7	157.4	0	0	0	111.7	L19 I20 D21 W26 F27 L198	L19-L23 HydrophobicContact CD2-CD1 4.48Å; L19-L23 WeakPolarHBondContact O-CB 3.34Å; L19-L23 VanDerWaalsContact O-CD1 3.29Å; L19-L23 WeakPolarHBondContact O-CD1 3.32Å; L19-L23 VanDerWaalsContact O-CG 3.22Å; L19-L23 WeakPolarHBondContact O-CG 3.26Å; L19-L23 PolarHBondContact O-N 3.4Å; I20-L23 WeakPolarHBondContact O-CB 3.25Å; I20-L23 PolarHBondContact O-N 2.78Å; I20-L23 VanDerWaalsContact O-N 3.08Å; D21-L23 PolarHBondContact O-N 3.42Å; L23-W26 PolarHBondContact O-N 2.88Å; L23-F27 WeakPolarHBondContact O-CB 3.31Å; L23-F27 PolarHBondContact O-N 2.74Å; L23-L198 HydrophobicContact CD1-CD1 3.7Å; L23-L198 HydrophobicContact CD1-CD2 3.85Å; L23-L198 HydrophobicContact CD1-CG 4.31Å; L23-L198 HydrophobicContact CD2-CD1 4.25Å
24	V	61.5	Low	54.6	Low	63 Å²	63	89.3 Å²	89.3	38%	0.382	46%	0.458	S	S	.	.	H	α-helix	trans	-62.5	-44.3	175.7	173.2	0	0	0	0	110.8	I20 D21 F27 A28	I20-V24 WeakPolarHBondContact O-CG2 3.38Å; I20-V24 PolarHBondContact O-N 3.38Å; D21-V24 PolarHBondContact O-N 2.86Å; V24-F27 WeakPolarHBondContact O-CB 3.32Å; V24-F27 PolarHBondContact O-N 3.4Å; V24-A28 WeakPolarHBondContact O-CB 3.26Å; V24-A28 PolarHBondContact O-N 2.91Å
25	H	58.3	Low	56.3	Low	135 Å²	135	83.9 Å²	83.9	63%	0.625	44%	0.444	S	S	*	.	H	α-helix	trans	-68.5	-37.1	177.1	-171.7	-77.9	0	0	0	112.3	D21 K29	D21-H25 WeakPolarHBondContact O-CB 3.28Å; D21-H25 PolarHBondContact O-N 2.75Å; H25-K29 WeakPolarHBondContact O-CB 3.36Å; H25-K29 PolarHBondContact O-N 3.34Å
26	W	61.1	Low	57.8	Low	96 Å²	96	83 Å²	83	36%	0.364	43%	0.43	S	S	.	.	H	α-helix	trans	-62.5	-44.8	172.9	-177.6	92.8	0	0	0	111.1	S22 L23 K29 S30 L205	S22-W26 WeakPolarHBondContact O-CB 3.27Å; S22-W26 PolarHBondContact O-N 2.79Å; L23-W26 PolarHBondContact O-N 2.88Å; W26-K29 WeakPolarHBondContact O-CB 3.49Å; W26-K29 PolarHBondContact O-N 3.31Å; W26-S30 PolarHBondContact O-N 3.41Å; W26-S30 PolarHBondContact O-OG 2.96Å; W26-L205 HydrophobicContact CH2-CB 4.44Å; W26-L205 HydrophobicContact CH2-CD1 3.88Å; W26-L205 HydrophobicContact CH2-CD2 4.03Å; W26-L205 HydrophobicContact CH2-CG 4.34Å; W26-L205 HydrophobicContact CZ3-CD1 3.97Å
27	F	59.9	Low	58.9	Low	54 Å²	54	80 Å²	80	24%	0.237	42%	0.416	C	S	.	.	H	α-helix	trans	-58	-52.7	173.6	-111.3	-80.2	0	0	0	112.4	L23 V24 K29 S30 Q31 M63	L23-F27 WeakPolarHBondContact O-CB 3.31Å; L23-F27 PolarHBondContact O-N 2.74Å; V24-F27 WeakPolarHBondContact O-CB 3.32Å; V24-F27 PolarHBondContact O-N 3.4Å; F27-K29 PolarHBondContact O-N 3.15Å; F27-K29 VanDerWaalsContact O-N 3.11Å; F27-S30 PolarHBondContact O-N 3.24Å; F27-Q31 WeakPolarHBondContact O-CB 3.3Å; F27-Q31 PolarHBondContact O-N 3.28Å; F27-M63 HydrophobicContact CE2-CB 3.83Å; F27-M63 HydrophobicContact CE2-CE 4.05Å; F27-M63 HydrophobicContact CE2-CG 4.22Å; F27-M63 HydrophobicContact CE2-SD 3.43Å; F27-M63 WeakPolarHBondContact CE2-SD 3.25Å; F27-M63 HydrophobicContact CZ-CB 3.65Å; F27-M63 HydrophobicContact CZ-CE 3.58Å; F27-M63 HydrophobicContact CZ-CG 4.04Å; F27-M63 HydrophobicContact CZ-SD 3.51Å; F27-M63 VanDerWaalsContact CZ-SD 3.51Å
28	A	63.1	Low	60.2	Low	49 Å²	49	80.2 Å²	80.2	41%	0.405	42%	0.416	S	S	.	.	H	α-helix	trans	-59.2	-27.5	179.3	0	0	0	0	0	112.7	V24 K32	V24-A28 WeakPolarHBondContact O-CB 3.26Å; V24-A28 PolarHBondContact O-N 2.91Å; A28-K32 WeakPolarHBondContact O-CD 3.37Å; A28-K32 VanDerWaalsContact O-CG 3.29Å; A28-K32 WeakPolarHBondContact O-CG 3.27Å
29	K	66.2	Low	61	Low	131 Å²	131	81.5 Å²	81.5	57%	0.57	42%	0.42	S	S	*	.	H	α-helix	trans	-77.6	-45	173	-169.6	172.8	-176.9	173.5	0	112.1	H25 W26 F27 K32 I33	H25-K29 WeakPolarHBondContact O-CB 3.36Å; H25-K29 PolarHBondContact O-N 3.34Å; W26-K29 WeakPolarHBondContact O-CB 3.49Å; W26-K29 PolarHBondContact O-N 3.31Å; F27-K29 PolarHBondContact O-N 3.15Å; F27-K29 VanDerWaalsContact O-N 3.11Å; K29-K32 PolarHBondContact O-N 3.49Å; K29-I33 HydrophobicContact CG-CD1 4.42Å; K29-I33 WeakPolarHBondContact O-CG1 3.48Å; K29-I33 PolarHBondContact O-N 2.74Å
30	S	58.2	Low	62	Low	29 Å²	29	86 Å²	86	20%	0.203	43%	0.431	C	S	.	.	H	α-helix	trans	-62.4	-42.9	176.3	-65.2	0	0	0	0	112.1	W26 F27 K32 I33 I34	W26-S30 PolarHBondContact O-N 3.41Å; W26-S30 PolarHBondContact O-OG 2.96Å; F27-S30 PolarHBondContact O-N 3.24Å; S30-K32 VanDerWaalsContact C-N 3.35Å; S30-K32 PolarHBondContact O-N 2.85Å; S30-I33 WeakPolarHBondContact O-CB 3.29Å; S30-I33 PolarHBondContact O-N 3.38Å; S30-I33 VanDerWaalsContact O-N 3.11Å; S30-I34 WeakPolarHBondContact O-CG1 3.38Å; S30-I34 PolarHBondContact O-N 3.15Å
31	Q	63.3	Low	62.7	Low	75 Å²	75	89.3 Å²	89.3	35%	0.35	44%	0.442	S	S	.	.	H	α-helix	trans	-54.7	-49.6	174.7	-153.3	100.9	-6.5	0	0	111.1	F27 I33 I34 T35 E60	F27-Q31 WeakPolarHBondContact O-CB 3.3Å; F27-Q31 PolarHBondContact O-N 3.28Å; Q31-I33 VanDerWaalsContact C-N 3.29Å; Q31-I33 PolarHBondContact O-N 3.09Å; Q31-I34 PolarHBondContact O-N 3.21Å; Q31-T35 PolarHBondContact O-N 2.99Å; Q31-T35 PolarHBondContact O-OG1 3.43Å; Q31-E60 PolarHBondContact NE2-OE1 3.28Å
32	K	67.5	Low	63.3	Low	157 Å²	157	92 Å²	92	68%	0.683	45%	0.448	S	S	*	.	H	α-helix	trans	-60.6	-36.6	178.4	-73.9	172	-177.2	178.2	0	112.4	A28 K29 S30 A36	A28-K32 WeakPolarHBondContact O-CD 3.37Å; A28-K32 VanDerWaalsContact O-CG 3.29Å; A28-K32 WeakPolarHBondContact O-CG 3.27Å; K29-K32 PolarHBondContact O-N 3.49Å; S30-K32 VanDerWaalsContact C-N 3.35Å; S30-K32 PolarHBondContact O-N 2.85Å; K32-A36 VanDerWaalsContact O-CB 3.31Å; K32-A36 WeakPolarHBondContact O-CB 3.21Å; K32-A36 PolarHBondContact O-N 3.36Å
33	I	64.7	Low	64	Low	91 Å²	91	96.2 Å²	96.2	47%	0.467	46%	0.46	S	S	.	.	H	α-helix	trans	-67.7	-45.7	176	-66.6	164	0	0	0	110.5	K29 S30 Q31 A36 M37	K29-I33 HydrophobicContact CG-CD1 4.42Å; K29-I33 WeakPolarHBondContact O-CG1 3.48Å; K29-I33 PolarHBondContact O-N 2.74Å; S30-I33 WeakPolarHBondContact O-CB 3.29Å; S30-I33 PolarHBondContact O-N 3.38Å; S30-I33 VanDerWaalsContact O-N 3.11Å; Q31-I33 VanDerWaalsContact C-N 3.29Å; Q31-I33 PolarHBondContact O-N 3.09Å; I33-A36 PolarHBondContact O-N 2.88Å; I33-M37 HydrophobicContact CG2-SD 4.27Å; I33-M37 WeakPolarHBondContact O-CG 3.25Å; I33-M37 PolarHBondContact O-N 2.98Å
34	I	62.5	Low	64.7	Low	76 Å²	76	100.9 Å²	100.9	39%	0.39	48%	0.481	S	S	.	.	H	α-helix	trans	-62.4	-46.3	178	-66.4	167.4	0	0	0	110.7	S30 Q31 A36 M37 Q38	S30-I34 WeakPolarHBondContact O-CG1 3.38Å; S30-I34 PolarHBondContact O-N 3.15Å; Q31-I34 PolarHBondContact O-N 3.21Å; I34-A36 VanDerWaalsContact C-N 3.33Å; I34-A36 PolarHBondContact O-N 3.25Å; I34-M37 PolarHBondContact O-N 3.1Å; I34-Q38 HydrophobicContact CG2-CG 4.49Å; I34-Q38 WeakPolarHBondContact O-CG 3.42Å; I34-Q38 PolarHBondContact O-N 2.79Å
35	T	67.4	Low	64.5	Low	61 Å²	61	101.1 Å²	101.1	37%	0.374	50%	0.496	S	S	.	.	H	α-helix	trans	-61.4	-40.1	176.3	-51.5	0	0	0	0	112	Q31 Q38 Q39	Q31-T35 PolarHBondContact O-N 2.99Å; Q31-T35 PolarHBondContact O-OG1 3.43Å; T35-Q38 PolarHBondContact O-N 3.47Å; T35-Q39 WeakPolarHBondContact O-CB 3.43Å; T35-Q39 WeakPolarHBondContact O-CG 3.07Å; T35-Q39 PolarHBondContact O-N 2.79Å
36	A	68.1	Low	64.6	Low	50 Å²	50	99.3 Å²	99.3	41%	0.413	49%	0.49	S	S	.	.	H	α-helix	trans	-66.8	-37	175.8	0	0	0	0	0	112.6	K32 I33 I34 Q39 R40	K32-A36 VanDerWaalsContact O-CB 3.31Å; K32-A36 WeakPolarHBondContact O-CB 3.21Å; K32-A36 PolarHBondContact O-N 3.36Å; I33-A36 PolarHBondContact O-N 2.88Å; I34-A36 VanDerWaalsContact C-N 3.33Å; I34-A36 PolarHBondContact O-N 3.25Å; A36-Q39 PolarHBondContact O-N 3.36Å; A36-R40 PolarHBondContact O-N 3.34Å
37	M	61.6	Low	64.4	Low	97 Å²	97	98.8 Å²	98.8	48%	0.478	50%	0.499	S	S	.	.	H	α-helix	trans	-65.2	-46.2	173	-77.2	179	151.6	0	0	111.8	I33 I34 Q39 R40 W41	I33-M37 HydrophobicContact CG2-SD 4.27Å; I33-M37 WeakPolarHBondContact O-CG 3.25Å; I33-M37 PolarHBondContact O-N 2.98Å; I34-M37 PolarHBondContact O-N 3.1Å; M37-Q39 VanDerWaalsContact C-N 3.32Å; M37-Q39 PolarHBondContact O-N 3.27Å; M37-R40 PolarHBondContact O-N 2.84Å; M37-W41 PolarHBondContact O-N 3.42Å
38	Q	65.1	Low	64	Low	97 Å²	97	100.6 Å²	100.6	45%	0.453	51%	0.511	S	S	.	.	H	α-helix	trans	-60	-40.6	175.1	-72.5	172.4	-19.3	0	0	112.1	I34 T35 W41 K42	I34-Q38 HydrophobicContact CG2-CG 4.49Å; I34-Q38 WeakPolarHBondContact O-CG 3.42Å; I34-Q38 PolarHBondContact O-N 2.79Å; T35-Q38 PolarHBondContact O-N 3.47Å; Q38-W41 PolarHBondContact O-N 3.04Å; Q38-K42 WeakPolarHBondContact O-CB 3.23Å; Q38-K42 PolarHBondContact O-N 3.08Å
39	Q	69.1	Low	63.4	Low	124 Å²	124	106.8 Å²	106.8	58%	0.579	53%	0.532	S	S	*	.	H	α-helix	trans	-63.8	-43.2	174.4	-76.5	179	-7.7	0	0	112.3	T35 A36 M37 K42 Q43	T35-Q39 WeakPolarHBondContact O-CB 3.43Å; T35-Q39 WeakPolarHBondContact O-CG 3.07Å; T35-Q39 PolarHBondContact O-N 2.79Å; A36-Q39 PolarHBondContact O-N 3.36Å; M37-Q39 VanDerWaalsContact C-N 3.32Å; M37-Q39 PolarHBondContact O-N 3.27Å; Q39-K42 PolarHBondContact O-N 3.45Å; Q39-Q43 WeakPolarHBondContact O-CG 3.38Å; Q39-Q43 PolarHBondContact O-N 2.87Å
40	R	66.8	Low	62.6	Low	179 Å²	179	109 Å²	109	68%	0.675	54%	0.544	S	S	*	.	H	α-helix	trans	-62.5	-44.6	173.6	-95.3	-176.1	168.1	-175.8	-4.7	112.5	A36 M37 K42 Q43 H44	A36-R40 PolarHBondContact O-N 3.34Å; M37-R40 PolarHBondContact O-N 2.84Å; R40-K42 VanDerWaalsContact C-N 3.26Å; R40-K42 PolarHBondContact O-N 3.32Å; R40-Q43 WeakPolarHBondContact O-CB 3.42Å; R40-Q43 PolarHBondContact O-N 2.88Å; R40-H44 PolarHBondContact O-CD2 3.18Å; R40-H44 VanDerWaalsContact O-CD2 3.25Å; R40-H44 PolarHBondContact O-N 3.35Å; R40-H44 VanDerWaalsContact O-N 3.12Å
41	W	68.5	Low	62.1	Low	97 Å²	97	113 Å²	113	37%	0.367	56%	0.558	S	S	.	*	H	α-helix	trans	-57.9	-42.9	177.2	-112.1	-42.4	0	0	0	111.8	M37 Q38 Q43 H44 G45 F51	M37-W41 PolarHBondContact O-N 3.42Å; Q38-W41 PolarHBondContact O-N 3.04Å; W41-Q43 VanDerWaalsContact C-N 3.31Å; W41-Q43 PolarHBondContact O-N 3.31Å; W41-H44 PolarHBondContact O-N 2.95Å; W41-G45 PolarHBondContact O-N 3.05Å; W41-F51 HydrophobicContact CH2-CD1 4.49Å; W41-F51 AromaticContact CH2-CD2 3.69Å; W41-F51 HydrophobicContact CH2-CD2 3.69Å; W41-F51 HydrophobicContact CH2-CE1 4.03Å; W41-F51 AromaticContact CH2-CE2 3.13Å; W41-F51 HydrophobicContact CH2-CE2 3.13Å; W41-F51 HydrophobicContact CH2-CG 4.34Å; W41-F51 AromaticContact CH2-CZ 3.33Å; W41-F51 HydrophobicContact CH2-CZ 3.33Å; W41-F51 HydrophobicContact CZ2-CD2 4.13Å; W41-F51 AromaticContact CZ2-CE2 3.83Å; W41-F51 HydrophobicContact CZ2-CE2 3.83Å; W41-F51 HydrophobicContact CZ2-CZ 4.42Å; W41-F51 AromaticContact CZ3-CD1 3.99Å; W41-F51 HydrophobicContact CZ3-CD1 3.99Å; W41-F51 AromaticContact CZ3-CD2 3.93Å; W41-F51 HydrophobicContact CZ3-CD2 3.93Å; W41-F51 AromaticContact CZ3-CE1 3.66Å; W41-F51 HydrophobicContact CZ3-CE1 3.66Å; W41-F51 AromaticContact CZ3-CE2 3.62Å; W41-F51 HydrophobicContact CZ3-CE2 3.62Å; W41-F51 HydrophobicContact CZ3-CG 4.12Å; W41-F51 AromaticContact CZ3-CZ 3.47Å; W41-F51 HydrophobicContact CZ3-CZ 3.47Å; W41-F51 VanDerWaalsContact CZ3-CZ 3.47Å
42	K	68.1	Low	61.1	Low	163 Å²	163	116.5 Å²	116.5	71%	0.709	58%	0.579	S	S	*	*	H	α-helix	trans	-65.9	-29.3	176.3	-162	172	-174.5	176.4	0	113.4	Q38 Q39 R40	Q38-K42 WeakPolarHBondContact O-CB 3.23Å; Q38-K42 PolarHBondContact O-N 3.08Å; Q39-K42 PolarHBondContact O-N 3.45Å; R40-K42 VanDerWaalsContact C-N 3.26Å; R40-K42 PolarHBondContact O-N 3.32Å
43	Q	69	Low	60	Low	155 Å²	155	112.1 Å²	112.1	72%	0.724	57%	0.567	S	S	*	*	H	α-helix	trans	-73.3	-27.8	173	-74.5	173.7	-13.7	0	0	113.2	Q39 R40 W41	Q39-Q43 WeakPolarHBondContact O-CG 3.38Å; Q39-Q43 PolarHBondContact O-N 2.87Å; R40-Q43 WeakPolarHBondContact O-CB 3.42Å; R40-Q43 PolarHBondContact O-N 2.88Å; W41-Q43 VanDerWaalsContact C-N 3.31Å; W41-Q43 PolarHBondContact O-N 3.31Å
44	H	69.3	Low	59.2	Low	139 Å²	139	109.6 Å²	109.6	64%	0.644	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	5	-178.6	-74.5	-70.6	0	0	0	114.7	R40 W41 L46	R40-H44 PolarHBondContact O-CD2 3.18Å; R40-H44 VanDerWaalsContact O-CD2 3.25Å; R40-H44 PolarHBondContact O-N 3.35Å; R40-H44 VanDerWaalsContact O-N 3.12Å; W41-H44 PolarHBondContact O-N 2.95Å; H44-L46 HydrophobicContact CB-CD1 4.4Å; H44-L46 PolarHBondContact O-N 2.81Å
45	G	56.4	Low	58.5	Low	69 Å²	69	113.1 Å²	113.1	71%	0.711	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.8	16	172.6	0	0	0	0	0	115.4	W41	W41-G45 PolarHBondContact O-N 3.05Å
46	L	60.6	Low	57.6	Low	96 Å²	96	113.7 Å²	113.7	50%	0.503	58%	0.582	S	S	.	*			trans	-79	140	177.5	-71.9	162.1	0	0	0	110.4	H44 L48	H44-L46 HydrophobicContact CB-CD1 4.4Å; H44-L46 PolarHBondContact O-N 2.81Å; L46-L48 PolarHBondContact O-N 2.86Å
47	P	56.8	Low	56.8	Low	85 Å²	85	120.5 Å²	120.5	55%	0.552	60%	0.597	S	S	*	*			trans	-66.9	122.7	-177.3	26.4	-33.3	0	0	0	111.3	E49	P47-E49 PolarHBondContact O-N 3.23Å
48	L	51.6	Low	56.5	Low	93 Å²	93	120.9 Å²	120.9	49%	0.487	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-69.6	-8.8	176.8	-92.2	135.5	0	0	0	113.7	L46 E50 F51	L46-L48 PolarHBondContact O-N 2.86Å; L48-E50 PolarHBondContact O-N 2.71Å; L48-F51 PolarHBondContact O-N 2.89Å
49	E	51.3	Low	55.9	Low	178 Å²	178	119 Å²	119	83%	0.832	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-69.7	-17.8	-176.1	-64.7	174.4	164.2	0	0	113.2	P47	P47-E49 PolarHBondContact O-N 3.23Å
50	E	49.3	Very low	55.2	Low	177 Å²	177	116.4 Å²	116.4	83%	0.827	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-87.9	-1.6	170.1	-65.5	-170.6	155.4	0	0	113.4	L48	L48-E50 PolarHBondContact O-N 2.71Å
51	F	46.1	Very low	55.1	Low	114 Å²	114	114.1 Å²	114.1	50%	0.5	58%	0.583	S	S	.	*			trans	-114.5	32.4	-176.9	-124.4	-94	0	0	0	113.9	W41 L48 C53	W41-F51 HydrophobicContact CH2-CD1 4.49Å; W41-F51 AromaticContact CH2-CD2 3.69Å; W41-F51 HydrophobicContact CH2-CD2 3.69Å; W41-F51 HydrophobicContact CH2-CE1 4.03Å; W41-F51 AromaticContact CH2-CE2 3.13Å; W41-F51 HydrophobicContact CH2-CE2 3.13Å; W41-F51 HydrophobicContact CH2-CG 4.34Å; W41-F51 AromaticContact CH2-CZ 3.33Å; W41-F51 HydrophobicContact CH2-CZ 3.33Å; W41-F51 HydrophobicContact CZ2-CD2 4.13Å; W41-F51 AromaticContact CZ2-CE2 3.83Å; W41-F51 HydrophobicContact CZ2-CE2 3.83Å; W41-F51 HydrophobicContact CZ2-CZ 4.42Å; W41-F51 AromaticContact CZ3-CD1 3.99Å; W41-F51 HydrophobicContact CZ3-CD1 3.99Å; W41-F51 AromaticContact CZ3-CD2 3.93Å; W41-F51 HydrophobicContact CZ3-CD2 3.93Å; W41-F51 AromaticContact CZ3-CE1 3.66Å; W41-F51 HydrophobicContact CZ3-CE1 3.66Å; W41-F51 AromaticContact CZ3-CE2 3.62Å; W41-F51 HydrophobicContact CZ3-CE2 3.62Å; W41-F51 HydrophobicContact CZ3-CG 4.12Å; W41-F51 AromaticContact CZ3-CZ 3.47Å; W41-F51 HydrophobicContact CZ3-CZ 3.47Å; W41-F51 VanDerWaalsContact CZ3-CZ 3.47Å; L48-F51 PolarHBondContact O-N 2.89Å; F51-C53 PolarHBondContact O-N 2.75Å
52	D	43.7	Very low	54.8	Low	149 Å²	149	115.9 Å²	115.9	80%	0.797	60%	0.595	S	S	*	*			trans	-77	69.5	174.9	-164.5	18.3	0	0	0	112.1	G54	D52-G54 VanDerWaalsContact C-N 3.27Å; D52-G54 PolarHBondContact O-N 3.45Å
53	C	43.3	Very low	54.2	Low	64 Å²	64	110.4 Å²	110.4	43%	0.432	57%	0.573	S	S	.	*			trans	-80.9	71.2	175.6	-115.5	0	0	0	0	110.6	F51 E55 V56	F51-C53 PolarHBondContact O-N 2.75Å; C53-E55 PolarHBondContact O-N 2.77Å; C53-V56 HydrophobicContact CB-CG2 3.8Å; C53-V56 WeakPolarHBondContact O-CB 3.1Å; C53-V56 PolarHBondContact O-N 2.79Å
54	G	48.7	Very low	53.9	Low	39 Å²	39	108.4 Å²	108.4	40%	0.402	57%	0.566	S	S	.	*	H	α-helix	trans	-52.1	-35.2	173.7	0	0	0	0	0	112.8	D52 V56 R57 D58	D52-G54 VanDerWaalsContact C-N 3.27Å; D52-G54 PolarHBondContact O-N 3.45Å; G54-V56 PolarHBondContact O-N 3.28Å; G54-V56 VanDerWaalsContact O-N 3.09Å; G54-R57 PolarHBondContact O-N 2.86Å; G54-R57 VanDerWaalsContact O-N 3.16Å; G54-D58 PolarHBondContact O-N 3.24Å
55	E	47.1	Very low	53.8	Low	149 Å²	149	110.1 Å²	110.1	70%	0.696	57%	0.567	S	S	*	*	H	α-helix	trans	-53.1	-28.5	174.9	-60	-178.2	160.3	0	0	114	C53 C59	C53-E55 PolarHBondContact O-N 2.77Å; E55-C59 VanDerWaalsContact O-CB 3.31Å; E55-C59 WeakPolarHBondContact O-CB 3.49Å; E55-C59 PolarHBondContact O-N 3.27Å; E55-C59 PolarHBondContact O-SG 3.27Å
56	V	48.4	Very low	54.1	Low	73 Å²	73	109.1 Å²	109.1	44%	0.442	54%	0.543	S	S	.	.	H	α-helix	trans	-72	-33.7	-177.8	173.8	0	0	0	0	112	C53 G54 E60	C53-V56 HydrophobicContact CB-CG2 3.8Å; C53-V56 WeakPolarHBondContact O-CB 3.1Å; C53-V56 PolarHBondContact O-N 2.79Å; G54-V56 PolarHBondContact O-N 3.28Å; G54-V56 VanDerWaalsContact O-N 3.09Å; V56-E60 WeakPolarHBondContact O-CB 3.22Å; V56-E60 PolarHBondContact O-N 3.49Å; V56-E60 VanDerWaalsContact O-N 3.13Å
57	R	51.7	Low	54.2	Low	193 Å²	193	106 Å²	106	73%	0.728	53%	0.528	S	S	*	.	H	α-helix	trans	-73	-43.2	174.1	-82.6	-169.5	179.3	-177.9	2.9	111.7	G54 C59 E60 E61	G54-R57 PolarHBondContact O-N 2.86Å; G54-R57 VanDerWaalsContact O-N 3.16Å; R57-C59 VanDerWaalsContact C-N 3.3Å; R57-C59 PolarHBondContact O-N 2.79Å; R57-E60 PolarHBondContact O-N 3.35Å; R57-E60 VanDerWaalsContact O-N 3.09Å; R57-E61 PolarHBondContact O-N 2.91Å
58	D	55.8	Low	54.8	Low	106 Å²	106	106 Å²	106	57%	0.567	52%	0.521	S	S	*	.	H	α-helix	trans	-62	-41.7	178.8	-66	-15.9	0	0	0	110.4	G54 E60 E61 E62	G54-D58 PolarHBondContact O-N 3.24Å; D58-E60 PolarHBondContact O-N 2.79Å; D58-E61 PolarHBondContact O-N 2.99Å; D58-E62 WeakPolarHBondContact O-CB 3.22Å; D58-E62 WeakPolarHBondContact O-CG 3.36Å; D58-E62 PolarHBondContact O-N 3Å
59	C	52.3	Low	55.5	Low	58 Å²	58	105.4 Å²	105.4	39%	0.392	52%	0.518	S	S	.	.	H	α-helix	trans	-64	-34.5	172.7	-72.5	0	0	0	0	113.8	E55 R57 M63	E55-C59 VanDerWaalsContact O-CB 3.31Å; E55-C59 WeakPolarHBondContact O-CB 3.49Å; E55-C59 PolarHBondContact O-N 3.27Å; E55-C59 PolarHBondContact O-SG 3.27Å; R57-C59 VanDerWaalsContact C-N 3.3Å; R57-C59 PolarHBondContact O-N 2.79Å; C59-M63 HydrophobicContact CB-CE 4.36Å; C59-M63 WeakPolarHBondContact O-CB 3.42Å; C59-M63 WeakPolarHBondContact O-CG 3.15Å; C59-M63 PolarHBondContact O-N 3.24Å
60	E	55.5	Low	56.1	Low	69 Å²	69	98.2 Å²	98.2	32%	0.322	49%	0.485	S	S	.	.	H	α-helix	trans	-69.2	-44.6	176.8	-172.8	172.6	-165.3	0	0	111.1	Q31 V56 R57 D58 L64	Q31-E60 PolarHBondContact NE2-OE1 3.28Å; V56-E60 WeakPolarHBondContact O-CB 3.22Å; V56-E60 PolarHBondContact O-N 3.49Å; V56-E60 VanDerWaalsContact O-N 3.13Å; R57-E60 PolarHBondContact O-N 3.35Å; R57-E60 VanDerWaalsContact O-N 3.09Å; D58-E60 PolarHBondContact O-N 2.79Å; E60-L64 HydrophobicContact CG-CD1 4.29Å; E60-L64 WeakPolarHBondContact O-CB 3.43Å; E60-L64 VanDerWaalsContact O-CG 3.32Å; E60-L64 WeakPolarHBondContact O-CG 3.32Å; E60-L64 PolarHBondContact O-N 2.85Å
61	E	62.9	Low	56.8	Low	130 Å²	130	95.9 Å²	95.9	61%	0.607	47%	0.469	S	S	*	.	H	α-helix	trans	-66.3	-43.4	175.2	-70.7	-165.7	-174.1	0	0	112.4	R57 D58 M63 L64 R65	R57-E61 PolarHBondContact O-N 2.91Å; D58-E61 PolarHBondContact O-N 2.99Å; E61-M63 PolarHBondContact O-N 3.09Å; E61-L64 PolarHBondContact O-N 3.48Å; E61-R65 VanDerWaalsContact O-CG 3.29Å; E61-R65 WeakPolarHBondContact O-CG 3.41Å; E61-R65 PolarHBondContact O-N 3.37Å
62	E	62.2	Low	57.9	Low	134 Å²	134	94 Å²	94	63%	0.626	46%	0.464	S	S	*	.	H	α-helix	trans	-61.2	-43.3	176.5	-77.4	-165.5	158	0	0	112.3	D58 R65 F66	D58-E62 WeakPolarHBondContact O-CB 3.22Å; D58-E62 WeakPolarHBondContact O-CG 3.36Å; D58-E62 PolarHBondContact O-N 3Å; E62-R65 PolarHBondContact O-N 2.87Å; E62-F66 WeakPolarHBondContact O-CB 3.41Å; E62-F66 PolarHBondContact O-N 3.25Å
63	M	56.7	Low	59	Low	49 Å²	49	88.5 Å²	88.5	24%	0.241	43%	0.434	C	S	.	.	H	α-helix	trans	-75.3	-29	-179.9	-67.4	-158.3	-110.5	0	0	113	F27 C59 E61 F66 V67	F27-M63 HydrophobicContact CE2-CB 3.83Å; F27-M63 HydrophobicContact CE2-CE 4.05Å; F27-M63 HydrophobicContact CE2-CG 4.22Å; F27-M63 HydrophobicContact CE2-SD 3.43Å; F27-M63 WeakPolarHBondContact CE2-SD 3.25Å; F27-M63 HydrophobicContact CZ-CB 3.65Å; F27-M63 HydrophobicContact CZ-CE 3.58Å; F27-M63 HydrophobicContact CZ-CG 4.04Å; F27-M63 HydrophobicContact CZ-SD 3.51Å; F27-M63 VanDerWaalsContact CZ-SD 3.51Å; C59-M63 HydrophobicContact CB-CE 4.36Å; C59-M63 WeakPolarHBondContact O-CB 3.42Å; C59-M63 WeakPolarHBondContact O-CG 3.15Å; C59-M63 PolarHBondContact O-N 3.24Å; E61-M63 PolarHBondContact O-N 3.09Å; M63-F66 PolarHBondContact O-N 3.43Å; M63-V67 WeakPolarHBondContact O-CG2 3.22Å; M63-V67 PolarHBondContact O-N 3.33Å
64	L	61.5	Low	59.8	Low	112 Å²	112	88.9 Å²	88.9	59%	0.586	43%	0.43	S	S	*	.	H	α-helix	trans	-64.6	-41.2	167.4	-78.2	168.9	0	0	0	112.1	E60 E61 V67 Q68	E60-L64 HydrophobicContact CG-CD1 4.29Å; E60-L64 WeakPolarHBondContact O-CB 3.43Å; E60-L64 VanDerWaalsContact O-CG 3.32Å; E60-L64 WeakPolarHBondContact O-CG 3.32Å; E60-L64 PolarHBondContact O-N 2.85Å; E61-L64 PolarHBondContact O-N 3.48Å; L64-V67 PolarHBondContact O-N 3.44Å; L64-Q68 PolarHBondContact O-N 3.36Å
65	R	68	Low	60.7	Low	176 Å²	176	90.5 Å²	90.5	66%	0.664	44%	0.435	S	S	*	.	H	α-helix	trans	-63.2	-44	173.4	-69.5	178.2	78.9	-151.7	2.2	111.2	E61 E62 V67 Q68 D69	E61-R65 VanDerWaalsContact O-CG 3.29Å; E61-R65 WeakPolarHBondContact O-CG 3.41Å; E61-R65 PolarHBondContact O-N 3.37Å; E62-R65 PolarHBondContact O-N 2.87Å; R65-V67 PolarHBondContact O-N 3.48Å; R65-Q68 PolarHBondContact O-N 2.75Å; R65-Q68 VanDerWaalsContact O-N 3.16Å; R65-D69 PolarHBondContact O-N 3.47Å
66	F	62.8	Low	61.6	Low	47 Å²	47	86.3 Å²	86.3	21%	0.206	42%	0.422	C	S	.	.	H	α-helix	trans	-59.9	-43.9	176.3	-175.7	-99.5	0	0	0	112.9	E62 M63 Q68 D69 I70 L194 L198	E62-F66 WeakPolarHBondContact O-CB 3.41Å; E62-F66 PolarHBondContact O-N 3.25Å; M63-F66 PolarHBondContact O-N 3.43Å; F66-Q68 VanDerWaalsContact C-N 3.33Å; F66-Q68 PolarHBondContact O-N 2.79Å; F66-D69 PolarHBondContact O-N 3.39Å; F66-I70 HydrophobicContact CD1-CD1 3.87Å; F66-I70 HydrophobicContact CE1-CD1 3.32Å; F66-I70 HydrophobicContact CE1-CG1 4.34Å; F66-I70 HydrophobicContact CZ-CD1 3.7Å; F66-I70 HydrophobicContact CZ-CG1 4.47Å; F66-I70 WeakPolarHBondContact O-CG1 3.45Å; F66-I70 PolarHBondContact O-N 2.79Å; F66-L194 HydrophobicContact CD2-CD2 4.49Å; F66-L194 HydrophobicContact CE2-CD2 3.84Å; F66-L198 HydrophobicContact CE1-CD1 3.98Å; F66-L198 HydrophobicContact CZ-CB 4.13Å; F66-L198 HydrophobicContact CZ-CD1 4.38Å
67	V	62.9	Low	62.3	Low	30 Å²	30	84.9 Å²	84.9	18%	0.182	42%	0.415	C	S	.	.	H	α-helix	trans	-62.6	-39.9	174.4	169	0	0	0	0	111.4	M63 L64 R65 I70 R71	M63-V67 WeakPolarHBondContact O-CG2 3.22Å; M63-V67 PolarHBondContact O-N 3.33Å; L64-V67 PolarHBondContact O-N 3.44Å; R65-V67 PolarHBondContact O-N 3.48Å; V67-I70 PolarHBondContact O-N 3.05Å; V67-R71 WeakPolarHBondContact O-CG 3.48Å; V67-R71 PolarHBondContact O-N 2.92Å; V67-R71 VanDerWaalsContact O-N 3.08Å
68	Q	68.2	Low	62.9	Low	87 Å²	87	79.1 Å²	79.1	41%	0.407	40%	0.404	S	S	.	.	H	α-helix	trans	-69.1	-38.4	177.2	-171.3	56.4	41.3	0	0	112.2	L64 R65 F66 R71 N72	L64-Q68 PolarHBondContact O-N 3.36Å; R65-Q68 PolarHBondContact O-N 2.75Å; R65-Q68 VanDerWaalsContact O-N 3.16Å; F66-Q68 VanDerWaalsContact C-N 3.33Å; F66-Q68 PolarHBondContact O-N 2.79Å; Q68-R71 PolarHBondContact O-N 3.1Å; Q68-N72 PolarHBondContact NE2-OD1 3.18Å; Q68-N72 WeakPolarHBondContact O-CB 3.48Å; Q68-N72 PolarHBondContact O-N 3.42Å; Q68-N72 PolarHBondContact O-ND2 2.85Å; Q68-N72 PolarHBondContact O-OD1 3.36Å
69	D	67.5	Low	63.5	Low	80 Å²	80	78.2 Å²	78.2	43%	0.428	40%	0.402	S	S	.	.	H	α-helix	trans	-64.5	-39.1	175.6	-76	-19	0	0	0	111.8	R65 F66 N72 L73	R65-D69 PolarHBondContact O-N 3.47Å; F66-D69 PolarHBondContact O-N 3.39Å; D69-N72 PolarHBondContact O-N 2.83Å; D69-L73 WeakPolarHBondContact O-CD1 3.32Å; D69-L73 PolarHBondContact O-N 3.36Å
70	I	62.7	Low	64.2	Low	27 Å²	27	76.7 Å²	76.7	14%	0.138	39%	0.39	C	S	.	.	H	α-helix	trans	-62.4	-45.3	171.8	-71.7	175.8	0	0	0	111.3	I20 F66 V67 N72 L73 Q74	I20-I70 HydrophobicContact CD1-CG2 3.47Å; I20-I70 VanDerWaalsContact CD1-CG2 3.47Å; I20-I70 HydrophobicContact CG1-CG2 4.12Å; F66-I70 HydrophobicContact CD1-CD1 3.87Å; F66-I70 HydrophobicContact CE1-CD1 3.32Å; F66-I70 HydrophobicContact CE1-CG1 4.34Å; F66-I70 HydrophobicContact CZ-CD1 3.7Å; F66-I70 HydrophobicContact CZ-CG1 4.47Å; F66-I70 WeakPolarHBondContact O-CG1 3.45Å; F66-I70 PolarHBondContact O-N 2.79Å; V67-I70 PolarHBondContact O-N 3.05Å; I70-N72 VanDerWaalsContact C-N 3.31Å; I70-N72 PolarHBondContact O-N 2.89Å; I70-L73 PolarHBondContact O-N 2.86Å; I70-Q74 HydrophobicContact CG2-CG 4.48Å; I70-Q74 WeakPolarHBondContact O-CG 3.39Å; I70-Q74 PolarHBondContact O-N 3.46Å
71	R	64.3	Low	64.7	Low	128 Å²	128	75.1 Å²	75.1	48%	0.483	38%	0.384	S	S	.	.	H	α-helix	trans	-61.1	-40.3	175.7	-75.2	177.5	177.5	159.4	-0.3	112.2	V67 Q68 Q74 S75	V67-R71 WeakPolarHBondContact O-CG 3.48Å; V67-R71 PolarHBondContact O-N 2.92Å; V67-R71 VanDerWaalsContact O-N 3.08Å; Q68-R71 PolarHBondContact O-N 3.1Å; R71-Q74 PolarHBondContact O-N 3.07Å; R71-S75 PolarHBondContact O-N 3.33Å
72	N	69.9	Low	64.9	Low	73 Å²	73	71.2 Å²	71.2	39%	0.39	37%	0.374	S	S	.	.	H	α-helix	trans	-61.6	-47	175.4	-65.8	-20.7	0	0	0	110.3	Q68 D69 I70 Q74 S75 S76	Q68-N72 PolarHBondContact NE2-OD1 3.18Å; Q68-N72 WeakPolarHBondContact O-CB 3.48Å; Q68-N72 PolarHBondContact O-N 3.42Å; Q68-N72 PolarHBondContact O-ND2 2.85Å; Q68-N72 PolarHBondContact O-OD1 3.36Å; D69-N72 PolarHBondContact O-N 2.83Å; I70-N72 VanDerWaalsContact C-N 3.31Å; I70-N72 PolarHBondContact O-N 2.89Å; N72-Q74 PolarHBondContact O-N 2.95Å; N72-S75 WeakPolarHBondContact O-CB 3.38Å; N72-S75 PolarHBondContact O-N 3.25Å; N72-S76 PolarHBondContact O-N 2.99Å; N72-S76 PolarHBondContact O-OG 3.39Å
73	L	65.9	Low	65.3	Low	34 Å²	34	66.8 Å²	66.8	18%	0.178	36%	0.358	C	S	.	.	H	α-helix	trans	-61.1	-41.3	174.8	-98.6	107.7	0	0	0	113.1	D69 I70 S75 S76 C77 R190 L194	D69-L73 WeakPolarHBondContact O-CD1 3.32Å; D69-L73 PolarHBondContact O-N 3.36Å; I70-L73 PolarHBondContact O-N 2.86Å; L73-S75 VanDerWaalsContact C-N 3.34Å; L73-S75 PolarHBondContact O-N 2.91Å; L73-S76 PolarHBondContact O-N 3.35Å; L73-C77 WeakPolarHBondContact O-CB 3.26Å; L73-C77 PolarHBondContact O-N 3.45Å; L73-C77 PolarHBondContact O-SG 3.49Å; L73-R190 HydrophobicContact CD2-CB 4.09Å; L73-R190 HydrophobicContact CD2-CG 3.98Å; L73-L194 HydrophobicContact CD1-CD1 3.62Å; L73-L194 HydrophobicContact CD2-CD1 4.12Å; L73-L194 HydrophobicContact CG-CD1 4.47Å
74	Q	61	Low	65.9	Low	73 Å²	73	65.3 Å²	65.3	34%	0.341	35%	0.351	S	S	.	.	H	α-helix	trans	-61.5	-42.2	175.9	-75.3	179.2	-33.6	0	0	111.7	I70 R71 N72 C77 S78	I70-Q74 HydrophobicContact CG2-CG 4.48Å; I70-Q74 WeakPolarHBondContact O-CG 3.39Å; I70-Q74 PolarHBondContact O-N 3.46Å; R71-Q74 PolarHBondContact O-N 3.07Å; N72-Q74 PolarHBondContact O-N 2.95Å; Q74-C77 PolarHBondContact O-N 2.92Å; Q74-S78 PolarHBondContact O-N 3.41Å; Q74-S78 PolarHBondContact O-OG 3.47Å
75	S	66.8	Low	66.2	Low	72 Å²	72	64.8 Å²	64.8	50%	0.503	35%	0.345	S	S	.	.	H	α-helix	trans	-63.2	-43.7	174	-171	0	0	0	0	111.9	R71 N72 L73 C77 S78 V79	R71-S75 PolarHBondContact O-N 3.33Å; N72-S75 WeakPolarHBondContact O-CB 3.38Å; N72-S75 PolarHBondContact O-N 3.25Å; L73-S75 VanDerWaalsContact C-N 3.34Å; L73-S75 PolarHBondContact O-N 2.91Å; S75-C77 PolarHBondContact O-N 2.85Å; S75-S78 PolarHBondContact O-N 3.47Å; S75-S78 PolarHBondContact O-OG 3.49Å; S75-V79 WeakPolarHBondContact O-CB 3.42Å; S75-V79 VanDerWaalsContact O-CG2 3.31Å; S75-V79 WeakPolarHBondContact O-CG2 3.48Å; S75-V79 PolarHBondContact O-N 2.97Å; S75-V79 VanDerWaalsContact O-N 3.09Å
76	S	66.5	Low	66.4	Low	62 Å²	62	59.6 Å²	59.6	43%	0.434	33%	0.333	S	S	.	.	H	α-helix	trans	-62.8	-41.9	174.4	-61	0	0	0	0	112.4	N72 L73 L80	N72-S76 PolarHBondContact O-N 2.99Å; N72-S76 PolarHBondContact O-OG 3.39Å; L73-S76 PolarHBondContact O-N 3.35Å; S76-L80 WeakPolarHBondContact O-CB 3.46Å; S76-L80 VanDerWaalsContact O-CG 3.27Å; S76-L80 WeakPolarHBondContact O-CG 3.31Å; S76-L80 PolarHBondContact O-N 3.02Å
77	C	62.8	Low	66.8	Low	43 Å²	43	59.5 Å²	59.5	29%	0.291	33%	0.333	S	S	.	.	H	α-helix	trans	-66.3	-39.7	179.1	-68.5	0	0	0	0	112.4	L73 Q74 S75 N81	L73-C77 WeakPolarHBondContact O-CB 3.26Å; L73-C77 PolarHBondContact O-N 3.45Å; L73-C77 PolarHBondContact O-SG 3.49Å; Q74-C77 PolarHBondContact O-N 2.92Å; S75-C77 PolarHBondContact O-N 2.85Å; C77-N81 VanDerWaalsContact O-CB 3.31Å; C77-N81 WeakPolarHBondContact O-CB 3.31Å; C77-N81 PolarHBondContact O-N 2.88Å
78	S	63.9	Low	67.2	Low	71 Å²	71	60.5 Å²	60.5	50%	0.497	34%	0.337	S	S	.	.	H	α-helix	trans	-68.8	-40.9	178	67	0	0	0	0	111.8	Q74 S75 N81 A82	Q74-S78 PolarHBondContact O-N 3.41Å; Q74-S78 PolarHBondContact O-OG 3.47Å; S75-S78 PolarHBondContact O-N 3.47Å; S75-S78 PolarHBondContact O-OG 3.49Å; S78-N81 PolarHBondContact O-N 3.16Å; S78-A82 VanDerWaalsContact O-CB 3.32Å; S78-A82 WeakPolarHBondContact O-CB 3.49Å; S78-A82 PolarHBondContact O-N 3.07Å
79	V	69.9	Low	67.5	Low	87 Å²	87	62.5 Å²	62.5	53%	0.527	34%	0.341	S	S	.	.	H	α-helix	trans	-64.4	-44.5	174.4	171.5	0	0	0	0	111.7	S75 S83	S75-V79 WeakPolarHBondContact O-CB 3.42Å; S75-V79 VanDerWaalsContact O-CG2 3.31Å; S75-V79 WeakPolarHBondContact O-CG2 3.48Å; S75-V79 PolarHBondContact O-N 2.97Å; S75-V79 VanDerWaalsContact O-N 3.09Å; V79-S83 WeakPolarHBondContact O-CB 3.49Å; V79-S83 PolarHBondContact O-N 3Å; V79-S83 PolarHBondContact O-OG 2.98Å
80	L	66.9	Low	67.8	Low	27 Å²	27	62.3 Å²	62.3	14%	0.141	34%	0.338	C	S	.	.	H	α-helix	trans	-64	-43.4	176.2	-76.1	170	0	0	0	112	S76 S83 L84 F180 E183 V184 T187	S76-L80 WeakPolarHBondContact O-CB 3.46Å; S76-L80 VanDerWaalsContact O-CG 3.27Å; S76-L80 WeakPolarHBondContact O-CG 3.31Å; S76-L80 PolarHBondContact O-N 3.02Å; L80-S83 PolarHBondContact O-N 3.47Å; L80-L84 WeakPolarHBondContact O-CB 3.31Å; L80-L84 PolarHBondContact O-N 3.48Å; L80-F180 HydrophobicContact CD2-CD1 4.49Å; L80-E183 HydrophobicContact CD2-CB 4.33Å; L80-E183 WeakPolarHBondContact CD2-OE2 3.32Å; L80-V184 HydrophobicContact CB-CG2 4.29Å; L80-T187 HydrophobicContact CD1-CG2 3.74Å
81	N	65.8	Low	68.2	Low	35 Å²	35	61.2 Å²	61.2	19%	0.187	33%	0.332	C	S	.	.	H	α-helix	trans	-68.2	-41.7	179.7	-167.2	65.8	0	0	0	111.9	C77 S78 S83 L84 E85	C77-N81 VanDerWaalsContact O-CB 3.31Å; C77-N81 WeakPolarHBondContact O-CB 3.31Å; C77-N81 PolarHBondContact O-N 2.88Å; S78-N81 PolarHBondContact O-N 3.16Å; N81-S83 VanDerWaalsContact C-N 3.3Å; N81-S83 PolarHBondContact O-N 3.24Å; N81-L84 PolarHBondContact O-N 3.39Å; N81-E85 PolarHBondContact ND2-OE1 3.41Å; N81-E85 WeakPolarHBondContact O-CG 3.42Å; N81-E85 PolarHBondContact O-N 3.2Å
82	A	67.3	Low	68.7	Low	49 Å²	49	58.7 Å²	58.7	41%	0.405	33%	0.334	S	S	.	.	H	α-helix	trans	-62.5	-36.6	173.2	0	0	0	0	0	112.5	S78 T86	S78-A82 VanDerWaalsContact O-CB 3.32Å; S78-A82 WeakPolarHBondContact O-CB 3.49Å; S78-A82 PolarHBondContact O-N 3.07Å; A82-T86 WeakPolarHBondContact O-CB 3.22Å; A82-T86 PolarHBondContact O-N 2.77Å; A82-T86 PolarHBondContact O-OG1 2.96Å
83	S	70.1	Confident	69	Low	41 Å²	41	61 Å²	61	29%	0.287	34%	0.342	S	S	.	.	H	α-helix	trans	-67.6	-43	175	-58.4	0	0	0	0	111.6	V79 L80 N81 T86 K87	V79-S83 WeakPolarHBondContact O-CB 3.49Å; V79-S83 PolarHBondContact O-N 3Å; V79-S83 PolarHBondContact O-OG 2.98Å; L80-S83 PolarHBondContact O-N 3.47Å; N81-S83 VanDerWaalsContact C-N 3.3Å; N81-S83 PolarHBondContact O-N 3.24Å; S83-T86 PolarHBondContact O-N 2.89Å; S83-K87 WeakPolarHBondContact O-CG 3.32Å; S83-K87 PolarHBondContact O-N 2.83Å
84	L	69.2	Low	69.4	Low	18 Å²	18	61.2 Å²	61.2	9%	0.094	34%	0.343	C	S	.	.	H	α-helix	trans	-63	-44.3	175.6	-175.8	67.4	0	0	0	111.8	L80 N81 T86 K87 D88 F180 I181	L80-L84 WeakPolarHBondContact O-CB 3.31Å; L80-L84 PolarHBondContact O-N 3.48Å; N81-L84 PolarHBondContact O-N 3.39Å; L84-T86 VanDerWaalsContact C-N 3.31Å; L84-T86 PolarHBondContact O-N 2.73Å; L84-K87 PolarHBondContact O-N 2.66Å; L84-D88 WeakPolarHBondContact O-CB 3.35Å; L84-D88 PolarHBondContact O-N 2.86Å; L84-F180 HydrophobicContact CD1-CB 4.01Å; L84-I181 HydrophobicContact CD1-CG1 4.39Å
85	E	68.7	Low	70.1	Confident	100 Å²	100	63.3 Å²	63.3	47%	0.467	35%	0.348	S	S	.	.	H	α-helix	trans	-63.3	-36	174.9	-75.2	178.9	-162.8	0	0	112.6	N81 R89	N81-E85 PolarHBondContact ND2-OE1 3.41Å; N81-E85 WeakPolarHBondContact O-CG 3.42Å; N81-E85 PolarHBondContact O-N 3.2Å; E85-R89 WeakPolarHBondContact O-CB 3.23Å; E85-R89 PolarHBondContact O-N 2.83Å; E85-R89 VanDerWaalsContact O-N 3.14Å; E85-R89 PolarHBondContact O-NH1 3.41Å
86	T	72	Confident	70.6	Confident	67 Å²	67	65.1 Å²	65.1	41%	0.411	35%	0.352	S	S	.	.	H	α-helix	trans	-65.9	-44.3	174.3	-56.2	0	0	0	0	110.7	A82 S83 L84 R89 E90	A82-T86 WeakPolarHBondContact O-CB 3.22Å; A82-T86 PolarHBondContact O-N 2.77Å; A82-T86 PolarHBondContact O-OG1 2.96Å; S83-T86 PolarHBondContact O-N 2.89Å; L84-T86 VanDerWaalsContact C-N 3.31Å; L84-T86 PolarHBondContact O-N 2.73Å; T86-R89 WeakPolarHBondContact O-CB 3.41Å; T86-R89 PolarHBondContact O-N 2.71Å; T86-E90 PolarHBondContact O-N 2.84Å
87	K	71.5	Confident	70.8	Confident	45 Å²	45	64.7 Å²	64.7	20%	0.196	35%	0.352	C	S	.	.	H	α-helix	trans	-68.9	-38.8	177.4	-72.8	-77.1	162.4	-171.7	0	113.5	S83 L84 R89 E90 L91 E176 F180	S83-K87 WeakPolarHBondContact O-CG 3.32Å; S83-K87 PolarHBondContact O-N 2.83Å; L84-K87 PolarHBondContact O-N 2.66Å; K87-R89 PolarHBondContact O-N 3.48Å; K87-E90 WeakPolarHBondContact CD-OE2 3.48Å; K87-E90 VanDerWaalsContact CE-OE2 3.32Å; K87-E90 WeakPolarHBondContact CE-OE2 3.38Å; K87-E90 IonicContact NZ-OE1 3.13Å; K87-E90 IonicContact NZ-OE2 3.08Å; K87-E90 PolarHBondContact NZ-OE2 3.17Å; K87-E90 PolarHBondContact O-N 3.18Å; K87-L91 VanDerWaalsContact O-CB 3.26Å; K87-L91 WeakPolarHBondContact O-CB 3.39Å; K87-L91 PolarHBondContact O-N 3.24Å; K87-E176 WeakPolarHBondContact CE-OE2 3.3Å; K87-E176 IonicContact NZ-OE2 2.61Å; K87-E176 PolarHBondContact NZ-OE2 2.81Å; K87-F180 HydrophobicContact CD-CE2 4.23Å; K87-F180 HydrophobicContact CG-CD2 4.14Å; K87-F180 HydrophobicContact CG-CE2 3.78Å
88	D	70.8	Confident	71.4	Confident	52 Å²	52	64.6 Å²	64.6	28%	0.278	35%	0.347	S	S	.	.	H	α-helix	trans	-64.8	-29.8	173.7	-95.3	-9.5	0	0	0	111.7	L84 S92 R177	L84-D88 WeakPolarHBondContact O-CB 3.35Å; L84-D88 PolarHBondContact O-N 2.86Å; D88-S92 WeakPolarHBondContact O-CB 3.48Å; D88-S92 PolarHBondContact O-N 3.36Å; D88-S92 PolarHBondContact O-OG 3Å; D88-R177 VanDerWaalsContact OD1-CD 3.32Å; D88-R177 WeakPolarHBondContact OD1-CD 3.29Å; D88-R177 IonicContact OD1-CZ 3.16Å; D88-R177 IonicContact OD1-NE 3.18Å; D88-R177 PolarHBondContact OD1-NE 3.31Å; D88-R177 IonicContact OD1-NH2 2.84Å; D88-R177 IonicContact OD2-NH2 2.73Å
89	R	74	Confident	71.9	Confident	129 Å²	129	65.9 Å²	65.9	49%	0.487	35%	0.348	S	S	.	.	H	α-helix	trans	-71.8	-50.5	171.4	-171.8	-176.2	-63.5	91.3	0.9	112.1	E85 T86 K87 L91 S92 E93	E85-R89 WeakPolarHBondContact O-CB 3.23Å; E85-R89 PolarHBondContact O-N 2.83Å; E85-R89 VanDerWaalsContact O-N 3.14Å; E85-R89 PolarHBondContact O-NH1 3.41Å; T86-R89 WeakPolarHBondContact O-CB 3.41Å; T86-R89 PolarHBondContact O-N 2.71Å; K87-R89 PolarHBondContact O-N 3.48Å; R89-L91 PolarHBondContact O-N 3.41Å; R89-S92 WeakPolarHBondContact O-CA 3.34Å; R89-S92 WeakPolarHBondContact O-CB 3.46Å; R89-S92 PolarHBondContact O-N 2.96Å; R89-E93 WeakPolarHBondContact O-CG 3.48Å; R89-E93 PolarHBondContact O-N 3.19Å
90	E	73.6	Confident	72.2	Confident	76 Å²	76	64.8 Å²	64.8	36%	0.355	34%	0.342	S	S	.	.	H	α-helix	trans	-52.9	-43.2	173.5	-73.7	177	-164.7	0	0	111.5	T86 K87 E93 L94	T86-E90 PolarHBondContact O-N 2.84Å; K87-E90 WeakPolarHBondContact CD-OE2 3.48Å; K87-E90 VanDerWaalsContact CE-OE2 3.32Å; K87-E90 WeakPolarHBondContact CE-OE2 3.38Å; K87-E90 IonicContact NZ-OE1 3.13Å; K87-E90 IonicContact NZ-OE2 3.08Å; K87-E90 PolarHBondContact NZ-OE2 3.17Å; K87-E90 PolarHBondContact O-N 3.18Å; E90-E93 PolarHBondContact O-N 3.17Å; E90-L94 WeakPolarHBondContact O-CB 3.49Å; E90-L94 VanDerWaalsContact O-CG 3.31Å; E90-L94 WeakPolarHBondContact O-CG 3.28Å; E90-L94 PolarHBondContact O-N 2.87Å
91	L	72.2	Confident	72.4	Confident	3 Å²	3	64.1 Å²	64.1	2%	0.016	34%	0.34	C	S	.	.	H	α-helix	trans	-71.7	-31.8	-179.6	-149.5	157	0	0	0	111.8	K87 R89 R95 L170 A173 E174 R177	K87-L91 VanDerWaalsContact O-CB 3.26Å; K87-L91 WeakPolarHBondContact O-CB 3.39Å; K87-L91 PolarHBondContact O-N 3.24Å; R89-L91 PolarHBondContact O-N 3.41Å; L91-R95 HydrophobicContact CD2-CG 4.16Å; L91-R95 VanDerWaalsContact CD2-NE 3.29Å; L91-R95 WeakPolarHBondContact O-CB 3.32Å; L91-R95 VanDerWaalsContact O-CG 3.27Å; L91-R95 WeakPolarHBondContact O-CG 3.47Å; L91-R95 PolarHBondContact O-N 3.34Å; L91-L170 HydrophobicContact CD2-CD1 4.09Å; L91-A173 HydrophobicContact CD1-CB 3.99Å; L91-A173 HydrophobicContact CG-CB 4.04Å; L91-E174 HydrophobicContact CD1-CG 3.82Å; L91-E174 HydrophobicContact CD2-CG 4.14Å; L91-E174 HydrophobicContact CG-CG 4.39Å; L91-R177 HydrophobicContact CD1-CB 4.12Å
92	S	73.7	Confident	72.8	Confident	75 Å²	75	65.5 Å²	65.5	52%	0.524	35%	0.347	S	S	.	.	H	α-helix	trans	-68.1	-41.4	171.7	-61.3	0	0	0	0	112.1	D88 R89 R95 L96	D88-S92 WeakPolarHBondContact O-CB 3.48Å; D88-S92 PolarHBondContact O-N 3.36Å; D88-S92 PolarHBondContact O-OG 3Å; R89-S92 WeakPolarHBondContact O-CA 3.34Å; R89-S92 WeakPolarHBondContact O-CB 3.46Å; R89-S92 PolarHBondContact O-N 2.96Å; S92-R95 PolarHBondContact O-N 3.31Å; S92-L96 PolarHBondContact O-N 3.13Å
93	E	76.1	Confident	73.3	Confident	121 Å²	121	68.4 Å²	68.4	57%	0.565	35%	0.352	S	S	*	.	H	α-helix	trans	-65.1	-43	174.4	-70.8	171.9	-162.6	0	0	111.7	R89 E90 R95 L96 A97	R89-E93 WeakPolarHBondContact O-CG 3.48Å; R89-E93 PolarHBondContact O-N 3.19Å; E90-E93 PolarHBondContact O-N 3.17Å; E93-R95 PolarHBondContact O-N 2.88Å; E93-L96 PolarHBondContact O-N 3.35Å; E93-A97 WeakPolarHBondContact O-CB 3.45Å; E93-A97 PolarHBondContact O-N 3.41Å
94	L	74.8	Confident	73.5	Confident	39 Å²	39	70.2 Å²	70.2	20%	0.204	36%	0.356	C	S	.	.	H	α-helix	trans	-63.1	-39.5	173.9	-74.9	169.7	0	0	0	112.4	E90 A97 H98 R169 L170 A173	E90-L94 WeakPolarHBondContact O-CB 3.49Å; E90-L94 VanDerWaalsContact O-CG 3.31Å; E90-L94 WeakPolarHBondContact O-CG 3.28Å; E90-L94 PolarHBondContact O-N 2.87Å; L94-A97 PolarHBondContact O-N 2.8Å; L94-H98 WeakPolarHBondContact O-CB 3.33Å; L94-H98 PolarHBondContact O-N 2.83Å; L94-R169 HydrophobicContact CD2-CB 4.09Å; L94-L170 HydrophobicContact CB-CD1 4.26Å; L94-A173 HydrophobicContact CD1-CB 3.85Å
95	R	76.4	Confident	73.7	Confident	117 Å²	117	72.1 Å²	72.1	44%	0.442	36%	0.363	S	S	.	.	H	α-helix	trans	-64.4	-42.1	173.6	-78.6	176.7	176	163.1	2.3	111.9	L91 S92 E93 H98 L99 L170 E174	L91-R95 HydrophobicContact CD2-CG 4.16Å; L91-R95 VanDerWaalsContact CD2-NE 3.29Å; L91-R95 WeakPolarHBondContact O-CB 3.32Å; L91-R95 VanDerWaalsContact O-CG 3.27Å; L91-R95 WeakPolarHBondContact O-CG 3.47Å; L91-R95 PolarHBondContact O-N 3.34Å; S92-R95 PolarHBondContact O-N 3.31Å; E93-R95 PolarHBondContact O-N 2.88Å; R95-H98 PolarHBondContact O-N 3.34Å; R95-L99 WeakPolarHBondContact O-CB 3.5Å; R95-L99 VanDerWaalsContact O-CG 3.32Å; R95-L99 WeakPolarHBondContact O-CG 3.37Å; R95-L99 PolarHBondContact O-N 3.49Å; R95-L170 HydrophobicContact CG-CD1 3.53Å; R95-E174 IonicContact CZ-OE1 2.85Å; R95-E174 IonicContact NE-OE1 2.66Å; R95-E174 IonicContact NH2-OE1 3.11Å; R95-E174 PolarHBondContact NH2-OE1 3.22Å
96	L	76.2	Confident	74.2	Confident	111 Å²	111	70.2 Å²	70.2	58%	0.581	36%	0.358	S	S	*	.	H	α-helix	trans	-63.2	-46.8	175.5	-174.3	64.4	0	0	0	110.8	S92 E93 H98 L99 T100	S92-L96 PolarHBondContact O-N 3.13Å; E93-L96 PolarHBondContact O-N 3.35Å; L96-H98 VanDerWaalsContact C-N 3.34Å; L96-H98 PolarHBondContact O-N 2.86Å; L96-L99 PolarHBondContact O-N 3.3Å; L96-L99 VanDerWaalsContact O-N 3.15Å; L96-T100 PolarHBondContact O-N 3.49Å; L96-T100 PolarHBondContact O-OG1 2.87Å
97	A	71.9	Confident	74.4	Confident	53 Å²	53	72.9 Å²	72.9	44%	0.438	36%	0.364	S	S	.	.	H	α-helix	trans	-59.6	-41.5	176.8	0	0	0	0	0	112.7	E93 L94 T100 A101	E93-A97 WeakPolarHBondContact O-CB 3.45Å; E93-A97 PolarHBondContact O-N 3.41Å; L94-A97 PolarHBondContact O-N 2.8Å; A97-T100 PolarHBondContact O-N 3.27Å; A97-A101 WeakPolarHBondContact O-CB 3.48Å; A97-A101 PolarHBondContact O-N 3Å
98	H	73.6	Confident	74.5	Confident	41 Å²	41	72.1 Å²	72.1	19%	0.19	37%	0.365	C	S	.	.	H	α-helix	trans	-65.3	-39.1	174.6	179.8	-97.1	0	0	0	112.5	L94 R95 L96 A101 L102 A166	L94-H98 WeakPolarHBondContact O-CB 3.33Å; L94-H98 PolarHBondContact O-N 2.83Å; R95-H98 PolarHBondContact O-N 3.34Å; L96-H98 VanDerWaalsContact C-N 3.34Å; L96-H98 PolarHBondContact O-N 2.86Å; H98-A101 PolarHBondContact O-N 3.44Å; H98-L102 VanDerWaalsContact CE1-CD1 3.49Å; H98-L102 WeakPolarHBondContact CE1-CD1 3.41Å; H98-L102 WeakPolarHBondContact O-CG 3.47Å; H98-L102 PolarHBondContact O-N 3.3Å; H98-A166 HydrophobicContact CB-CB 4.48Å
99	L	75.9	Confident	74.7	Confident	98 Å²	98	73.7 Å²	73.7	51%	0.513	37%	0.37	S	S	.	.	H	α-helix	trans	-65.2	-44.7	173.5	-74.2	168.4	0	0	0	111.9	R95 L96 A101 L102 E103	R95-L99 WeakPolarHBondContact O-CB 3.5Å; R95-L99 VanDerWaalsContact O-CG 3.32Å; R95-L99 WeakPolarHBondContact O-CG 3.37Å; R95-L99 PolarHBondContact O-N 3.49Å; L96-L99 PolarHBondContact O-N 3.3Å; L96-L99 VanDerWaalsContact O-N 3.15Å; L99-A101 VanDerWaalsContact C-N 3.34Å; L99-A101 PolarHBondContact O-N 3.04Å; L99-L102 WeakPolarHBondContact O-CB 3.29Å; L99-L102 PolarHBondContact O-N 2.99Å; L99-E103 PolarHBondContact O-N 3.02Å
100	T	76	Confident	74.9	Confident	64 Å²	64	75 Å²	75	39%	0.393	38%	0.375	S	S	.	.	H	α-helix	trans	-62	-41.4	176.1	-51.4	0	0	0	0	111.4	L96 A97 L102 E103 E104	L96-T100 PolarHBondContact O-N 3.49Å; L96-T100 PolarHBondContact O-OG1 2.87Å; A97-T100 PolarHBondContact O-N 3.27Å; T100-L102 PolarHBondContact O-N 3.07Å; T100-E103 PolarHBondContact O-N 3.25Å; T100-E104 WeakPolarHBondContact O-CG 3.39Å; T100-E104 PolarHBondContact O-N 2.72Å
101	A	71.3	Confident	75	Confident	12 Å²	12	73.4 Å²	73.4	10%	0.099	38%	0.376	C	S	.	.	H	α-helix	trans	-63.8	-38.6	174.9	0	0	0	0	0	112.6	A97 H98 L99 K105	A97-A101 WeakPolarHBondContact O-CB 3.48Å; A97-A101 PolarHBondContact O-N 3Å; H98-A101 PolarHBondContact O-N 3.44Å; L99-A101 VanDerWaalsContact C-N 3.34Å; L99-A101 PolarHBondContact O-N 3.04Å; A101-K105 WeakPolarHBondContact O-CB 3.36Å; A101-K105 PolarHBondContact O-N 3.44Å
102	L	73.1	Confident	74.9	Confident	65 Å²	65	74.5 Å²	74.5	34%	0.34	38%	0.381	S	S	.	.	H	α-helix	trans	-62.9	-45.1	171.1	-82.8	167.3	0	0	0	111.9	H98 L99 T100 K105 V106 L163	H98-L102 VanDerWaalsContact CE1-CD1 3.49Å; H98-L102 WeakPolarHBondContact CE1-CD1 3.41Å; H98-L102 WeakPolarHBondContact O-CG 3.47Å; H98-L102 PolarHBondContact O-N 3.3Å; L99-L102 WeakPolarHBondContact O-CB 3.29Å; L99-L102 PolarHBondContact O-N 2.99Å; T100-L102 PolarHBondContact O-N 3.07Å; L102-K105 PolarHBondContact O-N 3.33Å; L102-V106 WeakPolarHBondContact O-CG2 3.49Å; L102-V106 PolarHBondContact O-N 3.31Å; L102-L163 HydrophobicContact CD2-CD1 3.69Å; L102-L163 HydrophobicContact CG-CD1 3.99Å
103	E	77.7	Confident	75	Confident	110 Å²	110	75.5 Å²	75.5	51%	0.514	38%	0.378	S	S	.	.	H	α-helix	trans	-63	-43.1	177.3	-76.1	-169.6	-171.6	0	0	112.6	L99 T100 V106 K107	L99-E103 PolarHBondContact O-N 3.02Å; T100-E103 PolarHBondContact O-N 3.25Å; E103-V106 PolarHBondContact O-N 3.04Å; E103-K107 WeakPolarHBondContact O-CB 3.31Å; E103-K107 VanDerWaalsContact O-CG 3.27Å; E103-K107 WeakPolarHBondContact O-CG 3.28Å; E103-K107 PolarHBondContact O-N 3.32Å; E103-K107 IonicContact OE2-NZ 3.81Å; E103-K107 PolarHBondContact OE2-NZ 3.02Å
104	E	74.4	Confident	75.1	Confident	78 Å²	78	75.1 Å²	75.1	36%	0.364	38%	0.38	S	S	.	.	H	α-helix	trans	-62.8	-43.4	175	-74.8	-168.6	154.3	0	0	111.5	T100 V106 K107 S108 K159	T100-E104 WeakPolarHBondContact O-CG 3.39Å; T100-E104 PolarHBondContact O-N 2.72Å; E104-V106 VanDerWaalsContact C-N 3.33Å; E104-V106 PolarHBondContact O-N 3.02Å; E104-K107 PolarHBondContact O-N 2.85Å; E104-K107 VanDerWaalsContact O-N 3.17Å; E104-S108 PolarHBondContact O-N 3.24Å; E104-S108 PolarHBondContact O-OG 2.73Å; E104-K159 HydrophobicContact CB-CD 4.33Å; E104-K159 VanDerWaalsContact OE2-CE 3.31Å; E104-K159 WeakPolarHBondContact OE2-CE 3.39Å; E104-K159 IonicContact OE2-NZ 3.18Å; E104-K159 PolarHBondContact OE2-NZ 3.39Å
105	K	74.4	Confident	74.7	Confident	58 Å²	58	75 Å²	75	25%	0.252	38%	0.378	S	S	.	.	H	α-helix	trans	-58.5	-44	173.5	179.7	176.4	174.3	177.3	0	111.7	A101 L102 S108 Q109 L156 N160 L163	A101-K105 WeakPolarHBondContact O-CB 3.36Å; A101-K105 PolarHBondContact O-N 3.44Å; L102-K105 PolarHBondContact O-N 3.33Å; K105-S108 PolarHBondContact O-N 3.37Å; K105-Q109 WeakPolarHBondContact O-CB 3.34Å; K105-Q109 PolarHBondContact O-N 3.49Å; K105-L156 HydrophobicContact CG-CD2 4.4Å; K105-N160 PolarHBondContact NZ-OD1 2.88Å; K105-L163 HydrophobicContact CD-CD1 3.99Å
106	V	78.3	Confident	74.5	Confident	60 Å²	60	73.1 Å²	73.1	36%	0.364	38%	0.376	S	S	.	.	H	α-helix	trans	-65.2	-38	175.8	170.1	0	0	0	0	111.7	L102 E103 E104 Q109 R110	L102-V106 WeakPolarHBondContact O-CG2 3.49Å; L102-V106 PolarHBondContact O-N 3.31Å; E103-V106 PolarHBondContact O-N 3.04Å; E104-V106 VanDerWaalsContact C-N 3.33Å; E104-V106 PolarHBondContact O-N 3.02Å; V106-Q109 PolarHBondContact O-N 3.32Å; V106-R110 WeakPolarHBondContact O-CB 3.29Å; V106-R110 WeakPolarHBondContact O-CG 3.39Å; V106-R110 PolarHBondContact O-N 2.93Å
107	K	77.1	Confident	74.4	Confident	123 Å²	123	70.5 Å²	70.5	54%	0.535	37%	0.367	S	S	.	.	H	α-helix	trans	-64.4	-45.6	174	-72.6	162	-174	158.5	0	111.4	E103 E104 R110 A111	E103-K107 WeakPolarHBondContact O-CB 3.31Å; E103-K107 VanDerWaalsContact O-CG 3.27Å; E103-K107 WeakPolarHBondContact O-CG 3.28Å; E103-K107 PolarHBondContact O-N 3.32Å; E103-K107 IonicContact OE2-NZ 3.81Å; E103-K107 PolarHBondContact OE2-NZ 3.02Å; E104-K107 PolarHBondContact O-N 2.85Å; E104-K107 VanDerWaalsContact O-N 3.17Å; K107-R110 PolarHBondContact O-N 3.15Å; K107-A111 WeakPolarHBondContact O-CB 3.14Å; K107-A111 PolarHBondContact O-N 3.04Å
108	S	73.5	Confident	74.3	Confident	30 Å²	30	75.4 Å²	75.4	21%	0.21	38%	0.375	C	S	.	.	H	α-helix	trans	-63.5	-40.2	175.3	-62.2	0	0	0	0	112.4	E104 K105 A111 L112	E104-S108 PolarHBondContact O-N 3.24Å; E104-S108 PolarHBondContact O-OG 2.73Å; K105-S108 PolarHBondContact O-N 3.37Å; S108-A111 PolarHBondContact O-N 3.24Å; S108-L112 PolarHBondContact O-N 2.84Å
109	Q	74.2	Confident	73.7	Confident	84 Å²	84	74.6 Å²	74.6	39%	0.393	37%	0.374	S	S	.	.	H	α-helix	trans	-66.1	-44.6	176.3	-173.1	-177	-30.5	0	0	111.6	K105 V106 A111 L112 E113 L156	K105-Q109 WeakPolarHBondContact O-CB 3.34Å; K105-Q109 PolarHBondContact O-N 3.49Å; V106-Q109 PolarHBondContact O-N 3.32Å; Q109-A111 VanDerWaalsContact C-N 3.35Å; Q109-A111 PolarHBondContact O-N 2.86Å; Q109-L112 WeakPolarHBondContact O-CB 3.37Å; Q109-L112 PolarHBondContact O-N 3.13Å; Q109-E113 WeakPolarHBondContact CG-OE1 3.27Å; Q109-E113 PolarHBondContact NE2-OE1 3.31Å; Q109-E113 WeakPolarHBondContact O-CG 3.23Å; Q109-E113 PolarHBondContact O-N 3.42Å; Q109-L156 HydrophobicContact CB-CD2 4.35Å
110	R	78.8	Confident	73.3	Confident	156 Å²	156	77.5 Å²	77.5	59%	0.589	38%	0.383	S	S	*	.	H	α-helix	trans	-61.5	-41.5	174.2	-75.7	178.1	-176.5	170.9	3	112.2	V106 K107 L112 E113 D114	V106-R110 WeakPolarHBondContact O-CB 3.29Å; V106-R110 WeakPolarHBondContact O-CG 3.39Å; V106-R110 PolarHBondContact O-N 2.93Å; K107-R110 PolarHBondContact O-N 3.15Å; R110-L112 VanDerWaalsContact C-N 3.29Å; R110-L112 PolarHBondContact O-N 2.77Å; R110-E113 PolarHBondContact O-N 2.85Å; R110-E113 VanDerWaalsContact O-N 3.16Å; R110-D114 WeakPolarHBondContact O-CB 3.33Å; R110-D114 PolarHBondContact O-N 3.27Å
111	A	74.7	Confident	72.8	Confident	44 Å²	44	80.9 Å²	80.9	36%	0.364	39%	0.392	S	S	.	.	H	α-helix	trans	-60.8	-38.4	175.6	0	0	0	0	0	112.2	K107 S108 Q109 H115	K107-A111 WeakPolarHBondContact O-CB 3.14Å; K107-A111 PolarHBondContact O-N 3.04Å; S108-A111 PolarHBondContact O-N 3.24Å; Q109-A111 VanDerWaalsContact C-N 3.35Å; Q109-A111 PolarHBondContact O-N 2.86Å; A111-H115 WeakPolarHBondContact O-CB 3.15Å; A111-H115 PolarHBondContact O-N 2.85Å
112	L	71.7	Confident	72.1	Confident	25 Å²	25	82.1 Å²	82.1	13%	0.131	40%	0.399	C	S	.	.	H	α-helix	trans	-65.4	-45.5	171.9	-174.2	79.5	0	0	0	111.8	S108 Q109 R110 H115 L116 L152 L156	S108-L112 PolarHBondContact O-N 2.84Å; Q109-L112 WeakPolarHBondContact O-CB 3.37Å; Q109-L112 PolarHBondContact O-N 3.13Å; R110-L112 VanDerWaalsContact C-N 3.29Å; R110-L112 PolarHBondContact O-N 2.77Å; L112-H115 PolarHBondContact O-N 2.9Å; L112-L116 HydrophobicContact CD2-CD1 4.48Å; L112-L116 HydrophobicContact CG-CD1 4.03Å; L112-L116 WeakPolarHBondContact O-CB 3.48Å; L112-L116 VanDerWaalsContact O-CG 3.24Å; L112-L116 WeakPolarHBondContact O-CG 3.39Å; L112-L116 PolarHBondContact O-N 2.97Å; L112-L152 HydrophobicContact CD1-CB 3.64Å; L112-L152 HydrophobicContact CD1-CD1 3.89Å; L112-L152 HydrophobicContact CD1-CG 4.42Å; L112-L156 HydrophobicContact CD2-CD1 3.92Å
113	E	75.6	Confident	71.4	Confident	97 Å²	97	83.7 Å²	83.7	45%	0.453	41%	0.411	S	S	.	.	H	α-helix	trans	-62.8	-43.9	178.4	-72.4	169.5	-172.5	0	0	112.3	Q109 R110 L116 S117	Q109-E113 WeakPolarHBondContact CG-OE1 3.27Å; Q109-E113 PolarHBondContact NE2-OE1 3.31Å; Q109-E113 WeakPolarHBondContact O-CG 3.23Å; Q109-E113 PolarHBondContact O-N 3.42Å; R110-E113 PolarHBondContact O-N 2.85Å; R110-E113 VanDerWaalsContact O-N 3.16Å; E113-L116 PolarHBondContact O-N 2.99Å; E113-S117 VanDerWaalsContact O-CB 3.29Å; E113-S117 WeakPolarHBondContact O-CB 3.47Å; E113-S117 PolarHBondContact O-N 2.98Å
114	D	76.6	Confident	70.5	Confident	113 Å²	113	82.1 Å²	82.1	60%	0.604	42%	0.418	S	S	*	.	H	α-helix	trans	-66.1	-40.7	175.6	-76.1	-31.3	0	0	0	111.6	R110 S117 Y118	R110-D114 WeakPolarHBondContact O-CB 3.33Å; R110-D114 PolarHBondContact O-N 3.27Å; D114-S117 WeakPolarHBondContact O-CB 3.48Å; D114-S117 PolarHBondContact O-N 3.43Å; D114-Y118 WeakPolarHBondContact O-CB 3.27Å; D114-Y118 PolarHBondContact O-N 2.92Å
115	H	68.3	Low	69.6	Low	37 Å²	37	84.8 Å²	84.8	17%	0.171	43%	0.434	C	S	.	.	H	α-helix	trans	-63.7	-47.9	175	-169	-92.1	0	0	0	111.4	A111 L112 S117 Y118 C119 N145 L148 L152	A111-H115 WeakPolarHBondContact O-CB 3.15Å; A111-H115 PolarHBondContact O-N 2.85Å; L112-H115 PolarHBondContact O-N 2.9Å; H115-S117 VanDerWaalsContact C-N 3.25Å; H115-S117 PolarHBondContact O-N 3.1Å; H115-Y118 PolarHBondContact O-N 2.86Å; H115-Y118 VanDerWaalsContact O-N 3.13Å; H115-C119 VanDerWaalsContact CE1-SG 3.54Å; H115-C119 PolarHBondContact O-N 2.99Å; H115-C119 PolarHBondContact O-SG 3.18Å; H115-N145 PolarHBondContact CE1-OD1 2.88Å; H115-N145 PolarHBondContact NE2-OD1 3.25Å; H115-L148 VanDerWaalsContact NE2-CD2 3.3Å; H115-L148 WeakPolarHBondContact NE2-CD2 3.43Å; H115-L152 HydrophobicContact CB-CD1 4.46Å
116	L	70.4	Confident	68.5	Low	77 Å²	77	84.4 Å²	84.4	40%	0.403	44%	0.439	S	S	.	.	H	α-helix	trans	-60.2	-34.4	174.2	-73	167.1	0	0	0	112.4	L112 E113 K120	L112-L116 HydrophobicContact CD2-CD1 4.48Å; L112-L116 HydrophobicContact CG-CD1 4.03Å; L112-L116 WeakPolarHBondContact O-CB 3.48Å; L112-L116 VanDerWaalsContact O-CG 3.24Å; L112-L116 WeakPolarHBondContact O-CG 3.39Å; L112-L116 PolarHBondContact O-N 2.97Å; E113-L116 PolarHBondContact O-N 2.99Å; L116-K120 VanDerWaalsContact O-CG 3.28Å; L116-K120 WeakPolarHBondContact O-CG 3.37Å; L116-K120 PolarHBondContact O-N 3.45Å; L116-K120 VanDerWaalsContact O-N 3.17Å
117	S	75.8	Confident	67.3	Low	55 Å²	55	92.4 Å²	92.4	39%	0.385	46%	0.463	S	S	.	.	H	α-helix	trans	-67.7	-43.4	173.6	-174.3	0	0	0	0	111.9	E113 D114 H115 K120 K121	E113-S117 VanDerWaalsContact O-CB 3.29Å; E113-S117 WeakPolarHBondContact O-CB 3.47Å; E113-S117 PolarHBondContact O-N 2.98Å; D114-S117 WeakPolarHBondContact O-CB 3.48Å; D114-S117 PolarHBondContact O-N 3.43Å; H115-S117 VanDerWaalsContact C-N 3.25Å; H115-S117 PolarHBondContact O-N 3.1Å; S117-K120 PolarHBondContact O-N 3.47Å; S117-K121 PolarHBondContact O-N 2.79Å; S117-K121 VanDerWaalsContact O-N 3.14Å
118	Y	68.6	Low	65.8	Low	157 Å²	157	91.3 Å²	91.3	62%	0.616	48%	0.476	S	S	*	.	H	α-helix	trans	-64	-46.8	175.2	-178.2	-98.5	0	0	0	112	D114 H115 K120 K121 S122	D114-Y118 WeakPolarHBondContact O-CB 3.27Å; D114-Y118 PolarHBondContact O-N 2.92Å; H115-Y118 PolarHBondContact O-N 2.86Å; H115-Y118 VanDerWaalsContact O-N 3.13Å; Y118-K120 VanDerWaalsContact C-N 3.29Å; Y118-K120 PolarHBondContact O-N 3.45Å; Y118-K121 PolarHBondContact O-N 2.78Å; Y118-K121 VanDerWaalsContact O-N 3.1Å; Y118-S122 WeakPolarHBondContact O-CB 3.32Å; Y118-S122 PolarHBondContact O-N 2.94Å
119	C	61	Low	64.8	Low	24 Å²	24	96.3 Å²	96.3	16%	0.162	50%	0.501	C	S	.	.	H	α-helix	trans	-55.8	-43.6	174.6	-61	0	0	0	0	111.6	H115 K121 S122 V123 N145	H115-C119 VanDerWaalsContact CE1-SG 3.54Å; H115-C119 PolarHBondContact O-N 2.99Å; H115-C119 PolarHBondContact O-SG 3.18Å; C119-K121 VanDerWaalsContact C-N 3.34Å; C119-K121 PolarHBondContact O-N 3.08Å; C119-S122 PolarHBondContact O-N 2.79Å; C119-V123 WeakPolarHBondContact O-CG2 3.44Å; C119-V123 PolarHBondContact O-N 3.37Å; C119-V123 VanDerWaalsContact O-N 3.09Å; C119-N145 PolarHBondContact SG-OD1 3.35Å
120	K	67.2	Low	63.6	Low	159 Å²	159	100.8 Å²	100.8	69%	0.691	53%	0.527	S	S	*	.	H	α-helix	trans	-62.7	-35.9	177.3	-77.1	170.7	-177.6	173.5	0	113.2	L116 S117 Y118 A124	L116-K120 VanDerWaalsContact O-CG 3.28Å; L116-K120 WeakPolarHBondContact O-CG 3.37Å; L116-K120 PolarHBondContact O-N 3.45Å; L116-K120 VanDerWaalsContact O-N 3.17Å; S117-K120 PolarHBondContact O-N 3.47Å; Y118-K120 VanDerWaalsContact C-N 3.29Å; Y118-K120 PolarHBondContact O-N 3.45Å; K120-A124 WeakPolarHBondContact O-CB 3.42Å; K120-A124 PolarHBondContact O-N 2.96Å
121	K	66.2	Low	62.5	Low	135 Å²	135	97 Å²	97	59%	0.587	52%	0.519	S	S	*	.	H	α-helix	trans	-73.8	-47.9	174.9	-72.8	-179.1	177.9	178.4	0	112.1	S117 Y118 C119 V123 A124 D125	S117-K121 PolarHBondContact O-N 2.79Å; S117-K121 VanDerWaalsContact O-N 3.14Å; Y118-K121 PolarHBondContact O-N 2.78Å; Y118-K121 VanDerWaalsContact O-N 3.1Å; C119-K121 VanDerWaalsContact C-N 3.34Å; C119-K121 PolarHBondContact O-N 3.08Å; K121-V123 PolarHBondContact O-N 3.21Å; K121-A124 WeakPolarHBondContact O-CA 3.5Å; K121-A124 WeakPolarHBondContact O-CB 3.5Å; K121-A124 PolarHBondContact O-N 3.07Å; K121-D125 PolarHBondContact O-N 3.41Å
122	S	57.4	Low	61.9	Low	37 Å²	37	103.7 Å²	103.7	26%	0.259	54%	0.535	S	S	.	.	H	α-helix	trans	-56.2	-36.5	179.3	175.2	0	0	0	0	112.9	Y118 C119 S126	Y118-S122 WeakPolarHBondContact O-CB 3.32Å; Y118-S122 PolarHBondContact O-N 2.94Å; C119-S122 PolarHBondContact O-N 2.79Å; S122-S126 PolarHBondContact O-OG 3.35Å
123	V	58.6	Low	61.6	Low	98 Å²	98	109.6 Å²	109.6	59%	0.594	56%	0.562	S	S	*	*	H	α-helix	trans	-78.1	-21.6	176.3	173.7	0	0	0	0	112.6	C119 K121 S126	C119-V123 WeakPolarHBondContact O-CG2 3.44Å; C119-V123 PolarHBondContact O-N 3.37Å; C119-V123 VanDerWaalsContact O-N 3.09Å; K121-V123 PolarHBondContact O-N 3.21Å; V123-S126 PolarHBondContact O-OG 3.36Å
124	A	57.9	Low	60.8	Low	78 Å²	78	109.4 Å²	109.4	65%	0.645	56%	0.564	S	S	*	*	H	α-helix	trans	-84.7	-32.5	177	0	0	0	0	0	113.1	K120 K121	K120-A124 WeakPolarHBondContact O-CB 3.42Å; K120-A124 PolarHBondContact O-N 2.96Å; K121-A124 WeakPolarHBondContact O-CA 3.5Å; K121-A124 WeakPolarHBondContact O-CB 3.5Å; K121-A124 PolarHBondContact O-N 3.07Å
125	D	55.1	Low	60.3	Low	133 Å²	133	109.6 Å²	109.6	71%	0.711	56%	0.56	S	S	*	*	H	α-helix	trans	-83.9	-17.5	-177.9	-70.9	-34	0	0	0	113.5	K121 R127	K121-D125 PolarHBondContact O-N 3.41Å; D125-R127 PolarHBondContact O-N 3.12Å
126	S	52.3	Low	60.5	Low	50 Å²	50	111.2 Å²	111.2	35%	0.35	57%	0.569	S	S	.	*			trans	-74.3	86.2	176.4	56.3	0	0	0	0	112.2	S122 V123 A128	S122-S126 PolarHBondContact O-OG 3.35Å; V123-S126 PolarHBondContact O-OG 3.36Å; S126-A128 PolarHBondContact O-N 3.45Å
127	R	52.5	Low	60.4	Low	229 Å²	229	109.9 Å²	109.9	86%	0.864	57%	0.57	S	S	*	*			trans	-61	119.3	162.8	-80.7	-177.1	170.2	168.4	-2.2	109.6	D125 D129	D125-R127 PolarHBondContact O-N 3.12Å; R127-D129 PolarHBondContact O-N 2.92Å; R127-D129 VanDerWaalsContact O-N 3.12Å
128	A	46.2	Very low	59.9	Low	99 Å²	99	110.5 Å²	110.5	82%	0.818	57%	0.568	S	S	*	*			trans	-78.6	90.8	178	0	0	0	0	0	110.8	S126	S126-A128 PolarHBondContact O-N 3.45Å
129	D	50.9	Low	60.2	Low	135 Å²	135	108 Å²	108	72%	0.722	56%	0.56	S	S	*	*			trans	-106.3	89.1	167.9	-76.3	-36.1	0	0	0	109.7	R127 N131	R127-D129 PolarHBondContact O-N 2.92Å; R127-D129 VanDerWaalsContact O-N 3.12Å; D129-N131 VanDerWaalsContact C-N 3.26Å; D129-N131 PolarHBondContact O-N 2.91Å
130	D	50.6	Low	60.9	Low	178 Å²	178	112.9 Å²	112.9	95%	0.952	58%	0.579	S	S	*	*	S	Bend	trans	39.5	11.1	156.5	-70.7	-13.3	0	0	0	122.8
131	N	55.3	Low	61.1	Low	78 Å²	78	109.7 Å²	109.7	42%	0.417	57%	0.569	S	S	.	*			trans	-98.1	118.5	-178.5	-166.4	19.2	0	0	0	112.7	D129 E133 D134 F135	D129-N131 VanDerWaalsContact C-N 3.26Å; D129-N131 PolarHBondContact O-N 2.91Å; N131-E133 PolarHBondContact O-N 3.29Å; N131-D134 HydrophobicContact CB-CB 4.34Å; N131-D134 VanDerWaalsContact CB-OD2 3.26Å; N131-D134 WeakPolarHBondContact CB-OD2 3.35Å; N131-D134 PolarHBondContact ND2-OD2 2.94Å; N131-D134 PolarHBondContact O-N 2.78Å; N131-F135 PolarHBondContact O-N 2.99Å
132	W	62.4	Low	61.4	Low	183 Å²	183	111 Å²	111	69%	0.693	57%	0.572	S	S	*	*	H	α-helix	trans	-66	-25.1	-177.7	178.9	-103.3	0	0	0	113.4	F135 N136	W132-F135 HydrophobicContact CE3-CD1 4.35Å; W132-F135 HydrophobicContact CH2-CD1 4.45Å; W132-F135 HydrophobicContact CZ3-CD1 4.08Å; W132-F135 HydrophobicContact CZ3-CE1 4.42Å; W132-N136 VanDerWaalsContact CE2-ND2 3.34Å; W132-N136 PolarHBondContact NE1-ND2 2.88Å; W132-N136 VanDerWaalsContact NE1-ND2 3.11Å; W132-N136 PolarHBondContact O-N 3.2Å; W132-N136 PolarHBondContact O-ND2 3.49Å
133	E	65.5	Low	62.3	Low	150 Å²	150	113.9 Å²	113.9	70%	0.701	58%	0.581	S	S	*	*	H	α-helix	trans	-67.9	-41.9	174.2	-63	-171.2	154.4	0	0	111.2	N131 F135 N136 A137	N131-E133 PolarHBondContact O-N 3.29Å; E133-F135 PolarHBondContact O-N 3.13Å; E133-N136 PolarHBondContact O-N 2.92Å; E133-A137 PolarHBondContact O-N 3.37Å
134	D	59.2	Low	63.2	Low	92 Å²	92	113.1 Å²	113.1	49%	0.492	57%	0.573	S	S	.	*	H	α-helix	trans	-66.8	-35.7	178	-66.7	-44.8	0	0	0	112	N131 A137 L138	N131-D134 HydrophobicContact CB-CB 4.34Å; N131-D134 VanDerWaalsContact CB-OD2 3.26Å; N131-D134 WeakPolarHBondContact CB-OD2 3.35Å; N131-D134 PolarHBondContact ND2-OD2 2.94Å; N131-D134 PolarHBondContact O-N 2.78Å; D134-A137 PolarHBondContact O-N 3.46Å; D134-L138 WeakPolarHBondContact O-CB 3.4Å; D134-L138 PolarHBondContact O-N 3.03Å
135	F	64.9	Low	63.8	Low	118 Å²	118	111.2 Å²	111.2	52%	0.518	55%	0.552	S	S	.	*	H	α-helix	trans	-62.1	-42.7	172.8	179.1	-98.7	0	0	0	112.6	N131 W132 E133 L138 K139	N131-F135 PolarHBondContact O-N 2.99Å; W132-F135 HydrophobicContact CE3-CD1 4.35Å; W132-F135 HydrophobicContact CH2-CD1 4.45Å; W132-F135 HydrophobicContact CZ3-CD1 4.08Å; W132-F135 HydrophobicContact CZ3-CE1 4.42Å; E133-F135 PolarHBondContact O-N 3.13Å; F135-L138 PolarHBondContact O-N 3.19Å; F135-K139 WeakPolarHBondContact O-CB 3.32Å; F135-K139 PolarHBondContact O-N 3.36Å
136	N	72.4	Confident	64.9	Low	70 Å²	70	110.2 Å²	110.2	37%	0.374	55%	0.546	S	S	.	.	H	α-helix	trans	-70.7	-34.3	177.8	-74.3	-69.5	0	0	0	112.1	W132 E133 K139 K140	W132-N136 VanDerWaalsContact CE2-ND2 3.34Å; W132-N136 PolarHBondContact NE1-ND2 2.88Å; W132-N136 VanDerWaalsContact NE1-ND2 3.11Å; W132-N136 PolarHBondContact O-N 3.2Å; W132-N136 PolarHBondContact O-ND2 3.49Å; E133-N136 PolarHBondContact O-N 2.92Å; N136-K139 PolarHBondContact O-N 3.48Å; N136-K140 WeakPolarHBondContact O-CB 3.34Å; N136-K140 PolarHBondContact O-N 3.02Å
137	A	68.7	Low	66.2	Low	50 Å²	50	113.2 Å²	113.2	41%	0.413	56%	0.558	S	S	.	*	H	α-helix	trans	-62.8	-46.2	171.3	0	0	0	0	0	111.7	E133 D134 K140 L141	E133-A137 PolarHBondContact O-N 3.37Å; D134-A137 PolarHBondContact O-N 3.46Å; A137-K140 PolarHBondContact O-N 3.41Å; A137-L141 WeakPolarHBondContact O-CB 3.47Å; A137-L141 WeakPolarHBondContact O-CG 3.43Å; A137-L141 PolarHBondContact O-N 2.89Å
138	L	65	Low	67.3	Low	68 Å²	68	105.3 Å²	105.3	36%	0.356	53%	0.533	S	S	.	.	H	α-helix	trans	-62.2	-42.2	175	-106.6	142.4	0	0	0	112.7	D134 F135 L141 Y142	D134-L138 WeakPolarHBondContact O-CB 3.4Å; D134-L138 PolarHBondContact O-N 3.03Å; F135-L138 PolarHBondContact O-N 3.19Å; L138-L141 PolarHBondContact O-N 2.66Å; L138-Y142 PolarHBondContact O-N 3.38Å
139	K	74.2	Confident	68.5	Low	103 Å²	103	102.2 Å²	102.2	45%	0.448	51%	0.505	S	S	.	.	H	α-helix	trans	-62.8	-45.4	176.2	-171.9	-173.8	178.5	-126.1	0	111.3	F135 N136 Y142 E143	F135-K139 WeakPolarHBondContact O-CB 3.32Å; F135-K139 PolarHBondContact O-N 3.36Å; N136-K139 PolarHBondContact O-N 3.48Å; K139-Y142 WeakPolarHBondContact O-CB 3.43Å; K139-Y142 PolarHBondContact O-N 3.35Å; K139-Y142 VanDerWaalsContact O-N 3.17Å; K139-E143 WeakPolarHBondContact CE-OE1 3.24Å; K139-E143 IonicContact NZ-OE1 2.79Å; K139-E143 PolarHBondContact NZ-OE1 3.45Å; K139-E143 PolarHBondContact O-N 2.92Å
140	K	76.4	Confident	69.9	Low	128 Å²	128	98.8 Å²	98.8	56%	0.557	50%	0.495	S	S	*	.	H	α-helix	trans	-62.7	-45.3	177	-172.2	-176.9	174.4	-171.9	0	111.4	N136 A137 Y142 E143 D144	N136-K140 WeakPolarHBondContact O-CB 3.34Å; N136-K140 PolarHBondContact O-N 3.02Å; A137-K140 PolarHBondContact O-N 3.41Å; K140-Y142 VanDerWaalsContact C-N 3.26Å; K140-Y142 PolarHBondContact O-N 3.11Å; K140-E143 PolarHBondContact O-N 2.88Å; K140-E143 VanDerWaalsContact O-N 3.17Å; K140-D144 WeakPolarHBondContact O-CB 3.33Å; K140-D144 VanDerWaalsContact O-CG 3.31Å; K140-D144 PolarHBondContact O-N 2.76Å
141	L	71.6	Confident	71.3	Confident	91 Å²	91	94.9 Å²	94.9	48%	0.476	47%	0.471	S	S	.	.	H	α-helix	trans	-57.4	-38.1	173	-77.3	167.8	0	0	0	112	A137 L138 N145	A137-L141 WeakPolarHBondContact O-CB 3.47Å; A137-L141 WeakPolarHBondContact O-CG 3.43Å; A137-L141 PolarHBondContact O-N 2.89Å; L138-L141 PolarHBondContact O-N 2.66Å; L141-N145 WeakPolarHBondContact O-CB 3.49Å; L141-N145 PolarHBondContact O-N 3.11Å; L141-N145 PolarHBondContact O-ND2 3.49Å
142	Y	72.1	Confident	72.2	Confident	164 Å²	164	92.2 Å²	92.2	64%	0.643	46%	0.457	S	S	*	.	H	α-helix	trans	-67.2	-42.7	175.6	-174.7	-90.5	0	0	0	112.6	L138 K139 K140 N145 L146	L138-Y142 PolarHBondContact O-N 3.38Å; K139-Y142 WeakPolarHBondContact O-CB 3.43Å; K139-Y142 PolarHBondContact O-N 3.35Å; K139-Y142 VanDerWaalsContact O-N 3.17Å; K140-Y142 VanDerWaalsContact C-N 3.26Å; K140-Y142 PolarHBondContact O-N 3.11Å; Y142-N145 PolarHBondContact O-N 2.85Å; Y142-L146 WeakPolarHBondContact O-CB 3.43Å; Y142-L146 PolarHBondContact O-N 3.48Å
143	E	77.2	Confident	72.9	Confident	96 Å²	96	87.4 Å²	87.4	45%	0.449	45%	0.445	S	S	.	.	H	α-helix	trans	-64.8	-44.5	176.2	-70.7	172.5	177.5	0	0	111.4	K139 K140 L146 L147	K139-E143 WeakPolarHBondContact CE-OE1 3.24Å; K139-E143 IonicContact NZ-OE1 2.79Å; K139-E143 PolarHBondContact NZ-OE1 3.45Å; K139-E143 PolarHBondContact O-N 2.92Å; K140-E143 PolarHBondContact O-N 2.88Å; K140-E143 VanDerWaalsContact O-N 3.17Å; E143-L146 PolarHBondContact O-N 3.22Å; E143-L147 PolarHBondContact O-N 3.19Å; E143-L147 VanDerWaalsContact O-N 3.13Å
144	D	76.1	Confident	73.7	Confident	82 Å²	82	82.2 Å²	82.2	44%	0.439	43%	0.431	S	S	.	.	H	α-helix	trans	-63.4	-41.6	175.3	-68.7	-23	0	0	0	111.5	K140 L146 L147 L148	K140-D144 WeakPolarHBondContact O-CB 3.33Å; K140-D144 VanDerWaalsContact O-CG 3.31Å; K140-D144 PolarHBondContact O-N 2.76Å; D144-L146 PolarHBondContact O-N 2.97Å; D144-L147 PolarHBondContact O-N 2.95Å; D144-L148 WeakPolarHBondContact O-CB 3.33Å; D144-L148 PolarHBondContact O-N 2.8Å
145	N	71.9	Confident	74.6	Confident	39 Å²	39	82.6 Å²	82.6	21%	0.209	43%	0.429	C	S	.	.	H	α-helix	trans	-63.8	-38	175.3	-81.7	-49.1	0	0	0	112.6	H115 C119 L141 Y142 L148 S149	H115-N145 PolarHBondContact CE1-OD1 2.88Å; H115-N145 PolarHBondContact NE2-OD1 3.25Å; C119-N145 PolarHBondContact SG-OD1 3.35Å; L141-N145 WeakPolarHBondContact O-CB 3.49Å; L141-N145 PolarHBondContact O-N 3.11Å; L141-N145 PolarHBondContact O-ND2 3.49Å; Y142-N145 PolarHBondContact O-N 2.85Å; N145-L148 PolarHBondContact O-N 2.97Å; N145-S149 PolarHBondContact O-N 3.43Å
146	L	77.4	Confident	75.1	Confident	111 Å²	111	78.4 Å²	78.4	58%	0.581	41%	0.411	S	S	*	.	H	α-helix	trans	-67.4	-40.8	179	-165.5	77.2	0	0	0	111	Y142 E143 D144 S149 A150	Y142-L146 WeakPolarHBondContact O-CB 3.43Å; Y142-L146 PolarHBondContact O-N 3.48Å; E143-L146 PolarHBondContact O-N 3.22Å; D144-L146 PolarHBondContact O-N 2.97Å; L146-S149 PolarHBondContact O-N 3.45Å; L146-A150 PolarHBondContact O-N 2.96Å; L146-A150 VanDerWaalsContact O-N 3.16Å
147	L	78.8	Confident	75.5	Confident	113 Å²	113	78.3 Å²	78.3	59%	0.592	42%	0.416	S	S	*	.	H	α-helix	trans	-62.6	-46.3	174.7	-171.6	70	0	0	0	111.2	E143 D144 S149 A150 E151	E143-L147 PolarHBondContact O-N 3.19Å; E143-L147 VanDerWaalsContact O-N 3.13Å; D144-L147 PolarHBondContact O-N 2.95Å; L147-S149 VanDerWaalsContact C-N 3.34Å; L147-S149 PolarHBondContact O-N 3.38Å; L147-A150 PolarHBondContact O-N 3.49Å; L147-E151 PolarHBondContact O-N 3.43Å
148	L	76	Confident	76.1	Confident	64 Å²	64	82.1 Å²	82.1	34%	0.335	42%	0.424	S	S	.	.	H	α-helix	trans	-66.2	-33.8	179.4	-175.4	48.8	0	0	0	112.7	H115 D144 N145 E151 L152	H115-L148 VanDerWaalsContact NE2-CD2 3.3Å; H115-L148 WeakPolarHBondContact NE2-CD2 3.43Å; D144-L148 WeakPolarHBondContact O-CB 3.33Å; D144-L148 PolarHBondContact O-N 2.8Å; N145-L148 PolarHBondContact O-N 2.97Å; L148-E151 PolarHBondContact O-N 3.35Å; L148-L152 HydrophobicContact CD1-CD1 4.38Å; L148-L152 HydrophobicContact CD1-CG 4.32Å; L148-L152 HydrophobicContact CG-CD1 4.34Å; L148-L152 VanDerWaalsContact O-CG 3.3Å; L148-L152 WeakPolarHBondContact O-CG 3.43Å; L148-L152 PolarHBondContact O-N 2.84Å
149	S	72.1	Confident	76.7	Confident	34 Å²	34	81.1 Å²	81.1	24%	0.238	42%	0.416	C	S	.	.	H	α-helix	trans	-61.2	-47.1	170.4	-165.6	0	0	0	0	111.6	N145 L146 L147 E151 L152 D153	N145-S149 PolarHBondContact O-N 3.43Å; L146-S149 PolarHBondContact O-N 3.45Å; L147-S149 VanDerWaalsContact C-N 3.34Å; L147-S149 PolarHBondContact O-N 3.38Å; S149-E151 VanDerWaalsContact C-N 3.34Å; S149-E151 PolarHBondContact O-N 2.99Å; S149-L152 PolarHBondContact O-N 3.18Å; S149-D153 PolarHBondContact O-N 2.94Å
150	A	79.9	Confident	76.9	Confident	62 Å²	62	79.5 Å²	79.5	51%	0.512	41%	0.413	S	S	.	.	H	α-helix	trans	-64.5	-36.1	178.6	0	0	0	0	0	112.6	L146 L147 G154	L146-A150 PolarHBondContact O-N 2.96Å; L146-A150 VanDerWaalsContact O-N 3.16Å; L147-A150 PolarHBondContact O-N 3.49Å; A150-G154 PolarHBondContact O-N 3.32Å
151	E	79.7	Confident	77.2	Confident	96 Å²	96	79.6 Å²	79.6	45%	0.449	42%	0.415	S	S	.	.	H	α-helix	trans	-63.9	-40.5	171.8	-78.4	-163.7	-164.6	0	0	113.1	L147 L148 S149 G154 K155	L147-E151 PolarHBondContact O-N 3.43Å; L148-E151 PolarHBondContact O-N 3.35Å; S149-E151 VanDerWaalsContact C-N 3.34Å; S149-E151 PolarHBondContact O-N 2.99Å; E151-G154 PolarHBondContact O-N 2.93Å; E151-K155 WeakPolarHBondContact O-CB 3.32Å; E151-K155 WeakPolarHBondContact O-CD 3.49Å; E151-K155 VanDerWaalsContact O-CG 3.26Å; E151-K155 WeakPolarHBondContact O-CG 3.48Å; E151-K155 PolarHBondContact O-N 3.37Å; E151-K155 IonicContact OE2-NZ 3.56Å; E151-K155 PolarHBondContact OE2-NZ 2.98Å
152	L	74.5	Confident	77.5	Confident	22 Å²	22	78.8 Å²	78.8	12%	0.115	41%	0.409	C	S	.	.	H	α-helix	trans	-69.9	-40.4	179.3	-72.3	168.4	0	0	0	111.5	L112 H115 L148 S149 K155 L156	L112-L152 HydrophobicContact CD1-CB 3.64Å; L112-L152 HydrophobicContact CD1-CD1 3.89Å; L112-L152 HydrophobicContact CD1-CG 4.42Å; H115-L152 HydrophobicContact CB-CD1 4.46Å; L148-L152 HydrophobicContact CD1-CD1 4.38Å; L148-L152 HydrophobicContact CD1-CG 4.32Å; L148-L152 HydrophobicContact CG-CD1 4.34Å; L148-L152 VanDerWaalsContact O-CG 3.3Å; L148-L152 WeakPolarHBondContact O-CG 3.43Å; L148-L152 PolarHBondContact O-N 2.84Å; S149-L152 PolarHBondContact O-N 3.18Å; L152-K155 PolarHBondContact O-N 2.85Å; L152-L156 WeakPolarHBondContact O-CB 3.3Å; L152-L156 WeakPolarHBondContact O-CG 3.39Å; L152-L156 PolarHBondContact O-N 3.14Å
153	D	76.9	Confident	77.8	Confident	83 Å²	83	72 Å²	72	44%	0.444	38%	0.384	S	S	.	.	H	α-helix	trans	-62.4	-41.2	172.2	-73.5	-34.2	0	0	0	111.7	S149 L156 S157	S149-D153 PolarHBondContact O-N 2.94Å; D153-L156 PolarHBondContact O-N 3.07Å; D153-S157 PolarHBondContact O-N 2.75Å
154	G	82	Confident	77.9	Confident	41 Å²	41	70.7 Å²	70.7	42%	0.423	38%	0.384	S	S	.	.	H	α-helix	trans	-61.9	-42.8	173.6	0	0	0	0	0	113.1	A150 E151 S157 K158	A150-G154 PolarHBondContact O-N 3.32Å; E151-G154 PolarHBondContact O-N 2.93Å; G154-S157 PolarHBondContact O-N 2.96Å; G154-K158 PolarHBondContact O-N 3.05Å; G154-K158 VanDerWaalsContact O-N 3.12Å
155	K	79.9	Confident	78.2	Confident	100 Å²	100	70.9 Å²	70.9	44%	0.435	39%	0.388	S	S	.	.	H	α-helix	trans	-63.3	-42.3	174.4	-73.2	161.2	-170.3	155.2	0	111.4	E151 L152 K159	E151-K155 WeakPolarHBondContact O-CB 3.32Å; E151-K155 WeakPolarHBondContact O-CD 3.49Å; E151-K155 VanDerWaalsContact O-CG 3.26Å; E151-K155 WeakPolarHBondContact O-CG 3.48Å; E151-K155 PolarHBondContact O-N 3.37Å; E151-K155 IonicContact OE2-NZ 3.56Å; E151-K155 PolarHBondContact OE2-NZ 2.98Å; L152-K155 PolarHBondContact O-N 2.85Å; K155-K159 WeakPolarHBondContact O-CG 3.5Å; K155-K159 PolarHBondContact O-N 3.42Å
156	L	74.9	Confident	78.3	Confident	29 Å²	29	69.9 Å²	69.9	15%	0.152	39%	0.385	C	S	.	.	H	α-helix	trans	-63.5	-43.3	175.5	-82	167.2	0	0	0	112.4	K105 Q109 L112 L152 D153 K159 N160	K105-L156 HydrophobicContact CG-CD2 4.4Å; Q109-L156 HydrophobicContact CB-CD2 4.35Å; L112-L156 HydrophobicContact CD2-CD1 3.92Å; L152-L156 WeakPolarHBondContact O-CB 3.3Å; L152-L156 WeakPolarHBondContact O-CG 3.39Å; L152-L156 PolarHBondContact O-N 3.14Å; D153-L156 PolarHBondContact O-N 3.07Å; L156-K159 PolarHBondContact O-N 2.96Å; L156-N160 WeakPolarHBondContact O-CB 3.31Å; L156-N160 PolarHBondContact O-N 3.16Å
157	S	80.8	Confident	78.4	Confident	68 Å²	68	66.2 Å²	66.2	48%	0.476	37%	0.371	S	S	.	.	H	α-helix	trans	-60	-49	177.2	-166.9	0	0	0	0	111.4	D153 G154 K159 N160 E161	D153-S157 PolarHBondContact O-N 2.75Å; G154-S157 PolarHBondContact O-N 2.96Å; S157-K159 PolarHBondContact O-N 3.35Å; S157-N160 WeakPolarHBondContact O-CB 3.44Å; S157-N160 PolarHBondContact O-N 3.34Å; S157-E161 PolarHBondContact O-N 3.06Å; S157-E161 VanDerWaalsContact O-N 3.11Å
158	K	81.4	Confident	78.6	Confident	131 Å²	131	65.8 Å²	65.8	57%	0.57	37%	0.37	S	S	*	.	H	α-helix	trans	-60.2	-43.3	177.6	-174.9	178.3	176.8	-177.6	0	112.3	G154 N160 E161 E162	G154-K158 PolarHBondContact O-N 3.05Å; G154-K158 VanDerWaalsContact O-N 3.12Å; K158-N160 PolarHBondContact O-N 3.08Å; K158-E161 PolarHBondContact O-N 2.93Å; K158-E162 VanDerWaalsContact CE-OE1 3.3Å; K158-E162 WeakPolarHBondContact CE-OE1 3.38Å; K158-E162 WeakPolarHBondContact O-CG 3.3Å; K158-E162 PolarHBondContact O-N 2.64Å; K158-E162 VanDerWaalsContact O-N 3.08Å
