A0A5K4F0Q3_SCHMA Loading...

Conserved oligomeric Golgi complex subunit 2

AlphaFold DB , UniProt , Accession A0A5K4F0Q3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 849 aa.

						>A0A5K4F0Q3_SCHMA|A0A5K4F0Q3
MPTIEELKNSNVDLSIENNNSNLRKLLLEDTLDVAPIGLTFCFDRESFLNNDFKPDDFILEQHCRGISLEKLHDDLLQYSNILKSSLIELINQDYADFVSLSTNLVGLDKSIDTIVTPLKQLQSYVSSVVDELESTDQELSAKLKSLQHIKNEQDYADSLFTLDACVSRLERWLTQSNQPSVNKEQTSDQLLHKSNNIKLDDSDNNDNETSKDINSDGDENELDIWPIEFYADCSLHEDIGQRMDRIANEYIKLQFFNKKCRGHPILNSLKPRINWITVNLQEQLEIRLKESFKACCLTVIDTNVDCTIPKHSIEQLRQVLSIYLAIDKLSDLLILYRKFVLHDQLSQIFTPRPELTHAGSDIALAAETLNSMYTRALKVLDSQLYYVKEQIIRYSPEGSEPLSDFDCLVGGFWPETIDLICNNLSEIFSPGHPDRFYSLYTISMNFIKTVETKTWSTNQLVNLRNHPSYSMFIDKWSLPVYFQIRFQEIAGNVENAMKKGLIEIKESRKSCLIEVTEVVICQLNRCWEKGIYLDKLIHRFWKLTLQILSRYSSFIDEQIKSIQENNATASQSSDSISLTKSTDCFPELLIYFFVDCLRLVDYVRLELKGEIFTCLNQRLVLQTMNNDSNDDTVNYETILSECLEQSCERLITSTNSIMDLIIQKIQQNCLNSIRQVLDIPRQYRWTNREFPSNASLYVSNIIHPLMKLDSLGLHLSQSVPNAQPFLSTLIKKCITTVTHDYTAQLSEVSTSVRKMEDSLRRLREVRRGSSQISNQSQSVNGSSGFHSDDKIRHQLYLDAKAYIDEVRKFWSLDREYTCELDDFIEQIDTTRTEPNICNMNTIPAVSQE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.8	Very low	42.7	Very low	229 Å²	229	130.4 Å²	130.4	100%	1.128	68%	0.676	S	S	*	*				0	103.9	0	-84.9	-80.7	161.8	0	0	105.3	T3	M1-T3 PolarHBondContact O-N 3.04Å
2	P	40.1	Very low	42.5	Very low	68 Å²	68	128.3 Å²	128.3	44%	0.442	67%	0.673	S	S	.	*			trans	-58.1	136.4	173.3	2.7	10	0	0	0	106.9	E6 L7	P2-E6 WeakPolarHBondContact CA-OE2 2.96Å; P2-E6 HydrophobicContact CB-CB 4.09Å; P2-L7 HydrophobicContact CB-CG 4.3Å; P2-L7 HydrophobicContact CG-CD1 4.34Å; P2-L7 HydrophobicContact CG-CD2 4.42Å; P2-L7 HydrophobicContact CG-CG 4.27Å
3	T	41.2	Very low	42.3	Very low	86 Å²	86	129.6 Å²	129.6	53%	0.528	68%	0.681	S	S	.	*			trans	-59	147.8	174.3	37.6	0	0	0	0	108.7	M1 E5 E6	M1-T3 PolarHBondContact O-N 3.04Å; T3-E5 PolarHBondContact O-N 3.34Å; T3-E6 PolarHBondContact O-N 3.46Å
4	I	47.7	Very low	42.2	Very low	134 Å²	134	129.5 Å²	129.5	69%	0.687	68%	0.68	S	S	*	*	H	α-helix	trans	-55.9	-17.5	-178.2	-69.7	168.8	0	0	0	112.3
5	E	48.9	Very low	42	Very low	156 Å²	156	125.8 Å²	125.8	73%	0.729	67%	0.669	S	S	*	*	H	α-helix	trans	-78.2	-28.3	171.9	-72.4	178.1	155.6	0	0	114.1	T3	T3-E5 PolarHBondContact O-N 3.34Å
6	E	48.3	Very low	42.1	Very low	128 Å²	128	126 Å²	126	60%	0.598	67%	0.669	S	S	*	*	H	α-helix	trans	-77.3	-28.2	176.9	-71.7	178.3	159.1	0	0	112.4	P2 T3	P2-E6 WeakPolarHBondContact CA-OE2 2.96Å; P2-E6 HydrophobicContact CB-CB 4.09Å; T3-E6 PolarHBondContact O-N 3.46Å
7	L	44.1	Very low	42	Very low	105 Å²	105	127.9 Å²	127.9	55%	0.55	67%	0.673	S	S	.	*	H	α-helix	trans	-78.8	-30.4	176.6	-74.8	167.8	0	0	0	113	P2 N9 S10	P2-L7 HydrophobicContact CB-CG 4.3Å; P2-L7 HydrophobicContact CG-CD1 4.34Å; P2-L7 HydrophobicContact CG-CD2 4.42Å; P2-L7 HydrophobicContact CG-CG 4.27Å; L7-N9 VanDerWaalsContact C-N 3.26Å; L7-N9 PolarHBondContact O-N 2.8Å; L7-S10 PolarHBondContact O-N 3.19Å; L7-S10 PolarHBondContact O-OG 3.1Å