159	K	76.8	Confident	78.8	Confident	46 Å²	46	70.2 Å²	70.2	20%	0.2	38%	0.382	C	S	.	.	H	α-helix	trans	-64.8	-28.3	175.8	-73.7	-74.2	158.5	-166	0	112.8	E104 K155 L156 S157 E162 L163	E104-K159 HydrophobicContact CB-CD 4.33Å; E104-K159 VanDerWaalsContact OE2-CE 3.31Å; E104-K159 WeakPolarHBondContact OE2-CE 3.39Å; E104-K159 IonicContact OE2-NZ 3.18Å; E104-K159 PolarHBondContact OE2-NZ 3.39Å; K155-K159 WeakPolarHBondContact O-CG 3.5Å; K155-K159 PolarHBondContact O-N 3.42Å; L156-K159 PolarHBondContact O-N 2.96Å; S157-K159 PolarHBondContact O-N 3.35Å; K159-E162 WeakPolarHBondContact CD-OE2 3.24Å; K159-E162 VanDerWaalsContact CE-OE2 3.3Å; K159-E162 WeakPolarHBondContact CE-OE2 3.39Å; K159-E162 IonicContact NZ-OE2 2.67Å; K159-E162 PolarHBondContact NZ-OE2 2.99Å; K159-L163 WeakPolarHBondContact O-CB 3.26Å; K159-L163 PolarHBondContact O-N 2.77Å; K159-L163 VanDerWaalsContact O-N 3.11Å
160	N	77.8	Confident	79	Confident	70 Å²	70	69.9 Å²	69.9	37%	0.374	38%	0.377	S	S	.	.	H	α-helix	trans	-72.9	-36.1	175.7	-148.5	49.6	0	0	0	112.1	K105 L156 S157 K158 L163 C164	K105-N160 PolarHBondContact NZ-OD1 2.88Å; L156-N160 WeakPolarHBondContact O-CB 3.31Å; L156-N160 PolarHBondContact O-N 3.16Å; S157-N160 WeakPolarHBondContact O-CB 3.44Å; S157-N160 PolarHBondContact O-N 3.34Å; K158-N160 PolarHBondContact O-N 3.08Å; N160-L163 PolarHBondContact O-N 2.88Å; N160-C164 PolarHBondContact O-N 3.02Å; N160-C164 PolarHBondContact O-SG 3.19Å; N160-C164 VanDerWaalsContact O-SG 3.41Å
161	E	83.1	Confident	79.1	Confident	129 Å²	129	71.7 Å²	71.7	60%	0.603	38%	0.375	S	S	*	.	H	α-helix	trans	-65.6	-46.7	171.9	-68.8	173.6	-176.6	0	0	111.9	S157 K158 L163 C164 V165	S157-E161 PolarHBondContact O-N 3.06Å; S157-E161 VanDerWaalsContact O-N 3.11Å; K158-E161 PolarHBondContact O-N 2.93Å; E161-L163 VanDerWaalsContact C-N 3.25Å; E161-L163 PolarHBondContact O-N 2.98Å; E161-C164 PolarHBondContact O-N 3.36Å; E161-V165 PolarHBondContact O-N 3.06Å
162	E	78.7	Confident	79.2	Confident	74 Å²	74	70.8 Å²	70.8	35%	0.346	38%	0.376	S	S	.	.	H	α-helix	trans	-56	-40.9	175.1	-71.1	172.2	-165.6	0	0	111.4	K158 K159 V165 A166	K158-E162 VanDerWaalsContact CE-OE1 3.3Å; K158-E162 WeakPolarHBondContact CE-OE1 3.38Å; K158-E162 WeakPolarHBondContact O-CG 3.3Å; K158-E162 PolarHBondContact O-N 2.64Å; K158-E162 VanDerWaalsContact O-N 3.08Å; K159-E162 WeakPolarHBondContact CD-OE2 3.24Å; K159-E162 VanDerWaalsContact CE-OE2 3.3Å; K159-E162 WeakPolarHBondContact CE-OE2 3.39Å; K159-E162 IonicContact NZ-OE2 2.67Å; K159-E162 PolarHBondContact NZ-OE2 2.99Å; E162-V165 PolarHBondContact O-N 3.47Å; E162-A166 PolarHBondContact O-N 3.38Å
163	L	77.8	Confident	79.2	Confident	22 Å²	22	70.1 Å²	70.1	12%	0.115	37%	0.374	C	S	.	.	H	α-helix	trans	-67	-42.6	176.9	-165.6	157.2	0	0	0	112.4	L102 K105 K159 N160 E161 V165 A166 A167	L102-L163 HydrophobicContact CD2-CD1 3.69Å; L102-L163 HydrophobicContact CG-CD1 3.99Å; K105-L163 HydrophobicContact CD-CD1 3.99Å; K159-L163 WeakPolarHBondContact O-CB 3.26Å; K159-L163 PolarHBondContact O-N 2.77Å; K159-L163 VanDerWaalsContact O-N 3.11Å; N160-L163 PolarHBondContact O-N 2.88Å; E161-L163 VanDerWaalsContact C-N 3.25Å; E161-L163 PolarHBondContact O-N 2.98Å; L163-V165 VanDerWaalsContact C-N 3.33Å; L163-V165 PolarHBondContact O-N 3.28Å; L163-A166 PolarHBondContact O-N 2.99Å; L163-A167 WeakPolarHBondContact O-CB 3.39Å; L163-A167 PolarHBondContact O-N 2.69Å
164	C	80.4	Confident	79.2	Confident	68 Å²	68	70.1 Å²	70.1	46%	0.459	37%	0.371	S	S	.	.	H	α-helix	trans	-60.8	-40.6	174.5	-75.2	0	0	0	0	112.3	N160 E161 A167 N168	N160-C164 PolarHBondContact O-N 3.02Å; N160-C164 PolarHBondContact O-SG 3.19Å; N160-C164 VanDerWaalsContact O-SG 3.41Å; E161-C164 PolarHBondContact O-N 3.36Å; C164-A167 PolarHBondContact O-N 2.62Å; C164-N168 PolarHBondContact O-N 3.22Å; C164-N168 VanDerWaalsContact O-N 3.09Å; C164-N168 PolarHBondContact O-ND2 2.71Å
165	V	81.9	Confident	79.3	Confident	86 Å²	86	73.8 Å²	73.8	52%	0.521	38%	0.376	S	S	.	.	H	α-helix	trans	-65.7	-41.8	175.5	175.4	0	0	0	0	111	E161 E162 L163 R169	E161-V165 PolarHBondContact O-N 3.06Å; E162-V165 PolarHBondContact O-N 3.47Å; L163-V165 VanDerWaalsContact C-N 3.33Å; L163-V165 PolarHBondContact O-N 3.28Å; V165-R169 VanDerWaalsContact O-CG 3.32Å; V165-R169 WeakPolarHBondContact O-CG 3.49Å; V165-R169 PolarHBondContact O-N 3.46Å
166	A	74.2	Confident	79.2	Confident	18 Å²	18	72.9 Å²	72.9	15%	0.149	37%	0.373	C	S	.	.	H	α-helix	trans	-62.8	-43	175.6	0	0	0	0	0	112.4	H98 E162 L163 R169 L170	H98-A166 HydrophobicContact CB-CB 4.48Å; E162-A166 PolarHBondContact O-N 3.38Å; L163-A166 PolarHBondContact O-N 2.99Å; A166-R169 PolarHBondContact O-N 3.21Å; A166-L170 PolarHBondContact O-N 2.91Å
167	A	78.1	Confident	79.2	Confident	35 Å²	35	74.9 Å²	74.9	29%	0.289	38%	0.379	S	S	.	.	H	α-helix	trans	-63.1	-43.6	178.6	0	0	0	0	0	112.6	L163 C164 R169 L170 E171	L163-A167 WeakPolarHBondContact O-CB 3.39Å; L163-A167 PolarHBondContact O-N 2.69Å; C164-A167 PolarHBondContact O-N 2.62Å; A167-R169 VanDerWaalsContact C-N 3.34Å; A167-R169 PolarHBondContact O-N 3.15Å; A167-L170 WeakPolarHBondContact O-CB 3.5Å; A167-L170 PolarHBondContact O-N 3.45Å; A167-E171 PolarHBondContact O-N 3Å
168	N	84	Confident	79.2	Confident	104 Å²	104	74.3 Å²	74.3	56%	0.556	38%	0.378	S	S	*	.	H	α-helix	trans	-62.8	-40	176.2	-72.3	-19.1	0	0	0	112.1	C164 L170 E171 T172	C164-N168 PolarHBondContact O-N 3.22Å; C164-N168 VanDerWaalsContact O-N 3.09Å; C164-N168 PolarHBondContact O-ND2 2.71Å; N168-L170 VanDerWaalsContact C-N 3.33Å; N168-E171 PolarHBondContact O-N 3.38Å; N168-T172 PolarHBondContact O-N 3Å; N168-T172 VanDerWaalsContact O-N 3.09Å; N168-T172 PolarHBondContact O-OG1 3.44Å
169	R	79.9	Confident	79.2	Confident	156 Å²	156	73 Å²	73	59%	0.589	38%	0.377	S	S	*	.	H	α-helix	trans	-66.7	-34.8	176.6	-68	175	87.2	174.4	6.3	112.1	L94 V165 A166 A167 T172 A173	L94-R169 HydrophobicContact CD2-CB 4.09Å; V165-R169 VanDerWaalsContact O-CG 3.32Å; V165-R169 WeakPolarHBondContact O-CG 3.49Å; V165-R169 PolarHBondContact O-N 3.46Å; A166-R169 PolarHBondContact O-N 3.21Å; A167-R169 VanDerWaalsContact C-N 3.34Å; A167-R169 PolarHBondContact O-N 3.15Å; R169-T172 WeakPolarHBondContact CA-OG1 3.48Å; R169-T172 PolarHBondContact O-OG1 2.89Å; R169-A173 WeakPolarHBondContact O-CB 3.33Å; R169-A173 PolarHBondContact O-N 3.42Å; R169-A173 VanDerWaalsContact O-N 3.1Å
170	L	76.3	Confident	79	Confident	28 Å²	28	73.1 Å²	73.1	15%	0.147	38%	0.378	C	S	.	.	H	α-helix	trans	-63.3	-47.7	172.4	-170.2	78.7	0	0	0	111.2	L91 L94 R95 A166 A167 N168 T172 A173 E174	L91-L170 HydrophobicContact CD2-CD1 4.09Å; L94-L170 HydrophobicContact CB-CD1 4.26Å; R95-L170 HydrophobicContact CG-CD1 3.53Å; A166-L170 PolarHBondContact O-N 2.91Å; A167-L170 WeakPolarHBondContact O-CB 3.5Å; A167-L170 PolarHBondContact O-N 3.45Å; N168-L170 VanDerWaalsContact C-N 3.33Å; L170-T172 VanDerWaalsContact C-N 3.34Å; L170-T172 PolarHBondContact O-N 3.15Å; L170-A173 PolarHBondContact O-N 2.9Å; L170-E174 WeakPolarHBondContact O-CG 3.37Å; L170-E174 PolarHBondContact O-N 3.33Å
171	E	82.4	Confident	78.8	Confident	99 Å²	99	72.5 Å²	72.5	46%	0.463	37%	0.374	S	S	.	.	H	α-helix	trans	-62.4	-39.1	179.8	-163.8	-166.2	147.9	0	0	112.1	A167 N168 E174 K175	A167-E171 PolarHBondContact O-N 3Å; N168-E171 PolarHBondContact O-N 3.38Å; E171-E174 PolarHBondContact O-N 2.79Å; E171-K175 WeakPolarHBondContact O-CG 3.2Å; E171-K175 PolarHBondContact O-N 3.19Å; E171-K175 VanDerWaalsContact O-N 3.15Å; E171-K175 WeakPolarHBondContact OE1-CE 3.47Å; E171-K175 IonicContact OE1-NZ 2.88Å; E171-K175 PolarHBondContact OE1-NZ 2.85Å
172	T	81.9	Confident	78.6	Confident	77 Å²	77	69.1 Å²	69.1	47%	0.472	36%	0.364	S	S	.	.	H	α-helix	trans	-65	-43.1	174.5	48.5	0	0	0	0	112.1	N168 R169 L170 E174 K175 E176	N168-T172 PolarHBondContact O-N 3Å; N168-T172 VanDerWaalsContact O-N 3.09Å; N168-T172 PolarHBondContact O-OG1 3.44Å; R169-T172 WeakPolarHBondContact CA-OG1 3.48Å; R169-T172 PolarHBondContact O-OG1 2.89Å; L170-T172 VanDerWaalsContact C-N 3.34Å; L170-T172 PolarHBondContact O-N 3.15Å; T172-E174 VanDerWaalsContact C-N 3.35Å; T172-E174 PolarHBondContact O-N 2.99Å; T172-K175 PolarHBondContact O-N 3.41Å; T172-E176 PolarHBondContact O-N 3.37Å
173	A	74.2	Confident	78.6	Confident	9 Å²	9	69.7 Å²	69.7	7%	0.074	37%	0.367	C	S	.	.	H	α-helix	trans	-66.1	-35.9	177.9	0	0	0	0	0	112.3	L91 L94 R169 L170 K175 E176 R177	L91-A173 HydrophobicContact CD1-CB 3.99Å; L91-A173 HydrophobicContact CG-CB 4.04Å; L94-A173 HydrophobicContact CD1-CB 3.85Å; R169-A173 WeakPolarHBondContact O-CB 3.33Å; R169-A173 PolarHBondContact O-N 3.42Å; R169-A173 VanDerWaalsContact O-N 3.1Å; L170-A173 PolarHBondContact O-N 2.9Å; A173-K175 VanDerWaalsContact C-N 3.34Å; A173-E176 PolarHBondContact O-N 2.93Å; A173-R177 VanDerWaalsContact O-CB 3.32Å; A173-R177 WeakPolarHBondContact O-CB 3.43Å; A173-R177 PolarHBondContact O-N 3.41Å
174	E	77.3	Confident	78.3	Confident	83 Å²	83	70 Å²	70	39%	0.388	37%	0.37	S	S	.	.	H	α-helix	trans	-67.9	-31.7	175.6	-73.9	-173.1	164.7	0	0	112.7	L91 R95 L170 E171 T172 A178	L91-E174 HydrophobicContact CD1-CG 3.82Å; L91-E174 HydrophobicContact CD2-CG 4.14Å; L91-E174 HydrophobicContact CG-CG 4.39Å; R95-E174 IonicContact CZ-OE1 2.85Å; R95-E174 IonicContact NE-OE1 2.66Å; R95-E174 IonicContact NH2-OE1 3.11Å; R95-E174 PolarHBondContact NH2-OE1 3.22Å; L170-E174 WeakPolarHBondContact O-CG 3.37Å; L170-E174 PolarHBondContact O-N 3.33Å; E171-E174 PolarHBondContact O-N 2.79Å; T172-E174 VanDerWaalsContact C-N 3.35Å; T172-E174 PolarHBondContact O-N 2.99Å; E174-A178 PolarHBondContact O-N 3.24Å; E174-A178 VanDerWaalsContact O-N 3.12Å
175	K	84.5	Confident	78	Confident	118 Å²	118	70.7 Å²	70.7	51%	0.513	37%	0.369	S	S	.	.	H	α-helix	trans	-70.6	-45.7	171.3	-71.7	171.2	-173	166.5	0	112.5	E171 T172 A173 R177 A178 N179	E171-K175 WeakPolarHBondContact O-CG 3.2Å; E171-K175 PolarHBondContact O-N 3.19Å; E171-K175 VanDerWaalsContact O-N 3.15Å; E171-K175 WeakPolarHBondContact OE1-CE 3.47Å; E171-K175 IonicContact OE1-NZ 2.88Å; E171-K175 PolarHBondContact OE1-NZ 2.85Å; T172-K175 PolarHBondContact O-N 3.41Å; A173-K175 VanDerWaalsContact C-N 3.34Å; K175-R177 VanDerWaalsContact C-N 3.3Å; K175-R177 PolarHBondContact O-N 3.03Å; K175-A178 WeakPolarHBondContact O-CB 3.4Å; K175-A178 PolarHBondContact O-N 3.36Å; K175-A178 VanDerWaalsContact O-N 3.13Å; K175-N179 PolarHBondContact O-N 3.16Å; K175-N179 VanDerWaalsContact O-N 3.15Å
176	E	77.5	Confident	77.9	Confident	80 Å²	80	72.4 Å²	72.4	37%	0.374	37%	0.371	S	S	.	.	H	α-helix	trans	-57	-45.8	174.4	-73.1	177.6	-167.4	0	0	111.3	K87 T172 A173 A178 N179 F180	K87-E176 WeakPolarHBondContact CE-OE2 3.3Å; K87-E176 IonicContact NZ-OE2 2.61Å; K87-E176 PolarHBondContact NZ-OE2 2.81Å; T172-E176 PolarHBondContact O-N 3.37Å; A173-E176 PolarHBondContact O-N 2.93Å; E176-A178 VanDerWaalsContact C-N 3.3Å; E176-A178 PolarHBondContact O-N 2.63Å; E176-N179 WeakPolarHBondContact O-CB 3.36Å; E176-N179 PolarHBondContact O-N 3.47Å; E176-N179 VanDerWaalsContact O-N 3.14Å; E176-F180 VanDerWaalsContact O-CD2 3.24Å; E176-F180 WeakPolarHBondContact O-CD2 3.44Å; E176-F180 PolarHBondContact O-N 2.96Å; E176-F180 VanDerWaalsContact O-N 3.07Å
177	R	75.4	Confident	77.8	Confident	72 Å²	72	73 Å²	73	27%	0.272	37%	0.373	S	S	.	.	H	α-helix	trans	-60.4	-36.6	176.1	-177.7	178.3	179.9	-70	-13.7	113.1	D88 L91 A173 K175 N179 I181	D88-R177 VanDerWaalsContact OD1-CD 3.32Å; D88-R177 WeakPolarHBondContact OD1-CD 3.29Å; D88-R177 IonicContact OD1-CZ 3.16Å; D88-R177 IonicContact OD1-NE 3.18Å; D88-R177 PolarHBondContact OD1-NE 3.31Å; D88-R177 IonicContact OD1-NH2 2.84Å; D88-R177 IonicContact OD2-NH2 2.73Å; L91-R177 HydrophobicContact CD1-CB 4.12Å; A173-R177 VanDerWaalsContact O-CB 3.32Å; A173-R177 WeakPolarHBondContact O-CB 3.43Å; A173-R177 PolarHBondContact O-N 3.41Å; K175-R177 VanDerWaalsContact C-N 3.3Å; K175-R177 PolarHBondContact O-N 3.03Å; R177-N179 VanDerWaalsContact C-N 3.35Å; R177-I181 HydrophobicContact CG-CD1 4.1Å; R177-I181 WeakPolarHBondContact O-CD1 3.4Å; R177-I181 VanDerWaalsContact O-CG1 3.27Å; R177-I181 WeakPolarHBondContact O-CG1 3.27Å; R177-I181 PolarHBondContact O-N 3.43Å; R177-I181 VanDerWaalsContact O-N 3.12Å
178	A	79.9	Confident	77.6	Confident	56 Å²	56	77.4 Å²	77.4	46%	0.463	39%	0.386	S	S	.	.	H	α-helix	trans	-65.3	-38.6	175.6	0	0	0	0	0	112	E174 K175 E176 I181 S182	E174-A178 PolarHBondContact O-N 3.24Å; E174-A178 VanDerWaalsContact O-N 3.12Å; K175-A178 WeakPolarHBondContact O-CB 3.4Å; K175-A178 PolarHBondContact O-N 3.36Å; K175-A178 VanDerWaalsContact O-N 3.13Å; E176-A178 VanDerWaalsContact C-N 3.3Å; E176-A178 PolarHBondContact O-N 2.63Å; A178-I181 PolarHBondContact O-N 3.44Å; A178-S182 PolarHBondContact O-N 2.84Å
179	N	81.6	Confident	77.3	Confident	104 Å²	104	76.1 Å²	76.1	56%	0.556	38%	0.379	S	S	*	.	H	α-helix	trans	-65.5	-49	176.4	-65.6	-8.1	0	0	0	111.6	K175 E176 R177 I181 S182 E183	K175-N179 PolarHBondContact O-N 3.16Å; K175-N179 VanDerWaalsContact O-N 3.15Å; E176-N179 WeakPolarHBondContact O-CB 3.36Å; E176-N179 PolarHBondContact O-N 3.47Å; E176-N179 VanDerWaalsContact O-N 3.14Å; R177-N179 VanDerWaalsContact C-N 3.35Å; N179-I181 PolarHBondContact O-N 3.29Å; N179-S182 WeakPolarHBondContact O-CA 3.27Å; N179-S182 VanDerWaalsContact O-CB 3.28Å; N179-S182 WeakPolarHBondContact O-CB 3.29Å; N179-S182 PolarHBondContact O-N 2.88Å; N179-E183 PolarHBondContact O-N 3.17Å; N179-E183 VanDerWaalsContact O-N 3.08Å
180	F	72.1	Confident	77.1	Confident	47 Å²	47	75.3 Å²	75.3	21%	0.206	38%	0.376	C	S	.	.	H	α-helix	trans	-58.2	-35.8	175.9	-75.8	-64.4	0	0	0	112.6	L80 L84 K87 E176 S182 E183 V184	L80-F180 HydrophobicContact CD2-CD1 4.49Å; L84-F180 HydrophobicContact CD1-CB 4.01Å; K87-F180 HydrophobicContact CD-CE2 4.23Å; K87-F180 HydrophobicContact CG-CD2 4.14Å; K87-F180 HydrophobicContact CG-CE2 3.78Å; E176-F180 VanDerWaalsContact O-CD2 3.24Å; E176-F180 WeakPolarHBondContact O-CD2 3.44Å; E176-F180 PolarHBondContact O-N 2.96Å; E176-F180 VanDerWaalsContact O-N 3.07Å; F180-S182 VanDerWaalsContact C-N 3.31Å; F180-S182 PolarHBondContact O-N 2.97Å; F180-E183 PolarHBondContact O-N 3.46Å; F180-V184 WeakPolarHBondContact O-CB 3.49Å; F180-V184 VanDerWaalsContact O-CG2 3.28Å; F180-V184 WeakPolarHBondContact O-CG2 3.43Å; F180-V184 PolarHBondContact O-N 3.49Å
181	I	73.4	Confident	76.6	Confident	57 Å²	57	75.7 Å²	75.7	29%	0.292	38%	0.381	S	S	.	.	H	α-helix	trans	-65.8	-32.5	173.8	-71.6	167.7	0	0	0	111.7	L84 R177 A178 N179 N185	L84-I181 HydrophobicContact CD1-CG1 4.39Å; R177-I181 HydrophobicContact CG-CD1 4.1Å; R177-I181 WeakPolarHBondContact O-CD1 3.4Å; R177-I181 VanDerWaalsContact O-CG1 3.27Å; R177-I181 WeakPolarHBondContact O-CG1 3.27Å; R177-I181 PolarHBondContact O-N 3.43Å; R177-I181 VanDerWaalsContact O-N 3.12Å; A178-I181 PolarHBondContact O-N 3.44Å; N179-I181 PolarHBondContact O-N 3.29Å; I181-N185 PolarHBondContact O-N 3.45Å; I181-N185 VanDerWaalsContact O-N 3.16Å; I181-N185 PolarHBondContact O-ND2 2.85Å
182	S	79.4	Confident	76.2	Confident	58 Å²	58	77.1 Å²	77.1	41%	0.406	38%	0.382	S	S	.	.	H	α-helix	trans	-66.4	-50	173.3	-158.1	0	0	0	0	111.1	A178 N179 F180 V184 N185 E186	A178-S182 PolarHBondContact O-N 2.84Å; N179-S182 WeakPolarHBondContact O-CA 3.27Å; N179-S182 VanDerWaalsContact O-CB 3.28Å; N179-S182 WeakPolarHBondContact O-CB 3.29Å; N179-S182 PolarHBondContact O-N 2.88Å; F180-S182 VanDerWaalsContact C-N 3.31Å; F180-S182 PolarHBondContact O-N 2.97Å; S182-V184 VanDerWaalsContact C-N 3.33Å; S182-V184 PolarHBondContact O-N 2.85Å; S182-N185 WeakPolarHBondContact O-CA 3.41Å; S182-N185 WeakPolarHBondContact O-CB 3.34Å; S182-N185 PolarHBondContact O-N 2.73Å; S182-E186 PolarHBondContact O-N 3.07Å; S182-E186 PolarHBondContact OG-OE1 3.49Å
183	E	78.4	Confident	75.9	Confident	87 Å²	87	77.9 Å²	77.9	41%	0.407	38%	0.38	S	S	.	.	H	α-helix	trans	-59.9	-40.1	179.4	-66.4	172.1	-168.7	0	0	112.4	L80 N179 F180 N185 E186 T187	L80-E183 HydrophobicContact CD2-CB 4.33Å; L80-E183 WeakPolarHBondContact CD2-OE2 3.32Å; N179-E183 PolarHBondContact O-N 3.17Å; N179-E183 VanDerWaalsContact O-N 3.08Å; F180-E183 PolarHBondContact O-N 3.46Å; E183-N185 VanDerWaalsContact C-N 3.33Å; E183-N185 PolarHBondContact O-N 3.3Å; E183-E186 PolarHBondContact O-N 3.23Å; E183-T187 PolarHBondContact O-N 3.27Å; E183-T187 PolarHBondContact O-OG1 2.98Å
184	V	71.5	Confident	75.8	Confident	28 Å²	28	78.6 Å²	78.6	17%	0.17	38%	0.382	C	S	.	.	H	α-helix	trans	-66.1	-33	173.9	170.2	0	0	0	0	112	L80 F180 S182 T187 K188	L80-V184 HydrophobicContact CB-CG2 4.29Å; F180-V184 WeakPolarHBondContact O-CB 3.49Å; F180-V184 VanDerWaalsContact O-CG2 3.28Å; F180-V184 WeakPolarHBondContact O-CG2 3.43Å; F180-V184 PolarHBondContact O-N 3.49Å; S182-V184 VanDerWaalsContact C-N 3.33Å; S182-V184 PolarHBondContact O-N 2.85Å; V184-T187 WeakPolarHBondContact CA-OG1 3.46Å; V184-T187 PolarHBondContact O-OG1 3.17Å; V184-T187 VanDerWaalsContact O-OG1 3.12Å; V184-K188 WeakPolarHBondContact O-CB 3.47Å; V184-K188 PolarHBondContact O-N 2.71Å; V184-K188 VanDerWaalsContact O-N 3.07Å
185	N	75.1	Confident	75.4	Confident	82 Å²	82	78.3 Å²	78.3	44%	0.439	38%	0.381	S	S	.	.	H	α-helix	trans	-74.9	-36.7	175	-78.1	-55.7	0	0	0	112.4	I181 S182 E183 K188 N189	I181-N185 PolarHBondContact O-N 3.45Å; I181-N185 VanDerWaalsContact O-N 3.16Å; I181-N185 PolarHBondContact O-ND2 2.85Å; S182-N185 WeakPolarHBondContact O-CA 3.41Å; S182-N185 WeakPolarHBondContact O-CB 3.34Å; S182-N185 PolarHBondContact O-N 2.73Å; E183-N185 VanDerWaalsContact C-N 3.33Å; E183-N185 PolarHBondContact O-N 3.3Å; N185-K188 PolarHBondContact O-N 3.31Å; N185-N189 VanDerWaalsContact O-CG 3.25Å; N185-N189 PolarHBondContact O-N 3.23Å; N185-N189 PolarHBondContact O-ND2 3.44Å
186	E	78.6	Confident	75	Confident	122 Å²	122	78.5 Å²	78.5	57%	0.57	38%	0.384	S	S	*	.	H	α-helix	trans	-65.4	-48.3	175.5	-73.9	171.5	-151.8	0	0	111.5	S182 E183 K188 N189 R190	S182-E186 PolarHBondContact O-N 3.07Å; S182-E186 PolarHBondContact OG-OE1 3.49Å; E183-E186 PolarHBondContact O-N 3.23Å; E186-K188 VanDerWaalsContact C-N 3.32Å; E186-K188 PolarHBondContact O-N 2.89Å; E186-N189 WeakPolarHBondContact O-CB 3.5Å; E186-N189 PolarHBondContact O-N 3.5Å; E186-N189 VanDerWaalsContact O-N 3.09Å; E186-R190 PolarHBondContact O-N 2.91Å
187	T	71.5	Confident	75	Confident	31 Å²	31	80.2 Å²	80.2	19%	0.19	39%	0.392	C	S	.	.	H	α-helix	trans	-60.6	-39.1	173.3	47.4	0	0	0	0	112.1	L80 E183 V184 N189 R190 C191	L80-T187 HydrophobicContact CD1-CG2 3.74Å; E183-T187 PolarHBondContact O-N 3.27Å; E183-T187 PolarHBondContact O-OG1 2.98Å; V184-T187 WeakPolarHBondContact CA-OG1 3.46Å; V184-T187 PolarHBondContact O-OG1 3.17Å; V184-T187 VanDerWaalsContact O-OG1 3.12Å; T187-N189 VanDerWaalsContact C-N 3.33Å; T187-N189 PolarHBondContact O-N 2.85Å; T187-R190 WeakPolarHBondContact O-CB 3.37Å; T187-R190 PolarHBondContact O-N 3.17Å; T187-R190 VanDerWaalsContact O-N 3.13Å; T187-C191 PolarHBondContact O-N 2.95Å; T187-C191 PolarHBondContact O-SG 3.25Å; T187-C191 VanDerWaalsContact O-SG 3.36Å
188	K	73.9	Confident	74.6	Confident	128 Å²	128	78.1 Å²	78.1	56%	0.557	39%	0.386	S	S	*	.	H	α-helix	trans	-67.1	-26.1	173.4	-175.1	173.1	-176.2	173.8	0	114.5	V184 N185 E186 R192	V184-K188 WeakPolarHBondContact O-CB 3.47Å; V184-K188 PolarHBondContact O-N 2.71Å; V184-K188 VanDerWaalsContact O-N 3.07Å; N185-K188 PolarHBondContact O-N 3.31Å; E186-K188 VanDerWaalsContact C-N 3.32Å; E186-K188 PolarHBondContact O-N 2.89Å; K188-R192 PolarHBondContact O-NE 2.94Å
189	N	78.5	Confident	74.3	Confident	76 Å²	76	82 Å²	82	41%	0.406	39%	0.389	S	S	.	.	H	α-helix	trans	-71.2	-44.5	168.8	-68.2	-27	0	0	0	109.8	N185 E186 T187 C191 R192 E193	N185-N189 VanDerWaalsContact O-CG 3.25Å; N185-N189 PolarHBondContact O-N 3.23Å; N185-N189 PolarHBondContact O-ND2 3.44Å; E186-N189 WeakPolarHBondContact O-CB 3.5Å; E186-N189 PolarHBondContact O-N 3.5Å; E186-N189 VanDerWaalsContact O-N 3.09Å; T187-N189 VanDerWaalsContact C-N 3.33Å; T187-N189 PolarHBondContact O-N 2.85Å; N189-C191 PolarHBondContact O-N 2.95Å; N189-R192 PolarHBondContact O-N 3.09Å; N189-R192 VanDerWaalsContact O-N 3.12Å; N189-R192 PolarHBondContact OD1-NH2 3.44Å; N189-E193 PolarHBondContact O-N 2.93Å
190	R	76	Confident	74.1	Confident	139 Å²	139	80.2 Å²	80.2	53%	0.525	38%	0.384	S	S	.	.	H	α-helix	trans	-60.6	-41	179.3	-160.2	67.8	176.5	157.2	-1.2	113.3	L73 E186 T187 R192 E193 L194	L73-R190 HydrophobicContact CD2-CB 4.09Å; L73-R190 HydrophobicContact CD2-CG 3.98Å; E186-R190 PolarHBondContact O-N 2.91Å; T187-R190 WeakPolarHBondContact O-CB 3.37Å; T187-R190 PolarHBondContact O-N 3.17Å; T187-R190 VanDerWaalsContact O-N 3.13Å; R190-R192 PolarHBondContact O-N 3.28Å; R190-E193 WeakPolarHBondContact CD-OE2 3.48Å; R190-E193 IonicContact CZ-OE2 2.76Å; R190-E193 IonicContact NH1-OE2 3.94Å; R190-E193 PolarHBondContact NH1-OE2 3.24Å; R190-E193 PolarHBondContact O-N 2.96Å; R190-L194 WeakPolarHBondContact O-CG 3.45Å; R190-L194 PolarHBondContact O-N 3.46Å; R190-L194 VanDerWaalsContact O-N 3.16Å
191	C	65	Low	74	Confident	37 Å²	37	80 Å²	80	25%	0.25	39%	0.389	C	S	.	.	H	α-helix	trans	-59.3	-44.3	173.3	-65.1	0	0	0	0	111.9	T187 N189 E193 L194 E195	T187-C191 PolarHBondContact O-N 2.95Å; T187-C191 PolarHBondContact O-SG 3.25Å; T187-C191 VanDerWaalsContact O-SG 3.36Å; N189-C191 PolarHBondContact O-N 2.95Å; C191-E193 PolarHBondContact O-N 3.18Å; C191-L194 PolarHBondContact O-N 3.03Å; C191-E195 WeakPolarHBondContact O-CG 3.24Å; C191-E195 PolarHBondContact O-N 3.41Å
192	R	74	Confident	73.9	Confident	128 Å²	128	83.5 Å²	83.5	48%	0.483	40%	0.401	S	S	.	.	H	α-helix	trans	-65.4	-37	178.2	-81.1	-178.4	-75.1	150.7	-7.1	113.3	K188 N189 R190 L194 E195 E196	K188-R192 PolarHBondContact O-NE 2.94Å; N189-R192 PolarHBondContact O-N 3.09Å; N189-R192 VanDerWaalsContact O-N 3.12Å; N189-R192 PolarHBondContact OD1-NH2 3.44Å; R190-R192 PolarHBondContact O-N 3.28Å; R192-L194 VanDerWaalsContact C-N 3.33Å; R192-E195 PolarHBondContact O-N 3.34Å; R192-E196 PolarHBondContact O-N 3.22Å
193	E	77.1	Confident	73.8	Confident	93 Å²	93	82.8 Å²	82.8	44%	0.435	40%	0.399	S	S	.	.	H	α-helix	trans	-60.1	-44.1	173.2	-69.8	172.9	177.4	0	0	111.4	N189 R190 C191 E196 Q197	N189-E193 PolarHBondContact O-N 2.93Å; R190-E193 WeakPolarHBondContact CD-OE2 3.48Å; R190-E193 IonicContact CZ-OE2 2.76Å; R190-E193 IonicContact NH1-OE2 3.94Å; R190-E193 PolarHBondContact NH1-OE2 3.24Å; R190-E193 PolarHBondContact O-N 2.96Å; C191-E193 PolarHBondContact O-N 3.18Å; E193-E196 PolarHBondContact O-N 2.95Å; E193-Q197 WeakPolarHBondContact O-CG 3.49Å; E193-Q197 PolarHBondContact O-N 3.46Å; E193-Q197 VanDerWaalsContact O-N 3.1Å
194	L	71.1	Confident	73.5	Confident	25 Å²	25	81.1 Å²	81.1	13%	0.131	39%	0.393	C	S	.	.	H	α-helix	trans	-70.3	-36.1	178.5	-66.7	167.9	0	0	0	112.5	F66 L73 R190 C191 R192 Q197 L198	F66-L194 HydrophobicContact CD2-CD2 4.49Å; F66-L194 HydrophobicContact CE2-CD2 3.84Å; L73-L194 HydrophobicContact CD1-CD1 3.62Å; L73-L194 HydrophobicContact CD2-CD1 4.12Å; L73-L194 HydrophobicContact CG-CD1 4.47Å; R190-L194 WeakPolarHBondContact O-CG 3.45Å; R190-L194 PolarHBondContact O-N 3.46Å; R190-L194 VanDerWaalsContact O-N 3.16Å; C191-L194 PolarHBondContact O-N 3.03Å; R192-L194 VanDerWaalsContact C-N 3.33Å; L194-Q197 PolarHBondContact O-N 3.48Å; L194-L198 VanDerWaalsContact O-CB 3.25Å; L194-L198 WeakPolarHBondContact O-CB 3.47Å; L194-L198 PolarHBondContact O-N 3.46Å
195	E	68.8	Low	73.5	Confident	76 Å²	76	82 Å²	82	36%	0.355	40%	0.397	S	S	.	.	H	α-helix	trans	-62	-41.7	171.7	-74.7	166.8	-141.8	0	0	112.3	C191 R192 L198 R199	C191-E195 WeakPolarHBondContact O-CG 3.24Å; C191-E195 PolarHBondContact O-N 3.41Å; R192-E195 PolarHBondContact O-N 3.34Å; E195-L198 PolarHBondContact O-N 3.06Å; E195-R199 WeakPolarHBondContact O-CG 3.29Å; E195-R199 PolarHBondContact O-N 3.22Å; E195-R199 IonicContact OE2-NH2 3.79Å; E195-R199 PolarHBondContact OE2-NH2 2.66Å
196	E	77	Confident	73.4	Confident	123 Å²	123	82.6 Å²	82.6	58%	0.575	40%	0.397	S	S	*	.	H	α-helix	trans	-65.6	-44.9	178.4	-153.3	74.2	-131.5	0	0	110.7	R192 E193 L198 R199 S200	R192-E196 PolarHBondContact O-N 3.22Å; E193-E196 PolarHBondContact O-N 2.95Å; E196-L198 VanDerWaalsContact C-N 3.34Å; E196-L198 PolarHBondContact O-N 3.16Å; E196-R199 PolarHBondContact O-N 2.91Å; E196-R199 IonicContact OE2-NH1 3.73Å; E196-S200 PolarHBondContact O-N 3.27Å
197	Q	75.8	Confident	73.3	Confident	115 Å²	115	83.7 Å²	83.7	54%	0.537	40%	0.396	S	S	.	.	H	α-helix	trans	-59.8	-43	173.4	-72.5	177.1	-4.5	0	0	111.8	E193 L194 R199 S200 S201	E193-Q197 WeakPolarHBondContact O-CG 3.49Å; E193-Q197 PolarHBondContact O-N 3.46Å; E193-Q197 VanDerWaalsContact O-N 3.1Å; L194-Q197 PolarHBondContact O-N 3.48Å; Q197-R199 PolarHBondContact O-N 2.91Å; Q197-S200 PolarHBondContact O-N 3.46Å; Q197-S201 PolarHBondContact O-N 2.71Å
198	L	68.5	Low	73.4	Confident	28 Å²	28	87.9 Å²	87.9	15%	0.147	41%	0.413	C	S	.	.	H	α-helix	trans	-65	-38.6	178.1	-177	55.2	0	0	0	112.6	L19 L23 F66 L194 E195 E196 K202	L19-L198 HydrophobicContact CD2-CD2 3.88Å; L23-L198 HydrophobicContact CD1-CD1 3.7Å; L23-L198 HydrophobicContact CD1-CD2 3.85Å; L23-L198 HydrophobicContact CD1-CG 4.31Å; L23-L198 HydrophobicContact CD2-CD1 4.25Å; F66-L198 HydrophobicContact CE1-CD1 3.98Å; F66-L198 HydrophobicContact CZ-CB 4.13Å; F66-L198 HydrophobicContact CZ-CD1 4.38Å; L194-L198 VanDerWaalsContact O-CB 3.25Å; L194-L198 WeakPolarHBondContact O-CB 3.47Å; L194-L198 PolarHBondContact O-N 3.46Å; E195-L198 PolarHBondContact O-N 3.06Å; E196-L198 VanDerWaalsContact C-N 3.34Å; E196-L198 PolarHBondContact O-N 3.16Å; L198-K202 VanDerWaalsContact O-CB 3.26Å; L198-K202 WeakPolarHBondContact O-CB 3.39Å; L198-K202 PolarHBondContact O-N 2.78Å
199	R	73.6	Confident	73.5	Confident	139 Å²	139	88.1 Å²	88.1	53%	0.525	41%	0.41	S	S	.	.	H	α-helix	trans	-63.4	-40.7	173.1	-73.1	176	-162.8	137.4	12.7	111.7	E195 E196 Q197 A203	E195-R199 WeakPolarHBondContact O-CG 3.29Å; E195-R199 PolarHBondContact O-N 3.22Å; E195-R199 IonicContact OE2-NH2 3.79Å; E195-R199 PolarHBondContact OE2-NH2 2.66Å; E196-R199 PolarHBondContact O-N 2.91Å; E196-R199 IonicContact OE2-NH1 3.73Å; Q197-R199 PolarHBondContact O-N 2.91Å; R199-A203 WeakPolarHBondContact O-CB 3.46Å; R199-A203 PolarHBondContact O-N 3.18Å; R199-A203 VanDerWaalsContact O-N 3.09Å
200	S	76.9	Confident	73.5	Confident	65 Å²	65	87.9 Å²	87.9	46%	0.455	41%	0.409	S	S	.	.	H	α-helix	trans	-62.4	-55.2	175.5	-166.1	0	0	0	0	111.1	E196 Q197 K202 A203 D204	E196-S200 PolarHBondContact O-N 3.27Å; Q197-S200 PolarHBondContact O-N 3.46Å; S200-K202 VanDerWaalsContact C-N 3.3Å; S200-K202 PolarHBondContact O-N 3.45Å; S200-A203 WeakPolarHBondContact O-CA 3.4Å; S200-A203 WeakPolarHBondContact O-CB 3.39Å; S200-A203 PolarHBondContact O-N 3.33Å; S200-D204 PolarHBondContact O-N 3.42Å
201	S	69.8	Low	73.6	Confident	44 Å²	44	87.5 Å²	87.5	31%	0.308	41%	0.413	S	S	.	.	H	α-helix	trans	-56.8	-42.6	179.9	176.3	0	0	0	0	112.1	Q197 A203 D204 L205	Q197-S201 PolarHBondContact O-N 2.71Å; S201-A203 VanDerWaalsContact C-N 3.33Å; S201-A203 PolarHBondContact O-N 3.48Å; S201-D204 PolarHBondContact O-N 3Å; S201-L205 WeakPolarHBondContact O-CB 3.43Å; S201-L205 WeakPolarHBondContact O-CG 3.44Å; S201-L205 PolarHBondContact O-N 2.9Å
202	K	72.4	Confident	74.1	Confident	129 Å²	129	91.2 Å²	91.2	56%	0.561	43%	0.429	S	S	*	.	H	α-helix	trans	-61	-38	174.2	-175.3	174	-180	176.2	0	113.1	L198 S200 E206	L198-K202 VanDerWaalsContact O-CB 3.26Å; L198-K202 WeakPolarHBondContact O-CB 3.39Å; L198-K202 PolarHBondContact O-N 2.78Å; S200-K202 VanDerWaalsContact C-N 3.3Å; S200-K202 PolarHBondContact O-N 3.45Å; K202-E206 PolarHBondContact O-N 3.01Å; K202-E206 VanDerWaalsContact O-N 3.12Å
203	A	76.4	Confident	74.3	Confident	44 Å²	44	89.7 Å²	89.7	36%	0.364	43%	0.428	S	S	.	.	H	α-helix	trans	-69.8	-35.9	176.4	0	0	0	0	0	112.2	R199 S200 S201 R207	R199-A203 WeakPolarHBondContact O-CB 3.46Å; R199-A203 PolarHBondContact O-N 3.18Å; R199-A203 VanDerWaalsContact O-N 3.09Å; S200-A203 WeakPolarHBondContact O-CA 3.4Å; S200-A203 WeakPolarHBondContact O-CB 3.39Å; S200-A203 PolarHBondContact O-N 3.33Å; S201-A203 VanDerWaalsContact C-N 3.33Å; S201-A203 PolarHBondContact O-N 3.48Å; A203-R207 WeakPolarHBondContact O-CG 3.44Å; A203-R207 PolarHBondContact O-N 2.67Å
204	D	73	Confident	74.4	Confident	51 Å²	51	91.3 Å²	91.3	27%	0.273	43%	0.433	S	S	.	.	H	α-helix	trans	-69.6	-44.5	176.3	-61.2	-39.4	0	0	0	111	S200 S201 E206 R207 H208	S200-D204 PolarHBondContact O-N 3.42Å; S201-D204 PolarHBondContact O-N 3Å; D204-E206 VanDerWaalsContact C-N 3.3Å; D204-E206 PolarHBondContact O-N 3.37Å; D204-R207 WeakPolarHBondContact O-CA 3.45Å; D204-R207 WeakPolarHBondContact O-CB 3.28Å; D204-R207 PolarHBondContact O-N 3.43Å; D204-R207 IonicContact OD1-CZ 2.65Å; D204-R207 IonicContact OD1-NH1 3.42Å; D204-R207 PolarHBondContact OD1-NH1 3.27Å; D204-R207 IonicContact OD1-NH2 3.99Å; D204-R207 PolarHBondContact OD1-NH2 2.97Å; D204-H208 PolarHBondContact O-CD2 3.37Å; D204-H208 PolarHBondContact O-N 2.92Å
205	L	69.7	Low	74.7	Confident	47 Å²	47	92.5 Å²	92.5	25%	0.246	45%	0.447	C	S	.	.	H	α-helix	trans	-57.8	-39.2	173.1	-70.9	175	0	0	0	112.7	W26 S201 H208 R209	W26-L205 HydrophobicContact CH2-CB 4.44Å; W26-L205 HydrophobicContact CH2-CD1 3.88Å; W26-L205 HydrophobicContact CH2-CD2 4.03Å; W26-L205 HydrophobicContact CH2-CG 4.34Å; W26-L205 HydrophobicContact CZ3-CD1 3.97Å; S201-L205 WeakPolarHBondContact O-CB 3.43Å; S201-L205 WeakPolarHBondContact O-CG 3.44Å; S201-L205 PolarHBondContact O-N 2.9Å; L205-H208 PolarHBondContact O-N 3.4Å; L205-R209 WeakPolarHBondContact O-CB 3.22Å; L205-R209 PolarHBondContact O-N 3.44Å
206	E	73.7	Confident	75.1	Confident	94 Å²	94	90.4 Å²	90.4	44%	0.439	44%	0.443	S	S	.	.	H	α-helix	trans	-67.7	-34.3	175.5	-167.5	57.5	-141.5	0	0	111.8	K202 D204 R209 N210	K202-E206 PolarHBondContact O-N 3.01Å; K202-E206 VanDerWaalsContact O-N 3.12Å; D204-E206 VanDerWaalsContact C-N 3.3Å; D204-E206 PolarHBondContact O-N 3.37Å; E206-R209 PolarHBondContact O-N 3.49Å; E206-N210 PolarHBondContact O-N 3.48Å; E206-N210 VanDerWaalsContact O-N 3.07Å; E206-N210 PolarHBondContact O-ND2 3.15Å; E206-N210 PolarHBondContact OE1-ND2 2.96Å
207	R	76.2	Confident	75.3	Confident	145 Å²	145	89.8 Å²	89.8	55%	0.547	44%	0.44	S	S	.	.	H	α-helix	trans	-64.2	-47.5	170.3	-65.6	179	-149.4	133.9	19.3	111.2	A203 D204 R209 N210 H211	A203-R207 WeakPolarHBondContact O-CG 3.44Å; A203-R207 PolarHBondContact O-N 2.67Å; D204-R207 WeakPolarHBondContact O-CA 3.45Å; D204-R207 WeakPolarHBondContact O-CB 3.28Å; D204-R207 PolarHBondContact O-N 3.43Å; D204-R207 IonicContact OD1-CZ 2.65Å; D204-R207 IonicContact OD1-NH1 3.42Å; D204-R207 PolarHBondContact OD1-NH1 3.27Å; D204-R207 IonicContact OD1-NH2 3.99Å; D204-R207 PolarHBondContact OD1-NH2 2.97Å; R207-R209 VanDerWaalsContact C-N 3.31Å; R207-R209 PolarHBondContact O-N 3.1Å; R207-N210 PolarHBondContact O-N 3.2Å; R207-N210 VanDerWaalsContact O-N 3.17Å; R207-H211 PolarHBondContact O-CD2 2.91Å; R207-H211 PolarHBondContact O-N 3.44Å
208	H	75.1	Confident	75.5	Confident	120 Å²	120	87.5 Å²	87.5	56%	0.556	44%	0.437	S	S	*	.	H	α-helix	trans	-59.3	-40.7	177.6	-71.8	-69.1	0	0	0	112.2	D204 L205 H211 L212	D204-H208 PolarHBondContact O-CD2 3.37Å; D204-H208 PolarHBondContact O-N 2.92Å; L205-H208 PolarHBondContact O-N 3.4Å; H208-H211 PolarHBondContact O-N 3.32Å; H208-L212 PolarHBondContact O-N 3.32Å
209	R	74.8	Confident	76.1	Confident	133 Å²	133	89.8 Å²	89.8	50%	0.502	45%	0.452	S	S	.	.	H	α-helix	trans	-57.4	-50	172.5	180	-174	173.3	137.7	4.1	112.1	L205 E206 R207 H211 L212 E213	L205-R209 WeakPolarHBondContact O-CB 3.22Å; L205-R209 PolarHBondContact O-N 3.44Å; E206-R209 PolarHBondContact O-N 3.49Å; R207-R209 VanDerWaalsContact C-N 3.31Å; R207-R209 PolarHBondContact O-N 3.1Å; R209-H211 VanDerWaalsContact C-N 3.27Å; R209-H211 PolarHBondContact O-N 2.84Å; R209-L212 PolarHBondContact O-N 2.98Å; R209-E213 PolarHBondContact O-N 3.44Å
210	N	78.2	Confident	76.5	Confident	71 Å²	71	89.1 Å²	89.1	38%	0.38	45%	0.449	S	S	.	.	H	α-helix	trans	-64.3	-30.7	179.1	-80.7	-80.5	0	0	0	112.5	E206 R207 K214	E206-N210 PolarHBondContact O-N 3.48Å; E206-N210 VanDerWaalsContact O-N 3.07Å; E206-N210 PolarHBondContact O-ND2 3.15Å; E206-N210 PolarHBondContact OE1-ND2 2.96Å; R207-N210 PolarHBondContact O-N 3.2Å; R207-N210 VanDerWaalsContact O-N 3.17Å; N210-K214 WeakPolarHBondContact O-CG 3.46Å; N210-K214 PolarHBondContact O-N 3.15Å
211	H	79.1	Confident	76.7	Confident	131 Å²	131	88.6 Å²	88.6	61%	0.606	45%	0.445	S	S	*	.	H	α-helix	trans	-71.8	-42.3	171.8	-80.5	-72.9	0	0	0	112.6	R207 H208 R209 E213 K214 A215	R207-H211 PolarHBondContact O-CD2 2.91Å; R207-H211 PolarHBondContact O-N 3.44Å; H208-H211 PolarHBondContact O-N 3.32Å; R209-H211 VanDerWaalsContact C-N 3.27Å; R209-H211 PolarHBondContact O-N 2.84Å; H211-E213 VanDerWaalsContact C-N 3.34Å; H211-E213 PolarHBondContact O-N 3.28Å; H211-K214 PolarHBondContact O-N 3.32Å; H211-A215 WeakPolarHBondContact O-CB 3.39Å; H211-A215 PolarHBondContact O-N 3.03Å
212	L	75	Confident	77.3	Confident	114 Å²	114	91.8 Å²	91.8	60%	0.597	46%	0.458	S	S	*	.	H	α-helix	trans	-61.7	-39.1	174.7	-85.6	161.3	0	0	0	112.5	H208 R209 A215 A216	H208-L212 PolarHBondContact O-N 3.32Å; R209-L212 PolarHBondContact O-N 2.98Å; L212-A215 PolarHBondContact O-N 3.02Å; L212-A216 WeakPolarHBondContact O-CB 3.32Å; L212-A216 PolarHBondContact O-N 3.24Å
213	E	77.7	Confident	77.9	Confident	97 Å²	97	91.1 Å²	91.1	45%	0.453	46%	0.457	S	S	.	.	H	α-helix	trans	-64.9	-44.8	178.1	-170.6	153.8	-149.1	0	0	111.7	R209 H211 A215 A216 E217	R209-E213 PolarHBondContact O-N 3.44Å; H211-E213 VanDerWaalsContact C-N 3.34Å; H211-E213 PolarHBondContact O-N 3.28Å; E213-A215 PolarHBondContact O-N 3.34Å; E213-A216 PolarHBondContact O-N 2.95Å; E213-E217 WeakPolarHBondContact O-CG 3.35Å; E213-E217 PolarHBondContact O-N 2.92Å
214	K	80.5	Confident	78.3	Confident	126 Å²	126	95.7 Å²	95.7	55%	0.548	47%	0.465	S	S	.	.	H	α-helix	trans	-64.4	-37.2	173.3	-70.5	173.2	-178.6	177.5	0	113.3	N210 H211 E217 S218	N210-K214 WeakPolarHBondContact O-CG 3.46Å; N210-K214 PolarHBondContact O-N 3.15Å; H211-K214 PolarHBondContact O-N 3.32Å; K214-E217 PolarHBondContact O-N 2.84Å; K214-S218 PolarHBondContact O-N 3.27Å; K214-S218 PolarHBondContact O-OG 3.05Å
215	A	76.2	Confident	79	Confident	50 Å²	50	96.4 Å²	96.4	41%	0.413	47%	0.473	S	S	.	.	H	α-helix	trans	-64.8	-43.6	173.5	0	0	0	0	0	110.9	H211 L212 E213 E217 S218 V219	H211-A215 WeakPolarHBondContact O-CB 3.39Å; H211-A215 PolarHBondContact O-N 3.03Å; L212-A215 PolarHBondContact O-N 3.02Å; E213-A215 PolarHBondContact O-N 3.34Å; A215-E217 PolarHBondContact O-N 3.34Å; A215-S218 WeakPolarHBondContact O-CB 3.46Å; A215-S218 PolarHBondContact O-N 2.97Å; A215-S218 VanDerWaalsContact O-N 3.13Å; A215-V219 WeakPolarHBondContact O-CG2 3.28Å; A215-V219 PolarHBondContact O-N 3.3Å
216	A	77.6	Confident	79.5	Confident	33 Å²	33	97.7 Å²	97.7	27%	0.273	49%	0.486	S	S	.	.	H	α-helix	trans	-64.8	-35.8	176.3	0	0	0	0	0	113	L212 E213 R220	L212-A216 WeakPolarHBondContact O-CB 3.32Å; L212-A216 PolarHBondContact O-N 3.24Å; E213-A216 PolarHBondContact O-N 2.95Å; A216-R220 WeakPolarHBondContact O-CB 3.3Å; A216-R220 WeakPolarHBondContact O-CG 3.38Å; A216-R220 PolarHBondContact O-N 3.07Å
217	E	80.9	Confident	80	Confident	109 Å²	109	96.6 Å²	96.6	51%	0.509	49%	0.485	S	S	.	.	H	α-helix	trans	-63	-41.6	169.7	-73.1	179.7	157.6	0	0	112.3	E213 K214 A215 R220 S221	E213-E217 WeakPolarHBondContact O-CG 3.35Å; E213-E217 PolarHBondContact O-N 2.92Å; K214-E217 PolarHBondContact O-N 2.84Å; A215-E217 PolarHBondContact O-N 3.34Å; E217-R220 PolarHBondContact O-N 3.44Å; E217-S221 PolarHBondContact O-N 3.37Å
218	S	81.1	Confident	80.4	Confident	68 Å²	68	95.1 Å²	95.1	48%	0.476	48%	0.484	S	S	.	.	H	α-helix	trans	-64.9	-43.9	177.7	-55.1	0	0	0	0	111.5	K214 A215 S221 L222	K214-S218 PolarHBondContact O-N 3.27Å; K214-S218 PolarHBondContact O-OG 3.05Å; A215-S218 WeakPolarHBondContact O-CB 3.46Å; A215-S218 PolarHBondContact O-N 2.97Å; A215-S218 VanDerWaalsContact O-N 3.13Å; S218-S221 WeakPolarHBondContact O-CB 3.38Å; S218-S221 PolarHBondContact O-N 2.87Å; S218-L222 WeakPolarHBondContact O-CG 3.25Å; S218-L222 PolarHBondContact O-N 2.91Å
219	V	80.1	Confident	80.7	Confident	75 Å²	75	92 Å²	92	46%	0.455	48%	0.479	S	S	.	.	H	α-helix	trans	-61	-48.4	173.7	172.6	0	0	0	0	111	A215 S221 L222 E223	A215-V219 WeakPolarHBondContact O-CG2 3.28Å; A215-V219 PolarHBondContact O-N 3.3Å; V219-S221 PolarHBondContact O-N 2.96Å; V219-L222 PolarHBondContact O-N 3.32Å; V219-E223 HydrophobicContact CG1-CG 4.19Å; V219-E223 WeakPolarHBondContact O-CG 3.43Å; V219-E223 PolarHBondContact O-N 2.86Å
220	R	82.7	Confident	81.2	Confident	126 Å²	126	90.8 Å²	90.8	48%	0.475	48%	0.479	S	S	.	.	H	α-helix	trans	-59.7	-27.5	175.6	-74.9	-174.4	-65	-109.1	6.2	113.6	A216 E217 R224	A216-R220 WeakPolarHBondContact O-CB 3.3Å; A216-R220 WeakPolarHBondContact O-CG 3.38Å; A216-R220 PolarHBondContact O-N 3.07Å; E217-R220 PolarHBondContact O-N 3.44Å; R220-R224 PolarHBondContact O-N 3.46Å
221	S	81.5	Confident	81.7	Confident	53 Å²	53	91.4 Å²	91.4	37%	0.371	48%	0.483	S	S	.	.	H	α-helix	trans	-76.2	-41.8	173.2	-163	0	0	0	0	111.7	E217 S218 V219 R224 C225	E217-S221 PolarHBondContact O-N 3.37Å; S218-S221 WeakPolarHBondContact O-CB 3.38Å; S218-S221 PolarHBondContact O-N 2.87Å; V219-S221 PolarHBondContact O-N 2.96Å; S221-R224 PolarHBondContact O-N 2.83Å; S221-C225 PolarHBondContact O-N 3.34Å; S221-C225 PolarHBondContact O-SG 3.39Å
222	L	82.2	Confident	82.1	Confident	111 Å²	111	91.2 Å²	91.2	58%	0.581	48%	0.477	S	S	*	.	H	α-helix	trans	-66.9	-42.7	176.8	-71.4	171	0	0	0	112.1	S218 V219 R224 C225 C226	S218-L222 WeakPolarHBondContact O-CG 3.25Å; S218-L222 PolarHBondContact O-N 2.91Å; V219-L222 PolarHBondContact O-N 3.32Å; L222-R224 VanDerWaalsContact C-N 3.27Å; L222-R224 PolarHBondContact O-N 2.92Å; L222-C225 PolarHBondContact O-N 2.87Å; L222-C226 PolarHBondContact O-N 3.24Å; L222-C226 PolarHBondContact O-SG 2.93Å; L222-C226 VanDerWaalsContact O-SG 3.32Å
223	E	84.9	Confident	82.6	Confident	116 Å²	116	89.8 Å²	89.8	54%	0.542	48%	0.476	S	S	.	.	H	α-helix	trans	-53.5	-45.4	172.6	-73.7	173.2	159	0	0	111	V219 C226 T227	V219-E223 HydrophobicContact CG1-CG 4.19Å; V219-E223 WeakPolarHBondContact O-CG 3.43Å; V219-E223 PolarHBondContact O-N 2.86Å; E223-C226 PolarHBondContact O-N 2.94Å; E223-T227 WeakPolarHBondContact O-CG2 3.36Å; E223-T227 PolarHBondContact O-N 3.47Å; E223-T227 PolarHBondContact O-OG1 3.38Å
224	R	85.1	Confident	83	Confident	140 Å²	140	90.4 Å²	90.4	53%	0.528	48%	0.477	S	S	.	.	H	α-helix	trans	-62.2	-49.9	176.6	-161	-171.8	-49.1	136.5	15.9	111.6	R220 S221 L222 C226 T227 E228	R220-R224 PolarHBondContact O-N 3.46Å; S221-R224 PolarHBondContact O-N 2.83Å; L222-R224 VanDerWaalsContact C-N 3.27Å; L222-R224 PolarHBondContact O-N 2.92Å; R224-C226 VanDerWaalsContact C-N 3.27Å; R224-C226 PolarHBondContact O-N 3.25Å; R224-T227 PolarHBondContact O-N 3.45Å; R224-T227 VanDerWaalsContact O-N 3.11Å; R224-T227 PolarHBondContact O-OG1 3.23Å; R224-E228 WeakPolarHBondContact O-CG 3.33Å; R224-E228 PolarHBondContact O-N 2.98Å
225	C	85.9	Confident	83.3	Confident	66 Å²	66	88.8 Å²	88.8	45%	0.446	47%	0.471	S	S	.	.	H	α-helix	trans	-57.3	-39	175.6	-66.7	0	0	0	0	112.4	S221 L222 E228 A229	S221-C225 PolarHBondContact O-N 3.34Å; S221-C225 PolarHBondContact O-SG 3.39Å; L222-C225 PolarHBondContact O-N 2.87Å; C225-E228 PolarHBondContact O-N 3.4Å; C225-A229 VanDerWaalsContact O-CB 3.31Å; C225-A229 WeakPolarHBondContact O-CB 3.47Å; C225-A229 PolarHBondContact O-N 3.48Å
226	C	81	Confident	83.8	Confident	74 Å²	74	90.5 Å²	90.5	50%	0.5	47%	0.473	S	S	.	.	H	α-helix	trans	-64.6	-44.9	174.5	-70.4	0	0	0	0	111.6	L222 E223 R224 E228 A229 E230	L222-C226 PolarHBondContact O-N 3.24Å; L222-C226 PolarHBondContact O-SG 2.93Å; L222-C226 VanDerWaalsContact O-SG 3.32Å; E223-C226 PolarHBondContact O-N 2.94Å; R224-C226 VanDerWaalsContact C-N 3.27Å; R224-C226 PolarHBondContact O-N 3.25Å; C226-E228 VanDerWaalsContact C-N 3.35Å; C226-E228 PolarHBondContact O-N 3Å; C226-A229 PolarHBondContact O-N 3.49Å; C226-E230 WeakPolarHBondContact O-CG 3.41Å; C226-E230 PolarHBondContact O-N 3.38Å
227	T	84.3	Confident	84.4	Confident	70 Å²	70	95.1 Å²	95.1	43%	0.429	49%	0.487	S	S	.	.	H	α-helix	trans	-64.7	-36.6	176.3	59.1	0	0	0	0	113	E223 R224 N231	E223-T227 WeakPolarHBondContact O-CG2 3.36Å; E223-T227 PolarHBondContact O-N 3.47Å; E223-T227 PolarHBondContact O-OG1 3.38Å; R224-T227 PolarHBondContact O-N 3.45Å; R224-T227 VanDerWaalsContact O-N 3.11Å; R224-T227 PolarHBondContact O-OG1 3.23Å; T227-N231 WeakPolarHBondContact O-CB 3.32Å; T227-N231 PolarHBondContact O-N 2.99Å; T227-N231 PolarHBondContact O-ND2 3.38Å
228	E	84.6	Confident	84.7	Confident	114 Å²	114	95 Å²	95	53%	0.533	49%	0.49	S	S	.	.	H	α-helix	trans	-65.3	-43.8	173.5	-71.9	171.5	-164.4	0	0	111	R224 C225 C226 N231 R232	R224-E228 WeakPolarHBondContact O-CG 3.33Å; R224-E228 PolarHBondContact O-N 2.98Å; C225-E228 PolarHBondContact O-N 3.4Å; C226-E228 VanDerWaalsContact C-N 3.35Å; C226-E228 PolarHBondContact O-N 3Å; E228-N231 PolarHBondContact O-N 2.7Å; E228-R232 WeakPolarHBondContact O-CB 3.29Å; E228-R232 PolarHBondContact O-N 2.92Å
229	A	81.5	Confident	85.2	Confident	54 Å²	54	96.6 Å²	96.6	45%	0.446	49%	0.49	S	S	.	.	H	α-helix	trans	-64.8	-42	175.5	0	0	0	0	0	112.7	C225 C226 R232 C233	C225-A229 VanDerWaalsContact O-CB 3.31Å; C225-A229 WeakPolarHBondContact O-CB 3.47Å; C225-A229 PolarHBondContact O-N 3.48Å; C226-A229 PolarHBondContact O-N 3.49Å; A229-R232 PolarHBondContact O-N 2.91Å; A229-C233 WeakPolarHBondContact O-CB 3.17Å; A229-C233 PolarHBondContact O-N 3.47Å; A229-C233 PolarHBondContact O-SG 3.43Å
230	E	86.2	Confident	85.6	Confident	108 Å²	108	98.4 Å²	98.4	51%	0.505	50%	0.496	S	S	.	.	H	α-helix	trans	-61	-44	174.4	-80.2	-175	-162.5	0	0	112.2	C226 R232 C233 K234	C226-E230 WeakPolarHBondContact O-CG 3.41Å; C226-E230 PolarHBondContact O-N 3.38Å; E230-R232 VanDerWaalsContact C-N 3.33Å; E230-C233 PolarHBondContact O-N 2.76Å; E230-K234 VanDerWaalsContact O-CG 3.32Å; E230-K234 WeakPolarHBondContact O-CG 3.33Å; E230-K234 PolarHBondContact O-N 2.9Å; E230-K234 IonicContact OE2-NZ 2.62Å
231	N	86.8	Confident	85.8	Confident	84 Å²	84	96.3 Å²	96.3	45%	0.449	49%	0.494	S	S	.	.	H	α-helix	trans	-64.3	-41.5	176.6	-70.3	-22	0	0	0	110.7	T227 E228 C233 K234 E235	T227-N231 WeakPolarHBondContact O-CB 3.32Å; T227-N231 PolarHBondContact O-N 2.99Å; T227-N231 PolarHBondContact O-ND2 3.38Å; E228-N231 PolarHBondContact O-N 2.7Å; N231-C233 VanDerWaalsContact C-N 3.34Å; N231-C233 PolarHBondContact O-N 3.11Å; N231-K234 WeakPolarHBondContact O-CB 3.44Å; N231-K234 PolarHBondContact O-N 3.27Å; N231-K234 VanDerWaalsContact O-N 3.15Å; N231-K234 PolarHBondContact OD1-NZ 2.95Å; N231-E235 WeakPolarHBondContact O-CG 3.32Å; N231-E235 PolarHBondContact O-N 3.19Å
232	R	88.9	Confident	86.1	Confident	127 Å²	127	99.7 Å²	99.7	48%	0.479	50%	0.504	S	S	.	.	H	α-helix	trans	-64.4	-36.4	175	-165.8	58.2	175.6	154.3	9	112.9	E228 A229 E230 E235 L236	E228-R232 WeakPolarHBondContact O-CB 3.29Å; E228-R232 PolarHBondContact O-N 2.92Å; A229-R232 PolarHBondContact O-N 2.91Å; E230-R232 VanDerWaalsContact C-N 3.33Å; R232-E235 WeakPolarHBondContact CD-OE2 3.5Å; R232-E235 IonicContact CZ-OE2 2.66Å; R232-E235 IonicContact NE-OE2 2.75Å; R232-E235 IonicContact NH1-OE2 3.12Å; R232-E235 PolarHBondContact NH1-OE2 3.45Å; R232-E235 PolarHBondContact O-N 3.28Å; R232-L236 HydrophobicContact CG-CD1 4.3Å; R232-L236 WeakPolarHBondContact O-CB 3.43Å; R232-L236 VanDerWaalsContact O-CG 3.29Å; R232-L236 WeakPolarHBondContact O-CG 3.34Å; R232-L236 PolarHBondContact O-N 3.3Å
233	C	84.5	Confident	86.4	Confident	85 Å²	85	99.8 Å²	99.8	57%	0.574	50%	0.5	S	S	*	.	H	α-helix	trans	-65.9	-37.1	172.3	-74.6	0	0	0	0	112.5	A229 E230 N231 K237	A229-C233 WeakPolarHBondContact O-CB 3.17Å; A229-C233 PolarHBondContact O-N 3.47Å; A229-C233 PolarHBondContact O-SG 3.43Å; E230-C233 PolarHBondContact O-N 2.76Å; N231-C233 VanDerWaalsContact C-N 3.34Å; N231-C233 PolarHBondContact O-N 3.11Å; C233-K237 VanDerWaalsContact O-CB 3.3Å; C233-K237 WeakPolarHBondContact O-CB 3.36Å; C233-K237 PolarHBondContact O-N 3.32Å
234	K	87.6	Confident	86.6	Confident	109 Å²	109	97.1 Å²	97.1	47%	0.474	49%	0.492	S	S	.	.	H	α-helix	trans	-66.1	-43.1	173.7	-68.6	161.1	-166.7	154.5	0	111.4	E230 N231 K237 N238	E230-K234 VanDerWaalsContact O-CG 3.32Å; E230-K234 WeakPolarHBondContact O-CG 3.33Å; E230-K234 PolarHBondContact O-N 2.9Å; E230-K234 IonicContact OE2-NZ 2.62Å; N231-K234 WeakPolarHBondContact O-CB 3.44Å; N231-K234 PolarHBondContact O-N 3.27Å; N231-K234 VanDerWaalsContact O-N 3.15Å; N231-K234 PolarHBondContact OD1-NZ 2.95Å; K234-K237 PolarHBondContact O-N 2.67Å; K234-N238 VanDerWaalsContact O-CG 3.25Å; K234-N238 PolarHBondContact O-N 2.82Å; K234-N238 PolarHBondContact O-ND2 2.9Å
235	E	86.6	Confident	86.7	Confident	93 Å²	93	93.3 Å²	93.3	44%	0.435	49%	0.49	S	S	.	.	H	α-helix	trans	-59	-54.1	174	-71.7	171.7	179.3	0	0	111.7	N231 R232 K237 N238 E239	N231-E235 WeakPolarHBondContact O-CG 3.32Å; N231-E235 PolarHBondContact O-N 3.19Å; R232-E235 WeakPolarHBondContact CD-OE2 3.5Å; R232-E235 IonicContact CZ-OE2 2.66Å; R232-E235 IonicContact NE-OE2 2.75Å; R232-E235 IonicContact NH1-OE2 3.12Å; R232-E235 PolarHBondContact NH1-OE2 3.45Å; R232-E235 PolarHBondContact O-N 3.28Å; E235-K237 PolarHBondContact O-N 2.94Å; E235-N238 PolarHBondContact O-N 3.34Å; E235-N238 VanDerWaalsContact O-N 3.09Å; E235-E239 PolarHBondContact O-N 3.09Å
236	L	86.4	Confident	86.8	Confident	86 Å²	86	93.7 Å²	93.7	45%	0.45	49%	0.485	S	S	.	.	H	α-helix	trans	-61.1	-33.2	179.5	-71.8	170.6	0	0	0	112.5	R232 L240	R232-L236 HydrophobicContact CG-CD1 4.3Å; R232-L236 WeakPolarHBondContact O-CB 3.43Å; R232-L236 VanDerWaalsContact O-CG 3.29Å; R232-L236 WeakPolarHBondContact O-CG 3.34Å; R232-L236 PolarHBondContact O-N 3.3Å; L236-L240 WeakPolarHBondContact O-CB 3.16Å; L236-L240 PolarHBondContact O-N 3.12Å
237	K	90.2	Very high	87.2	Confident	129 Å²	129	93.7 Å²	93.7	56%	0.561	48%	0.483	S	S	*	.	H	α-helix	trans	-66.4	-45.9	173.1	-176.4	176.7	177.4	-177.9	0	111.7	C233 K234 E235 E239 L240 D241	C233-K237 VanDerWaalsContact O-CB 3.3Å; C233-K237 WeakPolarHBondContact O-CB 3.36Å; C233-K237 PolarHBondContact O-N 3.32Å; K234-K237 PolarHBondContact O-N 2.67Å; E235-K237 PolarHBondContact O-N 2.94Å; K237-E239 VanDerWaalsContact C-N 3.32Å; K237-E239 PolarHBondContact O-N 2.82Å; K237-L240 PolarHBondContact O-N 3.39Å; K237-D241 WeakPolarHBondContact O-CB 3.24Å; K237-D241 PolarHBondContact O-N 3.02Å
238	N	87.5	Confident	87.4	Confident	107 Å²	107	96.2 Å²	96.2	57%	0.572	49%	0.488	S	S	*	.	H	α-helix	trans	-62.2	-40.5	177	-66.6	-17.3	0	0	0	111.6	K234 E235 D241 Q242	K234-N238 VanDerWaalsContact O-CG 3.25Å; K234-N238 PolarHBondContact O-N 2.82Å; K234-N238 PolarHBondContact O-ND2 2.9Å; E235-N238 PolarHBondContact O-N 3.34Å; E235-N238 VanDerWaalsContact O-N 3.09Å; N238-D241 PolarHBondContact O-N 3.13Å; N238-Q242 WeakPolarHBondContact O-CB 3.46Å; N238-Q242 PolarHBondContact O-N 2.92Å
239	E	90	Very high	87.4	Confident	102 Å²	102	93.6 Å²	93.6	48%	0.477	48%	0.483	S	S	.	.	H	α-helix	trans	-61.5	-42.3	173.1	-71.8	179.6	-174.6	0	0	111.8	E235 K237 Q242 K243	E235-E239 PolarHBondContact O-N 3.09Å; K237-E239 VanDerWaalsContact C-N 3.32Å; K237-E239 PolarHBondContact O-N 2.82Å; E239-Q242 PolarHBondContact O-N 3.49Å; E239-K243 WeakPolarHBondContact O-CB 3.3Å; E239-K243 VanDerWaalsContact O-CG 3.3Å; E239-K243 WeakPolarHBondContact O-CG 3.37Å; E239-K243 PolarHBondContact O-N 2.7Å
240	L	88.4	Confident	87.7	Confident	112 Å²	112	95.9 Å²	95.9	59%	0.586	49%	0.487	S	S	*	.	H	α-helix	trans	-66.8	-43.3	177.5	-177.9	65.2	0	0	0	112.4	L236 K237 Q242 K243 T244	L236-L240 WeakPolarHBondContact O-CB 3.16Å; L236-L240 PolarHBondContact O-N 3.12Å; K237-L240 PolarHBondContact O-N 3.39Å; L240-Q242 VanDerWaalsContact C-N 3.34Å; L240-K243 PolarHBondContact O-N 3.02Å; L240-T244 WeakPolarHBondContact O-CB 3.35Å; L240-T244 PolarHBondContact O-N 3.22Å; L240-T244 PolarHBondContact O-OG1 3.48Å
241	D	88	Confident	87.7	Confident	83 Å²	83	95.6 Å²	95.6	44%	0.444	49%	0.486	S	S	.	.	H	α-helix	trans	-63.3	-41.6	177	-71.8	-24.2	0	0	0	110.3	K237 N238 T244 A245	K237-D241 WeakPolarHBondContact O-CB 3.24Å; K237-D241 PolarHBondContact O-N 3.02Å; N238-D241 PolarHBondContact O-N 3.13Å; D241-T244 PolarHBondContact O-N 3.02Å; D241-A245 PolarHBondContact O-N 3.48Å
242	Q	88	Confident	87.7	Confident	124 Å²	124	95 Å²	95	58%	0.579	48%	0.483	S	S	*	.	H	α-helix	trans	-62.4	-47.2	173.4	-178	176.8	-4.4	0	0	112.2	N238 E239 L240 T244 A245 E246	N238-Q242 WeakPolarHBondContact O-CB 3.46Å; N238-Q242 PolarHBondContact O-N 2.92Å; E239-Q242 PolarHBondContact O-N 3.49Å; L240-Q242 VanDerWaalsContact C-N 3.34Å; Q242-T244 VanDerWaalsContact C-N 3.28Å; Q242-T244 PolarHBondContact O-N 3.21Å; Q242-A245 PolarHBondContact O-N 3.29Å; Q242-E246 PolarHBondContact O-N 3.47Å
243	K	87.8	Confident	87.6	Confident	113 Å²	113	93.2 Å²	93.2	49%	0.491	48%	0.482	S	S	.	.	H	α-helix	trans	-65.1	-33.3	177.8	-72.6	-72	163.4	-131.5	0	112.4	E239 L240 E246 V247	E239-K243 WeakPolarHBondContact O-CB 3.3Å; E239-K243 VanDerWaalsContact O-CG 3.3Å; E239-K243 WeakPolarHBondContact O-CG 3.37Å; E239-K243 PolarHBondContact O-N 2.7Å; L240-K243 PolarHBondContact O-N 3.02Å; K243-E246 IonicContact NZ-OE1 2.72Å; K243-E246 PolarHBondContact NZ-OE1 2.91Å; K243-E246 IonicContact NZ-OE2 3.13Å; K243-E246 PolarHBondContact NZ-OE2 3.37Å; K243-E246 PolarHBondContact O-N 3.19Å; K243-V247 WeakPolarHBondContact O-CG2 3.43Å; K243-V247 PolarHBondContact O-N 3.07Å
244	T	89.7	Confident	87.7	Confident	59 Å²	59	93.6 Å²	93.6	36%	0.362	48%	0.478	S	S	.	.	H	α-helix	trans	-64.9	-43.7	174.2	-59.2	0	0	0	0	110.9	L240 D241 Q242 V247 F248	L240-T244 WeakPolarHBondContact O-CB 3.35Å; L240-T244 PolarHBondContact O-N 3.22Å; L240-T244 PolarHBondContact O-OG1 3.48Å; D241-T244 PolarHBondContact O-N 3.02Å; Q242-T244 VanDerWaalsContact C-N 3.28Å; Q242-T244 PolarHBondContact O-N 3.21Å; T244-V247 PolarHBondContact O-N 2.65Å; T244-F248 HydrophobicContact CG2-CD2 3.92Å; T244-F248 HydrophobicContact CG2-CE2 3.65Å; T244-F248 VanDerWaalsContact O-CD2 3.25Å; T244-F248 WeakPolarHBondContact O-CD2 3.42Å; T244-F248 PolarHBondContact O-N 2.78Å
245	A	87.5	Confident	87.8	Confident	61 Å²	61	94.6 Å²	94.6	50%	0.504	48%	0.479	S	S	.	.	H	α-helix	trans	-63.7	-40.5	174.4	0	0	0	0	0	112.9	D241 Q242 F248 S249	D241-A245 PolarHBondContact O-N 3.48Å; Q242-A245 PolarHBondContact O-N 3.29Å; A245-F248 PolarHBondContact O-N 3.06Å; A245-S249 PolarHBondContact O-N 2.96Å
246	E	88.4	Confident	87.7	Confident	73 Å²	73	93.9 Å²	93.9	34%	0.341	48%	0.477	S	S	.	.	H	α-helix	trans	-58.3	-47	172	-72.6	174.3	-152.8	0	0	111.3	Q242 K243 F248 S249 L250	Q242-E246 PolarHBondContact O-N 3.47Å; K243-E246 IonicContact NZ-OE1 2.72Å; K243-E246 PolarHBondContact NZ-OE1 2.91Å; K243-E246 IonicContact NZ-OE2 3.13Å; K243-E246 PolarHBondContact NZ-OE2 3.37Å; K243-E246 PolarHBondContact O-N 3.19Å; E246-F248 PolarHBondContact O-N 3.3Å; E246-S249 PolarHBondContact O-N 2.93Å; E246-S249 PolarHBondContact O-OG 2.95Å; E246-L250 WeakPolarHBondContact O-CG 3.47Å; E246-L250 PolarHBondContact O-N 3.3Å
247	V	87.8	Confident	87.7	Confident	75 Å²	75	94.8 Å²	94.8	46%	0.455	48%	0.482	S	S	.	.	H	α-helix	trans	-61.4	-42.4	178.2	168.8	0	0	0	0	112	K243 T244 S249 L250 Q251	K243-V247 WeakPolarHBondContact O-CG2 3.43Å; K243-V247 PolarHBondContact O-N 3.07Å; T244-V247 PolarHBondContact O-N 2.65Å; V247-S249 PolarHBondContact O-N 3.31Å; V247-L250 PolarHBondContact O-N 3.42Å; V247-Q251 HydrophobicContact CG1-CG 4.43Å; V247-Q251 WeakPolarHBondContact O-CG 3.32Å; V247-Q251 PolarHBondContact O-N 3.35Å
248	F	88.2	Confident	87.4	Confident	122 Å²	122	95 Å²	95	54%	0.535	49%	0.485	S	S	.	.	H	α-helix	trans	-60.4	-43.1	174.2	-82.5	-63.7	0	0	0	112	T244 A245 E246 L250 Q251 D252	T244-F248 HydrophobicContact CG2-CD2 3.92Å; T244-F248 HydrophobicContact CG2-CE2 3.65Å; T244-F248 VanDerWaalsContact O-CD2 3.25Å; T244-F248 WeakPolarHBondContact O-CD2 3.42Å; T244-F248 PolarHBondContact O-N 2.78Å; A245-F248 PolarHBondContact O-N 3.06Å; E246-F248 PolarHBondContact O-N 3.3Å; F248-L250 VanDerWaalsContact C-N 3.29Å; F248-L250 PolarHBondContact O-N 2.97Å; F248-Q251 PolarHBondContact O-N 2.89Å; F248-D252 PolarHBondContact O-N 2.89Å
249	S	85.7	Confident	87.2	Confident	60 Å²	60	96.7 Å²	96.7	42%	0.42	49%	0.49	S	S	.	.	H	α-helix	trans	-63	-34.9	176.2	79	0	0	0	0	112.9	A245 E246 V247 N253	A245-S249 PolarHBondContact O-N 2.96Å; E246-S249 PolarHBondContact O-N 2.93Å; E246-S249 PolarHBondContact O-OG 2.95Å; V247-S249 PolarHBondContact O-N 3.31Å; S249-N253 VanDerWaalsContact O-CG 3.3Å; S249-N253 PolarHBondContact O-N 3.41Å; S249-N253 VanDerWaalsContact O-N 3.07Å; S249-N253 PolarHBondContact O-ND2 3.39Å
250	L	86.9	Confident	87	Confident	101 Å²	101	97.6 Å²	97.6	53%	0.529	49%	0.494	S	S	.	.	H	α-helix	trans	-71.3	-37.8	175.2	-69.9	172.2	0	0	0	112.1	E246 V247 F248 N253 I254	E246-L250 WeakPolarHBondContact O-CG 3.47Å; E246-L250 PolarHBondContact O-N 3.3Å; V247-L250 PolarHBondContact O-N 3.42Å; F248-L250 VanDerWaalsContact C-N 3.29Å; F248-L250 PolarHBondContact O-N 2.97Å; L250-N253 PolarHBondContact O-N 3.09Å; L250-I254 WeakPolarHBondContact O-CB 3.3Å; L250-I254 WeakPolarHBondContact O-CD1 3.31Å; L250-I254 VanDerWaalsContact O-CG1 3.24Å; L250-I254 WeakPolarHBondContact O-CG1 3.35Å; L250-I254 PolarHBondContact O-N 3.43Å
251	Q	86	Confident	86.6	Confident	103 Å²	103	96.9 Å²	96.9	48%	0.481	49%	0.49	S	S	.	.	H	α-helix	trans	-64.1	-41.1	174.1	-73.8	176.9	-9.1	0	0	112.1	V247 F248 I254 R255	V247-Q251 HydrophobicContact CG1-CG 4.43Å; V247-Q251 WeakPolarHBondContact O-CG 3.32Å; V247-Q251 PolarHBondContact O-N 3.35Å; F248-Q251 PolarHBondContact O-N 2.89Å; Q251-I254 PolarHBondContact O-N 2.78Å; Q251-R255 PolarHBondContact O-N 3.1Å
252	D	87	Confident	86.4	Confident	72 Å²	72	94.8 Å²	94.8	39%	0.385	49%	0.489	S	S	.	.	H	α-helix	trans	-62.4	-47.2	174.3	-77.9	-7	0	0	0	111.4	F248 I254 R255 D256	F248-D252 PolarHBondContact O-N 2.89Å; D252-I254 VanDerWaalsContact C-N 3.32Å; D252-I254 PolarHBondContact O-N 2.93Å; D252-R255 WeakPolarHBondContact O-CB 3.45Å; D252-R255 PolarHBondContact O-N 3.36Å; D252-R255 VanDerWaalsContact O-N 3.16Å; D252-R255 IonicContact OD1-CZ 3.69Å; D252-R255 IonicContact OD1-NH1 2.73Å; D252-R255 PolarHBondContact OD1-NH1 3.17Å; D252-R255 IonicContact OD1-NH2 3.67Å; D252-R255 PolarHBondContact OD1-NH2 2.76Å; D252-R255 IonicContact OD2-NH2 2.71Å; D252-D256 PolarHBondContact O-N 3.42Å
253	N	88.2	Confident	86	Confident	89 Å²	89	92 Å²	92	48%	0.476	48%	0.483	S	S	.	.	H	α-helix	trans	-59.3	-39.7	174.3	-74.1	-43.5	0	0	0	112.7	S249 L250 D256 L257	S249-N253 VanDerWaalsContact O-CG 3.3Å; S249-N253 PolarHBondContact O-N 3.41Å; S249-N253 VanDerWaalsContact O-N 3.07Å; S249-N253 PolarHBondContact O-ND2 3.39Å; L250-N253 PolarHBondContact O-N 3.09Å; N253-D256 PolarHBondContact O-N 2.87Å; N253-L257 WeakPolarHBondContact O-CB 3.46Å; N253-L257 VanDerWaalsContact O-CG 3.27Å; N253-L257 WeakPolarHBondContact O-CG 3.32Å; N253-L257 PolarHBondContact O-N 3.38Å
254	I	86	Confident	85.5	Confident	92 Å²	92	89.4 Å²	89.4	47%	0.472	48%	0.482	S	S	.	.	H	α-helix	trans	-64.9	-41.3	176.1	-72.6	164.2	0	0	0	110.9	L250 Q251 D252 L257 Q258	L250-I254 WeakPolarHBondContact O-CB 3.3Å; L250-I254 WeakPolarHBondContact O-CD1 3.31Å; L250-I254 VanDerWaalsContact O-CG1 3.24Å; L250-I254 WeakPolarHBondContact O-CG1 3.35Å; L250-I254 PolarHBondContact O-N 3.43Å; Q251-I254 PolarHBondContact O-N 2.78Å; D252-I254 VanDerWaalsContact C-N 3.32Å; D252-I254 PolarHBondContact O-N 2.93Å; I254-L257 PolarHBondContact O-N 2.82Å; I254-Q258 HydrophobicContact CG2-CG 4.48Å; I254-Q258 WeakPolarHBondContact O-CB 3.48Å; I254-Q258 VanDerWaalsContact O-CG 3.29Å; I254-Q258 WeakPolarHBondContact O-CG 3.47Å; I254-Q258 PolarHBondContact O-N 2.93Å
255	R	88.9	Confident	85.1	Confident	131 Å²	131	94.6 Å²	94.6	49%	0.494	50%	0.495	S	S	.	.	H	α-helix	trans	-63.5	-44.5	177.1	-177.7	-179.6	63.1	-121.5	-5.3	111.6	Q251 D252 Q258 Q259	Q251-R255 PolarHBondContact O-N 3.1Å; D252-R255 WeakPolarHBondContact O-CB 3.45Å; D252-R255 PolarHBondContact O-N 3.36Å; D252-R255 VanDerWaalsContact O-N 3.16Å; D252-R255 IonicContact OD1-CZ 3.69Å; D252-R255 IonicContact OD1-NH1 2.73Å; D252-R255 PolarHBondContact OD1-NH1 3.17Å; D252-R255 IonicContact OD1-NH2 3.67Å; D252-R255 PolarHBondContact OD1-NH2 2.76Å; D252-R255 IonicContact OD2-NH2 2.71Å; R255-Q258 WeakPolarHBondContact O-CB 3.19Å; R255-Q258 PolarHBondContact O-N 3.3Å; R255-Q259 PolarHBondContact O-N 3.38Å
256	D	85.1	Confident	84.7	Confident	77 Å²	77	97.6 Å²	97.6	41%	0.412	50%	0.497	S	S	.	.	H	α-helix	trans	-64.5	-42.5	177.4	-76.4	13.2	0	0	0	111.4	D252 N253 Q258 Q259 Q260	D252-D256 PolarHBondContact O-N 3.42Å; N253-D256 PolarHBondContact O-N 2.87Å; D256-Q258 PolarHBondContact O-N 3.07Å; D256-Q259 PolarHBondContact O-N 3.23Å; D256-Q260 WeakPolarHBondContact O-CG 3.33Å; D256-Q260 PolarHBondContact O-N 3.34Å
257	L	85.7	Confident	84.1	Confident	106 Å²	106	99.5 Å²	99.5	56%	0.555	51%	0.508	S	S	*	.	H	α-helix	trans	-62.1	-40.2	173	-74.5	170.6	0	0	0	112.2	N253 I254 Q259 Q260 L261	N253-L257 WeakPolarHBondContact O-CB 3.46Å; N253-L257 VanDerWaalsContact O-CG 3.27Å; N253-L257 WeakPolarHBondContact O-CG 3.32Å; N253-L257 PolarHBondContact O-N 3.38Å; I254-L257 PolarHBondContact O-N 2.82Å; L257-Q259 VanDerWaalsContact C-N 3.34Å; L257-Q259 PolarHBondContact O-N 3.39Å; L257-Q260 PolarHBondContact O-N 2.86Å; L257-L261 WeakPolarHBondContact O-CB 3.33Å; L257-L261 PolarHBondContact O-N 3.45Å
258	Q	85.7	Confident	83.6	Confident	132 Å²	132	97.7 Å²	97.7	62%	0.617	51%	0.505	S	S	*	.	H	α-helix	trans	-63.2	-38.8	174.1	-76.3	174	-7.2	0	0	112	I254 R255 D256 L261 G262	I254-Q258 HydrophobicContact CG2-CG 4.48Å; I254-Q258 WeakPolarHBondContact O-CB 3.48Å; I254-Q258 VanDerWaalsContact O-CG 3.29Å; I254-Q258 WeakPolarHBondContact O-CG 3.47Å; I254-Q258 PolarHBondContact O-N 2.93Å; R255-Q258 WeakPolarHBondContact O-CB 3.19Å; R255-Q258 PolarHBondContact O-N 3.3Å; D256-Q258 PolarHBondContact O-N 3.07Å; Q258-L261 PolarHBondContact O-N 2.93Å; Q258-G262 PolarHBondContact O-N 3.29Å
259	Q	83.4	Confident	82.8	Confident	143 Å²	143	97.4 Å²	97.4	67%	0.668	51%	0.505	S	S	*	.	H	α-helix	trans	-67.8	-39.9	176	-169.6	175.6	5.3	0	0	112.1	R255 D256 L257 G262 S263	R255-Q259 PolarHBondContact O-N 3.38Å; D256-Q259 PolarHBondContact O-N 3.23Å; L257-Q259 VanDerWaalsContact C-N 3.34Å; L257-Q259 PolarHBondContact O-N 3.39Å; Q259-G262 PolarHBondContact O-N 3.19Å; Q259-S263 PolarHBondContact O-N 3.47Å; Q259-S263 PolarHBondContact O-OG 2.81Å
260	Q	84.4	Confident	82	Confident	121 Å²	121	99.2 Å²	99.2	57%	0.565	51%	0.507	S	S	*	.	H	α-helix	trans	-63.7	-39.8	172	-70.1	176.4	21.1	0	0	112	D256 L257 S263 A264	D256-Q260 WeakPolarHBondContact O-CG 3.33Å; D256-Q260 PolarHBondContact O-N 3.34Å; L257-Q260 PolarHBondContact O-N 2.86Å; Q260-S263 PolarHBondContact O-N 3.47Å; Q260-S263 PolarHBondContact O-OG 3.32Å; Q260-A264 VanDerWaalsContact O-CB 3.26Å; Q260-A264 WeakPolarHBondContact O-CB 3.48Å; Q260-A264 PolarHBondContact O-N 2.83Å
261	L	80.5	Confident	80.9	Confident	97 Å²	97	97.2 Å²	97.2	51%	0.508	51%	0.505	S	S	.	.	H	α-helix	trans	-69.4	-36.1	177.9	-148.3	158.6	0	0	0	111.1	L257 Q258 R265	L257-L261 WeakPolarHBondContact O-CB 3.33Å; L257-L261 PolarHBondContact O-N 3.45Å; Q258-L261 PolarHBondContact O-N 2.93Å; L261-R265 HydrophobicContact CD2-CG 4.2Å; L261-R265 WeakPolarHBondContact O-CB 3.44Å; L261-R265 WeakPolarHBondContact O-CG 3.23Å; L261-R265 PolarHBondContact O-N 3.41Å
262	G	83.6	Confident	79.7	Confident	40 Å²	40	99.2 Å²	99.2	41%	0.412	51%	0.514	S	S	.	.	H	α-helix	trans	-64.8	-44.3	172.9	0	0	0	0	0	113.4	Q258 Q259 R265 K266	Q258-G262 PolarHBondContact O-N 3.29Å; Q259-G262 PolarHBondContact O-N 3.19Å; G262-R265 PolarHBondContact O-N 2.94Å; G262-K266 PolarHBondContact O-N 3.18Å; G262-K266 VanDerWaalsContact O-N 3.12Å
263	S	80.1	Confident	78.4	Confident	65 Å²	65	102.5 Å²	102.5	46%	0.455	53%	0.527	S	S	.	.	H	α-helix	trans	-69.6	-36.8	175.6	56.2	0	0	0	0	112.4	Q259 Q260 K266 I267	Q259-S263 PolarHBondContact O-N 3.47Å; Q259-S263 PolarHBondContact O-OG 2.81Å; Q260-S263 PolarHBondContact O-N 3.47Å; Q260-S263 PolarHBondContact O-OG 3.32Å; S263-K266 PolarHBondContact O-N 3.08Å; S263-I267 WeakPolarHBondContact O-CG1 3.38Å; S263-I267 PolarHBondContact O-N 2.82Å; S263-I267 VanDerWaalsContact O-N 3.07Å
264	A	77.7	Confident	76.9	Confident	58 Å²	58	108 Å²	108	48%	0.479	54%	0.541	S	S	.	.	H	α-helix	trans	-63.6	-41.3	172.6	0	0	0	0	0	112.7	Q260 I267 G268	Q260-A264 VanDerWaalsContact O-CB 3.26Å; Q260-A264 WeakPolarHBondContact O-CB 3.48Å; Q260-A264 PolarHBondContact O-N 2.83Å; A264-I267 PolarHBondContact O-N 3.31Å; A264-G268 PolarHBondContact O-N 3.46Å
265	R	81.4	Confident	75.6	Confident	169 Å²	169	108.5 Å²	108.5	64%	0.638	55%	0.545	S	S	*	.	H	α-helix	trans	-59.6	-45.4	173.1	-80.9	-178.4	-174.5	-163.8	2.1	111.9	L261 G262 I267 G268 E269	L261-R265 HydrophobicContact CD2-CG 4.2Å; L261-R265 WeakPolarHBondContact O-CB 3.44Å; L261-R265 WeakPolarHBondContact O-CG 3.23Å; L261-R265 PolarHBondContact O-N 3.41Å; G262-R265 PolarHBondContact O-N 2.94Å; R265-I267 VanDerWaalsContact C-N 3.33Å; R265-I267 PolarHBondContact O-N 2.95Å; R265-G268 CarbonylContact O-C 3.57Å; R265-G268 WeakPolarHBondContact O-CA 3.47Å; R265-G268 PolarHBondContact O-N 2.93Å; R265-E269 WeakPolarHBondContact O-CG 3.36Å; R265-E269 PolarHBondContact O-N 3.27Å
266	K	77.8	Confident	74	Confident	123 Å²	123	106.7 Å²	106.7	54%	0.535	55%	0.545	S	S	.	.	H	α-helix	trans	-61.5	-40.5	178.6	-163.9	-175.4	179.2	-160.9	0	112.4	G262 S263 G268 E269 E270	G262-K266 PolarHBondContact O-N 3.18Å; G262-K266 VanDerWaalsContact O-N 3.12Å; S263-K266 PolarHBondContact O-N 3.08Å; K266-G268 VanDerWaalsContact C-N 3.28Å; K266-G268 PolarHBondContact O-N 2.93Å; K266-E269 PolarHBondContact O-N 3.42Å; K266-E270 WeakPolarHBondContact CE-OE1 3.46Å; K266-E270 IonicContact NZ-OE1 3.97Å; K266-E270 WeakPolarHBondContact O-CB 3.15Å; K266-E270 VanDerWaalsContact O-CG 3.3Å; K266-E270 WeakPolarHBondContact O-CG 3.48Å; K266-E270 PolarHBondContact O-N 3.11Å
267	I	77.2	Confident	72.6	Confident	114 Å²	114	110.6 Å²	110.6	59%	0.585	56%	0.561	S	S	*	*	H	α-helix	trans	-63.8	-35.4	172.6	-67.1	164.2	0	0	0	111.1	S263 A264 R265 A271	S263-I267 WeakPolarHBondContact O-CG1 3.38Å; S263-I267 PolarHBondContact O-N 2.82Å; S263-I267 VanDerWaalsContact O-N 3.07Å; A264-I267 PolarHBondContact O-N 3.31Å; R265-I267 VanDerWaalsContact C-N 3.33Å; R265-I267 PolarHBondContact O-N 2.95Å; I267-A271 WeakPolarHBondContact O-CB 3.47Å; I267-A271 PolarHBondContact O-N 2.93Å
268	G	75.7	Confident	71.2	Confident	37 Å²	37	108.8 Å²	108.8	38%	0.381	56%	0.555	S	S	.	*	H	α-helix	trans	-62.6	-50.3	172.4	0	0	0	0	0	112.8	A264 R265 K266 E270 A271 E272	A264-G268 PolarHBondContact O-N 3.46Å; R265-G268 CarbonylContact O-C 3.57Å; R265-G268 WeakPolarHBondContact O-CA 3.47Å; R265-G268 PolarHBondContact O-N 2.93Å; K266-G268 VanDerWaalsContact C-N 3.28Å; K266-G268 PolarHBondContact O-N 2.93Å; G268-E270 PolarHBondContact O-N 3.11Å; G268-A271 CarbonylContact O-C 3.5Å; G268-A271 WeakPolarHBondContact O-CB 3.09Å; G268-A271 PolarHBondContact O-N 3.47Å; G268-A271 VanDerWaalsContact O-N 3.1Å; G268-E272 WeakPolarHBondContact O-CB 3.28Å; G268-E272 PolarHBondContact O-N 3.39Å
269	E	72.7	Confident	69.8	Low	115 Å²	115	107 Å²	107	54%	0.537	55%	0.547	S	S	.	.	H	α-helix	trans	-60.6	-42	176.5	-68.6	165.1	-169.9	0	0	111.7	R265 K266 A271 E272 Q273	R265-E269 WeakPolarHBondContact O-CG 3.36Å; R265-E269 PolarHBondContact O-N 3.27Å; K266-E269 PolarHBondContact O-N 3.42Å; E269-A271 VanDerWaalsContact C-N 3.3Å; E269-A271 PolarHBondContact O-N 3.45Å; E269-E272 PolarHBondContact O-N 2.89Å; E269-Q273 WeakPolarHBondContact O-CG 3.49Å; E269-Q273 PolarHBondContact O-N 3.06Å
270	E	68.1	Low	68.5	Low	99 Å²	99	102.7 Å²	102.7	46%	0.463	54%	0.536	S	S	.	.	H	α-helix	trans	-66.8	-27.4	174.5	-72.8	173.8	-167	0	0	112.8	K266 G268	K266-E270 WeakPolarHBondContact CE-OE1 3.46Å; K266-E270 IonicContact NZ-OE1 3.97Å; K266-E270 WeakPolarHBondContact O-CB 3.15Å; K266-E270 VanDerWaalsContact O-CG 3.3Å; K266-E270 WeakPolarHBondContact O-CG 3.48Å; K266-E270 PolarHBondContact O-N 3.11Å; G268-E270 PolarHBondContact O-N 3.11Å
271	A	64.6	Low	67.2	Low	58 Å²	58	102.9 Å²	102.9	48%	0.479	54%	0.538	S	S	.	.	H	α-helix	trans	-80.3	-34.9	173.1	0	0	0	0	0	112.4	I267 G268 E269 R274 N275	I267-A271 WeakPolarHBondContact O-CB 3.47Å; I267-A271 PolarHBondContact O-N 2.93Å; G268-A271 CarbonylContact O-C 3.5Å; G268-A271 WeakPolarHBondContact O-CB 3.09Å; G268-A271 PolarHBondContact O-N 3.47Å; G268-A271 VanDerWaalsContact O-N 3.1Å; E269-A271 VanDerWaalsContact C-N 3.3Å; E269-A271 PolarHBondContact O-N 3.45Å; A271-R274 WeakPolarHBondContact O-CB 3.31Å; A271-R274 PolarHBondContact O-N 2.96Å; A271-R274 VanDerWaalsContact O-N 3.15Å; A271-N275 PolarHBondContact O-N 3.22Å
272	E	60.2	Low	66.2	Low	146 Å²	146	102.6 Å²	102.6	68%	0.682	54%	0.54	S	S	*	.	H	α-helix	trans	-66.5	-41.5	176.7	-157.1	159.1	-141.4	0	0	110.6	G268 E269 R274 N275	G268-E272 WeakPolarHBondContact O-CB 3.28Å; G268-E272 PolarHBondContact O-N 3.39Å; E269-E272 PolarHBondContact O-N 2.89Å; E272-R274 PolarHBondContact O-N 3.39Å; E272-N275 WeakPolarHBondContact O-CA 3.48Å; E272-N275 VanDerWaalsContact O-CB 3.28Å; E272-N275 WeakPolarHBondContact O-CB 3.44Å; E272-N275 PolarHBondContact O-N 3.19Å
273	Q	58.9	Low	65	Low	141 Å²	141	108 Å²	108	66%	0.659	55%	0.548	S	S	*	.	H	α-helix	trans	-64	-20.4	170.9	-73.1	179.2	-4.2	0	0	114.4	E269	E269-Q273 WeakPolarHBondContact O-CG 3.49Å; E269-Q273 PolarHBondContact O-N 3.06Å
274	R	57.2	Low	63.9	Low	205 Å²	205	109 Å²	109	77%	0.774	55%	0.551	S	S	*	*	H	α-helix	trans	-82.6	-14	170.4	-78.5	-178.3	172.1	175	0.8	113.2	A271 E272 D276	A271-R274 WeakPolarHBondContact O-CB 3.31Å; A271-R274 PolarHBondContact O-N 2.96Å; A271-R274 VanDerWaalsContact O-N 3.15Å; E272-R274 PolarHBondContact O-N 3.39Å; R274-D276 VanDerWaalsContact C-N 3.33Å
275	N	58.7	Low	62.8	Low	101 Å²	101	110 Å²	110	54%	0.54	55%	0.548	S	S	.	.	H	α-helix	trans	-84	-11.3	176.2	-154.7	39	0	0	0	112.5	A271 E272 E277 P278 E279	A271-N275 PolarHBondContact O-N 3.22Å; E272-N275 WeakPolarHBondContact O-CA 3.48Å; E272-N275 VanDerWaalsContact O-CB 3.28Å; E272-N275 WeakPolarHBondContact O-CB 3.44Å; E272-N275 PolarHBondContact O-N 3.19Å; N275-E277 VanDerWaalsContact C-N 3.29Å; N275-E277 PolarHBondContact O-N 3.09Å; N275-P278 WeakPolarHBondContact O-CD 3.27Å; N275-E279 PolarHBondContact O-N 3.13Å
276	D	56.1	Low	61.7	Low	94 Å²	94	109.7 Å²	109.7	50%	0.503	55%	0.551	S	S	.	*	H	α-helix	trans	-63.7	-27.8	171.8	-76.9	-41.5	0	0	0	113	R274 E279 A280	R274-D276 VanDerWaalsContact C-N 3.33Å; D276-E279 PolarHBondContact O-N 3.46Å; D276-A280 WeakPolarHBondContact O-CB 3.27Å; D276-A280 PolarHBondContact O-N 2.93Å
277	E	55.5	Low	60.4	Low	159 Å²	159	112.7 Å²	112.7	74%	0.743	56%	0.56	S	S	*	*	H	α-helix	trans	-68.1	-50.8	177.9	-81.8	-171.8	157.3	0	0	112.5	N275 E279 A280 M281	N275-E277 VanDerWaalsContact C-N 3.29Å; N275-E277 PolarHBondContact O-N 3.09Å; E277-E279 VanDerWaalsContact C-N 3.31Å; E277-E279 PolarHBondContact O-N 3.18Å; E277-A280 PolarHBondContact O-N 3.38Å; E277-M281 WeakPolarHBondContact O-CB 3.31Å; E277-M281 PolarHBondContact O-N 3.31Å
278	P	56.2	Low	58.8	Low	68 Å²	68	111.2 Å²	111.2	44%	0.442	56%	0.557	S	S	.	*	H	α-helix	trans	-56.8	-40	167.7	-26.7	33.6	0	0	0	113.4	N275 M281 V282	N275-P278 WeakPolarHBondContact O-CD 3.27Å; P278-M281 CarbonylContact O-C 3.52Å; P278-M281 PolarHBondContact O-N 3.05Å; P278-V282 WeakPolarHBondContact O-CB 3.39Å; P278-V282 VanDerWaalsContact O-CG2 3.31Å; P278-V282 WeakPolarHBondContact O-CG2 3.24Å; P278-V282 PolarHBondContact O-N 2.84Å
279	E	55.3	Low	57.3	Low	94 Å²	94	116.7 Å²	116.7	44%	0.439	58%	0.575	S	S	.	*	H	α-helix	trans	-73	-35.9	-178.4	-127.7	-161.6	-135.1	0	0	113	N275 D276 E277 M281 V282 R283	N275-E279 PolarHBondContact O-N 3.13Å; D276-E279 PolarHBondContact O-N 3.46Å; E277-E279 VanDerWaalsContact C-N 3.31Å; E277-E279 PolarHBondContact O-N 3.18Å; E279-M281 VanDerWaalsContact C-N 3.35Å; E279-V282 PolarHBondContact O-N 3.25Å; E279-R283 WeakPolarHBondContact O-CB 3.45Å; E279-R283 VanDerWaalsContact O-CG 3.31Å; E279-R283 WeakPolarHBondContact O-CG 3.4Å; E279-R283 PolarHBondContact O-N 2.89Å; E279-R283 IonicContact OE2-CZ 3.91Å; E279-R283 IonicContact OE2-NE 3.87Å; E279-R283 IonicContact OE2-NH2 2.66Å; E279-R283 PolarHBondContact OE2-NH2 2.81Å
280	A	57.5	Low	56	Low	52 Å²	52	114.1 Å²	114.1	43%	0.43	57%	0.573	S	S	.	*	H	α-helix	trans	-66.7	-36.7	169.9	0	0	0	0	0	111.5	D276 E277 R283 T284	D276-A280 WeakPolarHBondContact O-CB 3.27Å; D276-A280 PolarHBondContact O-N 2.93Å; E277-A280 PolarHBondContact O-N 3.38Å; A280-R283 PolarHBondContact O-N 3.39Å; A280-T284 WeakPolarHBondContact O-CB 3.31Å; A280-T284 PolarHBondContact O-N 3.5Å; A280-T284 PolarHBondContact O-OG1 3.2Å
281	M	55.3	Low	54.7	Low	126 Å²	126	116.4 Å²	116.4	62%	0.621	58%	0.583	S	S	*	*	H	α-helix	trans	-69	-37.7	173.5	-165.1	174	-78.2	0	0	111.3	E277 P278 E279 T284 I285	E277-M281 WeakPolarHBondContact O-CB 3.31Å; E277-M281 PolarHBondContact O-N 3.31Å; P278-M281 CarbonylContact O-C 3.52Å; P278-M281 PolarHBondContact O-N 3.05Å; E279-M281 VanDerWaalsContact C-N 3.35Å; M281-T284 CarbonylContact O-C 3.6Å; M281-T284 WeakPolarHBondContact O-CB 3.39Å; M281-T284 PolarHBondContact O-N 2.91Å; M281-I285 HydrophobicContact CG-CD1 4.12Å; M281-I285 WeakPolarHBondContact O-CB 3.47Å; M281-I285 WeakPolarHBondContact O-CD1 3.23Å; M281-I285 WeakPolarHBondContact O-CG1 3.43Å; M281-I285 PolarHBondContact O-N 3.36Å
282	V	60.4	Low	53.7	Low	90 Å²	90	121.4 Å²	121.4	55%	0.545	60%	0.602	S	S	.	*	H	α-helix	trans	-68.9	-37	172.2	167.4	0	0	0	0	111.9	P278 E279 T284 I285 K286	P278-V282 WeakPolarHBondContact O-CB 3.39Å; P278-V282 VanDerWaalsContact O-CG2 3.31Å; P278-V282 WeakPolarHBondContact O-CG2 3.24Å; P278-V282 PolarHBondContact O-N 2.84Å; E279-V282 PolarHBondContact O-N 3.25Å; V282-T284 VanDerWaalsContact C-N 3.34Å; V282-I285 PolarHBondContact O-N 2.94Å; V282-K286 VanDerWaalsContact O-CB 3.23Å; V282-K286 WeakPolarHBondContact O-CB 3.38Å; V282-K286 PolarHBondContact O-N 3.42Å
283	R	58.6	Low	52.8	Low	155 Å²	155	122.1 Å²	122.1	59%	0.585	61%	0.61	S	S	*	*	H	α-helix	trans	-62.7	-42.2	169.3	-72.9	175.3	-162.5	-167.6	9.4	110.8	E279 A280 K286 Y287	E279-R283 WeakPolarHBondContact O-CB 3.45Å; E279-R283 VanDerWaalsContact O-CG 3.31Å; E279-R283 WeakPolarHBondContact O-CG 3.4Å; E279-R283 PolarHBondContact O-N 2.89Å; E279-R283 IonicContact OE2-CZ 3.91Å; E279-R283 IonicContact OE2-NE 3.87Å; E279-R283 IonicContact OE2-NH2 2.66Å; E279-R283 PolarHBondContact OE2-NH2 2.81Å; A280-R283 PolarHBondContact O-N 3.39Å; R283-K286 PolarHBondContact O-N 2.99Å; R283-Y287 WeakPolarHBondContact O-CD2 3.25Å; R283-Y287 PolarHBondContact O-N 2.85Å