8	K	49	Very low	42	Very low	174 Å²	174	126.8 Å²	126.8	76%	0.757	67%	0.668	S	S	*	*	H	α-helix	trans	-71.5	-17.2	176.6	-80.8	-173.8	173.2	-173.8	0	114.3
9	N	44.7	Very low	42.1	Very low	138 Å²	138	126.1 Å²	126.1	74%	0.738	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	7.8	178.6	-76	-17.6	0	0	0	113.8	L7 N11	L7-N9 VanDerWaalsContact C-N 3.26Å; L7-N9 PolarHBondContact O-N 2.8Å; N9-N11 PolarHBondContact O-N 2.97Å
10	S	36.5	Very low	42.5	Very low	77 Å²	77	125.7 Å²	125.7	54%	0.538	66%	0.663	S	S	.	*			trans	-85.1	97	173.9	63	0	0	0	0	110.9	L7 V12	L7-S10 PolarHBondContact O-N 3.19Å; L7-S10 PolarHBondContact O-OG 3.1Å; S10-V12 PolarHBondContact O-N 3.35Å; S10-V12 VanDerWaalsContact O-N 3.11Å
11	N	31.9	Very low	43	Very low	139 Å²	139	122.2 Å²	122.2	74%	0.743	65%	0.649	S	S	*	*			trans	-51.2	106.3	174.7	-76.8	-42.1	0	0	0	112.6	N9	N9-N11 PolarHBondContact O-N 2.97Å
12	V	41.3	Very low	43.8	Very low	105 Å²	105	116 Å²	116	64%	0.636	62%	0.62	S	S	*	*			trans	-122.9	-21.1	164.6	178.6	0	0	0	0	112.3	S10 L14 S15	S10-V12 PolarHBondContact O-N 3.35Å; S10-V12 VanDerWaalsContact O-N 3.11Å; V12-L14 VanDerWaalsContact C-N 3.33Å; V12-L14 PolarHBondContact O-N 3.34Å; V12-S15 PolarHBondContact O-OG 2.9Å
13	D	39	Very low	44.4	Very low	146 Å²	146	118.2 Å²	118.2	78%	0.781	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-3.6	-174	-74	-28.7	0	0	0	116.3
14	L	40.6	Very low	44.8	Very low	128 Å²	128	121.1 Å²	121.1	67%	0.67	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-0.3	-178.6	-74.1	165.5	0	0	0	115.2	V12	V12-L14 VanDerWaalsContact C-N 3.33Å; V12-L14 PolarHBondContact O-N 3.34Å
15	S	39.6	Very low	45	Very low	74 Å²	74	121 Å²	121	52%	0.517	62%	0.624	S	S	.	*	S	Bend	trans	-97	-22	-172.4	60.8	0	0	0	0	115.4	V12	V12-S15 PolarHBondContact O-OG 2.9Å
16	I	43.7	Very low	45.1	Very low	129 Å²	129	119.4 Å²	119.4	66%	0.662	62%	0.619	S	S	*	*	S	Bend	trans	-86.7	-34.5	-173.2	-62.3	175.5	0	0	0	112.2	N18	I16-N18 VanDerWaalsContact C-N 3.31Å; I16-N18 PolarHBondContact O-N 3.29Å
17	E	40.8	Very low	45.1	Very low	158 Å²	158	119.5 Å²	119.5	74%	0.738	62%	0.623	S	S	*	*	H	α-helix	trans	-69.1	-27.7	-179.1	-72.3	-173.1	151.4	0	0	113.3	N19	E17-N19 PolarHBondContact O-N 3.14Å
18	N	41.7	Very low	45.4	Very low	109 Å²	109	118.1 Å²	118.1	58%	0.583	62%	0.616	S	S	*	*	H	α-helix	trans	-74.8	-17.9	-177.8	-99.7	-15.2	0	0	0	115.1	I16 S21 N22	I16-N18 VanDerWaalsContact C-N 3.31Å; I16-N18 PolarHBondContact O-N 3.29Å; N18-S21 PolarHBondContact O-OG 3.02Å; N18-S21 VanDerWaalsContact O-OG 3.11Å; N18-N22 PolarHBondContact O-ND2 3.45Å
19	N	44.3	Very low	45.5	Very low	112 Å²	112	115 Å²	115	60%	0.599	61%	0.605	S	S	*	*	H	α-helix	trans	-83.5	-28.6	-179.1	-80.3	-22.6	0	0	0	113.2	E17	E17-N19 PolarHBondContact O-N 3.14Å