284	T	57	Low	51.7	Low	85 Å²	85	118.3 Å²	118.3	52%	0.521	61%	0.608	S	S	.	*	H	α-helix	trans	-64.3	-41.4	175.8	-55.4	0	0	0	0	111.7	A280 M281 V282 Y287 T288	A280-T284 WeakPolarHBondContact O-CB 3.31Å; A280-T284 PolarHBondContact O-N 3.5Å; A280-T284 PolarHBondContact O-OG1 3.2Å; M281-T284 CarbonylContact O-C 3.6Å; M281-T284 WeakPolarHBondContact O-CB 3.39Å; M281-T284 PolarHBondContact O-N 2.91Å; V282-T284 VanDerWaalsContact C-N 3.34Å; T284-Y287 WeakPolarHBondContact O-CB 3.42Å; T284-Y287 PolarHBondContact O-N 2.94Å; T284-T288 PolarHBondContact O-N 2.85Å; T284-T288 PolarHBondContact O-OG1 2.79Å; T284-T288 VanDerWaalsContact O-OG1 3.1Å
285	I	55	Low	50.5	Low	78 Å²	78	116.1 Å²	116.1	40%	0.4	61%	0.609	S	S	.	*	H	α-helix	trans	-67.3	-37	174.5	-70.4	163.4	0	0	0	110.9	M281 V282 Y287 T288 M289	M281-I285 HydrophobicContact CG-CD1 4.12Å; M281-I285 WeakPolarHBondContact O-CB 3.47Å; M281-I285 WeakPolarHBondContact O-CD1 3.23Å; M281-I285 WeakPolarHBondContact O-CG1 3.43Å; M281-I285 PolarHBondContact O-N 3.36Å; V282-I285 PolarHBondContact O-N 2.94Å; I285-Y287 VanDerWaalsContact C-N 3.32Å; I285-Y287 PolarHBondContact O-N 2.78Å; I285-T288 WeakPolarHBondContact CA-OG1 3.28Å; I285-T288 PolarHBondContact O-N 3.04Å; I285-T288 PolarHBondContact O-OG1 3.22Å; I285-M289 HydrophobicContact CG2-CG 4.08Å; I285-M289 HydrophobicContact CG2-SD 3.6Å; I285-M289 VanDerWaalsContact CG2-SD 3.6Å; I285-M289 VanDerWaalsContact O-CB 3.29Å; I285-M289 WeakPolarHBondContact O-CB 3.23Å; I285-M289 VanDerWaalsContact O-CG 3.3Å; I285-M289 WeakPolarHBondContact O-CG 3.35Å; I285-M289 PolarHBondContact O-N 3.5Å
286	K	56.6	Low	49	Very low	163 Å²	163	118.9 Å²	118.9	71%	0.709	62%	0.619	S	S	*	*	H	α-helix	trans	-66.6	-33.4	173.1	-166.7	171.7	-174.8	176.7	0	112	V282 R283 A290	V282-K286 VanDerWaalsContact O-CB 3.23Å; V282-K286 WeakPolarHBondContact O-CB 3.38Å; V282-K286 PolarHBondContact O-N 3.42Å; R283-K286 PolarHBondContact O-N 2.99Å; K286-A290 WeakPolarHBondContact O-CB 3.45Å; K286-A290 PolarHBondContact O-N 3.21Å
287	Y	51	Low	47.5	Very low	186 Å²	186	118 Å²	118	73%	0.729	63%	0.625	S	S	*	*	H	α-helix	trans	-70.6	-36.9	170.8	-97.6	-81.4	0	0	0	112.8	R283 T284 I285 H291	R283-Y287 WeakPolarHBondContact O-CD2 3.25Å; R283-Y287 PolarHBondContact O-N 2.85Å; T284-Y287 WeakPolarHBondContact O-CB 3.42Å; T284-Y287 PolarHBondContact O-N 2.94Å; I285-Y287 VanDerWaalsContact C-N 3.32Å; I285-Y287 PolarHBondContact O-N 2.78Å; Y287-H291 PolarHBondContact O-CE1 3.39Å; Y287-H291 VanDerWaalsContact O-CE1 3.27Å; Y287-H291 PolarHBondContact O-ND1 3.41Å
288	T	44.6	Very low	46.3	Very low	84 Å²	84	119 Å²	119	52%	0.515	64%	0.635	S	S	.	*	H	α-helix	trans	-88.4	-19	-179.1	54.6	0	0	0	0	114.6	T284 I285 H291	T284-T288 PolarHBondContact O-N 2.85Å; T284-T288 PolarHBondContact O-OG1 2.79Å; T284-T288 VanDerWaalsContact O-OG1 3.1Å; I285-T288 WeakPolarHBondContact CA-OG1 3.28Å; I285-T288 PolarHBondContact O-N 3.04Å; I285-T288 PolarHBondContact O-OG1 3.22Å; T288-H291 WeakPolarHBondContact O-CB 3.46Å
289	M	43.7	Very low	44.9	Very low	152 Å²	152	121.4 Å²	121.4	75%	0.749	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-9.3	169.4	-66.9	-177.6	70.7	0	0	113.2	I285	I285-M289 HydrophobicContact CG2-CG 4.08Å; I285-M289 HydrophobicContact CG2-SD 3.6Å; I285-M289 VanDerWaalsContact CG2-SD 3.6Å; I285-M289 VanDerWaalsContact O-CB 3.29Å; I285-M289 WeakPolarHBondContact O-CB 3.23Å; I285-M289 VanDerWaalsContact O-CG 3.3Å; I285-M289 WeakPolarHBondContact O-CG 3.35Å; I285-M289 PolarHBondContact O-N 3.5Å
290	A	44.8	Very low	43.9	Very low	60 Å²	60	121.8 Å²	121.8	50%	0.496	65%	0.654	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.4	3.9	166.9	0	0	0	0	0	113.1	K286 D292 D293	K286-A290 WeakPolarHBondContact O-CB 3.45Å; K286-A290 PolarHBondContact O-N 3.21Å; A290-D292 PolarHBondContact O-N 2.9Å; A290-D293 PolarHBondContact O-N 2.85Å
291	H	41.9	Very low	42.7	Very low	148 Å²	148	127.7 Å²	127.7	69%	0.685	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	38.1	178	-79	51.7	0	0	0	113.7	Y287 T288	Y287-H291 PolarHBondContact O-CE1 3.39Å; Y287-H291 VanDerWaalsContact O-CE1 3.27Å; Y287-H291 PolarHBondContact O-ND1 3.41Å; T288-H291 WeakPolarHBondContact O-CB 3.46Å
292	D	43.4	Very low	41.7	Very low	162 Å²	162	129.2 Å²	129.2	87%	0.866	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	-14	159.8	-100.5	-21.6	0	0	0	111.9	A290 G294	A290-D292 PolarHBondContact O-N 2.9Å; D292-G294 PolarHBondContact O-N 2.93Å; D292-G294 VanDerWaalsContact O-N 3.16Å
293	D	41.5	Very low	40.2	Very low	162 Å²	162	130.5 Å²	130.5	87%	0.866	70%	0.696	S	S	*	*	S	Bend	trans	-88.2	44.1	172.9	-78.9	-35.9	0	0	0	112.3	A290	A290-D293 PolarHBondContact O-N 2.85Å
294	G	35.8	Very low	39.1	Very low	60 Å²	60	132.8 Å²	132.8	62%	0.619	71%	0.713	S	S	*	*			trans	-101.9	98.1	-177.3	0	0	0	0	0	113.7	D292	D292-G294 PolarHBondContact O-N 2.93Å; D292-G294 VanDerWaalsContact O-N 3.16Å
295	M	30.9	Very low	38.1	Very low	159 Å²	159	140 Å²	140	78%	0.783	73%	0.731	S	S	*	*			trans	160.1	122.5	133.7	-85.4	-93.5	175.2	0	0	112.6
296	Q	26.8	Very low	37.6	Very low	159 Å²	159	142 Å²	142	74%	0.743	75%	0.749	S	S	*	*			trans	67.5	146.7	155.3	-56.3	166.1	33.7	0	0	116.2	I299	Q296-I299 HydrophobicContact CB-CD1 4.22Å
297	A	25.2	Very low	37.1	Very low	77 Å²	77	138.6 Å²	138.6	64%	0.636	74%	0.737	S	S	*	*			cis	-167.2	-155.2	-17.4	0	0	0	0	0	105.9	I299	A297-I299 HydrophobicContact CB-CD1 4.35Å; A297-I299 HydrophobicContact CB-CG1 4.09Å; A297-I299 PolarHBondContact O-N 2.95Å
298	N	30.3	Very low	37.6	Very low	178 Å²	178	133 Å²	133	95%	0.952	73%	0.725	S	S	*	*			trans	-58.1	100.9	148.4	-72.2	-44	0	0	0	108.7
299	I	28.1	Very low	38.1	Very low	120 Å²	120	137.6 Å²	137.6	62%	0.615	73%	0.734	S	S	*	*			trans	-137.4	137.7	177	-59.4	-178.6	0	0	0	108.1	Q296 A297	Q296-I299 HydrophobicContact CB-CD1 4.22Å; A297-I299 HydrophobicContact CB-CD1 4.35Å; A297-I299 HydrophobicContact CB-CG1 4.09Å; A297-I299 PolarHBondContact O-N 2.95Å
300	P	33.2	Very low	39	Very low	102 Å²	102	132.5 Å²	132.5	66%	0.662	72%	0.716	S	S	*	*			trans	-108.2	166.4	-156.2	41.4	-35.8	0	0	0	115.4
301	Q	33.2	Very low	39.9	Very low	176 Å²	176	133 Å²	133	82%	0.822	71%	0.71	S	S	*	*			trans	70.1	139.4	159.4	-69.1	170.9	-38.3	0	0	119.8
302	N	34.1	Very low	40.9	Very low	158 Å²	158	129.9 Å²	129.9	85%	0.845	70%	0.697	S	S	*	*			trans	57.4	96	153.8	-67.6	3.8	0	0	0	121.3
303	S	29.3	Very low	42.2	Very low	116 Å²	116	127.3 Å²	127.3	81%	0.811	68%	0.68	S	S	*	*				-161.2	95.8	123.3	41.3	0	0	0	0	111.7	R305	S303-R305 PolarHBondContact O-N 3.03Å
304	E	34	Very low	43.6	Very low	203 Å²	203	126.2 Å²	126.2	95%	0.949	66%	0.664	S	S	*	*			trans	18.4	85	156.4	-64.3	172.6	-170.4	0	0	118.2
305	R	37.1	Very low	45.5	Very low	236 Å²	236	127.6 Å²	127.6	89%	0.891	65%	0.654	S	S	*	*			trans	-110.4	144.5	151.7	-99.2	-177.6	172.6	175.4	-1.1	109.7	S303 M307	S303-R305 PolarHBondContact O-N 3.03Å; R305-M307 PolarHBondContact O-N 2.99Å
306	P	43.8	Very low	47.4	Very low	122 Å²	122	123.7 Å²	123.7	79%	0.792	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-63.1	137.5	-173.9	-19.9	32.2	0	0	0	111.6	S308	P306-S308 PolarHBondContact O-N 3.19Å
307	M	45.9	Very low	49.7	Very low	91 Å²	91	122.3 Å²	122.3	45%	0.448	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-57.8	129.4	170.4	-157.2	177.6	-58	0	0	108.7	R305 D311 M312 H315	R305-M307 PolarHBondContact O-N 2.99Å; M307-D311 HydrophobicContact CG-CB 4.08Å; M307-M312 HydrophobicContact CB-CB 4.4Å; M307-M312 HydrophobicContact CB-CE 4.09Å; M307-M312 HydrophobicContact CB-CG 4.4Å; M307-M312 HydrophobicContact CG-CB 4.24Å; M307-M312 WeakPolarHBondContact O-CE 3.3Å; M307-M312 HydrophobicContact SD-CB 4.13Å; M307-M312 HydrophobicContact SD-CG 4.04Å; M307-H315 HydrophobicContact SD-CB 3.86Å
308	S	61.6	Low	52.1	Low	68 Å²	68	121.5 Å²	121.5	48%	0.476	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-59.8	144.7	176.5	179	0	0	0	0	109.9	P306 A310 D311 M312	P306-S308 PolarHBondContact O-N 3.19Å; S308-A310 VanDerWaalsContact C-N 3.26Å; S308-A310 PolarHBondContact O-N 3.18Å; S308-A310 VanDerWaalsContact O-N 3.17Å; S308-D311 WeakPolarHBondContact CB-OD2 3.49Å; S308-D311 CarbonylContact O-C 3.6Å; S308-D311 WeakPolarHBondContact O-CA 3.35Å; S308-D311 PolarHBondContact O-N 2.88Å; S308-M312 WeakPolarHBondContact O-CB 3.47Å; S308-M312 PolarHBondContact O-N 3.13Å
309	Y	55.5	Low	54.1	Low	180 Å²	180	117.4 Å²	117.4	71%	0.706	60%	0.602	S	S	*	*	H	α-helix	trans	-53.8	-42.5	-174.5	-154	-84.6	0	0	0	112.4	D311 M312 E313	Y309-D311 VanDerWaalsContact C-N 3.33Å; Y309-D311 PolarHBondContact O-N 3.02Å; Y309-M312 WeakPolarHBondContact O-CB 3.36Å; Y309-M312 PolarHBondContact O-N 3.45Å; Y309-E313 HydrophobicContact CD1-CG 4.35Å; Y309-E313 HydrophobicContact CE1-CG 4.36Å; Y309-E313 PolarHBondContact O-N 3.15Å
310	A	63.2	Low	56.5	Low	46 Å²	46	116.1 Å²	116.1	38%	0.38	60%	0.597	S	S	.	*	H	α-helix	trans	-72.7	-19.4	177.5	0	0	0	0	0	114.5	S308 R314	S308-A310 VanDerWaalsContact C-N 3.26Å; S308-A310 PolarHBondContact O-N 3.18Å; S308-A310 VanDerWaalsContact O-N 3.17Å; A310-R314 PolarHBondContact O-NE 3.4Å; A310-R314 PolarHBondContact O-NH2 2.73Å
311	D	63	Low	58.5	Low	69 Å²	69	115.5 Å²	115.5	37%	0.369	59%	0.591	S	S	.	*	H	α-helix	trans	-87.1	-30.2	170.6	-63.9	-42.3	0	0	0	110.9	M307 S308 Y309 R314 H315	M307-D311 HydrophobicContact CG-CB 4.08Å; S308-D311 WeakPolarHBondContact CB-OD2 3.49Å; S308-D311 CarbonylContact O-C 3.6Å; S308-D311 WeakPolarHBondContact O-CA 3.35Å; S308-D311 PolarHBondContact O-N 2.88Å; Y309-D311 VanDerWaalsContact C-N 3.33Å; Y309-D311 PolarHBondContact O-N 3.02Å; D311-R314 PolarHBondContact O-N 2.95Å; D311-R314 IonicContact OD1-CZ 3.65Å; D311-R314 IonicContact OD1-NH1 2.75Å; D311-R314 PolarHBondContact OD1-NH1 2.89Å; D311-R314 IonicContact OD1-NH2 3.74Å; D311-R314 PolarHBondContact OD1-NH2 2.9Å; D311-H315 WeakPolarHBondContact O-CB 3.47Å; D311-H315 PolarHBondContact O-N 3.19Å
312	M	63	Low	60.6	Low	83 Å²	83	111.3 Å²	111.3	41%	0.409	57%	0.574	S	S	.	*	H	α-helix	trans	-69.4	-41	174.8	-150.7	-175.1	-55.9	0	0	111.1	M307 S308 Y309 H315 C316	M307-M312 HydrophobicContact CB-CB 4.4Å; M307-M312 HydrophobicContact CB-CE 4.09Å; M307-M312 HydrophobicContact CB-CG 4.4Å; M307-M312 HydrophobicContact CG-CB 4.24Å; M307-M312 WeakPolarHBondContact O-CE 3.3Å; M307-M312 HydrophobicContact SD-CB 4.13Å; M307-M312 HydrophobicContact SD-CG 4.04Å; S308-M312 WeakPolarHBondContact O-CB 3.47Å; S308-M312 PolarHBondContact O-N 3.13Å; Y309-M312 WeakPolarHBondContact O-CB 3.36Å; Y309-M312 PolarHBondContact O-N 3.45Å; M312-H315 PolarHBondContact O-N 3.38Å; M312-C316 WeakPolarHBondContact O-CB 3.37Å; M312-C316 PolarHBondContact O-N 3.01Å; M312-C316 PolarHBondContact O-SG 2.83Å
313	E	69.7	Low	62.7	Low	108 Å²	108	109 Å²	109	51%	0.505	56%	0.561	S	S	.	*	H	α-helix	trans	-58.3	-52.5	169.1	-79.1	177	145.5	0	0	111.4	Y309 H315 C316 E317	Y309-E313 HydrophobicContact CD1-CG 4.35Å; Y309-E313 HydrophobicContact CE1-CG 4.36Å; Y309-E313 PolarHBondContact O-N 3.15Å; E313-H315 VanDerWaalsContact C-N 3.27Å; E313-H315 PolarHBondContact O-N 2.97Å; E313-C316 WeakPolarHBondContact O-CB 3.48Å; E313-C316 PolarHBondContact O-N 2.84Å; E313-C316 VanDerWaalsContact O-N 3.13Å; E313-E317 WeakPolarHBondContact O-CG 3.4Å; E313-E317 PolarHBondContact O-N 3.33Å
314	R	71.8	Confident	64.9	Low	139 Å²	139	109.2 Å²	109.2	53%	0.525	55%	0.549	S	S	.	.	H	α-helix	trans	-61	-33	177.5	-86.1	-178.4	-85.6	110.5	4.3	113.3	A310 D311 S318	A310-R314 PolarHBondContact O-NE 3.4Å; A310-R314 PolarHBondContact O-NH2 2.73Å; D311-R314 PolarHBondContact O-N 2.95Å; D311-R314 IonicContact OD1-CZ 3.65Å; D311-R314 IonicContact OD1-NH1 2.75Å; D311-R314 PolarHBondContact OD1-NH1 2.89Å; D311-R314 IonicContact OD1-NH2 3.74Å; D311-R314 PolarHBondContact OD1-NH2 2.9Å; R314-S318 WeakPolarHBondContact O-CB 3.34Å; R314-S318 PolarHBondContact O-N 3.35Å
315	H	74.8	Confident	66.9	Low	89 Å²	89	105.8 Å²	105.8	41%	0.412	53%	0.533	S	S	.	.	H	α-helix	trans	-73.4	-39.5	174.9	-166.7	40.5	0	0	0	112.1	M307 D311 M312 E313 S318 L319	M307-H315 HydrophobicContact SD-CB 3.86Å; D311-H315 WeakPolarHBondContact O-CB 3.47Å; D311-H315 PolarHBondContact O-N 3.19Å; M312-H315 PolarHBondContact O-N 3.38Å; E313-H315 VanDerWaalsContact C-N 3.27Å; E313-H315 PolarHBondContact O-N 2.97Å; H315-S318 PolarHBondContact O-N 2.93Å; H315-L319 WeakPolarHBondContact O-CB 3.47Å; H315-L319 WeakPolarHBondContact O-CG 3.25Å; H315-L319 PolarHBondContact O-N 3.38Å
316	C	71.3	Confident	68.8	Low	77 Å²	77	99.4 Å²	99.4	52%	0.52	51%	0.511	S	S	.	.	H	α-helix	trans	-62.1	-44.3	172.1	-75	0	0	0	0	111.9	M312 E313 S318 L319 N320	M312-C316 WeakPolarHBondContact O-CB 3.37Å; M312-C316 PolarHBondContact O-N 3.01Å; M312-C316 PolarHBondContact O-SG 2.83Å; E313-C316 WeakPolarHBondContact O-CB 3.48Å; E313-C316 PolarHBondContact O-N 2.84Å; E313-C316 VanDerWaalsContact O-N 3.13Å; C316-S318 PolarHBondContact O-N 3.49Å; C316-L319 PolarHBondContact O-N 3.5Å; C316-N320 VanDerWaalsContact O-CB 3.32Å; C316-N320 WeakPolarHBondContact O-CB 3.35Å; C316-N320 PolarHBondContact O-N 3.29Å
317	E	75.2	Confident	70.3	Confident	131 Å²	131	96.7 Å²	96.7	61%	0.612	49%	0.49	S	S	*	.	H	α-helix	trans	-61.3	-42.2	174.3	-70.7	178.3	150.2	0	0	112.1	E313 N320 T321	E313-E317 WeakPolarHBondContact O-CG 3.4Å; E313-E317 PolarHBondContact O-N 3.33Å; E317-N320 PolarHBondContact O-N 3.39Å; E317-T321 PolarHBondContact O-N 2.84Å; E317-T321 PolarHBondContact O-OG1 3.15Å
318	S	74.9	Confident	71.7	Confident	59 Å²	59	95 Å²	95	41%	0.413	49%	0.491	S	S	.	.	H	α-helix	trans	-67.4	-35	175.9	-178	0	0	0	0	113	R314 H315 C316 T321 L322	R314-S318 WeakPolarHBondContact O-CB 3.34Å; R314-S318 PolarHBondContact O-N 3.35Å; H315-S318 PolarHBondContact O-N 2.93Å; C316-S318 PolarHBondContact O-N 3.49Å; S318-T321 WeakPolarHBondContact CA-OG1 3.25Å; S318-T321 PolarHBondContact O-OG1 2.95Å; S318-L322 WeakPolarHBondContact O-CB 3.45Å; S318-L322 PolarHBondContact O-N 2.99Å
319	L	73.6	Confident	72.4	Confident	92 Å²	92	96.3 Å²	96.3	48%	0.482	49%	0.49	S	S	.	.	H	α-helix	trans	-73.4	-38.1	174.8	-76.9	169.6	0	0	0	111.2	H315 C316 T321 L322 L323	H315-L319 WeakPolarHBondContact O-CB 3.47Å; H315-L319 WeakPolarHBondContact O-CG 3.25Å; H315-L319 PolarHBondContact O-N 3.38Å; C316-L319 PolarHBondContact O-N 3.5Å; L319-T321 PolarHBondContact O-N 3Å; L319-L322 PolarHBondContact O-N 2.93Å; L319-L323 VanDerWaalsContact O-CB 3.23Å; L319-L323 WeakPolarHBondContact O-CB 3.46Å; L319-L323 PolarHBondContact O-N 2.93Å
320	N	77.7	Confident	73.2	Confident	94 Å²	94	91 Å²	91	50%	0.503	48%	0.476	S	S	.	.	H	α-helix	trans	-68.4	-35.3	-179.4	-148.1	23.5	0	0	0	111.9	C316 E317 H324	C316-N320 VanDerWaalsContact O-CB 3.32Å; C316-N320 WeakPolarHBondContact O-CB 3.35Å; C316-N320 PolarHBondContact O-N 3.29Å; E317-N320 PolarHBondContact O-N 3.39Å; N320-H324 WeakPolarHBondContact O-CB 3.36Å; N320-H324 PolarHBondContact O-CD2 2.91Å; N320-H324 PolarHBondContact O-N 3.17Å
321	T	75.9	Confident	73.8	Confident	88 Å²	88	94.7 Å²	94.7	54%	0.54	48%	0.483	S	S	.	.	H	α-helix	trans	-66.4	-45.6	171.6	38.6	0	0	0	0	112.3	E317 S318 L319 L323 H324 E325	E317-T321 PolarHBondContact O-N 2.84Å; E317-T321 PolarHBondContact O-OG1 3.15Å; S318-T321 WeakPolarHBondContact CA-OG1 3.25Å; S318-T321 PolarHBondContact O-OG1 2.95Å; L319-T321 PolarHBondContact O-N 3Å; T321-L323 VanDerWaalsContact C-N 3.32Å; T321-L323 PolarHBondContact O-N 3.2Å; T321-H324 PolarHBondContact O-N 3.41Å; T321-E325 PolarHBondContact O-N 3.17Å
322	L	77.5	Confident	74.4	Confident	88 Å²	88	98.2 Å²	98.2	46%	0.461	50%	0.497	S	S	.	.	H	α-helix	trans	-66.6	-33.1	177.4	-133.3	147.8	0	0	0	112.6	S318 L319 E325 K326	S318-L322 WeakPolarHBondContact O-CB 3.45Å; S318-L322 PolarHBondContact O-N 2.99Å; L319-L322 PolarHBondContact O-N 2.93Å; L322-E325 PolarHBondContact O-N 3.42Å; L322-K326 WeakPolarHBondContact O-CG 3.45Å; L322-K326 PolarHBondContact O-N 3.24Å
323	L	77	Confident	74.6	Confident	109 Å²	109	99.5 Å²	99.5	57%	0.571	51%	0.506	S	S	*	.	H	α-helix	trans	-71	-39.2	175.2	-158.6	151.1	0	0	0	110.6	L319 T321 K326 D327	L319-L323 VanDerWaalsContact O-CB 3.23Å; L319-L323 WeakPolarHBondContact O-CB 3.46Å; L319-L323 PolarHBondContact O-N 2.93Å; T321-L323 VanDerWaalsContact C-N 3.32Å; T321-L323 PolarHBondContact O-N 3.2Å; L323-K326 PolarHBondContact O-N 3.01Å; L323-D327 VanDerWaalsContact O-CB 3.27Å; L323-D327 WeakPolarHBondContact O-CB 3.48Å; L323-D327 PolarHBondContact O-N 3.24Å
324	H	76.2	Confident	74.6	Confident	121 Å²	121	99.6 Å²	99.6	56%	0.56	51%	0.506	S	S	*	.	H	α-helix	trans	-64.4	-36.4	170.4	-80.9	-42.9	0	0	0	113.7	N320 T321 D327 A328	N320-H324 WeakPolarHBondContact O-CB 3.36Å; N320-H324 PolarHBondContact O-CD2 2.91Å; N320-H324 PolarHBondContact O-N 3.17Å; T321-H324 PolarHBondContact O-N 3.41Å; H324-D327 PolarHBondContact O-N 3.39Å; H324-A328 WeakPolarHBondContact O-CB 3.43Å; H324-A328 PolarHBondContact O-N 3.3Å
325	E	75.2	Confident	74.4	Confident	132 Å²	132	98 Å²	98	62%	0.617	50%	0.504	S	S	*	.	H	α-helix	trans	-62.7	-43.8	171.6	-73.8	-176.4	157	0	0	111.7	T321 L322 A328 E329	T321-E325 PolarHBondContact O-N 3.17Å; L322-E325 PolarHBondContact O-N 3.42Å; E325-A328 WeakPolarHBondContact O-CB 3.35Å; E325-A328 PolarHBondContact O-N 3.16Å; E325-E329 PolarHBondContact O-N 2.98Å
326	K	77	Confident	74.2	Confident	101 Å²	101	96.9 Å²	96.9	44%	0.439	50%	0.504	S	S	.	.	H	α-helix	trans	-70.6	-33.2	177.5	-68.8	-65.5	167.7	-157.2	0	113.4	L322 L323 A328 E329 V330	L322-K326 WeakPolarHBondContact O-CG 3.45Å; L322-K326 PolarHBondContact O-N 3.24Å; L323-K326 PolarHBondContact O-N 3.01Å; K326-A328 VanDerWaalsContact C-N 3.26Å; K326-A328 PolarHBondContact O-N 3.27Å; K326-E329 VanDerWaalsContact CD-OE2 3.29Å; K326-E329 WeakPolarHBondContact CD-OE2 3.32Å; K326-E329 IonicContact NZ-OE1 3.62Å; K326-E329 PolarHBondContact NZ-OE1 2.91Å; K326-E329 IonicContact NZ-OE2 2.73Å; K326-E329 PolarHBondContact NZ-OE2 3.41Å; K326-E329 PolarHBondContact O-N 2.71Å; K326-V330 WeakPolarHBondContact O-CG2 3.35Å; K326-V330 PolarHBondContact O-N 3.28Å
327	D	76.5	Confident	73.9	Confident	66 Å²	66	96.9 Å²	96.9	35%	0.353	50%	0.501	S	S	.	.	H	α-helix	trans	-68.5	-27.9	173.5	-150.5	49	0	0	0	111.7	L323 H324 K331	L323-D327 VanDerWaalsContact O-CB 3.27Å; L323-D327 WeakPolarHBondContact O-CB 3.48Å; L323-D327 PolarHBondContact O-N 3.24Å; H324-D327 PolarHBondContact O-N 3.39Å; D327-K331 WeakPolarHBondContact O-CD 3.3Å; D327-K331 VanDerWaalsContact O-CG 3.27Å; D327-K331 WeakPolarHBondContact O-CG 3.31Å; D327-K331 PolarHBondContact O-N 2.89Å; D327-K331 IonicContact OD2-NZ 3.9Å; D327-K331 PolarHBondContact OD2-NZ 3.21Å
328	A	74.9	Confident	73.6	Confident	56 Å²	56	97.5 Å²	97.5	46%	0.463	50%	0.498	S	S	.	.	H	α-helix	trans	-72.1	-46.2	169.7	0	0	0	0	0	112.3	H324 E325 K326 V330 K331 E332	H324-A328 WeakPolarHBondContact O-CB 3.43Å; H324-A328 PolarHBondContact O-N 3.3Å; E325-A328 WeakPolarHBondContact O-CB 3.35Å; E325-A328 PolarHBondContact O-N 3.16Å; K326-A328 VanDerWaalsContact C-N 3.26Å; K326-A328 PolarHBondContact O-N 3.27Å; A328-V330 VanDerWaalsContact C-N 3.33Å; A328-V330 PolarHBondContact O-N 2.94Å; A328-K331 PolarHBondContact O-N 2.7Å; A328-E332 PolarHBondContact O-N 2.79Å
329	E	75.6	Confident	73.1	Confident	95 Å²	95	98.4 Å²	98.4	44%	0.444	50%	0.498	S	S	.	.	H	α-helix	trans	-56.3	-44.6	172.1	-82.8	-178.7	-167.4	0	0	111.8	E325 K326 K331 E332 L333	E325-E329 PolarHBondContact O-N 2.98Å; K326-E329 VanDerWaalsContact CD-OE2 3.29Å; K326-E329 WeakPolarHBondContact CD-OE2 3.32Å; K326-E329 IonicContact NZ-OE1 3.62Å; K326-E329 PolarHBondContact NZ-OE1 2.91Å; K326-E329 IonicContact NZ-OE2 2.73Å; K326-E329 PolarHBondContact NZ-OE2 3.41Å; K326-E329 PolarHBondContact O-N 2.71Å; E329-K331 VanDerWaalsContact C-N 3.32Å; E329-K331 PolarHBondContact O-N 3.5Å; E329-E332 PolarHBondContact O-N 2.82Å; E329-L333 WeakPolarHBondContact O-CB 3.4Å; E329-L333 WeakPolarHBondContact O-CG 3.47Å; E329-L333 PolarHBondContact O-N 2.88Å
330	V	73.6	Confident	72.3	Confident	69 Å²	69	99.2 Å²	99.2	42%	0.418	50%	0.502	S	S	.	.	H	α-helix	trans	-63.5	-37.1	178.2	169.7	0	0	0	0	111.5	K326 A328 L333 Q334	K326-V330 WeakPolarHBondContact O-CG2 3.35Å; K326-V330 PolarHBondContact O-N 3.28Å; A328-V330 VanDerWaalsContact C-N 3.33Å; A328-V330 PolarHBondContact O-N 2.94Å; V330-L333 PolarHBondContact O-N 3.45Å; V330-Q334 WeakPolarHBondContact O-CB 3.43Å; V330-Q334 VanDerWaalsContact O-CG 3.28Å; V330-Q334 WeakPolarHBondContact O-CG 3.39Å; V330-Q334 PolarHBondContact O-N 2.89Å
331	K	76.5	Confident	71.1	Confident	122 Å²	122	100.7 Å²	100.7	53%	0.53	51%	0.506	S	S	.	.	H	α-helix	trans	-68	-35.3	174.5	-76.1	163.2	-177	146.2	0	112.4	D327 A328 E329 Q334 H335	D327-K331 WeakPolarHBondContact O-CD 3.3Å; D327-K331 VanDerWaalsContact O-CG 3.27Å; D327-K331 WeakPolarHBondContact O-CG 3.31Å; D327-K331 PolarHBondContact O-N 2.89Å; D327-K331 IonicContact OD2-NZ 3.9Å; D327-K331 PolarHBondContact OD2-NZ 3.21Å; A328-K331 PolarHBondContact O-N 2.7Å; E329-K331 VanDerWaalsContact C-N 3.32Å; E329-K331 PolarHBondContact O-N 3.5Å; K331-Q334 PolarHBondContact O-N 2.98Å; K331-H335 PolarHBondContact O-N 3.25Å
332	E	74.2	Confident	70.1	Confident	143 Å²	143	103.2 Å²	103.2	67%	0.668	51%	0.511	S	S	*	.	H	α-helix	trans	-70.9	-40.4	174.9	-158.8	179.1	-139.1	0	0	111.9	A328 E329 H335 T336	A328-E332 PolarHBondContact O-N 2.79Å; E329-E332 PolarHBondContact O-N 2.82Å; E332-H335 PolarHBondContact O-N 3.35Å; E332-H335 VanDerWaalsContact O-N 3.16Å; E332-T336 PolarHBondContact O-N 2.95Å; E332-T336 PolarHBondContact O-OG1 3.49Å; E332-T336 VanDerWaalsContact O-OG1 3.07Å
333	L	67.9	Low	68.9	Low	111 Å²	111	105.9 Å²	105.9	58%	0.581	52%	0.521	S	S	*	.	H	α-helix	trans	-63.4	-39	171.1	-71.8	171.1	0	0	0	112.1	E329 V330 H335 T336 V337	E329-L333 WeakPolarHBondContact O-CB 3.4Å; E329-L333 WeakPolarHBondContact O-CG 3.47Å; E329-L333 PolarHBondContact O-N 2.88Å; V330-L333 PolarHBondContact O-N 3.45Å; L333-H335 VanDerWaalsContact C-N 3.33Å; L333-H335 PolarHBondContact O-N 3.48Å; L333-T336 WeakPolarHBondContact CA-OG1 3.45Å; L333-T336 PolarHBondContact O-N 2.93Å; L333-T336 PolarHBondContact O-OG1 3.46Å; L333-V337 WeakPolarHBondContact O-CB 3.49Å; L333-V337 VanDerWaalsContact O-CG2 3.31Å; L333-V337 WeakPolarHBondContact O-CG2 3.35Å; L333-V337 PolarHBondContact O-N 3.48Å
334	Q	68.7	Low	67.3	Low	109 Å²	109	108.4 Å²	108.4	51%	0.509	53%	0.533	S	S	.	.	H	α-helix	trans	-66.7	-32.6	172.3	-76.9	178.9	2.5	0	0	112.7	V330 K331 R338	V330-Q334 WeakPolarHBondContact O-CB 3.43Å; V330-Q334 VanDerWaalsContact O-CG 3.28Å; V330-Q334 WeakPolarHBondContact O-CG 3.39Å; V330-Q334 PolarHBondContact O-N 2.89Å; K331-Q334 PolarHBondContact O-N 2.98Å; Q334-R338 VanDerWaalsContact O-CB 3.32Å; Q334-R338 WeakPolarHBondContact O-CB 3.36Å; Q334-R338 PolarHBondContact O-N 3.12Å; Q334-R338 VanDerWaalsContact O-N 3.1Å
335	H	69	Low	65.7	Low	106 Å²	106	108.2 Å²	108.2	49%	0.491	54%	0.543	S	S	.	.	H	α-helix	trans	-70.2	-43	175.2	-171.3	1.6	0	0	0	111.9	K331 E332 L333 R338 L339	K331-H335 PolarHBondContact O-N 3.25Å; E332-H335 PolarHBondContact O-N 3.35Å; E332-H335 VanDerWaalsContact O-N 3.16Å; L333-H335 VanDerWaalsContact C-N 3.33Å; L333-H335 PolarHBondContact O-N 3.48Å; H335-R338 PolarHBondContact O-N 3.17Å; H335-L339 PolarHBondContact O-N 3.5Å
336	T	70.5	Confident	64.2	Low	66 Å²	66	106.3 Å²	106.3	41%	0.405	55%	0.545	S	S	.	.	H	α-helix	trans	-68.3	-39.7	178.2	47.3	0	0	0	0	112.3	E332 L333 R338 L339 L340	E332-T336 PolarHBondContact O-N 2.95Å; E332-T336 PolarHBondContact O-OG1 3.49Å; E332-T336 VanDerWaalsContact O-OG1 3.07Å; L333-T336 WeakPolarHBondContact CA-OG1 3.45Å; L333-T336 PolarHBondContact O-N 2.93Å; L333-T336 PolarHBondContact O-OG1 3.46Å; T336-R338 VanDerWaalsContact C-N 3.3Å; T336-R338 PolarHBondContact O-N 3.34Å; T336-L339 PolarHBondContact O-N 2.88Å; T336-L340 WeakPolarHBondContact O-CG 3.32Å; T336-L340 PolarHBondContact O-N 3.36Å
337	V	64.8	Low	62.2	Low	77 Å²	77	109 Å²	109	47%	0.467	56%	0.564	S	S	.	*	H	α-helix	trans	-60.9	-38.8	170.1	170	0	0	0	0	111.6	L333 L340 Q341	L333-V337 WeakPolarHBondContact O-CB 3.49Å; L333-V337 VanDerWaalsContact O-CG2 3.31Å; L333-V337 WeakPolarHBondContact O-CG2 3.35Å; L333-V337 PolarHBondContact O-N 3.48Å; V337-L340 PolarHBondContact O-N 3Å; V337-Q341 WeakPolarHBondContact O-CB 3.34Å; V337-Q341 WeakPolarHBondContact O-CG 3.45Å; V337-Q341 PolarHBondContact O-N 3.25Å
338	R	67.6	Low	60.2	Low	143 Å²	143	114 Å²	114	54%	0.54	59%	0.585	S	S	.	*	H	α-helix	trans	-68.4	-32.6	177	-166.6	-178.9	-59.9	142.7	5.8	113	Q334 H335 T336 Q341 Q342	Q334-R338 VanDerWaalsContact O-CB 3.32Å; Q334-R338 WeakPolarHBondContact O-CB 3.36Å; Q334-R338 PolarHBondContact O-N 3.12Å; Q334-R338 VanDerWaalsContact O-N 3.1Å; H335-R338 PolarHBondContact O-N 3.17Å; T336-R338 VanDerWaalsContact C-N 3.3Å; T336-R338 PolarHBondContact O-N 3.34Å; R338-Q341 PolarHBondContact O-N 3.43Å; R338-Q342 PolarHBondContact O-N 3.5Å; R338-Q342 VanDerWaalsContact O-N 3.07Å
339	L	65.7	Low	58.7	Low	79 Å²	79	116.3 Å²	116.3	41%	0.414	60%	0.595	S	S	.	*	H	α-helix	trans	-68	-45.6	172.3	-80.5	162	0	0	0	111.2	H335 T336 Q341 Q342 E343	H335-L339 PolarHBondContact O-N 3.5Å; T336-L339 PolarHBondContact O-N 2.88Å; L339-Q341 VanDerWaalsContact C-N 3.26Å; L339-Q341 PolarHBondContact O-N 2.93Å; L339-Q342 WeakPolarHBondContact O-CA 3.32Å; L339-Q342 WeakPolarHBondContact O-CB 3.43Å; L339-Q342 PolarHBondContact O-N 3.16Å; L339-E343 PolarHBondContact O-N 2.88Å
340	L	56	Low	57.2	Low	108 Å²	108	118.3 Å²	118.3	57%	0.565	61%	0.605	S	S	*	*	H	α-helix	trans	-61.5	-33.6	173.4	-69.5	168.6	0	0	0	112.3	T336 V337 Q342 E343 M344	T336-L340 WeakPolarHBondContact O-CG 3.32Å; T336-L340 PolarHBondContact O-N 3.36Å; V337-L340 PolarHBondContact O-N 3Å; L340-Q342 VanDerWaalsContact C-N 3.33Å; L340-E343 PolarHBondContact O-N 3.05Å; L340-M344 WeakPolarHBondContact O-CG 3.28Å; L340-M344 PolarHBondContact O-N 3.2Å
341	Q	53	Low	56.1	Low	125 Å²	125	119 Å²	119	58%	0.584	61%	0.612	S	S	*	*	H	α-helix	trans	-70.8	-23.8	171.3	-75.2	175.4	-22.7	0	0	113.6	V337 R338 L339	V337-Q341 WeakPolarHBondContact O-CB 3.34Å; V337-Q341 WeakPolarHBondContact O-CG 3.45Å; V337-Q341 PolarHBondContact O-N 3.25Å; R338-Q341 PolarHBondContact O-N 3.43Å; L339-Q341 VanDerWaalsContact C-N 3.26Å; L339-Q341 PolarHBondContact O-N 2.93Å
342	Q	54.4	Low	54.7	Low	141 Å²	141	119.6 Å²	119.6	66%	0.659	62%	0.621	S	S	*	*	H	α-helix	trans	-81.3	-30.5	172.3	-84.6	-176.4	-42.4	0	0	112.8	R338 L339 L340 M344	R338-Q342 PolarHBondContact O-N 3.5Å; R338-Q342 VanDerWaalsContact O-N 3.07Å; L339-Q342 WeakPolarHBondContact O-CA 3.32Å; L339-Q342 WeakPolarHBondContact O-CB 3.43Å; L339-Q342 PolarHBondContact O-N 3.16Å; L340-Q342 VanDerWaalsContact C-N 3.33Å; Q342-M344 VanDerWaalsContact C-N 3.28Å; Q342-M344 PolarHBondContact O-N 2.94Å
343	E	52	Low	53.7	Low	144 Å²	144	115.8 Å²	115.8	67%	0.673	61%	0.61	S	S	*	*	H	α-helix	trans	-72.9	-18	174.8	-68.9	-176.5	157.3	0	0	113.3	L339 L340 C345	L339-E343 PolarHBondContact O-N 2.88Å; L340-E343 PolarHBondContact O-N 3.05Å; E343-C345 PolarHBondContact O-N 3.4Å
344	M	44.6	Very low	52.7	Low	163 Å²	163	116.1 Å²	116.1	80%	0.803	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-0.3	177.1	-73.4	-90.5	-67	0	0	114.9	L340 Q342	L340-M344 WeakPolarHBondContact O-CG 3.28Å; L340-M344 PolarHBondContact O-N 3.2Å; Q342-M344 VanDerWaalsContact C-N 3.28Å; Q342-M344 PolarHBondContact O-N 2.94Å
345	C	42.5	Very low	52	Low	116 Å²	116	116.5 Å²	116.5	78%	0.784	61%	0.612	S	S	*	*			trans	-107	34.1	-170.7	-73.9	0	0	0	0	114.6	E343	E343-C345 PolarHBondContact O-N 3.4Å
346	S	43.1	Very low	51.5	Low	93 Å²	93	118.2 Å²	118.2	65%	0.65	62%	0.62	S	S	*	*			trans	-132.2	110	177.2	62	0	0	0	0	114.2
347	D	34.9	Very low	51.1	Low	157 Å²	157	123.1 Å²	123.1	84%	0.84	63%	0.631	S	S	*	*			trans	30.5	149	152.1	-64.8	-33.7	0	0	0	124.1
348	H	34.1	Very low	50.9	Low	171 Å²	171	122 Å²	122	79%	0.792	63%	0.627	S	S	*	*			trans	91.1	151.3	156.8	-92.3	48	0	0	0	118.9
349	P	44.3	Very low	50.8	Low	105 Å²	105	118.4 Å²	118.4	68%	0.682	62%	0.624	S	S	*	*				-128.6	116.5	-115.2	36	-18.3	0	0	0	116.2
350	E	44.5	Very low	51	Low	137 Å²	137	119.9 Å²	119.9	64%	0.64	63%	0.629	S	S	*	*			trans	-131.8	55.3	162.3	-68.2	-162.6	161.7	0	0	110.6	D352 S353 M354	E350-D352 PolarHBondContact O-N 2.87Å; E350-S353 PolarHBondContact O-OG 2.83Å; E350-M354 PolarHBondContact O-N 3.26Å; E350-M354 VanDerWaalsContact O-N 3.15Å
351	S	50.4	Low	51.7	Low	82 Å²	82	119.5 Å²	119.5	57%	0.573	63%	0.627	S	S	*	*	H	α-helix	trans	-56.8	-42.6	-163.5	-157.6	0	0	0	0	114.5	Q355	S351-Q355 WeakPolarHBondContact O-CB 3.37Å; S351-Q355 PolarHBondContact O-N 2.84Å
352	D	47.1	Very low	52.6	Low	135 Å²	135	119.5 Å²	119.5	72%	0.722	63%	0.626	S	S	*	*	H	α-helix	trans	-81.4	-33	-171.7	-65.3	-31	0	0	0	113.6	E350 Q355 Q356	E350-D352 PolarHBondContact O-N 2.87Å; D352-Q355 PolarHBondContact O-N 3.4Å; D352-Q356 PolarHBondContact O-N 3.49Å
353	S	51.9	Low	53.5	Low	63 Å²	63	115.8 Å²	115.8	44%	0.441	62%	0.62	S	S	.	*	H	α-helix	trans	-71.9	-36.6	173.9	64.1	0	0	0	0	110.9	E350 Q356 R357	E350-S353 PolarHBondContact O-OG 2.83Å; S353-Q356 PolarHBondContact O-N 2.88Å; S353-R357 PolarHBondContact O-N 3.02Å; S353-R357 VanDerWaalsContact O-N 3.09Å
354	M	48.7	Very low	54.5	Low	118 Å²	118	114.8 Å²	114.8	58%	0.581	62%	0.616	S	S	*	*	H	α-helix	trans	-73.4	-28.3	172.3	-69.2	-144.3	-86.9	0	0	112.9	E350 Q356 R357 S358	E350-M354 PolarHBondContact O-N 3.26Å; E350-M354 VanDerWaalsContact O-N 3.15Å; M354-Q356 VanDerWaalsContact C-N 3.34Å; M354-R357 CarbonylContact O-C 3.54Å; M354-R357 PolarHBondContact O-N 2.96Å; M354-S358 VanDerWaalsContact O-CB 3.25Å; M354-S358 WeakPolarHBondContact O-CB 3.3Å; M354-S358 PolarHBondContact O-N 2.84Å
355	Q	53.8	Low	55.8	Low	117 Å²	117	111.9 Å²	111.9	55%	0.547	60%	0.603	S	S	.	*	H	α-helix	trans	-62.8	-42.7	171.5	-149	110.4	-2.5	0	0	111.1	S351 D352 S358 S359	S351-Q355 WeakPolarHBondContact O-CB 3.37Å; S351-Q355 PolarHBondContact O-N 2.84Å; D352-Q355 PolarHBondContact O-N 3.4Å; Q355-S358 PolarHBondContact O-N 3.27Å; Q355-S359 PolarHBondContact O-N 3.37Å; Q355-S359 PolarHBondContact O-OG 3.47Å
356	Q	58.1	Low	57.4	Low	142 Å²	142	110.8 Å²	110.8	66%	0.664	59%	0.586	S	S	*	*	H	α-helix	trans	-67.4	-40.4	177.3	-148.3	173.2	4.2	0	0	111.6	D352 S353 M354 S358 S359 E360	D352-Q356 PolarHBondContact O-N 3.49Å; S353-Q356 PolarHBondContact O-N 2.88Å; M354-Q356 VanDerWaalsContact C-N 3.34Å; Q356-S358 VanDerWaalsContact C-N 3.35Å; Q356-S359 PolarHBondContact O-N 2.92Å; Q356-E360 PolarHBondContact O-N 3.47Å
357	R	62.3	Low	59	Low	169 Å²	169	110 Å²	110	64%	0.638	58%	0.581	S	S	*	*	H	α-helix	trans	-65.3	-34.7	172.3	-154.1	80.7	171.2	-132	-0.3	112.6	S353 M354 E360 L361	S353-R357 PolarHBondContact O-N 3.02Å; S353-R357 VanDerWaalsContact O-N 3.09Å; M354-R357 CarbonylContact O-C 3.54Å; M354-R357 PolarHBondContact O-N 2.96Å; R357-E360 PolarHBondContact O-N 2.89Å; R357-L361 WeakPolarHBondContact O-CB 3.36Å; R357-L361 WeakPolarHBondContact O-CG 3.48Å; R357-L361 PolarHBondContact O-N 3.33Å
358	S	59	Low	60.8	Low	53 Å²	53	104.8 Å²	104.8	37%	0.371	56%	0.559	S	S	.	*	H	α-helix	trans	-69.3	-39.5	175.2	-162.9	0	0	0	0	110.6	M354 Q355 Q356 L361 E362	M354-S358 VanDerWaalsContact O-CB 3.25Å; M354-S358 WeakPolarHBondContact O-CB 3.3Å; M354-S358 PolarHBondContact O-N 2.84Å; Q355-S358 PolarHBondContact O-N 3.27Å; Q356-S358 VanDerWaalsContact C-N 3.35Å; S358-L361 PolarHBondContact O-N 3.07Å; S358-E362 VanDerWaalsContact O-CB 3.26Å; S358-E362 WeakPolarHBondContact O-CB 3.38Å; S358-E362 VanDerWaalsContact O-CG 3.27Å; S358-E362 WeakPolarHBondContact O-CG 3.35Å; S358-E362 PolarHBondContact O-N 3.42Å; S358-E362 PolarHBondContact OG-OE1 2.89Å
359	S	67.5	Low	62.8	Low	68 Å²	68	101.8 Å²	101.8	48%	0.476	54%	0.544	S	S	.	.	H	α-helix	trans	-64.9	-37	171.7	-58.9	0	0	0	0	112.6	Q355 Q356 A363	Q355-S359 PolarHBondContact O-N 3.37Å; Q355-S359 PolarHBondContact O-OG 3.47Å; Q356-S359 PolarHBondContact O-N 2.92Å; S359-A363 VanDerWaalsContact O-CB 3.31Å; S359-A363 WeakPolarHBondContact O-CB 3.43Å; S359-A363 PolarHBondContact O-N 3.32Å
360	E	69.5	Low	64.3	Low	111 Å²	111	101.7 Å²	101.7	52%	0.519	54%	0.537	S	S	.	.	H	α-helix	trans	-68	-40.8	172.4	-74	-177.5	154.5	0	0	112.4	Q356 R357 A363 Q364	Q356-E360 PolarHBondContact O-N 3.47Å; R357-E360 PolarHBondContact O-N 2.89Å; E360-A363 PolarHBondContact O-N 2.82Å; E360-Q364 WeakPolarHBondContact O-CB 3.45Å; E360-Q364 WeakPolarHBondContact O-CG 3.38Å; E360-Q364 PolarHBondContact O-N 3.31Å
361	L	70.4	Confident	65.8	Low	100 Å²	100	99.1 Å²	99.1	52%	0.524	53%	0.525	S	S	.	.	H	α-helix	trans	-70.1	-37.4	176	-77.1	170.1	0	0	0	112.2	R357 S358 Q364 L365	R357-L361 WeakPolarHBondContact O-CB 3.36Å; R357-L361 WeakPolarHBondContact O-CG 3.48Å; R357-L361 PolarHBondContact O-N 3.33Å; S358-L361 PolarHBondContact O-N 3.07Å; L361-Q364 PolarHBondContact O-N 3.36Å; L361-L365 WeakPolarHBondContact O-CB 3.46Å; L361-L365 PolarHBondContact O-N 3.04Å
362	E	71.8	Confident	66.8	Low	124 Å²	124	100.3 Å²	100.3	58%	0.579	52%	0.524	S	S	*	.	H	α-helix	trans	-64	-41.3	171.3	-78.5	168.5	-159.8	0	0	110.8	S358 L365 E366	S358-E362 VanDerWaalsContact O-CB 3.26Å; S358-E362 WeakPolarHBondContact O-CB 3.38Å; S358-E362 VanDerWaalsContact O-CG 3.27Å; S358-E362 WeakPolarHBondContact O-CG 3.35Å; S358-E362 PolarHBondContact O-N 3.42Å; S358-E362 PolarHBondContact OG-OE1 2.89Å; E362-L365 PolarHBondContact O-N 2.79Å; E362-E366 VanDerWaalsContact O-CB 3.26Å; E362-E366 WeakPolarHBondContact O-CB 3.46Å; E362-E366 PolarHBondContact O-N 3.36Å
363	A	73.3	Confident	68.1	Low	64 Å²	64	95.8 Å²	95.8	53%	0.529	51%	0.51	S	S	.	.	H	α-helix	trans	-65	-38.3	173.2	0	0	0	0	0	112.5	S359 E360 S367	S359-A363 VanDerWaalsContact O-CB 3.31Å; S359-A363 WeakPolarHBondContact O-CB 3.43Å; S359-A363 PolarHBondContact O-N 3.32Å; E360-A363 PolarHBondContact O-N 2.82Å; A363-S367 VanDerWaalsContact O-CB 3.27Å; A363-S367 WeakPolarHBondContact O-CB 3.39Å; A363-S367 PolarHBondContact O-N 3.06Å
364	Q	73.8	Confident	69.3	Low	123 Å²	123	99 Å²	99	58%	0.575	51%	0.513	S	S	*	.	H	α-helix	trans	-69.9	-36.2	173.6	-74.1	176.5	21.6	0	0	112.5	E360 L361 S367 A368	E360-Q364 WeakPolarHBondContact O-CB 3.45Å; E360-Q364 WeakPolarHBondContact O-CG 3.38Å; E360-Q364 PolarHBondContact O-N 3.31Å; L361-Q364 PolarHBondContact O-N 3.36Å; Q364-S367 PolarHBondContact O-N 3.02Å; Q364-A368 VanDerWaalsContact O-CB 3.25Å; Q364-A368 WeakPolarHBondContact O-CB 3.4Å; Q364-A368 PolarHBondContact O-N 3.45Å
365	L	71	Confident	70.3	Confident	101 Å²	101	98.2 Å²	98.2	53%	0.529	51%	0.51	S	S	.	.	H	α-helix	trans	-74.5	-35.3	178.8	-162.2	155.9	0	0	0	110.8	L361 E362 A368 K369	L361-L365 WeakPolarHBondContact O-CB 3.46Å; L361-L365 PolarHBondContact O-N 3.04Å; E362-L365 PolarHBondContact O-N 2.79Å; L365-A368 PolarHBondContact O-N 3.47Å; L365-K369 HydrophobicContact CD2-CD 4.04Å; L365-K369 HydrophobicContact CD2-CG 4.23Å; L365-K369 WeakPolarHBondContact O-CB 3.16Å; L365-K369 WeakPolarHBondContact O-CG 3.38Å; L365-K369 PolarHBondContact O-N 2.86Å
366	E	76.6	Confident	71.1	Confident	93 Å²	93	95.6 Å²	95.6	44%	0.435	50%	0.502	S	S	.	.	H	α-helix	trans	-72	-36.1	170.5	-157.6	62.4	-158.8	0	0	111.2	E362 A368 K369 N370	E362-E366 VanDerWaalsContact O-CB 3.26Å; E362-E366 WeakPolarHBondContact O-CB 3.46Å; E362-E366 PolarHBondContact O-N 3.36Å; E366-A368 VanDerWaalsContact C-N 3.34Å; E366-K369 PolarHBondContact O-N 3.15Å; E366-K369 VanDerWaalsContact OE2-CD 3.25Å; E366-K369 WeakPolarHBondContact OE2-CD 3.17Å; E366-K369 IonicContact OE2-NZ 2.88Å; E366-K369 PolarHBondContact OE2-NZ 3.35Å; E366-N370 WeakPolarHBondContact O-CB 3.46Å; E366-N370 VanDerWaalsContact O-CG 3.29Å; E366-N370 PolarHBondContact O-N 2.78Å; E366-N370 PolarHBondContact O-ND2 2.95Å
367	S	76.5	Confident	71.5	Confident	77 Å²	77	91.2 Å²	91.2	54%	0.538	49%	0.49	S	S	.	.	H	α-helix	trans	-63	-39.7	168.4	-170.7	0	0	0	0	111.9	A363 Q364 N370 E371	A363-S367 VanDerWaalsContact O-CB 3.27Å; A363-S367 WeakPolarHBondContact O-CB 3.39Å; A363-S367 PolarHBondContact O-N 3.06Å; Q364-S367 PolarHBondContact O-N 3.02Å; S367-N370 PolarHBondContact O-N 3.08Å; S367-E371 WeakPolarHBondContact O-CB 3.5Å; S367-E371 PolarHBondContact O-N 2.86Å
368	A	71.4	Confident	71.7	Confident	47 Å²	47	87.4 Å²	87.4	39%	0.388	48%	0.483	S	S	.	.	H	α-helix	trans	-73	-34.9	178	0	0	0	0	0	112.2	Q364 L365 E366 E371 I372	Q364-A368 VanDerWaalsContact O-CB 3.25Å; Q364-A368 WeakPolarHBondContact O-CB 3.4Å; Q364-A368 PolarHBondContact O-N 3.45Å; L365-A368 PolarHBondContact O-N 3.47Å; E366-A368 VanDerWaalsContact C-N 3.34Å; A368-E371 PolarHBondContact O-N 3.08Å; A368-I372 WeakPolarHBondContact O-CB 3.39Å; A368-I372 WeakPolarHBondContact O-CG1 3.47Å; A368-I372 PolarHBondContact O-N 3.37Å
369	K	76.6	Confident	71.9	Confident	109 Å²	109	90.1 Å²	90.1	47%	0.474	49%	0.489	S	S	.	.	H	α-helix	trans	-65.3	-39.9	168.5	-80.2	170.2	-179.6	169.7	0	112	L365 E366 E371 G373	L365-K369 HydrophobicContact CD2-CD 4.04Å; L365-K369 HydrophobicContact CD2-CG 4.23Å; L365-K369 WeakPolarHBondContact O-CB 3.16Å; L365-K369 WeakPolarHBondContact O-CG 3.38Å; L365-K369 PolarHBondContact O-N 2.86Å; E366-K369 PolarHBondContact O-N 3.15Å; E366-K369 VanDerWaalsContact OE2-CD 3.25Å; E366-K369 WeakPolarHBondContact OE2-CD 3.17Å; E366-K369 IonicContact OE2-NZ 2.88Å; E366-K369 PolarHBondContact OE2-NZ 3.35Å; K369-E371 VanDerWaalsContact C-N 3.34Å; K369-G373 PolarHBondContact O-N 2.96Å
370	N	76.6	Confident	71.7	Confident	102 Å²	102	92.9 Å²	92.9	55%	0.545	49%	0.494	S	S	.	.	H	α-helix	trans	-66.6	-38.4	174.8	-77.4	-52.3	0	0	0	111	E366 S367 G373 R374	E366-N370 WeakPolarHBondContact O-CB 3.46Å; E366-N370 VanDerWaalsContact O-CG 3.29Å; E366-N370 PolarHBondContact O-N 2.78Å; E366-N370 PolarHBondContact O-ND2 2.95Å; S367-N370 PolarHBondContact O-N 3.08Å; N370-G373 PolarHBondContact O-N 3.41Å; N370-R374 VanDerWaalsContact O-CB 3.23Å; N370-R374 WeakPolarHBondContact O-CB 3.35Å; N370-R374 PolarHBondContact O-N 3.12Å
371	E	75.1	Confident	71.3	Confident	83 Å²	83	91.3 Å²	91.3	39%	0.388	50%	0.5	S	S	.	.	H	α-helix	trans	-71.4	-38.7	175.3	-167.2	66.2	-179.2	0	0	112.3	S367 A368 K369 R374 L375	S367-E371 WeakPolarHBondContact O-CB 3.5Å; S367-E371 PolarHBondContact O-N 2.86Å; A368-E371 PolarHBondContact O-N 3.08Å; K369-E371 VanDerWaalsContact C-N 3.34Å; E371-R374 PolarHBondContact O-N 3.37Å; E371-R374 IonicContact OE1-CZ 3.59Å; E371-R374 IonicContact OE1-NE 3.69Å; E371-R374 IonicContact OE1-NH2 2.69Å; E371-R374 PolarHBondContact OE1-NH2 3.2Å; E371-R374 IonicContact OE2-CZ 3.47Å; E371-R374 IonicContact OE2-NE 2.85Å; E371-R374 PolarHBondContact OE2-NE 3.48Å; E371-R374 IonicContact OE2-NH2 3.25Å; E371-R374 PolarHBondContact OE2-NH2 2.89Å; E371-L375 HydrophobicContact CG-CD1 4.44Å; E371-L375 WeakPolarHBondContact O-CB 3.3Å; E371-L375 VanDerWaalsContact O-CG 3.28Å; E371-L375 WeakPolarHBondContact O-CG 3.39Å; E371-L375 PolarHBondContact O-N 3.47Å
372	I	71.6	Confident	70.9	Confident	107 Å²	107	88.4 Å²	88.4	55%	0.549	49%	0.489	S	S	.	.	H	α-helix	trans	-63.1	-46.6	170	-72.9	166.2	0	0	0	109.8	A368 R374 L375 T376	A368-I372 WeakPolarHBondContact O-CB 3.39Å; A368-I372 WeakPolarHBondContact O-CG1 3.47Å; A368-I372 PolarHBondContact O-N 3.37Å; I372-R374 VanDerWaalsContact C-N 3.26Å; I372-R374 PolarHBondContact O-N 3.26Å; I372-L375 CarbonylContact O-C 3.59Å; I372-L375 PolarHBondContact O-N 3.44Å; I372-L375 VanDerWaalsContact O-N 3.14Å; I372-T376 WeakPolarHBondContact O-CB 3.48Å; I372-T376 PolarHBondContact O-N 2.84Å; I372-T376 PolarHBondContact O-OG1 3.41Å
373	G	75.6	Confident	70.6	Confident	41 Å²	41	91.3 Å²	91.3	42%	0.423	50%	0.499	S	S	.	.	H	α-helix	trans	-61.1	-35.1	176	0	0	0	0	0	112.4	K369 N370 A377	K369-G373 PolarHBondContact O-N 2.96Å; N370-G373 PolarHBondContact O-N 3.41Å; G373-A377 WeakPolarHBondContact O-CB 3.38Å; G373-A377 PolarHBondContact O-N 3.34Å
374	R	76.6	Confident	70.2	Confident	131 Å²	131	95.7 Å²	95.7	49%	0.494	51%	0.509	S	S	.	.	H	α-helix	trans	-70.3	-40.6	173.1	-163.1	172.7	76	90.5	1	111.9	N370 E371 I372 A377 D378	N370-R374 VanDerWaalsContact O-CB 3.23Å; N370-R374 WeakPolarHBondContact O-CB 3.35Å; N370-R374 PolarHBondContact O-N 3.12Å; E371-R374 PolarHBondContact O-N 3.37Å; E371-R374 IonicContact OE1-CZ 3.59Å; E371-R374 IonicContact OE1-NE 3.69Å; E371-R374 IonicContact OE1-NH2 2.69Å; E371-R374 PolarHBondContact OE1-NH2 3.2Å; E371-R374 IonicContact OE2-CZ 3.47Å; E371-R374 IonicContact OE2-NE 2.85Å; E371-R374 PolarHBondContact OE2-NE 3.48Å; E371-R374 IonicContact OE2-NH2 3.25Å; E371-R374 PolarHBondContact OE2-NH2 2.89Å; I372-R374 VanDerWaalsContact C-N 3.26Å; I372-R374 PolarHBondContact O-N 3.26Å; R374-A377 PolarHBondContact O-N 2.94Å; R374-D378 VanDerWaalsContact O-CB 3.32Å; R374-D378 WeakPolarHBondContact O-CB 3.46Å; R374-D378 VanDerWaalsContact O-CG 3.28Å; R374-D378 PolarHBondContact O-N 2.94Å
375	L	68.8	Low	69.9	Low	100 Å²	100	94.5 Å²	94.5	52%	0.524	50%	0.5	S	S	.	.	H	α-helix	trans	-71	-32.7	174.2	-72.7	170.4	0	0	0	112.8	E371 I372 H379	E371-L375 HydrophobicContact CG-CD1 4.44Å; E371-L375 WeakPolarHBondContact O-CB 3.3Å; E371-L375 VanDerWaalsContact O-CG 3.28Å; E371-L375 WeakPolarHBondContact O-CG 3.39Å; E371-L375 PolarHBondContact O-N 3.47Å; I372-L375 CarbonylContact O-C 3.59Å; I372-L375 PolarHBondContact O-N 3.44Å; I372-L375 VanDerWaalsContact O-N 3.14Å; L375-H379 VanDerWaalsContact O-CB 3.22Å; L375-H379 WeakPolarHBondContact O-CB 3.46Å; L375-H379 PolarHBondContact O-N 3.48Å
376	T	70.4	Confident	69.7	Low	63 Å²	63	94.1 Å²	94.1	39%	0.387	50%	0.498	S	S	.	.	H	α-helix	trans	-70.4	-42.6	172.1	-52.5	0	0	0	0	109.8	I372 H379 E380	I372-T376 WeakPolarHBondContact O-CB 3.48Å; I372-T376 PolarHBondContact O-N 2.84Å; I372-T376 PolarHBondContact O-OG1 3.41Å; T376-H379 WeakPolarHBondContact O-CB 3.42Å; T376-H379 PolarHBondContact O-N 2.88Å; T376-E380 WeakPolarHBondContact O-CB 3.45Å; T376-E380 WeakPolarHBondContact O-CG 3.33Å; T376-E380 PolarHBondContact O-N 2.92Å
377	A	66.4	Low	69.5	Low	50 Å²	50	91.3 Å²	91.3	41%	0.413	49%	0.491	S	S	.	.	H	α-helix	trans	-65.1	-37.7	172.3	0	0	0	0	0	112.7	G373 R374 H379 A381	G373-A377 WeakPolarHBondContact O-CB 3.38Å; G373-A377 PolarHBondContact O-N 3.34Å; R374-A377 PolarHBondContact O-N 2.94Å; A377-H379 VanDerWaalsContact C-N 3.34Å; A377-A381 WeakPolarHBondContact O-CB 3.44Å; A377-A381 PolarHBondContact O-N 3.35Å
378	D	66.9	Low	69.1	Low	89 Å²	89	89.8 Å²	89.8	48%	0.476	48%	0.483	S	S	.	.	H	α-helix	trans	-70.5	-29.7	173.8	-77.2	-19.4	0	0	0	111.5	R374 S382	R374-D378 VanDerWaalsContact O-CB 3.32Å; R374-D378 WeakPolarHBondContact O-CB 3.46Å; R374-D378 VanDerWaalsContact O-CG 3.28Å; R374-D378 PolarHBondContact O-N 2.94Å; D378-S382 WeakPolarHBondContact O-CB 3.33Å; D378-S382 PolarHBondContact O-N 3.21Å
379	H	63.6	Low	69.3	Low	109 Å²	109	90.4 Å²	90.4	51%	0.505	48%	0.482	S	S	.	.	H	α-helix	trans	-71.4	-47	172.2	-166.1	60.8	0	0	0	111.1	L375 T376 A377 A381 S382 Y385	L375-H379 VanDerWaalsContact O-CB 3.22Å; L375-H379 WeakPolarHBondContact O-CB 3.46Å; L375-H379 PolarHBondContact O-N 3.48Å; T376-H379 WeakPolarHBondContact O-CB 3.42Å; T376-H379 PolarHBondContact O-N 2.88Å; A377-H379 VanDerWaalsContact C-N 3.34Å; H379-A381 VanDerWaalsContact C-N 3.32Å; H379-A381 PolarHBondContact O-N 2.94Å; H379-S382 WeakPolarHBondContact O-CB 3.23Å; H379-S382 PolarHBondContact O-N 2.93Å; H379-Y385 AromaticContact CD2-CD2 3.59Å; H379-Y385 AromaticContact CD2-CE2 3.72Å; H379-Y385 AromaticContact CE1-CD2 3.81Å; H379-Y385 AromaticContact NE2-CD2 3.32Å; H379-Y385 VanDerWaalsContact NE2-CD2 3.32Å; H379-Y385 WeakPolarHBondContact NE2-CD2 3.46Å; H379-Y385 AromaticContact NE2-CE2 3.52Å; H379-Y385 WeakPolarHBondContact O-CB 3.33Å
380	E	63.2	Low	69.4	Low	126 Å²	126	91 Å²	91	59%	0.589	49%	0.485	S	S	*	.	H	α-helix	trans	-66.2	-30.2	174.7	-71.8	174.1	179.5	0	0	112.6	T376	T376-E380 WeakPolarHBondContact O-CB 3.45Å; T376-E380 WeakPolarHBondContact O-CG 3.33Å; T376-E380 PolarHBondContact O-N 2.92Å
381	A	60.5	Low	69.6	Low	78 Å²	78	94.2 Å²	94.2	65%	0.645	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-7.8	174.2	0	0	0	0	0	113.7	A377 H379 K383	A377-A381 WeakPolarHBondContact O-CB 3.44Å; A377-A381 PolarHBondContact O-N 3.35Å; H379-A381 VanDerWaalsContact C-N 3.32Å; H379-A381 PolarHBondContact O-N 2.94Å; A381-K383 PolarHBondContact O-N 2.9Å
382	S	63.6	Low	69.4	Low	40 Å²	40	94 Å²	94	28%	0.28	50%	0.496	S	S	.	.			trans	-73	124.6	177.1	-178.2	0	0	0	0	110.7	D378 H379 E384 Y385 D386	D378-S382 WeakPolarHBondContact O-CB 3.33Å; D378-S382 PolarHBondContact O-N 3.21Å; H379-S382 WeakPolarHBondContact O-CB 3.23Å; H379-S382 PolarHBondContact O-N 2.93Å; S382-E384 PolarHBondContact O-N 3.2Å; S382-E384 PolarHBondContact OG-N 2.91Å; S382-Y385 WeakPolarHBondContact O-CB 3.33Å; S382-Y385 PolarHBondContact O-N 3.42Å; S382-D386 PolarHBondContact O-N 3.21Å
383	K	64	Low	69.7	Low	185 Å²	185	93.8 Å²	93.8	80%	0.804	50%	0.496	S	S	*	.	H	α-helix	trans	-57.5	-21.6	173.5	-68.6	-179.2	178.3	176.9	0	113.2	A381 A387	A381-K383 PolarHBondContact O-N 2.9Å; K383-A387 VanDerWaalsContact O-CB 3.23Å; K383-A387 WeakPolarHBondContact O-CB 3.3Å; K383-A387 PolarHBondContact O-N 2.87Å; K383-A387 VanDerWaalsContact O-N 3.08Å
384	E	66.1	Low	69.8	Low	156 Å²	156	96.5 Å²	96.5	73%	0.729	50%	0.497	S	S	*	.	H	α-helix	trans	-77.2	-29.4	176.5	-64.2	-175.8	150	0	0	112.4	S382 A388	S382-E384 PolarHBondContact O-N 3.2Å; S382-E384 PolarHBondContact OG-N 2.91Å; E384-A388 VanDerWaalsContact O-CB 3.31Å; E384-A388 WeakPolarHBondContact O-CB 3.38Å; E384-A388 PolarHBondContact O-N 3.37Å
385	Y	67.1	Low	69.8	Low	98 Å²	98	96.1 Å²	96.1	38%	0.384	50%	0.503	S	S	.	.	H	α-helix	trans	-70.3	-49.9	173.3	-175.2	-97.9	0	0	0	110.7	H379 S382 A387 A388 V389	H379-Y385 AromaticContact CD2-CD2 3.59Å; H379-Y385 AromaticContact CD2-CE2 3.72Å; H379-Y385 AromaticContact CE1-CD2 3.81Å; H379-Y385 AromaticContact NE2-CD2 3.32Å; H379-Y385 VanDerWaalsContact NE2-CD2 3.32Å; H379-Y385 WeakPolarHBondContact NE2-CD2 3.46Å; H379-Y385 AromaticContact NE2-CE2 3.52Å; H379-Y385 WeakPolarHBondContact O-CB 3.33Å; S382-Y385 WeakPolarHBondContact O-CB 3.33Å; S382-Y385 PolarHBondContact O-N 3.42Å; Y385-A387 PolarHBondContact O-N 2.97Å; Y385-A388 WeakPolarHBondContact O-CB 3.36Å; Y385-A388 PolarHBondContact O-N 3.47Å; Y385-V389 HydrophobicContact CD1-CG2 4.17Å; Y385-V389 HydrophobicContact CE1-CG2 3.84Å; Y385-V389 WeakPolarHBondContact O-CG2 3.3Å; Y385-V389 PolarHBondContact O-N 3.23Å
386	D	67	Low	70.4	Confident	92 Å²	92	92.8 Å²	92.8	49%	0.492	49%	0.492	S	S	.	.	H	α-helix	trans	-55.5	-37.4	172.7	-116.7	12.1	0	0	0	112.2	S382 K390	S382-D386 PolarHBondContact O-N 3.21Å; D386-K390 WeakPolarHBondContact O-CB 3.32Å; D386-K390 VanDerWaalsContact O-CG 3.3Å; D386-K390 WeakPolarHBondContact O-CG 3.43Å; D386-K390 PolarHBondContact O-N 3.32Å; D386-K390 VanDerWaalsContact O-N 3.09Å
387	A	71.4	Confident	70.8	Confident	35 Å²	35	96 Å²	96	29%	0.289	50%	0.503	S	S	.	.	H	α-helix	trans	-73.4	-34.8	174.9	0	0	0	0	0	113	K383 Y385 R391	K383-A387 VanDerWaalsContact O-CB 3.23Å; K383-A387 WeakPolarHBondContact O-CB 3.3Å; K383-A387 PolarHBondContact O-N 2.87Å; K383-A387 VanDerWaalsContact O-N 3.08Å; Y385-A387 PolarHBondContact O-N 2.97Å; A387-R391 WeakPolarHBondContact O-CB 3.46Å; A387-R391 VanDerWaalsContact O-CG 3.26Å; A387-R391 WeakPolarHBondContact O-CG 3.39Å; A387-R391 PolarHBondContact O-N 3.39Å
388	A	69.3	Low	71.5	Confident	45 Å²	45	100.3 Å²	100.3	37%	0.372	51%	0.509	S	S	.	.	H	α-helix	trans	-68.7	-44.5	174.9	0	0	0	0	0	111.5	E384 Y385 R391 C392	E384-A388 VanDerWaalsContact O-CB 3.31Å; E384-A388 WeakPolarHBondContact O-CB 3.38Å; E384-A388 PolarHBondContact O-N 3.37Å; Y385-A388 WeakPolarHBondContact O-CB 3.36Å; Y385-A388 PolarHBondContact O-N 3.47Å; A388-R391 WeakPolarHBondContact O-CB 3.4Å; A388-R391 PolarHBondContact O-N 3.49Å; A388-C392 PolarHBondContact O-N 3.42Å; A388-C392 PolarHBondContact O-SG 2.97Å
389	V	76	Confident	72.1	Confident	59 Å²	59	101.5 Å²	101.5	36%	0.358	51%	0.511	S	S	.	.	H	α-helix	trans	-60.6	-46.6	174.6	175.4	0	0	0	0	110.5	Y385 R391 C392 D393	Y385-V389 HydrophobicContact CD1-CG2 4.17Å; Y385-V389 HydrophobicContact CE1-CG2 3.84Å; Y385-V389 WeakPolarHBondContact O-CG2 3.3Å; Y385-V389 PolarHBondContact O-N 3.23Å; V389-R391 VanDerWaalsContact C-N 3.33Å; V389-R391 PolarHBondContact O-N 3.06Å; V389-C392 CarbonylContact O-C 3.59Å; V389-C392 WeakPolarHBondContact O-CA 3.43Å; V389-C392 WeakPolarHBondContact O-CB 3.27Å; V389-C392 PolarHBondContact O-N 3.43Å; V389-D393 PolarHBondContact O-N 3.01Å
390	K	78.3	Confident	73	Confident	122 Å²	122	103.5 Å²	103.5	53%	0.53	52%	0.518	S	S	.	.	H	α-helix	trans	-59.6	-39.2	173.9	-77.2	172.2	-177	166.4	0	113.2	D386 C392 D393 E394	D386-K390 WeakPolarHBondContact O-CB 3.32Å; D386-K390 VanDerWaalsContact O-CG 3.3Å; D386-K390 WeakPolarHBondContact O-CG 3.43Å; D386-K390 PolarHBondContact O-N 3.32Å; D386-K390 VanDerWaalsContact O-N 3.09Å; K390-C392 VanDerWaalsContact C-N 3.35Å; K390-D393 PolarHBondContact O-N 3.06Å; K390-E394 WeakPolarHBondContact O-CB 3.42Å; K390-E394 VanDerWaalsContact O-CG 3.29Å; K390-E394 WeakPolarHBondContact O-CG 3.34Å; K390-E394 PolarHBondContact O-N 3.38Å
391	R	79.4	Confident	73.8	Confident	170 Å²	170	103.5 Å²	103.5	64%	0.642	52%	0.518	S	S	*	.	H	α-helix	trans	-65	-37.2	173.1	-74.6	171.7	-170	168.6	5.6	112.1	A387 A388 V389 M395	A387-R391 WeakPolarHBondContact O-CB 3.46Å; A387-R391 VanDerWaalsContact O-CG 3.26Å; A387-R391 WeakPolarHBondContact O-CG 3.39Å; A387-R391 PolarHBondContact O-N 3.39Å; A388-R391 WeakPolarHBondContact O-CB 3.4Å; A388-R391 PolarHBondContact O-N 3.49Å; V389-R391 VanDerWaalsContact C-N 3.33Å; V389-R391 PolarHBondContact O-N 3.06Å; R391-M395 WeakPolarHBondContact O-CB 3.28Å; R391-M395 VanDerWaalsContact O-CG 3.29Å; R391-M395 WeakPolarHBondContact O-CG 3.49Å; R391-M395 PolarHBondContact O-N 3.39Å
392	C	71.6	Confident	74.8	Confident	79 Å²	79	105.2 Å²	105.2	53%	0.534	52%	0.516	S	S	.	.	H	α-helix	trans	-66.4	-41.2	173.8	-72.6	0	0	0	0	111.9	A388 V389 K390 M395 G396	A388-C392 PolarHBondContact O-N 3.42Å; A388-C392 PolarHBondContact O-SG 2.97Å; V389-C392 CarbonylContact O-C 3.59Å; V389-C392 WeakPolarHBondContact O-CA 3.43Å; V389-C392 WeakPolarHBondContact O-CB 3.27Å; V389-C392 PolarHBondContact O-N 3.43Å; K390-C392 VanDerWaalsContact C-N 3.35Å; C392-M395 PolarHBondContact O-N 3.3Å; C392-G396 PolarHBondContact O-N 3.4Å
393	D	77.5	Confident	75.8	Confident	102 Å²	102	107.2 Å²	107.2	55%	0.545	52%	0.521	S	S	.	.	H	α-helix	trans	-65.2	-42.7	173.6	-73.9	-29	0	0	0	111.9	V389 K390 G396 Q397	V389-D393 PolarHBondContact O-N 3.01Å; K390-D393 PolarHBondContact O-N 3.06Å; D393-G396 PolarHBondContact O-N 3.15Å; D393-Q397 WeakPolarHBondContact O-CG 3.47Å; D393-Q397 PolarHBondContact O-N 3.38Å
394	E	78.4	Confident	76.8	Confident	97 Å²	97	100 Å²	100	45%	0.453	50%	0.496	S	S	.	.	H	α-helix	trans	-63	-38.9	173.3	-77.3	176.3	-156.4	0	0	112.1	K390 R398	K390-E394 WeakPolarHBondContact O-CB 3.42Å; K390-E394 VanDerWaalsContact O-CG 3.29Å; K390-E394 WeakPolarHBondContact O-CG 3.34Å; K390-E394 PolarHBondContact O-N 3.38Å; E394-R398 WeakPolarHBondContact O-CB 3.45Å; E394-R398 WeakPolarHBondContact O-CG 3.35Å; E394-R398 PolarHBondContact O-N 2.99Å; E394-R398 IonicContact OE2-NH1 2.8Å
395	M	76.6	Confident	77.6	Confident	124 Å²	124	94.5 Å²	94.5	61%	0.611	48%	0.477	S	S	*	.	H	α-helix	trans	-69.1	-37.5	172.9	-74.2	-152.9	-50.4	0	0	111.7	R391 C392 R398 Q399	R391-M395 WeakPolarHBondContact O-CB 3.28Å; R391-M395 VanDerWaalsContact O-CG 3.29Å; R391-M395 WeakPolarHBondContact O-CG 3.49Å; R391-M395 PolarHBondContact O-N 3.39Å; C392-M395 PolarHBondContact O-N 3.3Å; M395-R398 PolarHBondContact O-N 3.15Å; M395-Q399 WeakPolarHBondContact O-CB 3.31Å; M395-Q399 PolarHBondContact O-N 2.81Å
396	G	80.5	Confident	78.4	Confident	29 Å²	29	95.2 Å²	95.2	30%	0.299	49%	0.485	S	S	.	.	H	α-helix	trans	-67.3	-33.9	174.7	0	0	0	0	0	113.2	C392 D393 K400	C392-G396 PolarHBondContact O-N 3.4Å; D393-G396 PolarHBondContact O-N 3.15Å; G396-K400 WeakPolarHBondContact O-CG 3.38Å; G396-K400 PolarHBondContact O-N 2.88Å
397	Q	79.7	Confident	79.2	Confident	130 Å²	130	97 Å²	97	61%	0.607	49%	0.491	S	S	*	.	H	α-helix	trans	-69.6	-48.2	169.7	-72.9	-176.1	10	0	0	111.2	D393 Q399 K400 E401	D393-Q397 WeakPolarHBondContact O-CG 3.47Å; D393-Q397 PolarHBondContact O-N 3.38Å; Q397-Q399 VanDerWaalsContact C-N 3.27Å; Q397-Q399 PolarHBondContact O-N 2.9Å; Q397-K400 PolarHBondContact O-N 2.85Å; Q397-K400 VanDerWaalsContact O-N 3.13Å; Q397-E401 WeakPolarHBondContact O-CG 3.38Å; Q397-E401 PolarHBondContact O-N 3.17Å
398	R	81.7	Confident	79.8	Confident	142 Å²	142	103.4 Å²	103.4	54%	0.536	51%	0.507	S	S	.	.	H	α-helix	trans	-57.9	-37.5	174.3	-79.9	177.9	171.5	115.8	-0.8	112.8	E394 M395 E401 L402	E394-R398 WeakPolarHBondContact O-CB 3.45Å; E394-R398 WeakPolarHBondContact O-CG 3.35Å; E394-R398 PolarHBondContact O-N 2.99Å; E394-R398 IonicContact OE2-NH1 2.8Å; M395-R398 PolarHBondContact O-N 3.15Å; R398-E401 PolarHBondContact O-N 2.88Å; R398-L402 WeakPolarHBondContact O-CB 3.2Å; R398-L402 VanDerWaalsContact O-CG 3.24Å; R398-L402 WeakPolarHBondContact O-CG 3.44Å; R398-L402 PolarHBondContact O-N 2.88Å
399	Q	79.1	Confident	80.6	Confident	114 Å²	114	106.7 Å²	106.7	53%	0.533	51%	0.514	S	S	.	.	H	α-helix	trans	-63.3	-46.6	176	-175.3	-178.6	-26.6	0	0	110.5	M395 Q397 E401 L402 E403	M395-Q399 WeakPolarHBondContact O-CB 3.31Å; M395-Q399 PolarHBondContact O-N 2.81Å; Q397-Q399 VanDerWaalsContact C-N 3.27Å; Q397-Q399 PolarHBondContact O-N 2.9Å; Q399-E401 VanDerWaalsContact C-N 3.34Å; Q399-E401 PolarHBondContact O-N 3.04Å; Q399-L402 PolarHBondContact O-N 3.26Å; Q399-E403 HydrophobicContact CG-CG 4.46Å; Q399-E403 WeakPolarHBondContact CG-OE1 3.38Å; Q399-E403 PolarHBondContact NE2-OE1 2.85Å; Q399-E403 WeakPolarHBondContact O-CB 3.46Å; Q399-E403 VanDerWaalsContact O-CG 3.31Å; Q399-E403 WeakPolarHBondContact O-CG 3.34Å; Q399-E403 PolarHBondContact O-N 3.33Å
400	K	83.1	Confident	81.1	Confident	150 Å²	150	109.6 Å²	109.6	65%	0.652	52%	0.523	S	S	*	.	H	α-helix	trans	-64.3	-36	174.9	-70.5	174.9	-177.4	177.7	0	113.1	G396 Q397 A404	G396-K400 WeakPolarHBondContact O-CG 3.38Å; G396-K400 PolarHBondContact O-N 2.88Å; Q397-K400 PolarHBondContact O-N 2.85Å; Q397-K400 VanDerWaalsContact O-N 3.13Å; K400-A404 VanDerWaalsContact O-CB 3.3Å; K400-A404 WeakPolarHBondContact O-CB 3.24Å; K400-A404 PolarHBondContact O-N 2.88Å
401	E	79.9	Confident	81.6	Confident	126 Å²	126	107.8 Å²	107.8	59%	0.589	52%	0.522	S	S	*	.	H	α-helix	trans	-66.1	-38.7	173.6	-72.6	180	161.1	0	0	111.9	Q397 R398 Q399 A405	Q397-E401 WeakPolarHBondContact O-CG 3.38Å; Q397-E401 PolarHBondContact O-N 3.17Å; R398-E401 PolarHBondContact O-N 2.88Å; Q399-E401 VanDerWaalsContact C-N 3.34Å; Q399-E401 PolarHBondContact O-N 3.04Å; E401-A405 VanDerWaalsContact O-CB 3.24Å; E401-A405 WeakPolarHBondContact O-CB 3.27Å; E401-A405 PolarHBondContact O-N 2.86Å
402	L	80.3	Confident	81.8	Confident	114 Å²	114	104 Å²	104	60%	0.597	51%	0.512	S	S	*	.	H	α-helix	trans	-71	-41.9	175.3	-74.9	168.1	0	0	0	111.9	R398 Q399 A405 M406	R398-L402 WeakPolarHBondContact O-CB 3.2Å; R398-L402 VanDerWaalsContact O-CG 3.24Å; R398-L402 WeakPolarHBondContact O-CG 3.44Å; R398-L402 PolarHBondContact O-N 2.88Å; Q399-L402 PolarHBondContact O-N 3.26Å; L402-A405 CarbonylContact O-C 3.59Å; L402-A405 WeakPolarHBondContact O-CB 3.41Å; L402-A405 PolarHBondContact O-N 3.11Å; L402-A405 VanDerWaalsContact O-N 3.08Å; L402-M406 WeakPolarHBondContact O-CG 3.29Å; L402-M406 PolarHBondContact O-N 3.3Å
403	E	85.8	Confident	82.5	Confident	82 Å²	82	103.8 Å²	103.8	38%	0.383	51%	0.508	S	S	.	.	H	α-helix	trans	-57.8	-51.2	172.2	-74.4	164.7	-179.3	0	0	110.2	Q399 A405 M406 E407	Q399-E403 HydrophobicContact CG-CG 4.46Å; Q399-E403 WeakPolarHBondContact CG-OE1 3.38Å; Q399-E403 PolarHBondContact NE2-OE1 2.85Å; Q399-E403 WeakPolarHBondContact O-CB 3.46Å; Q399-E403 VanDerWaalsContact O-CG 3.31Å; Q399-E403 WeakPolarHBondContact O-CG 3.34Å; Q399-E403 PolarHBondContact O-N 3.33Å; E403-A405 PolarHBondContact O-N 3.28Å; E403-M406 HydrophobicContact CG-CE 4.42Å; E403-M406 PolarHBondContact O-N 3.29Å; E403-M406 VanDerWaalsContact O-N 3.13Å; E403-E407 PolarHBondContact O-N 3.03Å
404	A	83.4	Confident	82.8	Confident	34 Å²	34	104.9 Å²	104.9	28%	0.281	51%	0.509	S	S	.	.	H	α-helix	trans	-68.9	-12.9	175.3	0	0	0	0	0	114.1	K400 R408	K400-A404 VanDerWaalsContact O-CB 3.3Å; K400-A404 WeakPolarHBondContact O-CB 3.24Å; K400-A404 PolarHBondContact O-N 2.88Å; A404-R408 PolarHBondContact O-NE 3.28Å; A404-R408 PolarHBondContact O-NH2 3.03Å
405	A	84.5	Confident	83.1	Confident	41 Å²	41	103.7 Å²	103.7	34%	0.339	51%	0.509	S	S	.	.	H	α-helix	trans	-88.9	-34.5	170.7	0	0	0	0	0	111.6	E401 L402 E403 R408 K409	E401-A405 VanDerWaalsContact O-CB 3.24Å; E401-A405 WeakPolarHBondContact O-CB 3.27Å; E401-A405 PolarHBondContact O-N 2.86Å; L402-A405 CarbonylContact O-C 3.59Å; L402-A405 WeakPolarHBondContact O-CB 3.41Å; L402-A405 PolarHBondContact O-N 3.11Å; L402-A405 VanDerWaalsContact O-N 3.08Å; E403-A405 PolarHBondContact O-N 3.28Å; A405-R408 PolarHBondContact O-N 2.97Å; A405-K409 WeakPolarHBondContact O-CG 3.47Å; A405-K409 PolarHBondContact O-N 3.48Å
406	M	83.6	Confident	83.6	Confident	112 Å²	112	102.2 Å²	102.2	55%	0.552	50%	0.503	S	S	*	.	H	α-helix	trans	-64.2	-50.6	171	-71.8	-167.2	-54.7	0	0	110.5	L402 E403 R408 K409 E410	L402-M406 WeakPolarHBondContact O-CG 3.29Å; L402-M406 PolarHBondContact O-N 3.3Å; E403-M406 HydrophobicContact CG-CE 4.42Å; E403-M406 PolarHBondContact O-N 3.29Å; E403-M406 VanDerWaalsContact O-N 3.13Å; M406-R408 PolarHBondContact O-N 3.39Å; M406-K409 CarbonylContact O-C 3.53Å; M406-K409 WeakPolarHBondContact O-CA 3.45Å; M406-K409 PolarHBondContact O-N 3.28Å; M406-E410 WeakPolarHBondContact O-CG 3.26Å; M406-E410 PolarHBondContact O-N 3.22Å
407	E	83.5	Confident	83.8	Confident	129 Å²	129	105.9 Å²	105.9	60%	0.603	51%	0.513	S	S	*	.	H	α-helix	trans	-54.6	-40.2	175.8	-71.3	179.5	154.6	0	0	111.9	E403 E410 V411	E403-E407 PolarHBondContact O-N 3.03Å; E407-E410 PolarHBondContact O-N 3.13Å; E407-V411 WeakPolarHBondContact O-CG2 3.3Å; E407-V411 PolarHBondContact O-N 2.71Å; E407-V411 VanDerWaalsContact O-N 3.11Å
408	R	83.9	Confident	84	Confident	170 Å²	170	102.2 Å²	102.2	64%	0.642	51%	0.505	S	S	*	.	H	α-helix	trans	-67	-34.7	174.8	-85.1	-179.2	-79	-173.8	-4.6	113.1	A404 A405 M406 E412	A404-R408 PolarHBondContact O-NE 3.28Å; A404-R408 PolarHBondContact O-NH2 3.03Å; A405-R408 PolarHBondContact O-N 2.97Å; M406-R408 PolarHBondContact O-N 3.39Å; R408-E412 PolarHBondContact O-N 3.07Å; R408-E412 VanDerWaalsContact O-N 3.11Å
409	K	86.5	Confident	84.4	Confident	115 Å²	115	99.8 Å²	99.8	50%	0.5	50%	0.502	S	S	.	.	H	α-helix	trans	-78.3	-29.2	175.4	-75.6	-57.7	-171.9	-172.3	0	113.3	A405 M406 E412 V413	A405-K409 WeakPolarHBondContact O-CG 3.47Å; A405-K409 PolarHBondContact O-N 3.48Å; M406-K409 CarbonylContact O-C 3.53Å; M406-K409 WeakPolarHBondContact O-CA 3.45Å; M406-K409 PolarHBondContact O-N 3.28Å; K409-E412 HydrophobicContact CD-CB 4.42Å; K409-E412 WeakPolarHBondContact CD-OE2 3.27Å; K409-E412 WeakPolarHBondContact CE-OE2 3.34Å; K409-E412 IonicContact NZ-OE1 2.86Å; K409-E412 PolarHBondContact NZ-OE1 2.9Å; K409-E412 IonicContact NZ-OE2 3.92Å; K409-E412 PolarHBondContact NZ-OE2 3.17Å; K409-E412 PolarHBondContact O-N 3.23Å; K409-V413 WeakPolarHBondContact O-CB 3.18Å; K409-V413 VanDerWaalsContact O-CG2 3.27Å; K409-V413 WeakPolarHBondContact O-CG2 3.44Å; K409-V413 PolarHBondContact O-N 2.96Å
410	E	86.9	Confident	84.6	Confident	119 Å²	119	99.4 Å²	99.4	56%	0.556	50%	0.502	S	S	*	.	H	α-helix	trans	-63.3	-48.9	170.6	-72.3	172.9	160.2	0	0	110.1	M406 E407 E412 V413 E414	M406-E410 WeakPolarHBondContact O-CG 3.26Å; M406-E410 PolarHBondContact O-N 3.22Å; E407-E410 PolarHBondContact O-N 3.13Å; E410-E412 VanDerWaalsContact C-N 3.32Å; E410-E412 PolarHBondContact O-N 2.76Å; E410-V413 WeakPolarHBondContact O-CB 3.33Å; E410-V413 PolarHBondContact O-N 3.07Å; E410-V413 VanDerWaalsContact O-N 3.14Å; E410-E414 WeakPolarHBondContact O-CG 3.17Å; E410-E414 PolarHBondContact O-N 3.5Å
411	V	87.8	Confident	84.8	Confident	85 Å²	85	98.8 Å²	98.8	52%	0.515	50%	0.501	S	S	.	.	H	α-helix	trans	-60.4	-39.9	173	174.9	0	0	0	0	112	E407 E414 T415	E407-V411 WeakPolarHBondContact O-CG2 3.3Å; E407-V411 PolarHBondContact O-N 2.71Å; E407-V411 VanDerWaalsContact O-N 3.11Å; V411-E414 PolarHBondContact O-N 3.16Å; V411-T415 WeakPolarHBondContact O-CG2 3.31Å; V411-T415 PolarHBondContact O-N 2.73Å; V411-T415 PolarHBondContact O-OG1 2.96Å
412	E	84.5	Confident	85.2	Confident	91 Å²	91	96.3 Å²	96.3	43%	0.425	49%	0.492	S	S	.	.	H	α-helix	trans	-63.7	-40.8	175.6	-163	176.2	144.7	0	0	111.5	R408 K409 E410 T415 L416	R408-E412 PolarHBondContact O-N 3.07Å; R408-E412 VanDerWaalsContact O-N 3.11Å; K409-E412 HydrophobicContact CD-CB 4.42Å; K409-E412 WeakPolarHBondContact CD-OE2 3.27Å; K409-E412 WeakPolarHBondContact CE-OE2 3.34Å; K409-E412 IonicContact NZ-OE1 2.86Å; K409-E412 PolarHBondContact NZ-OE1 2.9Å; K409-E412 IonicContact NZ-OE2 3.92Å; K409-E412 PolarHBondContact NZ-OE2 3.17Å; K409-E412 PolarHBondContact O-N 3.23Å; E410-E412 VanDerWaalsContact C-N 3.32Å; E410-E412 PolarHBondContact O-N 2.76Å; E412-T415 PolarHBondContact O-N 2.9Å; E412-T415 PolarHBondContact O-OG1 3.21Å; E412-L416 WeakPolarHBondContact O-CG 3.47Å; E412-L416 PolarHBondContact O-N 2.85Å
413	V	85.2	Confident	85.5	Confident	73 Å²	73	95.7 Å²	95.7	44%	0.442	49%	0.488	S	S	.	.	H	α-helix	trans	-64.3	-43.5	174.1	167.2	0	0	0	0	111.8	K409 E410 T415 L416 Q417	K409-V413 WeakPolarHBondContact O-CB 3.18Å; K409-V413 VanDerWaalsContact O-CG2 3.27Å; K409-V413 WeakPolarHBondContact O-CG2 3.44Å; K409-V413 PolarHBondContact O-N 2.96Å; E410-V413 WeakPolarHBondContact O-CB 3.33Å; E410-V413 PolarHBondContact O-N 3.07Å; E410-V413 VanDerWaalsContact O-N 3.14Å; V413-T415 VanDerWaalsContact C-N 3.33Å; V413-T415 PolarHBondContact O-N 3.32Å; V413-L416 PolarHBondContact O-N 3.22Å; V413-Q417 HydrophobicContact CG1-CG 4.42Å; V413-Q417 WeakPolarHBondContact O-CG 3.45Å; V413-Q417 PolarHBondContact O-N 3.39Å
414	E	85	Confident	85.7	Confident	125 Å²	125	96.8 Å²	96.8	58%	0.584	49%	0.494	S	S	*	.	H	α-helix	trans	-59.1	-43	174.4	-72.3	-179.8	169	0	0	111.5	E410 V411 L416 Q417 A418	E410-E414 WeakPolarHBondContact O-CG 3.17Å; E410-E414 PolarHBondContact O-N 3.5Å; V411-E414 PolarHBondContact O-N 3.16Å; E414-L416 PolarHBondContact O-N 3.37Å; E414-Q417 PolarHBondContact O-N 3.14Å; E414-A418 PolarHBondContact O-N 3.07Å
415	T	84.4	Confident	85.7	Confident	72 Å²	72	98.9 Å²	98.9	44%	0.442	50%	0.498	S	S	.	.	H	α-helix	trans	-67.8	-33.8	175.9	62.8	0	0	0	0	113	V411 E412 V413 N419	V411-T415 WeakPolarHBondContact O-CG2 3.31Å; V411-T415 PolarHBondContact O-N 2.73Å; V411-T415 PolarHBondContact O-OG1 2.96Å; E412-T415 PolarHBondContact O-N 2.9Å; E412-T415 PolarHBondContact O-OG1 3.21Å; V413-T415 VanDerWaalsContact C-N 3.33Å; V413-T415 PolarHBondContact O-N 3.32Å; T415-N419 WeakPolarHBondContact O-CB 3.2Å; T415-N419 VanDerWaalsContact O-CG 3.26Å; T415-N419 PolarHBondContact O-N 3.47Å; T415-N419 PolarHBondContact O-ND2 2.74Å
416	L	85.4	Confident	85.8	Confident	93 Å²	93	102.4 Å²	102.4	49%	0.487	51%	0.505	S	S	.	.	H	α-helix	trans	-70.6	-36.5	174.4	-72.7	170.9	0	0	0	111.8	E412 V413 E414 N419 M420	E412-L416 WeakPolarHBondContact O-CG 3.47Å; E412-L416 PolarHBondContact O-N 2.85Å; V413-L416 PolarHBondContact O-N 3.22Å; E414-L416 PolarHBondContact O-N 3.37Å; L416-N419 PolarHBondContact O-N 3.29Å; L416-M420 WeakPolarHBondContact O-CG 3.44Å; L416-M420 PolarHBondContact O-N 2.92Å
417	Q	84.9	Confident	85.9	Confident	107 Å²	107	101.9 Å²	101.9	50%	0.5	50%	0.504	S	S	.	.	H	α-helix	trans	-62.6	-47.8	172.5	-74.8	174.5	-8.3	0	0	111.2	V413 E414 N419 M420 E421	V413-Q417 HydrophobicContact CG1-CG 4.42Å; V413-Q417 WeakPolarHBondContact O-CG 3.45Å; V413-Q417 PolarHBondContact O-N 3.39Å; E414-Q417 PolarHBondContact O-N 3.14Å; Q417-N419 VanDerWaalsContact C-N 3.31Å; Q417-N419 PolarHBondContact O-N 3.04Å; Q417-M420 WeakPolarHBondContact O-CB 3.41Å; Q417-M420 PolarHBondContact O-N 3.4Å; Q417-M420 VanDerWaalsContact O-N 3.08Å; Q417-E421 PolarHBondContact O-N 3.46Å
418	A	85.1	Confident	86.2	Confident	53 Å²	53	101.8 Å²	101.8	44%	0.438	50%	0.498	S	S	.	.	H	α-helix	trans	-60.6	-38.4	175.8	0	0	0	0	0	112.9	E414 E421 D422	E414-A418 PolarHBondContact O-N 3.07Å; A418-E421 PolarHBondContact O-N 3.29Å; A418-D422 PolarHBondContact O-N 3.13Å; A418-D422 VanDerWaalsContact O-N 3.15Å
419	N	89.1	Confident	86.3	Confident	90 Å²	90	96.7 Å²	96.7	48%	0.481	49%	0.487	S	S	.	.	H	α-helix	trans	-68.5	-34.3	174	-73.9	-40.4	0	0	0	112.6	T415 L416 Q417 L423	T415-N419 WeakPolarHBondContact O-CB 3.2Å; T415-N419 VanDerWaalsContact O-CG 3.26Å; T415-N419 PolarHBondContact O-N 3.47Å; T415-N419 PolarHBondContact O-ND2 2.74Å; L416-N419 PolarHBondContact O-N 3.29Å; Q417-N419 VanDerWaalsContact C-N 3.31Å; Q417-N419 PolarHBondContact O-N 3.04Å; N419-L423 WeakPolarHBondContact O-CB 3.29Å; N419-L423 VanDerWaalsContact O-CG 3.29Å; N419-L423 WeakPolarHBondContact O-CG 3.35Å; N419-L423 PolarHBondContact O-N 3.43Å
420	M	83.4	Confident	86.1	Confident	107 Å²	107	93.9 Å²	93.9	53%	0.527	49%	0.486	S	S	.	.	H	α-helix	trans	-65	-45	172.3	-80.2	171.6	42.1	0	0	111.3	L416 Q417 D422 L423 E424	L416-M420 WeakPolarHBondContact O-CG 3.44Å; L416-M420 PolarHBondContact O-N 2.92Å; Q417-M420 WeakPolarHBondContact O-CB 3.41Å; Q417-M420 PolarHBondContact O-N 3.4Å; Q417-M420 VanDerWaalsContact O-N 3.08Å; M420-D422 PolarHBondContact O-N 2.92Å; M420-L423 PolarHBondContact O-N 2.84Å; M420-E424 WeakPolarHBondContact O-CB 3.48Å; M420-E424 WeakPolarHBondContact O-CG 3.42Å; M420-E424 PolarHBondContact O-N 3.19Å
421	E	86.8	Confident	86.1	Confident	137 Å²	137	92.8 Å²	92.8	64%	0.64	48%	0.484	S	S	*	.	H	α-helix	trans	-60.7	-42.2	178	-70.4	-179.9	174.9	0	0	112.5	Q417 A418 E424 E425	Q417-E421 PolarHBondContact O-N 3.46Å; A418-E421 PolarHBondContact O-N 3.29Å; E421-E424 PolarHBondContact O-N 2.95Å; E421-E425 PolarHBondContact O-N 3.34Å
422	D	88.7	Confident	85.9	Confident	74 Å²	74	94.8 Å²	94.8	40%	0.396	49%	0.485	S	S	.	.	H	α-helix	trans	-65.8	-38.3	174.3	167.1	70.3	0	0	0	112.5	A418 M420 K426	A418-D422 PolarHBondContact O-N 3.13Å; A418-D422 VanDerWaalsContact O-N 3.15Å; M420-D422 PolarHBondContact O-N 2.92Å; D422-K426 VanDerWaalsContact CG-NZ 3.27Å; D422-K426 WeakPolarHBondContact O-CB 3.5Å; D422-K426 WeakPolarHBondContact O-CD 3.36Å; D422-K426 VanDerWaalsContact O-CG 3.28Å; D422-K426 WeakPolarHBondContact O-CG 3.2Å; D422-K426 PolarHBondContact O-N 2.93Å; D422-K426 WeakPolarHBondContact OD1-CE 3.47Å; D422-K426 IonicContact OD1-NZ 2.92Å; D422-K426 PolarHBondContact OD1-NZ 3.02Å; D422-K426 VanDerWaalsContact OD1-NZ 3.15Å; D422-K426 WeakPolarHBondContact OD2-CE 3.47Å; D422-K426 IonicContact OD2-NZ 3.65Å; D422-K426 PolarHBondContact OD2-NZ 3.45Å
423	L	88.1	Confident	85.8	Confident	100 Å²	100	99.7 Å²	99.7	52%	0.524	50%	0.5	S	S	.	.	H	α-helix	trans	-68.1	-39	173.2	-74.5	171.8	0	0	0	112.4	N419 M420 K426 I427	N419-L423 WeakPolarHBondContact O-CB 3.29Å; N419-L423 VanDerWaalsContact O-CG 3.29Å; N419-L423 WeakPolarHBondContact O-CG 3.35Å; N419-L423 PolarHBondContact O-N 3.43Å; M420-L423 PolarHBondContact O-N 2.84Å; L423-K426 PolarHBondContact O-N 3.22Å; L423-I427 VanDerWaalsContact O-CG1 3.28Å; L423-I427 WeakPolarHBondContact O-CG1 3.48Å; L423-I427 PolarHBondContact O-N 2.97Å
424	E	88.4	Confident	85.7	Confident	106 Å²	106	98 Å²	98	50%	0.495	50%	0.497	S	S	.	.	H	α-helix	trans	-63.5	-42.2	175.5	-77.9	-175.8	-172.3	0	0	111.8	M420 E421 I427 R428	M420-E424 WeakPolarHBondContact O-CB 3.48Å; M420-E424 WeakPolarHBondContact O-CG 3.42Å; M420-E424 PolarHBondContact O-N 3.19Å; E421-E424 PolarHBondContact O-N 2.95Å; E424-I427 PolarHBondContact O-N 3.44Å; E424-R428 VanDerWaalsContact O-CB 3.32Å; E424-R428 WeakPolarHBondContact O-CB 3.35Å; E424-R428 PolarHBondContact O-N 3.28Å
425	E	83.9	Confident	85.7	Confident	77 Å²	77	96.7 Å²	96.7	36%	0.36	49%	0.494	S	S	.	.	H	α-helix	trans	-67.9	-38.1	174.3	-171.3	59.6	-146.1	0	0	111.5	E421 I427 R428 C429	E421-E425 PolarHBondContact O-N 3.34Å; E425-I427 PolarHBondContact O-N 3.11Å; E425-R428 CarbonylContact O-C 3.59Å; E425-R428 WeakPolarHBondContact O-CB 3.44Å; E425-R428 PolarHBondContact O-N 3.17Å; E425-R428 VanDerWaalsContact O-N 3.16Å; E425-R428 WeakPolarHBondContact OE2-CD 3.45Å; E425-R428 IonicContact OE2-CZ 3.22Å; E425-R428 IonicContact OE2-NE 3.21Å; E425-R428 PolarHBondContact OE2-NE 3.41Å; E425-R428 IonicContact OE2-NH1 2.98Å; E425-R428 PolarHBondContact OE2-NH1 3Å; E425-R428 IonicContact OE2-NH2 2.66Å; E425-C429 PolarHBondContact O-N 2.88Å; E425-C429 PolarHBondContact O-SG 2.89Å
426	K	87.5	Confident	85.7	Confident	116 Å²	116	98.8 Å²	98.8	50%	0.504	50%	0.503	S	S	.	.	H	α-helix	trans	-60.7	-43	173	-78.3	164.8	179.5	164.5	0	112.5	D422 L423 R428 C429 A430	D422-K426 VanDerWaalsContact CG-NZ 3.27Å; D422-K426 WeakPolarHBondContact O-CB 3.5Å; D422-K426 WeakPolarHBondContact O-CD 3.36Å; D422-K426 VanDerWaalsContact O-CG 3.28Å; D422-K426 WeakPolarHBondContact O-CG 3.2Å; D422-K426 PolarHBondContact O-N 2.93Å; D422-K426 WeakPolarHBondContact OD1-CE 3.47Å; D422-K426 IonicContact OD1-NZ 2.92Å; D422-K426 PolarHBondContact OD1-NZ 3.02Å; D422-K426 VanDerWaalsContact OD1-NZ 3.15Å; D422-K426 WeakPolarHBondContact OD2-CE 3.47Å; D422-K426 IonicContact OD2-NZ 3.65Å; D422-K426 PolarHBondContact OD2-NZ 3.45Å; L423-K426 PolarHBondContact O-N 3.22Å; K426-R428 VanDerWaalsContact C-N 3.34Å; K426-C429 PolarHBondContact O-N 3.01Å; K426-A430 WeakPolarHBondContact O-CB 3.37Å; K426-A430 PolarHBondContact O-N 2.88Å
427	I	85.9	Confident	85.5	Confident	100 Å²	100	96.8 Å²	96.8	51%	0.513	50%	0.5	S	S	.	.	H	α-helix	trans	-62.9	-42.5	173.4	-69.7	164.5	0	0	0	110.1	L423 E424 E425 C429 A430 N431	L423-I427 VanDerWaalsContact O-CG1 3.28Å; L423-I427 WeakPolarHBondContact O-CG1 3.48Å; L423-I427 PolarHBondContact O-N 2.97Å; E424-I427 PolarHBondContact O-N 3.44Å; E425-I427 PolarHBondContact O-N 3.11Å; I427-C429 PolarHBondContact O-N 3.06Å; I427-A430 PolarHBondContact O-N 3.31Å; I427-N431 VanDerWaalsContact O-CG 3.31Å; I427-N431 PolarHBondContact O-N 3.49Å