20	N	50.8	Low	45.8	Very low	118 Å²	118	115.3 Å²	115.3	63%	0.631	61%	0.606	S	S	*	*	H	α-helix	trans	-76	-28.8	-179.2	-83.6	-22.7	0	0	0	113.3
21	S	52.7	Low	46.5	Very low	54 Å²	54	115.5 Å²	115.5	38%	0.378	60%	0.604	S	S	.	*	H	α-helix	trans	-69.7	-39.5	178.4	55.4	0	0	0	0	112.2	N18 R24 K25	N18-S21 PolarHBondContact O-OG 3.02Å; N18-S21 VanDerWaalsContact O-OG 3.11Å; S21-R24 PolarHBondContact O-N 3.4Å; S21-K25 PolarHBondContact O-N 3.41Å
22	N	53.2	Low	47.5	Very low	97 Å²	97	111.2 Å²	111.2	52%	0.519	58%	0.581	S	S	.	*	H	α-helix	trans	-67.1	-37.7	179.8	-76.9	-30	0	0	0	113.2	N18 R24 K25 L26	N18-N22 PolarHBondContact O-ND2 3.45Å; N22-R24 VanDerWaalsContact C-N 3.35Å; N22-R24 PolarHBondContact O-N 3.19Å; N22-K25 PolarHBondContact O-N 2.92Å; N22-L26 PolarHBondContact O-N 3.19Å
23	L	51.5	Low	48.1	Very low	116 Å²	116	113.8 Å²	113.8	61%	0.607	59%	0.591	S	S	*	*	H	α-helix	trans	-67.2	-34.5	177.8	-109.9	155.6	0	0	0	112.7	L27	L23-L27 PolarHBondContact O-N 3.32Å
24	R	50.5	Low	48.9	Very low	146 Å²	146	109.3 Å²	109.3	55%	0.551	57%	0.569	S	S	*	*	H	α-helix	trans	-67.7	-40.6	173.3	-92.5	-171.6	177	-178.9	4.8	112.5	S21 N22 L26 L27 L28 N51	S21-R24 PolarHBondContact O-N 3.4Å; N22-R24 VanDerWaalsContact C-N 3.35Å; N22-R24 PolarHBondContact O-N 3.19Å; R24-L26 VanDerWaalsContact C-N 3.33Å; R24-L26 PolarHBondContact O-N 3.5Å; R24-L27 PolarHBondContact O-N 3.31Å; R24-L28 WeakPolarHBondContact O-CD1 3.3Å; R24-L28 PolarHBondContact O-N 2.89Å; R24-N51 PolarHBondContact NH1-ND2 3.21Å; R24-N51 PolarHBondContact NH1-OD1 3.44Å
25	K	51	Low	49.5	Very low	132 Å²	132	104 Å²	104	57%	0.574	54%	0.543	S	S	*	.	H	α-helix	trans	-58.3	-44.8	177.6	-103.4	-173.8	171.5	-169.4	0	112	S21 N22 L27 L28 E29	S21-K25 PolarHBondContact O-N 3.41Å; N22-K25 PolarHBondContact O-N 2.92Å; K25-L27 PolarHBondContact O-N 3.06Å; K25-L28 PolarHBondContact O-N 2.87Å; K25-E29 PolarHBondContact O-N 3.08Å
26	L	52.2	Low	50.2	Low	122 Å²	122	104.2 Å²	104.2	64%	0.639	54%	0.543	S	S	*	.	H	α-helix	trans	-65.7	-35.5	-179.8	-105.9	121.3	0	0	0	114.1	N22 R24	N22-L26 PolarHBondContact O-N 3.19Å; R24-L26 VanDerWaalsContact C-N 3.33Å; R24-L26 PolarHBondContact O-N 3.5Å
27	L	49	Very low	50.6	Low	130 Å²	130	107 Å²	107	68%	0.681	56%	0.557	S	S	*	*	H	α-helix	trans	-78.8	-21.7	-177.9	-75.4	169.8	0	0	0	113.9	L23 R24 K25	L23-L27 PolarHBondContact O-N 3.32Å; R24-L27 PolarHBondContact O-N 3.31Å; K25-L27 PolarHBondContact O-N 3.06Å
28	L	50.5	Low	51.3	Low	76 Å²	76	102.8 Å²	102.8	40%	0.398	56%	0.556	S	S	.	*	H	α-helix	trans	-94	-20.5	177.1	-83.7	122.4	0	0	0	113	R24 K25 D30 T31 L49	R24-L28 WeakPolarHBondContact O-CD1 3.3Å; R24-L28 PolarHBondContact O-N 2.89Å; K25-L28 PolarHBondContact O-N 2.87Å; L28-D30 PolarHBondContact O-N 3.36Å; L28-T31 PolarHBondContact O-N 3.49Å; L28-T31 PolarHBondContact O-OG1 3.15Å; L28-L49 HydrophobicContact CB-CD2 4Å; L28-L49 HydrophobicContact CD2-CD2 3.46Å; L28-L49 VanDerWaalsContact CD2-CD2 3.46Å; L28-L49 HydrophobicContact CG-CD2 4.28Å