428	R	89.8	Confident	85.5	Confident	127 Å²	127	98.5 Å²	98.5	48%	0.479	51%	0.508	S	S	.	.	H	α-helix	trans	-61.5	-41.3	177.3	-161.3	-175.5	-59.4	169.7	-1.2	112.6	E424 E425 K426 K432	E424-R428 VanDerWaalsContact O-CB 3.32Å; E424-R428 WeakPolarHBondContact O-CB 3.35Å; E424-R428 PolarHBondContact O-N 3.28Å; E425-R428 CarbonylContact O-C 3.59Å; E425-R428 WeakPolarHBondContact O-CB 3.44Å; E425-R428 PolarHBondContact O-N 3.17Å; E425-R428 VanDerWaalsContact O-N 3.16Å; E425-R428 WeakPolarHBondContact OE2-CD 3.45Å; E425-R428 IonicContact OE2-CZ 3.22Å; E425-R428 IonicContact OE2-NE 3.21Å; E425-R428 PolarHBondContact OE2-NE 3.41Å; E425-R428 IonicContact OE2-NH1 2.98Å; E425-R428 PolarHBondContact OE2-NH1 3Å; E425-R428 IonicContact OE2-NH2 2.66Å; K426-R428 VanDerWaalsContact C-N 3.34Å; R428-K432 PolarHBondContact O-N 2.92Å
429	C	85.2	Confident	85.6	Confident	63 Å²	63	105.7 Å²	105.7	43%	0.426	52%	0.524	S	S	.	.	H	α-helix	trans	-67.3	-38.4	172.5	-69.7	0	0	0	0	112.7	E425 K426 I427 R433	E425-C429 PolarHBondContact O-N 2.88Å; E425-C429 PolarHBondContact O-SG 2.89Å; K426-C429 PolarHBondContact O-N 3.01Å; I427-C429 PolarHBondContact O-N 3.06Å; C429-R433 WeakPolarHBondContact O-CG 3.31Å; C429-R433 PolarHBondContact O-N 3.27Å
430	A	82.2	Confident	85.3	Confident	56 Å²	56	107.8 Å²	107.8	46%	0.463	53%	0.525	S	S	.	.	H	α-helix	trans	-66.2	-42.3	177.4	0	0	0	0	0	111.9	K426 I427 R433 G434	K426-A430 WeakPolarHBondContact O-CB 3.37Å; K426-A430 PolarHBondContact O-N 2.88Å; I427-A430 PolarHBondContact O-N 3.31Å; A430-R433 PolarHBondContact O-N 3.03Å; A430-G434 PolarHBondContact O-N 3.33Å
431	N	85.9	Confident	85.3	Confident	96 Å²	96	105.9 Å²	105.9	51%	0.513	52%	0.521	S	S	.	.	H	α-helix	trans	-61	-47.6	177.2	-71.1	-8.4	0	0	0	111.6	I427 R433 G434 D435	I427-N431 VanDerWaalsContact O-CG 3.31Å; I427-N431 PolarHBondContact O-N 3.49Å; N431-R433 VanDerWaalsContact C-N 3.28Å; N431-R433 PolarHBondContact O-N 2.95Å; N431-G434 CarbonylContact O-C 3.57Å; N431-G434 VanDerWaalsContact O-CA 3.32Å; N431-G434 WeakPolarHBondContact O-CA 3.39Å; N431-G434 PolarHBondContact O-N 2.92Å; N431-D435 PolarHBondContact O-N 2.83Å
432	K	85.3	Confident	85.3	Confident	127 Å²	127	101 Å²	101	55%	0.552	51%	0.508	S	S	*	.	H	α-helix	trans	-55.2	-42.1	174.7	-73.9	178.3	177.8	175.4	0	112.8	R428 G434 D435 D436	R428-K432 PolarHBondContact O-N 2.92Å; K432-G434 VanDerWaalsContact C-N 3.28Å; K432-G434 PolarHBondContact O-N 2.84Å; K432-D435 PolarHBondContact O-N 3.28Å; K432-D436 VanDerWaalsContact O-CG 3.3Å; K432-D436 PolarHBondContact O-N 2.92Å
433	R	81	Confident	85.1	Confident	194 Å²	194	101.3 Å²	101.3	73%	0.732	51%	0.507	S	S	*	.	H	α-helix	trans	-67.4	-28.5	175.4	-71.4	178.4	62	-167.7	-3.3	113.1	C429 A430 N431 A437	C429-R433 WeakPolarHBondContact O-CG 3.31Å; C429-R433 PolarHBondContact O-N 3.27Å; A430-R433 PolarHBondContact O-N 3.03Å; N431-R433 VanDerWaalsContact C-N 3.28Å; N431-R433 PolarHBondContact O-N 2.95Å; R433-A437 WeakPolarHBondContact O-CB 3.48Å; R433-A437 PolarHBondContact O-N 3.44Å; R433-A437 VanDerWaalsContact O-N 3.17Å
434	G	83.2	Confident	84.9	Confident	37 Å²	37	100.5 Å²	100.5	38%	0.381	50%	0.503	S	S	.	.	H	α-helix	trans	-67.7	-47.9	170.6	0	0	0	0	0	111.6	A430 N431 K432 D436 A437 Q438	A430-G434 PolarHBondContact O-N 3.33Å; N431-G434 CarbonylContact O-C 3.57Å; N431-G434 VanDerWaalsContact O-CA 3.32Å; N431-G434 WeakPolarHBondContact O-CA 3.39Å; N431-G434 PolarHBondContact O-N 2.92Å; K432-G434 VanDerWaalsContact C-N 3.28Å; K432-G434 PolarHBondContact O-N 2.84Å; G434-D436 PolarHBondContact O-N 3.35Å; G434-A437 PolarHBondContact O-N 2.95Å; G434-Q438 WeakPolarHBondContact O-CB 3.49Å; G434-Q438 PolarHBondContact O-N 2.97Å
435	D	86.3	Confident	84.9	Confident	99 Å²	99	101.7 Å²	101.7	53%	0.529	51%	0.508	S	S	.	.	H	α-helix	trans	-59.9	-46.2	177.1	-58.6	-32.2	0	0	0	111.3	N431 K432 A437 Q438 W439	N431-D435 PolarHBondContact O-N 2.83Å; K432-D435 PolarHBondContact O-N 3.28Å; D435-A437 VanDerWaalsContact C-N 3.35Å; D435-A437 PolarHBondContact O-N 3.45Å; D435-Q438 PolarHBondContact O-N 2.89Å; D435-W439 PolarHBondContact O-N 3Å
436	D	84.3	Confident	84.9	Confident	115 Å²	115	100.6 Å²	100.6	62%	0.615	51%	0.512	S	S	*	.	H	α-helix	trans	-59.8	-42.5	175.6	-71.3	-27.2	0	0	0	111.9	K432 G434 W439 R440	K432-D436 VanDerWaalsContact O-CG 3.3Å; K432-D436 PolarHBondContact O-N 2.92Å; G434-D436 PolarHBondContact O-N 3.35Å; D436-W439 PolarHBondContact O-N 2.91Å; D436-R440 PolarHBondContact O-N 3.26Å; D436-R440 VanDerWaalsContact O-N 3.1Å
437	A	80.6	Confident	84.9	Confident	52 Å²	52	100.5 Å²	100.5	43%	0.43	51%	0.514	S	S	.	.	H	α-helix	trans	-68.3	-37.9	177.3	0	0	0	0	0	112	R433 G434 D435 R440 C441	R433-A437 WeakPolarHBondContact O-CB 3.48Å; R433-A437 PolarHBondContact O-N 3.44Å; R433-A437 VanDerWaalsContact O-N 3.17Å; G434-A437 PolarHBondContact O-N 2.95Å; D435-A437 VanDerWaalsContact C-N 3.35Å; D435-A437 PolarHBondContact O-N 3.45Å; A437-R440 PolarHBondContact O-N 3.32Å; A437-C441 PolarHBondContact O-N 3.1Å; A437-C441 PolarHBondContact O-SG 3.1Å
438	Q	85	Confident	84.8	Confident	142 Å²	142	101 Å²	101	66%	0.664	52%	0.516	S	S	*	.	H	α-helix	trans	-66.1	-40.1	176.5	-171.8	171.5	1.3	0	0	111.4	G434 D435 C441 G442	G434-Q438 WeakPolarHBondContact O-CB 3.49Å; G434-Q438 PolarHBondContact O-N 2.97Å; D435-Q438 PolarHBondContact O-N 2.89Å; Q438-C441 PolarHBondContact O-N 3.44Å; Q438-G442 PolarHBondContact O-N 3.27Å; Q438-G442 VanDerWaalsContact O-N 3.07Å
439	W	86.4	Confident	84.6	Confident	204 Å²	204	101 Å²	101	77%	0.773	52%	0.522	S	S	*	.	H	α-helix	trans	-60	-45.6	172.1	-170.7	-82.2	0	0	0	111.8	D435 D436 C441 G442 E443	D435-W439 PolarHBondContact O-N 3Å; D436-W439 PolarHBondContact O-N 2.91Å; W439-C441 VanDerWaalsContact C-N 3.33Å; W439-C441 PolarHBondContact O-N 3.02Å; W439-G442 PolarHBondContact O-N 3.36Å; W439-E443 PolarHBondContact O-N 3.15Å
440	R	83.1	Confident	84.8	Confident	135 Å²	135	103.7 Å²	103.7	51%	0.509	53%	0.527	S	S	.	.	H	α-helix	trans	-66.5	-32.3	178.7	-170.3	57.7	169	177	3.8	113	D436 A437 E443 L444	D436-R440 PolarHBondContact O-N 3.26Å; D436-R440 VanDerWaalsContact O-N 3.1Å; A437-R440 PolarHBondContact O-N 3.32Å; R440-E443 VanDerWaalsContact CD-OE2 3.27Å; R440-E443 WeakPolarHBondContact CD-OE2 3.17Å; R440-E443 IonicContact CZ-OE2 3.74Å; R440-E443 IonicContact NE-OE2 2.69Å; R440-E443 VanDerWaalsContact NH1-CD 3.3Å; R440-E443 IonicContact NH1-OE1 2.64Å; R440-E443 IonicContact NH1-OE2 2.77Å; R440-E443 PolarHBondContact NH1-OE2 3.31Å; R440-L444 HydrophobicContact CG-CD1 4.48Å; R440-L444 WeakPolarHBondContact O-CG 3.38Å; R440-L444 PolarHBondContact O-N 3.15Å; R440-L444 VanDerWaalsContact O-N 3.15Å
441	C	82.9	Confident	85	Confident	67 Å²	67	103 Å²	103	45%	0.453	52%	0.521	S	S	.	.	H	α-helix	trans	-64.9	-47.5	171.5	-66.2	0	0	0	0	111.1	A437 Q438 W439 E443 L444 E445	A437-C441 PolarHBondContact O-N 3.1Å; A437-C441 PolarHBondContact O-SG 3.1Å; Q438-C441 PolarHBondContact O-N 3.44Å; W439-C441 VanDerWaalsContact C-N 3.33Å; W439-C441 PolarHBondContact O-N 3.02Å; C441-E443 VanDerWaalsContact C-N 3.3Å; C441-E443 PolarHBondContact O-N 3.38Å; C441-L444 PolarHBondContact O-N 3.44Å; C441-E445 WeakPolarHBondContact O-CB 3.19Å; C441-E445 VanDerWaalsContact O-CG 3.31Å; C441-E445 WeakPolarHBondContact O-CG 3.37Å; C441-E445 PolarHBondContact O-N 2.82Å
442	G	86.7	Confident	85	Confident	34 Å²	34	102.3 Å²	102.3	35%	0.351	52%	0.517	S	S	.	.	H	α-helix	trans	-62	-33.8	177.6	0	0	0	0	0	114	Q438 W439 A446	Q438-G442 PolarHBondContact O-N 3.27Å; Q438-G442 VanDerWaalsContact O-N 3.07Å; W439-G442 PolarHBondContact O-N 3.36Å; G442-A446 PolarHBondContact O-N 2.85Å; G442-A446 VanDerWaalsContact O-N 3.12Å
443	E	85.1	Confident	85.1	Confident	81 Å²	81	104 Å²	104	38%	0.379	52%	0.52	S	S	.	.	H	α-helix	trans	-65.2	-47.8	172.8	-171.3	178.7	-158.2	0	0	111.7	W439 R440 C441 A446 E447	W439-E443 PolarHBondContact O-N 3.15Å; R440-E443 VanDerWaalsContact CD-OE2 3.27Å; R440-E443 WeakPolarHBondContact CD-OE2 3.17Å; R440-E443 IonicContact CZ-OE2 3.74Å; R440-E443 IonicContact NE-OE2 2.69Å; R440-E443 VanDerWaalsContact NH1-CD 3.3Å; R440-E443 IonicContact NH1-OE1 2.64Å; R440-E443 IonicContact NH1-OE2 2.77Å; R440-E443 PolarHBondContact NH1-OE2 3.31Å; C441-E443 VanDerWaalsContact C-N 3.3Å; C441-E443 PolarHBondContact O-N 3.38Å; E443-A446 PolarHBondContact O-N 3.18Å; E443-E447 PolarHBondContact O-N 3.19Å; E443-E447 VanDerWaalsContact O-N 3.09Å
444	L	83.7	Confident	85.3	Confident	83 Å²	83	99.7 Å²	99.7	44%	0.435	51%	0.508	S	S	.	.	H	α-helix	trans	-65.9	-37.4	177.2	-70.4	170.4	0	0	0	112.3	R440 C441 A446 E447 L448	R440-L444 HydrophobicContact CG-CD1 4.48Å; R440-L444 WeakPolarHBondContact O-CG 3.38Å; R440-L444 PolarHBondContact O-N 3.15Å; R440-L444 VanDerWaalsContact O-N 3.15Å; C441-L444 PolarHBondContact O-N 3.44Å; L444-A446 VanDerWaalsContact C-N 3.35Å; L444-E447 PolarHBondContact O-N 3.18Å; L444-L448 WeakPolarHBondContact O-CB 3.49Å; L444-L448 PolarHBondContact O-N 3.34Å
445	E	87.8	Confident	85.5	Confident	130 Å²	130	101.6 Å²	101.6	61%	0.607	51%	0.509	S	S	*	.	H	α-helix	trans	-60	-43.8	173.9	-75.7	169.3	-179.4	0	0	111.2	C441 L448 E449	C441-E445 WeakPolarHBondContact O-CB 3.19Å; C441-E445 VanDerWaalsContact O-CG 3.31Å; C441-E445 WeakPolarHBondContact O-CG 3.37Å; C441-E445 PolarHBondContact O-N 2.82Å; E445-L448 PolarHBondContact O-N 3.12Å; E445-E449 PolarHBondContact O-N 3.42Å
446	A	85.7	Confident	85.5	Confident	54 Å²	54	102.9 Å²	102.9	45%	0.446	51%	0.512	S	S	.	.	H	α-helix	trans	-66.1	-37.2	176.6	0	0	0	0	0	113.2	G442 E443 L444 K450	G442-A446 PolarHBondContact O-N 2.85Å; G442-A446 VanDerWaalsContact O-N 3.12Å; E443-A446 PolarHBondContact O-N 3.18Å; L444-A446 VanDerWaalsContact C-N 3.35Å; A446-K450 PolarHBondContact O-N 2.96Å; A446-K450 VanDerWaalsContact O-N 3.07Å
447	E	87.2	Confident	85.6	Confident	115 Å²	115	100.6 Å²	100.6	54%	0.537	51%	0.505	S	S	.	.	H	α-helix	trans	-64.9	-41.6	172.2	-71.4	-172.8	157.1	0	0	111.7	E443 L444 K450 A451	E443-E447 PolarHBondContact O-N 3.19Å; E443-E447 VanDerWaalsContact O-N 3.09Å; L444-E447 PolarHBondContact O-N 3.18Å; E447-K450 WeakPolarHBondContact O-CB 3.37Å; E447-K450 PolarHBondContact O-N 2.63Å; E447-A451 PolarHBondContact O-N 3.04Å
448	L	83	Confident	85.8	Confident	109 Å²	109	103.3 Å²	103.3	57%	0.571	51%	0.512	S	S	*	.	H	α-helix	trans	-67.1	-39.3	178.6	-138.7	164.9	0	0	0	111.5	L444 E445 K450 A451 N452	L444-L448 WeakPolarHBondContact O-CB 3.49Å; L444-L448 PolarHBondContact O-N 3.34Å; E445-L448 PolarHBondContact O-N 3.12Å; L448-K450 VanDerWaalsContact C-N 3.32Å; L448-K450 PolarHBondContact O-N 2.88Å; L448-A451 PolarHBondContact O-N 3.09Å; L448-N452 VanDerWaalsContact CD2-ND2 3.27Å; L448-N452 WeakPolarHBondContact CD2-ND2 3.32Å; L448-N452 VanDerWaalsContact O-CB 3.31Å; L448-N452 WeakPolarHBondContact O-CB 3.39Å; L448-N452 PolarHBondContact O-N 3.19Å; L448-N452 PolarHBondContact O-ND2 3.01Å
449	E	86.7	Confident	85.9	Confident	127 Å²	127	102 Å²	102	59%	0.593	50%	0.504	S	S	*	.	H	α-helix	trans	-63.8	-34	170.6	-78.2	-164.5	164.5	0	0	113.4	E445 R453	E445-E449 PolarHBondContact O-N 3.42Å; E449-R453 WeakPolarHBondContact O-CG 3.4Å; E449-R453 PolarHBondContact O-N 2.91Å; E449-R453 PolarHBondContact O-NE 3.13Å
450	K	88.7	Confident	85.9	Confident	121 Å²	121	95.2 Å²	95.2	53%	0.526	49%	0.491	S	S	.	.	H	α-helix	trans	-68.5	-50.9	175.1	-173.5	-169.1	172.2	-151.3	0	110.5	A446 E447 L448 N452 R453 E454	A446-K450 PolarHBondContact O-N 2.96Å; A446-K450 VanDerWaalsContact O-N 3.07Å; E447-K450 WeakPolarHBondContact O-CB 3.37Å; E447-K450 PolarHBondContact O-N 2.63Å; L448-K450 VanDerWaalsContact C-N 3.32Å; L448-K450 PolarHBondContact O-N 2.88Å; K450-N452 VanDerWaalsContact C-N 3.31Å; K450-N452 PolarHBondContact O-N 2.94Å; K450-R453 WeakPolarHBondContact O-CB 3.49Å; K450-R453 PolarHBondContact O-N 2.89Å; K450-R453 VanDerWaalsContact O-N 3.11Å; K450-E454 WeakPolarHBondContact CE-OE1 3.49Å; K450-E454 IonicContact NZ-OE1 2.63Å; K450-E454 PolarHBondContact O-N 2.87Å; K450-E454 VanDerWaalsContact O-N 3.11Å
451	A	85.7	Confident	86.1	Confident	41 Å²	41	93 Å²	93	34%	0.339	49%	0.489	S	S	.	.	H	α-helix	trans	-59.5	-40.4	177.5	0	0	0	0	0	112.1	E447 L448 R453 E454 I455	E447-A451 PolarHBondContact O-N 3.04Å; L448-A451 PolarHBondContact O-N 3.09Å; A451-R453 VanDerWaalsContact C-N 3.34Å; A451-R453 PolarHBondContact O-N 3.36Å; A451-E454 PolarHBondContact O-N 3.03Å; A451-I455 WeakPolarHBondContact O-CG1 3.49Å; A451-I455 PolarHBondContact O-N 3.41Å
452	N	86.5	Confident	86.1	Confident	82 Å²	82	94.9 Å²	94.9	44%	0.439	49%	0.494	S	S	.	.	H	α-helix	trans	-62.5	-37.5	175.3	-83.4	-36.7	0	0	0	112.8	L448 K450 Q456	L448-N452 VanDerWaalsContact CD2-ND2 3.27Å; L448-N452 WeakPolarHBondContact CD2-ND2 3.32Å; L448-N452 VanDerWaalsContact O-CB 3.31Å; L448-N452 WeakPolarHBondContact O-CB 3.39Å; L448-N452 PolarHBondContact O-N 3.19Å; L448-N452 PolarHBondContact O-ND2 3.01Å; K450-N452 VanDerWaalsContact C-N 3.31Å; K450-N452 PolarHBondContact O-N 2.94Å; N452-Q456 VanDerWaalsContact O-CG 3.28Å; N452-Q456 WeakPolarHBondContact O-CG 3.14Å; N452-Q456 PolarHBondContact O-N 3.41Å
453	R	87.1	Confident	86	Confident	161 Å²	161	100.4 Å²	100.4	61%	0.608	51%	0.508	S	S	*	.	H	α-helix	trans	-65.8	-41.7	174.6	-78.4	176.2	-78.4	164.3	-11.8	112.1	E449 K450 A451 Q456 S457	E449-R453 WeakPolarHBondContact O-CG 3.4Å; E449-R453 PolarHBondContact O-N 2.91Å; E449-R453 PolarHBondContact O-NE 3.13Å; K450-R453 WeakPolarHBondContact O-CB 3.49Å; K450-R453 PolarHBondContact O-N 2.89Å; K450-R453 VanDerWaalsContact O-N 3.11Å; A451-R453 VanDerWaalsContact C-N 3.34Å; A451-R453 PolarHBondContact O-N 3.36Å; R453-Q456 PolarHBondContact O-N 3.39Å; R453-S457 PolarHBondContact O-N 3.45Å; R453-S457 VanDerWaalsContact O-N 3.09Å
454	E	86.4	Confident	85.9	Confident	104 Å²	104	100.7 Å²	100.7	49%	0.486	51%	0.51	S	S	.	.	H	α-helix	trans	-63.2	-43.9	175.9	-68.7	171.1	-172.5	0	0	111.4	K450 A451 Q456 S457 L458	K450-E454 WeakPolarHBondContact CE-OE1 3.49Å; K450-E454 IonicContact NZ-OE1 2.63Å; K450-E454 PolarHBondContact O-N 2.87Å; K450-E454 VanDerWaalsContact O-N 3.11Å; A451-E454 PolarHBondContact O-N 3.03Å; E454-Q456 VanDerWaalsContact C-N 3.33Å; E454-Q456 PolarHBondContact O-N 3.4Å; E454-S457 WeakPolarHBondContact O-CB 3.41Å; E454-S457 PolarHBondContact O-N 3.17Å; E454-L458 WeakPolarHBondContact O-CG 3.31Å; E454-L458 PolarHBondContact O-N 3.47Å
455	I	85.9	Confident	85.7	Confident	77 Å²	77	102.2 Å²	102.2	40%	0.395	52%	0.515	S	S	.	.	H	α-helix	trans	-60.8	-38.5	174.9	-70.5	164.5	0	0	0	112.1	A451 K459	A451-I455 WeakPolarHBondContact O-CG1 3.49Å; A451-I455 PolarHBondContact O-N 3.41Å; I455-K459 HydrophobicContact CG2-CD 4.08Å; I455-K459 WeakPolarHBondContact O-CB 3.35Å; I455-K459 VanDerWaalsContact O-CG 3.3Å; I455-K459 WeakPolarHBondContact O-CG 3.45Å; I455-K459 PolarHBondContact O-N 3.04Å
456	Q	86.3	Confident	85.3	Confident	126 Å²	126	101.8 Å²	101.8	59%	0.589	51%	0.513	S	S	*	.	H	α-helix	trans	-69.6	-35	176.9	-68	-69.8	3.6	0	0	112.4	N452 R453 E454 A460	N452-Q456 VanDerWaalsContact O-CG 3.28Å; N452-Q456 WeakPolarHBondContact O-CG 3.14Å; N452-Q456 PolarHBondContact O-N 3.41Å; R453-Q456 PolarHBondContact O-N 3.39Å; E454-Q456 VanDerWaalsContact C-N 3.33Å; E454-Q456 PolarHBondContact O-N 3.4Å; Q456-A460 PolarHBondContact O-N 3.23Å
457	S	86.3	Confident	85	Confident	68 Å²	68	104.1 Å²	104.1	48%	0.476	51%	0.513	S	S	.	.	H	α-helix	trans	-60.2	-54.8	171.7	-166.6	0	0	0	0	110.8	R453 E454 K459 A460 D461	R453-S457 PolarHBondContact O-N 3.45Å; R453-S457 VanDerWaalsContact O-N 3.09Å; E454-S457 WeakPolarHBondContact O-CB 3.41Å; E454-S457 PolarHBondContact O-N 3.17Å; S457-K459 PolarHBondContact O-N 3.18Å; S457-A460 WeakPolarHBondContact O-CA 3.49Å; S457-A460 WeakPolarHBondContact O-CB 3.32Å; S457-A460 PolarHBondContact O-N 3.21Å; S457-D461 PolarHBondContact O-N 2.87Å
458	L	85.7	Confident	84.5	Confident	109 Å²	109	100.9 Å²	100.9	57%	0.571	50%	0.499	S	S	*	.	H	α-helix	trans	-60.9	-33.1	-178.1	-65.8	173	0	0	0	112.6	E454 D461 L462	E454-L458 WeakPolarHBondContact O-CG 3.31Å; E454-L458 PolarHBondContact O-N 3.47Å; L458-D461 PolarHBondContact O-N 3.18Å; L458-L462 WeakPolarHBondContact O-CB 3.4Å; L458-L462 VanDerWaalsContact O-CG 3.3Å; L458-L462 WeakPolarHBondContact O-CG 3.47Å; L458-L462 PolarHBondContact O-N 2.91Å
459	K	87.7	Confident	84	Confident	115 Å²	115	101.2 Å²	101.2	50%	0.5	50%	0.501	S	S	.	.	H	α-helix	trans	-68.4	-31.4	173	-77.8	174.7	179.3	176.8	0	113.6	I455 S457 K463	I455-K459 HydrophobicContact CG2-CD 4.08Å; I455-K459 WeakPolarHBondContact O-CB 3.35Å; I455-K459 VanDerWaalsContact O-CG 3.3Å; I455-K459 WeakPolarHBondContact O-CG 3.45Å; I455-K459 PolarHBondContact O-N 3.04Å; S457-K459 PolarHBondContact O-N 3.18Å; K459-K463 WeakPolarHBondContact O-CG 3.3Å; K459-K463 PolarHBondContact O-N 3.01Å
460	A	85.5	Confident	83.3	Confident	61 Å²	61	102.3 Å²	102.3	50%	0.504	51%	0.505	S	S	.	.	H	α-helix	trans	-72.9	-43.6	173.9	0	0	0	0	0	110.8	Q456 S457 K463 E464	Q456-A460 PolarHBondContact O-N 3.23Å; S457-A460 WeakPolarHBondContact O-CA 3.49Å; S457-A460 WeakPolarHBondContact O-CB 3.32Å; S457-A460 PolarHBondContact O-N 3.21Å; A460-K463 PolarHBondContact O-N 3.49Å; A460-E464 PolarHBondContact O-N 2.92Å
461	D	87.6	Confident	82.3	Confident	87 Å²	87	102.7 Å²	102.7	47%	0.465	51%	0.507	S	S	.	.	H	α-helix	trans	-61.8	-45	177.6	-63.1	-40	0	0	0	111.6	S457 L458 K463 E464 Q465	S457-D461 PolarHBondContact O-N 2.87Å; L458-D461 PolarHBondContact O-N 3.18Å; D461-K463 PolarHBondContact O-N 3.22Å; D461-E464 PolarHBondContact O-N 2.73Å; D461-Q465 WeakPolarHBondContact O-CG 3.39Å; D461-Q465 PolarHBondContact O-N 3.11Å
462	L	83.2	Confident	81.1	Confident	108 Å²	108	106.5 Å²	106.5	57%	0.565	52%	0.521	S	S	*	.	H	α-helix	trans	-57.5	-44.4	175.4	-79.5	168.5	0	0	0	112.4	L458 E464 Q465 E466	L458-L462 WeakPolarHBondContact O-CB 3.4Å; L458-L462 VanDerWaalsContact O-CG 3.3Å; L458-L462 WeakPolarHBondContact O-CG 3.47Å; L458-L462 PolarHBondContact O-N 2.91Å; L462-E464 VanDerWaalsContact C-N 3.35Å; L462-E464 PolarHBondContact O-N 2.71Å; L462-Q465 PolarHBondContact O-N 3.39Å; L462-Q465 VanDerWaalsContact O-N 3.17Å; L462-E466 WeakPolarHBondContact O-CG 3.47Å; L462-E466 PolarHBondContact O-N 3.05Å
463	K	84.7	Confident	79.9	Confident	149 Å²	149	107.1 Å²	107.1	65%	0.648	52%	0.524	S	S	*	.	H	α-helix	trans	-64	-35.7	178.2	-79	-174.9	173.9	-171.7	0	113.8	K459 A460 D461 K467	K459-K463 WeakPolarHBondContact O-CG 3.3Å; K459-K463 PolarHBondContact O-N 3.01Å; A460-K463 PolarHBondContact O-N 3.49Å; D461-K463 PolarHBondContact O-N 3.22Å; K463-K467 WeakPolarHBondContact O-CB 3.47Å; K463-K467 PolarHBondContact O-N 2.98Å
464	E	83.5	Confident	78.9	Confident	87 Å²	87	103.9 Å²	103.9	41%	0.407	52%	0.518	S	S	.	.	H	α-helix	trans	-74.1	-32	175.4	-171.4	58.1	-150.5	0	0	111.1	A460 D461 L462 K467 N468 K471	A460-E464 PolarHBondContact O-N 2.92Å; D461-E464 PolarHBondContact O-N 2.73Å; L462-E464 VanDerWaalsContact C-N 3.35Å; L462-E464 PolarHBondContact O-N 2.71Å; E464-K467 IonicContact OE2-NZ 2.63Å; E464-N468 WeakPolarHBondContact O-CB 3.32Å; E464-N468 VanDerWaalsContact O-CG 3.24Å; E464-N468 PolarHBondContact O-N 3.37Å; E464-N468 PolarHBondContact O-ND2 3.07Å; E464-K471 IonicContact OE1-NZ 3.49Å
465	Q	77.7	Confident	77.7	Confident	115 Å²	115	106.9 Å²	106.9	54%	0.537	53%	0.526	S	S	.	.	H	α-helix	trans	-67.3	-43.4	170.7	-64.9	-57.6	-22.3	0	0	112.6	D461 L462 K467 N468 I469	D461-Q465 WeakPolarHBondContact O-CG 3.39Å; D461-Q465 PolarHBondContact O-N 3.11Å; L462-Q465 PolarHBondContact O-N 3.39Å; L462-Q465 VanDerWaalsContact O-N 3.17Å; Q465-K467 VanDerWaalsContact C-N 3.31Å; Q465-K467 PolarHBondContact O-N 3.03Å; Q465-N468 PolarHBondContact O-N 2.81Å; Q465-N468 VanDerWaalsContact O-N 3.07Å; Q465-I469 WeakPolarHBondContact O-CG1 3.46Å; Q465-I469 PolarHBondContact O-N 3.48Å
466	E	79.4	Confident	76.7	Confident	121 Å²	121	110 Å²	110	57%	0.565	54%	0.539	S	S	*	.	H	α-helix	trans	-52.9	-49	172.9	-74.2	170.1	164.4	0	0	111	L462 N468 I469 E470	L462-E466 WeakPolarHBondContact O-CG 3.47Å; L462-E466 PolarHBondContact O-N 3.05Å; E466-N468 VanDerWaalsContact C-N 3.32Å; E466-N468 PolarHBondContact O-N 3.37Å; E466-I469 PolarHBondContact O-N 2.93Å; E466-E470 WeakPolarHBondContact O-CB 3.43Å; E466-E470 PolarHBondContact O-N 3.18Å
467	K	80.2	Confident	76.1	Confident	104 Å²	104	109.5 Å²	109.5	45%	0.452	54%	0.541	S	S	.	.	H	α-helix	trans	-65.2	-30.9	177.3	-172.7	-175.4	-179.4	-172.7	0	113.8	K463 E464 Q465 K471	K463-K467 WeakPolarHBondContact O-CB 3.47Å; K463-K467 PolarHBondContact O-N 2.98Å; E464-K467 IonicContact OE2-NZ 2.63Å; Q465-K467 VanDerWaalsContact C-N 3.31Å; Q465-K467 PolarHBondContact O-N 3.03Å; K467-K471 WeakPolarHBondContact O-CG 3.46Å; K467-K471 PolarHBondContact O-N 3.32Å; K467-K471 VanDerWaalsContact O-N 3.16Å
468	N	77.7	Confident	75.3	Confident	47 Å²	47	111.7 Å²	111.7	25%	0.251	55%	0.545	S	S	.	.	H	α-helix	trans	-78.6	-33.7	176	-72.3	-35.7	0	0	0	112.1	E464 Q465 E466 E470 K471 L472	E464-N468 WeakPolarHBondContact O-CB 3.32Å; E464-N468 VanDerWaalsContact O-CG 3.24Å; E464-N468 PolarHBondContact O-N 3.37Å; E464-N468 PolarHBondContact O-ND2 3.07Å; Q465-N468 PolarHBondContact O-N 2.81Å; Q465-N468 VanDerWaalsContact O-N 3.07Å; E466-N468 VanDerWaalsContact C-N 3.32Å; E466-N468 PolarHBondContact O-N 3.37Å; N468-E470 VanDerWaalsContact C-N 3.35Å; N468-K471 PolarHBondContact O-N 3.15Å; N468-K471 PolarHBondContact OD1-NZ 2.97Å; N468-L472 WeakPolarHBondContact O-CB 3.45Å; N468-L472 VanDerWaalsContact O-CG 3.27Å; N468-L472 WeakPolarHBondContact O-CG 3.26Å; N468-L472 PolarHBondContact O-N 3.03Å
469	I	72.3	Confident	74.8	Confident	116 Å²	116	111.1 Å²	111.1	60%	0.595	55%	0.546	S	S	*	.	H	α-helix	trans	-62.9	-43.4	168.6	-68.4	164.4	0	0	0	110.1	Q465 E466 K471 L472 N473	Q465-I469 WeakPolarHBondContact O-CG1 3.46Å; Q465-I469 PolarHBondContact O-N 3.48Å; E466-I469 PolarHBondContact O-N 2.93Å; I469-K471 PolarHBondContact O-N 2.96Å; I469-L472 CarbonylContact O-C 3.49Å; I469-L472 PolarHBondContact O-N 3.32Å; I469-N473 PolarHBondContact O-N 2.94Å; I469-N473 VanDerWaalsContact O-N 3.15Å
470	E	70.3	Confident	74.3	Confident	149 Å²	149	110 Å²	110	70%	0.696	55%	0.545	S	S	*	.	H	α-helix	trans	-61.8	-40.9	177.8	-164.5	172	-136.3	0	0	112.3	E466 N468 L472 N473	E466-E470 WeakPolarHBondContact O-CB 3.43Å; E466-E470 PolarHBondContact O-N 3.18Å; N468-E470 VanDerWaalsContact C-N 3.35Å; E470-L472 VanDerWaalsContact C-N 3.34Å; E470-N473 VanDerWaalsContact O-CB 3.29Å; E470-N473 WeakPolarHBondContact O-CB 3.45Å; E470-N473 PolarHBondContact O-N 3.05Å
471	K	69.5	Low	74.2	Confident	129 Å²	129	114.5 Å²	114.5	56%	0.561	55%	0.549	S	S	*	.	H	α-helix	trans	-67.4	-29.8	171.1	-69	169.9	-161.6	154.9	0	113.9	E464 K467 N468 I469 N473	E464-K471 IonicContact OE1-NZ 3.49Å; K467-K471 WeakPolarHBondContact O-CG 3.46Å; K467-K471 PolarHBondContact O-N 3.32Å; K467-K471 VanDerWaalsContact O-N 3.16Å; N468-K471 PolarHBondContact O-N 3.15Å; N468-K471 PolarHBondContact OD1-NZ 2.97Å; I469-K471 PolarHBondContact O-N 2.96Å; K471-N473 VanDerWaalsContact C-N 3.25Å
472	L	60.4	Low	73.7	Confident	122 Å²	122	113.7 Å²	113.7	64%	0.639	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	4.7	178.9	-73.9	170.9	0	0	0	112.7	N468 I469 E470 I474	N468-L472 WeakPolarHBondContact O-CB 3.45Å; N468-L472 VanDerWaalsContact O-CG 3.27Å; N468-L472 WeakPolarHBondContact O-CG 3.26Å; N468-L472 PolarHBondContact O-N 3.03Å; I469-L472 CarbonylContact O-C 3.49Å; I469-L472 PolarHBondContact O-N 3.32Å; E470-L472 VanDerWaalsContact C-N 3.34Å; L472-I474 PolarHBondContact O-N 3.3Å
473	N	61	Low	73.7	Confident	94 Å²	94	109.9 Å²	109.9	50%	0.503	54%	0.536	S	S	.	.			trans	-75.7	55.5	179.8	-162.8	23	0	0	0	113	I469 E470 K471 Y475	I469-N473 PolarHBondContact O-N 2.94Å; I469-N473 VanDerWaalsContact O-N 3.15Å; E470-N473 VanDerWaalsContact O-CB 3.29Å; E470-N473 WeakPolarHBondContact O-CB 3.45Å; E470-N473 PolarHBondContact O-N 3.05Å; K471-N473 VanDerWaalsContact C-N 3.25Å; N473-Y475 PolarHBondContact O-N 2.88Å; N473-Y475 WeakPolarHBondContact OD1-CD2 3.5Å
474	I	65.2	Low	73.7	Confident	93 Å²	93	106.8 Å²	106.8	48%	0.477	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-2.2	176.9	-57.4	160.6	0	0	0	111.3	L472 E476 D477 M478	L472-I474 PolarHBondContact O-N 3.3Å; I474-E476 VanDerWaalsContact C-N 3.29Å; I474-E476 PolarHBondContact O-N 2.91Å; I474-D477 HydrophobicContact CG2-CB 4.44Å; I474-D477 PolarHBondContact O-N 3.13Å; I474-M478 HydrophobicContact CG2-CG 4.32Å; I474-M478 WeakPolarHBondContact O-CG 3.16Å; I474-M478 PolarHBondContact O-N 3.01Å
475	Y	61.4	Low	73.7	Confident	167 Å²	167	107.6 Å²	107.6	66%	0.655	53%	0.531	S	S	*	.	H	α-helix	trans	-58	-35.4	177	-77.5	-77	0	0	0	113.4	N473 M478 V479	N473-Y475 PolarHBondContact O-N 2.88Å; N473-Y475 WeakPolarHBondContact OD1-CD2 3.5Å; Y475-M478 PolarHBondContact O-N 3.35Å; Y475-V479 WeakPolarHBondContact O-CB 3.3Å; Y475-V479 VanDerWaalsContact O-CG2 3.24Å; Y475-V479 WeakPolarHBondContact O-CG2 3.38Å; Y475-V479 PolarHBondContact O-N 3.3Å
476	E	66	Low	74.1	Confident	143 Å²	143	106.7 Å²	106.7	67%	0.668	53%	0.529	S	S	*	.	H	α-helix	trans	-68.5	-42.4	179.1	-167.5	165.5	-166.6	0	0	111.6	I474 M478 V479 N480	I474-E476 VanDerWaalsContact C-N 3.29Å; I474-E476 PolarHBondContact O-N 2.91Å; E476-M478 PolarHBondContact O-N 2.88Å; E476-V479 PolarHBondContact O-N 2.82Å; E476-N480 WeakPolarHBondContact O-CB 3.23Å; E476-N480 VanDerWaalsContact O-CG 3.29Å; E476-N480 PolarHBondContact O-N 3.12Å; E476-N480 PolarHBondContact O-ND2 3.38Å; E476-N480 VanDerWaalsContact O-ND2 3.08Å
477	D	72.8	Confident	74.4	Confident	116 Å²	116	108.6 Å²	108.6	62%	0.62	53%	0.532	S	S	*	.	H	α-helix	trans	-62.9	-40.3	171.9	-77.4	-17.9	0	0	0	112	I474 N480 R481	I474-D477 HydrophobicContact CG2-CB 4.44Å; I474-D477 PolarHBondContact O-N 3.13Å; D477-N480 PolarHBondContact O-N 3.12Å; D477-R481 VanDerWaalsContact O-CB 3.31Å; D477-R481 WeakPolarHBondContact O-CB 3.35Å; D477-R481 PolarHBondContact O-N 2.87Å
478	M	68.9	Low	74.7	Confident	114 Å²	114	106.1 Å²	106.1	56%	0.562	53%	0.53	S	S	*	.	H	α-helix	trans	-65.5	-41	175.1	-72.4	-174.8	68.6	0	0	112.4	I474 Y475 E476 R481 C482	I474-M478 HydrophobicContact CG2-CG 4.32Å; I474-M478 WeakPolarHBondContact O-CG 3.16Å; I474-M478 PolarHBondContact O-N 3.01Å; Y475-M478 PolarHBondContact O-N 3.35Å; E476-M478 PolarHBondContact O-N 2.88Å; M478-R481 PolarHBondContact O-N 3.09Å; M478-C482 PolarHBondContact O-N 3Å; M478-C482 PolarHBondContact O-SG 3.09Å; M478-C482 VanDerWaalsContact O-SG 3.33Å
479	V	75.5	Confident	75	Confident	97 Å²	97	108.5 Å²	108.5	59%	0.588	54%	0.543	S	S	*	.	H	α-helix	trans	-65.1	-43.7	176.1	166.2	0	0	0	0	110.6	Y475 E476 R481 C482 G483	Y475-V479 WeakPolarHBondContact O-CB 3.3Å; Y475-V479 VanDerWaalsContact O-CG2 3.24Å; Y475-V479 WeakPolarHBondContact O-CG2 3.38Å; Y475-V479 PolarHBondContact O-N 3.3Å; E476-V479 PolarHBondContact O-N 2.82Å; V479-R481 VanDerWaalsContact C-N 3.31Å; V479-R481 PolarHBondContact O-N 3.18Å; V479-C482 PolarHBondContact O-N 3.38Å; V479-G483 PolarHBondContact O-N 3.3Å
480	N	78.2	Confident	75.7	Confident	92 Å²	92	109.2 Å²	109.2	49%	0.492	54%	0.541	S	S	.	.	H	α-helix	trans	-59	-42.9	173.2	-74.9	-37.8	0	0	0	111.4	E476 D477 G483 E484	E476-N480 WeakPolarHBondContact O-CB 3.23Å; E476-N480 VanDerWaalsContact O-CG 3.29Å; E476-N480 PolarHBondContact O-N 3.12Å; E476-N480 PolarHBondContact O-ND2 3.38Å; E476-N480 VanDerWaalsContact O-ND2 3.08Å; D477-N480 PolarHBondContact O-N 3.12Å; N480-G483 CarbonylContact O-C 3.49Å; N480-G483 PolarHBondContact O-N 2.95Å; N480-E484 PolarHBondContact O-N 3.29Å
481	R	82.9	Confident	76.5	Confident	154 Å²	154	107.5 Å²	107.5	58%	0.581	53%	0.533	S	S	*	.	H	α-helix	trans	-67.7	-39.5	177.9	-168.2	56.9	166.3	-174.7	-3.4	113.2	D477 M478 V479 G483 E484 L485	D477-R481 VanDerWaalsContact O-CB 3.31Å; D477-R481 WeakPolarHBondContact O-CB 3.35Å; D477-R481 PolarHBondContact O-N 2.87Å; M478-R481 PolarHBondContact O-N 3.09Å; V479-R481 VanDerWaalsContact C-N 3.31Å; V479-R481 PolarHBondContact O-N 3.18Å; R481-G483 VanDerWaalsContact C-N 3.34Å; R481-E484 VanDerWaalsContact CD-OE2 3.26Å; R481-E484 WeakPolarHBondContact CD-OE2 3.13Å; R481-E484 IonicContact CZ-OE2 3.86Å; R481-E484 IonicContact NE-OE2 3.55Å; R481-E484 IonicContact NH1-OE2 3.1Å; R481-E484 PolarHBondContact NH1-OE2 2.95Å; R481-E484 WeakPolarHBondContact O-CB 3.47Å; R481-E484 PolarHBondContact O-N 3.37Å; R481-L485 WeakPolarHBondContact O-CG 3.38Å; R481-L485 PolarHBondContact O-N 2.95Å
482	C	77.5	Confident	77.3	Confident	70 Å²	70	106.9 Å²	106.9	47%	0.473	53%	0.531	S	S	.	.	H	α-helix	trans	-61.3	-44	170.4	-71.7	0	0	0	0	110.9	M478 V479 E484 L485 D486	M478-C482 PolarHBondContact O-N 3Å; M478-C482 PolarHBondContact O-SG 3.09Å; M478-C482 VanDerWaalsContact O-SG 3.33Å; V479-C482 PolarHBondContact O-N 3.38Å; C482-E484 VanDerWaalsContact C-N 3.27Å; C482-E484 PolarHBondContact O-N 2.93Å; C482-L485 PolarHBondContact O-N 2.61Å; C482-L485 VanDerWaalsContact O-N 3.11Å; C482-D486 PolarHBondContact O-N 2.69Å
483	G	83.3	Confident	78.5	Confident	28 Å²	28	106.3 Å²	106.3	29%	0.289	53%	0.525	S	S	.	.	H	α-helix	trans	-64.7	-24.6	175.9	0	0	0	0	0	114.5	V479 N480 R481 R487	V479-G483 PolarHBondContact O-N 3.3Å; N480-G483 CarbonylContact O-C 3.49Å; N480-G483 PolarHBondContact O-N 2.95Å; R481-G483 VanDerWaalsContact C-N 3.34Å; G483-R487 WeakPolarHBondContact O-CG 3.47Å; G483-R487 PolarHBondContact O-NE 2.99Å; G483-R487 PolarHBondContact O-NH2 3.47Å
484	E	84	Confident	79.8	Confident	85 Å²	85	107.3 Å²	107.3	40%	0.397	53%	0.526	S	S	.	.	H	α-helix	trans	-72.9	-46.6	167.3	-72.8	-179.5	157.8	0	0	112.2	N480 R481 C482 R487 A488	N480-E484 PolarHBondContact O-N 3.29Å; R481-E484 VanDerWaalsContact CD-OE2 3.26Å; R481-E484 WeakPolarHBondContact CD-OE2 3.13Å; R481-E484 IonicContact CZ-OE2 3.86Å; R481-E484 IonicContact NE-OE2 3.55Å; R481-E484 IonicContact NH1-OE2 3.1Å; R481-E484 PolarHBondContact NH1-OE2 2.95Å; R481-E484 WeakPolarHBondContact O-CB 3.47Å; R481-E484 PolarHBondContact O-N 3.37Å; C482-E484 VanDerWaalsContact C-N 3.27Å; C482-E484 PolarHBondContact O-N 2.93Å; E484-R487 PolarHBondContact O-N 2.86Å; E484-A488 PolarHBondContact O-N 3.44Å
485	L	82.8	Confident	80.9	Confident	103 Å²	103	106.1 Å²	106.1	54%	0.539	52%	0.519	S	S	.	.	H	α-helix	trans	-63.2	-42.2	179.9	-69.6	170.4	0	0	0	111.7	R481 C482 R487 A488 L489	R481-L485 WeakPolarHBondContact O-CG 3.38Å; R481-L485 PolarHBondContact O-N 2.95Å; C482-L485 PolarHBondContact O-N 2.61Å; C482-L485 VanDerWaalsContact O-N 3.11Å; L485-R487 VanDerWaalsContact C-N 3.32Å; L485-R487 PolarHBondContact O-N 3.2Å; L485-A488 PolarHBondContact O-N 2.91Å; L485-L489 VanDerWaalsContact O-CB 3.3Å; L485-L489 WeakPolarHBondContact O-CB 3.21Å; L485-L489 PolarHBondContact O-N 2.85Å
486	D	86.7	Confident	82	Confident	96 Å²	96	101.6 Å²	101.6	51%	0.513	51%	0.509	S	S	.	.	H	α-helix	trans	-62.1	-36.6	176.1	-77.6	-13.6	0	0	0	112.6	C482 K490	C482-D486 PolarHBondContact O-N 2.69Å; D486-K490 WeakPolarHBondContact O-CG 3.42Å; D486-K490 PolarHBondContact O-N 3.17Å
487	R	86.3	Confident	82.9	Confident	162 Å²	162	98.2 Å²	98.2	61%	0.611	50%	0.5	S	S	*	.	H	α-helix	trans	-68.3	-42.9	174.8	-80.7	177.8	-75.9	137	-7	111.5	G483 E484 L485 L489 Q491	G483-R487 WeakPolarHBondContact O-CG 3.47Å; G483-R487 PolarHBondContact O-NE 2.99Å; G483-R487 PolarHBondContact O-NH2 3.47Å; E484-R487 PolarHBondContact O-N 2.86Å; L485-R487 VanDerWaalsContact C-N 3.32Å; L485-R487 PolarHBondContact O-N 3.2Å; R487-L489 VanDerWaalsContact C-N 3.34Å; R487-Q491 PolarHBondContact O-N 3.22Å; R487-Q491 VanDerWaalsContact O-N 3.13Å
488	A	86.7	Confident	83.5	Confident	52 Å²	52	99 Å²	99	43%	0.43	50%	0.498	S	S	.	.	H	α-helix	trans	-66	-37	176.2	0	0	0	0	0	112.2	E484 L485 Q491 K492	E484-A488 PolarHBondContact O-N 3.44Å; L485-A488 PolarHBondContact O-N 2.91Å; A488-Q491 PolarHBondContact O-N 2.85Å; A488-K492 WeakPolarHBondContact O-CG 3.26Å; A488-K492 PolarHBondContact O-N 2.88Å; A488-K492 VanDerWaalsContact O-N 3.1Å
489	L	84.4	Confident	84.4	Confident	97 Å²	97	99.4 Å²	99.4	51%	0.508	50%	0.501	S	S	.	.	H	α-helix	trans	-67.4	-47.1	178.6	-166.7	147.7	0	0	0	110.9	L485 R487 Q491 K492 E493	L485-L489 VanDerWaalsContact O-CB 3.3Å; L485-L489 WeakPolarHBondContact O-CB 3.21Å; L485-L489 PolarHBondContact O-N 2.85Å; R487-L489 VanDerWaalsContact C-N 3.34Å; L489-Q491 VanDerWaalsContact C-N 3.33Å; L489-Q491 PolarHBondContact O-N 3.49Å; L489-K492 CarbonylContact O-C 3.54Å; L489-K492 WeakPolarHBondContact O-CA 3.04Å; L489-K492 PolarHBondContact O-N 3.13Å; L489-E493 HydrophobicContact CD2-CG 4.09Å; L489-E493 WeakPolarHBondContact CD2-OE1 3.35Å; L489-E493 WeakPolarHBondContact O-CG 3.16Å; L489-E493 PolarHBondContact O-N 3.34Å
490	K	86.1	Confident	84.7	Confident	131 Å²	131	99.6 Å²	99.6	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-57.6	-41.5	172.9	-75.1	175.1	-179.9	177.3	0	113.2	D486 K492 E493 E494	D486-K490 WeakPolarHBondContact O-CG 3.42Å; D486-K490 PolarHBondContact O-N 3.17Å; K490-K492 VanDerWaalsContact C-N 3.27Å; K490-K492 PolarHBondContact O-N 3.37Å; K490-E493 PolarHBondContact O-N 2.85Å; K490-E494 PolarHBondContact O-N 3.16Å
491	Q	87.7	Confident	85.1	Confident	113 Å²	113	99 Å²	99	53%	0.528	50%	0.499	S	S	.	.	H	α-helix	trans	-60.5	-38.8	174.4	-176.2	-175.3	-20.1	0	0	111.6	R487 A488 L489 E494 E495	R487-Q491 PolarHBondContact O-N 3.22Å; R487-Q491 VanDerWaalsContact O-N 3.13Å; A488-Q491 PolarHBondContact O-N 2.85Å; L489-Q491 VanDerWaalsContact C-N 3.33Å; L489-Q491 PolarHBondContact O-N 3.49Å; Q491-E494 PolarHBondContact O-N 3.13Å; Q491-E495 PolarHBondContact NE2-OE1 3.42Å; Q491-E495 WeakPolarHBondContact O-CG 3.34Å; Q491-E495 PolarHBondContact O-N 3.09Å; Q491-E495 VanDerWaalsContact O-N 3.1Å
492	K	86.2	Confident	85.4	Confident	116 Å²	116	94.9 Å²	94.9	50%	0.504	49%	0.494	S	S	.	.	H	α-helix	trans	-72.6	-34	176.9	-69.7	-67.4	168.7	-144.9	0	113.1	A488 L489 K490 E495 V496	A488-K492 WeakPolarHBondContact O-CG 3.26Å; A488-K492 PolarHBondContact O-N 2.88Å; A488-K492 VanDerWaalsContact O-N 3.1Å; L489-K492 CarbonylContact O-C 3.54Å; L489-K492 WeakPolarHBondContact O-CA 3.04Å; L489-K492 PolarHBondContact O-N 3.13Å; K490-K492 VanDerWaalsContact C-N 3.27Å; K490-K492 PolarHBondContact O-N 3.37Å; K492-E495 IonicContact NZ-OE1 2.7Å; K492-E495 PolarHBondContact NZ-OE1 3.19Å; K492-E495 IonicContact NZ-OE2 2.61Å; K492-E495 PolarHBondContact NZ-OE2 3Å; K492-E495 PolarHBondContact O-N 2.92Å; K492-V496 WeakPolarHBondContact O-CG2 3.41Å; K492-V496 PolarHBondContact O-N 3.38Å
493	E	86	Confident	85.7	Confident	109 Å²	109	96.5 Å²	96.5	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-60.4	-44.1	170	-68.2	173.8	148.7	0	0	111.2	L489 K490 E495 V496 C497	L489-E493 HydrophobicContact CD2-CG 4.09Å; L489-E493 WeakPolarHBondContact CD2-OE1 3.35Å; L489-E493 WeakPolarHBondContact O-CG 3.16Å; L489-E493 PolarHBondContact O-N 3.34Å; K490-E493 PolarHBondContact O-N 2.85Å; E493-E495 PolarHBondContact O-N 2.96Å; E493-V496 PolarHBondContact O-N 3.43Å; E493-C497 PolarHBondContact O-N 3.5Å; E493-C497 PolarHBondContact O-SG 3.34Å
494	E	86.5	Confident	85.8	Confident	115 Å²	115	100.7 Å²	100.7	54%	0.537	51%	0.508	S	S	.	.	H	α-helix	trans	-62.8	-38.3	174.5	-72.7	-176.1	-158.4	0	0	113.7	K490 Q491 K498	K490-E494 PolarHBondContact O-N 3.16Å; Q491-E494 PolarHBondContact O-N 3.13Å; E494-K498 WeakPolarHBondContact O-CD 3.42Å; E494-K498 WeakPolarHBondContact O-CG 3.29Å; E494-K498 PolarHBondContact O-N 3.11Å; E494-K498 VanDerWaalsContact O-N 3.15Å; E494-K498 IonicContact OE2-NZ 2.68Å
495	E	88.2	Confident	85.9	Confident	69 Å²	69	98.8 Å²	98.8	32%	0.322	51%	0.511	S	S	.	.	H	α-helix	trans	-65	-42.4	174.2	-73.7	175.4	-150	0	0	111.3	Q491 K492 E493 K498 L499	Q491-E495 PolarHBondContact NE2-OE1 3.42Å; Q491-E495 WeakPolarHBondContact O-CG 3.34Å; Q491-E495 PolarHBondContact O-N 3.09Å; Q491-E495 VanDerWaalsContact O-N 3.1Å; K492-E495 IonicContact NZ-OE1 2.7Å; K492-E495 PolarHBondContact NZ-OE1 3.19Å; K492-E495 IonicContact NZ-OE2 2.61Å; K492-E495 PolarHBondContact NZ-OE2 3Å; K492-E495 PolarHBondContact O-N 2.92Å; E493-E495 PolarHBondContact O-N 2.96Å; E495-K498 PolarHBondContact O-N 2.97Å; E495-L499 WeakPolarHBondContact O-CG 3.47Å; E495-L499 PolarHBondContact O-N 3.01Å
496	V	85.4	Confident	86.1	Confident	72 Å²	72	99.1 Å²	99.1	44%	0.436	51%	0.513	S	S	.	.	H	α-helix	trans	-63	-44	175.5	169.6	0	0	0	0	111.2	K492 E493 K498 L499 Q500	K492-V496 WeakPolarHBondContact O-CG2 3.41Å; K492-V496 PolarHBondContact O-N 3.38Å; E493-V496 PolarHBondContact O-N 3.43Å; V496-K498 VanDerWaalsContact C-N 3.33Å; V496-K498 PolarHBondContact O-N 3.32Å; V496-L499 PolarHBondContact O-N 3.37Å; V496-Q500 HydrophobicContact CG1-CG 4.26Å; V496-Q500 WeakPolarHBondContact O-CB 3.43Å; V496-Q500 WeakPolarHBondContact O-CG 3.48Å; V496-Q500 PolarHBondContact O-N 2.84Å
497	C	84.9	Confident	86	Confident	71 Å²	71	98.6 Å²	98.6	48%	0.48	51%	0.507	S	S	.	.	H	α-helix	trans	-58.4	-42.5	175.5	-70.8	0	0	0	0	112.2	E493 Q500 S501	E493-C497 PolarHBondContact O-N 3.5Å; E493-C497 PolarHBondContact O-SG 3.34Å; C497-Q500 PolarHBondContact O-N 2.76Å; C497-S501 PolarHBondContact O-N 3.06Å; C497-S501 PolarHBondContact O-OG 3.29Å
498	K	86.3	Confident	85.9	Confident	133 Å²	133	94.8 Å²	94.8	58%	0.578	50%	0.499	S	S	*	.	H	α-helix	trans	-64.8	-40.3	176.3	-70.6	161.9	-170.2	155.3	0	111.9	E494 E495 V496 S502	E494-K498 WeakPolarHBondContact O-CD 3.42Å; E494-K498 WeakPolarHBondContact O-CG 3.29Å; E494-K498 PolarHBondContact O-N 3.11Å; E494-K498 VanDerWaalsContact O-N 3.15Å; E494-K498 IonicContact OE2-NZ 2.68Å; E495-K498 PolarHBondContact O-N 2.97Å; V496-K498 VanDerWaalsContact C-N 3.33Å; V496-K498 PolarHBondContact O-N 3.32Å; K498-S502 WeakPolarHBondContact O-CB 3.29Å; K498-S502 PolarHBondContact O-N 3.39Å; K498-S502 VanDerWaalsContact O-N 3.12Å
499	L	86.1	Confident	85.9	Confident	123 Å²	123	94.9 Å²	94.9	64%	0.644	50%	0.499	S	S	*	.	H	α-helix	trans	-67.8	-39.5	175.7	-71.5	172	0	0	0	112.1	E495 V496 S502 M503	E495-L499 WeakPolarHBondContact O-CG 3.47Å; E495-L499 PolarHBondContact O-N 3.01Å; V496-L499 PolarHBondContact O-N 3.37Å; L499-S502 WeakPolarHBondContact O-CB 3.45Å; L499-S502 PolarHBondContact O-N 2.95Å; L499-M503 WeakPolarHBondContact O-CB 3.48Å; L499-M503 PolarHBondContact O-N 2.95Å
500	Q	83.5	Confident	85.8	Confident	100 Å²	100	96 Å²	96	47%	0.467	51%	0.506	S	S	.	.	H	α-helix	trans	-62	-48.9	175	-76.2	174.1	-24	0	0	111.5	V496 C497 S502 M503 E504	V496-Q500 HydrophobicContact CG1-CG 4.26Å; V496-Q500 WeakPolarHBondContact O-CB 3.43Å; V496-Q500 WeakPolarHBondContact O-CG 3.48Å; V496-Q500 PolarHBondContact O-N 2.84Å; C497-Q500 PolarHBondContact O-N 2.76Å; Q500-S502 VanDerWaalsContact C-N 3.27Å; Q500-S502 PolarHBondContact O-N 3.45Å; Q500-M503 WeakPolarHBondContact O-CB 3.46Å; Q500-M503 PolarHBondContact O-N 2.89Å; Q500-M503 VanDerWaalsContact O-N 3.09Å; Q500-E504 WeakPolarHBondContact O-CG 3.47Å; Q500-E504 PolarHBondContact O-N 2.98Å
501	S	85.8	Confident	85.7	Confident	79 Å²	79	95.6 Å²	95.6	55%	0.552	50%	0.5	S	S	*	.	H	α-helix	trans	-58.5	-37.5	174.7	-59.5	0	0	0	0	113	C497 G505	C497-S501 PolarHBondContact O-N 3.06Å; C497-S501 PolarHBondContact O-OG 3.29Å; S501-G505 PolarHBondContact O-N 2.91Å; S501-G505 VanDerWaalsContact O-N 3.12Å
502	S	90.1	Very high	85.5	Confident	69 Å²	69	93.5 Å²	93.5	48%	0.483	50%	0.497	S	S	.	.	H	α-helix	trans	-68	-39.9	175	-170.3	0	0	0	0	112.3	K498 L499 Q500 G505 L506	K498-S502 WeakPolarHBondContact O-CB 3.29Å; K498-S502 PolarHBondContact O-N 3.39Å; K498-S502 VanDerWaalsContact O-N 3.12Å; L499-S502 WeakPolarHBondContact O-CB 3.45Å; L499-S502 PolarHBondContact O-N 2.95Å; Q500-S502 VanDerWaalsContact C-N 3.27Å; Q500-S502 PolarHBondContact O-N 3.45Å; S502-G505 PolarHBondContact O-N 2.67Å; S502-L506 WeakPolarHBondContact O-CG 3.5Å; S502-L506 PolarHBondContact O-N 2.94Å
503	M	83.2	Confident	85.4	Confident	104 Å²	104	90 Å²	90	51%	0.512	49%	0.49	S	S	.	.	H	α-helix	trans	-66.8	-42.7	177.4	-175.4	174.1	66.8	0	0	111.9	L499 Q500 G505 L506 Q507	L499-M503 WeakPolarHBondContact O-CB 3.48Å; L499-M503 PolarHBondContact O-N 2.95Å; Q500-M503 WeakPolarHBondContact O-CB 3.46Å; Q500-M503 PolarHBondContact O-N 2.89Å; Q500-M503 VanDerWaalsContact O-N 3.09Å; M503-G505 PolarHBondContact O-N 2.91Å; M503-L506 PolarHBondContact O-N 3.22Å; M503-Q507 WeakPolarHBondContact O-CG 3.38Å; M503-Q507 PolarHBondContact O-N 2.65Å
504	E	84.1	Confident	85.1	Confident	116 Å²	116	90.9 Å²	90.9	54%	0.542	49%	0.494	S	S	.	.	H	α-helix	trans	-59.3	-45.6	173.4	-71.6	178.1	169.5	0	0	111.1	Q500 L506 Q507 D508	Q500-E504 WeakPolarHBondContact O-CG 3.47Å; Q500-E504 PolarHBondContact O-N 2.98Å; E504-L506 VanDerWaalsContact C-N 3.34Å; E504-L506 PolarHBondContact O-N 3.39Å; E504-Q507 PolarHBondContact O-N 2.87Å; E504-Q507 VanDerWaalsContact O-N 3.17Å; E504-D508 PolarHBondContact O-N 3.41Å
505	G	86.9	Confident	84.9	Confident	44 Å²	44	92.2 Å²	92.2	45%	0.454	50%	0.498	S	S	.	.	H	α-helix	trans	-60.7	-37.9	175.3	0	0	0	0	0	113.9	S501 S502 M503 A509	S501-G505 PolarHBondContact O-N 2.91Å; S501-G505 VanDerWaalsContact O-N 3.12Å; S502-G505 PolarHBondContact O-N 2.67Å; M503-G505 PolarHBondContact O-N 2.91Å; G505-A509 WeakPolarHBondContact O-CB 3.47Å; G505-A509 PolarHBondContact O-N 3.16Å
506	L	87	Confident	84.7	Confident	111 Å²	111	96.9 Å²	96.9	58%	0.581	51%	0.512	S	S	*	.	H	α-helix	trans	-70.2	-37.5	173.6	-72.8	172	0	0	0	112.4	S502 M503 E504 A509 L510	S502-L506 WeakPolarHBondContact O-CG 3.5Å; S502-L506 PolarHBondContact O-N 2.94Å; M503-L506 PolarHBondContact O-N 3.22Å; E504-L506 VanDerWaalsContact C-N 3.34Å; E504-L506 PolarHBondContact O-N 3.39Å; L506-A509 PolarHBondContact O-N 2.89Å; L506-L510 WeakPolarHBondContact O-CG 3.49Å; L506-L510 PolarHBondContact O-N 3.29Å
507	Q	85	Confident	84.6	Confident	85 Å²	85	95.2 Å²	95.2	40%	0.397	51%	0.51	S	S	.	.	H	α-helix	trans	-65.5	-39.5	174.3	-73.2	177.3	3.2	0	0	111.9	M503 E504 L510 R511	M503-Q507 WeakPolarHBondContact O-CG 3.38Å; M503-Q507 PolarHBondContact O-N 2.65Å; E504-Q507 PolarHBondContact O-N 2.87Å; E504-Q507 VanDerWaalsContact O-N 3.17Å; Q507-L510 PolarHBondContact O-N 2.91Å; Q507-R511 WeakPolarHBondContact O-CG 3.5Å; Q507-R511 PolarHBondContact O-N 3.17Å
508	D	83.9	Confident	84.4	Confident	81 Å²	81	95.2 Å²	95.2	43%	0.433	51%	0.505	S	S	.	.	H	α-helix	trans	-66.1	-39.6	172.2	-88.7	-39.9	0	0	0	112.4	E504 L510 R511 C512	E504-D508 PolarHBondContact O-N 3.41Å; D508-L510 VanDerWaalsContact C-N 3.31Å; D508-L510 PolarHBondContact O-N 2.88Å; D508-R511 PolarHBondContact O-N 3.37Å; D508-R511 IonicContact OD1-CZ 3.6Å; D508-R511 IonicContact OD1-NE 3.17Å; D508-R511 PolarHBondContact OD1-NE 3.39Å; D508-R511 IonicContact OD1-NH2 3.72Å; D508-R511 PolarHBondContact OD1-NH2 3.25Å; D508-R511 IonicContact OD2-NH2 2.94Å; D508-R511 PolarHBondContact OD2-NH2 3.5Å; D508-C512 WeakPolarHBondContact O-CB 3.37Å; D508-C512 PolarHBondContact O-N 2.72Å; D508-C512 PolarHBondContact O-SG 2.99Å
509	A	86.5	Confident	84.2	Confident	54 Å²	54	94.2 Å²	94.2	45%	0.446	51%	0.506	S	S	.	.	H	α-helix	trans	-60.8	-40.4	173.3	0	0	0	0	0	112	G505 L506 C512 A513	G505-A509 WeakPolarHBondContact O-CB 3.47Å; G505-A509 PolarHBondContact O-N 3.16Å; L506-A509 PolarHBondContact O-N 2.89Å; A509-C512 PolarHBondContact O-N 3.32Å; A509-A513 WeakPolarHBondContact O-CB 3.41Å; A509-A513 PolarHBondContact O-N 3.4Å
510	L	82.7	Confident	84.1	Confident	122 Å²	122	90.9 Å²	90.9	64%	0.639	50%	0.496	S	S	*	.	H	α-helix	trans	-66.6	-44	173.6	-74.9	170.9	0	0	0	112.3	L506 Q507 D508 C512 A513 H514	L506-L510 WeakPolarHBondContact O-CG 3.49Å; L506-L510 PolarHBondContact O-N 3.29Å; Q507-L510 PolarHBondContact O-N 2.91Å; D508-L510 VanDerWaalsContact C-N 3.31Å; D508-L510 PolarHBondContact O-N 2.88Å; L510-C512 VanDerWaalsContact C-N 3.29Å; L510-C512 PolarHBondContact O-N 3.01Å; L510-A513 PolarHBondContact O-N 3.44Å; L510-A513 VanDerWaalsContact O-N 3.12Å; L510-H514 WeakPolarHBondContact O-CB 3.35Å; L510-H514 PolarHBondContact O-N 2.9Å
511	R	83.6	Confident	84.1	Confident	122 Å²	122	93 Å²	93	46%	0.46	51%	0.506	S	S	.	.	H	α-helix	trans	-57.4	-42	173.1	-77.3	-172.2	-76.6	-97.9	8.2	111.9	Q507 D508 H514 K515	Q507-R511 WeakPolarHBondContact O-CG 3.5Å; Q507-R511 PolarHBondContact O-N 3.17Å; D508-R511 PolarHBondContact O-N 3.37Å; D508-R511 IonicContact OD1-CZ 3.6Å; D508-R511 IonicContact OD1-NE 3.17Å; D508-R511 PolarHBondContact OD1-NE 3.39Å; D508-R511 IonicContact OD1-NH2 3.72Å; D508-R511 PolarHBondContact OD1-NH2 3.25Å; D508-R511 IonicContact OD2-NH2 2.94Å; D508-R511 PolarHBondContact OD2-NH2 3.5Å; R511-H514 PolarHBondContact O-N 2.88Å; R511-K515 WeakPolarHBondContact O-CG 3.5Å; R511-K515 PolarHBondContact O-N 3.33Å; R511-K515 VanDerWaalsContact O-N 3.15Å
512	C	82.9	Confident	83.9	Confident	68 Å²	68	97.8 Å²	97.8	46%	0.459	51%	0.512	S	S	.	.	H	α-helix	trans	-69.3	-35	176.3	-65.5	0	0	0	0	112.4	D508 A509 L510 R516	D508-C512 WeakPolarHBondContact O-CB 3.37Å; D508-C512 PolarHBondContact O-N 2.72Å; D508-C512 PolarHBondContact O-SG 2.99Å; A509-C512 PolarHBondContact O-N 3.32Å; L510-C512 VanDerWaalsContact C-N 3.29Å; L510-C512 PolarHBondContact O-N 3.01Å; C512-R516 WeakPolarHBondContact O-CG 3.26Å; C512-R516 PolarHBondContact O-N 3.3Å; C512-R516 PolarHBondContact O-NE 3.24Å
513	A	84.2	Confident	83.6	Confident	42 Å²	42	102.5 Å²	102.5	35%	0.347	52%	0.519	S	S	.	.	H	α-helix	trans	-68.3	-40.7	174.2	0	0	0	0	0	112.3	A509 L510 R516 G517	A509-A513 WeakPolarHBondContact O-CB 3.41Å; A509-A513 PolarHBondContact O-N 3.4Å; L510-A513 PolarHBondContact O-N 3.44Å; L510-A513 VanDerWaalsContact O-N 3.12Å; A513-R516 PolarHBondContact O-N 3.37Å; A513-G517 PolarHBondContact O-N 3.46Å
514	H	80.8	Confident	83.6	Confident	128 Å²	128	100.9 Å²	100.9	59%	0.593	52%	0.517	S	S	*	.	H	α-helix	trans	-62.4	-50	177.7	-169.3	47.3	0	0	0	111.4	L510 R511 R516 G517 D518	L510-H514 WeakPolarHBondContact O-CB 3.35Å; L510-H514 PolarHBondContact O-N 2.9Å; R511-H514 PolarHBondContact O-N 2.88Å; H514-R516 VanDerWaalsContact C-N 3.28Å; H514-R516 PolarHBondContact O-N 3.06Å; H514-G517 CarbonylContact O-C 3.48Å; H514-G517 VanDerWaalsContact O-CA 3.25Å; H514-G517 WeakPolarHBondContact O-CA 3.33Å; H514-G517 PolarHBondContact O-N 2.9Å; H514-D518 IonicContact CD2-OD2 2.61Å; H514-D518 IonicContact CE1-OD1 2.74Å; H514-D518 IonicContact ND1-OD1 3.36Å; H514-D518 PolarHBondContact O-N 2.67Å
515	K	83	Confident	83.6	Confident	143 Å²	143	97 Å²	97	62%	0.622	51%	0.508	S	S	*	.	H	α-helix	trans	-53.9	-41.7	174.4	-72.2	-178.4	178.2	-176.2	0	113.3	R511 G517 D518 D519	R511-K515 WeakPolarHBondContact O-CG 3.5Å; R511-K515 PolarHBondContact O-N 3.33Å; R511-K515 VanDerWaalsContact O-N 3.15Å; K515-G517 VanDerWaalsContact C-N 3.28Å; K515-G517 PolarHBondContact O-N 2.94Å; K515-D518 PolarHBondContact O-N 3.5Å; K515-D519 WeakPolarHBondContact O-CB 3.43Å; K515-D519 VanDerWaalsContact O-CG 3.26Å; K515-D519 PolarHBondContact O-N 3.33Å
516	R	82.4	Confident	83.4	Confident	167 Å²	167	99.3 Å²	99.3	63%	0.63	51%	0.507	S	S	*	.	H	α-helix	trans	-67.1	-28.6	174.7	-70.3	-177.6	-57.8	-146.8	0	113	C512 A513 H514 A520	C512-R516 WeakPolarHBondContact O-CG 3.26Å; C512-R516 PolarHBondContact O-N 3.3Å; C512-R516 PolarHBondContact O-NE 3.24Å; A513-R516 PolarHBondContact O-N 3.37Å; H514-R516 VanDerWaalsContact C-N 3.28Å; H514-R516 PolarHBondContact O-N 3.06Å; R516-A520 VanDerWaalsContact O-CB 3.25Å; R516-A520 WeakPolarHBondContact O-CB 3.39Å; R516-A520 PolarHBondContact O-N 3.03Å; R516-A520 VanDerWaalsContact O-N 3.12Å
517	G	83.1	Confident	83.4	Confident	38 Å²	38	98.7 Å²	98.7	39%	0.392	50%	0.504	S	S	.	.	H	α-helix	trans	-68.1	-46.5	170.8	0	0	0	0	0	111.6	A513 H514 K515 A520 Q521	A513-G517 PolarHBondContact O-N 3.46Å; H514-G517 CarbonylContact O-C 3.48Å; H514-G517 VanDerWaalsContact O-CA 3.25Å; H514-G517 WeakPolarHBondContact O-CA 3.33Å; H514-G517 PolarHBondContact O-N 2.9Å; K515-G517 VanDerWaalsContact C-N 3.28Å; K515-G517 PolarHBondContact O-N 2.94Å; G517-A520 PolarHBondContact O-N 3.46Å; G517-Q521 WeakPolarHBondContact O-CB 3.13Å; G517-Q521 PolarHBondContact O-N 2.85Å
518	D	82.6	Confident	83.5	Confident	71 Å²	71	101.1 Å²	101.1	38%	0.38	52%	0.516	S	S	.	.	H	α-helix	trans	-62.8	-46.2	177.5	-52.9	-32.9	0	0	0	111.3	H514 K515 A520 Q521 W522	H514-D518 IonicContact CD2-OD2 2.61Å; H514-D518 IonicContact CE1-OD1 2.74Å; H514-D518 IonicContact ND1-OD1 3.36Å; H514-D518 PolarHBondContact O-N 2.67Å; K515-D518 PolarHBondContact O-N 3.5Å; D518-A520 VanDerWaalsContact C-N 3.3Å; D518-A520 PolarHBondContact O-N 3.03Å; D518-Q521 PolarHBondContact O-N 2.88Å; D518-W522 PolarHBondContact O-N 3.3Å
519	D	80.7	Confident	83.5	Confident	112 Å²	112	99.4 Å²	99.4	60%	0.599	51%	0.512	S	S	*	.	H	α-helix	trans	-58.2	-41.1	174.1	-72.5	-25.3	0	0	0	111.6	K515 R523	K515-D519 WeakPolarHBondContact O-CB 3.43Å; K515-D519 VanDerWaalsContact O-CG 3.26Å; K515-D519 PolarHBondContact O-N 3.33Å; D519-R523 WeakPolarHBondContact O-CB 3.46Å; D519-R523 PolarHBondContact O-N 2.97Å; D519-R523 VanDerWaalsContact O-N 3.12Å
520	A	84	Confident	83.6	Confident	52 Å²	52	100.5 Å²	100.5	43%	0.43	51%	0.511	S	S	.	.	H	α-helix	trans	-69.2	-39.4	176.7	0	0	0	0	0	111.9	R516 G517 D518 R523 C524	R516-A520 VanDerWaalsContact O-CB 3.25Å; R516-A520 WeakPolarHBondContact O-CB 3.39Å; R516-A520 PolarHBondContact O-N 3.03Å; R516-A520 VanDerWaalsContact O-N 3.12Å; G517-A520 PolarHBondContact O-N 3.46Å; D518-A520 VanDerWaalsContact C-N 3.3Å; D518-A520 PolarHBondContact O-N 3.03Å; A520-R523 PolarHBondContact O-N 2.82Å; A520-C524 PolarHBondContact O-N 2.95Å; A520-C524 PolarHBondContact O-SG 3.48Å; A520-C524 VanDerWaalsContact O-SG 3.32Å
521	Q	83.9	Confident	83.9	Confident	144 Å²	144	100.6 Å²	100.6	67%	0.673	51%	0.511	S	S	*	.	H	α-helix	trans	-66.1	-42.4	176.8	-175.9	174.1	-7.4	0	0	111.6	G517 D518 R523 C524 G525	G517-Q521 WeakPolarHBondContact O-CB 3.13Å; G517-Q521 PolarHBondContact O-N 2.85Å; D518-Q521 PolarHBondContact O-N 2.88Å; Q521-R523 VanDerWaalsContact C-N 3.31Å; Q521-R523 PolarHBondContact O-N 3.47Å; Q521-C524 PolarHBondContact O-N 2.97Å; Q521-G525 PolarHBondContact O-N 3.49Å
522	W	82.5	Confident	84.1	Confident	180 Å²	180	96.3 Å²	96.3	68%	0.682	51%	0.505	S	S	*	.	H	α-helix	trans	-58.4	-45	173.5	-176.5	80.5	0	0	0	111.4	D518 G525 E526	D518-W522 PolarHBondContact O-N 3.3Å; W522-G525 PolarHBondContact O-N 3.18Å; W522-G525 VanDerWaalsContact O-N 3.17Å; W522-E526 PolarHBondContact O-N 2.65Å
523	R	83.1	Confident	84.4	Confident	169 Å²	169	99.7 Å²	99.7	64%	0.638	51%	0.508	S	S	*	.	H	α-helix	trans	-69.4	-31.1	178.2	-170.6	157.9	166.4	141.1	-9.9	113.5	D519 A520 Q521 L527	D519-R523 WeakPolarHBondContact O-CB 3.46Å; D519-R523 PolarHBondContact O-N 2.97Å; D519-R523 VanDerWaalsContact O-N 3.12Å; A520-R523 PolarHBondContact O-N 2.82Å; Q521-R523 VanDerWaalsContact C-N 3.31Å; Q521-R523 PolarHBondContact O-N 3.47Å; R523-L527 VanDerWaalsContact O-CG 3.28Å; R523-L527 WeakPolarHBondContact O-CG 3.31Å; R523-L527 PolarHBondContact O-N 3.14Å; R523-L527 VanDerWaalsContact O-N 3.11Å
524	C	83.6	Confident	84.6	Confident	69 Å²	69	99.9 Å²	99.9	47%	0.466	51%	0.51	S	S	.	.	H	α-helix	trans	-64.6	-44.8	167.4	-73.5	0	0	0	0	111.2	A520 Q521 E526 L527 E528	A520-C524 PolarHBondContact O-N 2.95Å; A520-C524 PolarHBondContact O-SG 3.48Å; A520-C524 VanDerWaalsContact O-SG 3.32Å; Q521-C524 PolarHBondContact O-N 2.97Å; C524-E526 VanDerWaalsContact C-N 3.34Å; C524-E526 PolarHBondContact O-N 3.43Å; C524-L527 PolarHBondContact O-N 3.46Å; C524-E528 WeakPolarHBondContact O-CB 3.36Å; C524-E528 WeakPolarHBondContact O-CG 3.44Å; C524-E528 PolarHBondContact O-N 2.94Å
525	G	84.3	Confident	85.1	Confident	34 Å²	34	102.8 Å²	102.8	35%	0.351	52%	0.515	S	S	.	.	H	α-helix	trans	-62	-37.4	176.1	0	0	0	0	0	113.6	Q521 W522 E528 A529	Q521-G525 PolarHBondContact O-N 3.49Å; W522-G525 PolarHBondContact O-N 3.18Å; W522-G525 VanDerWaalsContact O-N 3.17Å; G525-E528 PolarHBondContact O-N 3.08Å; G525-A529 WeakPolarHBondContact O-CB 3.5Å; G525-A529 PolarHBondContact O-N 2.99Å
526	E	81	Confident	85.4	Confident	93 Å²	93	101.1 Å²	101.1	44%	0.435	51%	0.513	S	S	.	.	H	α-helix	trans	-62.7	-47.2	172.8	-172.2	175.7	-143.2	0	0	111.5	W522 C524 A529 D530	W522-E526 PolarHBondContact O-N 2.65Å; C524-E526 VanDerWaalsContact C-N 3.34Å; C524-E526 PolarHBondContact O-N 3.43Å; E526-A529 PolarHBondContact O-N 3.4Å; E526-D530 PolarHBondContact O-N 2.9Å
527	L	86.9	Confident	85.8	Confident	98 Å²	98	99.1 Å²	99.1	51%	0.513	51%	0.511	S	S	.	.	H	α-helix	trans	-65.3	-36.5	176.6	-71.5	170.3	0	0	0	113	R523 C524 D530 L531	R523-L527 VanDerWaalsContact O-CG 3.28Å; R523-L527 WeakPolarHBondContact O-CG 3.31Å; R523-L527 PolarHBondContact O-N 3.14Å; R523-L527 VanDerWaalsContact O-N 3.11Å; C524-L527 PolarHBondContact O-N 3.46Å; L527-D530 PolarHBondContact O-N 3.43Å; L527-L531 WeakPolarHBondContact O-CB 3.15Å; L527-L531 VanDerWaalsContact O-CG 3.3Å; L527-L531 WeakPolarHBondContact O-CG 3.22Å; L527-L531 PolarHBondContact O-N 3.48Å
528	E	88.8	Confident	86.1	Confident	137 Å²	137	101.6 Å²	101.6	64%	0.64	52%	0.515	S	S	*	.	H	α-helix	trans	-65.6	-39	173.6	-76.6	176.3	-177.3	0	0	111.6	C524 G525 L531 G532	C524-E528 WeakPolarHBondContact O-CB 3.36Å; C524-E528 WeakPolarHBondContact O-CG 3.44Å; C524-E528 PolarHBondContact O-N 2.94Å; G525-E528 PolarHBondContact O-N 3.08Å; E528-L531 PolarHBondContact O-N 2.95Å; E528-G532 PolarHBondContact O-N 3.09Å
529	A	83.6	Confident	86.4	Confident	44 Å²	44	99.6 Å²	99.6	36%	0.364	51%	0.511	S	S	.	.	H	α-helix	trans	-66.6	-38.3	174.1	0	0	0	0	0	112.2	G525 E526 G532 R533	G525-A529 WeakPolarHBondContact O-CB 3.5Å; G525-A529 PolarHBondContact O-N 2.99Å; E526-A529 PolarHBondContact O-N 3.4Å; A529-G532 PolarHBondContact O-N 3.07Å; A529-R533 WeakPolarHBondContact O-CG 3.46Å; A529-R533 PolarHBondContact O-N 3.48Å
530	D	89	Confident	86.8	Confident	78 Å²	78	103.3 Å²	103.3	42%	0.417	52%	0.516	S	S	.	.	H	α-helix	trans	-65.7	-42.7	171.7	-87.7	-28.9	0	0	0	112.7	E526 L527 G532 R533 A534	E526-D530 PolarHBondContact O-N 2.9Å; L527-D530 PolarHBondContact O-N 3.43Å; D530-G532 VanDerWaalsContact C-N 3.28Å; D530-G532 PolarHBondContact O-N 3.13Å; D530-R533 VanDerWaalsContact CG-NH2 3.34Å; D530-R533 PolarHBondContact O-N 3.18Å; D530-R533 IonicContact OD1-CZ 2.88Å; D530-R533 IonicContact OD1-NE 2.71Å; D530-R533 PolarHBondContact OD1-NE 2.97Å; D530-R533 IonicContact OD1-NH2 3.63Å; D530-R533 PolarHBondContact OD1-NH2 3.01Å; D530-R533 IonicContact OD2-NH2 2.68Å; D530-A534 WeakPolarHBondContact O-CB 3.14Å; D530-A534 PolarHBondContact O-N 2.92Å
531	L	87.9	Confident	87.1	Confident	124 Å²	124	104.8 Å²	104.8	65%	0.649	52%	0.517	S	S	*	.	H	α-helix	trans	-62.1	-36.4	173.4	-75	170.1	0	0	0	111.7	L527 E528 R535	L527-L531 WeakPolarHBondContact O-CB 3.15Å; L527-L531 VanDerWaalsContact O-CG 3.3Å; L527-L531 WeakPolarHBondContact O-CG 3.22Å; L527-L531 PolarHBondContact O-N 3.48Å; E528-L531 PolarHBondContact O-N 2.95Å; L531-R535 WeakPolarHBondContact O-CB 3.47Å; L531-R535 PolarHBondContact O-N 3.45Å
532	G	87.9	Confident	87.6	Confident	31 Å²	31	104.7 Å²	104.7	32%	0.32	51%	0.51	S	S	.	.	H	α-helix	trans	-59.9	-53.5	170.7	0	0	0	0	0	112.1	E528 A529 D530 A534 R535 D536	E528-G532 PolarHBondContact O-N 3.09Å; A529-G532 PolarHBondContact O-N 3.07Å; D530-G532 VanDerWaalsContact C-N 3.28Å; D530-G532 PolarHBondContact O-N 3.13Å; G532-A534 PolarHBondContact O-N 3.43Å; G532-R535 WeakPolarHBondContact O-CB 3.48Å; G532-R535 PolarHBondContact O-N 2.99Å; G532-R535 VanDerWaalsContact O-N 3.14Å; G532-D536 PolarHBondContact O-N 3.01Å
533	R	89	Confident	87.9	Confident	139 Å²	139	99.2 Å²	99.2	53%	0.525	50%	0.499	S	S	.	.	H	α-helix	trans	-55.3	-47.9	176.2	-73.8	-176.9	-79.4	-92.8	12.6	112.3	A529 D530 R535 D536 E537	A529-R533 WeakPolarHBondContact O-CG 3.46Å; A529-R533 PolarHBondContact O-N 3.48Å; D530-R533 VanDerWaalsContact CG-NH2 3.34Å; D530-R533 PolarHBondContact O-N 3.18Å; D530-R533 IonicContact OD1-CZ 2.88Å; D530-R533 IonicContact OD1-NE 2.71Å; D530-R533 PolarHBondContact OD1-NE 2.97Å; D530-R533 IonicContact OD1-NH2 3.63Å; D530-R533 PolarHBondContact OD1-NH2 3.01Å; D530-R533 IonicContact OD2-NH2 2.68Å; R533-R535 VanDerWaalsContact C-N 3.34Å; R533-R535 PolarHBondContact O-N 2.97Å; R533-D536 PolarHBondContact O-N 3.36Å; R533-E537 PolarHBondContact O-N 3.28Å
534	A	88.5	Confident	88.3	Confident	47 Å²	47	99 Å²	99	39%	0.388	50%	0.498	S	S	.	.	H	α-helix	trans	-65.2	-35.8	178.4	0	0	0	0	0	112.5	D530 G532 L538	D530-A534 WeakPolarHBondContact O-CB 3.14Å; D530-A534 PolarHBondContact O-N 2.92Å; G532-A534 PolarHBondContact O-N 3.43Å; A534-L538 WeakPolarHBondContact O-CB 3.46Å; A534-L538 VanDerWaalsContact O-CG 3.28Å; A534-L538 WeakPolarHBondContact O-CG 3.5Å; A534-L538 PolarHBondContact O-N 3.47Å
535	R	91.9	Very high	88.7	Confident	189 Å²	189	100.1 Å²	100.1	71%	0.713	50%	0.499	S	S	*	.	H	α-helix	trans	-66.6	-40.7	175.4	-178	177.6	-177.6	162.6	0.9	112	L531 G532 R533 L538 G539	L531-R535 WeakPolarHBondContact O-CB 3.47Å; L531-R535 PolarHBondContact O-N 3.45Å; G532-R535 WeakPolarHBondContact O-CB 3.48Å; G532-R535 PolarHBondContact O-N 2.99Å; G532-R535 VanDerWaalsContact O-N 3.14Å; R533-R535 VanDerWaalsContact C-N 3.34Å; R533-R535 PolarHBondContact O-N 2.97Å; R535-L538 PolarHBondContact O-N 3.48Å; R535-G539 PolarHBondContact O-N 2.9Å
536	D	88.3	Confident	89	Confident	108 Å²	108	102 Å²	102	58%	0.578	50%	0.504	S	S	*	.	H	α-helix	trans	-67.8	-40.8	176.1	-74	-13.6	0	0	0	111.6	G532 R533 G539 R540	G532-D536 PolarHBondContact O-N 3.01Å; R533-D536 PolarHBondContact O-N 3.36Å; D536-G539 WeakPolarHBondContact O-CA 3.35Å; D536-G539 PolarHBondContact O-N 3.21Å; D536-G539 VanDerWaalsContact O-N 3.1Å; D536-R540 WeakPolarHBondContact O-CG 3.23Å; D536-R540 PolarHBondContact O-N 2.86Å
537	E	90.8	Very high	89.4	Confident	124 Å²	124	103.4 Å²	103.4	58%	0.579	51%	0.511	S	S	*	.	H	α-helix	trans	-62.3	-45.9	173.1	-174.3	170	-159.5	0	0	111.5	R533 G539 R540 L541	R533-E537 PolarHBondContact O-N 3.28Å; E537-G539 PolarHBondContact O-N 2.84Å; E537-R540 PolarHBondContact O-N 3.35Å; E537-R540 VanDerWaalsContact O-N 3.16Å; E537-L541 HydrophobicContact CG-CD1 4.17Å; E537-L541 HydrophobicContact CG-CG 4.45Å; E537-L541 WeakPolarHBondContact O-CB 3.36Å; E537-L541 WeakPolarHBondContact O-CG 3.39Å; E537-L541 PolarHBondContact O-N 2.96Å
538	L	89	Confident	89.6	Confident	91 Å²	91	102.5 Å²	102.5	48%	0.476	51%	0.509	S	S	.	.	H	α-helix	trans	-61.2	-29.9	171.5	-73.6	170.8	0	0	0	112.6	A534 R535 R542	A534-L538 WeakPolarHBondContact O-CB 3.46Å; A534-L538 VanDerWaalsContact O-CG 3.28Å; A534-L538 WeakPolarHBondContact O-CG 3.5Å; A534-L538 PolarHBondContact O-N 3.47Å; R535-L538 PolarHBondContact O-N 3.48Å; L538-R542 WeakPolarHBondContact O-CB 3.32Å; L538-R542 WeakPolarHBondContact O-CG 3.45Å; L538-R542 PolarHBondContact O-N 3.43Å; L538-R542 PolarHBondContact O-NE 3.36Å; L538-R542 VanDerWaalsContact O-NE 3.1Å
539	G	89.5	Confident	89.8	Confident	28 Å²	28	99.9 Å²	99.9	29%	0.289	50%	0.497	S	S	.	.	H	α-helix	trans	-62.5	-54.1	170	0	0	0	0	0	111.6	R535 D536 E537 L541 R542 S543	R535-G539 PolarHBondContact O-N 2.9Å; D536-G539 WeakPolarHBondContact O-CA 3.35Å; D536-G539 PolarHBondContact O-N 3.21Å; D536-G539 VanDerWaalsContact O-N 3.1Å; E537-G539 PolarHBondContact O-N 2.84Å; G539-L541 VanDerWaalsContact C-N 3.34Å; G539-L541 PolarHBondContact O-N 2.86Å; G539-R542 PolarHBondContact O-N 2.87Å; G539-R542 VanDerWaalsContact O-N 3.16Å; G539-S543 PolarHBondContact O-N 3.5Å; G539-S543 PolarHBondContact O-OG 3.11Å
540	R	89.7	Confident	90.1	Very high	191 Å²	191	101.4 Å²	101.4	72%	0.721	50%	0.499	S	S	*	.	H	α-helix	trans	-59.7	-41.6	177.3	-66	175.7	-175.2	-157	1.2	112.4	D536 E537 S543 R544	D536-R540 WeakPolarHBondContact O-CG 3.23Å; D536-R540 PolarHBondContact O-N 2.86Å; E537-R540 PolarHBondContact O-N 3.35Å; E537-R540 VanDerWaalsContact O-N 3.16Å; R540-S543 PolarHBondContact O-N 2.91Å; R540-R544 WeakPolarHBondContact O-CG 3.46Å; R540-R544 PolarHBondContact O-N 2.91Å
541	L	90.8	Very high	90.2	Very high	83 Å²	83	100.5 Å²	100.5	44%	0.435	50%	0.498	S	S	.	.	H	α-helix	trans	-65.3	-37.3	176.5	-70.7	173.5	0	0	0	112.1	E537 G539 R544 L545	E537-L541 HydrophobicContact CG-CD1 4.17Å; E537-L541 HydrophobicContact CG-CG 4.45Å; E537-L541 WeakPolarHBondContact O-CB 3.36Å; E537-L541 WeakPolarHBondContact O-CG 3.39Å; E537-L541 PolarHBondContact O-N 2.96Å; G539-L541 VanDerWaalsContact C-N 3.34Å; G539-L541 PolarHBondContact O-N 2.86Å; L541-R544 PolarHBondContact O-N 3.04Å; L541-L545 WeakPolarHBondContact O-CB 3.12Å; L541-L545 PolarHBondContact O-N 3.15Å
542	R	92.9	Very high	90.4	Very high	142 Å²	142	98.5 Å²	98.5	54%	0.536	49%	0.489	S	S	.	.	H	α-helix	trans	-65	-43.7	172.8	-83.5	178.7	-78.1	-117.8	2.3	112.5	L538 G539 R544 L545 T546	L538-R542 WeakPolarHBondContact O-CB 3.32Å; L538-R542 WeakPolarHBondContact O-CG 3.45Å; L538-R542 PolarHBondContact O-N 3.43Å; L538-R542 PolarHBondContact O-NE 3.36Å; L538-R542 VanDerWaalsContact O-NE 3.1Å; G539-R542 PolarHBondContact O-N 2.87Å; G539-R542 VanDerWaalsContact O-N 3.16Å; R542-R544 PolarHBondContact O-N 3.23Å; R542-L545 WeakPolarHBondContact O-CB 3.49Å; R542-L545 PolarHBondContact O-N 3.49Å; R542-T546 PolarHBondContact O-N 3.37Å; R542-T546 PolarHBondContact O-OG1 2.87Å
543	S	89.2	Confident	90.5	Very high	65 Å²	65	102.2 Å²	102.2	46%	0.455	50%	0.496	S	S	.	.	H	α-helix	trans	-60	-45.7	174.7	-57.9	0	0	0	0	111.8	G539 R540 L545 T546 E547	G539-S543 PolarHBondContact O-N 3.5Å; G539-S543 PolarHBondContact O-OG 3.11Å; R540-S543 PolarHBondContact O-N 2.91Å; S543-L545 VanDerWaalsContact C-N 3.31Å; S543-L545 PolarHBondContact O-N 2.67Å; S543-T546 WeakPolarHBondContact CA-OG1 3.34Å; S543-T546 PolarHBondContact O-N 2.89Å; S543-T546 VanDerWaalsContact O-N 3.16Å; S543-T546 PolarHBondContact O-OG1 2.84Å; S543-E547 WeakPolarHBondContact O-CG 3.27Å; S543-E547 PolarHBondContact O-N 3.12Å
544	R	92.6	Very high	90.6	Very high	163 Å²	163	104 Å²	104	62%	0.615	50%	0.502	S	S	*	.	H	α-helix	trans	-61.6	-36.9	174.8	-72.1	179.8	67.5	-168.5	0.4	112.7	R540 L541 R542 E547 V548	R540-R544 WeakPolarHBondContact O-CG 3.46Å; R540-R544 PolarHBondContact O-N 2.91Å; L541-R544 PolarHBondContact O-N 3.04Å; R542-R544 PolarHBondContact O-N 3.23Å; R544-E547 PolarHBondContact O-N 3.32Å; R544-V548 VanDerWaalsContact O-CG2 3.32Å; R544-V548 WeakPolarHBondContact O-CG2 3.28Å; R544-V548 PolarHBondContact O-N 3.31Å
545	L	91.7	Very high	90.7	Very high	94 Å²	94	106.7 Å²	106.7	49%	0.492	51%	0.51	S	S	.	.	H	α-helix	trans	-62.8	-46	174.1	-177.7	62.9	0	0	0	110.7	L541 R542 S543 E547 V548 E549	L541-L545 WeakPolarHBondContact O-CB 3.12Å; L541-L545 PolarHBondContact O-N 3.15Å; R542-L545 WeakPolarHBondContact O-CB 3.49Å; R542-L545 PolarHBondContact O-N 3.49Å; S543-L545 VanDerWaalsContact C-N 3.31Å; S543-L545 PolarHBondContact O-N 2.67Å; L545-E547 PolarHBondContact O-N 3.35Å; L545-V548 PolarHBondContact O-N 2.91Å; L545-E549 HydrophobicContact CD1-CG 4.48Å; L545-E549 HydrophobicContact CG-CG 4.48Å; L545-E549 WeakPolarHBondContact O-CB 3.45Å; L545-E549 WeakPolarHBondContact O-CG 3.33Å; L545-E549 PolarHBondContact O-N 3.41Å
546	T	89.7	Confident	90.7	Very high	74 Å²	74	102.2 Å²	102.2	45%	0.454	50%	0.5	S	S	.	.	H	α-helix	trans	-63.8	-36.9	177.3	52.3	0	0	0	0	113.2	R542 S543 E549 D550	R542-T546 PolarHBondContact O-N 3.37Å; R542-T546 PolarHBondContact O-OG1 2.87Å; S543-T546 WeakPolarHBondContact CA-OG1 3.34Å; S543-T546 PolarHBondContact O-N 2.89Å; S543-T546 VanDerWaalsContact O-N 3.16Å; S543-T546 PolarHBondContact O-OG1 2.84Å; T546-E549 PolarHBondContact O-N 3.42Å; T546-D550 WeakPolarHBondContact O-CB 3.41Å; T546-D550 PolarHBondContact O-N 3.44Å
547	E	90.2	Very high	90.8	Very high	121 Å²	121	104.2 Å²	104.2	57%	0.565	50%	0.504	S	S	*	.	H	α-helix	trans	-63.6	-40.6	173.5	-71.6	167.9	-172.9	0	0	112.3	S543 R544 L545 S551	S543-E547 WeakPolarHBondContact O-CG 3.27Å; S543-E547 PolarHBondContact O-N 3.12Å; R544-E547 PolarHBondContact O-N 3.32Å; L545-E547 PolarHBondContact O-N 3.35Å; E547-S551 WeakPolarHBondContact O-CB 3.4Å; E547-S551 PolarHBondContact O-N 3.46Å; E547-S551 PolarHBondContact O-OG 3.5Å
548	V	90.1	Very high	90.7	Very high	79 Å²	79	103.3 Å²	103.3	48%	0.479	50%	0.503	S	S	.	.	H	α-helix	trans	-70.4	-40.1	176.1	170.3	0	0	0	0	111.3	R544 L545 S551 N552	R544-V548 VanDerWaalsContact O-CG2 3.32Å; R544-V548 WeakPolarHBondContact O-CG2 3.28Å; R544-V548 PolarHBondContact O-N 3.31Å; L545-V548 PolarHBondContact O-N 2.91Å; V548-S551 WeakPolarHBondContact O-CB 3.34Å; V548-S551 PolarHBondContact O-N 2.92Å; V548-N552 WeakPolarHBondContact O-CB 3.49Å; V548-N552 PolarHBondContact O-N 3.02Å
549	E	93.3	Very high	90.8	Very high	83 Å²	83	105.9 Å²	105.9	39%	0.388	51%	0.507	S	S	.	.	H	α-helix	trans	-62	-44.2	174.2	-75.6	177.2	-179.4	0	0	111.9	L545 T546 S551 N552 K553	L545-E549 HydrophobicContact CD1-CG 4.48Å; L545-E549 HydrophobicContact CG-CG 4.48Å; L545-E549 WeakPolarHBondContact O-CB 3.45Å; L545-E549 WeakPolarHBondContact O-CG 3.33Å; L545-E549 PolarHBondContact O-N 3.41Å; T546-E549 PolarHBondContact O-N 3.42Å; E549-S551 VanDerWaalsContact C-N 3.34Å; E549-N552 PolarHBondContact O-N 3.23Å; E549-K553 VanDerWaalsContact O-CG 3.3Å; E549-K553 WeakPolarHBondContact O-CG 3.45Å; E549-K553 PolarHBondContact O-N 3.46Å
550	D	91.1	Very high	90.8	Very high	76 Å²	76	107.9 Å²	107.9	41%	0.406	51%	0.511	S	S	.	.	H	α-helix	trans	-69.4	-32.4	176.1	-81.2	-4.7	0	0	0	112.4	T546 K553 R554	T546-D550 WeakPolarHBondContact O-CB 3.41Å; T546-D550 PolarHBondContact O-N 3.44Å; D550-K553 PolarHBondContact O-N 3.48Å; D550-K553 WeakPolarHBondContact OD1-CD 3.47Å; D550-K553 IonicContact OD1-NZ 2.72Å; D550-K553 PolarHBondContact OD1-NZ 3Å; D550-R554 VanDerWaalsContact O-CG 3.29Å; D550-R554 WeakPolarHBondContact O-CG 3.22Å; D550-R554 PolarHBondContact O-N 2.88Å
551	S	91.2	Very high	90.8	Very high	58 Å²	58	103.6 Å²	103.6	41%	0.406	50%	0.502	S	S	.	.	H	α-helix	trans	-64.5	-42.8	169.9	-60.6	0	0	0	0	111.4	E547 V548 E549 R554 L555	E547-S551 WeakPolarHBondContact O-CB 3.4Å; E547-S551 PolarHBondContact O-N 3.46Å; E547-S551 PolarHBondContact O-OG 3.5Å; V548-S551 WeakPolarHBondContact O-CB 3.34Å; V548-S551 PolarHBondContact O-N 2.92Å; E549-S551 VanDerWaalsContact C-N 3.34Å; S551-R554 WeakPolarHBondContact O-CB 3.29Å; S551-R554 PolarHBondContact O-N 3.1Å; S551-L555 WeakPolarHBondContact O-CG 3.45Å; S551-L555 PolarHBondContact O-N 3.34Å
552	N	91.2	Very high	90.7	Very high	83 Å²	83	103.4 Å²	103.4	44%	0.444	51%	0.505	S	S	.	.	H	α-helix	trans	-64.2	-42.9	174.3	-76.7	-14.7	0	0	0	111.8	V548 E549 R554 L555 D556	V548-N552 WeakPolarHBondContact O-CB 3.49Å; V548-N552 PolarHBondContact O-N 3.02Å; E549-N552 PolarHBondContact O-N 3.23Å; N552-R554 PolarHBondContact O-N 3.16Å; N552-L555 CarbonylContact O-C 3.46Å; N552-L555 PolarHBondContact O-N 3.47Å; N552-L555 VanDerWaalsContact O-N 3.1Å; N552-D556 PolarHBondContact O-N 2.91Å
553	K	90.2	Very high	90.6	Very high	108 Å²	108	102.5 Å²	102.5	47%	0.47	51%	0.505	S	S	.	.	H	α-helix	trans	-59.3	-33.7	173.5	-68.4	165.3	-152.2	158.1	0	112.4	E549 D550 K557	E549-K553 VanDerWaalsContact O-CG 3.3Å; E549-K553 WeakPolarHBondContact O-CG 3.45Å; E549-K553 PolarHBondContact O-N 3.46Å; D550-K553 PolarHBondContact O-N 3.48Å; D550-K553 WeakPolarHBondContact OD1-CD 3.47Å; D550-K553 IonicContact OD1-NZ 2.72Å; D550-K553 PolarHBondContact OD1-NZ 3Å; K553-K557 WeakPolarHBondContact O-CG 3.25Å; K553-K557 PolarHBondContact O-N 3.42Å
554	R	91.1	Very high	90.4	Very high	176 Å²	176	108.8 Å²	108.8	66%	0.664	52%	0.519	S	S	*	.	H	α-helix	trans	-71.8	-43.1	173.5	-69.5	169	-171.1	-172.4	4.4	111.5	D550 S551 N552 K557 L558	D550-R554 VanDerWaalsContact O-CG 3.29Å; D550-R554 WeakPolarHBondContact O-CG 3.22Å; D550-R554 PolarHBondContact O-N 2.88Å; S551-R554 WeakPolarHBondContact O-CB 3.29Å; S551-R554 PolarHBondContact O-N 3.1Å; N552-R554 PolarHBondContact O-N 3.16Å; R554-K557 PolarHBondContact O-N 3.32Å; R554-L558 WeakPolarHBondContact O-CG 3.42Å; R554-L558 PolarHBondContact O-N 2.9Å
555	L	89.8	Confident	90.1	Very high	104 Å²	104	107.9 Å²	107.9	55%	0.545	52%	0.515	S	S	.	.	H	α-helix	trans	-62.8	-40.6	174.9	-71.2	172.2	0	0	0	112	S551 N552 K557 L558 Y559	S551-L555 WeakPolarHBondContact O-CG 3.45Å; S551-L555 PolarHBondContact O-N 3.34Å; N552-L555 CarbonylContact O-C 3.46Å; N552-L555 PolarHBondContact O-N 3.47Å; N552-L555 VanDerWaalsContact O-N 3.1Å; L555-K557 VanDerWaalsContact C-N 3.34Å; L555-K557 PolarHBondContact O-N 3.35Å; L555-L558 PolarHBondContact O-N 3.37Å; L555-Y559 VanDerWaalsContact O-CB 3.26Å; L555-Y559 WeakPolarHBondContact O-CB 3.48Å; L555-Y559 PolarHBondContact O-N 2.89Å
556	D	92.1	Very high	89.9	Confident	96 Å²	96	107.9 Å²	107.9	51%	0.513	52%	0.515	S	S	.	.	H	α-helix	trans	-62.2	-39.6	175.3	-83.3	-24.9	0	0	0	111.9	N552 Y559 N560	N552-D556 PolarHBondContact O-N 2.91Å; D556-Y559 PolarHBondContact O-N 3.08Å; D556-N560 WeakPolarHBondContact O-CB 3.43Å; D556-N560 PolarHBondContact O-N 3.05Å; D556-N560 PolarHBondContact O-ND2 3.47Å
557	K	89.9	Confident	89.9	Confident	150 Å²	150	105.9 Å²	105.9	65%	0.652	51%	0.51	S	S	*	.	H	α-helix	trans	-61.9	-53.2	172.5	-74.6	179.4	178.7	-175.1	0	111	K553 R554 L555 Y559 N560 D561	K553-K557 WeakPolarHBondContact O-CG 3.25Å; K553-K557 PolarHBondContact O-N 3.42Å; R554-K557 PolarHBondContact O-N 3.32Å; L555-K557 VanDerWaalsContact C-N 3.34Å; L555-K557 PolarHBondContact O-N 3.35Å; K557-Y559 VanDerWaalsContact C-N 3.27Å; K557-Y559 PolarHBondContact O-N 3.13Å; K557-N560 PolarHBondContact O-N 3.04Å; K557-N560 VanDerWaalsContact O-N 3.11Å; K557-D561 VanDerWaalsContact O-CG 3.22Å; K557-D561 PolarHBondContact O-N 3.24Å
558	L	90.3	Very high	89.7	Confident	105 Å²	105	104.7 Å²	104.7	55%	0.55	50%	0.504	S	S	.	.	H	α-helix	trans	-58.9	-37.2	177.9	-68.3	171.7	0	0	0	112.6	R554 L555 T562	R554-L558 WeakPolarHBondContact O-CG 3.42Å; R554-L558 PolarHBondContact O-N 2.9Å; L555-L558 PolarHBondContact O-N 3.37Å; L558-T562 WeakPolarHBondContact O-CB 3.38Å; L558-T562 WeakPolarHBondContact O-CG2 3.36Å; L558-T562 PolarHBondContact O-N 3.1Å; L558-T562 PolarHBondContact O-OG1 3.44Å
559	Y	90.5	Very high	89.5	Confident	144 Å²	144	104.7 Å²	104.7	57%	0.565	50%	0.501	S	S	*	.	H	α-helix	trans	-67.4	-42.9	175.9	175.6	-105.2	0	0	0	111.7	L555 D556 K557 T562 K563	L555-Y559 VanDerWaalsContact O-CB 3.26Å; L555-Y559 WeakPolarHBondContact O-CB 3.48Å; L555-Y559 PolarHBondContact O-N 2.89Å; D556-Y559 PolarHBondContact O-N 3.08Å; K557-Y559 VanDerWaalsContact C-N 3.27Å; K557-Y559 PolarHBondContact O-N 3.13Å; Y559-T562 WeakPolarHBondContact CA-OG1 3.4Å; Y559-T562 PolarHBondContact O-OG1 3.46Å; Y559-T562 VanDerWaalsContact O-OG1 3.06Å; Y559-K563 HydrophobicContact CE1-CD 4.47Å; Y559-K563 WeakPolarHBondContact O-CB 3.4Å; Y559-K563 PolarHBondContact O-N 3.16Å
560	N	89.2	Confident	89.3	Confident	71 Å²	71	106 Å²	106	38%	0.38	51%	0.507	S	S	.	.	H	α-helix	trans	-67.5	-39.2	175	-75.8	-63.8	0	0	0	112	D556 K557 K563 W564	D556-N560 WeakPolarHBondContact O-CB 3.43Å; D556-N560 PolarHBondContact O-N 3.05Å; D556-N560 PolarHBondContact O-ND2 3.47Å; K557-N560 PolarHBondContact O-N 3.04Å; K557-N560 VanDerWaalsContact O-N 3.11Å; N560-K563 PolarHBondContact O-N 2.96Å; N560-W564 WeakPolarHBondContact O-CB 3.42Å; N560-W564 PolarHBondContact O-N 2.84Å
561	D	89	Confident	89.1	Confident	100 Å²	100	105.2 Å²	105.2	54%	0.535	51%	0.512	S	S	.	.	H	α-helix	trans	-64.5	-45.2	176.6	-65.7	-22.2	0	0	0	111.5	K557 W564 R565	K557-D561 VanDerWaalsContact O-CG 3.22Å; K557-D561 PolarHBondContact O-N 3.24Å; D561-W564 PolarHBondContact O-N 2.96Å; D561-R565 WeakPolarHBondContact O-CB 3.45Å; D561-R565 PolarHBondContact O-N 3.47Å
562	T	89.2	Confident	89	Confident	79 Å²	79	107.3 Å²	107.3	49%	0.485	52%	0.516	S	S	.	.	H	α-helix	trans	-67.5	-35	174.7	49.2	0	0	0	0	112.6	L558 Y559 R565 N566	L558-T562 WeakPolarHBondContact O-CB 3.38Å; L558-T562 WeakPolarHBondContact O-CG2 3.36Å; L558-T562 PolarHBondContact O-N 3.1Å; L558-T562 PolarHBondContact O-OG1 3.44Å; Y559-T562 WeakPolarHBondContact CA-OG1 3.4Å; Y559-T562 PolarHBondContact O-OG1 3.46Å; Y559-T562 VanDerWaalsContact O-OG1 3.06Å; T562-R565 PolarHBondContact O-N 3.36Å; T562-N566 WeakPolarHBondContact O-CB 3.4Å; T562-N566 PolarHBondContact O-N 3.01Å
563	K	90.6	Very high	88.8	Confident	123 Å²	123	108.5 Å²	108.5	54%	0.535	52%	0.522	S	S	.	.	H	α-helix	trans	-64.6	-43.5	171.6	-178.7	-176.7	176.4	-172.2	0	112	Y559 N560 R565 N566 G567	Y559-K563 HydrophobicContact CE1-CD 4.47Å; Y559-K563 WeakPolarHBondContact O-CB 3.4Å; Y559-K563 PolarHBondContact O-N 3.16Å; N560-K563 PolarHBondContact O-N 2.96Å; K563-R565 VanDerWaalsContact C-N 3.35Å; K563-N566 PolarHBondContact O-N 2.92Å; K563-G567 PolarHBondContact O-N 3.42Å
564	W	86.1	Confident	88.6	Confident	198 Å²	198	112.1 Å²	112.1	75%	0.75	53%	0.533	S	S	*	.	H	α-helix	trans	-60.6	-45.3	172.6	-85.5	116.5	0	0	0	111.2	N560 D561 N566 G567 E568	N560-W564 WeakPolarHBondContact O-CB 3.42Å; N560-W564 PolarHBondContact O-N 2.84Å; D561-W564 PolarHBondContact O-N 2.96Å; W564-N566 VanDerWaalsContact C-N 3.34Å; W564-N566 PolarHBondContact O-N 2.72Å; W564-G567 CarbonylContact O-C 3.53Å; W564-G567 WeakPolarHBondContact O-CA 3.19Å; W564-G567 PolarHBondContact O-N 3.05Å; W564-E568 PolarHBondContact O-N 3.34Å
565	R	86.3	Confident	88.4	Confident	144 Å²	144	108.9 Å²	108.9	54%	0.543	53%	0.528	S	S	.	.	H	α-helix	trans	-63.5	-37.9	177.7	-168	55	165.7	-177.1	-2.5	112.7	D561 T562 K563 E568 L569	D561-R565 WeakPolarHBondContact O-CB 3.45Å; D561-R565 PolarHBondContact O-N 3.47Å; T562-R565 PolarHBondContact O-N 3.36Å; K563-R565 VanDerWaalsContact C-N 3.35Å; R565-E568 WeakPolarHBondContact CD-OE2 3.4Å; R565-E568 IonicContact CZ-OE2 3.7Å; R565-E568 IonicContact NE-OE2 2.87Å; R565-E568 IonicContact NH1-OE2 3Å; R565-E568 PolarHBondContact NH1-OE2 3.45Å; R565-E568 PolarHBondContact O-N 3.15Å; R565-L569 HydrophobicContact CG-CD1 4.48Å; R565-L569 VanDerWaalsContact O-CG 3.28Å; R565-L569 WeakPolarHBondContact O-CG 3.41Å; R565-L569 PolarHBondContact O-N 2.98Å
566	N	86.7	Confident	88.4	Confident	93 Å²	93	109 Å²	109	50%	0.497	53%	0.525	S	S	.	.	H	α-helix	trans	-64.5	-40	170.6	-78.8	-4.8	0	0	0	111.5	T562 K563 W564 E568 L569 E570	T562-N566 WeakPolarHBondContact O-CB 3.4Å; T562-N566 PolarHBondContact O-N 3.01Å; K563-N566 PolarHBondContact O-N 2.92Å; W564-N566 VanDerWaalsContact C-N 3.34Å; W564-N566 PolarHBondContact O-N 2.72Å; N566-E568 PolarHBondContact O-N 3.41Å; N566-L569 CarbonylContact O-C 3.57Å; N566-L569 PolarHBondContact O-N 3.35Å; N566-E570 WeakPolarHBondContact O-CB 3.38Å; N566-E570 WeakPolarHBondContact O-CG 3.46Å; N566-E570 PolarHBondContact O-N 2.87Å
567	G	88.8	Confident	88.2	Confident	33 Å²	33	109.1 Å²	109.1	34%	0.34	53%	0.525	S	S	.	.	H	α-helix	trans	-61	-40.2	173.5	0	0	0	0	0	113.6	K563 W564 E570 A571	K563-G567 PolarHBondContact O-N 3.42Å; W564-G567 CarbonylContact O-C 3.53Å; W564-G567 WeakPolarHBondContact O-CA 3.19Å; W564-G567 PolarHBondContact O-N 3.05Å; G567-E570 PolarHBondContact O-N 3.23Å; G567-A571 WeakPolarHBondContact O-CB 3.17Å; G567-A571 PolarHBondContact O-N 3.41Å
568	E	86.8	Confident	88	Confident	96 Å²	96	103.2 Å²	103.2	45%	0.449	51%	0.507	S	S	.	.	H	α-helix	trans	-63.5	-43.1	171.8	-68.2	-177.7	146.6	0	0	112	W564 R565 N566 A571 M572	W564-E568 PolarHBondContact O-N 3.34Å; R565-E568 WeakPolarHBondContact CD-OE2 3.4Å; R565-E568 IonicContact CZ-OE2 3.7Å; R565-E568 IonicContact NE-OE2 2.87Å; R565-E568 IonicContact NH1-OE2 3Å; R565-E568 PolarHBondContact NH1-OE2 3.45Å; R565-E568 PolarHBondContact O-N 3.15Å; N566-E568 PolarHBondContact O-N 3.41Å; E568-A571 PolarHBondContact O-N 2.86Å; E568-M572 HydrophobicContact CB-CE 4.32Å; E568-M572 WeakPolarHBondContact O-CE 3.26Å; E568-M572 WeakPolarHBondContact O-CG 3.32Å; E568-M572 PolarHBondContact O-N 3.19Å
569	L	86.3	Confident	88	Confident	78 Å²	78	102 Å²	102	41%	0.408	50%	0.499	S	S	.	.	H	α-helix	trans	-65.2	-41.7	176.6	-71.1	166.7	0	0	0	111.9	R565 N566 M572 L573	R565-L569 HydrophobicContact CG-CD1 4.48Å; R565-L569 VanDerWaalsContact O-CG 3.28Å; R565-L569 WeakPolarHBondContact O-CG 3.41Å; R565-L569 PolarHBondContact O-N 2.98Å; N566-L569 CarbonylContact O-C 3.57Å; N566-L569 PolarHBondContact O-N 3.35Å; L569-M572 HydrophobicContact CD2-CE 3.99Å; L569-M572 HydrophobicContact CG-CE 4.49Å; L569-M572 PolarHBondContact O-N 2.85Å; L569-L573 WeakPolarHBondContact O-CB 3.33Å; L569-L573 VanDerWaalsContact O-CG 3.3Å; L569-L573 WeakPolarHBondContact O-CG 3.31Å; L569-L573 PolarHBondContact O-N 2.99Å
570	E	89.9	Confident	87.8	Confident	111 Å²	111	98.9 Å²	98.9	52%	0.519	49%	0.491	S	S	.	.	H	α-helix	trans	-63.5	-39.1	173.4	-76.8	179.5	-157.9	0	0	112	N566 G567 L573 R574	N566-E570 WeakPolarHBondContact O-CB 3.38Å; N566-E570 WeakPolarHBondContact O-CG 3.46Å; N566-E570 PolarHBondContact O-N 2.87Å; G567-E570 PolarHBondContact O-N 3.23Å; E570-L573 PolarHBondContact O-N 3.45Å; E570-R574 WeakPolarHBondContact O-CG 3.42Å; E570-R574 PolarHBondContact O-N 2.9Å
571	A	85.7	Confident	87.7	Confident	60 Å²	60	102.3 Å²	102.3	50%	0.496	50%	0.499	S	S	.	.	H	α-helix	trans	-66.8	-41.8	175.1	0	0	0	0	0	111.8	G567 E568 R574 N575	G567-A571 WeakPolarHBondContact O-CB 3.17Å; G567-A571 PolarHBondContact O-N 3.41Å; E568-A571 PolarHBondContact O-N 2.86Å; A571-R574 PolarHBondContact O-N 3.45Å; A571-N575 PolarHBondContact O-N 2.85Å
572	M	88.7	Confident	87.4	Confident	102 Å²	102	103.9 Å²	103.9	50%	0.502	50%	0.503	S	S	.	.	H	α-helix	trans	-62.7	-42.7	172.3	-77.8	-173.7	-86	0	0	111.9	E568 L569 N575 K576	E568-M572 HydrophobicContact CB-CE 4.32Å; E568-M572 WeakPolarHBondContact O-CE 3.26Å; E568-M572 WeakPolarHBondContact O-CG 3.32Å; E568-M572 PolarHBondContact O-N 3.19Å; L569-M572 HydrophobicContact CD2-CE 3.99Å; L569-M572 HydrophobicContact CG-CE 4.49Å; L569-M572 PolarHBondContact O-N 2.85Å; M572-N575 PolarHBondContact O-N 3.16Å; M572-K576 WeakPolarHBondContact O-CG 3.48Å; M572-K576 PolarHBondContact O-N 3.47Å
573	L	87.8	Confident	87.4	Confident	108 Å²	108	105.5 Å²	105.5	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-61.9	-47.1	175.3	-76.6	169.5	0	0	0	111.5	L569 E570 N575 K576 D577	L569-L573 WeakPolarHBondContact O-CB 3.33Å; L569-L573 VanDerWaalsContact O-CG 3.3Å; L569-L573 WeakPolarHBondContact O-CG 3.31Å; L569-L573 PolarHBondContact O-N 2.99Å; E570-L573 PolarHBondContact O-N 3.45Å; L573-N575 VanDerWaalsContact C-N 3.27Å; L573-N575 PolarHBondContact O-N 2.82Å; L573-K576 CarbonylContact O-C 3.51Å; L573-K576 WeakPolarHBondContact O-CA 3.45Å; L573-K576 PolarHBondContact O-N 2.91Å; L573-D577 PolarHBondContact O-N 3.29Å
574	R	85.5	Confident	87.3	Confident	183 Å²	183	105.7 Å²	105.7	69%	0.691	51%	0.509	S	S	*	.	H	α-helix	trans	-58.5	-37.7	174.4	-75.6	179.5	-166.9	-108.5	2.6	112.9	E570 A571 D577 G578	E570-R574 WeakPolarHBondContact O-CG 3.42Å; E570-R574 PolarHBondContact O-N 2.9Å; A571-R574 PolarHBondContact O-N 3.45Å; R574-D577 PolarHBondContact O-N 2.79Å; R574-G578 PolarHBondContact O-N 3.12Å
575	N	88.3	Confident	87.3	Confident	108 Å²	108	99 Å²	99	58%	0.578	49%	0.488	S	S	*	.	H	α-helix	trans	-66	-42.1	175.8	-164.2	18.9	0	0	0	110.7	A571 M572 L573 G578 E579	A571-N575 PolarHBondContact O-N 2.85Å; M572-N575 PolarHBondContact O-N 3.16Å; L573-N575 VanDerWaalsContact C-N 3.27Å; L573-N575 PolarHBondContact O-N 2.82Å; N575-G578 WeakPolarHBondContact O-CA 3.31Å; N575-G578 PolarHBondContact O-N 3.48Å; N575-E579 PolarHBondContact O-N 3.26Å
576	K	88.7	Confident	87.4	Confident	107 Å²	107	94.2 Å²	94.2	47%	0.465	48%	0.48	S	S	.	.	H	α-helix	trans	-66.4	-35.9	172.6	-67	-45.1	-170.6	-173	0	113.5	M572 L573 G578 E579 I580	M572-K576 WeakPolarHBondContact O-CG 3.48Å; M572-K576 PolarHBondContact O-N 3.47Å; L573-K576 CarbonylContact O-C 3.51Å; L573-K576 WeakPolarHBondContact O-CA 3.45Å; L573-K576 PolarHBondContact O-N 2.91Å; K576-G578 VanDerWaalsContact C-N 3.3Å; K576-G578 PolarHBondContact O-N 2.91Å; K576-E579 VanDerWaalsContact CD-CD 3.49Å; K576-E579 WeakPolarHBondContact CD-OE1 3.49Å; K576-E579 VanDerWaalsContact CD-OE2 3.23Å; K576-E579 WeakPolarHBondContact CD-OE2 3.39Å; K576-E579 IonicContact NZ-OE1 3.89Å; K576-E579 PolarHBondContact NZ-OE1 2.8Å; K576-E579 IonicContact NZ-OE2 3.5Å; K576-E579 PolarHBondContact NZ-OE2 2.89Å; K576-E579 PolarHBondContact O-N 3.47Å; K576-I580 WeakPolarHBondContact O-CB 3.34Å; K576-I580 WeakPolarHBondContact O-CD1 3.37Å; K576-I580 WeakPolarHBondContact O-CG1 3.42Å; K576-I580 PolarHBondContact O-N 3.32Å
577	D	87.7	Confident	87.3	Confident	99 Å²	99	95.1 Å²	95.1	53%	0.529	48%	0.484	S	S	.	.	H	α-helix	trans	-64.5	-35.9	171.3	-72.7	-35.4	0	0	0	111.4	L573 R574 I580 Y581	L573-D577 PolarHBondContact O-N 3.29Å; R574-D577 PolarHBondContact O-N 2.79Å; D577-I580 PolarHBondContact O-N 3.23Å; D577-Y581 VanDerWaalsContact O-CB 3.29Å; D577-Y581 WeakPolarHBondContact O-CB 3.43Å; D577-Y581 PolarHBondContact O-N 2.89Å
578	G	86.8	Confident	87.3	Confident	26 Å²	26	98 Å²	98	27%	0.268	49%	0.492	S	S	.	.	H	α-helix	trans	-63.4	-49.5	170.9	0	0	0	0	0	112.5	R574 N575 K576 I580 Y581 H582	R574-G578 PolarHBondContact O-N 3.12Å; N575-G578 WeakPolarHBondContact O-CA 3.31Å; N575-G578 PolarHBondContact O-N 3.48Å; K576-G578 VanDerWaalsContact C-N 3.3Å; K576-G578 PolarHBondContact O-N 2.91Å; G578-I580 VanDerWaalsContact C-N 3.32Å; G578-I580 PolarHBondContact O-N 3.12Å; G578-Y581 PolarHBondContact O-N 2.87Å; G578-H582 PolarHBondContact O-CD2 3.38Å; G578-H582 PolarHBondContact O-N 3.29Å
579	E	89.2	Confident	87.2	Confident	80 Å²	80	98.4 Å²	98.4	37%	0.374	50%	0.497	S	S	.	.	H	α-helix	trans	-55.6	-46.6	171.9	-70.8	174.4	-152.6	0	0	111.2	N575 K576 Y581 H582 L583	N575-E579 PolarHBondContact O-N 3.26Å; K576-E579 VanDerWaalsContact CD-CD 3.49Å; K576-E579 WeakPolarHBondContact CD-OE1 3.49Å; K576-E579 VanDerWaalsContact CD-OE2 3.23Å; K576-E579 WeakPolarHBondContact CD-OE2 3.39Å; K576-E579 IonicContact NZ-OE1 3.89Å; K576-E579 PolarHBondContact NZ-OE1 2.8Å; K576-E579 IonicContact NZ-OE2 3.5Å; K576-E579 PolarHBondContact NZ-OE2 2.89Å; K576-E579 PolarHBondContact O-N 3.47Å; E579-Y581 VanDerWaalsContact C-N 3.35Å; E579-Y581 PolarHBondContact O-N 3.19Å; E579-H582 PolarHBondContact O-N 3.44Å; E579-L583 WeakPolarHBondContact O-CB 3.39Å; E579-L583 VanDerWaalsContact O-CG 3.27Å; E579-L583 WeakPolarHBondContact O-CG 3.48Å; E579-L583 PolarHBondContact O-N 3.04Å
580	I	86.5	Confident	87.3	Confident	77 Å²	77	99.7 Å²	99.7	40%	0.395	50%	0.503	S	S	.	.	H	α-helix	trans	-63.2	-38.4	177.2	-71.4	163.9	0	0	0	111.4	K576 D577 G578 L583 K584	K576-I580 WeakPolarHBondContact O-CB 3.34Å; K576-I580 WeakPolarHBondContact O-CD1 3.37Å; K576-I580 WeakPolarHBondContact O-CG1 3.42Å; K576-I580 PolarHBondContact O-N 3.32Å; D577-I580 PolarHBondContact O-N 3.23Å; G578-I580 VanDerWaalsContact C-N 3.32Å; G578-I580 PolarHBondContact O-N 3.12Å; I580-L583 PolarHBondContact O-N 3.24Å; I580-K584 HydrophobicContact CG2-CD 4.17Å; I580-K584 HydrophobicContact CG2-CG 4.43Å; I580-K584 WeakPolarHBondContact O-CB 3.4Å; I580-K584 VanDerWaalsContact O-CG 3.31Å; I580-K584 WeakPolarHBondContact O-CG 3.45Å; I580-K584 PolarHBondContact O-N 3.05Å
581	Y	86.6	Confident	87.1	Confident	144 Å²	144	98.3 Å²	98.3	57%	0.565	50%	0.497	S	S	*	.	H	α-helix	trans	-66.8	-42.5	176.4	-179.4	-102.8	0	0	0	111.7	D577 G578 E579 K584 N585	D577-Y581 VanDerWaalsContact O-CB 3.29Å; D577-Y581 WeakPolarHBondContact O-CB 3.43Å; D577-Y581 PolarHBondContact O-N 2.89Å; G578-Y581 PolarHBondContact O-N 2.87Å; E579-Y581 VanDerWaalsContact C-N 3.35Å; E579-Y581 PolarHBondContact O-N 3.19Å; Y581-K584 PolarHBondContact O-N 3.47Å; Y581-N585 WeakPolarHBondContact CE1-ND2 3.48Å; Y581-N585 PolarHBondContact O-N 3.42Å
582	H	84	Confident	87.1	Confident	132 Å²	132	99.7 Å²	99.7	61%	0.611	50%	0.496	S	S	*	.	H	α-helix	trans	-63.7	-41.5	172.8	-71	-59.9	0	0	0	112.1	G578 E579 N585 A586	G578-H582 PolarHBondContact O-CD2 3.38Å; G578-H582 PolarHBondContact O-N 3.29Å; E579-H582 PolarHBondContact O-N 3.44Å; H582-N585 PolarHBondContact O-N 2.9Å; H582-A586 WeakPolarHBondContact O-CB 3.45Å; H582-A586 PolarHBondContact O-N 2.82Å
583	L	88	Confident	87	Confident	114 Å²	114	100.4 Å²	100.4	60%	0.597	50%	0.498	S	S	*	.	H	α-helix	trans	-64.9	-38.6	174.4	-72.4	170.3	0	0	0	112.3	E579 I580 A586 L587	E579-L583 WeakPolarHBondContact O-CB 3.39Å; E579-L583 VanDerWaalsContact O-CG 3.27Å; E579-L583 WeakPolarHBondContact O-CG 3.48Å; E579-L583 PolarHBondContact O-N 3.04Å; I580-L583 PolarHBondContact O-N 3.24Å; L583-A586 PolarHBondContact O-N 3.47Å; L583-L587 WeakPolarHBondContact O-CB 3.49Å; L583-L587 PolarHBondContact O-N 3.35Å
584	K	88.3	Confident	86.9	Confident	126 Å²	126	101.4 Å²	101.4	55%	0.548	50%	0.498	S	S	.	.	H	α-helix	trans	-63.9	-46	173.5	-80.9	176.2	178.8	176.9	0	111.8	I580 Y581 A586 L587 D588	I580-K584 HydrophobicContact CG2-CD 4.17Å; I580-K584 HydrophobicContact CG2-CG 4.43Å; I580-K584 WeakPolarHBondContact O-CB 3.4Å; I580-K584 VanDerWaalsContact O-CG 3.31Å; I580-K584 WeakPolarHBondContact O-CG 3.45Å; I580-K584 PolarHBondContact O-N 3.05Å; Y581-K584 PolarHBondContact O-N 3.47Å; K584-A586 VanDerWaalsContact C-N 3.3Å; K584-A586 PolarHBondContact O-N 3.12Å; K584-L587 CarbonylContact O-C 3.5Å; K584-L587 WeakPolarHBondContact O-CA 3.32Å; K584-L587 VanDerWaalsContact O-CB 3.3Å; K584-L587 WeakPolarHBondContact O-CB 3.48Å; K584-L587 PolarHBondContact O-N 2.94Å; K584-L587 VanDerWaalsContact O-N 3.09Å; K584-D588 PolarHBondContact O-N 3.49Å
585	N	86.1	Confident	86.9	Confident	58 Å²	58	97.8 Å²	97.8	31%	0.31	49%	0.487	S	S	.	.	H	α-helix	trans	-65.2	-34.5	176.3	-70.8	-10.5	0	0	0	112.1	Y581 H582 N589	Y581-N585 WeakPolarHBondContact CE1-ND2 3.48Å; Y581-N585 PolarHBondContact O-N 3.42Å; H582-N585 PolarHBondContact O-N 2.9Å; N585-N589 WeakPolarHBondContact O-CB 3.29Å; N585-N589 VanDerWaalsContact O-CG 3.22Å; N585-N589 PolarHBondContact O-N 2.99Å; N585-N589 PolarHBondContact O-ND2 3.43Å
586	A	88.6	Confident	86.8	Confident	44 Å²	44	100.4 Å²	100.4	36%	0.364	49%	0.489	S	S	.	.	H	α-helix	trans	-65.2	-39.8	170.7	0	0	0	0	0	111.7	H582 L583 K584 N589 L590	H582-A586 WeakPolarHBondContact O-CB 3.45Å; H582-A586 PolarHBondContact O-N 2.82Å; L583-A586 PolarHBondContact O-N 3.47Å; K584-A586 VanDerWaalsContact C-N 3.3Å; K584-A586 PolarHBondContact O-N 3.12Å; A586-N589 PolarHBondContact O-N 2.97Å; A586-L590 WeakPolarHBondContact O-CB 3.47Å; A586-L590 VanDerWaalsContact O-CG 3.26Å; A586-L590 WeakPolarHBondContact O-CG 3.49Å; A586-L590 PolarHBondContact O-N 3.5Å
587	L	86.1	Confident	86.5	Confident	112 Å²	112	100.1 Å²	100.1	59%	0.586	49%	0.492	S	S	*	.	H	α-helix	trans	-63.1	-45.6	173.2	-110.8	157.1	0	0	0	112.5	L583 K584 L590 E591	L583-L587 WeakPolarHBondContact O-CB 3.49Å; L583-L587 PolarHBondContact O-N 3.35Å; K584-L587 CarbonylContact O-C 3.5Å; K584-L587 WeakPolarHBondContact O-CA 3.32Å; K584-L587 VanDerWaalsContact O-CB 3.3Å; K584-L587 WeakPolarHBondContact O-CB 3.48Å; K584-L587 PolarHBondContact O-N 2.94Å; K584-L587 VanDerWaalsContact O-N 3.09Å; L587-L590 CarbonylContact O-C 3.54Å; L587-L590 PolarHBondContact O-N 2.75Å; L587-E591 WeakPolarHBondContact O-CB 3.37Å; L587-E591 PolarHBondContact O-N 2.91Å
588	D	87.4	Confident	86.4	Confident	94 Å²	94	99 Å²	99	50%	0.503	49%	0.485	S	S	.	.	H	α-helix	trans	-63.5	-39.8	175.7	-87.7	10.7	0	0	0	111.5	K584 E591 N592	K584-D588 PolarHBondContact O-N 3.49Å; D588-E591 PolarHBondContact O-N 3.33Å; D588-N592 WeakPolarHBondContact O-CB 3.36Å; D588-N592 PolarHBondContact O-N 3.36Å; D588-N592 PolarHBondContact O-ND2 3.02Å; D588-N592 VanDerWaalsContact O-ND2 3.07Å
589	N	85.8	Confident	86.2	Confident	104 Å²	104	100.4 Å²	100.4	56%	0.556	49%	0.492	S	S	*	.	H	α-helix	trans	-63.2	-47.1	173.5	-75.7	-19.5	0	0	0	111.4	N585 A586 E591 N592 E593	N585-N589 WeakPolarHBondContact O-CB 3.29Å; N585-N589 VanDerWaalsContact O-CG 3.22Å; N585-N589 PolarHBondContact O-N 2.99Å; N585-N589 PolarHBondContact O-ND2 3.43Å; A586-N589 PolarHBondContact O-N 2.97Å; N589-E591 VanDerWaalsContact C-N 3.28Å; N589-E591 PolarHBondContact O-N 3.05Å; N589-N592 PolarHBondContact O-N 2.88Å; N589-E593 PolarHBondContact O-N 3.24Å
590	L	87	Confident	86.1	Confident	104 Å²	104	99.9 Å²	99.9	55%	0.545	49%	0.489	S	S	.	.	H	α-helix	trans	-63.6	-32.1	174.4	-72.6	168.7	0	0	0	112.3	A586 L587 K594	A586-L590 WeakPolarHBondContact O-CB 3.47Å; A586-L590 VanDerWaalsContact O-CG 3.26Å; A586-L590 WeakPolarHBondContact O-CG 3.49Å; A586-L590 PolarHBondContact O-N 3.5Å; L587-L590 CarbonylContact O-C 3.54Å; L587-L590 PolarHBondContact O-N 2.75Å; L590-K594 VanDerWaalsContact O-CB 3.23Å; L590-K594 WeakPolarHBondContact O-CB 3.34Å; L590-K594 PolarHBondContact O-N 3.5Å
591	E	87.3	Confident	85.6	Confident	83 Å²	83	101.7 Å²	101.7	39%	0.388	50%	0.497	S	S	.	.	H	α-helix	trans	-73.9	-34.4	174.9	-169.4	177.3	147.6	0	0	111.7	L587 D588 N589 K594 K595	L587-E591 WeakPolarHBondContact O-CB 3.37Å; L587-E591 PolarHBondContact O-N 2.91Å; D588-E591 PolarHBondContact O-N 3.33Å; N589-E591 VanDerWaalsContact C-N 3.28Å; N589-E591 PolarHBondContact O-N 3.05Å; E591-K594 WeakPolarHBondContact O-CB 3.49Å; E591-K594 PolarHBondContact O-N 3.15Å; E591-K595 WeakPolarHBondContact O-CB 3.45Å; E591-K595 VanDerWaalsContact O-CG 3.32Å; E591-K595 WeakPolarHBondContact O-CG 3.47Å; E591-K595 PolarHBondContact O-N 3.3Å; E591-K595 WeakPolarHBondContact OE1-CE 3.17Å; E591-K595 IonicContact OE1-NZ 2.68Å; E591-K595 PolarHBondContact OE1-NZ 3.39Å
592	N	85.7	Confident	85.4	Confident	89 Å²	89	100.3 Å²	100.3	48%	0.476	50%	0.499	S	S	.	.	H	α-helix	trans	-69.9	-39.7	172.2	-71.7	-35	0	0	0	111.6	D588 N589 K595 W596	D588-N592 WeakPolarHBondContact O-CB 3.36Å; D588-N592 PolarHBondContact O-N 3.36Å; D588-N592 PolarHBondContact O-ND2 3.02Å; D588-N592 VanDerWaalsContact O-ND2 3.07Å; N589-N592 PolarHBondContact O-N 2.88Å; N592-K595 PolarHBondContact O-N 3.46Å; N592-W596 WeakPolarHBondContact O-CB 3.48Å; N592-W596 PolarHBondContact O-N 2.97Å
593	E	86.3	Confident	85.2	Confident	117 Å²	117	99.5 Å²	99.5	55%	0.547	49%	0.494	S	S	.	.	H	α-helix	trans	-60.5	-45.3	168.4	-75.5	-175.9	173	0	0	111.1	N589 K595 W596 L597	N589-E593 PolarHBondContact O-N 3.24Å; E593-K595 VanDerWaalsContact C-N 3.34Å; E593-K595 PolarHBondContact O-N 2.89Å; E593-W596 PolarHBondContact O-N 3.49Å; E593-L597 WeakPolarHBondContact O-CB 3.45Å; E593-L597 VanDerWaalsContact O-CG 3.3Å; E593-L597 WeakPolarHBondContact O-CG 3.45Å; E593-L597 PolarHBondContact O-N 3.4Å
594	K	85.9	Confident	84.7	Confident	128 Å²	128	98.1 Å²	98.1	56%	0.557	49%	0.487	S	S	*	.	H	α-helix	trans	-58.8	-41.7	173.4	178.5	-170.8	172.4	-170	0	112	L590 E591 L597 L598	L590-K594 VanDerWaalsContact O-CB 3.23Å; L590-K594 WeakPolarHBondContact O-CB 3.34Å; L590-K594 PolarHBondContact O-N 3.5Å; E591-K594 WeakPolarHBondContact O-CB 3.49Å; E591-K594 PolarHBondContact O-N 3.15Å; K594-L597 PolarHBondContact O-N 2.87Å; K594-L598 HydrophobicContact CG-CD1 4.08Å; K594-L598 WeakPolarHBondContact O-CB 3.23Å; K594-L598 WeakPolarHBondContact O-CD1 3.45Å; K594-L598 WeakPolarHBondContact O-CG 3.33Å; K594-L598 PolarHBondContact O-N 3.25Å
595	K	85.7	Confident	84.3	Confident	108 Å²	108	93.5 Å²	93.5	47%	0.47	48%	0.475	S	S	.	.	H	α-helix	trans	-66.2	-39.6	175.5	-77.5	166	-174.7	152.7	0	111.9	E591 N592 E593 L598 S599	E591-K595 WeakPolarHBondContact O-CB 3.45Å; E591-K595 VanDerWaalsContact O-CG 3.32Å; E591-K595 WeakPolarHBondContact O-CG 3.47Å; E591-K595 PolarHBondContact O-N 3.3Å; E591-K595 WeakPolarHBondContact OE1-CE 3.17Å; E591-K595 IonicContact OE1-NZ 2.68Å; E591-K595 PolarHBondContact OE1-NZ 3.39Å; N592-K595 PolarHBondContact O-N 3.46Å; E593-K595 VanDerWaalsContact C-N 3.34Å; E593-K595 PolarHBondContact O-N 2.89Å; K595-L598 PolarHBondContact O-N 2.94Å; K595-S599 PolarHBondContact O-N 3.25Å
596	W	85	Confident	83.8	Confident	163 Å²	163	93.3 Å²	93.3	62%	0.617	48%	0.482	S	S	*	.	H	α-helix	trans	-64.6	-46.8	173.8	-179.9	85.5	0	0	0	111.5	N592 E593 L598 S599 E600	N592-W596 WeakPolarHBondContact O-CB 3.48Å; N592-W596 PolarHBondContact O-N 2.97Å; E593-W596 PolarHBondContact O-N 3.49Å; W596-L598 VanDerWaalsContact C-N 3.33Å; W596-L598 PolarHBondContact O-N 3.36Å; W596-S599 PolarHBondContact O-N 3.4Å; W596-E600 PolarHBondContact O-N 2.97Å
597	L	83.2	Confident	83	Confident	101 Å²	101	98.8 Å²	98.8	53%	0.529	49%	0.493	S	S	.	.	H	α-helix	trans	-61.5	-37.9	174.2	-72.8	171.3	0	0	0	112.3	E593 K594 E600 M601	E593-L597 WeakPolarHBondContact O-CB 3.45Å; E593-L597 VanDerWaalsContact O-CG 3.3Å; E593-L597 WeakPolarHBondContact O-CG 3.45Å; E593-L597 PolarHBondContact O-N 3.4Å; K594-L597 PolarHBondContact O-N 2.87Å; L597-E600 PolarHBondContact O-N 2.87Å; L597-M601 WeakPolarHBondContact O-CB 3.25Å; L597-M601 PolarHBondContact O-N 2.87Å
598	L	85	Confident	81.9	Confident	74 Å²	74	96.8 Å²	96.8	39%	0.387	49%	0.488	S	S	.	.	H	α-helix	trans	-62.9	-46.1	172.7	-80	163.3	0	0	0	111.1	K594 K595 W596 E600 M601 D602	K594-L598 HydrophobicContact CG-CD1 4.08Å; K594-L598 WeakPolarHBondContact O-CB 3.23Å; K594-L598 WeakPolarHBondContact O-CD1 3.45Å; K594-L598 WeakPolarHBondContact O-CG 3.33Å; K594-L598 PolarHBondContact O-N 3.25Å; K595-L598 PolarHBondContact O-N 2.94Å; W596-L598 VanDerWaalsContact C-N 3.33Å; W596-L598 PolarHBondContact O-N 3.36Å; L598-E600 PolarHBondContact O-N 2.94Å; L598-M601 HydrophobicContact CD2-CE 3.79Å; L598-M601 CarbonylContact O-C 3.5Å; L598-M601 PolarHBondContact O-N 3.31Å; L598-D602 PolarHBondContact O-N 3.45Å
599	S	82.2	Confident	80.9	Confident	57 Å²	57	99 Å²	99	40%	0.399	49%	0.493	S	S	.	.	H	α-helix	trans	-65.3	-36.6	176.7	-175.2	0	0	0	0	112.8	K595 W596 D602 K603	K595-S599 PolarHBondContact O-N 3.25Å; W596-S599 PolarHBondContact O-N 3.4Å; S599-D602 PolarHBondContact O-N 2.89Å; S599-K603 WeakPolarHBondContact O-CG 3.25Å; S599-K603 PolarHBondContact O-N 2.97Å
600	E	87	Confident	79.7	Confident	68 Å²	68	100.6 Å²	100.6	32%	0.318	50%	0.497	S	S	.	.	H	α-helix	trans	-69.7	-36.8	173.5	-160.7	61.6	-153.1	0	0	111.3	W596 L597 L598 D602 K603 L604	W596-E600 PolarHBondContact O-N 2.97Å; L597-E600 PolarHBondContact O-N 2.87Å; L598-E600 PolarHBondContact O-N 2.94Å; E600-D602 VanDerWaalsContact C-N 3.33Å; E600-K603 PolarHBondContact O-N 3.04Å; E600-K603 WeakPolarHBondContact OE2-CD 3.43Å; E600-K603 WeakPolarHBondContact OE2-CE 3.45Å; E600-K603 IonicContact OE2-NZ 2.66Å; E600-K603 PolarHBondContact OE2-NZ 3.33Å; E600-L604 WeakPolarHBondContact O-CB 3.31Å; E600-L604 WeakPolarHBondContact O-CG 3.41Å; E600-L604 PolarHBondContact O-N 3.39Å
601	M	77.3	Confident	78.4	Confident	115 Å²	115	100.8 Å²	100.8	57%	0.567	50%	0.498	S	S	*	.	H	α-helix	trans	-67.3	-30.8	172.1	-171.8	166.1	61.8	0	0	112.3	L597 L598 G605	L597-M601 WeakPolarHBondContact O-CB 3.25Å; L597-M601 PolarHBondContact O-N 2.87Å; L598-M601 HydrophobicContact CD2-CE 3.79Å; L598-M601 CarbonylContact O-C 3.5Å; L598-M601 PolarHBondContact O-N 3.31Å; M601-G605 WeakPolarHBondContact O-CA 3.33Å; M601-G605 PolarHBondContact O-N 3Å
602	D	81.1	Confident	76.8	Confident	115 Å²	115	103.1 Å²	103.1	62%	0.615	51%	0.509	S	S	*	.	H	α-helix	trans	-69.2	-40.1	171.1	-75.6	-33.5	0	0	0	111.6	L598 S599 E600 G605 A606	L598-D602 PolarHBondContact O-N 3.45Å; S599-D602 PolarHBondContact O-N 2.89Å; E600-D602 VanDerWaalsContact C-N 3.33Å; D602-G605 PolarHBondContact O-N 3.18Å; D602-A606 WeakPolarHBondContact O-CB 3.45Å; D602-A606 PolarHBondContact O-N 2.95Å
603	K	80.4	Confident	75.5	Confident	116 Å²	116	105.9 Å²	105.9	50%	0.504	52%	0.524	S	S	.	.	H	α-helix	trans	-63.3	-45.5	172.1	-66.4	172.9	-151.7	160.6	0	111.4	S599 E600 G605 A606 R607	S599-K603 WeakPolarHBondContact O-CG 3.25Å; S599-K603 PolarHBondContact O-N 2.97Å; E600-K603 PolarHBondContact O-N 3.04Å; E600-K603 WeakPolarHBondContact OE2-CD 3.43Å; E600-K603 WeakPolarHBondContact OE2-CE 3.45Å; E600-K603 IonicContact OE2-NZ 2.66Å; E600-K603 PolarHBondContact OE2-NZ 3.33Å; K603-G605 VanDerWaalsContact C-N 3.3Å; K603-G605 PolarHBondContact O-N 3.32Å; K603-A606 PolarHBondContact O-N 3.29Å; K603-R607 PolarHBondContact O-N 2.8Å
604	L	76.4	Confident	73.9	Confident	84 Å²	84	111 Å²	111	44%	0.44	54%	0.538	S	S	.	.	H	α-helix	trans	-64	-36.8	174.3	-70.8	173	0	0	0	111.1	E600 R607 C608	E600-L604 WeakPolarHBondContact O-CB 3.31Å; E600-L604 WeakPolarHBondContact O-CG 3.41Å; E600-L604 PolarHBondContact O-N 3.39Å; L604-R607 CarbonylContact O-C 3.5Å; L604-R607 PolarHBondContact O-N 3.48Å; L604-C608 WeakPolarHBondContact O-CB 3.32Å; L604-C608 PolarHBondContact O-N 3.34Å; L604-C608 PolarHBondContact O-SG 2.93Å
605	G	79.8	Confident	71.9	Confident	30 Å²	30	108.3 Å²	108.3	31%	0.309	54%	0.535	S	S	.	.	H	α-helix	trans	-66.7	-38.7	175.7	0	0	0	0	0	113	M601 D602 K603 C608 K609	M601-G605 WeakPolarHBondContact O-CA 3.33Å; M601-G605 PolarHBondContact O-N 3Å; D602-G605 PolarHBondContact O-N 3.18Å; K603-G605 VanDerWaalsContact C-N 3.3Å; K603-G605 PolarHBondContact O-N 3.32Å; G605-C608 PolarHBondContact O-N 2.79Å; G605-K609 WeakPolarHBondContact O-CG 3.36Å; G605-K609 PolarHBondContact O-N 2.93Å
606	A	76.1	Confident	70.3	Confident	54 Å²	54	109.2 Å²	109.2	45%	0.446	56%	0.555	S	S	.	*	H	α-helix	trans	-62.6	-44.3	169.3	0	0	0	0	0	111	D602 K603 C608 K609 E610	D602-A606 WeakPolarHBondContact O-CB 3.45Å; D602-A606 PolarHBondContact O-N 2.95Å; K603-A606 PolarHBondContact O-N 3.29Å; A606-C608 VanDerWaalsContact C-N 3.33Å; A606-C608 PolarHBondContact O-N 3.32Å; A606-K609 PolarHBondContact O-N 3.27Å; A606-E610 PolarHBondContact O-N 3.11Å
607	R	72.4	Confident	68.7	Low	159 Å²	159	105.9 Å²	105.9	60%	0.6	55%	0.553	S	S	*	*	H	α-helix	trans	-66.3	-32.9	175.9	-146.8	171.3	94.1	-175.6	8	112.7	K603 L604 E610 L611	K603-R607 PolarHBondContact O-N 2.8Å; L604-R607 CarbonylContact O-C 3.5Å; L604-R607 PolarHBondContact O-N 3.48Å; R607-E610 PolarHBondContact O-N 3.44Å; R607-L611 VanDerWaalsContact O-CG 3.31Å; R607-L611 WeakPolarHBondContact O-CG 3.21Å; R607-L611 PolarHBondContact O-N 3.35Å; R607-L611 VanDerWaalsContact O-N 3.16Å
608	C	62.5	Low	67.4	Low	70 Å²	70	106 Å²	106	47%	0.473	56%	0.562	S	S	.	*	H	α-helix	trans	-67.4	-41.9	171	-75.4	0	0	0	0	111	L604 G605 A606 E610 L611 E612	L604-C608 WeakPolarHBondContact O-CB 3.32Å; L604-C608 PolarHBondContact O-N 3.34Å; L604-C608 PolarHBondContact O-SG 2.93Å; G605-C608 PolarHBondContact O-N 2.79Å; A606-C608 VanDerWaalsContact C-N 3.33Å; A606-C608 PolarHBondContact O-N 3.32Å; C608-E610 VanDerWaalsContact C-N 3.34Å; C608-E610 PolarHBondContact O-N 3.08Å; C608-L611 CarbonylContact O-C 3.53Å; C608-L611 WeakPolarHBondContact O-CA 3.43Å; C608-L611 PolarHBondContact O-N 3.43Å; C608-E612 WeakPolarHBondContact O-CB 3.47Å; C608-E612 WeakPolarHBondContact O-CG 3.46Å; C608-E612 PolarHBondContact O-N 2.96Å
609	K	66.5	Low	66	Low	139 Å²	139	111 Å²	111	60%	0.604	58%	0.583	S	S	*	*	H	α-helix	trans	-63.2	-36.5	173.1	-76.2	176.8	177.1	175.9	0	112.9	G605 A606 L611 N613	G605-K609 WeakPolarHBondContact O-CG 3.36Å; G605-K609 PolarHBondContact O-N 2.93Å; A606-K609 PolarHBondContact O-N 3.27Å; K609-L611 VanDerWaalsContact C-N 3.26Å; K609-L611 PolarHBondContact O-N 2.86Å; K609-N613 VanDerWaalsContact O-CB 3.31Å; K609-N613 WeakPolarHBondContact O-CB 3.27Å; K609-N613 PolarHBondContact O-N 2.67Å; K609-N613 PolarHBondContact O-ND2 3.37Å
610	E	61.6	Low	64.8	Low	138 Å²	138	114.3 Å²	114.3	65%	0.645	60%	0.596	S	S	*	*	H	α-helix	trans	-63.8	-30.1	171.5	-72.2	-177.2	152.2	0	0	112.9	A606 R607 C608	A606-E610 PolarHBondContact O-N 3.11Å; R607-E610 PolarHBondContact O-N 3.44Å; C608-E610 VanDerWaalsContact C-N 3.34Å; C608-E610 PolarHBondContact O-N 3.08Å
611	L	58.9	Low	63.2	Low	109 Å²	109	113.8 Å²	113.8	57%	0.571	60%	0.603	S	S	*	*	H	α-helix	trans	-84.8	-37.5	176.2	-68.9	168.6	0	0	0	112.9	R607 C608 K609 R614 S615	R607-L611 VanDerWaalsContact O-CG 3.31Å; R607-L611 WeakPolarHBondContact O-CG 3.21Å; R607-L611 PolarHBondContact O-N 3.35Å; R607-L611 VanDerWaalsContact O-N 3.16Å; C608-L611 CarbonylContact O-C 3.53Å; C608-L611 WeakPolarHBondContact O-CA 3.43Å; C608-L611 PolarHBondContact O-N 3.43Å; K609-L611 VanDerWaalsContact C-N 3.26Å; K609-L611 PolarHBondContact O-N 2.86Å; L611-R614 WeakPolarHBondContact O-CB 3.37Å; L611-R614 PolarHBondContact O-N 3.17Å; L611-S615 PolarHBondContact O-N 2.95Å
612	E	53.8	Low	62.4	Low	132 Å²	132	114.3 Å²	114.3	62%	0.617	60%	0.604	S	S	*	*	H	α-helix	trans	-64.4	-41.3	174.3	-77.8	-178.8	134	0	0	111.1	C608 R614 S615	C608-E612 WeakPolarHBondContact O-CB 3.47Å; C608-E612 WeakPolarHBondContact O-CG 3.46Å; C608-E612 PolarHBondContact O-N 2.96Å; E612-R614 PolarHBondContact O-N 2.83Å; E612-S615 PolarHBondContact O-N 3.32Å; E612-S615 VanDerWaalsContact O-O 3.14Å
613	N	57.8	Low	61.7	Low	147 Å²	147	111 Å²	111	79%	0.786	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-2.9	172.7	-71.8	-23.9	0	0	0	113.8	K609	K609-N613 VanDerWaalsContact O-CB 3.31Å; K609-N613 WeakPolarHBondContact O-CB 3.27Å; K609-N613 PolarHBondContact O-N 2.67Å; K609-N613 PolarHBondContact O-ND2 3.37Å
614	R	52.5	Low	60.6	Low	225 Å²	225	110.6 Å²	110.6	85%	0.849	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.2	3.6	172.4	-71.6	-178.5	164.9	-149.3	-2.4	113.8	L611 E612	L611-R614 WeakPolarHBondContact O-CB 3.37Å; L611-R614 PolarHBondContact O-N 3.17Å; E612-R614 PolarHBondContact O-N 2.83Å
615	S	45.2	Very low	60	Low	71 Å²	71	112.8 Å²	112.8	50%	0.497	61%	0.607	S	S	.	*	S	Bend	trans	-139.1	127.1	-172.5	-166	0	0	0	0	113.8	L611 E612 V617	L611-S615 PolarHBondContact O-N 2.95Å; E612-S615 PolarHBondContact O-N 3.32Å; E612-S615 VanDerWaalsContact O-O 3.14Å; S615-V617 VanDerWaalsContact C-N 3.26Å; S615-V617 PolarHBondContact O-N 3.13Å
616	S	50.8	Low	59.4	Low	126 Å²	126	114.6 Å²	114.6	88%	0.881	62%	0.619	S	S	*	*			trans	-80.6	43.1	-167.4	60.8	0	0	0	0	115.3
617	V	52.4	Low	59.2	Low	94 Å²	94	117.8 Å²	117.8	57%	0.57	63%	0.625	S	S	*	*			trans	-98	1.7	-172.7	-171.1	0	0	0	0	112.7	S615 E619	S615-V617 VanDerWaalsContact C-N 3.26Å; S615-V617 PolarHBondContact O-N 3.13Å; V617-E619 PolarHBondContact O-N 3Å
618	S	55.4	Low	58.7	Low	103 Å²	103	115.5 Å²	115.5	72%	0.72	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-24.4	-169.6	-169	0	0	0	0	116.4
619	E	55.4	Low	59.1	Low	180 Å²	180	114.9 Å²	114.9	84%	0.841	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-24.5	-174.2	-69.8	-177.5	140.2	0	0	114	V617	V617-E619 PolarHBondContact O-N 3Å
620	N	57.9	Low	59.5	Low	126 Å²	126	111.2 Å²	111.2	67%	0.674	62%	0.615	S	S	*	*	H	α-helix	trans	-82.9	-18.3	-174.7	-70.8	-22.4	0	0	0	114
621	A	53.8	Low	60	Low	56 Å²	56	108.6 Å²	108.6	46%	0.463	61%	0.606	S	S	.	*	H	α-helix	trans	-79.6	-26.3	-174.9	0	0	0	0	0	114	K625	A621-K625 PolarHBondContact O-N 3.09Å
622	E	58.9	Low	60.6	Low	126 Å²	126	107.6 Å²	107.6	59%	0.589	60%	0.604	S	S	*	*	H	α-helix	trans	-71.9	-37.6	176.2	-76.7	-71.1	112.3	0	0	111.8	K625 A626	E622-K625 PolarHBondContact O-N 2.95Å; E622-K625 IonicContact OE1-NZ 2.67Å; E622-K625 PolarHBondContact OE1-NZ 3.4Å; E622-A626 PolarHBondContact O-N 3.41Å
623	G	66.2	Low	61.7	Low	47 Å²	47	106.3 Å²	106.3	49%	0.485	61%	0.605	S	S	.	*	H	α-helix	trans	-62	-46.2	176.5	0	0	0	0	0	113.1	K625 A626 E627	G623-K625 VanDerWaalsContact C-N 3.3Å; G623-K625 PolarHBondContact O-N 3.41Å; G623-A626 PolarHBondContact O-N 3.07Å; G623-E627 PolarHBondContact O-N 2.97Å
624	L	58.3	Low	62.6	Low	107 Å²	107	104.1 Å²	104.1	56%	0.56	59%	0.59	S	S	*	*	H	α-helix	trans	-66.2	-27.6	179.2	-74.5	166.6	0	0	0	113.4	L628	L624-L628 WeakPolarHBondContact O-CB 3.46Å; L624-L628 PolarHBondContact O-N 3.14Å
625	K	64.7	Low	63.4	Low	129 Å²	129	98.3 Å²	98.3	56%	0.561	58%	0.576	S	S	*	*	H	α-helix	trans	-67.3	-39.3	172.7	-78.1	175.4	-174.1	166.1	0	112.6	A621 E622 G623 E627 A629	A621-K625 PolarHBondContact O-N 3.09Å; E622-K625 PolarHBondContact O-N 2.95Å; E622-K625 IonicContact OE1-NZ 2.67Å; E622-K625 PolarHBondContact OE1-NZ 3.4Å; G623-K625 VanDerWaalsContact C-N 3.3Å; G623-K625 PolarHBondContact O-N 3.41Å; K625-E627 VanDerWaalsContact C-N 3.35Å; K625-A629 PolarHBondContact O-N 3.38Å; K625-A629 VanDerWaalsContact O-N 3.1Å
626	A	65.5	Low	64.8	Low	69 Å²	69	99.5 Å²	99.5	57%	0.57	57%	0.574	S	S	*	*	H	α-helix	trans	-66.9	-38.2	178.6	0	0	0	0	0	111.7	E622 G623 A629 S630	E622-A626 PolarHBondContact O-N 3.41Å; G623-A626 PolarHBondContact O-N 3.07Å; A626-A629 PolarHBondContact O-N 3.36Å; A626-S630 PolarHBondContact O-N 3.38Å
627	E	71.9	Confident	65.9	Low	120 Å²	120	102.2 Å²	102.2	56%	0.561	57%	0.565	S	S	*	*	H	α-helix	trans	-70.6	-39	177.2	-163.1	167	-149	0	0	112.3	G623 K625 A629 S630 L631	G623-E627 PolarHBondContact O-N 2.97Å; K625-E627 VanDerWaalsContact C-N 3.35Å; E627-A629 VanDerWaalsContact C-N 3.32Å; E627-A629 PolarHBondContact O-N 3.29Å; E627-S630 PolarHBondContact O-N 3.28Å; E627-S630 PolarHBondContact O-OG 3.49Å; E627-L631 WeakPolarHBondContact O-CG 3.41Å; E627-L631 PolarHBondContact O-N 3.21Å
628	L	62	Low	66.9	Low	111 Å²	111	102.2 Å²	102.2	58%	0.581	56%	0.56	S	S	*	*	H	α-helix	trans	-61.5	-37.2	170.8	-91.5	163.2	0	0	0	113	L624 T632	L624-L628 WeakPolarHBondContact O-CB 3.46Å; L624-L628 PolarHBondContact O-N 3.14Å; L628-T632 WeakPolarHBondContact O-CB 3.48Å; L628-T632 PolarHBondContact O-N 2.99Å; L628-T632 PolarHBondContact O-OG1 3.45Å
629	A	70.8	Confident	67.7	Low	57 Å²	57	103 Å²	103	47%	0.471	55%	0.55	S	S	.	.	H	α-helix	trans	-64.1	-39.5	178	0	0	0	0	0	112.4	K625 A626 E627 T632 T633	K625-A629 PolarHBondContact O-N 3.38Å; K625-A629 VanDerWaalsContact O-N 3.1Å; A626-A629 PolarHBondContact O-N 3.36Å; E627-A629 VanDerWaalsContact C-N 3.32Å; E627-A629 PolarHBondContact O-N 3.29Å; A629-T632 PolarHBondContact O-N 3.49Å; A629-T633 PolarHBondContact O-N 2.83Å
630	S	76.4	Confident	68.3	Low	62 Å²	62	99.8 Å²	99.8	43%	0.434	54%	0.537	S	S	.	.	H	α-helix	trans	-67.3	-48.5	176.8	72.1	0	0	0	0	111.4	A626 E627 T632 T633 E634	A626-S630 PolarHBondContact O-N 3.38Å; E627-S630 PolarHBondContact O-N 3.28Å; E627-S630 PolarHBondContact O-OG 3.49Å; S630-T632 PolarHBondContact O-N 2.92Å; S630-T633 PolarHBondContact O-N 3.47Å; S630-T633 PolarHBondContact O-OG1 3.36Å; S630-E634 PolarHBondContact O-N 3.38Å; S630-E634 VanDerWaalsContact O-N 3.09Å
631	L	70.7	Confident	68.5	Low	84 Å²	84	99.5 Å²	99.5	44%	0.44	53%	0.532	S	S	.	.	H	α-helix	trans	-59.8	-30.5	177.8	-69.8	171.6	0	0	0	112.8	E627 E634 N635	E627-L631 WeakPolarHBondContact O-CG 3.41Å; E627-L631 PolarHBondContact O-N 3.21Å; L631-E634 PolarHBondContact O-N 3.1Å; L631-N635 PolarHBondContact O-N 3.01Å; L631-N635 PolarHBondContact O-ND2 3.27Å
632	T	73.1	Confident	68.7	Low	87 Å²	87	101.7 Å²	101.7	53%	0.534	54%	0.535	S	S	.	.	H	α-helix	trans	-68.8	-41.9	175.6	-53.6	0	0	0	0	111.4	L628 A629 S630 E634 N635 E636	L628-T632 WeakPolarHBondContact O-CB 3.48Å; L628-T632 PolarHBondContact O-N 2.99Å; L628-T632 PolarHBondContact O-OG1 3.45Å; A629-T632 PolarHBondContact O-N 3.49Å; S630-T632 PolarHBondContact O-N 2.92Å; T632-E634 VanDerWaalsContact C-N 3.32Å; T632-E634 PolarHBondContact O-N 3.16Å; T632-N635 PolarHBondContact O-N 3.32Å; T632-E636 PolarHBondContact O-N 2.94Å
633	T	75.3	Confident	68.6	Low	105 Å²	105	99.9 Å²	99.9	64%	0.644	53%	0.529	S	S	*	.	H	α-helix	trans	-68.1	-30.1	175.7	60.6	0	0	0	0	113.4	A629 S630 R637	A629-T633 PolarHBondContact O-N 2.83Å; S630-T633 PolarHBondContact O-N 3.47Å; S630-T633 PolarHBondContact O-OG1 3.36Å; T633-R637 PolarHBondContact O-N 3.47Å
634	E	76.7	Confident	68.2	Low	101 Å²	101	105.4 Å²	105.4	47%	0.472	54%	0.54	S	S	.	.	H	α-helix	trans	-74.5	-39	176.2	-174.3	152.6	-144.1	0	0	112.5	S630 L631 T632 E636 R637 M638	S630-E634 PolarHBondContact O-N 3.38Å; S630-E634 VanDerWaalsContact O-N 3.09Å; L631-E634 PolarHBondContact O-N 3.1Å; T632-E634 VanDerWaalsContact C-N 3.32Å; T632-E634 PolarHBondContact O-N 3.16Å; E634-E636 PolarHBondContact O-N 2.68Å; E634-R637 WeakPolarHBondContact O-CB 3.5Å; E634-R637 PolarHBondContact O-N 3.02Å; E634-M638 HydrophobicContact CG-CE 4.13Å; E634-M638 PolarHBondContact O-N 3.48Å
635	N	70.8	Confident	68.1	Low	103 Å²	103	107.3 Å²	107.3	55%	0.551	55%	0.546	S	S	*	.	H	α-helix	trans	-60.4	-43.3	174.2	-87.7	-74.2	0	0	0	112.8	L631 T632 R637 M638 K639	L631-N635 PolarHBondContact O-N 3.01Å; L631-N635 PolarHBondContact O-ND2 3.27Å; T632-N635 PolarHBondContact O-N 3.32Å; N635-R637 PolarHBondContact O-N 2.99Å; N635-M638 PolarHBondContact O-N 2.91Å; N635-M638 VanDerWaalsContact O-N 3.15Å; N635-K639 PolarHBondContact O-N 3.21Å
636	E	73.8	Confident	67.4	Low	96 Å²	96	109.8 Å²	109.8	45%	0.449	55%	0.553	S	S	.	*	H	α-helix	trans	-67.6	-27.3	179.6	-144.7	64.2	-164.1	0	0	111.8	T632 E634 K639 I640	T632-E636 PolarHBondContact O-N 2.94Å; E634-E636 PolarHBondContact O-N 2.68Å; E636-K639 VanDerWaalsContact CD-CD 3.47Å; E636-K639 WeakPolarHBondContact O-CB 3.24Å; E636-K639 WeakPolarHBondContact OE1-CD 3.43Å; E636-K639 IonicContact OE1-NZ 2.9Å; E636-K639 PolarHBondContact OE1-NZ 2.78Å; E636-K639 WeakPolarHBondContact OE2-CD 3.48Å; E636-K639 IonicContact OE2-NZ 2.67Å; E636-K639 PolarHBondContact OE2-NZ 3.4Å; E636-I640 PolarHBondContact O-N 3.07Å
637	R	73.9	Confident	66.9	Low	184 Å²	184	114.4 Å²	114.4	69%	0.694	56%	0.56	S	S	*	*	H	α-helix	trans	-69.7	-40.4	171.1	-166.9	-177.3	-175.7	-169.5	2	112.4	T633 E634 N635 I640 Q641	T633-R637 PolarHBondContact O-N 3.47Å; E634-R637 WeakPolarHBondContact O-CB 3.5Å; E634-R637 PolarHBondContact O-N 3.02Å; N635-R637 PolarHBondContact O-N 2.99Å; R637-I640 PolarHBondContact O-N 3.3Å; R637-Q641 PolarHBondContact O-N 3Å
638	M	72.8	Confident	65.8	Low	94 Å²	94	112.2 Å²	112.2	46%	0.463	56%	0.563	S	S	.	*	H	α-helix	trans	-65.2	-38.4	174.2	-66.6	-170.1	-174.4	0	0	111.8	E634 N635 I640 Q641 I642	E634-M638 HydrophobicContact CG-CE 4.13Å; E634-M638 PolarHBondContact O-N 3.48Å; N635-M638 PolarHBondContact O-N 2.91Å; N635-M638 VanDerWaalsContact O-N 3.15Å; M638-I640 VanDerWaalsContact C-N 3.3Å; M638-I640 PolarHBondContact O-N 2.97Å; M638-Q641 WeakPolarHBondContact O-CA 3.5Å; M638-Q641 WeakPolarHBondContact O-CB 3.36Å; M638-Q641 PolarHBondContact O-N 2.92Å; M638-I642 WeakPolarHBondContact O-CG1 3.41Å; M638-I642 PolarHBondContact O-N 2.8Å
639	K	72.5	Confident	65	Low	118 Å²	118	111 Å²	111	51%	0.513	57%	0.569	S	S	.	*	H	α-helix	trans	-54.3	-43.5	174.8	-138.9	176.8	-170.8	172.8	0	112.5	N635 E636 Q641 I642 D643	N635-K639 PolarHBondContact O-N 3.21Å; E636-K639 VanDerWaalsContact CD-CD 3.47Å; E636-K639 WeakPolarHBondContact O-CB 3.24Å; E636-K639 WeakPolarHBondContact OE1-CD 3.43Å; E636-K639 IonicContact OE1-NZ 2.9Å; E636-K639 PolarHBondContact OE1-NZ 2.78Å; E636-K639 WeakPolarHBondContact OE2-CD 3.48Å; E636-K639 IonicContact OE2-NZ 2.67Å; E636-K639 PolarHBondContact OE2-NZ 3.4Å; K639-Q641 VanDerWaalsContact C-N 3.33Å; K639-Q641 PolarHBondContact O-N 3.49Å; K639-I642 PolarHBondContact O-N 3.31Å; K639-D643 PolarHBondContact O-N 3.47Å; K639-D643 VanDerWaalsContact O-N 3.09Å
640	I	68.2	Low	63.2	Low	113 Å²	113	118.6 Å²	118.6	58%	0.579	59%	0.585	S	S	*	*	H	α-helix	trans	-69.7	-27.4	177.2	-66.1	168.7	0	0	0	112.2	E636 R637 M638	E636-I640 PolarHBondContact O-N 3.07Å; R637-I640 PolarHBondContact O-N 3.3Å; M638-I640 VanDerWaalsContact C-N 3.3Å; M638-I640 PolarHBondContact O-N 2.97Å
641	Q	63.4	Low	61.5	Low	121 Å²	121	121.9 Å²	121.9	57%	0.565	60%	0.603	S	S	*	*	H	α-helix	trans	-74.9	-39.8	170.7	-75	-178.8	-48.6	0	0	112.1	R637 M638 K639 D643 K644 H645	R637-Q641 PolarHBondContact O-N 3Å; M638-Q641 WeakPolarHBondContact O-CA 3.5Å; M638-Q641 WeakPolarHBondContact O-CB 3.36Å; M638-Q641 PolarHBondContact O-N 2.92Å; K639-Q641 VanDerWaalsContact C-N 3.33Å; K639-Q641 PolarHBondContact O-N 3.49Å; Q641-D643 VanDerWaalsContact C-N 3.35Å; Q641-D643 PolarHBondContact O-N 2.81Å; Q641-K644 WeakPolarHBondContact O-CB 3.17Å; Q641-K644 PolarHBondContact O-N 3.2Å; Q641-K644 VanDerWaalsContact O-N 3.17Å; Q641-H645 PolarHBondContact O-CD2 3.21Å; Q641-H645 PolarHBondContact O-N 2.94Å; Q641-H645 VanDerWaalsContact O-N 3.16Å
642	I	57.2	Low	59.6	Low	102 Å²	102	123.6 Å²	123.6	52%	0.523	62%	0.622	S	S	.	*	H	α-helix	trans	-61.8	-41.6	177.2	-68.2	168.4	0	0	0	110.9	M638 K639 K644 H645 Y646	M638-I642 WeakPolarHBondContact O-CG1 3.41Å; M638-I642 PolarHBondContact O-N 2.8Å; K639-I642 PolarHBondContact O-N 3.31Å; I642-K644 VanDerWaalsContact C-N 3.25Å; I642-K644 PolarHBondContact O-N 3.36Å; I642-H645 PolarHBondContact O-N 3.42Å; I642-Y646 HydrophobicContact CG2-CD2 4.1Å; I642-Y646 PolarHBondContact O-N 2.74Å
643	D	55.8	Low	58.2	Low	87 Å²	87	124.7 Å²	124.7	47%	0.465	63%	0.63	S	S	.	*	H	α-helix	trans	-67.2	-22.5	177.7	-163.1	61.1	0	0	0	113.7	K639 Q641 K647	K639-D643 PolarHBondContact O-N 3.47Å; K639-D643 VanDerWaalsContact O-N 3.09Å; Q641-D643 VanDerWaalsContact C-N 3.35Å; Q641-D643 PolarHBondContact O-N 2.81Å; D643-K647 IonicContact OD1-NZ 3.37Å; D643-K647 IonicContact OD2-NZ 3.2Å; D643-K647 PolarHBondContact OD2-NZ 3.24Å
644	K	59	Low	56.2	Low	164 Å²	164	125.9 Å²	125.9	71%	0.713	63%	0.633	S	S	*	*	H	α-helix	trans	-75.8	-35.5	168.9	-81.6	-177.6	174.3	178.9	0	112.9	Q641 I642	Q641-K644 WeakPolarHBondContact O-CB 3.17Å; Q641-K644 PolarHBondContact O-N 3.2Å; Q641-K644 VanDerWaalsContact O-N 3.17Å; I642-K644 VanDerWaalsContact C-N 3.25Å; I642-K644 PolarHBondContact O-N 3.36Å
645	H	55.7	Low	54.1	Low	146 Å²	146	129 Å²	129	68%	0.676	65%	0.647	S	S	*	*	H	α-helix	trans	-74.7	-34.5	176.2	-80.2	-78.2	0	0	0	112.4	Q641 I642 K647 A648	Q641-H645 PolarHBondContact O-CD2 3.21Å; Q641-H645 PolarHBondContact O-N 2.94Å; Q641-H645 VanDerWaalsContact O-N 3.16Å; I642-H645 PolarHBondContact O-N 3.42Å; H645-K647 VanDerWaalsContact C-N 3.3Å; H645-K647 PolarHBondContact O-N 2.98Å; H645-A648 WeakPolarHBondContact O-CB 3.17Å; H645-A648 PolarHBondContact O-N 2.9Å; H645-A648 VanDerWaalsContact O-N 3.1Å
646	Y	51	Low	52.6	Low	182 Å²	182	130 Å²	130	71%	0.714	66%	0.657	S	S	*	*	H	α-helix	trans	-61.3	-34.1	179.6	-117	-91.9	0	0	0	113.6	I642 A648	I642-Y646 HydrophobicContact CG2-CD2 4.1Å; I642-Y646 PolarHBondContact O-N 2.74Å; Y646-A648 PolarHBondContact O-N 3.02Å
647	K	54	Low	50.6	Low	165 Å²	165	131.9 Å²	131.9	72%	0.717	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-5.2	178.2	-72.2	164.9	-179	145.4	0	114.2	D643 H645	D643-K647 IonicContact OD1-NZ 3.37Å; D643-K647 IonicContact OD2-NZ 3.2Å; D643-K647 PolarHBondContact OD2-NZ 3.24Å; H645-K647 VanDerWaalsContact C-N 3.3Å; H645-K647 PolarHBondContact O-N 2.98Å
648	A	49.2	Very low	49.2	Very low	75 Å²	75	129.4 Å²	129.4	62%	0.62	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	-14.9	176.2	0	0	0	0	0	113.7	H645 Y646 R650	H645-A648 WeakPolarHBondContact O-CB 3.17Å; H645-A648 PolarHBondContact O-N 2.9Å; H645-A648 VanDerWaalsContact O-N 3.1Å; Y646-A648 PolarHBondContact O-N 3.02Å; A648-R650 PolarHBondContact O-N 3.05Å
649	A	44	Very low	47.8	Very low	86 Å²	86	132.8 Å²	132.8	71%	0.711	69%	0.685	S	S	*	*			trans	-77.9	67.1	178.8	0	0	0	0	0	112.1
650	R	34.7	Very low	46.4	Very low	216 Å²	216	133.2 Å²	133.2	82%	0.815	70%	0.697	S	S	*	*			trans	-54.4	156.3	163.9	-96.9	177.8	169.5	172.1	-4.2	111.5	A648	A648-R650 PolarHBondContact O-N 3.05Å
651	T	40.7	Very low	45.5	Very low	130 Å²	130	130 Å²	130	80%	0.798	69%	0.685	S	S	*	*			trans	55.3	102.3	148	55.1	0	0	0	0	118.6
652	S	31	Very low	44.9	Very low	120 Å²	120	134.7 Å²	134.7	84%	0.839	70%	0.697	S	S	*	*				179.1	149.6	103.9	-159	0	0	0	0	110.9
653	P	42	Very low	44.7	Very low	110 Å²	110	137.2 Å²	137.2	71%	0.714	71%	0.707	S	S	*	*			trans	-115.4	172.5	-170.2	41.5	-31.1	0	0	0	115
654	D	33.6	Very low	44.9	Very low	131 Å²	131	138.5 Å²	138.5	70%	0.701	71%	0.71	S	S	*	*			trans	-165.3	123.4	149.3	-108.2	0.8	0	0	0	109.3
655	H	32.8	Very low	45.1	Very low	166 Å²	166	133.7 Å²	133.7	77%	0.769	70%	0.701	S	S	*	*				77.8	133.6	103.7	-68.6	5.6	0	0	0	113.8
656	T	39	Very low	45.6	Very low	125 Å²	125	134.9 Å²	134.9	77%	0.767	70%	0.7	S	S	*	*			cis	-147.1	138	38.9	38.2	0	0	0	0	112.7
657	L	32.8	Very low	46.8	Very low	134 Å²	134	131.4 Å²	131.4	70%	0.702	69%	0.694	S	S	*	*				67.1	123.7	95.3	-128.3	82.1	0	0	0	113.9
658	N	44.3	Very low	47.8	Very low	133 Å²	133	130.2 Å²	130.2	71%	0.711	69%	0.691	S	S	*	*			cis	-128.2	178	22.7	-49.9	-27.5	0	0	0	110.4
659	Q	43.6	Very low	49	Very low	164 Å²	164	132.6 Å²	132.6	77%	0.766	69%	0.693	S	S	*	*			cis	81.9	78.9	5.4	-63.6	178.3	-74	0	0	119.5
660	V	42.2	Very low	50.7	Low	128 Å²	128	131.8 Å²	131.8	78%	0.776	68%	0.682	S	S	*	*	S	Bend	trans	-122.1	118.4	135.2	173.6	0	0	0	0	106.9
661	S	49.1	Very low	52.9	Low	46 Å²	46	124 Å²	124	32%	0.322	66%	0.661	S	S	.	*			trans	37.8	74.5	160.4	-51.4	0	0	0	0	119.9	E663 E664 A665	S661-E663 PolarHBondContact O-N 3.12Å; S661-E664 VanDerWaalsContact CB-CB 3.45Å; S661-E664 WeakPolarHBondContact CB-OE1 3.35Å; S661-E664 WeakPolarHBondContact CB-OE2 3.45Å; S661-E664 PolarHBondContact O-N 3.47Å; S661-E664 PolarHBondContact OG-OE1 3.19Å; S661-A665 PolarHBondContact O-N 3.17Å
662	R	50.9	Low	55	Low	218 Å²	218	122 Å²	122	82%	0.823	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-16.6	156.8	-164.2	172.5	-177	163.3	0.5	112.5	Y666	R662-Y666 PolarHBondContact O-N 3.17Å
663	E	53	Low	57.5	Low	156 Å²	156	122.1 Å²	122.1	73%	0.729	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-46.7	168	-77.1	170.7	141.4	0	0	112	S661 A665 Y666 D667	S661-E663 PolarHBondContact O-N 3.12Å; E663-A665 VanDerWaalsContact C-N 3.26Å; E663-A665 PolarHBondContact O-N 2.88Å; E663-Y666 CarbonylContact O-C 3.47Å; E663-Y666 WeakPolarHBondContact O-CA 3.28Å; E663-Y666 WeakPolarHBondContact O-CB 3.44Å; E663-Y666 PolarHBondContact O-N 2.66Å; E663-D667 PolarHBondContact O-N 3.39Å
664	E	60.8	Low	59.5	Low	114 Å²	114	124 Å²	124	53%	0.533	63%	0.627	S	S	.	*	H	α-helix	trans	-55.8	-40.8	173.4	-76.4	159.6	-144.6	0	0	111.6	S661 Y666 D667 E668	S661-E664 VanDerWaalsContact CB-CB 3.45Å; S661-E664 WeakPolarHBondContact CB-OE1 3.35Å; S661-E664 WeakPolarHBondContact CB-OE2 3.45Å; S661-E664 PolarHBondContact O-N 3.47Å; S661-E664 PolarHBondContact OG-OE1 3.19Å; E664-Y666 PolarHBondContact O-N 2.98Å; E664-D667 PolarHBondContact O-N 2.98Å; E664-E668 WeakPolarHBondContact O-CB 3.44Å; E664-E668 PolarHBondContact O-N 3.38Å
665	A	61.9	Low	62.1	Low	62 Å²	62	122.7 Å²	122.7	51%	0.512	62%	0.615	S	S	.	*	H	α-helix	trans	-64.3	-26.4	174.5	0	0	0	0	0	113.5	S661 E663 L669	S661-A665 PolarHBondContact O-N 3.17Å; E663-A665 VanDerWaalsContact C-N 3.26Å; E663-A665 PolarHBondContact O-N 2.88Å; A665-L669 WeakPolarHBondContact O-CB 3.18Å; A665-L669 PolarHBondContact O-N 3.25Å
666	Y	67.1	Low	64.6	Low	171 Å²	171	120.1 Å²	120.1	67%	0.671	61%	0.606	S	S	*	*	H	α-helix	trans	-82.3	-39.9	173.6	-111.2	-81.6	0	0	0	111.8	R662 E663 E664 L669 S670	R662-Y666 PolarHBondContact O-N 3.17Å; E663-Y666 CarbonylContact O-C 3.47Å; E663-Y666 WeakPolarHBondContact O-CA 3.28Å; E663-Y666 WeakPolarHBondContact O-CB 3.44Å; E663-Y666 PolarHBondContact O-N 2.66Å; E664-Y666 PolarHBondContact O-N 2.98Å; Y666-L669 PolarHBondContact O-N 2.99Å; Y666-S670 WeakPolarHBondContact O-CB 3.42Å; Y666-S670 PolarHBondContact O-N 2.82Å
667	D	75.6	Confident	66.9	Low	109 Å²	109	119.6 Å²	119.6	58%	0.583	60%	0.595	S	S	*	*	H	α-helix	trans	-69.3	-36.6	177.3	-73	-27.4	0	0	0	111.8	E663 E664 S670 S671	E663-D667 PolarHBondContact O-N 3.39Å; E664-D667 PolarHBondContact O-N 2.98Å; D667-S670 PolarHBondContact O-N 2.88Å; D667-S671 WeakPolarHBondContact O-CB 3.42Å; D667-S671 PolarHBondContact O-N 2.97Å
668	E	76.1	Confident	69.5	Low	140 Å²	140	118 Å²	118	65%	0.654	58%	0.583	S	S	*	*	H	α-helix	trans	-70.5	-41.2	174.6	-169.5	159.3	-136.8	0	0	111	E664 S670 S671 E672	E664-E668 WeakPolarHBondContact O-CB 3.44Å; E664-E668 PolarHBondContact O-N 3.38Å; E668-S670 VanDerWaalsContact C-N 3.33Å; E668-S670 PolarHBondContact O-N 3.23Å; E668-S671 PolarHBondContact O-N 3.45Å; E668-E672 PolarHBondContact O-N 2.99Å
669	L	74.1	Confident	71.7	Confident	125 Å²	125	118.4 Å²	118.4	65%	0.654	58%	0.579	S	S	*	*	H	α-helix	trans	-64.4	-38	171.3	-156.3	82.6	0	0	0	111.9	A665 Y666 L673	A665-L669 WeakPolarHBondContact O-CB 3.18Å; A665-L669 PolarHBondContact O-N 3.25Å; Y666-L669 PolarHBondContact O-N 2.99Å; L669-L673 VanDerWaalsContact O-CB 3.3Å; L669-L673 WeakPolarHBondContact O-CB 3.4Å; L669-L673 PolarHBondContact O-N 3.47Å
670	S	79.5	Confident	73.8	Confident	70 Å²	70	115.5 Å²	115.5	49%	0.49	56%	0.564	S	S	.	*	H	α-helix	trans	-67.7	-40.3	176.1	-172.1	0	0	0	0	111.9	Y666 D667 E668 L673 Y674	Y666-S670 WeakPolarHBondContact O-CB 3.42Å; Y666-S670 PolarHBondContact O-N 2.82Å; D667-S670 PolarHBondContact O-N 2.88Å; E668-S670 VanDerWaalsContact C-N 3.33Å; E668-S670 PolarHBondContact O-N 3.23Å; S670-L673 PolarHBondContact O-N 3.16Å; S670-Y674 WeakPolarHBondContact O-CB 3.5Å; S670-Y674 PolarHBondContact O-N 3.12Å
671	S	80.3	Confident	76.1	Confident	52 Å²	52	116.8 Å²	116.8	36%	0.364	56%	0.556	S	S	.	*	H	α-helix	trans	-62.3	-48.2	173.8	179.8	0	0	0	0	111.5	D667 E668 Y674 K675	D667-S671 WeakPolarHBondContact O-CB 3.42Å; D667-S671 PolarHBondContact O-N 2.97Å; E668-S671 PolarHBondContact O-N 3.45Å; S671-Y674 PolarHBondContact O-N 2.97Å; S671-K675 VanDerWaalsContact O-CG 3.31Å; S671-K675 WeakPolarHBondContact O-CG 3.46Å; S671-K675 PolarHBondContact O-N 3.46Å; S671-K675 WeakPolarHBondContact OG-CE 3.5Å
672	E	85.2	Confident	77.9	Confident	89 Å²	89	117.3 Å²	117.3	42%	0.416	56%	0.56	S	S	.	*	H	α-helix	trans	-64.5	-39.1	174.1	-74.4	-56.1	129.2	0	0	112.3	E668 Y674 K675 L676	E668-E672 PolarHBondContact O-N 2.99Å; E672-Y674 VanDerWaalsContact C-N 3.33Å; E672-Y674 PolarHBondContact O-N 3.36Å; E672-K675 PolarHBondContact O-N 2.76Å; E672-K675 WeakPolarHBondContact OE1-CD 3.38Å; E672-K675 IonicContact OE1-NZ 3.51Å; E672-K675 PolarHBondContact OE1-NZ 3Å; E672-L676 WeakPolarHBondContact O-CB 3.24Å; E672-L676 PolarHBondContact O-N 3.5Å
673	L	83.4	Confident	79.6	Confident	121 Å²	121	111 Å²	111	63%	0.634	54%	0.541	S	S	*	.	H	α-helix	trans	-62	-41.1	174.1	-157.6	85.9	0	0	0	111.5	L669 S670 L676 H677	L669-L673 VanDerWaalsContact O-CB 3.3Å; L669-L673 WeakPolarHBondContact O-CB 3.4Å; L669-L673 PolarHBondContact O-N 3.47Å; S670-L673 PolarHBondContact O-N 3.16Å; L673-L676 PolarHBondContact O-N 3.48Å; L673-H677 WeakPolarHBondContact O-CB 3.23Å; L673-H677 PolarHBondContact O-N 2.99Å
674	Y	85	Confident	81.4	Confident	151 Å²	151	107.6 Å²	107.6	59%	0.592	53%	0.526	S	S	*	.	H	α-helix	trans	-67.4	-43.8	177.4	-175.8	-100.2	0	0	0	112.1	S670 S671 E672 L676 H677 Q678	S670-Y674 WeakPolarHBondContact O-CB 3.5Å; S670-Y674 PolarHBondContact O-N 3.12Å; S671-Y674 PolarHBondContact O-N 2.97Å; E672-Y674 VanDerWaalsContact C-N 3.33Å; E672-Y674 PolarHBondContact O-N 3.36Å; Y674-L676 PolarHBondContact O-N 3.39Å; Y674-H677 PolarHBondContact O-N 2.91Å; Y674-Q678 HydrophobicContact CD1-CG 4.35Å; Y674-Q678 HydrophobicContact CE1-CG 3.95Å; Y674-Q678 PolarHBondContact O-N 3.47Å; Y674-Q678 PolarHBondContact OH-NE2 2.81Å; Y674-Q678 VanDerWaalsContact OH-NE2 3.13Å
675	K	87.7	Confident	82.8	Confident	102 Å²	102	107.5 Å²	107.5	44%	0.443	52%	0.524	S	S	.	.	H	α-helix	trans	-59.8	-43.9	172.7	-68.9	170.9	-159.2	168.7	0	111.6	S671 E672 H677 Q678 K679	S671-K675 VanDerWaalsContact O-CG 3.31Å; S671-K675 WeakPolarHBondContact O-CG 3.46Å; S671-K675 PolarHBondContact O-N 3.46Å; S671-K675 WeakPolarHBondContact OG-CE 3.5Å; E672-K675 PolarHBondContact O-N 2.76Å; E672-K675 WeakPolarHBondContact OE1-CD 3.38Å; E672-K675 IonicContact OE1-NZ 3.51Å; E672-K675 PolarHBondContact OE1-NZ 3Å; K675-H677 VanDerWaalsContact C-N 3.34Å; K675-Q678 PolarHBondContact O-N 2.93Å; K675-K679 WeakPolarHBondContact O-CB 3.33Å; K675-K679 PolarHBondContact O-N 3.09Å
676	L	85.2	Confident	84.1	Confident	112 Å²	112	109.6 Å²	109.6	59%	0.586	52%	0.523	S	S	*	.	H	α-helix	trans	-61.8	-40.9	174.2	-86.8	166.6	0	0	0	111.8	E672 L673 Y674 K679 K680	E672-L676 WeakPolarHBondContact O-CB 3.24Å; E672-L676 PolarHBondContact O-N 3.5Å; L673-L676 PolarHBondContact O-N 3.48Å; Y674-L676 PolarHBondContact O-N 3.39Å; L676-K679 PolarHBondContact O-N 2.95Å; L676-K680 VanDerWaalsContact O-CB 3.27Å; L676-K680 WeakPolarHBondContact O-CB 3.42Å; L676-K680 PolarHBondContact O-N 3.34Å
677	H	87.9	Confident	84.9	Confident	115 Å²	115	107.2 Å²	107.2	53%	0.532	52%	0.519	S	S	.	.	H	α-helix	trans	-71	-35.7	179.4	-150.4	-64.4	0	0	0	112.6	L673 Y674 K675 Y681	L673-H677 WeakPolarHBondContact O-CB 3.23Å; L673-H677 PolarHBondContact O-N 2.99Å; Y674-H677 PolarHBondContact O-N 2.91Å; K675-H677 VanDerWaalsContact C-N 3.34Å; H677-Y681 WeakPolarHBondContact O-CB 3.35Å; H677-Y681 PolarHBondContact O-N 3.43Å
678	Q	86.5	Confident	85.6	Confident	99 Å²	99	105.2 Å²	105.2	46%	0.463	51%	0.514	S	S	.	.	H	α-helix	trans	-64.3	-47.5	169.3	-76.3	-167.5	-23.2	0	0	111.4	Y674 K675 K680 Y681 S682	Y674-Q678 HydrophobicContact CD1-CG 4.35Å; Y674-Q678 HydrophobicContact CE1-CG 3.95Å; Y674-Q678 PolarHBondContact O-N 3.47Å; Y674-Q678 PolarHBondContact OH-NE2 2.81Å; Y674-Q678 VanDerWaalsContact OH-NE2 3.13Å; K675-Q678 PolarHBondContact O-N 2.93Å; Q678-K680 VanDerWaalsContact C-N 3.33Å; Q678-K680 PolarHBondContact O-N 2.91Å; Q678-Y681 PolarHBondContact O-N 3.02Å; Q678-Y681 VanDerWaalsContact O-N 3.16Å; Q678-S682 PolarHBondContact O-N 3.4Å; Q678-S682 PolarHBondContact O-OG 3.27Å
679	K	90.1	Very high	86.1	Confident	142 Å²	142	102.7 Å²	102.7	62%	0.617	50%	0.502	S	S	*	.	H	α-helix	trans	-63.2	-39.1	178.8	-170.3	171.1	-175.3	174.4	0	112	K675 L676 S682 L683	K675-K679 WeakPolarHBondContact O-CB 3.33Å; K675-K679 PolarHBondContact O-N 3.09Å; L676-K679 PolarHBondContact O-N 2.95Å; K679-S682 PolarHBondContact O-N 2.71Å; K679-L683 HydrophobicContact CG-CD1 4.16Å; K679-L683 WeakPolarHBondContact O-CB 3.36Å; K679-L683 VanDerWaalsContact O-CG 3.28Å; K679-L683 WeakPolarHBondContact O-CG 3.44Å; K679-L683 PolarHBondContact O-N 2.99Å
680	K	88.3	Confident	86.7	Confident	103 Å²	103	100.8 Å²	100.8	45%	0.448	50%	0.496	S	S	.	.	H	α-helix	trans	-58.1	-50	171.5	-179.5	-170.8	162.6	-172.5	0	110.8	L676 Q678 S682 L683 E684	L676-K680 VanDerWaalsContact O-CB 3.27Å; L676-K680 WeakPolarHBondContact O-CB 3.42Å; L676-K680 PolarHBondContact O-N 3.34Å; Q678-K680 VanDerWaalsContact C-N 3.33Å; Q678-K680 PolarHBondContact O-N 2.91Å; K680-S682 PolarHBondContact O-N 3.06Å; K680-L683 PolarHBondContact O-N 3.25Å; K680-E684 WeakPolarHBondContact CE-OE1 3.47Å; K680-E684 WeakPolarHBondContact CE-OE2 3.44Å; K680-E684 HydrophobicContact CG-CG 4.4Å; K680-E684 IonicContact NZ-OE1 2.67Å; K680-E684 PolarHBondContact NZ-OE1 3.21Å; K680-E684 WeakPolarHBondContact O-CB 3.24Å; K680-E684 WeakPolarHBondContact O-CG 3.35Å; K680-E684 PolarHBondContact O-N 2.94Å
681	Y	90.6	Very high	87	Confident	156 Å²	156	103.9 Å²	103.9	61%	0.612	50%	0.502	S	S	*	.	H	α-helix	trans	-61.3	-41.9	179.2	-179	-96.4	0	0	0	112.7	H677 Q678 E684 K685	H677-Y681 WeakPolarHBondContact O-CB 3.35Å; H677-Y681 PolarHBondContact O-N 3.43Å; Q678-Y681 PolarHBondContact O-N 3.02Å; Q678-Y681 VanDerWaalsContact O-N 3.16Å; Y681-E684 PolarHBondContact O-N 2.96Å; Y681-K685 PolarHBondContact O-N 2.95Å
682	S	87.2	Confident	87.3	Confident	57 Å²	57	105.9 Å²	105.9	40%	0.399	51%	0.512	S	S	.	.	H	α-helix	trans	-61.7	-44.9	173.7	-61.6	0	0	0	0	112.1	Q678 K679 K680 K685 E686	Q678-S682 PolarHBondContact O-N 3.4Å; Q678-S682 PolarHBondContact O-OG 3.27Å; K679-S682 PolarHBondContact O-N 2.71Å; K680-S682 PolarHBondContact O-N 3.06Å; S682-K685 WeakPolarHBondContact O-CB 3.2Å; S682-K685 PolarHBondContact O-N 3.33Å; S682-E686 WeakPolarHBondContact O-CG 3.5Å; S682-E686 PolarHBondContact O-N 3.04Å
683	L	87.2	Confident	87.4	Confident	84 Å²	84	107 Å²	107	44%	0.44	52%	0.518	S	S	.	.	H	α-helix	trans	-66.5	-35.2	177	-71.4	169.6	0	0	0	112.6	K679 K680 K685 M687	K679-L683 HydrophobicContact CG-CD1 4.16Å; K679-L683 WeakPolarHBondContact O-CB 3.36Å; K679-L683 VanDerWaalsContact O-CG 3.28Å; K679-L683 WeakPolarHBondContact O-CG 3.44Å; K679-L683 PolarHBondContact O-N 2.99Å; K680-L683 PolarHBondContact O-N 3.25Å; L683-K685 VanDerWaalsContact C-N 3.34Å; L683-M687 WeakPolarHBondContact O-CB 3.44Å; L683-M687 PolarHBondContact O-N 3.01Å
684	E	88.9	Confident	87.5	Confident	85 Å²	85	105.6 Å²	105.6	40%	0.397	51%	0.51	S	S	.	.	H	α-helix	trans	-67.2	-34.6	173.7	-75.1	174.2	151.8	0	0	111.6	K680 Y681 S688	K680-E684 WeakPolarHBondContact CE-OE1 3.47Å; K680-E684 WeakPolarHBondContact CE-OE2 3.44Å; K680-E684 HydrophobicContact CG-CG 4.4Å; K680-E684 IonicContact NZ-OE1 2.67Å; K680-E684 PolarHBondContact NZ-OE1 3.21Å; K680-E684 WeakPolarHBondContact O-CB 3.24Å; K680-E684 WeakPolarHBondContact O-CG 3.35Å; K680-E684 PolarHBondContact O-N 2.94Å; Y681-E684 PolarHBondContact O-N 2.96Å; E684-S688 WeakPolarHBondContact O-CB 3.5Å; E684-S688 PolarHBondContact O-N 2.89Å; E684-S688 PolarHBondContact O-OG 2.93Å
685	K	90	Very high	87.7	Confident	112 Å²	112	104.1 Å²	104.1	49%	0.487	51%	0.507	S	S	.	.	H	α-helix	trans	-68.6	-50.9	172.3	-176.6	178.4	179.1	-76.2	0	111.9	Y681 S682 L683 M687 S688 E689	Y681-K685 PolarHBondContact O-N 2.95Å; S682-K685 WeakPolarHBondContact O-CB 3.2Å; S682-K685 PolarHBondContact O-N 3.33Å; L683-K685 VanDerWaalsContact C-N 3.34Å; K685-M687 VanDerWaalsContact C-N 3.3Å; K685-M687 PolarHBondContact O-N 3.37Å; K685-S688 WeakPolarHBondContact O-CB 3.44Å; K685-S688 PolarHBondContact O-N 3.4Å; K685-S688 VanDerWaalsContact O-N 3.09Å; K685-E689 WeakPolarHBondContact CE-OE1 3.06Å; K685-E689 IonicContact NZ-OE1 2.73Å; K685-E689 PolarHBondContact NZ-OE1 3.02Å; K685-E689 IonicContact NZ-OE2 2.63Å; K685-E689 WeakPolarHBondContact O-CG 3.45Å; K685-E689 PolarHBondContact O-N 2.83Å
686	E	90.1	Very high	87.6	Confident	106 Å²	106	101.7 Å²	101.7	50%	0.495	50%	0.503	S	S	.	.	H	α-helix	trans	-58.5	-41.7	176.4	-72.9	169.3	-166.9	0	0	111.5	S682 S688 E689 V690	S682-E686 WeakPolarHBondContact O-CG 3.5Å; S682-E686 PolarHBondContact O-N 3.04Å; E686-S688 VanDerWaalsContact C-N 3.33Å; E686-S688 PolarHBondContact O-N 2.86Å; E686-E689 PolarHBondContact O-N 2.88Å; E686-V690 WeakPolarHBondContact O-CG2 3.49Å; E686-V690 PolarHBondContact O-N 3.47Å
687	M	84.5	Confident	87.6	Confident	122 Å²	122	104.2 Å²	104.2	60%	0.601	51%	0.506	S	S	*	.	H	α-helix	trans	-62.5	-39.6	175.2	-169.7	-173.2	-43.3	0	0	111.9	L683 K685 Q691	L683-M687 WeakPolarHBondContact O-CB 3.44Å; L683-M687 PolarHBondContact O-N 3.01Å; K685-M687 VanDerWaalsContact C-N 3.3Å; K685-M687 PolarHBondContact O-N 3.37Å; M687-Q691 WeakPolarHBondContact O-CB 3.3Å; M687-Q691 PolarHBondContact O-N 2.97Å
688	S	89	Confident	87.5	Confident	67 Å²	67	103.5 Å²	103.5	47%	0.469	50%	0.503	S	S	.	.	H	α-helix	trans	-65.8	-41.2	175.8	-58	0	0	0	0	111.9	E684 K685 E686 Q691 T692	E684-S688 WeakPolarHBondContact O-CB 3.5Å; E684-S688 PolarHBondContact O-N 2.89Å; E684-S688 PolarHBondContact O-OG 2.93Å; K685-S688 WeakPolarHBondContact O-CB 3.44Å; K685-S688 PolarHBondContact O-N 3.4Å; K685-S688 VanDerWaalsContact O-N 3.09Å; E686-S688 VanDerWaalsContact C-N 3.33Å; E686-S688 PolarHBondContact O-N 2.86Å; S688-Q691 PolarHBondContact O-N 3.42Å; S688-T692 PolarHBondContact O-N 3.16Å; S688-T692 PolarHBondContact O-OG1 2.93Å
689	E	87.8	Confident	87.4	Confident	87 Å²	87	103.4 Å²	103.4	41%	0.407	50%	0.503	S	S	.	.	H	α-helix	trans	-63.6	-51.5	177	-72.7	168.7	177.7	0	0	110.8	K685 E686 Q691 T692 E693	K685-E689 WeakPolarHBondContact CE-OE1 3.06Å; K685-E689 IonicContact NZ-OE1 2.73Å; K685-E689 PolarHBondContact NZ-OE1 3.02Å; K685-E689 IonicContact NZ-OE2 2.63Å; K685-E689 WeakPolarHBondContact O-CG 3.45Å; K685-E689 PolarHBondContact O-N 2.83Å; E686-E689 PolarHBondContact O-N 2.88Å; E689-Q691 VanDerWaalsContact C-N 3.25Å; E689-Q691 PolarHBondContact O-N 2.82Å; E689-T692 PolarHBondContact O-N 3.46Å; E689-T692 PolarHBondContact O-OG1 3.26Å; E689-E693 PolarHBondContact O-N 2.96Å
690	V	86.4	Confident	87.2	Confident	85 Å²	85	100.5 Å²	100.5	52%	0.515	49%	0.494	S	S	.	.	H	α-helix	trans	-57.9	-37	174.4	171.7	0	0	0	0	111.9	E686 E693 L694	E686-V690 WeakPolarHBondContact O-CG2 3.49Å; E686-V690 PolarHBondContact O-N 3.47Å; V690-E693 PolarHBondContact O-N 3.14Å; V690-L694 VanDerWaalsContact O-CB 3.24Å; V690-L694 WeakPolarHBondContact O-CB 3.47Å; V690-L694 PolarHBondContact O-N 3.42Å
691	Q	84.9	Confident	87	Confident	134 Å²	134	101.1 Å²	101.1	63%	0.626	50%	0.498	S	S	*	.	H	α-helix	trans	-68.4	-34.6	177.8	-165.2	169.7	14.4	0	0	112.2	M687 S688 E689 F695	M687-Q691 WeakPolarHBondContact O-CB 3.3Å; M687-Q691 PolarHBondContact O-N 2.97Å; S688-Q691 PolarHBondContact O-N 3.42Å; E689-Q691 VanDerWaalsContact C-N 3.25Å; E689-Q691 PolarHBondContact O-N 2.82Å; Q691-F695 PolarHBondContact O-N 3.33Å; Q691-F695 VanDerWaalsContact O-N 3.16Å
692	T	87.8	Confident	86.9	Confident	95 Å²	95	98.7 Å²	98.7	58%	0.583	50%	0.495	S	S	*	.	H	α-helix	trans	-71.3	-39.4	171.5	53.9	0	0	0	0	113.3	S688 E689 F695 S696	S688-T692 PolarHBondContact O-N 3.16Å; S688-T692 PolarHBondContact O-OG1 2.93Å; E689-T692 PolarHBondContact O-N 3.46Å; E689-T692 PolarHBondContact O-OG1 3.26Å; T692-F695 PolarHBondContact O-N 3.4Å; T692-S696 PolarHBondContact O-N 2.88Å; T692-S696 VanDerWaalsContact O-N 3.1Å
693	E	87.3	Confident	86.9	Confident	112 Å²	112	101.5 Å²	101.5	52%	0.523	50%	0.5	S	S	.	.	H	α-helix	trans	-62.3	-48.1	174.2	-71.3	-174.4	169.9	0	0	110.9	E689 V690 F695 S696 Y697	E689-E693 PolarHBondContact O-N 2.96Å; V690-E693 PolarHBondContact O-N 3.14Å; E693-F695 VanDerWaalsContact C-N 3.28Å; E693-F695 PolarHBondContact O-N 2.91Å; E693-S696 WeakPolarHBondContact O-CA 3.36Å; E693-S696 WeakPolarHBondContact O-CB 3.48Å; E693-S696 PolarHBondContact O-N 3.18Å; E693-S696 PolarHBondContact O-OG 3.4Å; E693-Y697 HydrophobicContact CB-CE2 4.46Å; E693-Y697 VanDerWaalsContact O-CD2 3.23Å; E693-Y697 WeakPolarHBondContact O-CD2 3.43Å; E693-Y697 PolarHBondContact O-N 3.44Å
694	L	85	Confident	86.8	Confident	91 Å²	91	102.8 Å²	102.8	48%	0.476	51%	0.507	S	S	.	.	H	α-helix	trans	-59.2	-37.3	178.3	-169.8	146	0	0	0	112.3	V690 Y697 Q698	V690-L694 VanDerWaalsContact O-CB 3.24Å; V690-L694 WeakPolarHBondContact O-CB 3.47Å; V690-L694 PolarHBondContact O-N 3.42Å; L694-Y697 PolarHBondContact O-N 2.86Å; L694-Q698 HydrophobicContact CD2-CG 4.34Å; L694-Q698 VanDerWaalsContact O-CG 3.32Å; L694-Q698 WeakPolarHBondContact O-CG 3.48Å; L694-Q698 PolarHBondContact O-N 2.89Å
695	F	89.4	Confident	86.4	Confident	120 Å²	120	104.3 Å²	104.3	53%	0.526	52%	0.516	S	S	.	.	H	α-helix	trans	-65.3	-40.6	172.7	-175.3	-100.1	0	0	0	112.5	Q691 T692 E693 Q698 Q699	Q691-F695 PolarHBondContact O-N 3.33Å; Q691-F695 VanDerWaalsContact O-N 3.16Å; T692-F695 PolarHBondContact O-N 3.4Å; E693-F695 VanDerWaalsContact C-N 3.28Å; E693-F695 PolarHBondContact O-N 2.91Å; F695-Q698 PolarHBondContact O-N 3.39Å; F695-Q699 HydrophobicContact CE1-CG 4.19Å; F695-Q699 HydrophobicContact CZ-CG 4.44Å; F695-Q699 PolarHBondContact O-N 3.12Å
696	S	86.3	Confident	86.3	Confident	52 Å²	52	105.4 Å²	105.4	36%	0.364	52%	0.522	S	S	.	.	H	α-helix	trans	-67	-38	176.2	76.5	0	0	0	0	112.7	T692 E693 Q699 N700	T692-S696 PolarHBondContact O-N 2.88Å; T692-S696 VanDerWaalsContact O-N 3.1Å; E693-S696 WeakPolarHBondContact O-CA 3.36Å; E693-S696 WeakPolarHBondContact O-CB 3.48Å; E693-S696 PolarHBondContact O-N 3.18Å; E693-S696 PolarHBondContact O-OG 3.4Å; S696-Q699 PolarHBondContact O-N 3.41Å; S696-N700 PolarHBondContact O-N 2.89Å
697	Y	83.8	Confident	86	Confident	164 Å²	164	106.2 Å²	106.2	64%	0.643	53%	0.526	S	S	*	.	H	α-helix	trans	-64	-41	172.1	-78.9	-65.1	0	0	0	111.6	E693 L694 Q699 N700 Q701	E693-Y697 HydrophobicContact CB-CE2 4.46Å; E693-Y697 VanDerWaalsContact O-CD2 3.23Å; E693-Y697 WeakPolarHBondContact O-CD2 3.43Å; E693-Y697 PolarHBondContact O-N 3.44Å; L694-Y697 PolarHBondContact O-N 2.86Å; Y697-Q699 PolarHBondContact O-N 3.07Å; Y697-N700 PolarHBondContact O-N 3.25Å; Y697-Q701 WeakPolarHBondContact O-CB 3.35Å; Y697-Q701 PolarHBondContact O-N 3.46Å
698	Q	85.5	Confident	86	Confident	101 Å²	101	107.4 Å²	107.4	47%	0.472	52%	0.524	S	S	.	.	H	α-helix	trans	-61.9	-41.1	174.7	-77.5	175.6	-15.9	0	0	112.5	L694 F695 Q701 L702	L694-Q698 HydrophobicContact CD2-CG 4.34Å; L694-Q698 VanDerWaalsContact O-CG 3.32Å; L694-Q698 WeakPolarHBondContact O-CG 3.48Å; L694-Q698 PolarHBondContact O-N 2.89Å; F695-Q698 PolarHBondContact O-N 3.39Å; Q698-Q701 PolarHBondContact O-N 3.25Å; Q698-L702 PolarHBondContact O-N 2.81Å
699	Q	85.2	Confident	85.9	Confident	97 Å²	97	110.4 Å²	110.4	45%	0.453	53%	0.529	S	S	.	.	H	α-helix	trans	-64.7	-40.4	174.6	-74.4	-164.7	-15.9	0	0	112.8	F695 S696 Y697 L702 K703	F695-Q699 HydrophobicContact CE1-CG 4.19Å; F695-Q699 HydrophobicContact CZ-CG 4.44Å; F695-Q699 PolarHBondContact O-N 3.12Å; S696-Q699 PolarHBondContact O-N 3.41Å; Y697-Q699 PolarHBondContact O-N 3.07Å; Q699-L702 PolarHBondContact O-N 3.08Å; Q699-K703 PolarHBondContact O-N 3.28Å; Q699-K703 VanDerWaalsContact O-N 3.13Å
700	N	86.3	Confident	85.8	Confident	81 Å²	81	108 Å²	108	43%	0.433	53%	0.526	S	S	.	.	H	α-helix	trans	-68.7	-36.8	176.4	-72.9	-21.5	0	0	0	112	S696 Y697 L702 K703 L704	S696-N700 PolarHBondContact O-N 2.89Å; Y697-N700 PolarHBondContact O-N 3.25Å; N700-L702 VanDerWaalsContact C-N 3.32Å; N700-L702 PolarHBondContact O-N 3.44Å; N700-K703 PolarHBondContact O-N 2.87Å; N700-L704 WeakPolarHBondContact O-CG 3.44Å; N700-L704 PolarHBondContact O-N 3.3Å
701	Q	84.4	Confident	85.7	Confident	115 Å²	115	109.2 Å²	109.2	54%	0.537	53%	0.53	S	S	.	.	H	α-helix	trans	-62.7	-39	173.8	-167.6	-179	17.7	0	0	111.8	Y697 Q698 M705	Y697-Q701 WeakPolarHBondContact O-CB 3.35Å; Y697-Q701 PolarHBondContact O-N 3.46Å; Q698-Q701 PolarHBondContact O-N 3.25Å; Q701-M705 WeakPolarHBondContact O-CB 3.31Å; Q701-M705 WeakPolarHBondContact O-CG 3.27Å; Q701-M705 PolarHBondContact O-N 3.01Å
702	L	88.4	Confident	85.6	Confident	106 Å²	106	107 Å²	107	56%	0.555	52%	0.519	S	S	*	.	H	α-helix	trans	-61.5	-48.6	173.7	-99.9	156.2	0	0	0	112.3	Q698 Q699 N700 L704 M705 E706	Q698-L702 PolarHBondContact O-N 2.81Å; Q699-L702 PolarHBondContact O-N 3.08Å; N700-L702 VanDerWaalsContact C-N 3.32Å; N700-L702 PolarHBondContact O-N 3.44Å; L702-L704 PolarHBondContact O-N 3.28Å; L702-M705 WeakPolarHBondContact O-CB 3.32Å; L702-M705 PolarHBondContact O-N 3.22Å; L702-M705 VanDerWaalsContact O-N 3.15Å; L702-E706 PolarHBondContact O-N 2.74Å
703	K	86.8	Confident	85.5	Confident	116 Å²	116	105.7 Å²	105.7	50%	0.504	51%	0.509	S	S	.	.	H	α-helix	trans	-58.8	-46.7	176.5	-70.3	175.6	-178.8	173.7	0	112.3	Q699 N700 M705 E706 E707	Q699-K703 PolarHBondContact O-N 3.28Å; Q699-K703 VanDerWaalsContact O-N 3.13Å; N700-K703 PolarHBondContact O-N 2.87Å; K703-M705 VanDerWaalsContact C-N 3.27Å; K703-M705 PolarHBondContact O-N 3.42Å; K703-E706 PolarHBondContact O-N 2.72Å; K703-E706 VanDerWaalsContact O-N 3.13Å; K703-E707 WeakPolarHBondContact O-CG 3.5Å; K703-E707 PolarHBondContact O-N 2.74Å
704	L	84.3	Confident	85.3	Confident	111 Å²	111	105.9 Å²	105.9	58%	0.581	51%	0.51	S	S	*	.	H	α-helix	trans	-63.8	-31.8	177.4	-70.7	169.5	0	0	0	112.4	N700 L702 R708	N700-L704 WeakPolarHBondContact O-CG 3.44Å; N700-L704 PolarHBondContact O-N 3.3Å; L702-L704 PolarHBondContact O-N 3.28Å; L704-R708 WeakPolarHBondContact O-CB 3.33Å; L704-R708 PolarHBondContact O-N 2.95Å
705	M	81.8	Confident	85	Confident	117 Å²	117	105.6 Å²	105.6	58%	0.576	51%	0.508	S	S	*	.	H	α-helix	trans	-69.4	-38.5	172.2	-79.3	-173.6	169.4	0	0	112.6	Q701 L702 K703 K709	Q701-M705 WeakPolarHBondContact O-CB 3.31Å; Q701-M705 WeakPolarHBondContact O-CG 3.27Å; Q701-M705 PolarHBondContact O-N 3.01Å; L702-M705 WeakPolarHBondContact O-CB 3.32Å; L702-M705 PolarHBondContact O-N 3.22Å; L702-M705 VanDerWaalsContact O-N 3.15Å; K703-M705 VanDerWaalsContact C-N 3.27Å; K703-M705 PolarHBondContact O-N 3.42Å; M705-K709 WeakPolarHBondContact O-CB 3.31Å; M705-K709 PolarHBondContact O-N 2.96Å
706	E	87	Confident	84.8	Confident	135 Å²	135	103 Å²	103	63%	0.631	50%	0.502	S	S	*	.	H	α-helix	trans	-67.4	-44.7	175.9	-70.4	177.5	161.1	0	0	111.7	L702 K703 K709 G710	L702-E706 PolarHBondContact O-N 2.74Å; K703-E706 PolarHBondContact O-N 2.72Å; K703-E706 VanDerWaalsContact O-N 3.13Å; E706-K709 PolarHBondContact O-N 3.09Å; E706-G710 PolarHBondContact O-N 3.49Å
707	E	84.6	Confident	84.6	Confident	122 Å²	122	108 Å²	108	57%	0.57	51%	0.513	S	S	*	.	H	α-helix	trans	-61.4	-46.4	174.1	-72.1	173.8	179.4	0	0	111.7	K703 K709 G710 L711	K703-E707 WeakPolarHBondContact O-CG 3.5Å; K703-E707 PolarHBondContact O-N 2.74Å; E707-K709 VanDerWaalsContact C-N 3.29Å; E707-K709 PolarHBondContact O-N 3.45Å; E707-G710 PolarHBondContact O-N 2.87Å; E707-L711 PolarHBondContact O-N 3.07Å
708	R	84	Confident	84.3	Confident	147 Å²	147	104.3 Å²	104.3	56%	0.555	51%	0.508	S	S	*	.	H	α-helix	trans	-58.7	-40.5	175.8	-177	179.6	176.7	-69.9	-11.4	111.8	L704 L711 E712	L704-R708 WeakPolarHBondContact O-CB 3.33Å; L704-R708 PolarHBondContact O-N 2.95Å; R708-L711 PolarHBondContact O-N 2.8Å; R708-E712 IonicContact CZ-OE1 2.71Å; R708-E712 IonicContact CZ-OE2 3.6Å; R708-E712 IonicContact NH1-OE1 2.71Å; R708-E712 PolarHBondContact NH1-OE1 3.28Å; R708-E712 IonicContact NH1-OE2 2.72Å; R708-E712 PolarHBondContact NH1-OE2 3.49Å; R708-E712 IonicContact NH2-OE1 3.64Å; R708-E712 PolarHBondContact NH2-OE1 3.02Å; R708-E712 WeakPolarHBondContact O-CG 3.2Å; R708-E712 PolarHBondContact O-N 3.4Å
709	K	87.5	Confident	84.2	Confident	131 Å²	131	107.7 Å²	107.7	57%	0.57	52%	0.516	S	S	*	.	H	α-helix	trans	-66.4	-42	176.4	-173.9	-176.4	174.6	-171.2	0	111.8	M705 E706 E707 L711 E712 D713	M705-K709 WeakPolarHBondContact O-CB 3.31Å; M705-K709 PolarHBondContact O-N 2.96Å; E706-K709 PolarHBondContact O-N 3.09Å; E707-K709 VanDerWaalsContact C-N 3.29Å; E707-K709 PolarHBondContact O-N 3.45Å; K709-L711 VanDerWaalsContact C-N 3.31Å; K709-L711 PolarHBondContact O-N 3.39Å; K709-E712 PolarHBondContact O-N 2.63Å; K709-D713 PolarHBondContact O-N 3.07Å