29	E	49.7	Very low	52.3	Low	110 Å²	110	100 Å²	100	51%	0.514	54%	0.541	S	S	.	.	H	α-helix	trans	-58.6	-33.3	176.3	-93.2	174.4	167.7	0	0	113	K25 T31 L32	K25-E29 PolarHBondContact O-N 3.08Å; E29-T31 PolarHBondContact O-N 2.9Å; E29-T31 VanDerWaalsContact O-N 3.08Å; E29-L32 HydrophobicContact CG-CD1 4.35Å; E29-L32 PolarHBondContact O-N 3.42Å; E29-L32 VanDerWaalsContact O-N 3.14Å
30	D	50.5	Low	53.1	Low	143 Å²	143	100.8 Å²	100.8	77%	0.765	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	-13.7	175.5	-78.1	-14.1	0	0	0	113.5	L28	L28-D30 PolarHBondContact O-N 3.36Å
31	T	52.3	Low	54	Low	81 Å²	81	96.3 Å²	96.3	50%	0.497	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-3.4	177.3	61.6	0	0	0	0	114.3	L28 E29 V34	L28-T31 PolarHBondContact O-N 3.49Å; L28-T31 PolarHBondContact O-OG1 3.15Å; E29-T31 PolarHBondContact O-N 2.9Å; E29-T31 VanDerWaalsContact O-N 3.08Å; T31-V34 WeakPolarHBondContact O-CG2 3.38Å
32	L	52	Low	54.9	Low	49 Å²	49	95.1 Å²	95.1	26%	0.257	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-82.1	-10.1	-176.5	-81.9	157.9	0	0	0	114.9	E29 V34 R45 E46 L49	E29-L32 HydrophobicContact CG-CD1 4.35Å; E29-L32 PolarHBondContact O-N 3.42Å; E29-L32 VanDerWaalsContact O-N 3.14Å; L32-V34 PolarHBondContact O-N 3.34Å; L32-V34 VanDerWaalsContact O-N 3.13Å; L32-R45 HydrophobicContact CD2-CB 4.22Å; L32-E46 HydrophobicContact CD1-CG 4.48Å; L32-L49 HydrophobicContact CD1-CD1 4.03Å; L32-L49 HydrophobicContact CG-CD1 4.44Å
33	D	55.2	Low	55.8	Low	160 Å²	160	91 Å²	91	86%	0.856	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-76.2	8	179.3	-88.2	-13.1	0	0	0	114.5
34	V	56.1	Low	56.6	Low	52 Å²	52	89.6 Å²	89.6	32%	0.315	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-82.4	-16.3	-168.5	177.5	0	0	0	0	114.1	T31 L32 S86	T31-V34 WeakPolarHBondContact O-CG2 3.38Å; L32-V34 PolarHBondContact O-N 3.34Å; L32-V34 VanDerWaalsContact O-N 3.13Å; V34-S86 WeakPolarHBondContact CG1-OG 3.48Å
35	A	52.4	Low	57.6	Low	15 Å²	15	85.5 Å²	85.5	12%	0.124	47%	0.471	C	S	.	.	S	Bend	trans	-99.7	136.1	-180	0	0	0	0	0	112.3	I37	A35-I37 PolarHBondContact O-N 3.17Å
36	P	54.5	Low	58.4	Low	80 Å²	80	84.2 Å²	84.2	52%	0.519	47%	0.467	S	S	.	.			trans	-52.8	130.4	175.2	-20	27.5	0	0	0	111.3	G38 L39	P36-G38 PolarHBondContact O-N 2.7Å; P36-G38 VanDerWaalsContact O-N 3.07Å; P36-L39 HydrophobicContact CB-CD1 4.16Å; P36-L39 HydrophobicContact CG-CD1 3.96Å; P36-L39 PolarHBondContact O-N 2.89Å
37	I	51.7	Low	59.2	Low	187 Å²	187	79.6 Å²	79.6	96%	0.959	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	115.4	175.7	-56.7	160.4	0	0	0	108.2	A35	A35-I37 PolarHBondContact O-N 3.17Å
38	G	56.3	Low	60.4	Low	69 Å²	69	76.6 Å²	76.6	71%	0.711	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	123.2	-9.2	177.4	0	0	0	0	0	116.4	P36 T40	P36-G38 PolarHBondContact O-N 2.7Å; P36-G38 VanDerWaalsContact O-N 3.07Å; G38-T40 PolarHBondContact O-N 3.13Å
39	L	61.3	Low	61.2	Low	52 Å²	52	76.2 Å²	76.2	27%	0.272	43%	0.425	S	S	.	.			trans	-84.7	105.3	174.4	-81.7	152.2	0	0	0	111.5	P36 F41 R45 I82	P36-L39 HydrophobicContact CB-CD1 4.16Å; P36-L39 HydrophobicContact CG-CD1 3.96Å; P36-L39 PolarHBondContact O-N 2.89Å; L39-F41 HydrophobicContact CB-CE2 4.39Å; L39-F41 HydrophobicContact CB-CZ 4.23Å; L39-R45 PolarHBondContact O-NH2 3.38Å; L39-I82 HydrophobicContact CD1-CD1 3.76Å
40	T	61.1	Low	62.1	Low	128 Å²	128	75.8 Å²	75.8	79%	0.785	43%	0.426	S	S	*	.			trans	-89.4	115.7	172.3	54.5	0	0	0	0	109.8	G38	G38-T40 PolarHBondContact O-N 3.13Å
41	F	70.3	Confident	62.9	Low	24 Å²	24	74.7 Å²	74.7	11%	0.105	42%	0.42	C	S	.	.			trans	-91.3	157	169.8	-56.8	-73.4	0	0	0	109.9	L39 F43 R45 D75 Q78 Y79 I82	L39-F41 HydrophobicContact CB-CE2 4.39Å; L39-F41 HydrophobicContact CB-CZ 4.23Å; F41-F43 HydrophobicContact CB-CD1 4.38Å; F41-F43 HydrophobicContact CB-CD2 4.21Å; F41-F43 HydrophobicContact CB-CE1 4.14Å; F41-F43 HydrophobicContact CB-CE2 3.96Å; F41-F43 HydrophobicContact CB-CG 4.42Å; F41-F43 HydrophobicContact CB-CZ 3.93Å; F41-F43 HydrophobicContact CD1-CZ 4.28Å; F41-F43 HydrophobicContact CG-CE2 4.22Å; F41-F43 HydrophobicContact CG-CZ 4.1Å; F41-F43 PolarHBondContact O-N 3.39Å; F41-R45 HydrophobicContact CD2-CG 4.28Å; F41-D75 HydrophobicContact CD1-CB 4.11Å; F41-Q78 HydrophobicContact CE1-CB 4.45Å; F41-Y79 HydrophobicContact CD2-CD2 4.25Å; F41-Y79 HydrophobicContact CE1-CD2 4.31Å; F41-Y79 AromaticContact CE2-CD2 3.61Å; F41-Y79 HydrophobicContact CE2-CD2 3.61Å; F41-Y79 HydrophobicContact CE2-CE2 4.24Å; F41-Y79 HydrophobicContact CE2-CG 4.47Å; F41-Y79 AromaticContact CZ-CD2 3.66Å; F41-Y79 HydrophobicContact CZ-CD2 3.66Å; F41-Y79 HydrophobicContact CZ-CG 4.32Å; F41-I82 HydrophobicContact CE1-CD1 4.29Å; F41-I82 HydrophobicContact CZ-CD1 3.75Å
42	C	71.4	Confident	63.7	Low	28 Å²	28	77.9 Å²	77.9	19%	0.189	43%	0.434	C	S	.	.	S	Bend	trans	-70.5	-4.4	175	66.8	0	0	0	0	114.1	I67 D75	C42-I67 HydrophobicContact CB-CD1 4Å; C42-I67 HydrophobicContact CB-CG1 4.29Å; C42-I67 HydrophobicContact CB-CG2 3.84Å; C42-I67 WeakPolarHBondContact O-CD1 3.23Å; C42-D75 VanDerWaalsContact CB-OD2 3.28Å; C42-D75 WeakPolarHBondContact CB-OD2 3.4Å; C42-D75 PolarHBondContact N-OD2 2.97Å; C42-D75 PolarHBondContact SG-OD2 3.02Å
43	F	73.4	Confident	64.7	Low	12 Å²	12	78.9 Å²	78.9	5%	0.053	44%	0.436	C	S	.	.	S	Bend	trans	-126.3	159.1	177.4	52	-99	0	0	0	111.3	F41 F48 F58 Q62 L72 D75 L76 Y79	F41-F43 HydrophobicContact CB-CD1 4.38Å; F41-F43 HydrophobicContact CB-CD2 4.21Å; F41-F43 HydrophobicContact CB-CE1 4.14Å; F41-F43 HydrophobicContact CB-CE2 3.96Å; F41-F43 HydrophobicContact CB-CG 4.42Å; F41-F43 HydrophobicContact CB-CZ 3.93Å; F41-F43 HydrophobicContact CD1-CZ 4.28Å; F41-F43 HydrophobicContact CG-CE2 4.22Å; F41-F43 HydrophobicContact CG-CZ 4.1Å; F41-F43 PolarHBondContact