710	G	85.4	Confident	84	Confident	35 Å²	35	108.4 Å²	108.4	36%	0.361	52%	0.52	S	S	.	.	H	α-helix	trans	-57.6	-43.7	174.4	0	0	0	0	0	112.5	E706 E707 D713 E714	E706-G710 PolarHBondContact O-N 3.49Å; E707-G710 PolarHBondContact O-N 2.87Å; G710-D713 PolarHBondContact O-N 2.92Å; G710-E714 PolarHBondContact O-N 2.89Å
711	L	83.6	Confident	83.6	Confident	112 Å²	112	107.1 Å²	107.1	59%	0.586	52%	0.517	S	S	*	.	H	α-helix	trans	-66.9	-36.8	175.1	-67.8	170.9	0	0	0	112.8	E707 R708 K709 E714 L715	E707-L711 PolarHBondContact O-N 3.07Å; R708-L711 PolarHBondContact O-N 2.8Å; K709-L711 VanDerWaalsContact C-N 3.31Å; K709-L711 PolarHBondContact O-N 3.39Å; L711-E714 PolarHBondContact O-N 2.93Å; L711-L715 VanDerWaalsContact O-CB 3.23Å; L711-L715 WeakPolarHBondContact O-CB 3.36Å; L711-L715 PolarHBondContact O-N 3.49Å
712	E	83.4	Confident	83.3	Confident	86 Å²	86	103.8 Å²	103.8	40%	0.402	51%	0.509	S	S	.	.	H	α-helix	trans	-65.6	-36.7	173.1	-74.9	178.7	148.5	0	0	112.4	R708 K709 L715 T716	R708-E712 IonicContact CZ-OE1 2.71Å; R708-E712 IonicContact CZ-OE2 3.6Å; R708-E712 IonicContact NH1-OE1 2.71Å; R708-E712 PolarHBondContact NH1-OE1 3.28Å; R708-E712 IonicContact NH1-OE2 2.72Å; R708-E712 PolarHBondContact NH1-OE2 3.49Å; R708-E712 IonicContact NH2-OE1 3.64Å; R708-E712 PolarHBondContact NH2-OE1 3.02Å; R708-E712 WeakPolarHBondContact O-CG 3.2Å; R708-E712 PolarHBondContact O-N 3.4Å; K709-E712 PolarHBondContact O-N 2.63Å; E712-L715 PolarHBondContact O-N 3.48Å; E712-T716 WeakPolarHBondContact O-CG2 3.46Å; E712-T716 PolarHBondContact O-N 2.93Å; E712-T716 PolarHBondContact O-OG1 3.46Å
713	D	85.8	Confident	82.8	Confident	69 Å²	69	100.4 Å²	100.4	37%	0.369	50%	0.5	S	S	.	.	H	α-helix	trans	-69.6	-33.5	174.3	-73.5	-16	0	0	0	112.2	K709 G710 T716 R717	K709-D713 PolarHBondContact O-N 3.07Å; G710-D713 PolarHBondContact O-N 2.92Å; D713-T716 WeakPolarHBondContact CA-OG1 3.37Å; D713-T716 PolarHBondContact O-OG1 3.33Å; D713-R717 VanDerWaalsContact O-CG 3.26Å; D713-R717 WeakPolarHBondContact O-CG 3.19Å; D713-R717 PolarHBondContact O-N 2.97Å; D713-R717 PolarHBondContact O-NE 3.11Å
714	E	82.9	Confident	82.5	Confident	115 Å²	115	100.9 Å²	100.9	54%	0.537	50%	0.499	S	S	.	.	H	α-helix	trans	-73.4	-37.8	172	-72.8	-176.1	173.2	0	0	112.4	G710 L711 T716 R717 T718	G710-E714 PolarHBondContact O-N 2.89Å; L711-E714 PolarHBondContact O-N 2.93Å; E714-T716 VanDerWaalsContact C-N 3.32Å; E714-T716 PolarHBondContact O-N 3.31Å; E714-R717 PolarHBondContact O-N 2.86Å; E714-T718 WeakPolarHBondContact O-CG2 3.4Å; E714-T718 PolarHBondContact O-N 2.77Å; E714-T718 PolarHBondContact O-OG1 3.37Å
715	L	79.5	Confident	82	Confident	86 Å²	86	101.1 Å²	101.1	45%	0.45	50%	0.5	S	S	.	.	H	α-helix	trans	-70.1	-29.8	178.8	-158.9	150.5	0	0	0	111.7	L711 E712 T718 R719	L711-L715 VanDerWaalsContact O-CB 3.23Å; L711-L715 WeakPolarHBondContact O-CB 3.36Å; L711-L715 PolarHBondContact O-N 3.49Å; E712-L715 PolarHBondContact O-N 3.48Å; L715-T718 VanDerWaalsContact CA-OG1 3.32Å; L715-T718 WeakPolarHBondContact CA-OG1 3.23Å; L715-T718 PolarHBondContact O-OG1 2.82Å; L715-T718 VanDerWaalsContact O-OG1 3.06Å; L715-R719 HydrophobicContact CD2-CG 4.45Å; L715-R719 WeakPolarHBondContact O-CB 3.47Å; L715-R719 VanDerWaalsContact O-CG 3.28Å; L715-R719 WeakPolarHBondContact O-CG 3.43Å; L715-R719 PolarHBondContact O-N 2.85Å; L715-R719 VanDerWaalsContact O-N 3.15Å
716	T	84.8	Confident	81.8	Confident	65 Å²	65	102.3 Å²	102.3	40%	0.399	50%	0.504	S	S	.	.	H	α-helix	trans	-72.4	-46.2	169.9	44.6	0	0	0	0	112.3	E712 D713 E714 T718 R719 E720	E712-T716 WeakPolarHBondContact O-CG2 3.46Å; E712-T716 PolarHBondContact O-N 2.93Å; E712-T716 PolarHBondContact O-OG1 3.46Å; D713-T716 WeakPolarHBondContact CA-OG1 3.37Å; D713-T716 PolarHBondContact O-OG1 3.33Å; E714-T716 VanDerWaalsContact C-N 3.32Å; E714-T716 PolarHBondContact O-N 3.31Å; T716-T718 VanDerWaalsContact C-N 3.3Å; T716-T718 PolarHBondContact O-N 3.39Å; T716-R719 WeakPolarHBondContact O-CB 3.42Å; T716-R719 PolarHBondContact O-N 3.05Å; T716-E720 PolarHBondContact O-N 3.06Å
717	R	81.3	Confident	81.7	Confident	156 Å²	156	103.6 Å²	103.6	59%	0.589	50%	0.503	S	S	*	.	H	α-helix	trans	-58	-39.3	174.8	-70.4	172.3	-150.9	174.5	8.8	113.1	D713 E714 E720 S721	D713-R717 VanDerWaalsContact O-CG 3.26Å; D713-R717 WeakPolarHBondContact O-CG 3.19Å; D713-R717 PolarHBondContact O-N 2.97Å; D713-R717 PolarHBondContact O-NE 3.11Å; E714-R717 PolarHBondContact O-N 2.86Å; R717-E720 PolarHBondContact O-N 2.68Å; R717-S721 PolarHBondContact O-N 2.88Å
718	T	77.8	Confident	81.3	Confident	88 Å²	88	103.4 Å²	103.4	54%	0.54	50%	0.501	S	S	.	.	H	α-helix	trans	-70.3	-39	177	47.8	0	0	0	0	112	E714 L715 T716 S721 A722	E714-T718 WeakPolarHBondContact O-CG2 3.4Å; E714-T718 PolarHBondContact O-N 2.77Å; E714-T718 PolarHBondContact O-OG1 3.37Å; L715-T718 VanDerWaalsContact CA-OG1 3.32Å; L715-T718 WeakPolarHBondContact CA-OG1 3.23Å; L715-T718 PolarHBondContact O-OG1 2.82Å; L715-T718 VanDerWaalsContact O-OG1 3.06Å; T716-T718 VanDerWaalsContact C-N 3.3Å; T716-T718 PolarHBondContact O-N 3.39Å; T718-S721 WeakPolarHBondContact O-CB 3.47Å; T718-S721 PolarHBondContact O-N 2.87Å; T718-A722 PolarHBondContact O-N 2.65Å
719	R	83.3	Confident	80.8	Confident	171 Å²	171	101.3 Å²	101.3	65%	0.645	50%	0.5	S	S	*	.	H	α-helix	trans	-60.3	-43.3	170.3	-79.3	173.5	174.1	158.8	0.6	112.8	L715 T716 S721 A722 G723	L715-R719 HydrophobicContact CD2-CG 4.45Å; L715-R719 WeakPolarHBondContact O-CB 3.47Å; L715-R719 VanDerWaalsContact O-CG 3.28Å; L715-R719 WeakPolarHBondContact O-CG 3.43Å; L715-R719 PolarHBondContact O-N 2.85Å; L715-R719 VanDerWaalsContact O-N 3.15Å; T716-R719 WeakPolarHBondContact O-CB 3.42Å; T716-R719 PolarHBondContact O-N 3.05Å; R719-S721 VanDerWaalsContact C-N 3.3Å; R719-S721 PolarHBondContact O-N 3.29Å; R719-A722 PolarHBondContact O-N 3.28Å; R719-G723 PolarHBondContact O-N 3.28Å
720	E	81.6	Confident	80.5	Confident	113 Å²	113	97 Å²	97	53%	0.528	49%	0.493	S	S	.	.	H	α-helix	trans	-62.8	-38.2	174.1	-70.4	-179.8	-174.7	0	0	112.3	T716 R717 G723 R724	T716-E720 PolarHBondContact O-N 3.06Å; R717-E720 PolarHBondContact O-N 2.68Å; E720-G723 PolarHBondContact O-N 3.1Å; E720-R724 WeakPolarHBondContact O-CG 3.27Å; E720-R724 PolarHBondContact O-N 3.22Å; E720-R724 IonicContact OE2-NH1 2.65Å
721	S	77.6	Confident	80.2	Confident	54 Å²	54	99.2 Å²	99.2	38%	0.378	49%	0.494	S	S	.	.	H	α-helix	trans	-66.6	-40.6	176	-152.7	0	0	0	0	111.8	R717 T718 R719 R724 L725	R717-S721 PolarHBondContact O-N 2.88Å; T718-S721 WeakPolarHBondContact O-CB 3.47Å; T718-S721 PolarHBondContact O-N 2.87Å; R719-S721 VanDerWaalsContact C-N 3.3Å; R719-S721 PolarHBondContact O-N 3.29Å; S721-R724 PolarHBondContact O-N 2.77Å; S721-L725 WeakPolarHBondContact O-CG 3.28Å; S721-L725 PolarHBondContact O-N 3.29Å
722	A	77.3	Confident	79.8	Confident	45 Å²	45	98.9 Å²	98.9	37%	0.372	49%	0.493	S	S	.	.	H	α-helix	trans	-61	-47.5	172.8	0	0	0	0	0	111.3	T718 R719 R724 L725 E726	T718-A722 PolarHBondContact O-N 2.65Å; R719-A722 PolarHBondContact O-N 3.28Å; A722-R724 VanDerWaalsContact C-N 3.31Å; A722-R724 PolarHBondContact O-N 2.99Å; A722-L725 WeakPolarHBondContact O-CB 3.28Å; A722-L725 PolarHBondContact O-N 3.1Å; A722-E726 WeakPolarHBondContact O-CG 3.42Å; A722-E726 PolarHBondContact O-N 2.88Å
723	G	79.5	Confident	79.5	Confident	35 Å²	35	97.7 Å²	97.7	36%	0.361	49%	0.487	S	S	.	.	H	α-helix	trans	-61.3	-35.1	176.1	0	0	0	0	0	113.7	R719 E720 W727	R719-G723 PolarHBondContact O-N 3.28Å; E720-G723 PolarHBondContact O-N 3.1Å; G723-W727 WeakPolarHBondContact O-CB 3.49Å; G723-W727 PolarHBondContact O-N 3.46Å
724	R	80.2	Confident	79.2	Confident	125 Å²	125	96.6 Å²	96.6	47%	0.472	49%	0.487	S	S	.	.	H	α-helix	trans	-65.5	-41.4	171.2	-75.4	-175	-67.3	-94.6	0.3	112.1	E720 S721 A722 W727 F728	E720-R724 WeakPolarHBondContact O-CG 3.27Å; E720-R724 PolarHBondContact O-N 3.22Å; E720-R724 IonicContact OE2-NH1 2.65Å; S721-R724 PolarHBondContact O-N 2.77Å; A722-R724 VanDerWaalsContact C-N 3.31Å; A722-R724 PolarHBondContact O-N 2.99Å; R724-W727 PolarHBondContact O-N 3.41Å; R724-F728 WeakPolarHBondContact O-CD2 3.42Å; R724-F728 PolarHBondContact O-N 2.84Å
725	L	73.6	Confident	79.1	Confident	116 Å²	116	95.6 Å²	95.6	61%	0.607	48%	0.483	S	S	*	.	H	α-helix	trans	-67.3	-39.9	176.3	-70.6	170.8	0	0	0	112.2	S721 A722 W727 F728 N729	S721-L725 WeakPolarHBondContact O-CG 3.28Å; S721-L725 PolarHBondContact O-N 3.29Å; A722-L725 WeakPolarHBondContact O-CB 3.28Å; A722-L725 PolarHBondContact O-N 3.1Å; L725-W727 VanDerWaalsContact C-N 3.33Å; L725-F728 PolarHBondContact O-N 3.05Å; L725-N729 VanDerWaalsContact O-CB 3.29Å; L725-N729 WeakPolarHBondContact O-CB 3.47Å; L725-N729 PolarHBondContact O-N 2.65Å
726	E	77	Confident	79.2	Confident	143 Å²	143	95.8 Å²	95.8	67%	0.668	48%	0.48	S	S	*	.	H	α-helix	trans	-61	-41.7	172.8	-73.2	174.4	177.6	0	0	111.6	A722 N729 G730	A722-E726 WeakPolarHBondContact O-CG 3.42Å; A722-E726 PolarHBondContact O-N 2.88Å; E726-N729 PolarHBondContact O-N 2.7Å; E726-G730 PolarHBondContact O-N 2.92Å
727	W	84.1	Confident	79	Confident	162 Å²	162	99.9 Å²	99.9	61%	0.614	49%	0.488	S	S	*	.	H	α-helix	trans	-63.5	-48.4	174.8	-176.8	83.4	0	0	0	112.4	G723 R724 L725 N729 G730 E731	G723-W727 WeakPolarHBondContact O-CB 3.49Å; G723-W727 PolarHBondContact O-N 3.46Å; R724-W727 PolarHBondContact O-N 3.41Å; L725-W727 VanDerWaalsContact C-N 3.33Å; W727-N729 VanDerWaalsContact C-N 3.3Å; W727-N729 PolarHBondContact O-N 3.16Å; W727-G730 PolarHBondContact O-N 2.91Å; W727-G730 VanDerWaalsContact O-N 3.15Å; W727-E731 PolarHBondContact O-N 3.14Å
728	F	76.2	Confident	79.2	Confident	118 Å²	118	95.4 Å²	95.4	52%	0.518	48%	0.48	S	S	.	.	H	α-helix	trans	-60.7	-38.1	175.3	-81.5	-62.2	0	0	0	112.4	R724 L725 E731 L732	R724-F728 WeakPolarHBondContact O-CD2 3.42Å; R724-F728 PolarHBondContact O-N 2.84Å; L725-F728 PolarHBondContact O-N 3.05Å; F728-E731 PolarHBondContact O-N 3.15Å; F728-L732 WeakPolarHBondContact O-CB 3.42Å; F728-L732 WeakPolarHBondContact O-CG 3.46Å; F728-L732 PolarHBondContact O-N 3.41Å
729	N	74.8	Confident	79.3	Confident	102 Å²	102	96.1 Å²	96.1	55%	0.545	48%	0.481	S	S	.	.	H	α-helix	trans	-68.3	-36	176.2	-167.4	65.2	0	0	0	111.8	L725 E726 W727 L732 E733	L725-N729 VanDerWaalsContact O-CB 3.29Å; L725-N729 WeakPolarHBondContact O-CB 3.47Å; L725-N729 PolarHBondContact O-N 2.65Å; E726-N729 PolarHBondContact O-N 2.7Å; W727-N729 VanDerWaalsContact C-N 3.3Å; W727-N729 PolarHBondContact O-N 3.16Å; N729-L732 PolarHBondContact O-N 2.96Å; N729-E733 WeakPolarHBondContact O-CB 3.43Å; N729-E733 PolarHBondContact O-N 2.95Å
730	G	81.5	Confident	79.3	Confident	40 Å²	40	92.7 Å²	92.7	41%	0.412	47%	0.472	S	S	.	.	H	α-helix	trans	-64	-41.6	172	0	0	0	0	0	113.1	E726 W727 E733 A734	E726-G730 PolarHBondContact O-N 2.92Å; W727-G730 PolarHBondContact O-N 2.91Å; W727-G730 VanDerWaalsContact O-N 3.15Å; G730-E733 PolarHBondContact O-N 3.12Å; G730-A734 WeakPolarHBondContact O-CB 3.39Å; G730-A734 PolarHBondContact O-N 2.68Å
731	E	78.7	Confident	79.3	Confident	82 Å²	82	92.5 Å²	92.5	38%	0.383	47%	0.471	S	S	.	.	H	α-helix	trans	-66	-43	175	-178.3	58.3	-149.6	0	0	111.5	W727 F728 A734 Q735	W727-E731 PolarHBondContact O-N 3.14Å; F728-E731 PolarHBondContact O-N 3.15Å; E731-A734 WeakPolarHBondContact O-CB 3.45Å; E731-A734 PolarHBondContact O-N 3.36Å; E731-A734 VanDerWaalsContact O-N 3.16Å; E731-Q735 WeakPolarHBondContact O-CG 3.48Å; E731-Q735 PolarHBondContact O-N 3.13Å; E731-Q735 PolarHBondContact OE1-NE2 2.9Å
732	L	74	Confident	79.4	Confident	106 Å²	106	95 Å²	95	56%	0.555	48%	0.477	S	S	*	.	H	α-helix	trans	-62.9	-41.7	174.4	-74.6	169.9	0	0	0	112.5	F728 N729 A734 Q735 K736	F728-L732 WeakPolarHBondContact O-CB 3.42Å; F728-L732 WeakPolarHBondContact O-CG 3.46Å; F728-L732 PolarHBondContact O-N 3.41Å; N729-L732 PolarHBondContact O-N 2.96Å; L732-A734 VanDerWaalsContact C-N 3.32Å; L732-Q735 PolarHBondContact O-N 2.69Å; L732-K736 VanDerWaalsContact O-CB 3.28Å; L732-K736 WeakPolarHBondContact O-CB 3.33Å; L732-K736 PolarHBondContact O-N 3.37Å
733	E	78.9	Confident	79.3	Confident	61 Å²	61	96.6 Å²	96.6	29%	0.285	48%	0.479	S	S	.	.	H	α-helix	trans	-67.9	-29.9	173.2	-79.3	-70	155.1	0	0	112.4	N729 G730 K736 R737	N729-E733 WeakPolarHBondContact O-CB 3.43Å; N729-E733 PolarHBondContact O-N 2.95Å; G730-E733 PolarHBondContact O-N 3.12Å; E733-K736 VanDerWaalsContact CD-NZ 3.29Å; E733-K736 IonicContact OE1-NZ 3.3Å; E733-K736 PolarHBondContact OE1-NZ 3.38Å; E733-K736 IonicContact OE2-NZ 2.77Å; E733-K736 PolarHBondContact OE2-NZ 3.27Å; E733-R737 VanDerWaalsContact O-CG 3.31Å; E733-R737 WeakPolarHBondContact O-CG 3.49Å; E733-R737 PolarHBondContact O-N 2.92Å
734	A	79.7	Confident	79.4	Confident	45 Å²	45	96.9 Å²	96.9	37%	0.372	48%	0.477	S	S	.	.	H	α-helix	trans	-69.1	-43.7	172.2	0	0	0	0	0	111.9	G730 E731 L732 R737 S738	G730-A734 WeakPolarHBondContact O-CB 3.39Å; G730-A734 PolarHBondContact O-N 2.68Å; E731-A734 WeakPolarHBondContact O-CB 3.45Å; E731-A734 PolarHBondContact O-N 3.36Å; E731-A734 VanDerWaalsContact O-N 3.16Å; L732-A734 VanDerWaalsContact C-N 3.32Å; A734-R737 PolarHBondContact O-N 3.14Å; A734-S738 PolarHBondContact O-N 3.03Å
735	Q	80.7	Confident	79.5	Confident	95 Å²	95	94.9 Å²	94.9	44%	0.444	48%	0.476	S	S	.	.	H	α-helix	trans	-63.5	-43.1	174.7	-70.4	175.8	15.7	0	0	111.6	E731 L732 S738 L739	E731-Q735 WeakPolarHBondContact O-CG 3.48Å; E731-Q735 PolarHBondContact O-N 3.13Å; E731-Q735 PolarHBondContact OE1-NE2 2.9Å; L732-Q735 PolarHBondContact O-N 2.69Å; Q735-S738 WeakPolarHBondContact O-CB 3.13Å; Q735-S738 PolarHBondContact O-N 3.16Å; Q735-S738 VanDerWaalsContact O-N 3.15Å; Q735-L739 WeakPolarHBondContact O-CG 3.41Å; Q735-L739 PolarHBondContact O-N 3.04Å
736	K	80.4	Confident	79.8	Confident	90 Å²	90	94.7 Å²	94.7	39%	0.391	47%	0.47	S	S	.	.	H	α-helix	trans	-57.4	-49.2	173.2	176.3	-178.9	155	-143.4	0	111.9	L732 E733 S738 L739 E740	L732-K736 VanDerWaalsContact O-CB 3.28Å; L732-K736 WeakPolarHBondContact O-CB 3.33Å; L732-K736 PolarHBondContact O-N 3.37Å; E733-K736 VanDerWaalsContact CD-NZ 3.29Å; E733-K736 IonicContact OE1-NZ 3.3Å; E733-K736 PolarHBondContact OE1-NZ 3.38Å; E733-K736 IonicContact OE2-NZ 2.77Å; E733-K736 PolarHBondContact OE2-NZ 3.27Å; K736-S738 VanDerWaalsContact C-N 3.28Å; K736-S738 PolarHBondContact O-N 2.99Å; K736-L739 PolarHBondContact O-N 3.44Å; K736-L739 VanDerWaalsContact O-N 3.15Å; K736-E740 WeakPolarHBondContact CE-OE1 3.39Å; K736-E740 HydrophobicContact CG-CG 4.48Å; K736-E740 WeakPolarHBondContact O-CB 3.44Å; K736-E740 WeakPolarHBondContact O-CG 2.8Å; K736-E740 PolarHBondContact O-N 2.89Å
737	R	81.8	Confident	79.9	Confident	150 Å²	150	92.4 Å²	92.4	57%	0.566	46%	0.462	S	S	*	.	H	α-helix	trans	-60.9	-35.5	174.7	-72.7	178.1	-160.5	119.4	8	112.9	E733 A734 E740 Q741	E733-R737 VanDerWaalsContact O-CG 3.31Å; E733-R737 WeakPolarHBondContact O-CG 3.49Å; E733-R737 PolarHBondContact O-N 2.92Å; A734-R737 PolarHBondContact O-N 3.14Å; R737-E740 PolarHBondContact O-N 2.61Å; R737-Q741 WeakPolarHBondContact O-CB 3.29Å; R737-Q741 PolarHBondContact O-N 2.83Å
738	S	84.1	Confident	79.8	Confident	62 Å²	62	89.7 Å²	89.7	43%	0.434	46%	0.46	S	S	.	.	H	α-helix	trans	-64.9	-41.9	174.6	-171.5	0	0	0	0	111.9	A734 Q735 K736 Q741 Q742	A734-S738 PolarHBondContact O-N 3.03Å; Q735-S738 WeakPolarHBondContact O-CB 3.13Å; Q735-S738 PolarHBondContact O-N 3.16Å; Q735-S738 VanDerWaalsContact O-N 3.15Å; K736-S738 VanDerWaalsContact C-N 3.28Å; K736-S738 PolarHBondContact O-N 2.99Å; S738-Q741 PolarHBondContact O-N 3.23Å; S738-Q742 VanDerWaalsContact O-CG 3.31Å; S738-Q742 WeakPolarHBondContact O-CG 3.44Å; S738-Q742 PolarHBondContact O-N 2.92Å; S738-Q742 PolarHBondContact OG-NE2 3.45Å
739	L	79.4	Confident	80	Confident	104 Å²	104	88.8 Å²	88.8	55%	0.545	46%	0.457	S	S	.	.	H	α-helix	trans	-69.1	-38.8	175.5	-68	170.5	0	0	0	112.3	Q735 K736 Q742 L743	Q735-L739 WeakPolarHBondContact O-CG 3.41Å; Q735-L739 PolarHBondContact O-N 3.04Å; K736-L739 PolarHBondContact O-N 3.44Å; K736-L739 VanDerWaalsContact O-N 3.15Å; L739-Q742 PolarHBondContact O-N 3.37Å; L739-L743 WeakPolarHBondContact O-CB 3.37Å; L739-L743 PolarHBondContact O-N 2.86Å
740	E	83.7	Confident	79.9	Confident	98 Å²	98	85.7 Å²	85.7	46%	0.458	44%	0.441	S	S	.	.	H	α-helix	trans	-62	-41.7	173.2	-73.3	169	170.3	0	0	111.4	K736 R737 L743 A744	K736-E740 WeakPolarHBondContact CE-OE1 3.39Å; K736-E740 HydrophobicContact CG-CG 4.48Å; K736-E740 WeakPolarHBondContact O-CB 3.44Å; K736-E740 WeakPolarHBondContact O-CG 2.8Å; K736-E740 PolarHBondContact O-N 2.89Å; R737-E740 PolarHBondContact O-N 2.61Å; E740-L743 PolarHBondContact O-N 3.43Å; E740-A744 PolarHBondContact O-N 2.94Å
741	Q	81.8	Confident	79.7	Confident	109 Å²	109	89.3 Å²	89.3	51%	0.509	45%	0.447	S	S	.	.	H	α-helix	trans	-65.3	-44.2	173.6	-174.5	63.1	52.5	0	0	111.8	R737 S738 L743 A744 D745	R737-Q741 WeakPolarHBondContact O-CB 3.29Å; R737-Q741 PolarHBondContact O-N 2.83Å; S738-Q741 PolarHBondContact O-N 3.23Å; Q741-L743 VanDerWaalsContact C-N 3.3Å; Q741-L743 PolarHBondContact O-N 3.31Å; Q741-A744 WeakPolarHBondContact O-CB 3.33Å; Q741-A744 PolarHBondContact O-N 3.22Å; Q741-A744 VanDerWaalsContact O-N 3.13Å; Q741-D745 PolarHBondContact NE2-OD1 3.4Å; Q741-D745 PolarHBondContact O-N 2.97Å
742	Q	80.1	Confident	79.7	Confident	108 Å²	108	89.3 Å²	89.3	51%	0.505	45%	0.45	S	S	.	.	H	α-helix	trans	-60.7	-38.7	175.6	-73.5	173.8	45.8	0	0	112	S738 L739 D745 K746	S738-Q742 VanDerWaalsContact O-CG 3.31Å; S738-Q742 WeakPolarHBondContact O-CG 3.44Å; S738-Q742 PolarHBondContact O-N 2.92Å; S738-Q742 PolarHBondContact OG-NE2 3.45Å; L739-Q742 PolarHBondContact O-N 3.37Å; Q742-D745 PolarHBondContact O-N 2.99Å; Q742-K746 WeakPolarHBondContact O-CB 3.48Å; Q742-K746 VanDerWaalsContact O-CG 3.23Å; Q742-K746 WeakPolarHBondContact O-CG 3.32Å; Q742-K746 PolarHBondContact O-N 3.14Å
743	L	74.9	Confident	79.7	Confident	78 Å²	78	88.4 Å²	88.4	41%	0.408	45%	0.445	S	S	.	.	H	α-helix	trans	-64.9	-40.6	173	-86.1	165	0	0	0	112.2	L739 E740 Q741 N747 L788	L739-L743 WeakPolarHBondContact O-CB 3.37Å; L739-L743 PolarHBondContact O-N 2.86Å; E740-L743 PolarHBondContact O-N 3.43Å; Q741-L743 VanDerWaalsContact C-N 3.3Å; Q741-L743 PolarHBondContact O-N 3.31Å; L743-N747 WeakPolarHBondContact O-CB 3.45Å; L743-N747 PolarHBondContact O-N 3.22Å; L743-L788 HydrophobicContact CD1-CD1 3.99Å
744	A	82.5	Confident	79.5	Confident	40 Å²	40	90.1 Å²	90.1	33%	0.331	45%	0.451	S	S	.	.	H	α-helix	trans	-64.3	-45.8	175	0	0	0	0	0	111.7	E740 Q741 K746 N747 N748	E740-A744 PolarHBondContact O-N 2.94Å; Q741-A744 WeakPolarHBondContact O-CB 3.33Å; Q741-A744 PolarHBondContact O-N 3.22Å; Q741-A744 VanDerWaalsContact O-N 3.13Å; A744-K746 PolarHBondContact O-N 3.41Å; A744-N747 PolarHBondContact O-N 3.03Å; A744-N748 VanDerWaalsContact O-CG 3.26Å; A744-N748 PolarHBondContact O-N 3.43Å; A744-N748 PolarHBondContact O-ND2 2.83Å
745	D	80.8	Confident	79.2	Confident	83 Å²	83	94.1 Å²	94.1	44%	0.444	46%	0.462	S	S	.	.	H	α-helix	trans	-61.6	-42.7	177.4	-65.3	-17.9	0	0	0	111.2	Q741 Q742 N748 E749	Q741-D745 PolarHBondContact NE2-OD1 3.4Å; Q741-D745 PolarHBondContact O-N 2.97Å; Q742-D745 PolarHBondContact O-N 2.99Å; D745-N748 PolarHBondContact O-N 3.03Å; D745-E749 PolarHBondContact O-N 3.36Å
746	K	80	Confident	78.7	Confident	113 Å²	113	93.7 Å²	93.7	49%	0.491	46%	0.46	S	S	.	.	H	α-helix	trans	-67.1	-38.2	175.1	-71.6	-73.1	156.7	-161.2	0	112.6	Q742 A744 N748 E749 I750	Q742-K746 WeakPolarHBondContact O-CB 3.48Å; Q742-K746 VanDerWaalsContact O-CG 3.23Å; Q742-K746 WeakPolarHBondContact O-CG 3.32Å; Q742-K746 PolarHBondContact O-N 3.14Å; A744-K746 PolarHBondContact O-N 3.41Å; K746-N748 VanDerWaalsContact C-N 3.34Å; K746-E749 WeakPolarHBondContact CD-OE2 3.49Å; K746-E749 WeakPolarHBondContact CE-OE2 3.3Å; K746-E749 IonicContact NZ-OE1 3.36Å; K746-E749 IonicContact NZ-OE2 3.15Å; K746-E749 PolarHBondContact NZ-OE2 3.3Å; K746-E749 PolarHBondContact O-N 3.37Å; K746-I750 WeakPolarHBondContact O-CD1 3.49Å; K746-I750 VanDerWaalsContact O-CG1 3.23Å; K746-I750 WeakPolarHBondContact O-CG1 3.47Å; K746-I750 PolarHBondContact O-N 3.05Å
747	N	80.5	Confident	77.8	Confident	94 Å²	94	91.7 Å²	91.7	50%	0.503	45%	0.453	S	S	.	.	H	α-helix	trans	-63	-40	172	-96.6	-27.3	0	0	0	112.2	L743 A744 E749 I750 Q751	L743-N747 WeakPolarHBondContact O-CB 3.45Å; L743-N747 PolarHBondContact O-N 3.22Å; A744-N747 PolarHBondContact O-N 3.03Å; N747-E749 VanDerWaalsContact C-N 3.35Å; N747-I750 PolarHBondContact O-N 2.93Å; N747-Q751 WeakPolarHBondContact O-CG 3.46Å; N747-Q751 PolarHBondContact O-N 2.81Å
748	N	82.2	Confident	77	Confident	105 Å²	105	93 Å²	93	56%	0.561	46%	0.459	S	S	*	.	H	α-helix	trans	-64.4	-39.5	174.8	-68.2	-31.7	0	0	0	111.7	A744 D745 K746 Q751 N752	A744-N748 VanDerWaalsContact O-CG 3.26Å; A744-N748 PolarHBondContact O-N 3.43Å; A744-N748 PolarHBondContact O-ND2 2.83Å; D745-N748 PolarHBondContact O-N 3.03Å; K746-N748 VanDerWaalsContact C-N 3.34Å; N748-Q751 PolarHBondContact O-N 2.94Å; N748-N752 WeakPolarHBondContact O-CB 3.25Å; N748-N752 PolarHBondContact O-N 2.75Å
749	E	79.1	Confident	76	Confident	99 Å²	99	95 Å²	95	46%	0.463	47%	0.465	S	S	.	.	H	α-helix	trans	-63	-42.4	173.7	-165.7	173.6	-155.2	0	0	111.7	D745 K746 N747 N752 L753	D745-E749 PolarHBondContact O-N 3.36Å; K746-E749 WeakPolarHBondContact CD-OE2 3.49Å; K746-E749 WeakPolarHBondContact CE-OE2 3.3Å; K746-E749 IonicContact NZ-OE1 3.36Å; K746-E749 IonicContact NZ-OE2 3.15Å; K746-E749 PolarHBondContact NZ-OE2 3.3Å; K746-E749 PolarHBondContact O-N 3.37Å; N747-E749 VanDerWaalsContact C-N 3.35Å; E749-N752 PolarHBondContact O-N 3.03Å; E749-L753 WeakPolarHBondContact O-CG 3.47Å; E749-L753 PolarHBondContact O-N 3Å
750	I	73.2	Confident	74.9	Confident	38 Å²	38	97.1 Å²	97.1	20%	0.195	47%	0.467	C	S	.	.	H	α-helix	trans	-64	-40.9	174.3	-66.7	157.6	0	0	0	111.7	K746 N747 L753 K754 L781	K746-I750 WeakPolarHBondContact O-CD1 3.49Å; K746-I750 VanDerWaalsContact O-CG1 3.23Å; K746-I750 WeakPolarHBondContact O-CG1 3.47Å; K746-I750 PolarHBondContact O-N 3.05Å; N747-I750 PolarHBondContact O-N 2.93Å; I750-L753 PolarHBondContact O-N 3.04Å; I750-K754 HydrophobicContact CG2-CD 4.13Å; I750-K754 WeakPolarHBondContact O-CG 3.28Å; I750-K754 PolarHBondContact O-N 3.48Å; I750-L781 HydrophobicContact CD1-CD1 3.45Å; I750-L781 VanDerWaalsContact CD1-CD1 3.45Å; I750-L781 HydrophobicContact CD1-CD2 4.35Å; I750-L781 HydrophobicContact CG1-CD1 4.42Å
751	Q	76.4	Confident	73.5	Confident	115 Å²	115	97.1 Å²	97.1	54%	0.537	47%	0.47	S	S	.	.	H	α-helix	trans	-66	-42	177	-70.9	-66.3	-0.2	0	0	111.8	N747 N748 L753 K754 E755	N747-Q751 WeakPolarHBondContact O-CG 3.46Å; N747-Q751 PolarHBondContact O-N 2.81Å; N748-Q751 PolarHBondContact O-N 2.94Å; Q751-L753 VanDerWaalsContact C-N 3.35Å; Q751-L753 PolarHBondContact O-N 3.01Å; Q751-K754 CarbonylContact O-C 3.57Å; Q751-K754 WeakPolarHBondContact O-CA 3.39Å; Q751-K754 WeakPolarHBondContact O-CB 3.43Å; Q751-K754 PolarHBondContact O-N 3.4Å; Q751-K754 VanDerWaalsContact O-N 3.1Å; Q751-E755 PolarHBondContact O-N 3.38Å
752	N	79.2	Confident	72.2	Confident	83 Å²	83	96.5 Å²	96.5	44%	0.444	48%	0.478	S	S	.	.	H	α-helix	trans	-62.6	-40.9	174.6	-170.6	-17.5	0	0	0	111.4	N748 E749 K754 E755 Q756	N748-N752 WeakPolarHBondContact O-CB 3.25Å; N748-N752 PolarHBondContact O-N 2.75Å; E749-N752 PolarHBondContact O-N 3.03Å; N752-K754 VanDerWaalsContact C-N 3.34Å; N752-K754 PolarHBondContact O-N 3.45Å; N752-E755 PolarHBondContact O-N 3.03Å; N752-Q756 VanDerWaalsContact O-CG 3.32Å; N752-Q756 WeakPolarHBondContact O-CG 3.45Å; N752-Q756 PolarHBondContact O-N 2.84Å; N752-Q756 PolarHBondContact OD1-NE2 3.48Å
753	L	74	Confident	71.1	Confident	86 Å²	86	97.9 Å²	97.9	45%	0.45	49%	0.489	S	S	.	.	H	α-helix	trans	-63.1	-37.4	171.8	-71.2	169.9	0	0	0	112.3	E749 I750 Q751 Q756 I757	E749-L753 WeakPolarHBondContact O-CG 3.47Å; E749-L753 PolarHBondContact O-N 3Å; I750-L753 PolarHBondContact O-N 3.04Å; Q751-L753 VanDerWaalsContact C-N 3.35Å; Q751-L753 PolarHBondContact O-N 3.01Å; L753-Q756 PolarHBondContact O-N 3.18Å; L753-I757 WeakPolarHBondContact O-CD1 3.32Å; L753-I757 VanDerWaalsContact O-CG1 3.23Å; L753-I757 WeakPolarHBondContact O-CG1 3.34Å; L753-I757 PolarHBondContact O-N 3.48Å
754	K	75.2	Confident	69.9	Low	97 Å²	97	97.4 Å²	97.4	42%	0.422	50%	0.503	S	S	.	.	H	α-helix	trans	-66.7	-39.1	174.1	-75.4	176.3	178.4	-176.1	0	112.5	I750 Q751 N752 I757 Y758 E778	I750-K754 HydrophobicContact CG2-CD 4.13Å; I750-K754 WeakPolarHBondContact O-CG 3.28Å; I750-K754 PolarHBondContact O-N 3.48Å; Q751-K754 CarbonylContact O-C 3.57Å; Q751-K754 WeakPolarHBondContact O-CA 3.39Å; Q751-K754 WeakPolarHBondContact O-CB 3.43Å; Q751-K754 PolarHBondContact O-N 3.4Å; Q751-K754 VanDerWaalsContact O-N 3.1Å; N752-K754 VanDerWaalsContact C-N 3.34Å; N752-K754 PolarHBondContact O-N 3.45Å; K754-I757 PolarHBondContact O-N 3.15Å; K754-Y758 PolarHBondContact O-N 3.38Å; K754-E778 IonicContact NZ-OE1 3.76Å; K754-E778 PolarHBondContact NZ-OE1 3.43Å
755	E	73.1	Confident	68.5	Low	129 Å²	129	103.9 Å²	103.9	60%	0.603	53%	0.526	S	S	*	.	H	α-helix	trans	-64.2	-40.7	170.9	-76.3	-172.2	145.8	0	0	112.2	Q751 N752 Y758 N759	Q751-E755 PolarHBondContact O-N 3.38Å; N752-E755 PolarHBondContact O-N 3.03Å; E755-Y758 WeakPolarHBondContact O-CB 3.4Å; E755-Y758 PolarHBondContact O-N 2.95Å; E755-N759 PolarHBondContact O-N 3.16Å; E755-N759 PolarHBondContact O-ND2 3.22Å
756	Q	70.9	Confident	67.2	Low	86 Å²	86	103 Å²	103	40%	0.402	52%	0.521	S	S	.	.	H	α-helix	trans	-61.9	-44.1	174.3	-71.7	171.2	46.3	0	0	111.3	N752 L753 Y758 N759 Y760	N752-Q756 VanDerWaalsContact O-CG 3.32Å; N752-Q756 WeakPolarHBondContact O-CG 3.45Å; N752-Q756 PolarHBondContact O-N 2.84Å; N752-Q756 PolarHBondContact OD1-NE2 3.48Å; L753-Q756 PolarHBondContact O-N 3.18Å; Q756-Y758 VanDerWaalsContact C-N 3.34Å; Q756-Y758 PolarHBondContact O-N 2.9Å; Q756-N759 PolarHBondContact O-N 3.04Å; Q756-Y760 WeakPolarHBondContact O-CD2 3.24Å; Q756-Y760 PolarHBondContact O-N 3.1Å
757	I	61.6	Low	66.4	Low	48 Å²	48	101.3 Å²	101.3	25%	0.246	52%	0.522	C	S	.	.	H	α-helix	trans	-61.3	-41.4	174.2	-67.2	158.7	0	0	0	111.2	L753 K754 N759 Y760 N761 I766 I774	L753-I757 WeakPolarHBondContact O-CD1 3.32Å; L753-I757 VanDerWaalsContact O-CG1 3.23Å; L753-I757 WeakPolarHBondContact O-CG1 3.34Å; L753-I757 PolarHBondContact O-N 3.48Å; K754-I757 PolarHBondContact O-N 3.15Å; I757-N759 VanDerWaalsContact C-N 3.33Å; I757-N759 PolarHBondContact O-N 3.28Å; I757-Y760 PolarHBondContact O-N 2.94Å; I757-N761 PolarHBondContact O-N 3.5Å; I757-I766 HydrophobicContact CG2-CD1 3.91Å; I757-I774 HydrophobicContact CD1-CD1 3.52Å; I757-I774 HydrophobicContact CG1-CD1 4.49Å
758	Y	64.2	Low	65.7	Low	178 Å²	178	100.4 Å²	100.4	70%	0.698	53%	0.527	S	S	*	.	H	α-helix	trans	-60.4	-42.2	175.1	-174.4	-95.2	0	0	0	111.9	K754 E755 Q756 N761	K754-Y758 PolarHBondContact O-N 3.38Å; E755-Y758 WeakPolarHBondContact O-CB 3.4Å; E755-Y758 PolarHBondContact O-N 2.95Å; Q756-Y758 VanDerWaalsContact C-N 3.34Å; Q756-Y758 PolarHBondContact O-N 2.9Å; Y758-N761 WeakPolarHBondContact O-CB 3.32Å; Y758-N761 PolarHBondContact O-N 3.03Å
759	N	62.6	Low	65.1	Low	104 Å²	104	103.5 Å²	103.5	56%	0.556	54%	0.538	S	S	*	.	H	α-helix	trans	-64.7	-41.8	174.1	-70.7	-35.8	0	0	0	112.2	E755 Q756 I757 N761 S762	E755-N759 PolarHBondContact O-N 3.16Å; E755-N759 PolarHBondContact O-ND2 3.22Å; Q756-N759 PolarHBondContact O-N 3.04Å; I757-N759 VanDerWaalsContact C-N 3.33Å; I757-N759 PolarHBondContact O-N 3.28Å; N759-N761 VanDerWaalsContact C-N 3.33Å; N759-N761 PolarHBondContact O-N 2.91Å; N759-S762 PolarHBondContact O-N 3.47Å; N759-S762 PolarHBondContact O-OG 3.44Å
760	Y	57.4	Low	64.5	Low	149 Å²	149	103.6 Å²	103.6	58%	0.584	54%	0.541	S	S	*	.	H	α-helix	trans	-68.1	-27.5	175.4	-79	-68	0	0	0	113.7	Q756 I757 S762 N763	Q756-Y760 WeakPolarHBondContact O-CD2 3.24Å; Q756-Y760 PolarHBondContact O-N 3.1Å; I757-Y760 PolarHBondContact O-N 2.94Å; Y760-S762 PolarHBondContact O-N 3.1Å; Y760-N763 PolarHBondContact O-N 3.41Å
761	N	54.1	Low	64.4	Low	98 Å²	98	104.7 Å²	104.7	52%	0.524	55%	0.549	S	S	.	.	H	α-helix	trans	-63.2	-17.9	173.9	-86	-23.5	0	0	0	113.6	I757 Y758 N759 N763 I766	I757-N761 PolarHBondContact O-N 3.5Å; Y758-N761 WeakPolarHBondContact O-CB 3.32Å; Y758-N761 PolarHBondContact O-N 3.03Å; N759-N761 VanDerWaalsContact C-N 3.33Å; N759-N761 PolarHBondContact O-N 2.91Å; N761-N763 VanDerWaalsContact C-N 3.25Å; N761-N763 PolarHBondContact O-N 3.26Å; N761-I766 WeakPolarHBondContact OD1-CD1 3.48Å
762	S	54.7	Low	64.3	Low	96 Å²	96	103 Å²	103	67%	0.671	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-16.3	169.5	71.1	0	0	0	0	114.1	N759 Y760	N759-S762 PolarHBondContact O-N 3.47Å; N759-S762 PolarHBondContact O-OG 3.44Å; Y760-S762 PolarHBondContact O-N 3.1Å
763	N	56.6	Low	64.1	Low	136 Å²	136	105.8 Å²	105.8	73%	0.727	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.3	13.2	-175.5	-75.5	-37.5	0	0	0	114.5	Y760 N761 Q765	Y760-N763 PolarHBondContact O-N 3.41Å; N761-N763 VanDerWaalsContact C-N 3.25Å; N761-N763 PolarHBondContact O-N 3.26Å; N763-Q765 PolarHBondContact O-N 2.88Å
764	G	48.9	Very low	64	Low	69 Å²	69	104.2 Å²	104.2	71%	0.711	55%	0.55	S	S	*	.	S	Bend	trans	82.5	-1.9	153.1	0	0	0	0	0	119.7
765	Q	53.1	Low	64	Low	176 Å²	176	103.9 Å²	103.9	82%	0.822	55%	0.553	S	S	*	*			trans	-153.3	118.3	173.9	-114.5	168.2	-2.8	0	0	113.1	N763	N763-Q765 PolarHBondContact O-N 2.88Å
766	I	54.3	Low	64.2	Low	64 Å²	64	104.7 Å²	104.7	33%	0.328	55%	0.552	S	S	.	*			trans	-92	128.9	170	-56.5	174.1	0	0	0	108.8	I757 N761 A768 V771	I757-I766 HydrophobicContact CG2-CD1 3.91Å; N761-I766 WeakPolarHBondContact OD1-CD1 3.48Å; I766-A768 PolarHBondContact O-N 2.9Å; I766-V771 HydrophobicContact CB-CG2 4.4Å; I766-V771 HydrophobicContact CG2-CG2 3.72Å
767	P	63.4	Low	64.4	Low	78 Å²	78	104.3 Å²	104.3	51%	0.506	55%	0.552	S	S	.	*			trans	-59.7	131.3	172.7	-24.9	34.3	0	0	0	112.9	E769 L770 V771	P767-E769 VanDerWaalsContact C-N 3.29Å; P767-E769 PolarHBondContact O-N 2.73Å; P767-L770 HydrophobicContact CB-CD1 4.35Å; P767-L770 HydrophobicContact CG-CD1 4.19Å; P767-L770 PolarHBondContact O-N 2.72Å; P767-V771 PolarHBondContact O-N 3.37Å
768	A	65	Low	65.1	Low	74 Å²	74	106.1 Å²	106.1	61%	0.612	56%	0.559	S	S	*	*	H	α-helix	trans	-58.8	-34.6	-175.3	0	0	0	0	0	113.9	I766 L770 V771 S772	I766-A768 PolarHBondContact O-N 2.9Å; A768-L770 VanDerWaalsContact C-N 3.29Å; A768-L770 PolarHBondContact O-N 2.86Å; A768-V771 PolarHBondContact O-N 3.04Å; A768-V771 VanDerWaalsContact O-N 3.16Å; A768-S772 PolarHBondContact O-N 3.26Å; A768-S772 PolarHBondContact O-OG 3.42Å
769	E	70.7	Confident	65.8	Low	171 Å²	171	101.5 Å²	101.5	80%	0.799	55%	0.549	S	S	*	.	H	α-helix	trans	-59.7	-36.4	176.3	-71.8	-174.4	134	0	0	113	P767 K773	P767-E769 VanDerWaalsContact C-N 3.29Å; P767-E769 PolarHBondContact O-N 2.73Å; E769-K773 WeakPolarHBondContact O-CB 3.42Å; E769-K773 PolarHBondContact O-N 3.44Å
770	L	66.2	Low	66.6	Low	101 Å²	101	100.8 Å²	100.8	53%	0.529	54%	0.543	S	S	.	.	H	α-helix	trans	-68.1	-41.7	176.4	-75.4	167.6	0	0	0	110.7	P767 A768 K773 I774	P767-L770 HydrophobicContact CB-CD1 4.35Å; P767-L770 HydrophobicContact CG-CD1 4.19Å; P767-L770 PolarHBondContact O-N 2.72Å; A768-L770 VanDerWaalsContact C-N 3.29Å; A768-L770 PolarHBondContact O-N 2.86Å; L770-K773 PolarHBondContact O-N 2.87Å; L770-I774 WeakPolarHBondContact O-CB 3.43Å; L770-I774 WeakPolarHBondContact O-CD1 3.36Å; L770-I774 WeakPolarHBondContact O-CG1 3.37Å; L770-I774 PolarHBondContact O-N 3.39Å
771	V	70.9	Confident	67.3	Low	60 Å²	60	96.7 Å²	96.7	36%	0.364	53%	0.531	S	S	.	.	H	α-helix	trans	-62.1	-45.2	176.1	-176.9	0	0	0	0	111.1	I766 P767 A768 K773 I774 N775	I766-V771 HydrophobicContact CB-CG2 4.4Å; I766-V771 HydrophobicContact CG2-CG2 3.72Å; P767-V771 PolarHBondContact O-N 3.37Å; A768-V771 PolarHBondContact O-N 3.04Å; A768-V771 VanDerWaalsContact O-N 3.16Å; V771-K773 VanDerWaalsContact C-N 3.34Å; V771-K773 PolarHBondContact O-N 2.82Å; V771-I774 PolarHBondContact O-N 2.89Å; V771-N775 PolarHBondContact O-N 3.43Å
772	S	73.7	Confident	68.5	Low	80 Å²	80	100.6 Å²	100.6	56%	0.559	54%	0.538	S	S	*	.	H	α-helix	trans	-62	-39.7	175.5	-61.3	0	0	0	0	112.6	A768 Y776	A768-S772 PolarHBondContact O-N 3.26Å; A768-S772 PolarHBondContact O-OG 3.42Å; S772-Y776 PolarHBondContact O-N 3.31Å
773	K	75	Confident	69.6	Low	141 Å²	141	100.5 Å²	100.5	61%	0.613	53%	0.53	S	S	*	.	H	α-helix	trans	-70.1	-37.8	178.2	-166	123.9	-175.8	176.6	0	112.4	E769 L770 V771 Y776 L777	E769-K773 WeakPolarHBondContact O-CB 3.42Å; E769-K773 PolarHBondContact O-N 3.44Å; L770-K773 PolarHBondContact O-N 2.87Å; V771-K773 VanDerWaalsContact C-N 3.34Å; V771-K773 PolarHBondContact O-N 2.82Å; K773-Y776 PolarHBondContact O-N 2.89Å; K773-L777 HydrophobicContact CG-CD1 4.23Å; K773-L777 WeakPolarHBondContact O-CB 3.32Å; K773-L777 VanDerWaalsContact O-CG 3.32Å; K773-L777 WeakPolarHBondContact O-CG 3.37Å; K773-L777 PolarHBondContact O-N 3.49Å
774	I	71.7	Confident	70.4	Confident	53 Å²	53	97.4 Å²	97.4	27%	0.272	52%	0.516	S	S	.	.	H	α-helix	trans	-62.3	-51.1	173.1	-69.2	158.3	0	0	0	109.8	I757 L770 V771 Y776 L777 E778	I757-I774 HydrophobicContact CD1-CD1 3.52Å; I757-I774 HydrophobicContact CG1-CD1 4.49Å; L770-I774 WeakPolarHBondContact O-CB 3.43Å; L770-I774 WeakPolarHBondContact O-CD1 3.36Å; L770-I774 WeakPolarHBondContact O-CG1 3.37Å; L770-I774 PolarHBondContact O-N 3.39Å; V771-I774 PolarHBondContact O-N 2.89Å; I774-Y776 VanDerWaalsContact C-N 3.29Å; I774-Y776 PolarHBondContact O-N 3.32Å; I774-L777 PolarHBondContact O-N 3.48Å; I774-L777 VanDerWaalsContact O-N 3.13Å; I774-E778 HydrophobicContact CG2-CG 4.1Å; I774-E778 WeakPolarHBondContact O-CB 3.41Å; I774-E778 WeakPolarHBondContact O-CG 3.27Å; I774-E778 PolarHBondContact O-N 3.32Å
775	N	75.9	Confident	71.8	Confident	91 Å²	91	100 Å²	100	49%	0.487	51%	0.51	S	S	.	.	H	α-helix	trans	-58.6	-39.7	178.9	-73.7	-7.6	0	0	0	112.4	V771 T779	V771-N775 PolarHBondContact O-N 3.43Å; N775-T779 WeakPolarHBondContact O-CB 3.44Å; N775-T779 PolarHBondContact O-N 3.03Å; N775-T779 PolarHBondContact O-OG1 3.04Å
776	Y	78.1	Confident	72.9	Confident	146 Å²	146	95 Å²	95	57%	0.573	49%	0.489	S	S	*	.	H	α-helix	trans	-60.9	-51.7	174	177.6	-91.5	0	0	0	111.6	S772 K773 I774 E778 T779 E780	S772-Y776 PolarHBondContact O-N 3.31Å; K773-Y776 PolarHBondContact O-N 2.89Å; I774-Y776 VanDerWaalsContact C-N 3.29Å; I774-Y776 PolarHBondContact O-N 3.32Å; Y776-E778 PolarHBondContact O-N 2.97Å; Y776-T779 PolarHBondContact O-N 3.21Å; Y776-E780 WeakPolarHBondContact CE1-OE2 3.44Å; Y776-E780 PolarHBondContact O-N 3.14Å
777	L	75.1	Confident	73.9	Confident	77 Å²	77	95.7 Å²	95.7	40%	0.403	50%	0.499	S	S	.	.	H	α-helix	trans	-65.6	-37.6	-179.4	-70.2	170.5	0	0	0	112.6	K773 I774 T779 E780 L781	K773-L777 HydrophobicContact CG-CD1 4.23Å; K773-L777 WeakPolarHBondContact O-CB 3.32Å; K773-L777 VanDerWaalsContact O-CG 3.32Å; K773-L777 WeakPolarHBondContact O-CG 3.37Å; K773-L777 PolarHBondContact O-N 3.49Å; I774-L777 PolarHBondContact O-N 3.48Å; I774-L777 VanDerWaalsContact O-N 3.13Å; L777-T779 VanDerWaalsContact C-N 3.33Å; L777-E780 PolarHBondContact O-N 3.26Å; L777-L781 VanDerWaalsContact O-CB 3.25Å; L777-L781 WeakPolarHBondContact O-CB 3.41Å; L777-L781 WeakPolarHBondContact O-CD1 3.47Å; L777-L781 VanDerWaalsContact O-CG 3.24Å; L777-L781 WeakPolarHBondContact O-CG 3.45Å; L777-L781 PolarHBondContact O-N 2.71Å
778	E	76.6	Confident	74.2	Confident	87 Å²	87	96.3 Å²	96.3	41%	0.407	50%	0.498	S	S	.	.	H	α-helix	trans	-67.2	-33.7	174.8	-72.2	-167.6	149.6	0	0	111.9	K754 I774 Y776 R782	K754-E778 IonicContact NZ-OE1 3.76Å; K754-E778 PolarHBondContact NZ-OE1 3.43Å; I774-E778 HydrophobicContact CG2-CG 4.1Å; I774-E778 WeakPolarHBondContact O-CB 3.41Å; I774-E778 WeakPolarHBondContact O-CG 3.27Å; I774-E778 PolarHBondContact O-N 3.32Å; Y776-E778 PolarHBondContact O-N 2.97Å; E778-R782 WeakPolarHBondContact O-CB 3.28Å; E778-R782 PolarHBondContact O-N 3.11Å
779	T	77.5	Confident	74.8	Confident	80 Å²	80	100 Å²	100	49%	0.491	50%	0.496	S	S	.	.	H	α-helix	trans	-70.4	-42.5	173.5	-52.1	0	0	0	0	111.2	N775 Y776 L777 R782 N783	N775-T779 WeakPolarHBondContact O-CB 3.44Å; N775-T779 PolarHBondContact O-N 3.03Å; N775-T779 PolarHBondContact O-OG1 3.04Å; Y776-T779 PolarHBondContact O-N 3.21Å; L777-T779 VanDerWaalsContact C-N 3.33Å; T779-R782 PolarHBondContact O-N 2.89Å; T779-N783 WeakPolarHBondContact O-CB 3.34Å; T779-N783 PolarHBondContact O-N 2.7Å; T779-N783 PolarHBondContact O-ND2 2.72Å
780	E	78.9	Confident	74.9	Confident	89 Å²	89	96.6 Å²	96.6	42%	0.416	48%	0.483	S	S	.	.	H	α-helix	trans	-67	-38.8	176.9	-165	171.1	-142.9	0	0	112	Y776 L777 N783 T784	Y776-E780 WeakPolarHBondContact CE1-OE2 3.44Å; Y776-E780 PolarHBondContact O-N 3.14Å; L777-E780 PolarHBondContact O-N 3.26Å; E780-N783 PolarHBondContact O-N 3.01Å; E780-T784 WeakPolarHBondContact O-CB 3.28Å; E780-T784 WeakPolarHBondContact O-CG2 3.44Å; E780-T784 PolarHBondContact O-N 3.14Å; E780-T784 PolarHBondContact O-OG1 2.72Å
781	L	72.5	Confident	75	Confident	64 Å²	64	94.4 Å²	94.4	34%	0.335	48%	0.48	S	S	.	.	H	α-helix	trans	-63.7	-40.6	170.8	-79.4	161.6	0	0	0	112.5	I750 L777 T784 H785	I750-L781 HydrophobicContact CD1-CD1 3.45Å; I750-L781 VanDerWaalsContact CD1-CD1 3.45Å; I750-L781 HydrophobicContact CD1-CD2 4.35Å; I750-L781 HydrophobicContact CG1-CD1 4.42Å; L777-L781 VanDerWaalsContact O-CB 3.25Å; L777-L781 WeakPolarHBondContact O-CB 3.41Å; L777-L781 WeakPolarHBondContact O-CD1 3.47Å; L777-L781 VanDerWaalsContact O-CG 3.24Å; L777-L781 WeakPolarHBondContact O-CG 3.45Å; L777-L781 PolarHBondContact O-N 2.71Å; L781-T784 WeakPolarHBondContact CA-OG1 3.4Å; L781-T784 PolarHBondContact O-OG1 3.4Å; L781-T784 VanDerWaalsContact O-OG1 3.08Å; L781-H785 WeakPolarHBondContact O-CB 3.42Å; L781-H785 PolarHBondContact O-N 3.16Å
782	R	79.6	Confident	75.1	Confident	179 Å²	179	94.1 Å²	94.1	68%	0.675	48%	0.48	S	S	*	.	H	α-helix	trans	-64.6	-48.1	174.8	-178.4	169.4	-72.4	-162.6	-2.7	111.1	E778 T779 T784 H785 D786	E778-R782 WeakPolarHBondContact O-CB 3.28Å; E778-R782 PolarHBondContact O-N 3.11Å; T779-R782 PolarHBondContact O-N 2.89Å; R782-T784 VanDerWaalsContact C-N 3.34Å; R782-T784 PolarHBondContact O-N 2.94Å; R782-H785 PolarHBondContact O-N 3.38Å; R782-D786 WeakPolarHBondContact CG-OD2 3.38Å; R782-D786 WeakPolarHBondContact O-CB 3.37Å; R782-D786 VanDerWaalsContact O-CG 3.31Å; R782-D786 PolarHBondContact O-N 3.21Å
783	N	78.5	Confident	75	Confident	95 Å²	95	93.4 Å²	93.4	51%	0.508	47%	0.47	S	S	.	.	H	α-helix	trans	-61.1	-40.2	179	-68.2	-15.5	0	0	0	112.6	T779 E780 S787	T779-N783 WeakPolarHBondContact O-CB 3.34Å; T779-N783 PolarHBondContact O-N 2.7Å; T779-N783 PolarHBondContact O-ND2 2.72Å; E780-N783 PolarHBondContact O-N 3.01Å; N783-S787 WeakPolarHBondContact O-CB 3.31Å; N783-S787 PolarHBondContact O-N 2.98Å; N783-S787 PolarHBondContact O-OG 3.41Å
784	T	72.2	Confident	74.8	Confident	70 Å²	70	92.3 Å²	92.3	43%	0.429	47%	0.465	S	S	.	.	H	α-helix	trans	-71.9	-36.1	175.7	50	0	0	0	0	112.3	E780 L781 R782 S787 L788	E780-T784 WeakPolarHBondContact O-CB 3.28Å; E780-T784 WeakPolarHBondContact O-CG2 3.44Å; E780-T784 PolarHBondContact O-N 3.14Å; E780-T784 PolarHBondContact O-OG1 2.72Å; L781-T784 WeakPolarHBondContact CA-OG1 3.4Å; L781-T784 PolarHBondContact O-OG1 3.4Å; L781-T784 VanDerWaalsContact O-OG1 3.08Å; R782-T784 VanDerWaalsContact C-N 3.34Å; R782-T784 PolarHBondContact O-N 2.94Å; T784-S787 PolarHBondContact O-N 3.43Å; T784-L788 WeakPolarHBondContact O-CB 3.32Å; T784-L788 PolarHBondContact O-N 2.97Å
785	H	78.7	Confident	74.6	Confident	124 Å²	124	92.6 Å²	92.6	57%	0.574	48%	0.476	S	S	*	.	H	α-helix	trans	-66	-44.1	173.8	-172.7	79.1	0	0	0	112.3	L781 R782 S787 L788 R789	L781-H785 WeakPolarHBondContact O-CB 3.42Å; L781-H785 PolarHBondContact O-N 3.16Å; R782-H785 PolarHBondContact O-N 3.38Å; H785-S787 VanDerWaalsContact C-N 3.34Å; H785-L788 PolarHBondContact O-N 2.83Å; H785-R789 WeakPolarHBondContact O-CB 3.32Å; H785-R789 PolarHBondContact O-N 2.98Å
786	D	77	Confident	74.4	Confident	71 Å²	71	94.3 Å²	94.3	38%	0.38	48%	0.479	S	S	.	.	H	α-helix	trans	-64	-40.4	175.4	-68.2	-26.6	0	0	0	110.6	R782 L788 R789 D790	R782-D786 WeakPolarHBondContact CG-OD2 3.38Å; R782-D786 WeakPolarHBondContact O-CB 3.37Å; R782-D786 VanDerWaalsContact O-CG 3.31Å; R782-D786 PolarHBondContact O-N 3.21Å; D786-L788 PolarHBondContact O-N 3.21Å; D786-R789 WeakPolarHBondContact O-CB 3.44Å; D786-R789 PolarHBondContact O-N 3.01Å; D786-D790 PolarHBondContact O-N 2.82Å
787	S	75.1	Confident	73.9	Confident	78 Å²	78	91.5 Å²	91.5	55%	0.545	47%	0.467	S	S	.	.	H	α-helix	trans	-63.6	-39.7	173.6	-59	0	0	0	0	113	N783 T784 H785 A791	N783-S787 WeakPolarHBondContact O-CB 3.31Å; N783-S787 PolarHBondContact O-N 2.98Å; N783-S787 PolarHBondContact O-OG 3.41Å; T784-S787 PolarHBondContact O-N 3.43Å; H785-S787 VanDerWaalsContact C-N 3.34Å; S787-A791 WeakPolarHBondContact O-CB 3.38Å; S787-A791 PolarHBondContact O-N 3.3Å
788	L	70.5	Confident	73.3	Confident	92 Å²	92	94.6 Å²	94.6	48%	0.482	48%	0.475	S	S	.	.	H	α-helix	trans	-67.8	-36.8	174.3	-90.9	164.6	0	0	0	112	L743 T784 H785 D786 A791 S792	L743-L788 HydrophobicContact CD1-CD1 3.99Å; T784-L788 WeakPolarHBondContact O-CB 3.32Å; T784-L788 PolarHBondContact O-N 2.97Å; H785-L788 PolarHBondContact O-N 2.83Å; D786-L788 PolarHBondContact O-N 3.21Å; L788-A791 PolarHBondContact O-N 3.44Å; L788-S792 WeakPolarHBondContact O-CB 3.41Å; L788-S792 PolarHBondContact O-N 2.93Å
789	R	77.5	Confident	72.9	Confident	152 Å²	152	97 Å²	97	57%	0.574	48%	0.484	S	S	*	.	H	α-helix	trans	-65	-49.3	174.8	-177.9	-179.8	178	176.4	1.8	110.9	H785 D786 A791 S792 D793	H785-R789 WeakPolarHBondContact O-CB 3.32Å; H785-R789 PolarHBondContact O-N 2.98Å; D786-R789 WeakPolarHBondContact O-CB 3.44Å; D786-R789 PolarHBondContact O-N 3.01Å; R789-A791 VanDerWaalsContact C-N 3.3Å; R789-A791 PolarHBondContact O-N 3.24Å; R789-S792 WeakPolarHBondContact O-CB 3.4Å; R789-S792 PolarHBondContact O-N 3.36Å; R789-S792 VanDerWaalsContact O-N 3.15Å; R789-D793 IonicContact NE-OD2 3.91Å; R789-D793 WeakPolarHBondContact O-CB 3.45Å; R789-D793 PolarHBondContact O-N 3.15Å
790	D	71.6	Confident	72.4	Confident	98 Å²	98	95.2 Å²	95.2	52%	0.524	48%	0.481	S	S	.	.	H	α-helix	trans	-58.9	-40.5	175.1	-84.7	4.2	0	0	0	112	D786 K794	D786-D790 PolarHBondContact O-N 2.82Å; D790-K794 VanDerWaalsContact O-CB 3.31Å; D790-K794 WeakPolarHBondContact O-CB 3.45Å; D790-K794 WeakPolarHBondContact O-CD 3.26Å; D790-K794 WeakPolarHBondContact O-CG 3.4Å; D790-K794 PolarHBondContact O-N 3.33Å
791	A	67.9	Low	71.6	Confident	56 Å²	56	93.7 Å²	93.7	46%	0.463	47%	0.474	S	S	.	.	H	α-helix	trans	-67.3	-40.5	175.1	0	0	0	0	0	112.5	S787 L788 R789 A795	S787-A791 WeakPolarHBondContact O-CB 3.38Å; S787-A791 PolarHBondContact O-N 3.3Å; L788-A791 PolarHBondContact O-N 3.44Å; R789-A791 VanDerWaalsContact C-N 3.3Å; R789-A791 PolarHBondContact O-N 3.24Å; A791-A795 WeakPolarHBondContact O-CB 3.45Å; A791-A795 PolarHBondContact O-N 2.61Å
792	S	73.2	Confident	71.1	Confident	53 Å²	53	94.5 Å²	94.5	37%	0.371	48%	0.482	S	S	.	.	H	α-helix	trans	-64.8	-45.1	176	178.8	0	0	0	0	111.8	L788 R789 A795 K796	L788-S792 WeakPolarHBondContact O-CB 3.41Å; L788-S792 PolarHBondContact O-N 2.93Å; R789-S792 WeakPolarHBondContact O-CB 3.4Å; R789-S792 PolarHBondContact O-N 3.36Å; R789-S792 VanDerWaalsContact O-N 3.15Å; S792-A795 PolarHBondContact O-N 2.86Å; S792-K796 WeakPolarHBondContact O-CG 3.48Å; S792-K796 PolarHBondContact O-N 3.44Å
793	D	71.5	Confident	70.5	Confident	65 Å²	65	88.7 Å²	88.7	35%	0.348	46%	0.464	S	S	.	.	H	α-helix	trans	-72.2	-33.9	-179.7	-68.7	-19.4	0	0	0	111	R789 K796 W797	R789-D793 IonicContact NE-OD2 3.91Å; R789-D793 WeakPolarHBondContact O-CB 3.45Å; R789-D793 PolarHBondContact O-N 3.15Å; D793-K796 IonicContact OD1-NZ 3.63Å; D793-K796 PolarHBondContact OD1-NZ 2.95Å; D793-W797 VanDerWaalsContact O-CB 3.32Å; D793-W797 WeakPolarHBondContact O-CB 3.31Å; D793-W797 PolarHBondContact O-N 3.43Å
794	K	70.7	Confident	70	Confident	118 Å²	118	89 Å²	89	51%	0.513	46%	0.458	S	S	.	.	H	α-helix	trans	-61.1	-43.8	164.8	-76.3	169.1	-176.3	171.7	0	112.4	D790 W797 Y798	D790-K794 VanDerWaalsContact O-CB 3.31Å; D790-K794 WeakPolarHBondContact O-CB 3.45Å; D790-K794 WeakPolarHBondContact O-CD 3.26Å; D790-K794 WeakPolarHBondContact O-CG 3.4Å; D790-K794 PolarHBondContact O-N 3.33Å; K794-W797 WeakPolarHBondContact O-CB 3.27Å; K794-W797 PolarHBondContact O-N 3.02Å; K794-Y798 WeakPolarHBondContact O-CD2 3.35Å; K794-Y798 PolarHBondContact O-N 3.32Å
795	A	67.9	Low	69.4	Low	60 Å²	60	90.3 Å²	90.3	50%	0.496	46%	0.459	S	S	.	.	H	α-helix	trans	-66.4	-39.9	179.2	0	0	0	0	0	112.5	A791 S792 W797 K799	A791-A795 WeakPolarHBondContact O-CB 3.45Å; A791-A795 PolarHBondContact O-N 2.61Å; S792-A795 PolarHBondContact O-N 2.86Å; A795-W797 VanDerWaalsContact C-N 3.34Å; A795-K799 WeakPolarHBondContact O-CB 3.5Å; A795-K799 PolarHBondContact O-N 3.39Å
796	K	71.7	Confident	68.9	Low	127 Å²	127	91.5 Å²	91.5	55%	0.552	46%	0.458	S	S	*	.	H	α-helix	trans	-62.2	-41.5	171.2	-69.9	171.3	-164	158.3	0	111.6	S792 D793 K799 G800	S792-K796 WeakPolarHBondContact O-CG 3.48Å; S792-K796 PolarHBondContact O-N 3.44Å; D793-K796 IonicContact OD1-NZ 3.63Å; D793-K796 PolarHBondContact OD1-NZ 2.95Å; K796-K799 PolarHBondContact O-N 2.99Å; K796-G800 PolarHBondContact O-N 3.26Å
797	W	67.5	Low	68.5	Low	86 Å²	86	93.2 Å²	93.2	33%	0.326	46%	0.464	S	S	.	.	H	α-helix	trans	-62.7	-51.4	177.2	-178.7	76.4	0	0	0	111.8	D793 K794 A795 K799 G800 E801 K932	D793-W797 VanDerWaalsContact O-CB 3.32Å; D793-W797 WeakPolarHBondContact O-CB 3.31Å; D793-W797 PolarHBondContact O-N 3.43Å; K794-W797 WeakPolarHBondContact O-CB 3.27Å; K794-W797 PolarHBondContact O-N 3.02Å; A795-W797 VanDerWaalsContact C-N 3.34Å; W797-K799 VanDerWaalsContact C-N 3.27Å; W797-K799 PolarHBondContact O-N 2.94Å; W797-G800 WeakPolarHBondContact O-CA 3.43Å; W797-G800 PolarHBondContact O-N 3.45Å; W797-E801 HydrophobicContact CD2-CG 4.46Å; W797-E801 HydrophobicContact CH2-CG 4.5Å; W797-E801 WeakPolarHBondContact CH2-OE1 3.45Å; W797-E801 WeakPolarHBondContact CH2-OE2 3.49Å; W797-E801 VanDerWaalsContact CZ2-CD 3.42Å; W797-E801 HydrophobicContact CZ2-CG 4.2Å; W797-E801 WeakPolarHBondContact CZ2-OE1 3.45Å; W797-E801 WeakPolarHBondContact CZ3-OE2 3.38Å; W797-E801 PolarHBondContact O-N 3.09Å; W797-K932 HydrophobicContact CH2-CD 4.03Å; W797-K932 HydrophobicContact CH2-CG 4Å; W797-K932 HydrophobicContact CZ2-CD 4.31Å; W797-K932 HydrophobicContact CZ2-CG 3.99Å
798	Y	61.7	Low	68.2	Low	143 Å²	143	93.2 Å²	93.2	56%	0.561	46%	0.455	S	S	*	.	H	α-helix	trans	-58.8	-36.9	174.3	-76.3	-59.1	0	0	0	112.8	K794 V802	K794-Y798 WeakPolarHBondContact O-CD2 3.35Å; K794-Y798 PolarHBondContact O-N 3.32Å; Y798-V802 WeakPolarHBondContact O-CB 3.43Å; Y798-V802 VanDerWaalsContact O-CG2 3.29Å; Y798-V802 WeakPolarHBondContact O-CG2 3.4Å; Y798-V802 PolarHBondContact O-N 3.48Å
799	K	69.8	Low	67.9	Low	138 Å²	138	91.7 Å²	91.7	60%	0.6	45%	0.447	S	S	*	.	H	α-helix	trans	-63.2	-45.7	173.7	-174.6	-176.6	175.9	-171.4	0	111.1	A795 K796 W797 V802 D803	A795-K799 WeakPolarHBondContact O-CB 3.5Å; A795-K799 PolarHBondContact O-N 3.39Å; K796-K799 PolarHBondContact O-N 2.99Å; W797-K799 VanDerWaalsContact C-N 3.27Å; W797-K799 PolarHBondContact O-N 2.94Å; K799-V802 PolarHBondContact O-N 3.18Å; K799-D803 WeakPolarHBondContact O-CB 3.39Å; K799-D803 VanDerWaalsContact O-CG 3.3Å; K799-D803 PolarHBondContact O-N 2.87Å
800	G	66.9	Low	67.6	Low	42 Å²	42	87.7 Å²	87.7	43%	0.433	44%	0.442	S	S	.	.	H	α-helix	trans	-59.7	-43.9	176.6	0	0	0	0	0	113.2	K796 W797 D803 Y804	K796-G800 PolarHBondContact O-N 3.26Å; W797-G800 WeakPolarHBondContact O-CA 3.43Å; W797-G800 PolarHBondContact O-N 3.45Å; G800-D803 PolarHBondContact O-N 2.89Å; G800-Y804 WeakPolarHBondContact O-CB 3.32Å; G800-Y804 PolarHBondContact O-N 3.28Å
801	E	60.6	Low	67.6	Low	56 Å²	56	86.5 Å²	86.5	26%	0.262	44%	0.436	S	S	.	.	H	α-helix	trans	-62.4	-47.1	174.1	-69.9	-166.2	134	0	0	112.1	W797 D803 Y804 F805	W797-E801 HydrophobicContact CD2-CG 4.46Å; W797-E801 HydrophobicContact CH2-CG 4.5Å; W797-E801 WeakPolarHBondContact CH2-OE1 3.45Å; W797-E801 WeakPolarHBondContact CH2-OE2 3.49Å; W797-E801 VanDerWaalsContact CZ2-CD 3.42Å; W797-E801 HydrophobicContact CZ2-CG 4.2Å; W797-E801 WeakPolarHBondContact CZ2-OE1 3.45Å; W797-E801 WeakPolarHBondContact CZ3-OE2 3.38Å; W797-E801 PolarHBondContact O-N 3.09Å; E801-D803 VanDerWaalsContact C-N 3.29Å; E801-D803 PolarHBondContact O-N 2.86Å; E801-Y804 WeakPolarHBondContact O-CB 3.35Å; E801-Y804 PolarHBondContact O-N 3.13Å; E801-F805 HydrophobicContact CB-CE2 4.45Å; E801-F805 WeakPolarHBondContact O-CD2 3.43Å; E801-F805 PolarHBondContact O-N 2.85Å
802	V	63.8	Low	67.4	Low	82 Å²	82	85.8 Å²	85.8	50%	0.497	43%	0.427	S	S	.	.	H	α-helix	trans	-63.2	-36.8	178.8	169	0	0	0	0	111.5	Y798 K799 R806	Y798-V802 WeakPolarHBondContact O-CB 3.43Å; Y798-V802 VanDerWaalsContact O-CG2 3.29Å; Y798-V802 WeakPolarHBondContact O-CG2 3.4Å; Y798-V802 PolarHBondContact O-N 3.48Å; K799-V802 PolarHBondContact O-N 3.18Å; V802-R806 VanDerWaalsContact O-CB 3.27Å; V802-R806 WeakPolarHBondContact O-CB 3.47Å; V802-R806 PolarHBondContact O-N 3.36Å
803	D	67.1	Low	67.1	Low	56 Å²	56	88 Å²	88	30%	0.299	43%	0.432	S	S	.	.	H	α-helix	trans	-72.5	-35.6	176.1	-70.4	-21.4	0	0	0	111.5	K799 G800 E801 R806 Q807	K799-D803 WeakPolarHBondContact O-CB 3.39Å; K799-D803 VanDerWaalsContact O-CG 3.3Å; K799-D803 PolarHBondContact O-N 2.87Å; G800-D803 PolarHBondContact O-N 2.89Å; E801-D803 VanDerWaalsContact C-N 3.29Å; E801-D803 PolarHBondContact O-N 2.86Å; D803-R806 PolarHBondContact O-N 2.88Å; D803-R806 IonicContact OD1-CZ 3.43Å; D803-R806 IonicContact OD1-NH1 2.78Å; D803-R806 PolarHBondContact OD1-NH1 2.92Å; D803-R806 IonicContact OD1-NH2 3.56Å; D803-R806 PolarHBondContact OD1-NH2 2.92Å; D803-R806 VanDerWaalsContact OD1-NH2 3.13Å; D803-Q807 WeakPolarHBondContact O-CB 3.48Å; D803-Q807 PolarHBondContact O-N 3.45Å
804	Y	67.2	Low	67.3	Low	101 Å²	101	86.7 Å²	86.7	40%	0.396	43%	0.433	S	S	.	.	H	α-helix	trans	-61.1	-54.1	170.4	171.7	-105.6	0	0	0	111.8	G800 E801 R806 Q807 E808 L939	G800-Y804 WeakPolarHBondContact O-CB 3.32Å; G800-Y804 PolarHBondContact O-N 3.28Å; E801-Y804 WeakPolarHBondContact O-CB 3.35Å; E801-Y804 PolarHBondContact O-N 3.13Å; Y804-R806 VanDerWaalsContact C-N 3.25Å; Y804-R806 PolarHBondContact O-N 3.41Å; Y804-Q807 PolarHBondContact O-N 3.23Å; Y804-E808 HydrophobicContact CD2-CG 4.33Å; Y804-E808 HydrophobicContact CE1-CG 4.22Å; Y804-E808 HydrophobicContact CE2-CG 3.71Å; Y804-E808 PolarHBondContact O-N 2.74Å; Y804-L939 HydrophobicContact CE1-CD2 4.25Å
805	F	59.3	Low	67.5	Low	99 Å²	99	87.4 Å²	87.4	43%	0.434	43%	0.432	S	S	.	.	H	α-helix	trans	-61.6	-33.7	176.8	-71.8	-63.2	0	0	0	112.1	E801 L809	E801-F805 HydrophobicContact CB-CE2 4.45Å; E801-F805 WeakPolarHBondContact O-CD2 3.43Å; E801-F805 PolarHBondContact O-N 2.85Å; F805-L809 VanDerWaalsContact O-CB 3.26Å; F805-L809 WeakPolarHBondContact O-CB 3.36Å; F805-L809 WeakPolarHBondContact O-CD1 3.39Å; F805-L809 WeakPolarHBondContact O-CG 3.49Å; F805-L809 PolarHBondContact O-N 3.41Å
806	R	68.5	Low	67.6	Low	149 Å²	149	85.6 Å²	85.6	56%	0.562	41%	0.414	S	S	*	.	H	α-helix	trans	-65.2	-41.5	172.9	-169.8	-171.2	-59.6	129.2	13.4	111.4	V802 D803 Y804 S810	V802-R806 VanDerWaalsContact O-CB 3.27Å; V802-R806 WeakPolarHBondContact O-CB 3.47Å; V802-R806 PolarHBondContact O-N 3.36Å; D803-R806 PolarHBondContact O-N 2.88Å; D803-R806 IonicContact OD1-CZ 3.43Å; D803-R806 IonicContact OD1-NH1 2.78Å; D803-R806 PolarHBondContact OD1-NH1 2.92Å; D803-R806 IonicContact OD1-NH2 3.56Å; D803-R806 PolarHBondContact OD1-NH2 2.92Å; D803-R806 VanDerWaalsContact OD1-NH2 3.13Å; Y804-R806 VanDerWaalsContact C-N 3.25Å; Y804-R806 PolarHBondContact O-N 3.41Å; R806-S810 VanDerWaalsContact O-CB 3.31Å; R806-S810 WeakPolarHBondContact O-CB 3.32Å; R806-S810 PolarHBondContact O-N 2.82Å
807	Q	69.3	Low	67.8	Low	107 Å²	107	85.7 Å²	85.7	50%	0.5	42%	0.416	S	S	.	.	H	α-helix	trans	-67.7	-45	178.5	-172.7	60.2	48.5	0	0	111.6	D803 Y804 S810 N811	D803-Q807 WeakPolarHBondContact O-CB 3.48Å; D803-Q807 PolarHBondContact O-N 3.45Å; Y804-Q807 PolarHBondContact O-N 3.23Å; Q807-S810 CarbonylContact O-C 3.58Å; Q807-S810 WeakPolarHBondContact O-CA 3.22Å; Q807-S810 WeakPolarHBondContact O-CB 3.49Å; Q807-S810 PolarHBondContact O-N 2.9Å; Q807-S810 VanDerWaalsContact O-N 3.11Å; Q807-N811 PolarHBondContact NE2-OD1 2.78Å; Q807-N811 PolarHBondContact O-N 2.86Å; Q807-N811 PolarHBondContact O-ND2 2.81Å; Q807-N811 PolarHBondContact O-OD1 3.27Å
808	E	67.5	Low	68.3	Low	77 Å²	77	88.3 Å²	88.3	36%	0.36	43%	0.426	S	S	.	.	H	α-helix	trans	-64.5	-42.3	176.3	-70.1	-59.7	172.6	0	0	112.1	Y804 S810 N811 C812	Y804-E808 HydrophobicContact CD2-CG 4.33Å; Y804-E808 HydrophobicContact CE1-CG 4.22Å; Y804-E808 HydrophobicContact CE2-CG 3.71Å; Y804-E808 PolarHBondContact O-N 2.74Å; E808-S810 VanDerWaalsContact C-N 3.28Å; E808-S810 PolarHBondContact O-N 2.83Å; E808-N811 WeakPolarHBondContact O-CB 3.46Å; E808-N811 PolarHBondContact O-N 2.87Å; E808-N811 PolarHBondContact OE2-ND2 3.48Å; E808-C812 WeakPolarHBondContact O-CB 3.38Å; E808-C812 PolarHBondContact O-N 2.86Å; E808-C812 PolarHBondContact O-SG 2.76Å; E808-C812 VanDerWaalsContact O-SG 3.34Å
809	L	65	Low	68.8	Low	61 Å²	61	81.5 Å²	81.5	32%	0.319	40%	0.4	S	S	.	.	H	α-helix	trans	-58.6	-41.5	170.9	-73.7	170.3	0	0	0	111.3	F805 C812 H813 L863	F805-L809 VanDerWaalsContact O-CB 3.26Å; F805-L809 WeakPolarHBondContact O-CB 3.36Å; F805-L809 WeakPolarHBondContact O-CD1 3.39Å; F805-L809 WeakPolarHBondContact O-CG 3.49Å; F805-L809 PolarHBondContact O-N 3.41Å; L809-C812 PolarHBondContact O-N 3.01Å; L809-H813 WeakPolarHBondContact O-CB 3.5Å; L809-H813 PolarHBondContact O-N 3.39Å; L809-H813 PolarHBondContact O-ND1 2.94Å; L809-L863 HydrophobicContact CD2-CD1 3.54Å
810	S	71.3	Confident	69.1	Low	67 Å²	67	78.6 Å²	78.6	47%	0.469	39%	0.388	S	S	.	.	H	α-helix	trans	-63	-41.8	176.1	-166.4	0	0	0	0	112.2	R806 Q807 E808 H813 G814	R806-S810 VanDerWaalsContact O-CB 3.31Å; R806-S810 WeakPolarHBondContact O-CB 3.32Å; R806-S810 PolarHBondContact O-N 2.82Å; Q807-S810 CarbonylContact O-C 3.58Å; Q807-S810 WeakPolarHBondContact O-CA 3.22Å; Q807-S810 WeakPolarHBondContact O-CB 3.49Å; Q807-S810 PolarHBondContact O-N 2.9Å; Q807-S810 VanDerWaalsContact O-N 3.11Å; E808-S810 VanDerWaalsContact C-N 3.28Å; E808-S810 PolarHBondContact O-N 2.83Å; S810-H813 PolarHBondContact O-N 3.36Å; S810-G814 PolarHBondContact O-N 3.35Å
811	N	70.2	Confident	69.7	Low	73 Å²	73	80.3 Å²	80.3	39%	0.39	39%	0.393	S	S	.	.	H	α-helix	trans	-62.4	-47.4	175.5	-63.6	-17.8	0	0	0	111	Q807 E808 G814 R815	Q807-N811 PolarHBondContact NE2-OD1 2.78Å; Q807-N811 PolarHBondContact O-N 2.86Å; Q807-N811 PolarHBondContact O-ND2 2.81Å; Q807-N811 PolarHBondContact O-OD1 3.27Å; E808-N811 WeakPolarHBondContact O-CB 3.46Å; E808-N811 PolarHBondContact O-N 2.87Å; E808-N811 PolarHBondContact OE2-ND2 3.48Å; N811-G814 PolarHBondContact O-N 2.8Å; N811-R815 WeakPolarHBondContact O-CB 3.39Å; N811-R815 PolarHBondContact O-N 3.01Å
812	C	63.9	Low	70.5	Confident	41 Å²	41	79.3 Å²	79.3	28%	0.277	39%	0.389	S	S	.	.	H	α-helix	trans	-61	-45.4	175.5	-68.9	0	0	0	0	111.9	E808 L809 R815 I816 L863	E808-C812 WeakPolarHBondContact O-CB 3.38Å; E808-C812 PolarHBondContact O-N 2.86Å; E808-C812 PolarHBondContact O-SG 2.76Å; E808-C812 VanDerWaalsContact O-SG 3.34Å; L809-C812 PolarHBondContact O-N 3.01Å; C812-R815 PolarHBondContact O-N 2.96Å; C812-I816 WeakPolarHBondContact O-CB 3.43Å; C812-I816 VanDerWaalsContact O-CG1 3.27Å; C812-I816 WeakPolarHBondContact O-CG1 3.37Å; C812-I816 PolarHBondContact O-N 2.87Å; C812-L863 HydrophobicContact CB-CD1 4.47Å
813	H	68	Low	71	Confident	101 Å²	101	77 Å²	77	47%	0.468	37%	0.373	S	S	.	.	H	α-helix	trans	-63.1	-43.4	177.4	-78.1	78.5	0	0	0	111.6	L809 S810 R815 I816 Q817	L809-H813 WeakPolarHBondContact O-CB 3.5Å; L809-H813 PolarHBondContact O-N 3.39Å; L809-H813 PolarHBondContact O-ND1 2.94Å; S810-H813 PolarHBondContact O-N 3.36Å; H813-R815 PolarHBondContact O-N 3.35Å; H813-I816 PolarHBondContact O-N 3.27Å; H813-Q817 WeakPolarHBondContact O-CG 3.3Å; H813-Q817 PolarHBondContact O-N 3.21Å
814	G	75.9	Confident	71.7	Confident	36 Å²	36	79.8 Å²	79.8	37%	0.371	39%	0.388	S	S	.	.	H	α-helix	trans	-62.1	-40.4	175.3	0	0	0	0	0	112.7	S810 N811 Q817 W818	S810-G814 PolarHBondContact O-N 3.35Å; N811-G814 PolarHBondContact O-N 2.8Å; G814-Q817 PolarHBondContact O-N 3.07Å; G814-W818 PolarHBondContact O-N 3.27Å
815	R	73.7	Confident	72.5	Confident	133 Å²	133	79.5 Å²	79.5	50%	0.502	39%	0.387	S	S	.	.	H	α-helix	trans	-69.7	-36.7	176.1	-170	168.3	178	128.3	1.2	112.6	N811 C812 H813 W818 L819 E855 L859	N811-R815 WeakPolarHBondContact O-CB 3.39Å; N811-R815 PolarHBondContact O-N 3.01Å; C812-R815 PolarHBondContact O-N 2.96Å; H813-R815 PolarHBondContact O-N 3.35Å; R815-W818 PolarHBondContact O-N 3.1Å; R815-L819 WeakPolarHBondContact O-CB 3.36Å; R815-L819 WeakPolarHBondContact O-CG 3.2Å; R815-L819 PolarHBondContact O-N 2.9Å; R815-E855 IonicContact NH2-OE2 2.88Å; R815-E855 PolarHBondContact NH2-OE2 3.47Å; R815-L859 HydrophobicContact CG-CD1 4Å
816	I	71	Confident	73.4	Confident	23 Å²	23	74.8 Å²	74.8	12%	0.118	37%	0.366	C	S	.	.	H	α-helix	trans	-63.7	-47.2	172.6	-71.1	165	0	0	0	110.2	C812 H813 W818 L819 E820 L863	C812-I816 WeakPolarHBondContact O-CB 3.43Å; C812-I816 VanDerWaalsContact O-CG1 3.27Å; C812-I816 WeakPolarHBondContact O-CG1 3.37Å; C812-I816 PolarHBondContact O-N 2.87Å; H813-I816 PolarHBondContact O-N 3.27Å; I816-W818 VanDerWaalsContact C-N 3.3Å; I816-W818 PolarHBondContact O-N 2.78Å; I816-L819 PolarHBondContact O-N 3.28Å; I816-E820 HydrophobicContact CG2-CG 4.25Å; I816-E820 WeakPolarHBondContact O-CB 3.41Å; I816-E820 WeakPolarHBondContact O-CG 3.38Å; I816-E820 PolarHBondContact O-N 2.91Å; I816-L863 HydrophobicContact CD1-CD2 3.8Å
817	Q	74.9	Confident	73.8	Confident	128 Å²	128	71.6 Å²	71.6	60%	0.598	36%	0.357	S	S	*	.	H	α-helix	trans	-60	-38.6	176.1	-76.1	-178.8	-19.8	0	0	112.7	H813 G814 S821	H813-Q817 WeakPolarHBondContact O-CG 3.3Å; H813-Q817 PolarHBondContact O-N 3.21Å; G814-Q817 PolarHBondContact O-N 3.07Å; Q817-S821 WeakPolarHBondContact O-CB 3.28Å; Q817-S821 PolarHBondContact O-N 2.98Å; Q817-S821 PolarHBondContact O-OG 3.45Å
818	W	79.6	Confident	74.2	Confident	142 Å²	142	68 Å²	68	54%	0.538	35%	0.349	S	S	.	.	H	α-helix	trans	-64.6	-47.8	174	-178.7	80.8	0	0	0	111.8	G814 R815 I816 E820 S821 E822	G814-W818 PolarHBondContact O-N 3.27Å; R815-W818 PolarHBondContact O-N 3.1Å; I816-W818 VanDerWaalsContact C-N 3.3Å; I816-W818 PolarHBondContact O-N 2.78Å; W818-E820 PolarHBondContact O-N 2.89Å; W818-S821 WeakPolarHBondContact O-CB 3.49Å; W818-S821 PolarHBondContact O-N 2.99Å; W818-E822 HydrophobicContact CH2-CG 4.41Å; W818-E822 HydrophobicContact CZ2-CG 4.41Å; W818-E822 WeakPolarHBondContact O-CB 3.31Å; W818-E822 PolarHBondContact O-N 2.68Å
819	L	71.7	Confident	74.8	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-62	-42.1	176.4	-77	171.9	0	0	0	112.3	R815 I816 S821 E822 L823 L852 E855 L856 L859	R815-L819 WeakPolarHBondContact O-CB 3.36Å; R815-L819 WeakPolarHBondContact O-CG 3.2Å; R815-L819 PolarHBondContact O-N 2.9Å; I816-L819 PolarHBondContact O-N 3.28Å; L819-S821 VanDerWaalsContact C-N 3.33Å; L819-S821 PolarHBondContact O-N 3.25Å; L819-E822 PolarHBondContact O-N 2.86Å; L819-L823 VanDerWaalsContact O-CB 3.24Å; L819-L823 WeakPolarHBondContact O-CB 3.48Å; L819-L823 PolarHBondContact O-N 3.35Å; L819-L852 HydrophobicContact CD2-CD2 3.76Å; L819-E855 HydrophobicContact CD1-CB 4.26Å; L819-E855 HydrophobicContact CD2-CB 4.33Å; L819-L856 HydrophobicContact CB-CD1 4.26Å; L819-L856 HydrophobicContact CB-CG 4.38Å; L819-L856 HydrophobicContact CD1-CB 4.35Å; L819-L859 HydrophobicContact CD1-CD1 3.38Å
820	E	75.6	Confident	75.1	Confident	76 Å²	76	65.2 Å²	65.2	36%	0.355	34%	0.336	S	S	.	.	H	α-helix	trans	-63.2	-39.1	175.7	-73.3	177.2	163.5	0	0	111.5	I816 W818 N824 L856 R860	I816-E820 HydrophobicContact CG2-CG 4.25Å; I816-E820 WeakPolarHBondContact O-CB 3.41Å; I816-E820 WeakPolarHBondContact O-CG 3.38Å; I816-E820 PolarHBondContact O-N 2.91Å; W818-E820 PolarHBondContact O-N 2.89Å; E820-N824 WeakPolarHBondContact O-CB 3.37Å; E820-N824 VanDerWaalsContact O-CG 3.25Å; E820-N824 PolarHBondContact O-N 3.49Å; E820-N824 PolarHBondContact O-ND2 3.2Å; E820-L856 HydrophobicContact CG-CD1 4.01Å; E820-R860 IonicContact OE1-NH2 3.93Å
821	S	80.1	Confident	75.3	Confident	78 Å²	78	66 Å²	66	55%	0.545	34%	0.335	S	S	.	.	H	α-helix	trans	-65.4	-42.6	174.9	-59.4	0	0	0	0	112	Q817 W818 L819 N824 R825	Q817-S821 WeakPolarHBondContact O-CB 3.28Å; Q817-S821 PolarHBondContact O-N 2.98Å; Q817-S821 PolarHBondContact O-OG 3.45Å; W818-S821 WeakPolarHBondContact O-CB 3.49Å; W818-S821 PolarHBondContact O-N 2.99Å; L819-S821 VanDerWaalsContact C-N 3.33Å; L819-S821 PolarHBondContact O-N 3.25Å; S821-N824 PolarHBondContact O-N 3.25Å; S821-R825 PolarHBondContact O-N 3.18Å
822	E	76.8	Confident	75.5	Confident	36 Å²	36	69.9 Å²	69.9	17%	0.168	35%	0.348	C	S	.	.	H	α-helix	trans	-72.1	-37.8	179.5	-167.4	69.4	167.8	0	0	112	W818 L819 N824 R825 V826 L852	W818-E822 HydrophobicContact CH2-CG 4.41Å; W818-E822 HydrophobicContact CZ2-CG 4.41Å; W818-E822 WeakPolarHBondContact O-CB 3.31Å; W818-E822 PolarHBondContact O-N 2.68Å; L819-E822 PolarHBondContact O-N 2.86Å; E822-N824 VanDerWaalsContact C-N 3.33Å; E822-N824 PolarHBondContact O-N 3.01Å; E822-R825 WeakPolarHBondContact O-CB 3.35Å; E822-R825 PolarHBondContact O-N 3.49Å; E822-R825 VanDerWaalsContact O-N 3.16Å; E822-R825 IonicContact OE1-CZ 2.83Å; E822-R825 VanDerWaalsContact OE1-CZ 3.3Å; E822-R825 IonicContact OE1-NE 3.87Å; E822-R825 PolarHBondContact OE1-NE 3.09Å; E822-R825 VanDerWaalsContact OE1-NE 3.1Å; E822-R825 IonicContact OE1-NH2 3.66Å; E822-R825 PolarHBondContact OE1-NH2 3.45Å; E822-R825 WeakPolarHBondContact OE2-CD 3.32Å; E822-R825 IonicContact OE2-CZ 2.64Å; E822-R825 IonicContact OE2-NE 2.88Å; E822-R825 PolarHBondContact OE2-NE 2.95Å; E822-R825 IonicContact OE2-NH2 3.02Å; E822-V826 WeakPolarHBondContact O-CG2 3.22Å; E822-V826 PolarHBondContact O-N 3.49Å; E822-L852 HydrophobicContact CB-CD1 4.48Å; E822-L852 HydrophobicContact CG-CD1 3.88Å; E822-L852 HydrophobicContact CG-CD2 4.25Å
823	L	75.5	Confident	75.5	Confident	33 Å²	33	69.2 Å²	69.2	17%	0.173	34%	0.341	C	S	.	.	H	α-helix	trans	-62.2	-42.2	172.6	-154.4	115.4	0	0	0	110.5	L819 V826 H827 L852 L853	L819-L823 VanDerWaalsContact O-CB 3.24Å; L819-L823 WeakPolarHBondContact O-CB 3.48Å; L819-L823 PolarHBondContact O-N 3.35Å; L823-V826 PolarHBondContact O-N 3.45Å; L823-H827 VanDerWaalsContact O-CB 3.23Å; L823-H827 WeakPolarHBondContact O-CB 3.46Å; L823-H827 PolarHBondContact O-N 2.88Å; L823-L852 HydrophobicContact CD1-CB 3.9Å; L823-L853 HydrophobicContact CD1-CB 4.3Å; L823-L853 HydrophobicContact CD1-CD1 4.26Å; L823-L853 HydrophobicContact CD1-CG 4.36Å
824	N	80.1	Confident	75.2	Confident	114 Å²	114	72 Å²	72	61%	0.61	35%	0.352	S	S	*	.	H	α-helix	trans	-63.1	-39	172.5	-77.7	-42.8	0	0	0	112.5	E820 S821 E822 G828	E820-N824 WeakPolarHBondContact O-CB 3.37Å; E820-N824 VanDerWaalsContact O-CG 3.25Å; E820-N824 PolarHBondContact O-N 3.49Å; E820-N824 PolarHBondContact O-ND2 3.2Å; S821-N824 PolarHBondContact O-N 3.25Å; E822-N824 VanDerWaalsContact C-N 3.33Å; E822-N824 PolarHBondContact O-N 3.01Å; N824-G828 PolarHBondContact O-N 2.82Å
825	R	84.7	Confident	74.7	Confident	96 Å²	96	77.3 Å²	77.3	36%	0.362	37%	0.372	S	S	.	.	H	α-helix	trans	-59.4	-52.3	173.6	-176.4	-170.3	66.5	71.4	-2.6	111	S821 E822 G828 L829 E848	S821-R825 PolarHBondContact O-N 3.18Å; E822-R825 WeakPolarHBondContact O-CB 3.35Å; E822-R825 PolarHBondContact O-N 3.49Å; E822-R825 VanDerWaalsContact O-N 3.16Å; E822-R825 IonicContact OE1-CZ 2.83Å; E822-R825 VanDerWaalsContact OE1-CZ 3.3Å; E822-R825 IonicContact OE1-NE 3.87Å; E822-R825 PolarHBondContact OE1-NE 3.09Å; E822-R825 VanDerWaalsContact OE1-NE 3.1Å; E822-R825 IonicContact OE1-NH2 3.66Å; E822-R825 PolarHBondContact OE1-NH2 3.45Å; E822-R825 WeakPolarHBondContact OE2-CD 3.32Å; E822-R825 IonicContact OE2-CZ 2.64Å; E822-R825 IonicContact OE2-NE 2.88Å; E822-R825 PolarHBondContact OE2-NE 2.95Å; E822-R825 IonicContact OE2-NH2 3.02Å; R825-G828 PolarHBondContact O-N 3.48Å; R825-L829 VanDerWaalsContact NH1-CD1 3.29Å; R825-L829 WeakPolarHBondContact O-CG 3.39Å; R825-L829 PolarHBondContact O-N 3.37Å; R825-E848 IonicContact CZ-OE1 2.65Å; R825-E848 IonicContact NH2-OE1 2.7Å; R825-E848 PolarHBondContact NH2-OE1 3.45Å
826	V	77.4	Confident	74	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-64.9	-42.2	-179.3	176.8	0	0	0	0	110.9	E822 L823 G828 L829 L830 L845 E848 K849 L852	E822-V826 WeakPolarHBondContact O-CG2 3.22Å; E822-V826 PolarHBondContact O-N 3.49Å; L823-V826 PolarHBondContact O-N 3.45Å; V826-G828 VanDerWaalsContact C-N 3.31Å; V826-G828 PolarHBondContact O-N 3.48Å; V826-L829 PolarHBondContact O-N 2.84Å; V826-L829 VanDerWaalsContact O-N 3.11Å; V826-L830 WeakPolarHBondContact O-CB 3.43Å; V826-L830 PolarHBondContact O-N 3.49Å; V826-L845 HydrophobicContact CG1-CB 4.42Å; V826-L845 HydrophobicContact CG1-CD2 4.42Å; V826-L845 WeakPolarHBondContact CG1-O 3.46Å; V826-E848 HydrophobicContact CG2-CG 4.08Å; V826-K849 HydrophobicContact CG1-CB 3.86Å; V826-L852 HydrophobicContact CG2-CD1 3.94Å
827	H	76.8	Confident	73.4	Confident	82 Å²	82	76.6 Å²	76.6	38%	0.38	40%	0.401	S	S	.	.	H	α-helix	trans	-61.8	-38.6	176.3	-153.1	100.6	0	0	0	112.1	L823 L830 N831	L823-H827 VanDerWaalsContact O-CB 3.23Å; L823-H827 WeakPolarHBondContact O-CB 3.46Å; L823-H827 PolarHBondContact O-N 2.88Å; H827-L830 PolarHBondContact O-N 3.3Å; H827-N831 PolarHBondContact CD2-ND2 2.89Å; H827-N831 PolarHBondContact O-N 3.4Å; H827-N831 PolarHBondContact O-ND2 2.64Å
828	G	79	Confident	72.7	Confident	31 Å²	31	73.8 Å²	73.8	32%	0.32	39%	0.392	S	S	.	.	H	α-helix	trans	-66.8	-31.7	173.4	0	0	0	0	0	114.1	N824 R825 V826 K832	N824-G828 PolarHBondContact O-N 2.82Å; R825-G828 PolarHBondContact O-N 3.48Å; V826-G828 VanDerWaalsContact C-N 3.31Å; V826-G828 PolarHBondContact O-N 3.48Å; G828-K832 WeakPolarHBondContact O-CG 3.13Å; G828-K832 PolarHBondContact O-N 2.86Å
829	L	79.7	Confident	72	Confident	65 Å²	65	70.5 Å²	70.5	34%	0.34	39%	0.391	S	S	.	.	H	α-helix	trans	-74.2	-44.1	172.2	-68.9	174.5	0	0	0	111.7	R825 V826 N831 K832 Q833 L845	R825-L829 VanDerWaalsContact NH1-CD1 3.29Å; R825-L829 WeakPolarHBondContact O-CG 3.39Å; R825-L829 PolarHBondContact O-N 3.37Å; V826-L829 PolarHBondContact O-N 2.84Å; V826-L829 VanDerWaalsContact O-N 3.11Å; L829-N831 VanDerWaalsContact C-N 3.3Å; L829-N831 PolarHBondContact O-N 2.78Å; L829-K832 PolarHBondContact O-N 2.77Å; L829-K832 VanDerWaalsContact O-N 3.14Å; L829-Q833 WeakPolarHBondContact O-CB 3.48Å; L829-Q833 PolarHBondContact O-N 2.78Å; L829-L845 HydrophobicContact CB-CD1 3.72Å; L829-L845 HydrophobicContact CB-CD2 4.39Å; L829-L845 HydrophobicContact CD1-CD2 4.19Å
830	L	71.8	Confident	71.9	Confident	14 Å²	14	76.1 Å²	76.1	7%	0.073	42%	0.421	C	S	.	.	H	α-helix	trans	-57.8	-43.3	178.3	-159.9	86.7	0	0	0	111.3	V826 H827 Q833 K834 W842 L845 E846 K849	V826-L830 WeakPolarHBondContact O-CB 3.43Å; V826-L830 PolarHBondContact O-N 3.49Å; H827-L830 PolarHBondContact O-N 3.3Å; L830-Q833 PolarHBondContact O-N 2.77Å; L830-K834 PolarHBondContact O-N 3.29Å; L830-W842 HydrophobicContact CD1-CD2 4.48Å; L830-W842 HydrophobicContact CD1-CG 4.3Å; L830-L845 HydrophobicContact CD1-CB 3.73Å; L830-E846 HydrophobicContact CD1-CB 4.22Å; L830-E846 VanDerWaalsContact CD2-OE2 3.28Å; L830-E846 WeakPolarHBondContact CD2-OE2 3.47Å; L830-K849 HydrophobicContact CD2-CD 4.47Å
831	N	75.5	Confident	71.5	Confident	85 Å²	85	77.6 Å²	77.6	46%	0.455	43%	0.428	S	S	.	.	H	α-helix	trans	-64	-41.5	175.9	-78.6	-23.8	0	0	0	112.8	H827 L829 Q833	H827-N831 PolarHBondContact CD2-ND2 2.89Å; H827-N831 PolarHBondContact O-N 3.4Å; H827-N831 PolarHBondContact O-ND2 2.64Å; L829-N831 VanDerWaalsContact C-N 3.3Å; L829-N831 PolarHBondContact O-N 2.78Å; N831-Q833 VanDerWaalsContact C-N 3.28Å; N831-Q833 PolarHBondContact O-N 3.38Å
832	K	74.6	Confident	71.3	Confident	153 Å²	153	78.5 Å²	78.5	67%	0.665	42%	0.42	S	S	*	.	H	α-helix	trans	-65.4	-31.2	175.6	-72.6	170.7	-176.9	177.2	0	113.1	G828 L829	G828-K832 WeakPolarHBondContact O-CG 3.13Å; G828-K832 PolarHBondContact O-N 2.86Å; L829-K832 PolarHBondContact O-N 2.77Å; L829-K832 VanDerWaalsContact O-N 3.14Å
833	Q	63.5	Low	71.2	Confident	27 Å²	27	80.8 Å²	80.8	13%	0.126	43%	0.433	C	S	.	.	H	α-helix	trans	-88.2	-20.8	-174.9	-160.4	169	70.6	0	0	113.2	L829 L830 N831 D835 S836 G837 Q841 W842	L829-Q833 WeakPolarHBondContact O-CB 3.48Å; L829-Q833 PolarHBondContact O-N 2.78Å; L830-Q833 PolarHBondContact O-N 2.77Å; N831-Q833 VanDerWaalsContact C-N 3.28Å; N831-Q833 PolarHBondContact O-N 3.38Å; Q833-D835 PolarHBondContact O-N 3.34Å; Q833-S836 WeakPolarHBondContact CG-OG 3.42Å; Q833-S836 PolarHBondContact O-N 3.1Å; Q833-S836 PolarHBondContact O-OG 2.73Å; Q833-G837 PolarHBondContact O-N 2.88Å; Q833-Q841 VanDerWaalsContact CD-CB 3.49Å; Q833-Q841 PolarHBondContact OE1-O 3.18Å; Q833-W842 VanDerWaalsContact OE1-CA 3.3Å
834	K	62.3	Low	71.4	Confident	160 Å²	160	86.5 Å²	86.5	70%	0.696	46%	0.457	S	S	*	.	H	α-helix	trans	-56.2	-29.3	168.6	-161.5	175.5	-176	179.5	0	112.3	L830	L830-K834 PolarHBondContact O-N 3.29Å
835	D	63.8	Low	71.3	Confident	148 Å²	148	82 Å²	82	79%	0.791	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-14.6	175.9	-62.1	-23.6	0	0	0	113.7	Q833	Q833-D835 PolarHBondContact O-N 3.34Å
836	S	60.2	Low	71	Confident	66 Å²	66	79.2 Å²	79.2	46%	0.462	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-6.5	-172.3	76.2	0	0	0	0	115.3	Q833 V838	Q833-S836 WeakPolarHBondContact CG-OG 3.42Å; Q833-S836 PolarHBondContact O-N 3.1Å; Q833-S836 PolarHBondContact O-OG 2.73Å; S836-V838 VanDerWaalsContact C-N 3.31Å; S836-V838 PolarHBondContact O-N 2.89Å
837	G	58.6	Low	71.1	Confident	74 Å²	74	82 Å²	82	76%	0.763	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	15	168.9	0	0	0	0	0	117.1	Q833	Q833-G837 PolarHBondContact O-N 2.88Å
838	V	59.9	Low	71.3	Confident	69 Å²	69	81.3 Å²	81.3	42%	0.418	44%	0.444	S	S	.	.			trans	-97.3	100.8	-178.9	-177.1	0	0	0	0	110.5	S836 Q841 W842	S836-V838 VanDerWaalsContact C-N 3.31Å; S836-V838 PolarHBondContact O-N 2.89Å; V838-Q841 HydrophobicContact CG1-CB 4.38Å; V838-Q841 HydrophobicContact CG1-CG 4.08Å; V838-W842 PolarHBondContact O-N 3.16Å