O-N 3.39Å; F43-F48 AromaticContact CD2-CE2 3.51Å; F43-F48 HydrophobicContact CD2-CE2 3.51Å; F43-F48 HydrophobicContact CD2-CZ 4.06Å; F43-F48 AromaticContact CE2-CE2 3.5Å; F43-F48 HydrophobicContact CE2-CE2 3.5Å; F43-F48 VanDerWaalsContact CE2-CE2 3.5Å; F43-F48 HydrophobicContact CE2-CZ 4.07Å; F43-F48 HydrophobicContact CG-CE2 4.37Å; F43-F48 HydrophobicContact CZ-CE2 4.34Å; F43-F58 HydrophobicContact CB-CE1 4.47Å; F43-F58 HydrophobicContact CB-CE2 4.06Å; F43-F58 HydrophobicContact CB-CZ 3.48Å; F43-F58 VanDerWaalsContact CB-CZ 3.48Å; F43-F58 HydrophobicContact CD1-CZ 4.42Å; F43-F58 HydrophobicContact CD2-CZ 4.33Å; F43-F58 AromaticContact CG-CZ 3.83Å; F43-F58 HydrophobicContact CG-CZ 3.83Å; F43-Q62 HydrophobicContact CB-CG 4.44Å; F43-L72 HydrophobicContact CD1-CD1 4.09Å; F43-D75 HydrophobicContact CE1-CB 3.88Å; F43-L76 HydrophobicContact CE1-CB 4.44Å; F43-L76 HydrophobicContact CE1-CG 3.87Å; F43-L76 HydrophobicContact CZ-CG 4.23Å; F43-Y79 HydrophobicContact CE2-CD1 4.23Å; F43-Y79 HydrophobicContact CE2-CG 4.33Å; F43-Y79 HydrophobicContact CZ-CD1 4.3Å; F43-Y79 HydrophobicContact CZ-CG 4.22Å
44	D	68.5	Low	65.4	Low	85 Å²	85	77.5 Å²	77.5	46%	0.455	42%	0.423	S	S	.	.			trans	-79.7	133.3	172.1	-162.6	-6.7	0	0	0	110.1	E46 S47	D44-E46 VanDerWaalsContact C-N 3.26Å; D44-E46 PolarHBondContact O-N 2.73Å; D44-E46 PolarHBondContact OD1-N 3.18Å; D44-S47 WeakPolarHBondContact O-CB 3.48Å; D44-S47 PolarHBondContact O-N 3.34Å; D44-S47 PolarHBondContact O-OG 2.71Å
45	R	71.5	Confident	66.2	Low	61 Å²	61	78.5 Å²	78.5	23%	0.23	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-71	-28.8	-177.2	-58.1	177	-163.3	161.4	0.3	110.9	L32 L39 F41 S47 F48 Y79	L32-R45 HydrophobicContact CD2-CB 4.22Å; L39-R45 PolarHBondContact O-NH2 3.38Å; F41-R45 HydrophobicContact CD2-CG 4.28Å; R45-S47 PolarHBondContact O-N 2.96Å; R45-F48 PolarHBondContact O-N 3.41Å; R45-Y79 HydrophobicContact CG-CE2 4.27Å
46	E	67.5	Low	67.4	Low	105 Å²	105	83.6 Å²	83.6	49%	0.491	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-67.1	-21.2	178.9	-65.8	-177.2	-168.5	0	0	112.9	L32 D44 F48 L49	L32-E46 HydrophobicContact CD1-CG 4.48Å; D44-E46 VanDerWaalsContact C-N 3.26Å; D44-E46 PolarHBondContact O-N 2.73Å; D44-E46 PolarHBondContact OD1-N 3.18Å; E46-F48 PolarHBondContact O-N 3.21Å; E46-L49 WeakPolarHBondContact O-CB 3.46Å; E46-L49 PolarHBondContact O-N 3.46Å
47	S	68.6	Low	68.2	Low	25 Å²	25	84 Å²	84	18%	0.175	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-60.4	-31.7	178.9	-52.1	0	0	0	0	112.5	D44 R45 L49 F53	D44-S47 WeakPolarHBondContact O-CB 3.48Å; D44-S47 PolarHBondContact O-N 3.34Å; D44-S47 PolarHBondContact O-OG 2.71Å; R45-S47 PolarHBondContact O-N 2.96Å; S47-L49 PolarHBondContact O-N 2.96Å; S47-F53 WeakPolarHBondContact O-CD2 3.27Å
48	F	72.8	Confident	69.4	Low	67 Å²	67	75.5 Å²	75.5	29%	0.294	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-76.3	-8.5	178.8	-58.8	-74.5	0	0	0	113.8	F43 R45 E46 F53 F58 L76 Y79	F43-F48 AromaticContact CD2-CE2 3.51Å; F43-F48 HydrophobicContact CD2-CE2 3.51Å; F43-F48 HydrophobicContact CD2-CZ 4.06Å; F43-F48 AromaticContact CE2-CE2 3.5Å; F43-F48 HydrophobicContact CE2-CE2 3.5Å; F43-F48 VanDerWaalsContact CE2-CE2 3.5Å; F43-F48 HydrophobicContact CE2-CZ 4.07Å; F43-F48 HydrophobicContact CG-CE2 4.37Å; F43-F48 HydrophobicContact CZ-CE2 4.34Å; R45-F48 PolarHBondContact O-N 3.41Å; E46-F48 PolarHBondContact O-N 3.21Å; F48-F53 HydrophobicContact CD1-CE1 4.11Å; F48-F53 AromaticContact CD1-CE2 3.85Å; F48-F53 HydrophobicContact CD1-CE2 3.85Å; F48-F53 AromaticContact CD1-CZ 3.59Å; F48-F53 HydrophobicContact CD1-CZ 3.59Å; F48-F53 HydrophobicContact CE1-CE1 4.39Å; F48-F53 HydrophobicContact CE1-CE2 4.1Å; F48-F53 AromaticContact CE1-CZ 3.64Å; F48-F53 HydrophobicContact CE1-CZ 3.64Å; F48-F58 HydrophobicContact CE1-CE1 4.02Å; F48-F58 HydrophobicContact CE1-CZ 4.07Å; F48-F58 HydrophobicContact CE2-CZ 4.13Å; F48-F58 AromaticContact CZ-CE1 3.75Å; F48-F58 HydrophobicContact CZ-CE1 3.75Å; F48-F58 HydrophobicContact CZ-CE2 4.35Å; F48-F58 AromaticContact CZ-CZ 3.54Å; F48-F58 HydrophobicContact CZ-CZ 3.54Å; F48-L76 HydrophobicContact CZ-CD2 4.19Å; F48-Y79 HydrophobicContact CD2-CE1 4.46Å; F48-Y79 HydrophobicContact CE2-CE1 4.5Å
49	L	69.2	Low	70.2	Confident	67 Å²	67	75.8 Å²	75.8	35%	0.351	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-90.3	-8.3	179.9	-65.1	169.4	0	0	0	113.2	L28 L32 E46 S47	L28-L49 HydrophobicContact CB-CD2 4Å; L28-L49 HydrophobicContact CD2-CD2 3.46Å; L28-L49 VanDerWaalsContact CD2-CD2 3.46Å; L28-L49 HydrophobicContact CG-CD2 4.28Å; L32-L49 HydrophobicContact CD1-CD1 4.03Å; L32-L49 HydrophobicContact CG-CD1 4.44Å; E46-L49 WeakPolarHBondContact O-CB 3.46Å; E46-L49 PolarHBondContact O-N 3.46Å; S47-L49 PolarHBondContact O-N 2.96Å
50	N	67.7	Low	70.8	Confident	101 Å²	101	78.2 Å²	78.2	54%	0.54	41%	0.407	S	S	.	.			trans	-74.3	130.1	179.7	-79.7	-22.7	0	0	0	111.8	D52 F53	N50-D52 PolarHBondContact O-N 2.9Å; N50-F53 VanDerWaalsContact O-CB 3.27Å; N50-F53 WeakPolarHBondContact O-CB 3.37Å; N50-F53 PolarHBondContact O-N 3.36Å
51	N	66.5	Low	71.2	Confident	120 Å²	120	77 Å²	77	64%	0.642	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-28.7	177.5	-73.8	-25.4	0	0	0	113.1	R24 F53	R24-N51 PolarHBondContact NH1-ND2 3.21Å; R24-N51 PolarHBondContact NH1-OD1 3.44Å; N51-F53 VanDerWaalsContact C-N 3.35Å
52	D	69.6	Low	71.1	Confident	149 Å²	149	76 Å²	76	80%	0.797	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	20.6	179.4	-67.2	-25.9	0	0	0	112.9	N50 K54	N50-D52 PolarHBondContact O-N 2.9Å; D52-K54 PolarHBondContact O-N 3.29Å