839	S	64.2	Low	71.4	Confident	73 Å²	73	81.7 Å²	81.7	51%	0.51	44%	0.436	S	S	.	.	H	α-helix	trans	-59.8	-50.6	-175	-157.3	0	0	0	0	113.5	Q841 W842 D843	S839-Q841 PolarHBondContact O-N 2.79Å; S839-W842 WeakPolarHBondContact O-CA 3.48Å; S839-W842 WeakPolarHBondContact O-CB 3.3Å; S839-W842 PolarHBondContact O-N 3.01Å; S839-D843 PolarHBondContact O-N 2.89Å
840	D	70.3	Confident	71.4	Confident	119 Å²	119	82.3 Å²	82.3	64%	0.636	44%	0.44	S	S	*	.	H	α-helix	trans	-60.9	-23.5	-171.5	-60.7	7.6	0	0	0	114.8	K844	D840-K844 WeakPolarHBondContact O-CG 3.34Å
841	Q	67.1	Low	71.9	Confident	106 Å²	106	85 Å²	85	50%	0.495	46%	0.459	S	S	.	.	H	α-helix	trans	-87.7	-32.4	174.4	-64.8	-173	-20.3	0	0	111.6	Q833 V838 S839 K844 L845	Q833-Q841 VanDerWaalsContact CD-CB 3.49Å; Q833-Q841 PolarHBondContact OE1-O 3.18Å; V838-Q841 HydrophobicContact CG1-CB 4.38Å; V838-Q841 HydrophobicContact CG1-CG 4.08Å; S839-Q841 PolarHBondContact O-N 2.79Å; Q841-K844 PolarHBondContact O-N 2.89Å; Q841-L845 PolarHBondContact O-N 2.8Å
842	W	75.2	Confident	72	Confident	97 Å²	97	81.8 Å²	81.8	37%	0.367	44%	0.442	S	S	.	.	H	α-helix	trans	-64.6	-45.2	176.7	-171	88.2	0	0	0	110.6	L830 Q833 V838 S839 K844 L845 E846	L830-W842 HydrophobicContact CD1-CD2 4.48Å; L830-W842 HydrophobicContact CD1-CG 4.3Å; Q833-W842 VanDerWaalsContact OE1-CA 3.3Å; V838-W842 PolarHBondContact O-N 3.16Å; S839-W842 WeakPolarHBondContact O-CA 3.48Å; S839-W842 WeakPolarHBondContact O-CB 3.3Å; S839-W842 PolarHBondContact O-N 3.01Å; W842-K844 VanDerWaalsContact C-N 3.27Å; W842-K844 PolarHBondContact O-N 3.07Å; W842-L845 PolarHBondContact O-N 3.31Å; W842-E846 HydrophobicContact CE3-CB 4.37Å; W842-E846 HydrophobicContact CH2-CB 4.35Å; W842-E846 HydrophobicContact CH2-CG 3.99Å; W842-E846 HydrophobicContact CZ2-CG 4.48Å; W842-E846 HydrophobicContact CZ3-CB 4.22Å; W842-E846 HydrophobicContact CZ3-CG 4.17Å; W842-E846 WeakPolarHBondContact O-CB 3.39Å; W842-E846 PolarHBondContact O-N 3.06Å
843	D	76.1	Confident	72.1	Confident	85 Å²	85	77.6 Å²	77.6	46%	0.455	43%	0.427	S	S	.	.	H	α-helix	trans	-60.3	-35.9	176.8	-65.7	-40	0	0	0	112.3	S839 A847	S839-D843 PolarHBondContact O-N 2.89Å; D843-A847 VanDerWaalsContact O-CB 3.32Å; D843-A847 WeakPolarHBondContact O-CB 3.44Å; D843-A847 PolarHBondContact O-N 2.82Å
844	K	79.3	Confident	72.8	Confident	153 Å²	153	83 Å²	83	67%	0.665	45%	0.452	S	S	*	.	H	α-helix	trans	-69.4	-44.4	175.6	-73.5	177.2	-177.7	177.3	0	112.6	D840 Q841 W842 A847 E848	D840-K844 WeakPolarHBondContact O-CG 3.34Å; Q841-K844 PolarHBondContact O-N 2.89Å; W842-K844 VanDerWaalsContact C-N 3.27Å; W842-K844 PolarHBondContact O-N 3.07Å; K844-A847 PolarHBondContact O-N 3.17Å; K844-E848 WeakPolarHBondContact O-CB 3.27Å; K844-E848 PolarHBondContact O-N 3.29Å
845	L	77.1	Confident	73.6	Confident	20 Å²	20	78.8 Å²	78.8	11%	0.105	43%	0.434	C	S	.	.	H	α-helix	trans	-70	-35.1	178.5	-71.5	179.4	0	0	0	112.2	V826 L829 L830 Q841 W842 E848 K849	V826-L845 HydrophobicContact CG1-CB 4.42Å; V826-L845 HydrophobicContact CG1-CD2 4.42Å; V826-L845 WeakPolarHBondContact CG1-O 3.46Å; L829-L845 HydrophobicContact CB-CD1 3.72Å; L829-L845 HydrophobicContact CB-CD2 4.39Å; L829-L845 HydrophobicContact CD1-CD2 4.19Å; L830-L845 HydrophobicContact CD1-CB 3.73Å; Q841-L845 PolarHBondContact O-N 2.8Å; W842-L845 PolarHBondContact O-N 3.31Å; L845-E848 PolarHBondContact O-N 2.86Å; L845-K849 VanDerWaalsContact O-CB 3.29Å; L845-K849 WeakPolarHBondContact O-CB 3.4Å; L845-K849 PolarHBondContact O-N 3.01Å
846	E	78.9	Confident	74.1	Confident	36 Å²	36	72.3 Å²	72.3	17%	0.168	40%	0.4	C	S	.	.	H	α-helix	trans	-69.5	-36.3	175	-172.2	62.4	-156.9	0	0	111	L830 W842 K849 N850	L830-E846 HydrophobicContact CD1-CB 4.22Å; L830-E846 VanDerWaalsContact CD2-OE2 3.28Å; L830-E846 WeakPolarHBondContact CD2-OE2 3.47Å; W842-E846 HydrophobicContact CE3-CB 4.37Å; W842-E846 HydrophobicContact CH2-CB 4.35Å; W842-E846 HydrophobicContact CH2-CG 3.99Å; W842-E846 HydrophobicContact CZ2-CG 4.48Å; W842-E846 HydrophobicContact CZ3-CB 4.22Å; W842-E846 HydrophobicContact CZ3-CG 4.17Å; W842-E846 WeakPolarHBondContact O-CB 3.39Å; W842-E846 PolarHBondContact O-N 3.06Å; E846-K849 IonicContact OE1-NZ 3.34Å; E846-K849 PolarHBondContact OE1-NZ 2.97Å; E846-K849 WeakPolarHBondContact OE2-CD 3.32Å; E846-K849 IonicContact OE2-NZ 3.54Å; E846-K849 PolarHBondContact OE2-NZ 3.47Å; E846-N850 WeakPolarHBondContact O-CB 3.35Å; E846-N850 VanDerWaalsContact O-CG 3.22Å; E846-N850 PolarHBondContact O-N 3.36Å; E846-N850 PolarHBondContact O-ND2 2.9Å
847	A	79.7	Confident	74.8	Confident	59 Å²	59	72.6 Å²	72.6	49%	0.488	40%	0.396	S	S	.	.	H	α-helix	trans	-65.2	-43.6	170.2	0	0	0	0	0	112.8	D843 K844 N850 C851	D843-A847 VanDerWaalsContact O-CB 3.32Å; D843-A847 WeakPolarHBondContact O-CB 3.44Å; D843-A847 PolarHBondContact O-N 2.82Å; K844-A847 PolarHBondContact O-N 3.17Å; A847-N850 PolarHBondContact O-N 3.09Å; A847-C851 WeakPolarHBondContact O-CB 3.49Å; A847-C851 PolarHBondContact O-N 2.89Å
848	E	81.2	Confident	75.6	Confident	68 Å²	68	73 Å²	73	32%	0.318	38%	0.384	S	S	.	.	H	α-helix	trans	-60.1	-46.5	175.1	-171.1	-179.7	177.9	0	0	111	R825 V826 K844 L845 N850 C851 L852	R825-E848 IonicContact CZ-OE1 2.65Å; R825-E848 IonicContact NH2-OE1 2.7Å; R825-E848 PolarHBondContact NH2-OE1 3.45Å; V826-E848 HydrophobicContact CG2-CG 4.08Å; K844-E848 WeakPolarHBondContact O-CB 3.27Å; K844-E848 PolarHBondContact O-N 3.29Å; L845-E848 PolarHBondContact O-N 2.86Å; E848-N850 PolarHBondContact O-N 2.86Å; E848-C851 PolarHBondContact O-N 2.83Å; E848-L852 HydrophobicContact CG-CD1 4.33Å; E848-L852 WeakPolarHBondContact O-CG 3.48Å; E848-L852 PolarHBondContact O-N 2.81Å
849	K	79.7	Confident	76.1	Confident	38 Å²	38	71 Å²	71	17%	0.165	37%	0.371	C	S	.	.	H	α-helix	trans	-56.8	-48.9	174	170.6	-173.1	154.9	-140.4	0	112.1	V826 L830 L845 E846 L852 L853	V826-K849 HydrophobicContact CG1-CB 3.86Å; L830-K849 HydrophobicContact CD2-CD 4.47Å; L845-K849 VanDerWaalsContact O-CB 3.29Å; L845-K849 WeakPolarHBondContact O-CB 3.4Å; L845-K849 PolarHBondContact O-N 3.01Å; E846-K849 IonicContact OE1-NZ 3.34Å; E846-K849 PolarHBondContact OE1-NZ 2.97Å; E846-K849 WeakPolarHBondContact OE2-CD 3.32Å; E846-K849 IonicContact OE2-NZ 3.54Å; E846-K849 PolarHBondContact OE2-NZ 3.47Å; K849-L852 PolarHBondContact O-N 2.98Å; K849-L853 WeakPolarHBondContact O-CB 3.34Å; K849-L853 PolarHBondContact O-N 3.41Å
850	N	80.9	Confident	76.6	Confident	78 Å²	78	73.1 Å²	73.1	42%	0.417	37%	0.368	S	S	.	.	H	α-helix	trans	-65.6	-39.2	-177.5	-72.4	-31.1	0	0	0	112	E846 A847 E848 L853 E854	E846-N850 WeakPolarHBondContact O-CB 3.35Å; E846-N850 VanDerWaalsContact O-CG 3.22Å; E846-N850 PolarHBondContact O-N 3.36Å; E846-N850 PolarHBondContact O-ND2 2.9Å; A847-N850 PolarHBondContact O-N 3.09Å; E848-N850 PolarHBondContact O-N 2.86Å; N850-L853 PolarHBondContact O-N 3.32Å; N850-E854 PolarHBondContact O-N 3.38Å
851	C	81.3	Confident	76.8	Confident	71 Å²	71	71.2 Å²	71.2	48%	0.48	36%	0.357	S	S	.	.	H	α-helix	trans	-61.7	-46.9	174.2	-167	0	0	0	0	112	A847 E848 L853 E854 E855	A847-C851 WeakPolarHBondContact O-CB 3.49Å; A847-C851 PolarHBondContact O-N 2.89Å; E848-C851 PolarHBondContact O-N 2.83Å; C851-L853 VanDerWaalsContact C-N 3.26Å; C851-L853 PolarHBondContact O-N 3.2Å; C851-E854 PolarHBondContact O-N 3.02Å; C851-E855 PolarHBondContact O-N 2.82Å
852	L	77.2	Confident	77	Confident	17 Å²	17	71.4 Å²	71.4	9%	0.089	36%	0.359	C	S	.	.	H	α-helix	trans	-62.4	-32.6	174.8	-68.6	169	0	0	0	112.4	L819 E822 L823 V826 E848 K849 L856	L819-L852 HydrophobicContact CD2-CD2 3.76Å; E822-L852 HydrophobicContact CB-CD1 4.48Å; E822-L852 HydrophobicContact CG-CD1 3.88Å; E822-L852 HydrophobicContact CG-CD2 4.25Å; L823-L852 HydrophobicContact CD1-CB 3.9Å; V826-L852 HydrophobicContact CG2-CD1 3.94Å; E848-L852 HydrophobicContact CG-CD1 4.33Å; E848-L852 WeakPolarHBondContact O-CG 3.48Å; E848-L852 PolarHBondContact O-N 2.81Å; K849-L852 PolarHBondContact O-N 2.98Å; L852-L856 WeakPolarHBondContact O-CB 3.16Å; L852-L856 PolarHBondContact O-N 3.08Å
853	L	77.2	Confident	76.7	Confident	66 Å²	66	69 Å²	69	35%	0.346	35%	0.352	S	S	.	.	H	α-helix	trans	-73.1	-34.1	178.5	-141.4	138.2	0	0	0	111.9	L823 K849 N850 C851 N857	L823-L853 HydrophobicContact CD1-CB 4.3Å; L823-L853 HydrophobicContact CD1-CD1 4.26Å; L823-L853 HydrophobicContact CD1-CG 4.36Å; K849-L853 WeakPolarHBondContact O-CB 3.34Å; K849-L853 PolarHBondContact O-N 3.41Å; N850-L853 PolarHBondContact O-N 3.32Å; C851-L853 VanDerWaalsContact C-N 3.26Å; C851-L853 PolarHBondContact O-N 3.2Å; L853-N857 WeakPolarHBondContact O-CB 3.16Å; L853-N857 VanDerWaalsContact O-CG 3.25Å; L853-N857 PolarHBondContact O-N 3.44Å; L853-N857 PolarHBondContact O-ND2 2.72Å
854	E	79.1	Confident	76.6	Confident	141 Å²	141	71.5 Å²	71.5	66%	0.659	36%	0.356	S	S	*	.	H	α-helix	trans	-67.1	-44.1	169.3	-80.5	-174.4	145.6	0	0	112.4	N850 C851 L856 N857 T858	N850-E854 PolarHBondContact O-N 3.38Å; C851-E854 PolarHBondContact O-N 3.02Å; E854-L856 VanDerWaalsContact C-N 3.35Å; E854-L856 PolarHBondContact O-N 2.83Å; E854-N857 PolarHBondContact O-N 3.41Å; E854-T858 PolarHBondContact O-N 3.29Å; E854-T858 PolarHBondContact O-OG1 2.88Å
855	E	78.4	Confident	76.1	Confident	70 Å²	70	70 Å²	70	33%	0.327	35%	0.351	S	S	.	.	H	α-helix	trans	-60.1	-42.9	173.5	-79.2	-162.4	-146.3	0	0	112.1	R815 L819 C851 T858 L859	R815-E855 IonicContact NH2-OE2 2.88Å; R815-E855 PolarHBondContact NH2-OE2 3.47Å; L819-E855 HydrophobicContact CD1-CB 4.26Å; L819-E855 HydrophobicContact CD2-CB 4.33Å; C851-E855 PolarHBondContact O-N 2.82Å; E855-T858 WeakPolarHBondContact CA-OG1 3.45Å; E855-T858 PolarHBondContact O-OG1 3.04Å; E855-T858 VanDerWaalsContact O-OG1 3.07Å; E855-L859 WeakPolarHBondContact O-CB 3.21Å; E855-L859 WeakPolarHBondContact O-CG 3.14Å; E855-L859 PolarHBondContact O-N 3.45Å
856	L	73.5	Confident	75.5	Confident	13 Å²	13	72.7 Å²	72.7	7%	0.068	36%	0.363	C	S	.	.	H	α-helix	trans	-67.6	-41.2	179.9	-157	165.9	0	0	0	111.2	L819 E820 L852 E854 R860	L819-L856 HydrophobicContact CB-CD1 4.26Å; L819-L856 HydrophobicContact CB-CG 4.38Å; L819-L856 HydrophobicContact CD1-CB 4.35Å; E820-L856 HydrophobicContact CG-CD1 4.01Å; L852-L856 WeakPolarHBondContact O-CB 3.16Å; L852-L856 PolarHBondContact O-N 3.08Å; E854-L856 VanDerWaalsContact C-N 3.35Å; E854-L856 PolarHBondContact O-N 2.83Å; L856-R860 WeakPolarHBondContact O-CB 3.31Å; L856-R860 PolarHBondContact O-N 3.32Å
857	N	76.1	Confident	74.9	Confident	72 Å²	72	72.2 Å²	72.2	39%	0.385	37%	0.367	S	S	.	.	H	α-helix	trans	-65.7	-45.2	176	-75.7	-26.7	0	0	0	112.2	L853 E854 L859 R860 D861	L853-N857 WeakPolarHBondContact O-CB 3.16Å; L853-N857 VanDerWaalsContact O-CG 3.25Å; L853-N857 PolarHBondContact O-N 3.44Å; L853-N857 PolarHBondContact O-ND2 2.72Å; E854-N857 PolarHBondContact O-N 3.41Å; N857-L859 PolarHBondContact O-N 3.34Å; N857-R860 PolarHBondContact O-N 2.67Å; N857-R860 VanDerWaalsContact O-N 3.15Å; N857-D861 PolarHBondContact O-N 2.91Å
858	T	75.9	Confident	74.4	Confident	83 Å²	83	73 Å²	73	51%	0.509	36%	0.363	S	S	.	.	H	α-helix	trans	-62.4	-41.4	177.6	40.2	0	0	0	0	112.6	E854 E855 D861 Q862	E854-T858 PolarHBondContact O-N 3.29Å; E854-T858 PolarHBondContact O-OG1 2.88Å; E855-T858 WeakPolarHBondContact CA-OG1 3.45Å; E855-T858 PolarHBondContact O-OG1 3.04Å; E855-T858 VanDerWaalsContact O-OG1 3.07Å; T858-D861 PolarHBondContact O-N 2.76Å; T858-Q862 WeakPolarHBondContact O-CG 3.42Å; T858-Q862 PolarHBondContact O-N 3.04Å
859	L	70.3	Confident	73.6	Confident	26 Å²	26	74.2 Å²	74.2	14%	0.136	37%	0.368	C	S	.	.	H	α-helix	trans	-66.2	-36	172.8	-76.9	164.1	0	0	0	112.9	R815 L819 E855 N857 D861 Q862 L863	R815-L859 HydrophobicContact CG-CD1 4Å; L819-L859 HydrophobicContact CD1-CD1 3.38Å; E855-L859 WeakPolarHBondContact O-CB 3.21Å; E855-L859 WeakPolarHBondContact O-CG 3.14Å; E855-L859 PolarHBondContact O-N 3.45Å; N857-L859 PolarHBondContact O-N 3.34Å; L859-D861 VanDerWaalsContact C-N 3.34Å; L859-Q862 PolarHBondContact O-N 3.02Å; L859-L863 WeakPolarHBondContact O-CB 3.35Å; L859-L863 PolarHBondContact O-N 3.41Å
860	R	75	Confident	73	Confident	117 Å²	117	81.3 Å²	81.3	44%	0.442	39%	0.393	S	S	.	.	H	α-helix	trans	-69.3	-32.8	177.2	-175.6	176.8	-79.4	164.9	-6.6	112	E820 L856 N857 R864	E820-R860 IonicContact OE1-NH2 3.93Å; L856-R860 WeakPolarHBondContact O-CB 3.31Å; L856-R860 PolarHBondContact O-N 3.32Å; N857-R860 PolarHBondContact O-N 2.67Å; N857-R860 VanDerWaalsContact O-N 3.15Å; R860-R864 WeakPolarHBondContact O-CB 3.31Å; R860-R864 PolarHBondContact O-N 3.28Å
861	D	74.1	Confident	72.4	Confident	79 Å²	79	84.9 Å²	84.9	42%	0.422	40%	0.401	S	S	.	.	H	α-helix	trans	-75.9	-39.4	173.8	-72.1	-27.4	0	0	0	112	N857 T858 L859 L863 R864 E865	N857-D861 PolarHBondContact O-N 2.91Å; T858-D861 PolarHBondContact O-N 2.76Å; L859-D861 VanDerWaalsContact C-N 3.34Å; D861-L863 VanDerWaalsContact C-N 3.34Å; D861-L863 PolarHBondContact O-N 3.49Å; D861-R864 WeakPolarHBondContact O-CA 3.49Å; D861-R864 VanDerWaalsContact O-CB 3.32Å; D861-R864 WeakPolarHBondContact O-CB 3.26Å; D861-R864 PolarHBondContact O-N 3.12Å; D861-R864 VanDerWaalsContact O-N 3.1Å; D861-R864 IonicContact OD1-NE 3.91Å; D861-R864 IonicContact OD1-NH2 2.95Å; D861-E865 PolarHBondContact O-N 2.91Å
862	Q	70.9	Confident	72.1	Confident	111 Å²	111	86.9 Å²	86.9	52%	0.519	40%	0.398	S	S	.	.	H	α-helix	trans	-58.1	-45	168.9	-73.4	172.9	-5.3	0	0	112	T858 L859 R864 E865 E866	T858-Q862 WeakPolarHBondContact O-CG 3.42Å; T858-Q862 PolarHBondContact O-N 3.04Å; L859-Q862 PolarHBondContact O-N 3.02Å; Q862-R864 VanDerWaalsContact C-N 3.26Å; Q862-R864 PolarHBondContact O-N 3.05Å; Q862-E865 PolarHBondContact O-N 3.41Å; Q862-E866 PolarHBondContact O-N 3.06Å
863	L	69.2	Low	71.3	Confident	45 Å²	45	90.7 Å²	90.7	24%	0.236	41%	0.412	C	S	.	.	H	α-helix	trans	-65.2	-30.2	176.3	-172.9	65.9	0	0	0	112.3	L809 C812 I816 L859 D861 G867	L809-L863 HydrophobicContact CD2-CD1 3.54Å; C812-L863 HydrophobicContact CB-CD1 4.47Å; I816-L863 HydrophobicContact CD1-CD2 3.8Å; L859-L863 WeakPolarHBondContact O-CB 3.35Å; L859-L863 PolarHBondContact O-N 3.41Å; D861-L863 VanDerWaalsContact C-N 3.34Å; D861-L863 PolarHBondContact O-N 3.49Å; L863-G867 PolarHBondContact O-N 2.93Å
864	R	73.2	Confident	70.8	Confident	139 Å²	139	91.8 Å²	91.8	53%	0.525	42%	0.416	S	S	.	.	H	α-helix	trans	-68.1	-47.1	172.8	-173	-167.2	-55.8	-80.7	-1.4	110.8	R860 D861 Q862 G867 D868	R860-R864 WeakPolarHBondContact O-CB 3.31Å; R860-R864 PolarHBondContact O-N 3.28Å; D861-R864 WeakPolarHBondContact O-CA 3.49Å; D861-R864 VanDerWaalsContact O-CB 3.32Å; D861-R864 WeakPolarHBondContact O-CB 3.26Å; D861-R864 PolarHBondContact O-N 3.12Å; D861-R864 VanDerWaalsContact O-N 3.1Å; D861-R864 IonicContact OD1-NE 3.91Å; D861-R864 IonicContact OD1-NH2 2.95Å; Q862-R864 VanDerWaalsContact C-N 3.26Å; Q862-R864 PolarHBondContact O-N 3.05Å; R864-G867 CarbonylContact O-C 3.48Å; R864-G867 WeakPolarHBondContact O-CA 3.39Å; R864-G867 PolarHBondContact O-N 2.86Å; R864-G867 VanDerWaalsContact O-N 3.14Å; R864-D868 PolarHBondContact O-N 2.77Å
865	E	69.6	Low	70.6	Confident	120 Å²	120	86.7 Å²	86.7	56%	0.561	40%	0.401	S	S	*	.	H	α-helix	trans	-59.6	-45.5	176.3	-72.1	-176.2	177.3	0	0	112	D861 Q862 G867 D868 K869	D861-E865 PolarHBondContact O-N 2.91Å; Q862-E865 PolarHBondContact O-N 3.41Å; E865-G867 VanDerWaalsContact C-N 3.32Å; E865-G867 PolarHBondContact O-N 3.49Å; E865-D868 PolarHBondContact O-N 2.82Å; E865-K869 WeakPolarHBondContact O-CG 3.49Å; E865-K869 PolarHBondContact O-N 3.39Å
866	E	63.1	Low	70.3	Confident	78 Å²	78	85.2 Å²	85.2	36%	0.364	39%	0.394	S	S	.	.	H	α-helix	trans	-65	-35.9	173.8	-68.5	-52.8	138.1	0	0	112.3	Q862 D868 K869 R870	Q862-E866 PolarHBondContact O-N 3.06Å; E866-D868 VanDerWaalsContact C-N 3.33Å; E866-D868 PolarHBondContact O-N 2.74Å; E866-K869 PolarHBondContact O-N 2.84Å; E866-K869 IonicContact OE1-NZ 3.27Å; E866-K869 PolarHBondContact OE1-NZ 3.17Å; E866-R870 WeakPolarHBondContact O-CB 3.46Å; E866-R870 PolarHBondContact O-N 2.85Å
867	G	67.4	Low	70	Confident	25 Å²	25	91.3 Å²	91.3	26%	0.258	42%	0.42	S	S	.	.	H	α-helix	trans	-62.4	-37.5	171.2	0	0	0	0	0	113.2	L863 R864 E865 R871	L863-G867 PolarHBondContact O-N 2.93Å; R864-G867 CarbonylContact O-C 3.48Å; R864-G867 WeakPolarHBondContact O-CA 3.39Å; R864-G867 PolarHBondContact O-N 2.86Å; R864-G867 VanDerWaalsContact O-N 3.14Å; E865-G867 VanDerWaalsContact C-N 3.32Å; E865-G867 PolarHBondContact O-N 3.49Å; G867-R871 WeakPolarHBondContact O-CG 3.32Å; G867-R871 PolarHBondContact O-N 3.47Å
868	D	69	Low	69.9	Low	75 Å²	75	92.5 Å²	92.5	40%	0.401	42%	0.424	S	S	.	.	H	α-helix	trans	-74.2	-41	176	-78.6	-42.7	0	0	0	112.4	R864 E865 E866 R870 R871 W872	R864-D868 PolarHBondContact O-N 2.77Å; E865-D868 PolarHBondContact O-N 2.82Å; E866-D868 VanDerWaalsContact C-N 3.33Å; E866-D868 PolarHBondContact O-N 2.74Å; D868-R870 VanDerWaalsContact C-N 3.32Å; D868-R870 PolarHBondContact O-N 2.9Å; D868-R871 VanDerWaalsContact CG-NH2 3.3Å; D868-R871 PolarHBondContact O-N 3.43Å; D868-R871 IonicContact OD1-CZ 2.75Å; D868-R871 IonicContact OD1-NE 2.73Å; D868-R871 PolarHBondContact OD1-NE 2.94Å; D868-R871 IonicContact OD1-NH2 3.75Å; D868-R871 PolarHBondContact OD1-NH2 3.42Å; D868-R871 IonicContact OD2-NH2 3.77Å; D868-W872 WeakPolarHBondContact O-CB 3.47Å; D868-W872 PolarHBondContact O-N 2.87Å
869	K	65.4	Low	69.8	Low	95 Å²	95	92.4 Å²	92.4	41%	0.413	41%	0.414	S	S	.	.	H	α-helix	trans	-56.3	-46.9	169.1	-70.7	172.3	-169.6	171	0	110.8	E865 E866 R871 W872 Y873	E865-K869 WeakPolarHBondContact O-CG 3.49Å; E865-K869 PolarHBondContact O-N 3.39Å; E866-K869 PolarHBondContact O-N 2.84Å; E866-K869 IonicContact OE1-NZ 3.27Å; E866-K869 PolarHBondContact OE1-NZ 3.17Å; K869-R871 PolarHBondContact O-N 3.3Å; K869-W872 WeakPolarHBondContact O-CB 3.47Å; K869-W872 PolarHBondContact O-N 3.41Å; K869-Y873 HydrophobicContact CB-CE2 4.48Å; K869-Y873 WeakPolarHBondContact O-CD2 3.45Å; K869-Y873 PolarHBondContact O-N 3.48Å
870	R	65.5	Low	69.8	Low	187 Å²	187	93.6 Å²	93.6	71%	0.706	42%	0.419	S	S	*	.	H	α-helix	trans	-61.3	-42.5	176.5	-176.1	-177.9	174	-157.8	-2.6	112.4	E866 D868 W872 Q874	E866-R870 WeakPolarHBondContact O-CB 3.46Å; E866-R870 PolarHBondContact O-N 2.85Å; D868-R870 VanDerWaalsContact C-N 3.32Å; D868-R870 PolarHBondContact O-N 2.9Å; R870-W872 VanDerWaalsContact C-N 3.34Å; R870-Q874 WeakPolarHBondContact O-CB 3.48Å; R870-Q874 PolarHBondContact O-N 3.23Å
871	R	70	Confident	69.7	Low	152 Å²	152	90.6 Å²	90.6	57%	0.574	42%	0.416	S	S	*	.	H	α-helix	trans	-60.9	-42.9	173.8	-81.8	-173.1	-81.2	-98.2	3.5	111.5	G867 D868 K869 Q874 G875	G867-R871 WeakPolarHBondContact O-CG 3.32Å; G867-R871 PolarHBondContact O-N 3.47Å; D868-R871 VanDerWaalsContact CG-NH2 3.3Å; D868-R871 PolarHBondContact O-N 3.43Å; D868-R871 IonicContact OD1-CZ 2.75Å; D868-R871 IonicContact OD1-NE 2.73Å; D868-R871 PolarHBondContact OD1-NE 2.94Å; D868-R871 IonicContact OD1-NH2 3.75Å; D868-R871 PolarHBondContact OD1-NH2 3.42Å; D868-R871 IonicContact OD2-NH2 3.77Å; K869-R871 PolarHBondContact O-N 3.3Å; R871-Q874 PolarHBondContact O-N 3.11Å; R871-G875 PolarHBondContact O-N 3.43Å
872	W	73.4	Confident	70	Confident	113 Å²	113	91.4 Å²	91.4	43%	0.428	42%	0.42	S	S	.	.	H	α-helix	trans	-63.2	-50	178	-176.6	84.8	0	0	0	112	D868 K869 R870 Q874 G875 E876 W927 Y928	D868-W872 WeakPolarHBondContact O-CB 3.47Å; D868-W872 PolarHBondContact O-N 2.87Å; K869-W872 WeakPolarHBondContact O-CB 3.47Å; K869-W872 PolarHBondContact O-N 3.41Å; R870-W872 VanDerWaalsContact C-N 3.34Å; W872-Q874 VanDerWaalsContact C-N 3.31Å; W872-Q874 PolarHBondContact O-N 3.06Å; W872-G875 PolarHBondContact O-N 3.18Å; W872-G875 VanDerWaalsContact O-N 3.13Å; W872-E876 HydrophobicContact CD2-CG 4.4Å; W872-E876 HydrophobicContact CH2-CG 4.4Å; W872-E876 HydrophobicContact CZ2-CG 4Å; W872-E876 PolarHBondContact O-N 3.08Å; W872-W927 HydrophobicContact CH2-CH2 4.38Å; W872-W927 HydrophobicContact CH2-CZ3 4.18Å; W872-Y928 AromaticContact CH2-CE1 3.81Å; W872-Y928 HydrophobicContact CH2-CE1 3.81Å; W872-Y928 AromaticContact CH2-CZ 3.98Å; W872-Y928 VanDerWaalsContact CH2-OH 3.3Å; W872-Y928 WeakPolarHBondContact CH2-OH 3.32Å; W872-Y928 HydrophobicContact CZ3-CE1 4.13Å
873	Y	60.7	Low	70.2	Confident	97 Å²	97	87.8 Å²	87.8	38%	0.38	40%	0.403	S	S	.	.	H	α-helix	trans	-59.4	-39.4	175.4	-77.4	-61.4	0	0	0	112.9	K869 K877	K869-Y873 HydrophobicContact CB-CE2 4.48Å; K869-Y873 WeakPolarHBondContact O-CD2 3.45Å; K869-Y873 PolarHBondContact O-N 3.48Å; Y873-K877 WeakPolarHBondContact O-CB 3.42Å; Y873-K877 PolarHBondContact O-N 3.24Å
874	Q	67.6	Low	70.5	Confident	89 Å²	89	88.8 Å²	88.8	42%	0.416	41%	0.414	S	S	.	.	H	α-helix	trans	-65.5	-41.5	175.2	-179.9	61.9	27.9	0	0	111.5	R870 R871 W872 K877 E878	R870-Q874 WeakPolarHBondContact O-CB 3.48Å; R870-Q874 PolarHBondContact O-N 3.23Å; R871-Q874 PolarHBondContact O-N 3.11Å; W872-Q874 VanDerWaalsContact C-N 3.31Å; W872-Q874 PolarHBondContact O-N 3.06Å; Q874-K877 PolarHBondContact O-N 3.32Å; Q874-E878 PolarHBondContact NE2-OE1 2.73Å; Q874-E878 WeakPolarHBondContact O-CB 3.3Å; Q874-E878 WeakPolarHBondContact O-CG 3.43Å; Q874-E878 PolarHBondContact O-N 3.25Å
875	G	73.4	Confident	70.8	Confident	35 Å²	35	87.9 Å²	87.9	36%	0.361	42%	0.416	S	S	.	.	H	α-helix	trans	-64.8	-39.9	175.6	0	0	0	0	0	113.5	R871 W872 E878 Y879	R871-G875 PolarHBondContact O-N 3.43Å; W872-G875 PolarHBondContact O-N 3.18Å; W872-G875 VanDerWaalsContact O-N 3.13Å; G875-E878 PolarHBondContact O-N 3.03Å; G875-Y879 WeakPolarHBondContact O-CB 3.21Å; G875-Y879 PolarHBondContact O-N 2.83Å
876	E	72.4	Confident	71.4	Confident	38 Å²	38	85.8 Å²	85.8	18%	0.178	41%	0.409	C	S	.	.	H	α-helix	trans	-71.3	-36.3	175	-76.7	-73.8	152	0	0	111.9	W872 E878 Y879 F880 K924 Y928	W872-E876 HydrophobicContact CD2-CG 4.4Å; W872-E876 HydrophobicContact CH2-CG 4.4Å; W872-E876 HydrophobicContact CZ2-CG 4Å; W872-E876 PolarHBondContact O-N 3.08Å; E876-E878 VanDerWaalsContact C-N 3.33Å; E876-E878 PolarHBondContact O-N 2.65Å; E876-Y879 WeakPolarHBondContact O-CB 3.49Å; E876-Y879 PolarHBondContact O-N 2.81Å; E876-F880 WeakPolarHBondContact O-CD2 3.36Å; E876-F880 PolarHBondContact O-N 3.11Å; E876-K924 IonicContact OE1-NZ 3.62Å; E876-K924 PolarHBondContact OE1-NZ 3.48Å; E876-K924 VanDerWaalsContact OE1-NZ 3.16Å; E876-K924 IonicContact OE2-NZ 3.58Å; E876-K924 PolarHBondContact OE2-NZ 3.06Å; E876-Y928 VanDerWaalsContact CD-OH 3.26Å; E876-Y928 WeakPolarHBondContact CG-OH 3.42Å; E876-Y928 PolarHBondContact OE2-OH 2.7Å
877	K	68.2	Low	72	Confident	141 Å²	141	82.7 Å²	82.7	61%	0.613	40%	0.395	S	S	*	.	H	α-helix	trans	-59.5	-43.5	169.5	178.3	-177.3	175.6	-178.3	0	111.7	Y873 Q874 F880 S881	Y873-K877 WeakPolarHBondContact O-CB 3.42Å; Y873-K877 PolarHBondContact O-N 3.24Å; Q874-K877 PolarHBondContact O-N 3.32Å; K877-F880 PolarHBondContact O-N 3.21Å; K877-S881 WeakPolarHBondContact O-CB 3.29Å; K877-S881 PolarHBondContact O-N 3.25Å
878	E	74.6	Confident	72.4	Confident	98 Å²	98	84.1 Å²	84.1	46%	0.458	40%	0.404	S	S	.	.	H	α-helix	trans	-65.1	-40.2	174.5	-75.4	170.2	-161.9	0	0	111.5	Q874 G875 E876 S881 N882	Q874-E878 PolarHBondContact NE2-OE1 2.73Å; Q874-E878 WeakPolarHBondContact O-CB 3.3Å; Q874-E878 WeakPolarHBondContact O-CG 3.43Å; Q874-E878 PolarHBondContact O-N 3.25Å; G875-E878 PolarHBondContact O-N 3.03Å; E876-E878 VanDerWaalsContact C-N 3.33Å; E876-E878 PolarHBondContact O-N 2.65Å; E878-S881 PolarHBondContact O-N 3.3Å; E878-N882 VanDerWaalsContact O-CB 3.26Å; E878-N882 WeakPolarHBondContact O-CB 3.45Å; E878-N882 PolarHBondContact O-N 2.66Å; E878-N882 PolarHBondContact O-ND2 2.9Å
879	Y	73.1	Confident	73	Confident	80 Å²	80	83.1 Å²	83.1	31%	0.314	41%	0.406	S	S	.	.	H	α-helix	trans	-56.4	-50.9	172.7	173	-88.5	0	0	0	112	G875 E876 N882 M883 K924	G875-Y879 WeakPolarHBondContact O-CB 3.21Å; G875-Y879 PolarHBondContact O-N 2.83Å; E876-Y879 WeakPolarHBondContact O-CB 3.49Å; E876-Y879 PolarHBondContact O-N 2.81Å; Y879-N882 PolarHBondContact O-N 3.08Å; Y879-M883 HydrophobicContact CE2-CE 4.06Å; Y879-M883 VanDerWaalsContact O-CB 3.3Å; Y879-M883 WeakPolarHBondContact O-CB 3.32Å; Y879-M883 PolarHBondContact O-N 3.31Å; Y879-K924 HydrophobicContact CD1-CD 4.36Å; Y879-K924 HydrophobicContact CE1-CD 3.63Å
880	F	69.7	Low	73.6	Confident	51 Å²	51	80.8 Å²	80.8	22%	0.224	40%	0.397	C	S	.	.	H	α-helix	trans	-66	-40.1	177.3	-76.1	-70.1	0	0	0	112.9	E876 K877 M883 S884 M921 K924 Y928	E876-F880 WeakPolarHBondContact O-CD2 3.36Å; E876-F880 PolarHBondContact O-N 3.11Å; K877-F880 PolarHBondContact O-N 3.21Å; F880-M883 PolarHBondContact O-N 3.13Å; F880-S884 WeakPolarHBondContact O-CB 3.36Å; F880-S884 PolarHBondContact O-N 2.86Å; F880-M921 HydrophobicContact CD1-SD 4.12Å; F880-K924 HydrophobicContact CE1-CB 4.06Å; F880-K924 HydrophobicContact CZ-CB 3.87Å; F880-K924 HydrophobicContact CZ-CD 4.27Å; F880-Y928 AromaticContact CE2-CD2 3.69Å; F880-Y928 HydrophobicContact CE2-CD2 3.69Å; F880-Y928 AromaticContact CE2-CE2 3.39Å; F880-Y928 HydrophobicContact CE2-CE2 3.39Å; F880-Y928 AromaticContact CZ-CD2 3.62Å; F880-Y928 HydrophobicContact CZ-CD2 3.62Å; F880-Y928 AromaticContact CZ-CE2 3.57Å; F880-Y928 HydrophobicContact CZ-CE2 3.57Å
881	S	73.5	Confident	74.2	Confident	55 Å²	55	76.8 Å²	76.8	39%	0.385	39%	0.389	S	S	.	.	H	α-helix	trans	-61.3	-45.8	176.6	-174.8	0	0	0	0	111.1	K877 E878 S884 Q885	K877-S881 WeakPolarHBondContact O-CB 3.29Å; K877-S881 PolarHBondContact O-N 3.25Å; E878-S881 PolarHBondContact O-N 3.3Å; S881-S884 PolarHBondContact O-N 2.94Å; S881-Q885 WeakPolarHBondContact O-CB 3.21Å; S881-Q885 VanDerWaalsContact O-CG 3.27Å; S881-Q885 WeakPolarHBondContact O-CG 3.37Å; S881-Q885 PolarHBondContact O-N 3.46Å
882	N	80.3	Confident	74.5	Confident	96 Å²	96	75.6 Å²	75.6	51%	0.513	39%	0.39	S	S	.	.	H	α-helix	trans	-67.7	-43.1	179	-67.2	-19.3	0	0	0	111.5	E878 Y879 S884 Q885 D886	E878-N882 VanDerWaalsContact O-CB 3.26Å; E878-N882 WeakPolarHBondContact O-CB 3.45Å; E878-N882 PolarHBondContact O-N 2.66Å; E878-N882 PolarHBondContact O-ND2 2.9Å; Y879-N882 PolarHBondContact O-N 3.08Å; N882-S884 PolarHBondContact O-N 2.8Å; N882-Q885 PolarHBondContact O-N 2.93Å; N882-D886 WeakPolarHBondContact O-CB 3.39Å; N882-D886 PolarHBondContact O-N 3.3Å
883	M	75.9	Confident	74.6	Confident	34 Å²	34	73.5 Å²	73.5	17%	0.167	39%	0.392	C	S	.	.	H	α-helix	trans	-64.9	-38.5	177	-169.4	65.8	67.9	0	0	112.1	Y879 F880 L887 M921	Y879-M883 HydrophobicContact CE2-CE 4.06Å; Y879-M883 VanDerWaalsContact O-CB 3.3Å; Y879-M883 WeakPolarHBondContact O-CB 3.32Å; Y879-M883 PolarHBondContact O-N 3.31Å; F880-M883 PolarHBondContact O-N 3.13Å; M883-L887 HydrophobicContact CG-CD1 4.25Å; M883-L887 WeakPolarHBondContact O-CB 3.42Å; M883-L887 WeakPolarHBondContact O-CG 3.26Å; M883-L887 PolarHBondContact O-N 2.92Å; M883-M921 HydrophobicContact CB-SD 3.91Å; M883-M921 HydrophobicContact CG-CG 3.61Å; M883-M921 HydrophobicContact CG-SD 3.59Å; M883-M921 VanDerWaalsContact CG-SD 3.59Å
884	S	74.6	Confident	75.2	Confident	66 Å²	66	70.2 Å²	70.2	46%	0.462	38%	0.381	S	S	.	.	H	α-helix	trans	-65.9	-43.9	174.6	-175.7	0	0	0	0	111.8	F880 S881 N882 A888	F880-S884 WeakPolarHBondContact O-CB 3.36Å; F880-S884 PolarHBondContact O-N 2.86Å; S881-S884 PolarHBondContact O-N 2.94Å; N882-S884 PolarHBondContact O-N 2.8Å; S884-A888 VanDerWaalsContact O-CB 3.3Å; S884-A888 WeakPolarHBondContact O-CB 3.39Å; S884-A888 PolarHBondContact O-N 2.92Å
885	Q	80.4	Confident	75.5	Confident	121 Å²	121	74 Å²	74	57%	0.565	39%	0.391	S	S	*	.	H	α-helix	trans	-65.6	-40	175	-73.6	175.6	12.7	0	0	112.4	S881 N882 A888 A889	S881-Q885 WeakPolarHBondContact O-CB 3.21Å; S881-Q885 VanDerWaalsContact O-CG 3.27Å; S881-Q885 WeakPolarHBondContact O-CG 3.37Å; S881-Q885 PolarHBondContact O-N 3.46Å; N882-Q885 PolarHBondContact O-N 2.93Å; Q885-A888 PolarHBondContact O-N 3.29Å; Q885-A889 VanDerWaalsContact O-CB 3.3Å; Q885-A889 WeakPolarHBondContact O-CB 3.46Å; Q885-A889 PolarHBondContact O-N 3.33Å
886	D	80.5	Confident	75.5	Confident	76 Å²	76	76.4 Å²	76.4	41%	0.406	40%	0.395	S	S	.	.	H	α-helix	trans	-64.6	-47.5	175.9	-175.1	65.5	0	0	0	111.1	N882 A888 A889 Q890	N882-D886 WeakPolarHBondContact O-CB 3.39Å; N882-D886 PolarHBondContact O-N 3.3Å; D886-A888 VanDerWaalsContact C-N 3.33Å; D886-A888 PolarHBondContact O-N 3.36Å; D886-A889 PolarHBondContact O-N 2.88Å; D886-Q890 WeakPolarHBondContact O-CB 3.49Å; D886-Q890 VanDerWaalsContact O-CG 3.32Å; D886-Q890 WeakPolarHBondContact O-CG 3.37Å; D886-Q890 PolarHBondContact O-N 3.43Å; D886-Q890 PolarHBondContact OD2-NE2 2.65Å
887	L	76.1	Confident	75.2	Confident	13 Å²	13	76.1 Å²	76.1	7%	0.068	40%	0.398	C	S	.	.	H	α-helix	trans	-60.5	-40.7	174.1	-78	167.2	0	0	0	112.4	M883 Q890 L891 L914 Q917 M921	M883-L887 HydrophobicContact CG-CD1 4.25Å; M883-L887 WeakPolarHBondContact O-CB 3.42Å; M883-L887 WeakPolarHBondContact O-CG 3.26Å; M883-L887 PolarHBondContact O-N 2.92Å; L887-Q890 PolarHBondContact O-N 2.83Å; L887-L891 WeakPolarHBondContact O-CB 3.14Å; L887-L891 VanDerWaalsContact O-CG 3.25Å; L887-L891 WeakPolarHBondContact O-CG 3.43Å; L887-L891 PolarHBondContact O-N 3.37Å; L887-L914 HydrophobicContact CD2-CD2 3.7Å; L887-Q917 HydrophobicContact CD2-CB 3.9Å; L887-M921 HydrophobicContact CD1-CE 3.72Å; L887-M921 HydrophobicContact CD1-CG 4.22Å; L887-M921 HydrophobicContact CD1-SD 4.35Å
888	A	76.6	Confident	75	Confident	54 Å²	54	74 Å²	74	45%	0.446	39%	0.388	S	S	.	.	H	α-helix	trans	-64.1	-43.1	174.9	0	0	0	0	0	111.8	S884 Q885 D886 L891 Q892	S884-A888 VanDerWaalsContact O-CB 3.3Å; S884-A888 WeakPolarHBondContact O-CB 3.39Å; S884-A888 PolarHBondContact O-N 2.92Å; Q885-A888 PolarHBondContact O-N 3.29Å; D886-A888 VanDerWaalsContact C-N 3.33Å; D886-A888 PolarHBondContact O-N 3.36Å; A888-L891 PolarHBondContact O-N 3.3Å; A888-Q892 VanDerWaalsContact O-CB 3.25Å; A888-Q892 WeakPolarHBondContact O-CB 3.34Å; A888-Q892 PolarHBondContact O-N 3.04Å
889	A	80.3	Confident	74.8	Confident	54 Å²	54	76 Å²	76	45%	0.446	40%	0.398	S	S	.	.	H	α-helix	trans	-66.2	-41.8	176.7	0	0	0	0	0	112.1	Q885 D886 Q892 S893	Q885-A889 VanDerWaalsContact O-CB 3.3Å; Q885-A889 WeakPolarHBondContact O-CB 3.46Å; Q885-A889 PolarHBondContact O-N 3.33Å; D886-A889 PolarHBondContact O-N 2.88Å; A889-Q892 PolarHBondContact O-N 3.15Å; A889-S893 WeakPolarHBondContact O-CB 3.44Å; A889-S893 PolarHBondContact O-N 2.99Å; A889-S893 PolarHBondContact O-OG 3.34Å
890	Q	79.5	Confident	74.5	Confident	47 Å²	47	76.9 Å²	76.9	22%	0.22	41%	0.412	C	S	.	.	H	α-helix	trans	-59.6	-51.6	173.1	-73.6	-171.4	51	0	0	110.7	D886 L887 Q892 S893 L894 L914	D886-Q890 WeakPolarHBondContact O-CB 3.49Å; D886-Q890 VanDerWaalsContact O-CG 3.32Å; D886-Q890 WeakPolarHBondContact O-CG 3.37Å; D886-Q890 PolarHBondContact O-N 3.43Å; D886-Q890 PolarHBondContact OD2-NE2 2.65Å; L887-Q890 PolarHBondContact O-N 2.83Å; Q890-Q892 VanDerWaalsContact C-N 3.33Å; Q890-Q892 PolarHBondContact O-N 3.46Å; Q890-S893 PolarHBondContact O-N 2.88Å; Q890-S893 PolarHBondContact O-OG 3.2Å; Q890-L894 WeakPolarHBondContact O-CG 3.5Å; Q890-L894 PolarHBondContact O-N 2.86Å; Q890-L914 HydrophobicContact CB-CD2 4.12Å
891	L	76.3	Confident	74	Confident	103 Å²	103	83.8 Å²	83.8	54%	0.539	44%	0.436	S	S	.	.	H	α-helix	trans	-61.3	-37.7	177.5	-72.9	170.2	0	0	0	112.8	L887 A888 L894 R895 L914	L887-L891 WeakPolarHBondContact O-CB 3.14Å; L887-L891 VanDerWaalsContact O-CG 3.25Å; L887-L891 WeakPolarHBondContact O-CG 3.43Å; L887-L891 PolarHBondContact O-N 3.37Å; A888-L891 PolarHBondContact O-N 3.3Å; L891-L894 PolarHBondContact O-N 2.85Å; L891-R895 WeakPolarHBondContact O-CB 3.43Å; L891-R895 PolarHBondContact O-N 3.49Å; L891-L914 HydrophobicContact CD2-CD1 3.97Å
892	Q	77.7	Confident	72.9	Confident	127 Å²	127	84.9 Å²	84.9	59%	0.593	46%	0.456	S	S	*	.	H	α-helix	trans	-70.6	-39.6	176.4	-169.4	168.7	12.6	0	0	111.7	A888 A889 Q890 L894 R895 I896	A888-Q892 VanDerWaalsContact O-CB 3.25Å; A888-Q892 WeakPolarHBondContact O-CB 3.34Å; A888-Q892 PolarHBondContact O-N 3.04Å; A889-Q892 PolarHBondContact O-N 3.15Å; Q890-Q892 VanDerWaalsContact C-N 3.33Å; Q890-Q892 PolarHBondContact O-N 3.46Å; Q892-L894 VanDerWaalsContact C-N 3.32Å; Q892-L894 PolarHBondContact O-N 3.09Å; Q892-R895 PolarHBondContact O-N 3.07Å; Q892-I896 HydrophobicContact CG-CD1 4.25Å; Q892-I896 VanDerWaalsContact O-CG1 3.31Å; Q892-I896 WeakPolarHBondContact O-CG1 3.42Å; Q892-I896 PolarHBondContact O-N 2.74Å
893	S	75.9	Confident	71.6	Confident	69 Å²	69	87.9 Å²	87.9	48%	0.483	47%	0.467	S	S	.	.	H	α-helix	trans	-64	-38.1	173.9	76.6	0	0	0	0	112	A889 Q890 I896 S897	A889-S893 WeakPolarHBondContact O-CB 3.44Å; A889-S893 PolarHBondContact O-N 2.99Å; A889-S893 PolarHBondContact O-OG 3.34Å; Q890-S893 PolarHBondContact O-N 2.88Å; Q890-S893 PolarHBondContact O-OG 3.2Å; S893-I896 PolarHBondContact O-N 3.46Å; S893-S897 WeakPolarHBondContact O-CB 3.3Å; S893-S897 PolarHBondContact O-N 3.2Å
894	L	72.3	Confident	70.5	Confident	28 Å²	28	93.7 Å²	93.7	15%	0.147	49%	0.494	C	S	.	.	H	α-helix	trans	-65.8	-47.2	174.8	-75	163.8	0	0	0	111.3	Q890 L891 Q892 I896 S897 F898 I910 L914	Q890-L894 WeakPolarHBondContact O-CG 3.5Å; Q890-L894 PolarHBondContact O-N 2.86Å; L891-L894 PolarHBondContact O-N 2.85Å; Q892-L894 VanDerWaalsContact C-N 3.32Å; Q892-L894 PolarHBondContact O-N 3.09Å; L894-I896 VanDerWaalsContact C-N 3.33Å; L894-I896 PolarHBondContact O-N 3.46Å; L894-S897 WeakPolarHBondContact CA-OG 3.17Å; L894-S897 WeakPolarHBondContact O-CA 3.31Å; L894-S897 WeakPolarHBondContact O-CB 3.19Å; L894-S897 PolarHBondContact O-N 3.3Å; L894-S897 PolarHBondContact O-OG 3.04Å; L894-F898 HydrophobicContact CB-CE2 4.35Å; L894-F898 WeakPolarHBondContact O-CD2 3.12Å; L894-F898 PolarHBondContact O-N 2.83Å; L894-I910 HydrophobicContact CD1-CG2 3.63Å; L894-I910 HydrophobicContact CD2-CD1 4.06Å; L894-I910 HydrophobicContact CD2-CG2 3.81Å; L894-I910 HydrophobicContact CG-CG2 4.34Å; L894-L914 HydrophobicContact CD1-CD1 3.59Å
895	R	74.1	Confident	69.4	Low	167 Å²	167	93.6 Å²	93.6	63%	0.63	49%	0.492	S	S	*	.	H	α-helix	trans	-53.2	-49.5	173.5	-179	-176.5	-70.2	-130.4	2.3	111.5	L891 Q892 S897 F898 E899	L891-R895 WeakPolarHBondContact O-CB 3.43Å; L891-R895 PolarHBondContact O-N 3.49Å; Q892-R895 PolarHBondContact O-N 3.07Å; R895-S897 VanDerWaalsContact C-N 3.28Å; R895-S897 PolarHBondContact O-N 3.47Å; R895-F898 PolarHBondContact O-N 2.9Å; R895-E899 VanDerWaalsContact CG-OE1 3.28Å; R895-E899 WeakPolarHBondContact CG-OE1 3.36Å; R895-E899 WeakPolarHBondContact O-CG 3.43Å; R895-E899 PolarHBondContact O-N 2.85Å
896	I	73.7	Confident	68.3	Low	86 Å²	86	93.8 Å²	93.8	44%	0.441	50%	0.497	S	S	.	.	H	α-helix	trans	-62	-36.8	177	-66.5	164.6	0	0	0	111	Q892 S893 L894 E899 T900	Q892-I896 HydrophobicContact CG-CD1 4.25Å; Q892-I896 VanDerWaalsContact O-CG1 3.31Å; Q892-I896 WeakPolarHBondContact O-CG1 3.42Å; Q892-I896 PolarHBondContact O-N 2.74Å; S893-I896 PolarHBondContact O-N 3.46Å; L894-I896 VanDerWaalsContact C-N 3.33Å; L894-I896 PolarHBondContact O-N 3.46Å; I896-E899 PolarHBondContact O-N 3.05Å; I896-T900 HydrophobicContact CG2-CG2 4.23Å; I896-T900 WeakPolarHBondContact O-CB 3.25Å; I896-T900 VanDerWaalsContact O-CG2 3.3Å; I896-T900 WeakPolarHBondContact O-CG2 3.38Å; I896-T900 PolarHBondContact O-N 3.11Å; I896-T900 PolarHBondContact O-OG1 3.12Å
897	S	66.7	Low	67.4	Low	33 Å²	33	92.7 Å²	92.7	23%	0.231	49%	0.491	C	S	.	.	H	α-helix	trans	-67	-39.8	177.2	79.4	0	0	0	0	113	S893 L894 R895 T900 R901	S893-S897 WeakPolarHBondContact O-CB 3.3Å; S893-S897 PolarHBondContact O-N 3.2Å; L894-S897 WeakPolarHBondContact CA-OG 3.17Å; L894-S897 WeakPolarHBondContact O-CA 3.31Å; L894-S897 WeakPolarHBondContact O-CB 3.19Å; L894-S897 PolarHBondContact O-N 3.3Å; L894-S897 PolarHBondContact O-OG 3.04Å; R895-S897 VanDerWaalsContact C-N 3.28Å; R895-S897 PolarHBondContact O-N 3.47Å; S897-T900 PolarHBondContact O-N 3.28Å; S897-T900 PolarHBondContact O-OG1 3.07Å; S897-R901 PolarHBondContact O-N 2.93Å
898	F	63.7	Low	67.1	Low	95 Å²	95	100.3 Å²	100.3	42%	0.417	52%	0.519	S	S	.	.	H	α-helix	trans	-64	-45.3	173	-73.6	-66.3	0	0	0	111.3	L894 R895 T900 D907	L894-F898 HydrophobicContact CB-CE2 4.35Å; L894-F898 WeakPolarHBondContact O-CD2 3.12Å; L894-F898 PolarHBondContact O-N 2.83Å; R895-F898 PolarHBondContact O-N 2.9Å; F898-T900 VanDerWaalsContact C-N 3.28Å; F898-T900 PolarHBondContact O-N 2.87Å; F898-D907 WeakPolarHBondContact CZ-OD1 3.42Å
899	E	70.4	Confident	66.9	Low	140 Å²	140	104 Å²	104	65%	0.654	53%	0.53	S	S	*	.	H	α-helix	trans	-65.2	-27.8	179	-72.7	170.9	-171.6	0	0	113.1	R895 I896	R895-E899 VanDerWaalsContact CG-OE1 3.28Å; R895-E899 WeakPolarHBondContact CG-OE1 3.36Å; R895-E899 WeakPolarHBondContact O-CG 3.43Å; R895-E899 PolarHBondContact O-N 2.85Å; I896-E899 PolarHBondContact O-N 3.05Å
900	T	66.9	Low	66.4	Low	99 Å²	99	104.4 Å²	104.4	61%	0.607	52%	0.524	S	S	*	.	H	α-helix	trans	-102.4	-21.9	-173.2	54	0	0	0	0	116.1	I896 S897 F898	I896-T900 HydrophobicContact CG2-CG2 4.23Å; I896-T900 WeakPolarHBondContact O-CB 3.25Å; I896-T900 VanDerWaalsContact O-CG2 3.3Å; I896-T900 WeakPolarHBondContact O-CG2 3.38Å; I896-T900 PolarHBondContact O-N 3.11Å; I896-T900 PolarHBondContact O-OG1 3.12Å; S897-T900 PolarHBondContact O-N 3.28Å; S897-T900 PolarHBondContact O-OG1 3.07Å; F898-T900 VanDerWaalsContact C-N 3.28Å; F898-T900 PolarHBondContact O-N 2.87Å
901	R	57.9	Low	66	Low	197 Å²	197	110.3 Å²	110.3	74%	0.743	54%	0.544	S	S	*	.	H	α-helix	trans	-110.8	-24.7	-176	-67.6	-167.3	-172.8	-163.3	4	116.2	S897 E903	S897-R901 PolarHBondContact O-N 2.93Å; R901-E903 PolarHBondContact O-N 3.21Å
902	G	51.9	Low	66.1	Low	78 Å²	78	109.5 Å²	109.5	80%	0.804	54%	0.538	S	S	*	.			trans	65.5	-14.4	178.9	0	0	0	0	0	116.6
903	E	52.3	Low	66.1	Low	159 Å²	159	107.8 Å²	107.8	74%	0.743	53%	0.53	S	S	*	.	S	Bend	trans	-95.5	130.5	171.6	-64.2	-179.5	151.3	0	0	109.7	R901 P905	R901-E903 PolarHBondContact O-N 3.21Å; E903-P905 VanDerWaalsContact O-CD 3.24Å; E903-P905 WeakPolarHBondContact O-CD 3.31Å
904	Q	52.7	Low	66.1	Low	155 Å²	155	105.8 Å²	105.8	72%	0.724	51%	0.514	S	S	*	.			trans	-66	119.6	169	-74.8	-175.3	-85.2	0	0	109.4	D907	Q904-D907 PolarHBondContact NE2-OD2 3.48Å
905	P	52.5	Low	66.3	Low	65 Å²	65	107.7 Å²	107.7	42%	0.422	52%	0.522	S	S	.	.			trans	-66.5	175.9	160.4	-9.6	28.4	0	0	0	109.2	E903 D907	E903-P905 VanDerWaalsContact O-CD 3.24Å; E903-P905 WeakPolarHBondContact O-CD 3.31Å; P905-D907 PolarHBondContact O-N 3.35Å
906	D	57.4	Low	66.6	Low	125 Å²	125	104.2 Å²	104.2	67%	0.668	51%	0.509	S	S	*	.			trans	-67.9	81	177.7	-164.8	-4.2	0	0	0	111.4	R908 L909	D906-R908 PolarHBondContact O-N 2.71Å; D906-L909 PolarHBondContact O-N 3.36Å
907	D	61.5	Low	66.7	Low	53 Å²	53	101.2 Å²	101.2	28%	0.283	49%	0.493	S	S	.	.	H	α-helix	trans	-52.1	-28.7	-170	-98.6	-30.2	0	0	0	113	F898 Q904 P905 R911	F898-D907 WeakPolarHBondContact CZ-OD1 3.42Å; Q904-D907 PolarHBondContact NE2-OD2 3.48Å; P905-D907 PolarHBondContact O-N 3.35Å; D907-R911 WeakPolarHBondContact O-CB 3.16Å; D907-R911 PolarHBondContact O-N 3.35Å
908	R	69.6	Low	67.2	Low	173 Å²	173	104.2 Å²	104.2	65%	0.653	51%	0.506	S	S	*	.	H	α-helix	trans	-63.7	-47.5	-171.9	-173.9	174.2	-179.7	164.9	4.5	112.3	D906 R911 E912	D906-R908 PolarHBondContact O-N 2.71Å; R908-R911 PolarHBondContact O-N 3.01Å; R908-E912 HydrophobicContact CG-CG 4.4Å; R908-E912 WeakPolarHBondContact CG-OE1 3.47Å; R908-E912 IonicContact CZ-OE1 3.84Å; R908-E912 IonicContact NE-OE1 3.63Å; R908-E912 PolarHBondContact NE-OE1 2.9Å; R908-E912 IonicContact NH2-OE1 2.83Å; R908-E912 PolarHBondContact NH2-OE1 3.36Å; R908-E912 WeakPolarHBondContact O-CB 3.46Å; R908-E912 VanDerWaalsContact O-CG 3.3Å; R908-E912 WeakPolarHBondContact O-CG 3.46Å; R908-E912 PolarHBondContact O-N 2.85Å
909	L	72.9	Confident	67.8	Low	131 Å²	131	105.7 Å²	105.7	69%	0.686	51%	0.509	S	S	*	.	H	α-helix	trans	-71.6	-36.3	-171.7	-148.4	121	0	0	0	111.7	D906 Q913	D906-L909 PolarHBondContact O-N 3.36Å; L909-Q913 WeakPolarHBondContact O-CB 3.2Å; L909-Q913 PolarHBondContact O-N 3.43Å; L909-Q913 VanDerWaalsContact O-N 3.09Å
910	I	69	Low	68	Low	63 Å²	63	103 Å²	103	32%	0.323	50%	0.496	S	S	.	.	H	α-helix	trans	-71	-41.8	176.3	-58.7	177.6	0	0	0	110.3	L894 Q913 L914	L894-I910 HydrophobicContact CD1-CG2 3.63Å; L894-I910 HydrophobicContact CD2-CD1 4.06Å; L894-I910 HydrophobicContact CD2-CG2 3.81Å; L894-I910 HydrophobicContact CG-CG2 4.34Å; I910-Q913 WeakPolarHBondContact O-CB 3.29Å; I910-Q913 PolarHBondContact O-N 3.38Å; I910-L914 HydrophobicContact CG2-CD1 4.25Å; I910-L914 WeakPolarHBondContact O-CG 3.46Å; I910-L914 PolarHBondContact O-N 3.4Å
911	R	71.3	Confident	68.2	Low	170 Å²	170	100 Å²	100	64%	0.642	48%	0.476	S	S	*	.	H	α-helix	trans	-65	-43.8	175.9	-174.1	176.3	179.5	157.1	6.1	112.1	D907 R908 Q913 L914 E915	D907-R911 WeakPolarHBondContact O-CB 3.16Å; D907-R911 PolarHBondContact O-N 3.35Å; R908-R911 PolarHBondContact O-N 3.01Å; R911-Q913 VanDerWaalsContact C-N 3.31Å; R911-Q913 PolarHBondContact O-N 2.84Å; R911-L914 PolarHBondContact O-N 3.2Å; R911-E915 HydrophobicContact CG-CG 4.3Å; R911-E915 WeakPolarHBondContact CG-OE1 3.44Å; R911-E915 IonicContact NE-OE1 3.95Å; R911-E915 PolarHBondContact NE-OE1 3.1Å; R911-E915 VanDerWaalsContact O-CB 3.32Å; R911-E915 WeakPolarHBondContact O-CB 3.14Å; R911-E915 VanDerWaalsContact O-CG 3.28Å; R911-E915 WeakPolarHBondContact O-CG 3.31Å; R911-E915 PolarHBondContact O-N 3Å
912	E	77.3	Confident	69	Low	87 Å²	87	93.5 Å²	93.5	41%	0.407	46%	0.458	S	S	.	.	H	α-helix	trans	-61.6	-38.1	175.5	-75.2	174.3	-175.2	0	0	111.8	R908 R916	R908-E912 HydrophobicContact CG-CG 4.4Å; R908-E912 WeakPolarHBondContact CG-OE1 3.47Å; R908-E912 IonicContact CZ-OE1 3.84Å; R908-E912 IonicContact NE-OE1 3.63Å; R908-E912 PolarHBondContact NE-OE1 2.9Å; R908-E912 IonicContact NH2-OE1 2.83Å; R908-E912 PolarHBondContact NH2-OE1 3.36Å; R908-E912 WeakPolarHBondContact O-CB 3.46Å; R908-E912 VanDerWaalsContact O-CG 3.3Å; R908-E912 WeakPolarHBondContact O-CG 3.46Å; R908-E912 PolarHBondContact O-N 2.85Å; E912-R916 WeakPolarHBondContact O-CB 3.4Å; E912-R916 PolarHBondContact O-N 3.38Å
913	Q	78.3	Confident	70	Confident	91 Å²	91	94.1 Å²	94.1	43%	0.425	44%	0.443	S	S	.	.	H	α-helix	trans	-64	-50.8	173.6	179.8	83.1	-24.3	0	0	112.3	L909 I910 R911 R916 Q917	L909-Q913 WeakPolarHBondContact O-CB 3.2Å; L909-Q913 PolarHBondContact O-N 3.43Å; L909-Q913 VanDerWaalsContact O-N 3.09Å; I910-Q913 WeakPolarHBondContact O-CB 3.29Å; I910-Q913 PolarHBondContact O-N 3.38Å; R911-Q913 VanDerWaalsContact C-N 3.31Å; R911-Q913 PolarHBondContact O-N 2.84Å; Q913-R916 WeakPolarHBondContact O-CB 3.28Å; Q913-R916 PolarHBondContact O-N 3.35Å; Q913-Q917 PolarHBondContact O-N 3.39Å
914	L	75.3	Confident	71	Confident	26 Å²	26	89.5 Å²	89.5	14%	0.136	42%	0.42	C	S	.	.	H	α-helix	trans	-63.5	-44.4	178.4	-77.1	173	0	0	0	112	L887 Q890 L891 L894 I910 R911 R916 Q917 L918	L887-L914 HydrophobicContact CD2-CD2 3.7Å; Q890-L914 HydrophobicContact CB-CD2 4.12Å; L891-L914 HydrophobicContact CD2-CD1 3.97Å; L894-L914 HydrophobicContact CD1-CD1 3.59Å; I910-L914 HydrophobicContact CG2-CD1 4.25Å; I910-L914 WeakPolarHBondContact O-CG 3.46Å; I910-L914 PolarHBondContact O-N 3.4Å; R911-L914 PolarHBondContact O-N 3.2Å; L914-R916 VanDerWaalsContact C-N 3.27Å; L914-R916 PolarHBondContact O-N 2.78Å; L914-Q917 PolarHBondContact O-N 3.47Å; L914-L918 WeakPolarHBondContact O-CB 3.45Å; L914-L918 PolarHBondContact O-N 3.4Å
915	E	76.5	Confident	71.7	Confident	68 Å²	68	84.3 Å²	84.3	32%	0.318	40%	0.404	S	S	.	.	H	α-helix	trans	-63.8	-33	175.8	-72.8	-178.7	-166	0	0	111.8	R911 R919	R911-E915 HydrophobicContact CG-CG 4.3Å; R911-E915 WeakPolarHBondContact CG-OE1 3.44Å; R911-E915 IonicContact NE-OE1 3.95Å; R911-E915 PolarHBondContact NE-OE1 3.1Å; R911-E915 VanDerWaalsContact O-CB 3.32Å; R911-E915 WeakPolarHBondContact O-CB 3.14Å; R911-E915 VanDerWaalsContact O-CG 3.28Å; R911-E915 WeakPolarHBondContact O-CG 3.31Å; R911-E915 PolarHBondContact O-N 3Å; E915-R919 WeakPolarHBondContact O-CB 3.44Å; E915-R919 VanDerWaalsContact O-CG 3.23Å; E915-R919 WeakPolarHBondContact O-CG 3.39Å; E915-R919 PolarHBondContact O-N 2.98Å; E915-R919 PolarHBondContact O-NE 3.05Å; E915-R919 IonicContact OE2-CZ 3.7Å; E915-R919 IonicContact OE2-NH1 3.9Å; E915-R919 PolarHBondContact OE2-NH1 3.24Å; E915-R919 IonicContact OE2-NH2 3.08Å
916	R	80.9	Confident	72.5	Confident	95 Å²	95	87.2 Å²	87.2	36%	0.358	41%	0.41	S	S	.	.	H	α-helix	trans	-65.1	-49	172.6	-177.5	-176.3	59.4	73.9	2.7	111.3	E912 Q913 L914 L918 R919 E920	E912-R916 WeakPolarHBondContact O-CB 3.4Å; E912-R916 PolarHBondContact O-N 3.38Å; Q913-R916 WeakPolarHBondContact O-CB 3.28Å; Q913-R916 PolarHBondContact O-N 3.35Å; L914-R916 VanDerWaalsContact C-N 3.27Å; L914-R916 PolarHBondContact O-N 2.78Å; R916-L918 VanDerWaalsContact C-N 3.3Å; R916-L918 PolarHBondContact O-N 2.92Å; R916-R919 PolarHBondContact O-N 2.79Å; R916-E920 WeakPolarHBondContact CG-OE1 3.3Å; R916-E920 IonicContact CZ-OE1 3.85Å; R916-E920 VanDerWaalsContact NH1-CD 3.35Å; R916-E920 IonicContact NH1-OE1 2.71Å; R916-E920 PolarHBondContact NH1-OE1 2.91Å; R916-E920 IonicContact NH1-OE2 3.66Å; R916-E920 PolarHBondContact NH1-OE2 3.21Å; R916-E920 WeakPolarHBondContact O-CG 3.49Å; R916-E920 PolarHBondContact O-N 3.16Å
917	Q	75.7	Confident	73.1	Confident	22 Å²	22	87.8 Å²	87.8	10%	0.103	40%	0.403	C	S	.	.	H	α-helix	trans	-61.6	-37.9	176.1	-72.1	-176	-76.9	0	0	112.1	L887 Q913 L914 E920 M921	L887-Q917 HydrophobicContact CD2-CB 3.9Å; Q913-Q917 PolarHBondContact O-N 3.39Å; L914-Q917 PolarHBondContact O-N 3.47Å; Q917-E920 PolarHBondContact O-N 3.39Å; Q917-M921 PolarHBondContact O-N 3.07Å
918	L	76.4	Confident	73.1	Confident	97 Å²	97	87.6 Å²	87.6	51%	0.508	40%	0.398	S	S	.	.	H	α-helix	trans	-68.3	-38.3	176.3	-163.5	75.8	0	0	0	112.1	L914 R916 M921 T922	L914-L918 WeakPolarHBondContact O-CB 3.45Å; L914-L918 PolarHBondContact O-N 3.4Å; R916-L918 VanDerWaalsContact C-N 3.3Å; R916-L918 PolarHBondContact O-N 2.92Å; L918-M921 PolarHBondContact O-N 3.43Å; L918-T922 VanDerWaalsContact O-CB 3.3Å; L918-T922 WeakPolarHBondContact O-CB 3.38Å; L918-T922 PolarHBondContact O-N 3.42Å; L918-T922 PolarHBondContact O-OG1 2.88Å
919	R	77.3	Confident	72.7	Confident	126 Å²	126	84.6 Å²	84.6	48%	0.475	39%	0.392	S	S	.	.	H	α-helix	trans	-63.3	-47.8	172.3	-78.2	178.9	-73.5	-107.7	0.9	111	E915 R916 M921 T922 D923	E915-R919 WeakPolarHBondContact O-CB 3.44Å; E915-R919 VanDerWaalsContact O-CG 3.23Å; E915-R919 WeakPolarHBondContact O-CG 3.39Å; E915-R919 PolarHBondContact O-N 2.98Å; E915-R919 PolarHBondContact O-NE 3.05Å; E915-R919 IonicContact OE2-CZ 3.7Å; E915-R919 IonicContact OE2-NH1 3.9Å; E915-R919 PolarHBondContact OE2-NH1 3.24Å; E915-R919 IonicContact OE2-NH2 3.08Å; R916-R919 PolarHBondContact O-N 2.79Å; R919-M921 PolarHBondContact O-N 3.34Å; R919-T922 PolarHBondContact O-N 3.36Å; R919-T922 VanDerWaalsContact O-N 3.08Å; R919-D923 PolarHBondContact O-N 2.6Å
920	E	75.2	Confident	72.3	Confident	82 Å²	82	80.6 Å²	80.6	38%	0.383	38%	0.383	S	S	.	.	H	α-helix	trans	-58	-43.2	175.5	-74.7	167	-162.4	0	0	112.4	R916 Q917 K924	R916-E920 WeakPolarHBondContact CG-OE1 3.3Å; R916-E920 IonicContact CZ-OE1 3.85Å; R916-E920 VanDerWaalsContact NH1-CD 3.35Å; R916-E920 IonicContact NH1-OE1 2.71Å; R916-E920 PolarHBondContact NH1-OE1 2.91Å; R916-E920 IonicContact NH1-OE2 3.66Å; R916-E920 PolarHBondContact NH1-OE2 3.21Å; R916-E920 WeakPolarHBondContact O-CG 3.49Å; R916-E920 PolarHBondContact O-N 3.16Å; Q917-E920 PolarHBondContact O-N 3.39Å; E920-K924 WeakPolarHBondContact O-CB 3.46Å; E920-K924 PolarHBondContact O-N 3.11Å; E920-K924 VanDerWaalsContact O-N 3.12Å
921	M	71	Confident	72	Confident	37 Å²	37	80.7 Å²	80.7	18%	0.182	38%	0.382	C	S	.	.	H	α-helix	trans	-62.2	-44.7	171.6	-81.8	-120.7	-63.8	0	0	112.5	F880 M883 L887 Q917 L918 R919 A925	F880-M921 HydrophobicContact CD1-SD 4.12Å; M883-M921 HydrophobicContact CB-SD 3.91Å; M883-M921 HydrophobicContact CG-CG 3.61Å; M883-M921 HydrophobicContact CG-SD 3.59Å; M883-M921 VanDerWaalsContact CG-SD 3.59Å; L887-M921 HydrophobicContact CD1-CE 3.72Å; L887-M921 HydrophobicContact CD1-CG 4.22Å; L887-M921 HydrophobicContact CD1-SD 4.35Å; Q917-M921 PolarHBondContact O-N 3.07Å; L918-M921 PolarHBondContact O-N 3.43Å; R919-M921 PolarHBondContact O-N 3.34Å; M921-A925 VanDerWaalsContact O-CB 3.27Å; M921-A925 WeakPolarHBondContact O-CB 3.43Å; M921-A925 PolarHBondContact O-N 3.07Å
922	T	74.2	Confident	71.4	Confident	60 Å²	60	75.6 Å²	75.6	37%	0.368	36%	0.364	S	S	.	.	H	α-helix	trans	-66.3	-41.1	-176.9	-60	0	0	0	0	111.6	L918 R919 A925 K926	L918-T922 VanDerWaalsContact O-CB 3.3Å; L918-T922 WeakPolarHBondContact O-CB 3.38Å; L918-T922 PolarHBondContact O-N 3.42Å; L918-T922 PolarHBondContact O-OG1 2.88Å; R919-T922 PolarHBondContact O-N 3.36Å; R919-T922 VanDerWaalsContact O-N 3.08Å; T922-A925 PolarHBondContact O-N 3.42Å; T922-K926 HydrophobicContact CG2-CD 4.46Å; T922-K926 WeakPolarHBondContact O-CG 3.35Å; T922-K926 PolarHBondContact O-N 3.12Å
923	D	72.9	Confident	70.6	Confident	91 Å²	91	75.7 Å²	75.7	49%	0.487	36%	0.364	S	S	.	.	H	α-helix	trans	-75.8	-36.1	-178.5	-66.8	-24.9	0	0	0	111.8	R919 K926 W927	R919-D923 PolarHBondContact O-N 2.6Å; D923-K926 IonicContact OD1-NZ 2.8Å; D923-K926 PolarHBondContact OD1-NZ 3.42Å; D923-W927 PolarHBondContact O-N 3.19Å
924	K	72.6	Confident	69.6	Low	62 Å²	62	76.1 Å²	76.1	27%	0.27	37%	0.366	S	S	.	.	H	α-helix	trans	-59.3	-46.8	164.9	-93.9	-163.9	162.9	-155.2	0	111.3	E876 Y879 F880 E920 K926 W927 Y928	E876-K924 IonicContact OE1-NZ 3.62Å; E876-K924 PolarHBondContact OE1-NZ 3.48Å; E876-K924 VanDerWaalsContact OE1-NZ 3.16Å; E876-K924 IonicContact OE2-NZ 3.58Å; E876-K924 PolarHBondContact OE2-NZ 3.06Å; Y879-K924 HydrophobicContact CD1-CD 4.36Å; Y879-K924 HydrophobicContact CE1-CD 3.63Å; F880-K924 HydrophobicContact CE1-CB 4.06Å; F880-K924 HydrophobicContact CZ-CB 3.87Å; F880-K924 HydrophobicContact CZ-CD 4.27Å; E920-K924 WeakPolarHBondContact O-CB 3.46Å; E920-K924 PolarHBondContact O-N 3.11Å; E920-K924 VanDerWaalsContact O-N 3.12Å; K924-K926 PolarHBondContact O-N 3.35Å; K924-W927 WeakPolarHBondContact O-CB 3.37Å; K924-W927 PolarHBondContact O-N 3.42Å; K924-W927 VanDerWaalsContact O-N 3.13Å; K924-Y928 WeakPolarHBondContact O-CD2 3.4Å; K924-Y928 PolarHBondContact O-N 2.91Å
925	A	68	Low	68.4	Low	46 Å²	46	79.2 Å²	79.2	38%	0.38	38%	0.379	S	S	.	.	H	α-helix	trans	-61.4	-41.4	-179.9	0	0	0	0	0	112.8	M921 T922 W927 Y928 E929	M921-A925 VanDerWaalsContact O-CB 3.27Å; M921-A925 WeakPolarHBondContact O-CB 3.43Å; M921-A925 PolarHBondContact O-N 3.07Å; T922-A925 PolarHBondContact O-N 3.42Å; A925-W927 VanDerWaalsContact C-N 3.33Å; A925-W927 PolarHBondContact O-N 3.2Å; A925-Y928 PolarHBondContact O-N 3.47Å; A925-E929 PolarHBondContact O-N 3.29Å
926	K	68.2	Low	67.7	Low	127 Å²	127	80.4 Å²	80.4	55%	0.552	38%	0.383	S	S	*	.	H	α-helix	trans	-62.2	-37.9	172.6	-73	169.1	-171.3	156.7	0	112.8	T922 D923 K924 Y928 E929 G930	T922-K926 HydrophobicContact CG2-CD 4.46Å; T922-K926 WeakPolarHBondContact O-CG 3.35Å; T922-K926 PolarHBondContact O-N 3.12Å; D923-K926 IonicContact OD1-NZ 2.8Å; D923-K926 PolarHBondContact OD1-NZ 3.42Å; K924-K926 PolarHBondContact O-N 3.35Å; K926-Y928 VanDerWaalsContact C-N 3.35Å; K926-E929 PolarHBondContact O-N 2.69Å; K926-G930 PolarHBondContact O-N 3.06Å
927	W	71	Confident	67	Low	137 Å²	137	78.9 Å²	78.9	52%	0.519	39%	0.387	S	S	.	.	H	α-helix	trans	-61.8	-44.2	175.8	-175.2	87.8	0	0	0	110.9	W872 D923 K924 A925 G930 E931	W872-W927 HydrophobicContact CH2-CH2 4.38Å; W872-W927 HydrophobicContact CH2-CZ3 4.18Å; D923-W927 PolarHBondContact O-N 3.19Å; K924-W927 WeakPolarHBondContact O-CB 3.37Å; K924-W927 PolarHBondContact O-N 3.42Å; K924-W927 VanDerWaalsContact O-N 3.13Å; A925-W927 VanDerWaalsContact C-N 3.33Å; A925-W927 PolarHBondContact O-N 3.2Å; W927-G930 PolarHBondContact O-N 2.92Å; W927-E931 HydrophobicContact CE3-CG 4.43Å; W927-E931 HydrophobicContact CH2-CG 3.86Å; W927-E931 WeakPolarHBondContact CH2-OE1 3.49Å; W927-E931 VanDerWaalsContact CH2-OE2 3.23Å; W927-E931 WeakPolarHBondContact CH2-OE2 3.47Å; W927-E931 HydrophobicContact CZ2-CG 3.97Å; W927-E931 WeakPolarHBondContact CZ2-OE1 3.44Å; W927-E931 HydrophobicContact CZ3-CG 4.1Å; W927-E931 PolarHBondContact O-N 3.36Å
928	Y	62.2	Low	66.2	Low	48 Å²	48	82.8 Å²	82.8	19%	0.188	41%	0.405	C	S	.	.	H	α-helix	trans	-64.6	-37.2	172.5	-76.7	-71.3	0	0	0	113.9	W872 E876 F880 K924 A925 K926 G930 E931 K932	W872-Y928 AromaticContact CH2-CE1 3.81Å; W872-Y928 HydrophobicContact CH2-CE1 3.81Å; W872-Y928 AromaticContact CH2-CZ 3.98Å; W872-Y928 VanDerWaalsContact CH2-OH 3.3Å; W872-Y928 WeakPolarHBondContact CH2-OH 3.32Å; W872-Y928 HydrophobicContact CZ3-CE1 4.13Å; E876-Y928 VanDerWaalsContact CD-OH 3.26Å; E876-Y928 WeakPolarHBondContact CG-OH 3.42Å; E876-Y928 PolarHBondContact OE2-OH 2.7Å; F880-Y928 AromaticContact CE2-CD2 3.69Å; F880-Y928 HydrophobicContact CE2-CD2 3.69Å; F880-Y928 AromaticContact CE2-CE2 3.39Å; F880-Y928 HydrophobicContact CE2-CE2 3.39Å; F880-Y928 AromaticContact CZ-CD2 3.62Å; F880-Y928 HydrophobicContact CZ-CD2 3.62Å; F880-Y928 AromaticContact CZ-CE2 3.57Å; F880-Y928 HydrophobicContact CZ-CE2 3.57Å; K924-Y928 WeakPolarHBondContact O-CD2 3.4Å; K924-Y928 PolarHBondContact O-N 2.91Å; A925-Y928 PolarHBondContact O-N 3.47Å; K926-Y928 VanDerWaalsContact C-N 3.35Å; Y928-G930 PolarHBondContact O-N 3.05Å; Y928-E931 PolarHBondContact O-N 3.36Å; Y928-K932 WeakPolarHBondContact O-CB 3.34Å; Y928-K932 PolarHBondContact O-N 3.45Å
929	E	61.3	Low	65.1	Low	110 Å²	110	81.6 Å²	81.6	51%	0.514	40%	0.399	S	S	.	.	H	α-helix	trans	-62	-35	174	-156.5	90.9	-115.6	0	0	111.1	A925 K926 K932 E933	A925-E929 PolarHBondContact O-N 3.29Å; K926-E929 PolarHBondContact O-N 2.69Å; E929-K932 IonicContact OE1-NZ 2.67Å; E929-K932 PolarHBondContact OE1-NZ 3.06Å; E929-E933 PolarHBondContact O-N 2.75Å
930	G	63	Low	64.6	Low	48 Å²	48	78.8 Å²	78.8	50%	0.495	40%	0.396	S	S	.	.	H	α-helix	trans	-66.8	-50.4	173.3	0	0	0	0	0	113.7	K926 W927 Y928 K932 E933 H934	K926-G930 PolarHBondContact O-N 3.06Å; W927-G930 PolarHBondContact O-N 2.92Å; Y928-G930 PolarHBondContact O-N 3.05Å; G930-K932 VanDerWaalsContact C-N 3.33Å; G930-K932 PolarHBondContact O-N 2.87Å; G930-E933 PolarHBondContact O-N 3.41Å; G930-H934 PolarHBondContact O-N 3.35Å; G930-H934 VanDerWaalsContact O-N 3.17Å
931	E	62.9	Low	64.1	Low	65 Å²	65	78.6 Å²	78.6	30%	0.304	40%	0.397	S	S	.	.	H	α-helix	trans	-64.1	-37.4	176.2	-73.4	-144.8	146	0	0	112.4	W927 Y928 E933 H934 F935	W927-E931 HydrophobicContact CE3-CG 4.43Å; W927-E931 HydrophobicContact CH2-CG 3.86Å; W927-E931 WeakPolarHBondContact CH2-OE1 3.49Å; W927-E931 VanDerWaalsContact CH2-OE2 3.23Å; W927-E931 WeakPolarHBondContact CH2-OE2 3.47Å; W927-E931 HydrophobicContact CZ2-CG 3.97Å; W927-E931 WeakPolarHBondContact CZ2-OE1 3.44Å; W927-E931 HydrophobicContact CZ3-CG 4.1Å; W927-E931 PolarHBondContact O-N 3.36Å; Y928-E931 PolarHBondContact O-N 3.36Å; E931-E933 PolarHBondContact O-N 2.82Å; E931-H934 WeakPolarHBondContact O-CA 3.48Å; E931-H934 WeakPolarHBondContact O-CB 3.3Å; E931-H934 PolarHBondContact O-N 3.43Å; E931-H934 VanDerWaalsContact O-N 3.13Å; E931-F935 HydrophobicContact CB-CD2 4.37Å; E931-F935 HydrophobicContact CB-CE2 4.36Å; E931-F935 VanDerWaalsContact O-CD2 3.22Å; E931-F935 WeakPolarHBondContact O-CD2 3.49Å; E931-F935 PolarHBondContact O-N 2.94Å
932	K	58.2	Low	63.3	Low	62 Å²	62	80.3 Å²	80.3	27%	0.27	41%	0.412	S	S	.	.	H	α-helix	trans	-58.5	-45.2	176.2	173.7	-174.7	160.4	-157.1	0	112.2	W797 Y928 E929 G930 H934 F935 K936	W797-K932 HydrophobicContact CH2-CD 4.03Å; W797-K932 HydrophobicContact CH2-CG 4Å; W797-K932 HydrophobicContact CZ2-CD 4.31Å; W797-K932 HydrophobicContact CZ2-CG 3.99Å; Y928-K932 WeakPolarHBondContact O-CB 3.34Å; Y928-K932 PolarHBondContact O-N 3.45Å; E929-K932 IonicContact OE1-NZ 2.67Å; E929-K932 PolarHBondContact OE1-NZ 3.06Å; G930-K932 VanDerWaalsContact C-N 3.33Å; G930-K932 PolarHBondContact O-N 2.87Å; K932-H934 VanDerWaalsContact C-N 3.33Å; K932-F935 PolarHBondContact O-N 3.5Å; K932-K936 WeakPolarHBondContact O-CB 3.37Å; K932-K936 PolarHBondContact O-N 3.3Å
933	E	60.7	Low	62.8	Low	89 Å²	89	79.7 Å²	79.7	42%	0.416	41%	0.413	S	S	.	.	H	α-helix	trans	-69.6	-30.7	176.2	-70.1	-65.3	129.8	0	0	112.1	E929 G930 E931 K936 S937	E929-E933 PolarHBondContact O-N 2.75Å; G930-E933 PolarHBondContact O-N 3.41Å; E931-E933 PolarHBondContact O-N 2.82Å; E933-K936 WeakPolarHBondContact OE1-CD 3.11Å; E933-K936 IonicContact OE1-NZ 3.76Å; E933-K936 PolarHBondContact OE1-NZ 3.27Å; E933-K936 IonicContact OE2-NZ 2.68Å; E933-K936 PolarHBondContact OE2-NZ 2.96Å; E933-S937 WeakPolarHBondContact O-CB 3.48Å; E933-S937 PolarHBondContact O-N 2.84Å
934	H	59	Low	62.5	Low	101 Å²	101	80.8 Å²	80.8	47%	0.468	42%	0.415	S	S	.	.	H	α-helix	trans	-62.9	-53.1	170	175.6	-84.2	0	0	0	112	G930 E931 K932 K936 S937 E938	G930-H934 PolarHBondContact O-N 3.35Å; G930-H934 VanDerWaalsContact O-N 3.17Å; E931-H934 WeakPolarHBondContact O-CA 3.48Å; E931-H934 WeakPolarHBondContact O-CB 3.3Å; E931-H934 PolarHBondContact O-N 3.43Å; E931-H934 VanDerWaalsContact O-N 3.13Å; K932-H934 VanDerWaalsContact C-N 3.33Å; H934-K936 VanDerWaalsContact C-N 3.31Å; H934-K936 PolarHBondContact O-N 2.75Å; H934-S937 WeakPolarHBondContact O-CB 3.47Å; H934-S937 PolarHBondContact O-N 3.37Å; H934-S937 VanDerWaalsContact O-N 3.11Å; H934-E938 PolarHBondContact O-N 3.35Å
935	F	49.3	Very low	62.1	Low	91 Å²	91	86.4 Å²	86.4	40%	0.399	44%	0.435	S	S	.	.	H	α-helix	trans	-60.9	-38.6	177.4	-79.1	-66.2	0	0	0	112.6	E931 K932 S937 E938 L939	E931-F935 HydrophobicContact CB-CD2 4.37Å; E931-F935 HydrophobicContact CB-CE2 4.36Å; E931-F935 VanDerWaalsContact O-CD2 3.22Å; E931-F935 WeakPolarHBondContact O-CD2 3.49Å; E931-F935 PolarHBondContact O-N 2.94Å; K932-F935 PolarHBondContact O-N 3.5Å; F935-S937 VanDerWaalsContact C-N 3.35Å; F935-E938 PolarHBondContact O-N 3.41Å; F935-L939 WeakPolarHBondContact O-CB 3.44Å; F935-L939 PolarHBondContact O-N 2.84Å
936	K	62.2	Low	61.7	Low	92 Å²	92	87.4 Å²	87.4	40%	0.4	44%	0.438	S	S	.	.	H	α-helix	trans	-63.3	-38.1	174	178.8	-175	168.7	-155.9	0	112.3	K932 E933 H934 T940	K932-K936 WeakPolarHBondContact O-CB 3.37Å; K932-K936 PolarHBondContact O-N 3.3Å; E933-K936 WeakPolarHBondContact OE1-CD 3.11Å; E933-K936 IonicContact OE1-NZ 3.76Å; E933-K936 PolarHBondContact OE1-NZ 3.27Å; E933-K936 IonicContact OE2-NZ 2.68Å; E933-K936 PolarHBondContact OE2-NZ 2.96Å; H934-K936 VanDerWaalsContact C-N 3.31Å; H934-K936 PolarHBondContact O-N 2.75Å; K936-T940 WeakPolarHBondContact O-CB 3.15Å; K936-T940 PolarHBondContact O-N 3.13Å; K936-T940 PolarHBondContact O-OG1 3.38Å
937	S	66.5	Low	61.6	Low	63 Å²	63	87.3 Å²	87.3	44%	0.441	44%	0.44	S	S	.	.	H	α-helix	trans	-64.1	-47.5	173.3	-168.6	0	0	0	0	111.2	E933 H934 F935 T940 N941	E933-S937 WeakPolarHBondContact O-CB 3.48Å; E933-S937 PolarHBondContact O-N 2.84Å; H934-S937 WeakPolarHBondContact O-CB 3.47Å; H934-S937 PolarHBondContact O-N 3.37Å; H934-S937 VanDerWaalsContact O-N 3.11Å; F935-S937 VanDerWaalsContact C-N 3.35Å; S937-T940 PolarHBondContact O-N 3.31Å; S937-N941 PolarHBondContact O-N 3.28Å
938	E	58.8	Low	61.2	Low	105 Å²	105	86.2 Å²	86.2	49%	0.491	44%	0.44	S	S	.	.	H	α-helix	trans	-63.1	-42.8	177.4	-76.2	-63.3	98.9	0	0	112.8	H934 F935 T940 N941 C942	H934-E938 PolarHBondContact O-N 3.35Å; F935-E938 PolarHBondContact O-N 3.41Å; E938-T940 VanDerWaalsContact C-N 3.33Å; E938-T940 PolarHBondContact O-N 2.9Å; E938-N941 PolarHBondContact O-N 3.17Å; E938-N941 PolarHBondContact OE1-ND2 2.94Å; E938-C942 WeakPolarHBondContact O-CB 3.43Å; E938-C942 PolarHBondContact O-N 3.18Å
939	L	52	Low	60.9	Low	72 Å²	72	88.8 Å²	88.8	38%	0.377	46%	0.456	S	S	.	.	H	α-helix	trans	-63.3	-37.7	173.4	-84.2	160.4	0	0	0	112.1	Y804 F935 C942 A943	Y804-L939 HydrophobicContact CE1-CD2 4.25Å; F935-L939 WeakPolarHBondContact O-CB 3.44Å; F935-L939 PolarHBondContact O-N 2.84Å; L939-C942 PolarHBondContact O-N 2.86Å; L939-A943 WeakPolarHBondContact O-CB 3.47Å; L939-A943 PolarHBondContact O-N 3.46Å
940	T	66.6	Low	61.2	Low	66 Å²	66	88.7 Å²	88.7	41%	0.405	46%	0.456	S	S	.	.	H	α-helix	trans	-67.6	-42.4	176.3	-55.3	0	0	0	0	111.1	K936 S937 E938 C942 A943 Q944	K936-T940 WeakPolarHBondContact O-CB 3.15Å; K936-T940 PolarHBondContact O-N 3.13Å; K936-T940 PolarHBondContact O-OG1 3.38Å; S937-T940 PolarHBondContact O-N 3.31Å; E938-T940 VanDerWaalsContact C-N 3.33Å; E938-T940 PolarHBondContact O-N 2.9Å; T940-C942 VanDerWaalsContact C-N 3.34Å; T940-C942 PolarHBondContact O-N 3.48Å; T940-A943 PolarHBondContact O-N 2.98Å; T940-Q944 WeakPolarHBondContact O-CB 3.43Å; T940-Q944 VanDerWaalsContact O-CG 3.31Å; T940-Q944 WeakPolarHBondContact O-CG 3.18Å; T940-Q944 PolarHBondContact O-N 2.89Å
941	N	65	Low	61.5	Low	79 Å²	79	93.4 Å²	93.4	42%	0.422	46%	0.459	S	S	.	.	H	α-helix	trans	-60	-43.6	172.3	-77.1	-19	0	0	0	111.4	S937 E938 Q944 R945	S937-N941 PolarHBondContact O-N 3.28Å; E938-N941 PolarHBondContact O-N 3.17Å; E938-N941 PolarHBondContact OE1-ND2 2.94Å; N941-Q944 PolarHBondContact O-N 2.97Å; N941-R945 PolarHBondContact O-N 3.31Å
942	C	55.7	Low	61.6	Low	72 Å²	72	93.5 Å²	93.5	49%	0.486	46%	0.461	S	S	.	.	H	α-helix	trans	-64.6	-46.1	178.6	-158.4	0	0	0	0	111.5	E938 L939 T940 Q944 R945 C946	E938-C942 WeakPolarHBondContact O-CB 3.43Å; E938-C942 PolarHBondContact O-N 3.18Å; L939-C942 PolarHBondContact O-N 2.86Å; T940-C942 VanDerWaalsContact C-N 3.34Å; T940-C942 PolarHBondContact O-N 3.48Å; C942-Q944 PolarHBondContact O-N 3.3Å; C942-R945 PolarHBondContact O-N 2.88Å; C942-R945 VanDerWaalsContact O-N 3.16Å; C942-C946 PolarHBondContact O-N 3.02Å; C942-C946 PolarHBondContact O-SG 2.96Å; C942-C946 VanDerWaalsContact O-SG 3.41Å
943	A	63	Low	61.6	Low	48 Å²	48	93.6 Å²	93.6	40%	0.397	47%	0.468	S	S	.	.	H	α-helix	trans	-62.6	-40	176.2	0	0	0	0	0	112.7	L939 T940 C946 H947	L939-A943 WeakPolarHBondContact O-CB 3.47Å; L939-A943 PolarHBondContact O-N 3.46Å; T940-A943 PolarHBondContact O-N 2.98Å; A943-C946 PolarHBondContact O-N 2.9Å; A943-H947 PolarHBondContact O-N 3.34Å
944	Q	66.7	Low	61.8	Low	114 Å²	114	94.9 Å²	94.9	53%	0.533	48%	0.478	S	S	.	.	H	α-helix	trans	-60.8	-44.6	172.2	-75.6	176.3	6.4	0	0	111.3	T940 N941 C942 C946 H947 E948	T940-Q944 WeakPolarHBondContact O-CB 3.43Å; T940-Q944 VanDerWaalsContact O-CG 3.31Å; T940-Q944 WeakPolarHBondContact O-CG 3.18Å; T940-Q944 PolarHBondContact O-N 2.89Å; N941-Q944 PolarHBondContact O-N 2.97Å; C942-Q944 PolarHBondContact O-N 3.3Å; Q944-C946 VanDerWaalsContact C-N 3.35Å; Q944-C946 PolarHBondContact O-N 2.67Å; Q944-H947 PolarHBondContact O-N 3.48Å; Q944-E948 WeakPolarHBondContact O-CG 3.49Å; Q944-E948 PolarHBondContact O-N 2.9Å
945	R	64.2	Low	62	Low	180 Å²	180	95.3 Å²	95.3	68%	0.679	48%	0.481	S	S	*	.	H	α-helix	trans	-65.5	-35.9	176.6	-125.9	166	74.5	177.5	3.1	112.6	N941 C942 L949	N941-R945 PolarHBondContact O-N 3.31Å; C942-R945 PolarHBondContact O-N 2.88Å; C942-R945 VanDerWaalsContact O-N 3.16Å; R945-L949 WeakPolarHBondContact O-CB 3.31Å; R945-L949 VanDerWaalsContact O-CG 3.24Å; R945-L949 WeakPolarHBondContact O-CG 3.47Å; R945-L949 PolarHBondContact O-N 3.02Å
946	C	59.1	Low	62.6	Low	66 Å²	66	91.7 Å²	91.7	45%	0.446	47%	0.465	S	S	.	.	H	α-helix	trans	-62.9	-47.3	171.3	-73.5	0	0	0	0	111.5	C942 A943 Q944 E948 L949 E950	C942-C946 PolarHBondContact O-N 3.02Å; C942-C946 PolarHBondContact O-SG 2.96Å; C942-C946 VanDerWaalsContact O-SG 3.41Å; A943-C946 PolarHBondContact O-N 2.9Å; Q944-C946 VanDerWaalsContact C-N 3.35Å; Q944-C946 PolarHBondContact O-N 2.67Å; C946-E948 PolarHBondContact O-N 3.21Å; C946-L949 CarbonylContact O-C 3.54Å; C946-L949 WeakPolarHBondContact O-CB 3.2Å; C946-L949 PolarHBondContact O-N 3.34Å; C946-E950 WeakPolarHBondContact O-CG 3.19Å; C946-E950 PolarHBondContact O-N 2.68Å
947	H	65.5	Low	62.1	Low	126 Å²	126	91.2 Å²	91.2	58%	0.583	48%	0.479	S	S	*	.	H	α-helix	trans	-66.8	-33.2	176.4	-77.5	-33.3	0	0	0	113.6	A943 Q944 E950 R951	A943-H947 PolarHBondContact O-N 3.34Å; Q944-H947 PolarHBondContact O-N 3.48Å; H947-E950 IonicContact CE1-OE2 3.76Å; H947-E950 IonicContact CG-OE2 3.32Å; H947-E950 IonicContact ND1-OE2 3.45Å; H947-E950 PolarHBondContact ND1-OE2 2.88Å; H947-R951 VanDerWaalsContact O-CB 3.23Å; H947-R951 WeakPolarHBondContact O-CB 3.46Å; H947-R951 PolarHBondContact O-N 2.82Å
948	E	62.7	Low	61.8	Low	114 Å²	114	95.2 Å²	95.2	53%	0.533	49%	0.49	S	S	.	.	H	α-helix	trans	-63.2	-43.2	170.3	-75.8	-173.8	153.8	0	0	111.3	Q944 C946 I952	Q944-E948 WeakPolarHBondContact O-CG 3.49Å; Q944-E948 PolarHBondContact O-N 2.9Å; C946-E948 PolarHBondContact O-N 3.21Å; E948-I952 WeakPolarHBondContact O-CB 3.39Å; E948-I952 WeakPolarHBondContact O-CD1 3.38Å; E948-I952 WeakPolarHBondContact O-CG1 3.38Å; E948-I952 PolarHBondContact O-N 2.86Å
949	L	57.6	Low	61.6	Low	101 Å²	101	94 Å²	94	53%	0.529	49%	0.487	S	S	.	.	H	α-helix	trans	-66.9	-42	175.9	-72.4	168.3	0	0	0	112.5	R945 C946 I952 C953	R945-L949 WeakPolarHBondContact O-CB 3.31Å; R945-L949 VanDerWaalsContact O-CG 3.24Å; R945-L949 WeakPolarHBondContact O-CG 3.47Å; R945-L949 PolarHBondContact O-N 3.02Å; C946-L949 CarbonylContact O-C 3.54Å; C946-L949 WeakPolarHBondContact O-CB 3.2Å; C946-L949 PolarHBondContact O-N 3.34Å; L949-I952 WeakPolarHBondContact O-CB 3.37Å; L949-I952 PolarHBondContact O-N 3.32Å; L949-C953 WeakPolarHBondContact O-CB 3.29Å; L949-C953 PolarHBondContact O-N 2.8Å; L949-C953 PolarHBondContact O-SG 3.4Å; L949-C953 VanDerWaalsContact O-SG 3.34Å
950	E	65.8	Low	61.8	Low	108 Å²	108	94.8 Å²	94.8	51%	0.505	50%	0.496	S	S	.	.	H	α-helix	trans	-61.5	-48.7	173.5	-76.2	178.4	144.5	0	0	111.1	C946 H947 I952 C953 D954	C946-E950 WeakPolarHBondContact O-CG 3.19Å; C946-E950 PolarHBondContact O-N 2.68Å; H947-E950 IonicContact CE1-OE2 3.76Å; H947-E950 IonicContact CG-OE2 3.32Å; H947-E950 IonicContact ND1-OE2 3.45Å; H947-E950 PolarHBondContact ND1-OE2 2.88Å; E950-I952 PolarHBondContact O-N 2.92Å; E950-C953 CarbonylContact O-C 3.46Å; E950-C953 WeakPolarHBondContact O-CA 3.24Å; E950-C953 WeakPolarHBondContact O-CB 3.37Å; E950-C953 PolarHBondContact O-N 3.46Å; E950-D954 PolarHBondContact O-N 2.8Å
951	R	71	Confident	60.9	Low	148 Å²	148	96.4 Å²	96.4	56%	0.558	50%	0.502	S	S	*	.	H	α-helix	trans	-59.7	-37.7	177	-169.9	-166.2	71.8	163.2	-1.1	111.4	H947 Q955	H947-R951 VanDerWaalsContact O-CB 3.23Å; H947-R951 WeakPolarHBondContact O-CB 3.46Å; H947-R951 PolarHBondContact O-N 2.82Å; R951-Q955 WeakPolarHBondContact O-CB 3.44Å; R951-Q955 WeakPolarHBondContact O-CG 3.3Å; R951-Q955 PolarHBondContact O-N 3.42Å; R951-Q955 VanDerWaalsContact O-N 3.08Å
952	I	64	Low	60.3	Low	67 Å²	67	98.5 Å²	98.5	34%	0.344	51%	0.513	S	S	.	.	H	α-helix	trans	-63.6	-52.3	171.6	-74.1	166.6	0	0	0	109.1	E948 L949 E950 D954 Q955 I956	E948-I952 WeakPolarHBondContact O-CB 3.39Å; E948-I952 WeakPolarHBondContact O-CD1 3.38Å; E948-I952 WeakPolarHBondContact O-CG1 3.38Å; E948-I952 PolarHBondContact O-N 2.86Å; L949-I952 WeakPolarHBondContact O-CB 3.37Å; L949-I952 PolarHBondContact O-N 3.32Å; E950-I952 PolarHBondContact O-N 2.92Å; I952-D954 PolarHBondContact O-N 3.43Å; I952-Q955 WeakPolarHBondContact O-CB 3.26Å; I952-Q955 PolarHBondContact O-N 3.44Å; I952-Q955 VanDerWaalsContact O-N 3.12Å; I952-I956 HydrophobicContact CG2-CD1 3.46Å; I952-I956 VanDerWaalsContact CG2-CD1 3.46Å; I952-I956 WeakPolarHBondContact O-CD1 3.35Å; I952-I956 WeakPolarHBondContact O-CG1 3.44Å; I952-I956 PolarHBondContact O-N 3.24Å; I952-I956 VanDerWaalsContact O-N 3.17Å
953	C	57.9	Low	60	Low	63 Å²	63	96.8 Å²	96.8	43%	0.426	50%	0.5	S	S	.	.	H	α-helix	trans	-55.5	-42.7	177.2	-72.8	0	0	0	0	113.8	L949 E950 I956 A957	L949-C953 WeakPolarHBondContact O-CB 3.29Å; L949-C953 PolarHBondContact O-N 2.8Å; L949-C953 PolarHBondContact O-SG 3.4Å; L949-C953 VanDerWaalsContact O-SG 3.34Å; E950-C953 CarbonylContact O-C 3.46Å; E950-C953 WeakPolarHBondContact O-CA 3.24Å; E950-C953 WeakPolarHBondContact O-CB 3.37Å; E950-C953 PolarHBondContact O-N 3.46Å; C953-I956 CarbonylContact O-C 3.5Å; C953-I956 WeakPolarHBondContact O-CA 3.49Å; C953-I956 WeakPolarHBondContact O-CB 3.27Å; C953-I956 PolarHBondContact O-N 2.76Å; C953-A957 PolarHBondContact O-N 3.18Å
954	D	66.1	Low	59.6	Low	116 Å²	116	97.9 Å²	97.9	62%	0.62	50%	0.496	S	S	*	.	H	α-helix	trans	-65.5	-39.1	176.6	-73.7	-18.6	0	0	0	112.3	E950 I952 I956 A957 H958	E950-D954 PolarHBondContact O-N 2.8Å; I952-D954 PolarHBondContact O-N 3.43Å; D954-I956 PolarHBondContact O-N 3.4Å; D954-A957 PolarHBondContact O-N 2.81Å; D954-H958 PolarHBondContact O-ND1 3.09Å
955	Q	62	Low	58.9	Low	111 Å²	111	96.9 Å²	96.9	52%	0.519	49%	0.488	S	S	.	.	H	α-helix	trans	-65.7	-12	172.1	-74.9	173.3	-2.4	0	0	113.2	R951 I952 H958	R951-Q955 WeakPolarHBondContact O-CB 3.44Å; R951-Q955 WeakPolarHBondContact O-CG 3.3Å; R951-Q955 PolarHBondContact O-N 3.42Å; R951-Q955 VanDerWaalsContact O-N 3.08Å; I952-Q955 WeakPolarHBondContact O-CB 3.26Å; I952-Q955 PolarHBondContact O-N 3.44Å; I952-Q955 VanDerWaalsContact O-N 3.12Å; Q955-H958 PolarHBondContact O-CE1 3.06Å; Q955-H958 PolarHBondContact O-NE2 2.91Å
956	I	61.2	Low	58.4	Low	14 Å²	14	91.3 Å²	91.3	7%	0.072	47%	0.473	C	S	.	.	H	α-helix	trans	-110.4	-22.5	-177.5	-59	164.2	0	0	0	111.9	I952 C953 D954 H958 L959 W965	I952-I956 HydrophobicContact CG2-CD1 3.46Å; I952-I956 VanDerWaalsContact CG2-CD1 3.46Å; I952-I956 WeakPolarHBondContact O-CD1 3.35Å; I952-I956 WeakPolarHBondContact O-CG1 3.44Å; I952-I956 PolarHBondContact O-N 3.24Å; I952-I956 VanDerWaalsContact O-N 3.17Å; C953-I956 CarbonylContact O-C 3.5Å; C953-I956 WeakPolarHBondContact O-CA 3.49Å; C953-I956 WeakPolarHBondContact O-CB 3.27Å; C953-I956 PolarHBondContact O-N 2.76Å; D954-I956 PolarHBondContact O-N 3.4Å; I956-H958 PolarHBondContact O-N 3.3Å; I956-L959 HydrophobicContact CG2-CD1 4.23Å; I956-L959 WeakPolarHBondContact O-CB 3.23Å; I956-L959 PolarHBondContact O-N 3.3Å; I956-W965 HydrophobicContact CB-CZ2 4.15Å; I956-W965 HydrophobicContact CD1-CH2 3.19Å; I956-W965 HydrophobicContact CD1-CZ2 3.22Å; I956-W965 HydrophobicContact CD1-CZ3 4.1Å; I956-W965 HydrophobicContact CG1-CH2 3.44Å; I956-W965 VanDerWaalsContact CG1-CH2 3.44Å; I956-W965 HydrophobicContact CG1-CZ2 3.31Å; I956-W965 HydrophobicContact CG2-CZ2 3.71Å
957	A	53.3	Low	57.9	Low	83 Å²	83	93 Å²	93	69%	0.686	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-9.6	-169	0	0	0	0	0	116	C953 D954	C953-A957 PolarHBondContact O-N 3.18Å; D954-A957 PolarHBondContact O-N 2.81Å
958	H	59.4	Low	57	Low	147 Å²	147	92.3 Å²	92.3	68%	0.681	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-0.4	179.5	46.3	-81.3	0	0	0	113.8	D954 Q955 I956	D954-H958 PolarHBondContact O-ND1 3.09Å; Q955-H958 PolarHBondContact O-CE1 3.06Å; Q955-H958 PolarHBondContact O-NE2 2.91Å; I956-H958 PolarHBondContact O-N 3.3Å
959	L	55.5	Low	56.1	Low	80 Å²	80	90.5 Å²	90.5	42%	0.419	46%	0.462	S	S	.	.	S	Bend	trans	-81.3	137.6	171.6	-71.2	167.4	0	0	0	109.9	I956 T963	I956-L959 HydrophobicContact CG2-CD1 4.23Å; I956-L959 WeakPolarHBondContact O-CB 3.23Å; I956-L959 PolarHBondContact O-N 3.3Å; L959-T963 HydrophobicContact CB-CG2 4.24Å; L959-T963 HydrophobicContact CD1-CG2 4.26Å; L959-T963 HydrophobicContact CD2-CG2 4.3Å; L959-T963 HydrophobicContact CG-CG2 4.5Å
960	P	55	Low	55.3	Low	87 Å²	87	91.3 Å²	91.3	57%	0.565	47%	0.473	S	S	*	.			trans	-55	151.7	176.8	-25.5	33.9	0	0	0	113.1	D962 T963	P960-D962 PolarHBondContact O-N 3.42Å; P960-T963 WeakPolarHBondContact CD-OG1 3.42Å; P960-T963 VanDerWaalsContact O-CB 3.25Å; P960-T963 WeakPolarHBondContact O-CB 3.5Å; P960-T963 PolarHBondContact O-N 2.81Å; P960-T963 PolarHBondContact O-OG1 2.93Å
961	D	49	Very low	54	Low	101 Å²	101	92.9 Å²	92.9	54%	0.54	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-21.6	176.3	-74	-52.7	0	0	0	112.5	T963	D961-T963 PolarHBondContact O-N 3.07Å
962	D	51.7	Low	52.9	Low	122 Å²	122	92.2 Å²	92.2	65%	0.652	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	3	176.5	-56.6	-37.6	0	0	0	114.4	P960	P960-D962 PolarHBondContact O-N 3.42Å
963	T	49.8	Very low	51.5	Low	36 Å²	36	95.1 Å²	95.1	22%	0.221	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-76.7	129.1	-171.1	-52.9	0	0	0	0	113.2	L959 P960 D961 W982	L959-T963 HydrophobicContact CB-CG2 4.24Å; L959-T963 HydrophobicContact CD1-CG2 4.26Å; L959-T963 HydrophobicContact CD2-CG2 4.3Å; L959-T963 HydrophobicContact CG-CG2 4.5Å; P960-T963 WeakPolarHBondContact CD-OG1 3.42Å; P960-T963 VanDerWaalsContact O-CB 3.25Å; P960-T963 WeakPolarHBondContact O-CB 3.5Å; P960-T963 PolarHBondContact O-N 2.81Å; P960-T963 PolarHBondContact O-OG1 2.93Å; D961-T963 PolarHBondContact O-N 3.07Å; T963-W982 PolarHBondContact O-N 3.16Å
964	F	53.5	Low	50.6	Low	71 Å²	71	99.5 Å²	99.5	31%	0.311	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	128.5	175.7	-69.3	-80.5	0	0	0	113	L979 Q981 C1011	F964-L979 HydrophobicContact CB-CD2 4.25Å; F964-L979 HydrophobicContact CB-CG 4.14Å; F964-L979 HydrophobicContact CD1-CD2 3.47Å; F964-L979 VanDerWaalsContact CD1-CD2 3.47Å; F964-L979 HydrophobicContact CD1-CG 3.9Å; F964-L979 HydrophobicContact CE1-CD2 3.91Å; F964-L979 HydrophobicContact CG-CD2 3.86Å; F964-L979 HydrophobicContact CG-CG 4.24Å; F964-Q981 HydrophobicContact CD1-CB 3.99Å; F964-Q981 HydrophobicContact CD1-CG 4.43Å; F964-Q981 HydrophobicContact CE1-CB 3.88Å; F964-Q981 HydrophobicContact CE1-CG 4.23Å; F964-C1011 VanDerWaalsContact CE2-O 3.31Å; F964-C1011 WeakPolarHBondContact CE2-O 3.3Å
965	W	51.8	Low	49.3	Very low	93 Å²	93	98 Å²	98	35%	0.352	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	129.9	165.8	-74.1	70.6	0	0	0	110	I956 L979 C980 W982	I956-W965 HydrophobicContact CB-CZ2 4.15Å; I956-W965 HydrophobicContact CD1-CH2 3.19Å; I956-W965 HydrophobicContact CD1-CZ2 3.22Å; I956-W965 HydrophobicContact CD1-CZ3 4.1Å; I956-W965 HydrophobicContact CG1-CH2 3.44Å; I956-W965 VanDerWaalsContact CG1-CH2 3.44Å; I956-W965 HydrophobicContact CG1-CZ2 3.31Å; I956-W965 HydrophobicContact CG2-CZ2 3.71Å; W965-L979 CarbonylContact O-C 3.53Å; W965-L979 WeakPolarHBondContact O-CA 3.42Å; W965-C980 WeakPolarHBondContact CA-O 3.36Å; W965-C980 HydrophobicContact CB-CB 4.39Å; W965-C980 VanDerWaalsContact CB-O 3.3Å; W965-C980 WeakPolarHBondContact CB-O 3.29Å; W965-C980 PolarHBondContact N-O 2.96Å; W965-C980 PolarHBondContact O-N 3.46Å; W965-W982 AromaticContact CD1-CE3 3.92Å; W965-W982 AromaticContact NE1-CE3 3.79Å
966	V	54	Low	48.4	Very low	63 Å²	63	98.7 Å²	98.7	38%	0.382	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	88.9	174.2	-156.9	0	0	0	0	109.6	K968 W977 L979	V966-K968 PolarHBondContact O-N 3.1Å; V966-W977 HydrophobicContact CB-CE3 4.19Å; V966-W977 HydrophobicContact CG1-CB 3.68Å; V966-W977 HydrophobicContact CG1-CD2 4.05Å; V966-W977 HydrophobicContact CG1-CE3 3.38Å; V966-W977 HydrophobicContact CG1-CG 4.24Å; V966-W977 HydrophobicContact CG1-CZ3 4.18Å; V966-L979 HydrophobicContact CB-CD1 4.45Å; V966-L979 HydrophobicContact CG1-CD1 4.07Å; V966-L979 HydrophobicContact CG2-CD1 3.79Å
967	Q	48.3	Very low	47.9	Very low	102 Å²	102	105.3 Å²	105.3	48%	0.477	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	111.1	176.9	-173.9	-172.1	53.1	0	0	109.5	Q969 N978	Q967-Q969 HydrophobicContact CG-CG 4.36Å; Q967-Q969 PolarHBondContact O-N 3.14Å; Q967-Q969 VanDerWaalsContact OE1-NE2 3.14Å; Q967-N978 HydrophobicContact CB-CB 4.34Å; Q967-N978 PolarHBondContact N-O 2.83Å; Q967-N978 PolarHBondContact O-N 3.42Å
968	K	47.5	Very low	47.5	Very low	112 Å²	112	103 Å²	103	49%	0.487	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	111.5	164.6	-83.4	-177.4	163.6	150	0	109.6	V966 N975 W977	V966-K968 PolarHBondContact O-N 3.1Å; K968-N975 HydrophobicContact CD-CB 4.31Å; K968-N975 HydrophobicContact CG-CB 4.12Å; K968-W977 HydrophobicContact CD-CE3 4.26Å; K968-W977 HydrophobicContact CD-CH2 4.38Å; K968-W977 HydrophobicContact CD-CZ3 4.1Å; K968-W977 VanDerWaalsContact CE-CZ2 3.41Å; K968-W977 VanDerWaalsContact CE-CZ3 3.41Å; K968-W977 HydrophobicContact CG-CD2 4Å; K968-W977 HydrophobicContact CG-CE3 3.53Å; K968-W977 HydrophobicContact CG-CH2 4.5Å; K968-W977 HydrophobicContact CG-CZ3 3.85Å
969	Q	44.2	Very low	46.9	Very low	75 Å²	75	99.1 Å²	99.1	35%	0.35	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	133.7	160.3	-73.2	-176.6	-13.8	0	0	109.2	Q967 Y971 R976 N978	Q967-Q969 HydrophobicContact CG-CG 4.36Å; Q967-Q969 PolarHBondContact O-N 3.14Å; Q967-Q969 VanDerWaalsContact OE1-NE2 3.14Å; Q969-Y971 PolarHBondContact O-N 3.21Å; Q969-R976 HydrophobicContact CB-CB 4.5Å; Q969-R976 PolarHBondContact N-O 3.43Å; Q969-R976 PolarHBondContact O-N 3.45Å; Q969-N978 PolarHBondContact NE2-ND2 3.33Å; Q969-N978 PolarHBondContact OE1-ND2 2.86Å
970	P	39.7	Very low	46.4	Very low	119 Å²	119	98.2 Å²	98.2	77%	0.773	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58	130.1	165.2	-19.9	32.1	0	0	0	109.5
971	Y	38.5	Very low	46.1	Very low	141 Å²	141	98 Å²	98	55%	0.553	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.7	103.1	176.4	-176.2	-94.5	0	0	0	109.5	Q969 D973 R974 R976	Q969-Y971 PolarHBondContact O-N 3.21Å; Y971-D973 PolarHBondContact O-N 3.32Å; Y971-R974 CarbonylContact C-O 3.6Å; Y971-R974 PolarHBondContact N-O 3.09Å; Y971-R974 PolarHBondContact O-N 3.32Å; Y971-R976 HydrophobicContact CG-CB 4.24Å
972	V	49.3	Very low	45.9	Very low	133 Å²	133	98.3 Å²	98.3	81%	0.806	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	-104.1	-175	-166.9	0	0	0	0	110.8
973	D	34.5	Very low	45.5	Very low	129 Å²	129	99.7 Å²	99.7	69%	0.69	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	1.7	-177.6	64.6	-42	0	0	0	112.9	Y971	Y971-D973 PolarHBondContact O-N 3.32Å
974	R	37.5	Very low	45.1	Very low	155 Å²	155	103.6 Å²	103.6	59%	0.585	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.3	169.4	-174.3	-62.6	-173.7	-176.8	-154.5	-1.9	112.1	Y971	Y971-R974 CarbonylContact C-O 3.6Å; Y971-R974 PolarHBondContact N-O 3.09Å; Y971-R974 PolarHBondContact O-N 3.32Å
975	N	40	Very low	44.5	Very low	83 Å²	83	107.6 Å²	107.6	44%	0.444	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	119.2	167.5	-67.8	-62.1	0	0	0	109.4	K968 W977	K968-N975 HydrophobicContact CD-CB 4.31Å; K968-N975 HydrophobicContact CG-CB 4.12Å; N975-W977 VanDerWaalsContact O-CD1 3.28Å
976	R	42.1	Very low	44	Very low	126 Å²	126	114.1 Å²	114.1	48%	0.475	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	118.7	160.4	176.2	178	177.1	165	2.6	107.4	Q969 Y971 N978	Q969-R976 HydrophobicContact CB-CB 4.5Å; Q969-R976 PolarHBondContact N-O 3.43Å; Q969-R976 PolarHBondContact O-N 3.45Å; Y971-R976 HydrophobicContact CG-CB 4.24Å; R976-N978 PolarHBondContact NE-OD1 3.05Å
977	W	51.3	Low	43.7	Very low	154 Å²	154	117.8 Å²	117.8	58%	0.583	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	102.9	176.6	-58.8	89.6	0	0	0	108	V966 K968 N975	V966-W977 HydrophobicContact CB-CE3 4.19Å; V966-W977 HydrophobicContact CG1-CB 3.68Å; V966-W977 HydrophobicContact CG1-CD2 4.05Å; V966-W977 HydrophobicContact CG1-CE3 3.38Å; V966-W977 HydrophobicContact CG1-CG 4.24Å; V966-W977 HydrophobicContact CG1-CZ3 4.18Å; K968-W977 HydrophobicContact CD-CE3 4.26Å; K968-W977 HydrophobicContact CD-CH2 4.38Å; K968-W977 HydrophobicContact CD-CZ3 4.1Å; K968-W977 VanDerWaalsContact CE-CZ2 3.41Å; K968-W977 VanDerWaalsContact CE-CZ3 3.41Å; K968-W977 HydrophobicContact CG-CD2 4Å; K968-W977 HydrophobicContact CG-CE3 3.53Å; K968-W977 HydrophobicContact CG-CH2 4.5Å; K968-W977 HydrophobicContact CG-CZ3 3.85Å; N975-W977 VanDerWaalsContact O-CD1 3.28Å
978	N	45.1	Very low	43.8	Very low	34 Å²	34	118.2 Å²	118.2	18%	0.182	55%	0.55	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	115.5	171.5	-65.7	-30.5	0	0	0	108.2	Q967 Q969 R976	Q967-N978 HydrophobicContact CB-CB 4.34Å; Q967-N978 PolarHBondContact N-O 2.83Å; Q967-N978 PolarHBondContact O-N 3.42Å; Q969-N978 PolarHBondContact NE2-ND2 3.33Å; Q969-N978 PolarHBondContact OE1-ND2 2.86Å; R976-N978 PolarHBondContact NE-OD1 3.05Å
979	L	46.3	Very low	44.6	Very low	66 Å²	66	117.1 Å²	117.1	35%	0.346	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.3	127.2	171.6	-137.1	84.4	0	0	0	109	F964 W965 V966 F1012	F964-L979 HydrophobicContact CB-CD2 4.25Å; F964-L979 HydrophobicContact CB-CG 4.14Å; F964-L979 HydrophobicContact CD1-CD2 3.47Å; F964-L979 VanDerWaalsContact CD1-CD2 3.47Å; F964-L979 HydrophobicContact CD1-CG 3.9Å; F964-L979 HydrophobicContact CE1-CD2 3.91Å; F964-L979 HydrophobicContact CG-CD2 3.86Å; F964-L979 HydrophobicContact CG-CG 4.24Å; W965-L979 CarbonylContact O-C 3.53Å; W965-L979 WeakPolarHBondContact O-CA 3.42Å; V966-L979 HydrophobicContact CB-CD1 4.45Å; V966-L979 HydrophobicContact CG1-CD1 4.07Å; V966-L979 HydrophobicContact CG2-CD1 3.79Å; L979-F1012 HydrophobicContact CD2-CD1 3.64Å; L979-F1012 HydrophobicContact CD2-CE1 3.24Å; L979-F1012 HydrophobicContact CD2-CZ 4.09Å
980	C	45.8	Very low	45.8	Very low	61 Å²	61	117.9 Å²	117.9	41%	0.412	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-136.6	118.5	179.1	-65.7	0	0	0	0	109.2	W965	W965-C980 WeakPolarHBondContact CA-O 3.36Å; W965-C980 HydrophobicContact CB-CB 4.39Å; W965-C980 VanDerWaalsContact CB-O 3.3Å; W965-C980 WeakPolarHBondContact CB-O 3.29Å; W965-C980 PolarHBondContact N-O 2.96Å; W965-C980 PolarHBondContact O-N 3.46Å
981	Q	48	Very low	47.7	Very low	82 Å²	82	118.4 Å²	118.4	38%	0.383	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.5	139.4	176.5	-166.9	176.4	-8.3	0	0	110.4	F964	F964-Q981 HydrophobicContact CD1-CB 3.99Å; F964-Q981 HydrophobicContact CD1-CG 4.43Å; F964-Q981 HydrophobicContact CE1-CB 3.88Å; F964-Q981 HydrophobicContact CE1-CG 4.23Å
982	W	46	Very low	50	Low	108 Å²	108	118.8 Å²	118.8	41%	0.409	55%	0.551	S	S	.	*	S	Bend	trans	-71.8	129.1	172	-156.2	-113.9	0	0	0	109	T963 W965	T963-W982 PolarHBondContact O-N 3.16Å; W965-W982 AromaticContact CD1-CE3 3.92Å; W965-W982 AromaticContact NE1-CE3 3.79Å
983	K	42.9	Very low	52	Low	151 Å²	151	113.7 Å²	113.7	66%	0.657	52%	0.519	S	S	*	.	S	Bend	trans	48.4	84	174	-66.4	179.4	178.5	171	0	119.5
984	E	40.8	Very low	54.7	Low	117 Å²	117	110.1 Å²	110.1	55%	0.547	50%	0.5	S	S	.	.			trans	156.7	64.7	132.9	-85.5	-143.7	148	0	0	112.1	R986 K987	E984-R986 PolarHBondContact O-N 3.44Å; E984-K987 IonicContact OE1-NZ 3.12Å; E984-K987 PolarHBondContact OE1-NZ 3.19Å; E984-K987 WeakPolarHBondContact OE2-CD 3.23Å; E984-K987 IonicContact OE2-NZ 2.71Å; E984-K987 PolarHBondContact OE2-NZ 3.18Å
985	I	40.6	Very low	57.4	Low	156 Å²	156	102.7 Å²	102.7	80%	0.8	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-3.3	174.1	-65.8	173.9	0	0	0	113
986	R	42.5	Very low	60	Low	230 Å²	230	101.3 Å²	101.3	87%	0.868	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	4.2	-172.4	-69.6	-168.5	176.1	-165.8	-0.9	116.4	E984	E984-R986 PolarHBondContact O-N 3.44Å
987	K	47.6	Very low	62.4	Low	140 Å²	140	95.4 Å²	95.4	61%	0.609	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.1	-26.8	-179.6	-67.5	-155.1	-167.4	104.9	0	118.1	E984	E984-K987 IonicContact OE1-NZ 3.12Å; E984-K987 PolarHBondContact OE1-NZ 3.19Å; E984-K987 WeakPolarHBondContact OE2-CD 3.23Å; E984-K987 IonicContact OE2-NZ 2.71Å; E984-K987 PolarHBondContact OE2-NZ 3.18Å
988	N	49.3	Very low	64.2	Low	110 Å²	110	95.1 Å²	95.1	59%	0.588	44%	0.443	S	S	*	.	S	Bend	trans	-123.7	117.2	174.5	-82	-23.9	0	0	0	110.4	T990	N988-T990 PolarHBondContact O-N 3.45Å
989	P	64	Low	66.2	Low	89 Å²	89	94.7 Å²	94.7	58%	0.578	44%	0.441	S	S	*	.			trans	-66.9	130.5	171.7	28.2	-32.4	0	0	0	109.9	A1036	P989-A1036 PolarHBondContact O-N 2.82Å
990	T	70.7	Confident	68	Low	91 Å²	91	94.7 Å²	94.7	56%	0.558	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	141.8	165.1	53.2	0	0	0	0	109.7	N988 V1034 P1035	N988-T990 PolarHBondContact O-N 3.45Å; T990-V1034 CarbonylContact C-O 3.55Å; T990-V1034 WeakPolarHBondContact CA-O 3.47Å; T990-P1035 HydrophobicContact CG2-CG 4.41Å
991	R	79.6	Confident	70	Confident	130 Å²	130	98.6 Å²	98.6	49%	0.491	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	136.4	179.8	-160.4	166.3	173.4	-174.5	-5.9	109.6	I993 V1034 I1071 D1072	R991-I993 HydrophobicContact CB-CD1 4.42Å; R991-I993 HydrophobicContact CG-CD1 4.21Å; R991-I993 PolarHBondContact O-N 3.43Å; R991-V1034 PolarHBondContact N-O 3.45Å; R991-V1034 PolarHBondContact O-N 2.95Å; R991-I1071 HydrophobicContact CB-CG2 3.61Å; R991-I1071 HydrophobicContact CG-CG2 4.4Å; R991-D1072 VanDerWaalsContact CD-O 3.31Å; R991-D1072 WeakPolarHBondContact CD-O 3.37Å; R991-D1072 PolarHBondContact NH1-O 2.96Å
992	R	86	Confident	71.8	Confident	149 Å²	149	94.8 Å²	94.8	56%	0.562	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	115.3	179	-176.4	156	-69.7	178.6	0.8	110.3	W1031 D1033	R992-W1031 HydrophobicContact CG-CB 4.48Å; R992-W1031 HydrophobicContact CG-CD2 4.22Å; R992-W1031 HydrophobicContact CG-CE3 3.46Å; R992-W1031 VanDerWaalsContact CG-CE3 3.46Å; R992-W1031 HydrophobicContact CG-CZ3 3.97Å; R992-D1033 WeakPolarHBondContact CA-OD1 3.31Å; R992-D1033 WeakPolarHBondContact CB-OD1 3.5Å; R992-D1033 WeakPolarHBondContact CG-OD1 3.43Å; R992-D1033 IonicContact CZ-OD1 3.18Å; R992-D1033 IonicContact CZ-OD2 2.8Å; R992-D1033 IonicContact NE-OD1 2.69Å; R992-D1033 PolarHBondContact NE-OD1 2.99Å; R992-D1033 IonicContact NE-OD2 3.63Å; R992-D1033 IonicContact NH2-OD1 2.65Å; R992-D1033 PolarHBondContact NH2-OD1 3.03Å; R992-D1033 IonicContact NH2-OD2 2.9Å; R992-D1033 PolarHBondContact NH2-OD2 3.47Å
993	I	90.6	Very high	73.9	Confident	27 Å²	27	97.3 Å²	97.3	14%	0.138	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	142.2	-173	-58.2	-61.5	0	0	0	110.6	R991 F995 W1031 V1032 V1034 I1069 I1071	R991-I993 HydrophobicContact CB-CD1 4.42Å; R991-I993 HydrophobicContact CG-CD1 4.21Å; R991-I993 PolarHBondContact O-N 3.43Å; I993-F995 HydrophobicContact CB-CE2 4.06Å; I993-F995 HydrophobicContact CG2-CD2 4.18Å; I993-F995 HydrophobicContact CG2-CE2 3.66Å; I993-F995 HydrophobicContact CG2-CZ 3.97Å; I993-W1031 VanDerWaalsContact C-CE3 3.48Å; I993-W1031 WeakPolarHBondContact O-CA 3.46Å; I993-V1032 PolarHBondContact N-O 3.21Å; I993-V1032 PolarHBondContact O-N 3.27Å; I993-V1034 HydrophobicContact CB-CG2 4.22Å; I993-V1034 HydrophobicContact CG1-CB 4.3Å; I993-V1034 HydrophobicContact CG1-CG2 4.26Å; I993-I1069 HydrophobicContact CG2-CD1 3.96Å; I993-I1071 HydrophobicContact CD1-CD1 3.67Å; I993-I1071 HydrophobicContact CG1-CD1 3.6Å; I993-I1071 HydrophobicContact CG1-CG1 4.43Å
994	L	93	Very high	76.1	Confident	53 Å²	53	94.6 Å²	94.6	28%	0.277	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	116.5	179.2	-177.9	53.7	0	0	0	109.7	E996 Y1029 W1031	L994-E996 HydrophobicContact CD1-CG 4.23Å; L994-E996 VanDerWaalsContact CD2-OE1 3.25Å; L994-E996 WeakPolarHBondContact CD2-OE1 3.43Å; L994-E996 HydrophobicContact CG-CG 4.02Å; L994-Y1029 HydrophobicContact CD1-CD2 4.09Å; L994-W1031 HydrophobicContact CB-CD2 4.1Å; L994-W1031 HydrophobicContact CB-CE3 3.75Å; L994-W1031 HydrophobicContact CB-CH2 3.82Å; L994-W1031 HydrophobicContact CB-CZ2 4.11Å; L994-W1031 HydrophobicContact CB-CZ3 3.63Å; L994-W1031 HydrophobicContact CD1-CD2 4Å; L994-W1031 HydrophobicContact CD1-CG 4.27Å; L994-W1031 HydrophobicContact CD1-CZ2 4.33Å; L994-W1031 HydrophobicContact CD2-CH2 4.1Å; L994-W1031 HydrophobicContact CD2-CZ2 3.79Å; L994-W1031 HydrophobicContact CG-CH2 4.49Å; L994-W1031 HydrophobicContact CG-CZ2 4.32Å
995	F	93.9	Very high	78.6	Confident	0 Å²	0	89 Å²	89	0%	0	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	129.9	171	-67.5	-92.9	0	0	0	108.8	I993 L1007 L1009 M1020 Y1029 L1030 V1032 V1034 F1041 Y1055 I1069	I993-F995 HydrophobicContact CB-CE2 4.06Å; I993-F995 HydrophobicContact CG2-CD2 4.18Å; I993-F995 HydrophobicContact CG2-CE2 3.66Å; I993-F995 HydrophobicContact CG2-CZ 3.97Å; F995-L1007 HydrophobicContact CB-CD1 4.39Å; F995-L1007 HydrophobicContact CB-CD2 3.66Å; F995-L1007 HydrophobicContact CD1-CD1 4Å; F995-L1007 HydrophobicContact CD1-CD2 4.02Å; F995-L1007 HydrophobicContact CD2-CD2 3.57Å; F995-L1007 HydrophobicContact CE2-CD2 4.23Å; F995-L1007 HydrophobicContact CG-CD1 4.21Å; F995-L1007 HydrophobicContact CG-CD2 3.46Å; F995-L1007 VanDerWaalsContact CG-CD2 3.46Å; F995-L1009 HydrophobicContact CE1-CD2 4.03Å; F995-L1009 HydrophobicContact CE2-CD2 4.12Å; F995-L1009 HydrophobicContact CZ-CD2 3.55Å; F995-M1020 HydrophobicContact CB-CE 4.32Å; F995-M1020 VanDerWaalsContact O-CE 3.26Å; F995-M1020 WeakPolarHBondContact O-CE 3.48Å; F995-Y1029 CarbonylContact O-C 3.55Å; F995-Y1029 WeakPolarHBondContact O-CA 3.43Å; F995-L1030 PolarHBondContact N-O 2.93Å; F995-L1030 PolarHBondContact O-N 3.42Å; F995-V1032 HydrophobicContact CD2-CB 4.36Å; F995-V1032 HydrophobicContact CD2-CG2 4.11Å; F995-V1032 HydrophobicContact CE2-CB 4.18Å; F995-V1032 HydrophobicContact CE2-CG2 4.34Å; F995-V1034 HydrophobicContact CE2-CG2 4.04Å; F995-V1034 HydrophobicContact CZ-CG2 4.36Å; F995-F1041 HydrophobicContact CD1-CD2 4Å; F995-F1041 HydrophobicContact CD1-CE1 4.45Å; F995-F1041 AromaticContact CD1-CE2 3.79Å; F995-F1041 HydrophobicContact CD1-CE2 3.79Å; F995-F1041 HydrophobicContact CD1-CG 4.41Å; F995-F1041 HydrophobicContact CD1-CZ 4.02Å; F995-F1041 AromaticContact CE1-CD1 3.86Å; F995-F1041 HydrophobicContact CE1-CD1 3.86Å; F995-F1041 HydrophobicContact CE1-CD2 4Å; F995-F1041 AromaticContact CE1-CE1 3.82Å; F995-F1041 HydrophobicContact CE1-CE1 3.82Å; F995-F1041 AromaticContact CE1-CE2 3.95Å; F995-F1041 HydrophobicContact CE1-CE2 3.95Å; F995-F1041 AromaticContact CE1-CG 3.95Å; F995-F1041 HydrophobicContact CE1-CG 3.95Å; F995-F1041 AromaticContact CE1-CZ 3.85Å; F995-F1041 HydrophobicContact CE1-CZ 3.85Å; F995-Y1055 WeakPolarHBondContact CA-OH 3.17Å; F995-I1069 HydrophobicContact CE1-CG2 4.36Å; F995-I1069 HydrophobicContact CZ-CG2 4.27Å
996	E	93.8	Very high	81.1	Confident	54 Å²	54	84.8 Å²	84.8	25%	0.252	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	148.9	179.5	-69.6	-172.3	-172.9	0	0	111.4	L994 R1023 T1027 W1028 Y1055	L994-E996 HydrophobicContact CD1-CG 4.23Å; L994-E996 VanDerWaalsContact CD2-OE1 3.25Å; L994-E996 WeakPolarHBondContact CD2-OE1 3.43Å; L994-E996 HydrophobicContact CG-CG 4.02Å; E996-R1023 IonicContact OE1-CZ 2.88Å; E996-R1023 IonicContact OE1-NH1 2.84Å; E996-R1023 PolarHBondContact OE1-NH1 3.47Å; E996-R1023 IonicContact OE1-NH2 3.58Å; E996-R1023 PolarHBondContact OE1-NH2 2.88Å; E996-R1023 IonicContact OE2-NH1 2.65Å; E996-R1023 PolarHBondContact OE2-NH1 3.45Å; E996-R1023 VanDerWaalsContact OE2-NH1 3.08Å; E996-T1027 HydrophobicContact CB-CG2 4.19Å; E996-W1028 CarbonylContact C-O 3.49Å; E996-W1028 WeakPolarHBondContact CA-O 3.22Å; E996-Y1055 PolarHBondContact N-OH 3.42Å; E996-Y1055 VanDerWaalsContact O-CE2 3.31Å; E996-Y1055 WeakPolarHBondContact O-CE2 3.33Å; E996-Y1055 PolarHBondContact O-OH 3.36Å; E996-Y1055 VanDerWaalsContact O-OH 3.13Å
997	T	92.8	Very high	83.5	Confident	2 Å²	2	73.8 Å²	73.8	1%	0.012	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	145.3	171.3	-175.6	0	0	0	0	112.1	L999 I1005 M1020 W1028 F1043	T997-L999 HydrophobicContact CG2-CD1 4.28Å; T997-L999 PolarHBondContact O-N 3.42Å; T997-I1005 HydrophobicContact CG2-CD1 3.88Å; T997-I1005 HydrophobicContact CG2-CG2 4.24Å; T997-M1020 HydrophobicContact CG2-SD 4.3Å; T997-W1028 HydrophobicContact CG2-CB 4.01Å; T997-W1028 PolarHBondContact N-O 3.48Å; T997-W1028 PolarHBondContact O-N 2.82Å; T997-F1043 HydrophobicContact CG2-CD1 3.78Å; T997-F1043 HydrophobicContact CG2-CE1 3.88Å; T997-F1043 HydrophobicContact CG2-CG 4.12Å; T997-F1043 HydrophobicContact CG2-CZ 4.31Å
998	K	89.8	Confident	85.6	Confident	147 Å²	147	67.2 Å²	67.2	64%	0.639	33%	0.328	S	S	*	.			trans	-99.6	80.6	-176.2	-70.2	174.5	-175.1	157.4	0	111.4	T1027	K998-T1027 HydrophobicContact CG-CG2 4.31Å
999	L	86.9	Confident	87.6	Confident	26 Å²	26	62 Å²	62	14%	0.136	30%	0.3	C	S	.	.			trans	-128.5	74.2	178.8	-71.9	170.7	0	0	0	109.4	T997 D1001 A1002 I1005 W1028 Q1045	T997-L999 HydrophobicContact CG2-CD1 4.28Å; T997-L999 PolarHBondContact O-N 3.42Å; L999-D1001 VanDerWaalsContact C-N 3.26Å; L999-D1001 PolarHBondContact O-N 2.93Å; L999-A1002 HydrophobicContact CB-CB 4.26Å; L999-A1002 WeakPolarHBondContact O-CB 3.32Å; L999-A1002 PolarHBondContact O-N 2.84Å; L999-I1005 HydrophobicContact CB-CD1 3.57Å; L999-I1005 HydrophobicContact CD1-CD1 3.72Å; L999-I1005 HydrophobicContact CG-CD1 4.27Å; L999-W1028 PolarHBondContact O-NE1 2.79Å; L999-Q1045 HydrophobicContact CD1-CB 4.39Å
1000	P	83.7	Confident	88.6	Confident	65 Å²	65	59.6 Å²	59.6	42%	0.422	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-26.4	-170	27.3	-35.8	0	0	0	113.7	R1022	P1000-R1022 PolarHBondContact O-NH1 3.2Å
1001	D	86.7	Confident	89.1	Confident	144 Å²	144	56 Å²	56	77%	0.77	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-4.1	-178	-56.7	-42.4	0	0	0	113.5	L999	L999-D1001 VanDerWaalsContact C-N 3.26Å; L999-D1001 PolarHBondContact O-N 2.93Å
1002	A	87.2	Confident	88.9	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.008	25%	0.245	C	C	.	.			trans	-69.3	145.6	177.3	0	0	0	0	0	112.2	L999 I1005 W1028 Q1045 D1046	L999-A1002 HydrophobicContact CB-CB 4.26Å; L999-A1002 WeakPolarHBondContact O-CB 3.32Å; L999-A1002 PolarHBondContact O-N 2.84Å; A1002-I1005 HydrophobicContact CB-CD1 3.78Å; A1002-I1005 HydrophobicContact CB-CG1 3.71Å; A1002-W1028 HydrophobicContact CB-CZ2 4.24Å; A1002-W1028 WeakPolarHBondContact O-CZ2 3.46Å; A1002-Q1045 HydrophobicContact CB-CG 3.77Å; A1002-D1046 WeakPolarHBondContact CA-OD2 3.45Å
1003	H	88.5	Confident	88.4	Confident	162 Å²	162	49.1 Å²	49.1	75%	0.75	25%	0.247	S	C	*	.	S	Bend	trans	-86.2	-40.9	169.6	-73.8	-79.5	0	0	0	112.2	W1028 D1046	H1003-W1028 WeakPolarHBondContact O-CH2 3.42Å; H1003-D1046 WeakPolarHBondContact CA-OD1 3.38Å; H1003-D1046 WeakPolarHBondContact CB-OD1 3.47Å; H1003-D1046 PolarHBondContact N-OD1 3.4Å; H1003-D1046 PolarHBondContact N-OD2 2.91Å
1004	Q	90.5	Very high	88	Confident	93 Å²	93	52.1 Å²	52.1	44%	0.435	26%	0.257	S	S	.	.			trans	-144.5	140.5	176.6	-61.4	-176	5.8	0	0	110.6	Y1006 L1019 D1046	Q1004-Y1006 HydrophobicContact CB-CE2 3.97Å; Q1004-Y1006 PolarHBondContact OE1-OH 2.95Å; Q1004-L1019 HydrophobicContact CB-CD1 4.24Å; Q1004-D1046 PolarHBondContact N-OD1 3.2Å; Q1004-D1046 PolarHBondContact O-N 2.84Å
1005	I	92.7	Very high	87	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	129.3	172	-53.3	-167.6	0	0	0	109.4	T997 L999 A1002 M1020 W1028 F1043 M1044	T997-I1005 HydrophobicContact CG2-CD1 3.88Å; T997-I1005 HydrophobicContact CG2-CG2 4.24Å; L999-I1005 HydrophobicContact CB-CD1 3.57Å; L999-I1005 HydrophobicContact CD1-CD1 3.72Å; L999-I1005 HydrophobicContact CG-CD1 4.27Å; A1002-I1005 HydrophobicContact CB-CD1 3.78Å; A1002-I1005 HydrophobicContact CB-CG1 3.71Å; I1005-M1020 HydrophobicContact CB-CB 4.48Å; I1005-M1020 HydrophobicContact CB-SD 4.29Å; I1005-M1020 HydrophobicContact CG2-CG 4.35Å; I1005-M1020 HydrophobicContact CG2-SD 3.62Å; I1005-M1020 WeakPolarHBondContact O-CB 3.28Å; I1005-M1020 PolarHBondContact O-N 2.79Å; I1005-W1028 HydrophobicContact CB-CD2 4.09Å; I1005-W1028 HydrophobicContact CB-CE3 4.13Å; I1005-W1028 HydrophobicContact CB-CG 4.3Å; I1005-W1028 HydrophobicContact CD1-CB 4.02Å; I1005-W1028 HydrophobicContact CD1-CD2 3.84Å; I1005-W1028 HydrophobicContact CD1-CG 3.47Å; I1005-W1028 VanDerWaalsContact CD1-CG 3.47Å; I1005-W1028 HydrophobicContact CG1-CD2 3.77Å; I1005-W1028 HydrophobicContact CG1-CE3 4.23Å; I1005-W1028 HydrophobicContact CG1-CG 3.95Å; I1005-W1028 HydrophobicContact CG1-CZ2 4.37Å; I1005-F1043 HydrophobicContact CG2-CB 4.08Å; I1005-F1043 HydrophobicContact CG2-CD1 4.06Å; I1005-F1043 HydrophobicContact CG2-CG 4.5Å; I1005-M1044 WeakPolarHBondContact CA-O 3.46Å
1006	Y	93.3	Very high	86	Confident	67 Å²	67	59.1 Å²	59.1	26%	0.263	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	146.4	170.5	-59.4	-98.9	0	0	0	110.2	Q1004 A1017 L1018 L1019 F1043 M1044	Q1004-Y1006 HydrophobicContact CB-CE2 3.97Å; Q1004-Y1006 PolarHBondContact OE1-OH 2.95Å; Y1006-A1017 HydrophobicContact CD1-CB 4.05Å; Y1006-A1017 HydrophobicContact CG-CB 4.31Å; Y1006-L1018 CarbonylContact C-O 3.56Å; Y1006-L1018 VanDerWaalsContact CA-O 3.28Å; Y1006-L1018 WeakPolarHBondContact CA-O 3.37Å; Y1006-L1019 HydrophobicContact CD1-CB 4.14Å; Y1006-L1019 HydrophobicContact CD1-CD1 4.31Å; Y1006-L1019 HydrophobicContact CE1-CB 3.95Å; Y1006-L1019 HydrophobicContact CE1-CD1 3.86Å; Y1006-L1019 HydrophobicContact CE1-CG 4.48Å; Y1006-L1019 HydrophobicContact CE2-CD1 4.14Å; Y1006-F1043 CarbonylContact O-C 3.58Å; Y1006-F1043 WeakPolarHBondContact O-CA 3.3Å; Y1006-M1044 PolarHBondContact N-O 3.45Å; Y1006-M1044 PolarHBondContact O-N 3.13Å
1007	L	93.3	Very high	85.6	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	124.5	170.6	176.8	68.7	0	0	0	108.8	F995 L1009 L1018 M1020 L1030 V1032 F1041 F1043	F995-L1007 HydrophobicContact CB-CD1 4.39Å; F995-L1007 HydrophobicContact CB-CD2 3.66Å; F995-L1007 HydrophobicContact CD1-CD1 4Å; F995-L1007 HydrophobicContact CD1-CD2 4.02Å; F995-L1007 HydrophobicContact CD2-CD2 3.57Å; F995-L1007 HydrophobicContact CE2-CD2 4.23Å; F995-L1007 HydrophobicContact CG-CD1 4.21Å; F995-L1007 HydrophobicContact CG-CD2 3.46Å; F995-L1007 VanDerWaalsContact CG-CD2 3.46Å; L1007-L1009 HydrophobicContact CD2-CD1 3.73Å; L1007-L1009 HydrophobicContact CD2-CG 4.46Å; L1007-L1009 HydrophobicContact CG-CD1 3.76Å; L1007-L1009 HydrophobicContact CG-CG 4.23Å; L1007-L1018 PolarHBondContact N-O 3.23Å; L1007-L1018 PolarHBondContact O-N 3.29Å; L1007-M1020 HydrophobicContact CB-CG 4.23Å; L1007-M1020 HydrophobicContact CB-SD 4.3Å; L1007-L1030 HydrophobicContact CB-CD2 4.29Å; L1007-L1030 HydrophobicContact CD2-CD2 4.08Å; L1007-V1032 HydrophobicContact CD2-CG2 3.96Å; L1007-F1041 HydrophobicContact CD1-CB 4.23Å; L1007-F1041 HydrophobicContact CD1-CD2 3.7Å; L1007-F1041 HydrophobicContact CD1-CG 4.32Å; L1007-F1043 HydrophobicContact CD1-CD1 4.16Å; L1007-F1043 HydrophobicContact CD1-CE1 3.86Å; L1007-F1043 HydrophobicContact CD1-CZ 4.42Å
1008	C	91.7	Very high	85.4	Confident	2 Å²	2	61 Å²	61	1%	0.014	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	132.9	175.1	-54.1	0	0	0	0	108.9	W1014 F1041 R1042 W1049	C1008-W1014 HydrophobicContact CB-CE3 4.02Å; C1008-W1014 HydrophobicContact CB-CZ3 4.34Å; C1008-F1041 CarbonylContact O-C 3.58Å; C1008-F1041 WeakPolarHBondContact O-CA 3.47Å; C1008-F1041 VanDerWaalsContact O-CB 3.22Å; C1008-F1041 WeakPolarHBondContact O-CB 3.32Å; C1008-R1042 PolarHBondContact N-O 3.36Å; C1008-R1042 PolarHBondContact O-N 2.94Å; C1008-W1049 HydrophobicContact CB-CH2 4.02Å; C1008-W1049 HydrophobicContact CB-CZ3 3.88Å
1009	L	90.5	Very high	85.4	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	150.7	-176.1	-64.9	117.8	0	0	0	112.8	F995 L1007 C1011 F1012 W1014 V1032 E1040 F1041	F995-L1009 HydrophobicContact CE1-CD2 4.03Å; F995-L1009 HydrophobicContact CE2-CD2 4.12Å; F995-L1009 HydrophobicContact CZ-CD2 3.55Å; L1007-L1009 HydrophobicContact CD2-CD1 3.73Å; L1007-L1009 HydrophobicContact CD2-CG 4.46Å; L1007-L1009 HydrophobicContact CG-CD1 3.76Å; L1007-L1009 HydrophobicContact CG-CG 4.23Å; L1009-C1011 VanDerWaalsContact C-N 3.26Å; L1009-C1011 WeakPolarHBondContact CB-SG 3.26Å; L1009-C1011 PolarHBondContact O-N 2.89Å; L1009-F1012 HydrophobicContact CB-CD2 4.08Å; L1009-F1012 HydrophobicContact CB-CE2 4.32Å; L1009-F1012 HydrophobicContact CD1-CD2 3.95Å; L1009-F1012 HydrophobicContact CD1-CE2 3.51Å; L1009-F1012 HydrophobicContact CD1-CZ 4.47Å; L1009-F1012 PolarHBondContact O-N 3.18Å; L1009-F1012 VanDerWaalsContact O-N 3.11Å; L1009-W1014 PolarHBondContact O-N 2.94Å; L1009-V1032 HydrophobicContact CD1-CG1 4.41Å; L1009-E1040 CarbonylContact C-O 3.5Å; L1009-E1040 WeakPolarHBondContact CA-O 3.3Å; L1009-F1041 HydrophobicContact CB-CB 4.43Å; L1009-F1041 HydrophobicContact CD2-CB 3.89Å; L1009-F1041 HydrophobicContact CD2-CG 4.49Å; L1009-F1041 HydrophobicContact CG-CB 3.85Å
1010	S	86.1	Confident	85.7	Confident	38 Å²	38	56.7 Å²	56.7	27%	0.266	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-62.8	-28.7	172.3	64.9	0	0	0	0	113.2	F1012 N1013 H1039 E1040	S1010-F1012 PolarHBondContact O-N 3.37Å; S1010-F1012 VanDerWaalsContact O-N 3.14Å; S1010-N1013 PolarHBondContact O-N 2.73Å; S1010-H1039 WeakPolarHBondContact OG-CA 3.48Å; S1010-E1040 PolarHBondContact N-O 2.74Å; S1010-E1040 PolarHBondContact OG-N 3.05Å; S1010-E1040 PolarHBondContact OG-O 3.44Å
1011	C	80.5	Confident	86.1	Confident	16 Å²	16	57 Å²	57	11%	0.108	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-64.3	-13.6	174.3	62.7	0	0	0	0	113.7	F964 L1009	F964-C1011 VanDerWaalsContact CE2-O 3.31Å; F964-C1011 WeakPolarHBondContact CE2-O 3.3Å; L1009-C1011 VanDerWaalsContact C-N 3.26Å; L1009-C1011 WeakPolarHBondContact CB-SG 3.26Å; L1009-C1011 PolarHBondContact O-N 2.89Å
1012	F	76.4	Confident	86.3	Confident	21 Å²	21	56.8 Å²	56.8	9%	0.092	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-114	25.2	173.6	-48.2	-42.1	0	0	0	111.7	L979 L1009 S1010 W1014 E1015 C1016 L1018 V1032	L979-F1012 HydrophobicContact CD2-CD1 3.64Å; L979-F1012 HydrophobicContact CD2-CE1 3.24Å; L979-F1012 HydrophobicContact CD2-CZ 4.09Å; L1009-F1012 HydrophobicContact CB-CD2 4.08Å; L1009-F1012 HydrophobicContact CB-CE2 4.32Å; L1009-F1012 HydrophobicContact CD1-CD2 3.95Å; L1009-F1012 HydrophobicContact CD1-CE2 3.51Å; L1009-F1012 HydrophobicContact CD1-CZ 4.47Å; L1009-F1012 PolarHBondContact O-N 3.18Å; L1009-F1012 VanDerWaalsContact O-N 3.11Å; S1010-F1012 PolarHBondContact O-N 3.37Å; S1010-F1012 VanDerWaalsContact O-N 3.14Å; F1012-W1014 PolarHBondContact O-N 3.45Å; F1012-E1015 PolarHBondContact O-N 2.72Å; F1012-C1016 HydrophobicContact CB-CB 3.79Å; F1012-C1016 HydrophobicContact CD2-CB 4.28Å; F1012-C1016 HydrophobicContact CG-CB 4.24Å; F1012-L1018 HydrophobicContact CD2-CD1 4.31Å; F1012-L1018 HydrophobicContact CE2-CD1 3.6Å; F1012-L1018 HydrophobicContact CE2-CG 4.43Å; F1012-L1018 HydrophobicContact CZ-CD1 4.4Å; F1012-V1032 HydrophobicContact CE2-CG1 4.02Å; F1012-V1032 HydrophobicContact CZ-CG1 3.69Å
1013	N	75.3	Confident	86.4	Confident	114 Å²	114	60.5 Å²	60.5	61%	0.61	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	22.5	-178.9	-155.1	39.8	0	0	0	114.5	S1010 E1015	S1010-N1013 PolarHBondContact O-N 2.73Å; N1013-E1015 HydrophobicContact CB-CG 4.31Å; N1013-E1015 PolarHBondContact ND2-OE1 3.28Å; N1013-E1015 PolarHBondContact O-N 3.5Å
1014	W	81.6	Confident	86.3	Confident	90 Å²	90	61.5 Å²	61.5	34%	0.341	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	7.6	-168.7	-53	91.6	0	0	0	116.1	C1008 L1009 F1012 E1040 R1042 N1066	C1008-W1014 HydrophobicContact CB-CE3 4.02Å; C1008-W1014 HydrophobicContact CB-CZ3 4.34Å; L1009-W1014 PolarHBondContact O-N 2.94Å; F1012-W1014 PolarHBondContact O-N 3.45Å; W1014-E1040 HydrophobicContact CH2-CB 4.25Å; W1014-E1040 HydrophobicContact CZ2-CB 3.81Å; W1014-R1042 HydrophobicContact CH2-CG 4.49Å; W1014-R1042 HydrophobicContact CZ3-CB 4.34Å; W1014-R1042 HydrophobicContact CZ3-CG 4.4Å; W1014-N1066 WeakPolarHBondContact CZ2-ND2 3.42Å
1015	E	72.7	Confident	86.1	Confident	159 Å²	159	62.3 Å²	62.3	74%	0.743	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-16.3	-178.2	-66.7	175.1	-153.7	0	0	113.3	F1012 N1013	F1012-E1015 PolarHBondContact O-N 2.72Å; N1013-E1015 HydrophobicContact CB-CG 4.31Å; N1013-E1015 PolarHBondContact ND2-OE1 3.28Å; N1013-E1015 PolarHBondContact O-N 3.5Å
1016	C	71.4	Confident	85.7	Confident	41 Å²	41	62.7 Å²	62.7	28%	0.277	32%	0.317	S	S	.	.			trans	-115.6	123.5	-177.5	-151.4	0	0	0	0	112.4	F1012	F1012-C1016 HydrophobicContact CB-CB 3.79Å; F1012-C1016 HydrophobicContact CD2-CB 4.28Å; F1012-C1016 HydrophobicContact CG-CB 4.24Å
1017	A	85.8	Confident	85.6	Confident	49 Å²	49	60.1 Å²	60.1	41%	0.405	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	109	175.1	0	0	0	0	0	109.9	Y1006	Y1006-A1017 HydrophobicContact CD1-CB 4.05Å; Y1006-A1017 HydrophobicContact CG-CB 4.31Å
1018	L	88.4	Confident	85.6	Confident	47 Å²	47	60.8 Å²	60.8	25%	0.246	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	116.8	-173.4	-59.4	-179.5	0	0	0	111.7	Y1006 L1007 F1012 M1020 L1030 V1032	Y1006-L1018 CarbonylContact C-O 3.56Å; Y1006-L1018 VanDerWaalsContact CA-O 3.28Å; Y1006-L1018 WeakPolarHBondContact CA-O 3.37Å; L1007-L1018 PolarHBondContact N-O 3.23Å; L1007-L1018 PolarHBondContact O-N 3.29Å; F1012-L1018 HydrophobicContact CD2-CD1 4.31Å; F1012-L1018 HydrophobicContact CE2-CD1 3.6Å; F1012-L1018 HydrophobicContact CE2-CG 4.43Å; F1012-L1018 HydrophobicContact CZ-CD1 4.4Å; L1018-M1020 PolarHBondContact O-N 3.36Å; L1018-L1030 HydrophobicContact CB-CD2 3.46Å; L1018-L1030 VanDerWaalsContact CB-CD2 3.46Å; L1018-L1030 HydrophobicContact CD1-CD2 4.01Å; L1018-L1030 HydrophobicContact CG-CD2 4.41Å; L1018-V1032 HydrophobicContact CD1-CG1 4.43Å; L1018-V1032 HydrophobicContact CD1-CG2 4.03Å
1019	L	91.1	Very high	85.7	Confident	79 Å²	79	63.9 Å²	63.9	41%	0.414	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	125.2	178.6	-174.9	68.8	0	0	0	111.4	Q1004 Y1006	Q1004-L1019 HydrophobicContact CB-CD1 4.24Å; Y1006-L1019 HydrophobicContact CD1-CB 4.14Å; Y1006-L1019 HydrophobicContact CD1-CD1 4.31Å; Y1006-L1019 HydrophobicContact CE1-CB 3.95Å; Y1006-L1019 HydrophobicContact CE1-CD1 3.86Å; Y1006-L1019 HydrophobicContact CE1-CG 4.48Å; Y1006-L1019 HydrophobicContact CE2-CD1 4.14Å
1020	M	93.4	Very high	85.8	Confident	3 Å²	3	65 Å²	65	2%	0.015	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-84.3	154.8	177.6	-58	-173.8	75.4	0	0	111.9	F995 T997 I1005 L1007 L1018 W1028 L1030 F1043	F995-M1020 HydrophobicContact CB-CE 4.32Å; F995-M1020 VanDerWaalsContact O-CE 3.26Å; F995-M1020 WeakPolarHBondContact O-CE 3.48Å; T997-M1020 HydrophobicContact CG2-SD 4.3Å; I1005-M1020 HydrophobicContact CB-CB 4.48Å; I1005-M1020 HydrophobicContact CB-SD 4.29Å; I1005-M1020 HydrophobicContact CG2-CG 4.35Å; I1005-M1020 HydrophobicContact CG2-SD 3.62Å; I1005-M1020 WeakPolarHBondContact O-CB 3.28Å; I1005-M1020 PolarHBondContact O-N 2.79Å; L1007-M1020 HydrophobicContact CB-CG 4.23Å; L1007-M1020 HydrophobicContact CB-SD 4.3Å; L1018-M1020 PolarHBondContact O-N 3.36Å; M1020-W1028 HydrophobicContact CB-CB 4.25Å; M1020-W1028 HydrophobicContact CB-CE3 4.06Å; M1020-W1028 HydrophobicContact CE-CB 4.35Å; M1020-W1028 WeakPolarHBondContact O-CZ3 3.41Å; M1020-W1028 HydrophobicContact SD-CB 4.4Å; M1020-L1030 HydrophobicContact CB-CB 4.43Å; M1020-L1030 HydrophobicContact CE-CB 4.18Å; M1020-L1030 HydrophobicContact CG-CB 4.04Å; M1020-F1043 HydrophobicContact CE-CD1 4.37Å; M1020-F1043 HydrophobicContact CE-CE1 3.78Å; M1020-F1043 HydrophobicContact SD-CD1 3.55Å; M1020-F1043 VanDerWaalsContact SD-CD1 3.55Å; M1020-F1043 HydrophobicContact SD-CE1 3.58Å; M1020-F1043 VanDerWaalsContact SD-CE1 3.58Å
1021	N	91.2	Very high	86	Confident	70 Å²	70	70 Å²	70	37%	0.374	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	142.8	174.3	-68.2	-52.1	0	0	0	110.7	W1028 Y1029	N1021-W1028 CarbonylContact O-C 3.47Å; N1021-W1028 VanDerWaalsContact O-CA 3.31Å; N1021-W1028 WeakPolarHBondContact O-CA 3.37Å; N1021-Y1029 HydrophobicContact CB-CD1 3.98Å; N1021-Y1029 HydrophobicContact CB-CE1 3.49Å; N1021-Y1029 VanDerWaalsContact CB-CE1 3.49Å; N1021-Y1029 HydrophobicContact CB-CE2 4.43Å; N1021-Y1029 PolarHBondContact N-O 2.86Å; N1021-Y1029 WeakPolarHBondContact O-CD1 3.2Å; N1021-Y1029 PolarHBondContact O-N 3.21Å
1022	R	91.4	Very high	86.3	Confident	140 Å²	140	69.6 Å²	69.6	53%	0.528	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	133.2	177.2	179.1	171.7	157.8	159.9	-0.1	111.2	P1000 W1028	P1000-R1022 PolarHBondContact O-NH1 3.2Å; R1022-W1028 HydrophobicContact CB-CD2 3.99Å; R1022-W1028 HydrophobicContact CB-CE3 3.92Å; R1022-W1028 HydrophobicContact CB-CH2 4.03Å; R1022-W1028 HydrophobicContact CB-CZ2 4.09Å; R1022-W1028 HydrophobicContact CB-CZ3 3.95Å; R1022-W1028 HydrophobicContact CG-CD2 4.47Å; R1022-W1028 HydrophobicContact CG-CZ2 4.29Å
1023	R	89.8	Confident	86.6	Confident	80 Å²	80	72.1 Å²	72.1	30%	0.302	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-85.7	163.8	171.2	-74.9	-175.5	-177.5	146.1	9.4	111.8	E996 D1025 G1026 T1027 Y1029	E996-R1023 IonicContact OE1-CZ 2.88Å; E996-R1023 IonicContact OE1-NH1 2.84Å; E996-R1023 PolarHBondContact OE1-NH1 3.47Å; E996-R1023 IonicContact OE1-NH2 3.58Å; E996-R1023 PolarHBondContact OE1-NH2 2.88Å; E996-R1023 IonicContact OE2-NH1 2.65Å; E996-R1023 PolarHBondContact OE2-NH1 3.45Å; E996-R1023 VanDerWaalsContact OE2-NH1 3.08Å; R1023-D1025 WeakPolarHBondContact CB-OD1 3.5Å; R1023-D1025 PolarHBondContact O-N 3.19Å; R1023-G1026 PolarHBondContact O-N 3.42Å; R1023-G1026 VanDerWaalsContact O-N 3.11Å; R1023-T1027 WeakPolarHBondContact CB-O 3.48Å; R1023-T1027 PolarHBondContact N-O 2.81Å; R1023-Y1029 HydrophobicContact CG-CD1 3.6Å; R1023-Y1029 HydrophobicContact CG-CE1 3.74Å
1024	N	84.4	Confident	87	Confident	183 Å²	183	66.7 Å²	66.7	98%	0.979	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-20.9	174.7	-64.2	-5.1	0	0	0	113.5
1025	D	86.9	Confident	86.9	Confident	109 Å²	109	63.7 Å²	63.7	58%	0.583	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-0.9	177.4	61	20.6	0	0	0	113.8	R1023 T1027	R1023-D1025 WeakPolarHBondContact CB-OD1 3.5Å; R1023-D1025 PolarHBondContact O-N 3.19Å; D1025-T1027 VanDerWaalsContact CG-OG1 3.29Å; D1025-T1027 WeakPolarHBondContact OD1-CB 3.48Å; D1025-T1027 PolarHBondContact OD1-N 2.97Å; D1025-T1027 PolarHBondContact OD1-OG1 3.44Å
1026	G	84.3	Confident	87.1	Confident	9 Å²	9	57.5 Å²	57.5	9%	0.093	29%	0.292	C	S	.	.	S	Bend	trans	87.5	-1.7	-176.8	0	0	0	0	0	115.1	R1023	R1023-G1026 PolarHBondContact O-N 3.42Å; R1023-G1026 VanDerWaalsContact O-N 3.11Å
1027	T	91.4	Very high	87.6	Confident	13 Å²	13	57 Å²	57	8%	0.08	29%	0.294	C	S	.	.			trans	-78.3	136.9	175.2	-42.4	0	0	0	0	110.4	E996 K998 R1023 D1025	E996-T1027 HydrophobicContact CB-CG2 4.19Å; K998-T1027 HydrophobicContact CG-CG2 4.31Å; R1023-T1027 WeakPolarHBondContact CB-O 3.48Å; R1023-T1027 PolarHBondContact N-O 2.81Å; D1025-T1027 VanDerWaalsContact CG-OG1 3.29Å; D1025-T1027 WeakPolarHBondContact OD1-CB 3.48Å; D1025-T1027 PolarHBondContact OD1-N 2.97Å; D1025-T1027 PolarHBondContact OD1-OG1 3.44Å
1028	W	93.9	Very high	87.6	Confident	14 Å²	14	60.7 Å²	60.7	5%	0.053	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	138.8	171.4	-66.9	80.5	0	0	0	109.8	E996 T997 L999 A1002 H1003 I1005 M1020 N1021 R1022	E996-W1028 CarbonylContact C-O 3.49Å; E996-W1028 WeakPolarHBondContact CA-O 3.22Å; T997-W1028 HydrophobicContact CG2-CB 4.01Å; T997-W1028 PolarHBondContact N-O 3.48Å; T997-W1028 PolarHBondContact O-N 2.82Å; L999-W1028 PolarHBondContact O-NE1 2.79Å; A1002-W1028 HydrophobicContact CB-CZ2 4.24Å; A1002-W1028 WeakPolarHBondContact O-CZ2 3.46Å; H1003-W1028 WeakPolarHBondContact O-CH2 3.42Å; I1005-W1028 HydrophobicContact CB-CD2 4.09Å; I1005-W1028 HydrophobicContact CB-CE3 4.13Å; I1005-W1028 HydrophobicContact CB-CG 4.3Å; I1005-W1028 HydrophobicContact CD1-CB 4.02Å; I1005-W1028 HydrophobicContact CD1-CD2 3.84Å; I1005-W1028 HydrophobicContact CD1-CG 3.47Å; I1005-W1028 VanDerWaalsContact CD1-CG 3.47Å; I1005-W1028 HydrophobicContact CG1-CD2 3.77Å; I1005-W1028 HydrophobicContact CG1-CE3 4.23Å; I1005-W1028 HydrophobicContact CG1-CG 3.95Å; I1005-W1028 HydrophobicContact CG1-CZ2 4.37Å; M1020-W1028 HydrophobicContact CB-CB 4.25Å; M1020-W1028 HydrophobicContact CB-CE3 4.06Å; M1020-W1028 HydrophobicContact CE-CB 4.35Å; M1020-W1028 WeakPolarHBondContact O-CZ3 3.41Å; M1020-W1028 HydrophobicContact SD-CB 4.4Å; N1021-W1028 CarbonylContact O-C 3.47Å; N1021-W1028 VanDerWaalsContact O-CA 3.31Å; N1021-W1028 WeakPolarHBondContact O-CA 3.37Å; R1022-W1028 HydrophobicContact CB-CD2 3.99Å; R1022-W1028 HydrophobicContact CB-CE3 3.92Å; R1022-W1028 HydrophobicContact CB-CH2 4.03Å; R1022-W1028 HydrophobicContact CB-CZ2 4.09Å; R1022-W1028 HydrophobicContact CB-CZ3 3.95Å; R1022-W1028 HydrophobicContact CG-CD2 4.47Å; R1022-W1028 HydrophobicContact CG-CZ2 4.29Å
1029	Y	93.7	Very high	87.7	Confident	66 Å²	66	59.3 Å²	59.3	26%	0.259	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	149.6	-177.1	78.7	-76.6	0	0	0	113.3	L994 F995 N1021 R1023	L994-Y1029 HydrophobicContact CD1-CD2 4.09Å; F995-Y1029 CarbonylContact O-C 3.55Å; F995-Y1029 WeakPolarHBondContact O-CA 3.43Å; N1021-Y1029 HydrophobicContact CB-CD1 3.98Å; N1021-Y1029 HydrophobicContact CB-CE1 3.49Å; N1021-Y1029 VanDerWaalsContact CB-CE1 3.49Å; N1021-Y1029 HydrophobicContact CB-CE2 4.43Å; N1021-Y1029 PolarHBondContact N-O 2.86Å; N1021-Y1029 WeakPolarHBondContact O-CD1 3.2Å; N1021-Y1029 PolarHBondContact O-N 3.21Å; R1023-Y1029 HydrophobicContact CG-CD1 3.6Å; R1023-Y1029 HydrophobicContact CG-CE1 3.74Å
1030	L	92.5	Very high	87.8	Confident	24 Å²	24	57.6 Å²	57.6	13%	0.126	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	137.5	171.9	-176.2	64.4	0	0	0	111.1	F995 L1007 L1018 M1020 V1032	F995-L1030 PolarHBondContact N-O 2.93Å; F995-L1030 PolarHBondContact O-N 3.42Å; L1007-L1030 HydrophobicContact CB-CD2 4.29Å; L1007-L1030 HydrophobicContact CD2-CD2 4.08Å; L1018-L1030 HydrophobicContact CB-CD2 3.46Å; L1018-L1030 VanDerWaalsContact CB-CD2 3.46Å; L1018-L1030 HydrophobicContact CD1-CD2 4.01Å; L1018-L1030 HydrophobicContact CG-CD2 4.41Å; M1020-L1030 HydrophobicContact CB-CB 4.43Å; M1020-L1030 HydrophobicContact CE-CB 4.18Å; M1020-L1030 HydrophobicContact CG-CB 4.04Å; L1030-V1032 HydrophobicContact CD2-CG2 3.84Å; L1030-V1032 HydrophobicContact CG-CG2 3.91Å
1031	W	90.1	Very high	87.8	Confident	142 Å²	142	57.4 Å²	57.4	54%	0.538	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	128.4	169.4	-74.3	105.8	0	0	0	110	R992 I993 L994	R992-W1031 HydrophobicContact CG-CB 4.48Å; R992-W1031 HydrophobicContact CG-CD2 4.22Å; R992-W1031 HydrophobicContact CG-CE3 3.46Å; R992-W1031 VanDerWaalsContact CG-CE3 3.46Å; R992-W1031 HydrophobicContact CG-CZ3 3.97Å; I993-W1031 VanDerWaalsContact C-CE3 3.48Å; I993-W1031 WeakPolarHBondContact O-CA 3.46Å; L994-W1031 HydrophobicContact CB-CD2 4.1Å; L994-W1031 HydrophobicContact CB-CE3 3.75Å; L994-W1031 HydrophobicContact CB-CH2 3.82Å; L994-W1031 HydrophobicContact CB-CZ2 4.11Å; L994-W1031 HydrophobicContact CB-CZ3 3.63Å; L994-W1031 HydrophobicContact CD1-CD2 4Å; L994-W1031 HydrophobicContact CD1-CG 4.27Å; L994-W1031 HydrophobicContact CD1-CZ2 4.33Å; L994-W1031 HydrophobicContact CD2-CH2 4.1Å; L994-W1031 HydrophobicContact CD2-CZ2 3.79Å; L994-W1031 HydrophobicContact CG-CH2 4.49Å; L994-W1031 HydrophobicContact CG-CZ2 4.32Å
1032	V	86.9	Confident	87.9	Confident	9 Å²	9	55.5 Å²	55.5	6%	0.055	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	136.7	179	-173.7	0	0	0	0	109.2	I993 F995 L1007 L1009 F1012 L1018 L1030 V1034	I993-V1032 PolarHBondContact N-O 3.21Å; I993-V1032 PolarHBondContact O-N 3.27Å; F995-V1032 HydrophobicContact CD2-CB 4.36Å; F995-V1032 HydrophobicContact CD2-CG2 4.11Å; F995-V1032 HydrophobicContact CE2-CB 4.18Å; F995-V1032 HydrophobicContact CE2-CG2 4.34Å; L1007-V1032 HydrophobicContact CD2-CG2 3.96Å; L1009-V1032 HydrophobicContact CD1-CG1 4.41Å; F1012-V1032 HydrophobicContact CE2-CG1 4.02Å; F1012-V1032 HydrophobicContact CZ-CG1 3.69Å; L1018-V1032 HydrophobicContact CD1-CG1 4.43Å; L1018-V1032 HydrophobicContact CD1-CG2 4.03Å; L1030-V1032 HydrophobicContact CD2-CG2 3.84Å; L1030-V1032 HydrophobicContact CG-CG2 3.91Å; V1032-V1034 HydrophobicContact CB-CG2 4.07Å; V1032-V1034 HydrophobicContact CG1-CG2 3.87Å; V1032-V1034 PolarHBondContact O-N 3.42Å
1033	D	82	Confident	88	Confident	74 Å²	74	48.8 Å²	48.8	40%	0.396	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	107.5	170.9	-64	-36.6	0	0	0	108.6	R992	R992-D1033 WeakPolarHBondContact CA-OD1 3.31Å; R992-D1033 WeakPolarHBondContact CB-OD1 3.5Å; R992-D1033 WeakPolarHBondContact CG-OD1 3.43Å; R992-D1033 IonicContact CZ-OD1 3.18Å; R992-D1033 IonicContact CZ-OD2 2.8Å; R992-D1033 IonicContact NE-OD1 2.69Å; R992-D1033 PolarHBondContact NE-OD1 2.99Å; R992-D1033 IonicContact NE-OD2 3.63Å; R992-D1033 IonicContact NH2-OD1 2.65Å; R992-D1033 PolarHBondContact NH2-OD1 3.03Å; R992-D1033 IonicContact NH2-OD2 2.9Å; R992-D1033 PolarHBondContact NH2-OD2 3.47Å
1034	V	84	Confident	88.1	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	133.5	-171.6	-174.3	0	0	0	0	109.5	T990 R991 I993 F995 V1032 H1039 I1071	T990-V1034 CarbonylContact C-O 3.55Å; T990-V1034 WeakPolarHBondContact CA-O 3.47Å; R991-V1034 PolarHBondContact N-O 3.45Å; R991-V1034 PolarHBondContact O-N 2.95Å; I993-V1034 HydrophobicContact CB-CG2 4.22Å; I993-V1034 HydrophobicContact CG1-CB 4.3Å; I993-V1034 HydrophobicContact CG1-CG2 4.26Å; F995-V1034 HydrophobicContact CE2-CG2 4.04Å; F995-V1034 HydrophobicContact CZ-CG2 4.36Å; V1032-V1034 HydrophobicContact CB-CG2 4.07Å; V1032-V1034 HydrophobicContact CG1-CG2 3.87Å; V1032-V1034 PolarHBondContact O-N 3.42Å; V1034-H1039 WeakPolarHBondContact CG1-CD2 3.46Å; V1034-I1071 HydrophobicContact CB-CG1 4.22Å; V1034-I1071 HydrophobicContact CG1-CG1 3.85Å
1035	P	79	Confident	88.5	Confident	26 Å²	26	40.7 Å²	40.7	17%	0.169	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	154.2	174.5	-21.9	33.3	0	0	0	112.7	T990 H1039	T990-P1035 HydrophobicContact CG2-CG 4.41Å; P1035-H1039 PolarHBondContact O-NE2 3Å
1036	A	77	Confident	88.5	Confident	29 Å²	29	39.1 Å²	39.1	24%	0.24	19%	0.192	C	C	.	.	S	Bend	trans	-53.3	141.9	166.9	0	0	0	0	0	111.8	P989 I1071	P989-A1036 PolarHBondContact O-N 2.82Å; A1036-I1071 CarbonylContact C-O 3.59Å; A1036-I1071 WeakPolarHBondContact CA-O 3.37Å
1037	G	81.5	Confident	88.5	Confident	31 Å²	31	41.4 Å²	41.4	32%	0.32	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	125.3	-177.1	-178.2	0	0	0	0	0	115.3	H1039 V1070 I1071	G1037-H1039 PolarHBondContact O-CD2 2.96Å; G1037-V1070 WeakPolarHBondContact O-CA 3Å; G1037-I1071 PolarHBondContact N-O 2.84Å; G1037-I1071 PolarHBondContact O-N 3.11Å
1038	R	87.5	Confident	88.3	Confident	126 Å²	126	48.1 Å²	48.1	48%	0.475	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	123.5	176.5	-178.3	174.9	173.7	-97	-12.5	110	E1040 C1058 W1068 I1069 V1070	R1038-E1040 IonicContact CZ-OE1 2.75Å; R1038-E1040 IonicContact NH1-OE1 3.33Å; R1038-E1040 PolarHBondContact NH1-OE1 3.39Å; R1038-E1040 IonicContact NH2-OE1 2.84Å; R1038-E1040 PolarHBondContact NH2-OE1 2.9Å; R1038-C1058 PolarHBondContact NH2-SG 3.32Å; R1038-W1068 HydrophobicContact CG-CE3 4.16Å; R1038-I1069 WeakPolarHBondContact CA-O 3.38Å; R1038-V1070 HydrophobicContact CB-CG2 3.79Å; R1038-V1070 HydrophobicContact CG-CG2 3.99Å
1039	H	90.3	Very high	88.1	Confident	19 Å²	19	53.3 Å²	53.3	9%	0.088	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	136.9	178.3	-59.8	-76.6	0	0	0	111	S1010 V1034 P1035 G1037 W1068 I1069	S1010-H1039 WeakPolarHBondContact OG-CA 3.48Å; V1034-H1039 WeakPolarHBondContact CG1-CD2 3.46Å; P1035-H1039 PolarHBondContact O-NE2 3Å; G1037-H1039 PolarHBondContact O-CD2 2.96Å; H1039-W1068 CarbonylContact O-C 3.51Å; H1039-W1068 WeakPolarHBondContact O-CA 3.19Å; H1039-W1068 WeakPolarHBondContact O-CB 3.44Å; H1039-I1069 HydrophobicContact CB-CG2 4.31Å; H1039-I1069 PolarHBondContact N-O 2.79Å; H1039-I1069 PolarHBondContact O-N 3.06Å
1040	E	92.6	Very high	87.9	Confident	42 Å²	42	53.2 Å²	53.2	20%	0.196	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	147.2	172.4	-58.6	-165.8	-179.9	0	0	109.5	L1009 S1010 W1014 R1038 C1058 N1066 N1067 W1068	L1009-E1040 CarbonylContact C-O 3.5Å; L1009-E1040 WeakPolarHBondContact CA-O 3.3Å; S1010-E1040 PolarHBondContact N-O 2.74Å; S1010-E1040 PolarHBondContact OG-N 3.05Å; S1010-E1040 PolarHBondContact OG-O 3.44Å; W1014-E1040 HydrophobicContact CH2-CB 4.25Å; W1014-E1040 HydrophobicContact CZ2-CB 3.81Å; R1038-E1040 IonicContact CZ-OE1 2.75Å; R1038-E1040 IonicContact NH1-OE1 3.33Å; R1038-E1040 PolarHBondContact NH1-OE1 3.39Å; R1038-E1040 IonicContact NH2-OE1 2.84Å; R1038-E1040 PolarHBondContact NH2-OE1 2.9Å; E1040-C1058 PolarHBondContact OE1-SG 3.33Å; E1040-C1058 VanDerWaalsContact OE1-SG 3.41Å; E1040-N1066 HydrophobicContact CB-CB 4.36Å; E1040-N1066 PolarHBondContact OE2-ND2 3.48Å; E1040-N1067 CarbonylContact C-O 3.59Å; E1040-N1067 VanDerWaalsContact CA-O 3.3Å; E1040-N1067 WeakPolarHBondContact CA-O 3.47Å; E1040-W1068 HydrophobicContact CG-CB 4.17Å
1041	F	94.3	Very high	87.8	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	162.1	-179.6	66	-82.6	0	0	0	111.7	F995 L1007 C1008 L1009 F1043 Y1055 N1067 I1069	F995-F1041 HydrophobicContact CD1-CD2 4Å; F995-F1041 HydrophobicContact CD1-CE1 4.45Å; F995-F1041 AromaticContact CD1-CE2 3.79Å; F995-F1041 HydrophobicContact CD1-CE2 3.79Å; F995-F1041 HydrophobicContact CD1-CG 4.41Å; F995-F1041 HydrophobicContact CD1-CZ 4.02Å; F995-F1041 AromaticContact CE1-CD1 3.86Å; F995-F1041 HydrophobicContact CE1-CD1 3.86Å; F995-F1041 HydrophobicContact CE1-CD2 4Å; F995-F1041 AromaticContact CE1-CE1 3.82Å; F995-F1041 HydrophobicContact CE1-CE1 3.82Å; F995-F1041 AromaticContact CE1-CE2 3.95Å; F995-F1041 HydrophobicContact CE1-CE2 3.95Å; F995-F1041 AromaticContact CE1-CG 3.95Å; F995-F1041 HydrophobicContact CE1-CG 3.95Å; F995-F1041 AromaticContact CE1-CZ 3.85Å; F995-F1041 HydrophobicContact CE1-CZ 3.85Å; L1007-F1041 HydrophobicContact CD1-CB 4.23Å; L1007-F1041 HydrophobicContact CD1-CD2 3.7Å; L1007-F1041 HydrophobicContact CD1-CG 4.32Å; C1008-F1041 CarbonylContact O-C 3.58Å; C1008-F1041 WeakPolarHBondContact O-CA 3.47Å; C1008-F1041 VanDerWaalsContact O-CB 3.22Å; C1008-F1041 WeakPolarHBondContact O-CB 3.32Å; L1009-F1041 HydrophobicContact CB-CB 4.43Å; L1009-F1041 HydrophobicContact CD2-CB 3.89Å; L1009-F1041 HydrophobicContact CD2-CG 4.49Å; L1009-F1041 HydrophobicContact CG-CB 3.85Å; F1041-F1043 HydrophobicContact CD2-CE2 4.39Å; F1041-F1043 HydrophobicContact CD2-CZ 4.43Å; F1041-F1043 AromaticContact CE2-CE2 3.88Å; F1041-F1043 HydrophobicContact CE2-CE2 3.88Å; F1041-F1043 AromaticContact CE2-CZ 3.94Å; F1041-F1043 HydrophobicContact CE2-CZ 3.94Å; F1041-Y1055 HydrophobicContact CE2-CD1 4.48Å; F1041-Y1055 HydrophobicContact CE2-CD2 4.03Å; F1041-Y1055 HydrophobicContact CE2-CE2 4.16Å; F1041-Y1055 HydrophobicContact CE2-CG 4.19Å; F1041-Y1055 AromaticContact CZ-CD1 3.63Å; F1041-Y1055 HydrophobicContact CZ-CD1 3.63Å; F1041-Y1055 AromaticContact CZ-CD2 3.88Å; F1041-Y1055 HydrophobicContact CZ-CD2 3.88Å; F1041-Y1055 AromaticContact CZ-CE1 3.99Å; F1041-Y1055 HydrophobicContact CZ-CE1 3.99Å; F1041-Y1055 HydrophobicContact CZ-CE2 4.23Å; F1041-Y1055 AromaticContact CZ-CG 3.57Å; F1041-Y1055 HydrophobicContact CZ-CG 3.57Å; F1041-N1067 HydrophobicContact CD1-CB 4.19Å; F1041-N1067 HydrophobicContact CD2-CB 4.03Å; F1041-N1067 HydrophobicContact CE1-CB 3.79Å; F1041-N1067 HydrophobicContact CE2-CB 3.62Å; F1041-N1067 HydrophobicContact CG-CB 4.3Å; F1041-N1067 HydrophobicContact CZ-CB 3.5Å; F1041-N1067 PolarHBondContact N-O 2.77Å; F1041-N1067 WeakPolarHBondContact O-CA 3.42Å; F1041-N1067 PolarHBondContact O-N 2.91Å; F1041-I1069 HydrophobicContact CD1-CG2 4.29Å; F1041-I1069 HydrophobicContact CE1-CB 4.05Å; F1041-I1069 HydrophobicContact CE1-CG2 4.08Å
1042	R	93.1	Very high	87.8	Confident	29 Å²	29	46.8 Å²	46.8	11%	0.109	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	158.8	167.8	-72.5	-176.2	93.5	165.5	7.7	110.5	C1008 W1014 W1049 S1051 S1064 D1065 N1066	C1008-R1042 PolarHBondContact N-O 3.36Å; C1008-R1042 PolarHBondContact O-N 2.94Å; W1014-R1042 HydrophobicContact CH2-CG 4.49Å; W1014-R1042 HydrophobicContact CZ3-CB 4.34Å; W1014-R1042 HydrophobicContact CZ3-CG 4.4Å; R1042-W1049 HydrophobicContact CB-CE3 3.73Å; R1042-W1049 HydrophobicContact CB-CZ3 3.94Å; R1042-S1051 PolarHBondContact NE-OG 3.07Å; R1042-S1051 PolarHBondContact NH2-OG 2.87Å; R1042-S1064 PolarHBondContact NH1-OG 3Å; R1042-S1064 VanDerWaalsContact NH1-OG 3.08Å; R1042-D1065 PolarHBondContact NE-O 3.3Å; R1042-N1066 WeakPolarHBondContact CD-OD1 3.26Å; R1042-N1066 HydrophobicContact CG-CB 4.47Å
1043	F	93.6	Very high	87.8	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	149	165.6	-57.9	-76.9	0	0	0	109.3	T997 I1005 Y1006 L1007 M1020 F1041 H1050 Y1055	T997-F1043 HydrophobicContact CG2-CD1 3.78Å; T997-F1043 HydrophobicContact CG2-CE1 3.88Å; T997-F1043 HydrophobicContact CG2-CG 4.12Å; T997-F1043 HydrophobicContact CG2-CZ 4.31Å; I1005-F1043 HydrophobicContact CG2-CB 4.08Å; I1005-F1043 HydrophobicContact CG2-CD1 4.06Å; I1005-F1043 HydrophobicContact CG2-CG 4.5Å; Y1006-F1043 CarbonylContact O-C 3.58Å; Y1006-F1043 WeakPolarHBondContact O-CA 3.3Å; L1007-F1043 HydrophobicContact CD1-CD1 4.16Å; L1007-F1043 HydrophobicContact CD1-CE1 3.86Å; L1007-F1043 HydrophobicContact CD1-CZ 4.42Å; M1020-F1043 HydrophobicContact CE-CD1 4.37Å; M1020-F1043 HydrophobicContact CE-CE1 3.78Å; M1020-F1043 HydrophobicContact SD-CD1 3.55Å; M1020-F1043 VanDerWaalsContact SD-CD1 3.55Å; M1020-F1043 HydrophobicContact SD-CE1 3.58Å; M1020-F1043 VanDerWaalsContact SD-CE1 3.58Å; F1041-F1043 HydrophobicContact CD2-CE2 4.39Å; F1041-F1043 HydrophobicContact CD2-CZ 4.43Å; F1041-F1043 AromaticContact CE2-CE2 3.88Å; F1041-F1043 HydrophobicContact CE2-CE2 3.88Å; F1041-F1043 AromaticContact CE2-CZ 3.94Å; F1041-F1043 HydrophobicContact CE2-CZ 3.94Å; F1043-H1050 HydrophobicContact CB-CB 4.45Å; F1043-H1050 PolarHBondContact N-O 3.49Å; F1043-H1050 PolarHBondContact O-N 3.46Å; F1043-H1050 VanDerWaalsContact O-O 3.06Å; F1043-Y1055 HydrophobicContact CE2-CD2 4.17Å; F1043-Y1055 AromaticContact CE2-CE2 3.88Å; F1043-Y1055 HydrophobicContact CE2-CE2 3.88Å; F1043-Y1055 HydrophobicContact CZ-CD2 4.49Å; F1043-Y1055 AromaticContact CZ-CE2 3.78Å; F1043-Y1055 HydrophobicContact CZ-CE2 3.78Å
1044	M	92	Very high	88.1	Confident	40 Å²	40	51.5 Å²	51.5	20%	0.197	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	103.7	170.2	-168.1	-170.6	-56.5	0	0	108	I1005 Y1006 Q1048 W1049	I1005-M1044 WeakPolarHBondContact CA-O 3.46Å; Y1006-M1044 PolarHBondContact N-O 3.45Å; Y1006-M1044 PolarHBondContact O-N 3.13Å; M1044-Q1048 CarbonylContact C-O 3.59Å; M1044-Q1048 VanDerWaalsContact CA-O 3.32Å; M1044-Q1048 WeakPolarHBondContact CA-O 3.31Å; M1044-W1049 HydrophobicContact CB-CE3 4.35Å; M1044-W1049 HydrophobicContact CE-CD2 4.22Å; M1044-W1049 HydrophobicContact CE-CE3 4.17Å; M1044-W1049 HydrophobicContact CE-CH2 3.52Å; M1044-W1049 HydrophobicContact CE-CZ2 3.52Å; M1044-W1049 HydrophobicContact CE-CZ3 3.84Å
1045	Q	91.1	Very high	88.6	Confident	53 Å²	53	53.7 Å²	53.7	25%	0.248	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	116.4	178.4	173.7	-176.8	-1.5	0	0	108.6	L999 A1002 G1047 Q1048	L999-Q1045 HydrophobicContact CD1-CB 4.39Å; A1002-Q1045 HydrophobicContact CB-CG 3.77Å; Q1045-G1047 PolarHBondContact O-N 3.45Å; Q1045-Q1048 PolarHBondContact N-O 3.41Å; Q1045-Q1048 PolarHBondContact O-N 2.84Å
1046	D	87.5	Confident	89.2	Confident	75 Å²	75	60.5 Å²	60.5	40%	0.401	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	34.2	171.5	-55.9	-40.4	0	0	0	114	A1002 H1003 Q1004	A1002-D1046 WeakPolarHBondContact CA-OD2 3.45Å; H1003-D1046 WeakPolarHBondContact CA-OD1 3.38Å; H1003-D1046 WeakPolarHBondContact CB-OD1 3.47Å; H1003-D1046 PolarHBondContact N-OD1 3.4Å; H1003-D1046 PolarHBondContact N-OD2 2.91Å; Q1004-D1046 PolarHBondContact N-OD1 3.2Å; Q1004-D1046 PolarHBondContact O-N 2.84Å
1047	G	84.1	Confident	89.9	Confident	58 Å²	58	62.5 Å²	62.5	60%	0.598	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.2	-3	-178.3	0	0	0	0	0	116.2	Q1045	Q1045-G1047 PolarHBondContact O-N 3.45Å
1048	Q	88	Confident	90.3	Very high	153 Å²	153	62.1 Å²	62.1	72%	0.715	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	137.7	174.3	-63.3	-159.4	0.2	0	0	112.5	M1044 Q1045	M1044-Q1048 CarbonylContact C-O 3.59Å; M1044-Q1048 VanDerWaalsContact CA-O 3.32Å; M1044-Q1048 WeakPolarHBondContact CA-O 3.31Å; Q1045-Q1048 PolarHBondContact N-O 3.41Å; Q1045-Q1048 PolarHBondContact O-N 2.84Å
1049	W	89.7	Confident	90.5	Very high	123 Å²	123	66.2 Å²	66.2	47%	0.466	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	128.9	176.7	-68.8	107.6	0	0	0	111.7	C1008 R1042 M1044	C1008-W1049 HydrophobicContact CB-CH2 4.02Å; C1008-W1049 HydrophobicContact CB-CZ3 3.88Å; R1042-W1049 HydrophobicContact CB-CE3 3.73Å; R1042-W1049 HydrophobicContact CB-CZ3 3.94Å; M1044-W1049 HydrophobicContact CB-CE3 4.35Å; M1044-W1049 HydrophobicContact CE-CD2 4.22Å; M1044-W1049 HydrophobicContact CE-CE3 4.17Å; M1044-W1049 HydrophobicContact CE-CH2 3.52Å; M1044-W1049 HydrophobicContact CE-CZ2 3.52Å; M1044-W1049 HydrophobicContact CE-CZ3 3.84Å
1050	H	88.2	Confident	90.1	Very high	65 Å²	65	66.1 Å²	66.1	30%	0.301	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	143.7	-178.2	-174.8	82.7	0	0	0	111	F1043	F1043-H1050 HydrophobicContact CB-CB 4.45Å; F1043-H1050 PolarHBondContact N-O 3.49Å; F1043-H1050 PolarHBondContact O-N 3.46Å; F1043-H1050 VanDerWaalsContact O-O 3.06Å
1051	S	90.9	Very high	89.6	Confident	22 Å²	22	72.1 Å²	72.1	15%	0.154	38%	0.377	C	S	.	.			trans	-123.7	121.4	178.5	-52.6	0	0	0	0	107.3	R1042 D1065 N1067	R1042-S1051 PolarHBondContact NE-OG 3.07Å; R1042-S1051 PolarHBondContact NH2-OG 2.87Å; S1051-D1065 PolarHBondContact OG-O 3.29Å; S1051-N1067 VanDerWaalsContact CA-OD1 3.29Å; S1051-N1067 WeakPolarHBondContact CA-OD1 3.42Å
1052	S	89.6	Confident	88.9	Confident	8 Å²	8	82.1 Å²	82.1	6%	0.056	42%	0.416	C	S	.	.			trans	-81.6	140.9	-175.7	171.7	0	0	0	0	110.8	D1054 Y1055 N1067	S1052-D1054 PolarHBondContact O-N 3.16Å; S1052-D1054 WeakPolarHBondContact OG-CB 3.47Å; S1052-D1054 PolarHBondContact OG-N 2.66Å; S1052-D1054 PolarHBondContact OG-OD2 3.28Å; S1052-Y1055 PolarHBondContact O-N 2.95Å; S1052-N1067 PolarHBondContact N-OD1 3.24Å; S1052-N1067 PolarHBondContact O-ND2 2.9Å
1053	G	88.4	Confident	88.3	Confident	82 Å²	82	83.3 Å²	83.3	85%	0.845	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-6.9	171.5	0	0	0	0	0	114.3	Y1055	G1053-Y1055 PolarHBondContact O-N 2.89Å
1054	D	88	Confident	88	Confident	100 Å²	100	85 Å²	85	54%	0.535	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-7.7	174.6	-61.3	-50.6	0	0	0	112.6	S1052	S1052-D1054 PolarHBondContact O-N 3.16Å; S1052-D1054 WeakPolarHBondContact OG-CB 3.47Å; S1052-D1054 PolarHBondContact OG-N 2.66Å; S1052-D1054 PolarHBondContact OG-OD2 3.28Å
1055	Y	93.3	Very high	87.9	Confident	46 Å²	46	86.6 Å²	86.6	18%	0.18	46%	0.458	C	S	.	.	S	Bend	trans	-129.4	158.1	-178.8	-57.7	-84.8	0	0	0	112.4	F995 E996 F1041 F1043 S1052 G1053 N1067	F995-Y1055 WeakPolarHBondContact CA-OH 3.17Å; E996-Y1055 PolarHBondContact N-OH 3.42Å; E996-Y1055 VanDerWaalsContact O-CE2 3.31Å; E996-Y1055 WeakPolarHBondContact O-CE2 3.33Å; E996-Y1055 PolarHBondContact O-OH 3.36Å; E996-Y1055 VanDerWaalsContact O-OH 3.13Å; F1041-Y1055 HydrophobicContact CE2-CD1 4.48Å; F1041-Y1055 HydrophobicContact CE2-CD2 4.03Å; F1041-Y1055 HydrophobicContact CE2-CE2 4.16Å; F1041-Y1055 HydrophobicContact CE2-CG 4.19Å; F1041-Y1055 AromaticContact CZ-CD1 3.63Å; F1041-Y1055 HydrophobicContact CZ-CD1 3.63Å; F1041-Y1055 AromaticContact CZ-CD2 3.88Å; F1041-Y1055 HydrophobicContact CZ-CD2 3.88Å; F1041-Y1055 AromaticContact CZ-CE1 3.99Å; F1041-Y1055 HydrophobicContact CZ-CE1 3.99Å; F1041-Y1055 HydrophobicContact CZ-CE2 4.23Å; F1041-Y1055 AromaticContact CZ-CG 3.57Å; F1041-Y1055 HydrophobicContact CZ-CG 3.57Å; F1043-Y1055 HydrophobicContact CE2-CD2 4.17Å; F1043-Y1055 AromaticContact CE2-CE2 3.88Å; F1043-Y1055 HydrophobicContact CE2-CE2 3.88Å; F1043-Y1055 HydrophobicContact CZ-CD2 4.49Å; F1043-Y1055 AromaticContact CZ-CE2 3.78Å; F1043-Y1055 HydrophobicContact CZ-CE2 3.78Å; S1052-Y1055 PolarHBondContact O-N 2.95Å; G1053-Y1055 PolarHBondContact O-N 2.89Å; Y1055-N1067 PolarHBondContact O-ND2 2.97Å
1056	Y	92	Very high	88	Confident	170 Å²	170	84.7 Å²	84.7	67%	0.667	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.6	143.4	171	-60.4	-70.9	0	0	0	111.3	N1067 W1068	Y1056-N1067 CarbonylContact O-C 3.57Å; Y1056-N1067 WeakPolarHBondContact O-CA 3.34Å; Y1056-N1067 PolarHBondContact O-ND2 3.17Å; Y1056-W1068 VanDerWaalsContact CB-CE2 3.49Å; Y1056-W1068 HydrophobicContact CD2-CH2 4.35Å; Y1056-W1068 HydrophobicContact CD2-CZ2 4.32Å; Y1056-W1068 HydrophobicContact CG-CH2 4.46Å; Y1056-W1068 AromaticContact CG-CZ2 3.99Å; Y1056-W1068 HydrophobicContact CG-CZ2 3.99Å; Y1056-W1068 PolarHBondContact O-N 3.29Å
1057	S	91.8	Very high	88.4	Confident	71 Å²	71	81.1 Å²	81.1	50%	0.497	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	155.2	177.5	11.6	0	0	0	0	112.8	N1066 W1068	S1057-N1066 CarbonylContact C-O 3.57Å; S1057-N1066 WeakPolarHBondContact CA-O 3.43Å; S1057-N1066 WeakPolarHBondContact CB-O 3.45Å; S1057-W1068 PolarHBondContact O-NE1 3.47Å
1058	C	90.8	Very high	88.8	Confident	22 Å²	22	81.5 Å²	81.5	15%	0.149	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	148.8	172.8	55.1	0	0	0	0	110.4	R1038 E1040 D1065 N1066	R1038-C1058 PolarHBondContact NH2-SG 3.32Å; E1040-C1058 PolarHBondContact OE1-SG 3.33Å; E1040-C1058 VanDerWaalsContact OE1-SG 3.41Å; C1058-D1065 CarbonylContact O-C 3.54Å; C1058-D1065 VanDerWaalsContact O-CA 3.31Å; C1058-D1065 WeakPolarHBondContact O-CA 3.47Å; C1058-N1066 PolarHBondContact N-O 2.91Å; C1058-N1066 PolarHBondContact O-N 3.29Å
1059	W	90.4	Very high	89	Confident	212 Å²	212	76 Å²	76	80%	0.803	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.3	140	175.5	-86.9	75.8	0	0	0	111.3
1060	N	83.8	Confident	89	Confident	18 Å²	18	73.5 Å²	73.5	10%	0.096	39%	0.387	C	S	.	.			trans	-111.9	164.6	173	67.7	37	0	0	0	112.1	Y1062 G1063 S1064 N1066	N1060-Y1062 PolarHBondContact O-N 3.42Å; N1060-Y1062 WeakPolarHBondContact OD1-CA 3.47Å; N1060-Y1062 WeakPolarHBondContact OD1-CB 3.48Å; N1060-Y1062 PolarHBondContact OD1-N 2.97Å; N1060-Y1062 VanDerWaalsContact OD1-N 3.12Å; N1060-G1063 PolarHBondContact O-N 2.89Å; N1060-G1063 VanDerWaalsContact O-N 3.12Å; N1060-G1063 PolarHBondContact OD1-N 3.49Å; N1060-S1064 PolarHBondContact N-O 3.29Å; N1060-S1064 PolarHBondContact ND2-O 3.36Å; N1060-S1064 PolarHBondContact ND2-OG 2.96Å; N1060-S1064 PolarHBondContact OD1-N 2.89Å; N1060-S1064 PolarHBondContact OD1-O 3.17Å; N1060-S1064 VanDerWaalsContact OD1-O 3.05Å; N1060-S1064 PolarHBondContact OD1-OG 3.12Å; N1060-N1066 PolarHBondContact ND2-OD1 2.73Å
1061	D	80.3	Confident	89	Confident	167 Å²	167	70.8 Å²	70.8	89%	0.893	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-12.8	-177	-60.2	-32.5	0	0	0	114
1062	Y	81.2	Confident	88.2	Confident	211 Å²	211	77.4 Å²	77.4	83%	0.827	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	8	178.2	-59.4	-79.7	0	0	0	113.4	N1060 S1064	N1060-Y1062 PolarHBondContact O-N 3.42Å; N1060-Y1062 WeakPolarHBondContact OD1-CA 3.47Å; N1060-Y1062 WeakPolarHBondContact OD1-CB 3.48Å; N1060-Y1062 PolarHBondContact OD1-N 2.97Å; N1060-Y1062 VanDerWaalsContact OD1-N 3.12Å; Y1062-S1064 VanDerWaalsContact C-N 3.32Å; Y1062-S1064 PolarHBondContact O-N 3.18Å
1063	G	80.6	Confident	88.2	Confident	53 Å²	53	80.9 Å²	80.9	55%	0.546	43%	0.426	S	S	.	.	S	Bend	trans	72.9	24.5	179	0	0	0	0	0	113.9	N1060	N1060-G1063 PolarHBondContact O-N 2.89Å; N1060-G1063 VanDerWaalsContact O-N 3.12Å; N1060-G1063 PolarHBondContact OD1-N 3.49Å
1064	S	86.3	Confident	88.1	Confident	36 Å²	36	80.8 Å²	80.8	25%	0.252	40%	0.404	S	S	.	.	S	Bend	trans	-128.2	-175.8	172.8	61.6	0	0	0	0	110.4	R1042 N1060 Y1062	R1042-S1064 PolarHBondContact NH1-OG 3Å; R1042-S1064 VanDerWaalsContact NH1-OG 3.08Å; N1060-S1064 PolarHBondContact N-O 3.29Å; N1060-S1064 PolarHBondContact ND2-O 3.36Å; N1060-S1064 PolarHBondContact ND2-OG 2.96Å; N1060-S1064 PolarHBondContact OD1-N 2.89Å; N1060-S1064 PolarHBondContact OD1-O 3.17Å; N1060-S1064 VanDerWaalsContact OD1-O 3.05Å; N1060-S1064 PolarHBondContact OD1-OG 3.12Å; Y1062-S1064 VanDerWaalsContact C-N 3.32Å; Y1062-S1064 PolarHBondContact O-N 3.18Å
1065	D	89.9	Confident	88.1	Confident	73 Å²	73	79.8 Å²	79.8	39%	0.39	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	128.7	-177.8	55.6	-38	0	0	0	112.2	R1042 S1051 C1058	R1042-D1065 PolarHBondContact NE-O 3.3Å; S1051-D1065 PolarHBondContact OG-O 3.29Å; C1058-D1065 CarbonylContact O-C 3.54Å; C1058-D1065 VanDerWaalsContact O-CA 3.31Å; C1058-D1065 WeakPolarHBondContact O-CA 3.47Å
1066	N	93.6	Very high	87.8	Confident	13 Å²	13	81.8 Å²	81.8	7%	0.07	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	153.4	166	-70.9	-11	0	0	0	109.3	W1014 E1040 R1042 S1057 C1058 N1060	W1014-N1066 WeakPolarHBondContact CZ2-ND2 3.42Å; E1040-N1066 HydrophobicContact CB-CB 4.36Å; E1040-N1066 PolarHBondContact OE2-ND2 3.48Å; R1042-N1066 WeakPolarHBondContact CD-OD1 3.26Å; R1042-N1066 HydrophobicContact CG-CB 4.47Å; S1057-N1066 CarbonylContact C-O 3.57Å; S1057-N1066 WeakPolarHBondContact CA-O 3.43Å; S1057-N1066 WeakPolarHBondContact CB-O 3.45Å; C1058-N1066 PolarHBondContact N-O 2.91Å; C1058-N1066 PolarHBondContact O-N 3.29Å; N1060-N1066 PolarHBondContact ND2-OD1 2.73Å
1067	N	95.1	Very high	87.6	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	158.5	159.5	-69.1	125.1	0	0	0	110.2	E1040 F1041 S1051 S1052 Y1055 Y1056	E1040-N1067 CarbonylContact C-O 3.59Å; E1040-N1067 VanDerWaalsContact CA-O 3.3Å; E1040-N1067 WeakPolarHBondContact CA-O 3.47Å; F1041-N1067 HydrophobicContact CD1-CB 4.19Å; F1041-N1067 HydrophobicContact CD2-CB 4.03Å; F1041-N1067 HydrophobicContact CE1-CB 3.79Å; F1041-N1067 HydrophobicContact CE2-CB 3.62Å; F1041-N1067 HydrophobicContact CG-CB 4.3Å; F1041-N1067 HydrophobicContact CZ-CB 3.5Å; F1041-N1067 PolarHBondContact N-O 2.77Å; F1041-N1067 WeakPolarHBondContact O-CA 3.42Å; F1041-N1067 PolarHBondContact O-N 2.91Å; S1051-N1067 VanDerWaalsContact CA-OD1 3.29Å; S1051-N1067 WeakPolarHBondContact CA-OD1 3.42Å; S1052-N1067 PolarHBondContact N-OD1 3.24Å; S1052-N1067 PolarHBondContact O-ND2 2.9Å; Y1055-N1067 PolarHBondContact O-ND2 2.97Å; Y1056-N1067 CarbonylContact O-C 3.57Å; Y1056-N1067 WeakPolarHBondContact O-CA 3.34Å; Y1056-N1067 PolarHBondContact O-ND2 3.17Å
1068	W	93.6	Very high	87.3	Confident	67 Å²	67	76.6 Å²	76.6	25%	0.254	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	156.2	172.4	68.1	-88.6	0	0	0	113.3	R1038 H1039 E1040 Y1056 S1057 V1070	R1038-W1068 HydrophobicContact CG-CE3 4.16Å; H1039-W1068 CarbonylContact O-C 3.51Å; H1039-W1068 WeakPolarHBondContact O-CA 3.19Å; H1039-W1068 WeakPolarHBondContact O-CB 3.44Å; E1040-W1068 HydrophobicContact CG-CB 4.17Å; Y1056-W1068 VanDerWaalsContact CB-CE2 3.49Å; Y1056-W1068 HydrophobicContact CD2-CH2 4.35Å; Y1056-W1068 HydrophobicContact CD2-CZ2 4.32Å; Y1056-W1068 HydrophobicContact CG-CH2 4.46Å; Y1056-W1068 AromaticContact CG-CZ2 3.99Å; Y1056-W1068 HydrophobicContact CG-CZ2 3.99Å; Y1056-W1068 PolarHBondContact O-N 3.29Å; S1057-W1068 PolarHBondContact O-NE1 3.47Å; W1068-V1070 HydrophobicContact CE3-CG2 4.03Å; W1068-V1070 HydrophobicContact CZ3-CB 4.43Å; W1068-V1070 HydrophobicContact CZ3-CG2 3.65Å
1069	I	92.6	Very high	87.1	Confident	36 Å²	36	80.5 Å²	80.5	19%	0.185	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	153.1	177.8	-167.1	166.1	0	0	0	109.8	I993 F995 R1038 H1039 F1041 I1071	I993-I1069 HydrophobicContact CG2-CD1 3.96Å; F995-I1069 HydrophobicContact CE1-CG2 4.36Å; F995-I1069 HydrophobicContact CZ-CG2 4.27Å; R1038-I1069 WeakPolarHBondContact CA-O 3.38Å; H1039-I1069 HydrophobicContact CB-CG2 4.31Å; H1039-I1069 PolarHBondContact N-O 2.79Å; H1039-I1069 PolarHBondContact O-N 3.06Å; F1041-I1069 HydrophobicContact CD1-CG2 4.29Å; F1041-I1069 HydrophobicContact CE1-CB 4.05Å; F1041-I1069 HydrophobicContact CE1-CG2 4.08Å; I1069-I1071 HydrophobicContact CD1-CD1 4.06Å; I1069-I1071 HydrophobicContact CG1-CD1 3.97Å; I1069-I1071 HydrophobicContact CG2-CD1 4.25Å
1070	V	89.4	Confident	86.8	Confident	72 Å²	72	70.4 Å²	70.4	44%	0.436	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132.4	171.9	165.1	0	0	0	0	108.9	G1037 R1038 W1068	G1037-V1070 WeakPolarHBondContact O-CA 3Å; R1038-V1070 HydrophobicContact CB-CG2 3.79Å; R1038-V1070 HydrophobicContact CG-CG2 3.99Å; W1068-V1070 HydrophobicContact CE3-CG2 4.03Å; W1068-V1070 HydrophobicContact CZ3-CB 4.43Å; W1068-V1070 HydrophobicContact CZ3-CG2 3.65Å
1071	I	86.5	Confident	87.1	Confident	8 Å²	8	74.8 Å²	74.8	4%	0.041	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	115.5	-179.9	-51.8	-50.1	0	0	0	108.6	R991 I993 V1034 A1036 G1037 I1069	R991-I1071 HydrophobicContact CB-CG2 3.61Å; R991-I1071 HydrophobicContact CG-CG2 4.4Å; I993-I1071 HydrophobicContact CD1-CD1 3.67Å; I993-I1071 HydrophobicContact CG1-CD1 3.6Å; I993-I1071 HydrophobicContact CG1-CG1 4.43Å; V1034-I1071 HydrophobicContact CB-CG1 4.22Å; V1034-I1071 HydrophobicContact CG1-CG1 3.85Å; A1036-I1071 CarbonylContact C-O 3.59Å; A1036-I1071 WeakPolarHBondContact CA-O 3.37Å; G1037-I1071 PolarHBondContact N-O 2.84Å; G1037-I1071 PolarHBondContact O-N 3.11Å; I1069-I1071 HydrophobicContact CD1-CD1 4.06Å; I1069-I1071 HydrophobicContact CG1-CD1 3.97Å; I1069-I1071 HydrophobicContact CG2-CD1 4.25Å
1072	D	75.6	Confident	87.7	Confident	161 Å²	161	66.4 Å²	66.4	86%	0.861	35%	0.351	S	S	*	.			trans	-80.9	0	169.1	-54.2	-39.5	0	0	0	111.6	R991	R991-D1072 VanDerWaalsContact CD-O 3.31Å; R991-D1072 WeakPolarHBondContact CD-O 3.37Å; R991-D1072 PolarHBondContact NH1-O 2.96Å

Retrieved 1,072 of 1,072 residues in 1776.3 ms (Link to these results)

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