53	F	72.4	Confident	70.9	Confident	69 Å²	69	80.3 Å²	80.3	30%	0.303	41%	0.405	S	S	.	.			trans	-60.5	110.1	179.1	-179.1	-96.3	0	0	0	110.9	S47 F48 N50 N51 P55 F58	S47-F53 WeakPolarHBondContact O-CD2 3.27Å; F48-F53 HydrophobicContact CD1-CE1 4.11Å; F48-F53 AromaticContact CD1-CE2 3.85Å; F48-F53 HydrophobicContact CD1-CE2 3.85Å; F48-F53 AromaticContact CD1-CZ 3.59Å; F48-F53 HydrophobicContact CD1-CZ 3.59Å; F48-F53 HydrophobicContact CE1-CE1 4.39Å; F48-F53 HydrophobicContact CE1-CE2 4.1Å; F48-F53 AromaticContact CE1-CZ 3.64Å; F48-F53 HydrophobicContact CE1-CZ 3.64Å; N50-F53 VanDerWaalsContact O-CB 3.27Å; N50-F53 WeakPolarHBondContact O-CB 3.37Å; N50-F53 PolarHBondContact O-N 3.36Å; N51-F53 VanDerWaalsContact C-N 3.35Å; F53-P55 HydrophobicContact CE1-CB 4.18Å; F53-F58 HydrophobicContact CD2-CB 4.42Å; F53-F58 HydrophobicContact CE2-CB 3.48Å; F53-F58 VanDerWaalsContact CE2-CB 3.48Å; F53-F58 HydrophobicContact CE2-CD1 4.18Å; F53-F58 AromaticContact CE2-CD2 3.63Å; F53-F58 HydrophobicContact CE2-CD2 3.63Å; F53-F58 HydrophobicContact CE2-CE2 4.32Å; F53-F58 AromaticContact CE2-CG 3.5Å; F53-F58 HydrophobicContact CE2-CG 3.5Å; F53-F58 HydrophobicContact CZ-CB 3.64Å; F53-F58 AromaticContact CZ-CD1 3.96Å; F53-F58 HydrophobicContact CZ-CD1 3.96Å; F53-F58 HydrophobicContact CZ-CD2 4.25Å; F53-F58 AromaticContact CZ-CG 3.71Å; F53-F58 HydrophobicContact CZ-CG 3.71Å
54	K	71.5	Confident	70.5	Confident	131 Å²	131	85 Å²	85	57%	0.57	44%	0.438	S	S	*	.			trans	-101.5	119	170.4	-74.4	175.8	179.7	175	0	108.7	D52 D56 D57 F58	D52-K54 PolarHBondContact O-N 3.29Å; K54-D56 PolarHBondContact O-N 3.49Å; K54-D57 HydrophobicContact CB-CB 3.99Å; K54-D57 WeakPolarHBondContact CB-OD2 3.46Å; K54-D57 WeakPolarHBondContact CD-OD2 3.45Å; K54-D57 PolarHBondContact O-N 2.72Å; K54-D57 VanDerWaalsContact O-N 3.14Å; K54-F58 PolarHBondContact O-N 3.49Å
55	P	73	Confident	70.6	Confident	74 Å²	74	89 Å²	89	48%	0.481	45%	0.446	S	S	.	.	H	α-helix	trans	-60.2	-35.4	-178.2	20.6	-29.8	0	0	0	112	F53 F58 I59	F53-P55 HydrophobicContact CE1-CB 4.18Å; P55-F58 PolarHBondContact O-N 2.93Å; P55-I59 VanDerWaalsContact O-CG1 3.27Å; P55-I59 WeakPolarHBondContact O-CG1 3.38Å; P55-I59 PolarHBondContact O-N 3.29Å
56	D	76.3	Confident	70.4	Confident	121 Å²	121	89.3 Å²	89.3	65%	0.647	47%	0.469	S	S	*	.	H	α-helix	trans	-65	-42.2	177.4	-62.5	-24.6	0	0	0	111.8	K54 I59 L60	K54-D56 PolarHBondContact O-N 3.49Å; D56-I59 PolarHBondContact O-N 2.9Å; D56-L60 WeakPolarHBondContact O-CB 3.15Å; D56-L60 VanDerWaalsContact O-CG 3.3Å; D56-L60 WeakPolarHBondContact O-CG 3.4Å; D56-L60 PolarHBondContact O-N 3.42Å
57	D	72.5	Confident	70.4	Confident	88 Å²	88	86 Å²	86	47%	0.471	45%	0.454	S	S	.	.	H	α-helix	trans	-68.9	-37.4	177.8	-69.4	-26.8	0	0	0	111.4	K54 L60 E61	K54-D57 HydrophobicContact CB-CB 3.99Å; K54-D57 WeakPolarHBondContact CB-OD2 3.46Å; K54-D57 WeakPolarHBondContact CD-OD2 3.45Å; K54-D57 PolarHBondContact O-N 2.72Å; K54-D57 VanDerWaalsContact O-N 3.14Å; D57-L60 PolarHBondContact O-N 3.48Å; D57-E61 VanDerWaalsContact O-CB 3.31Å; D57-E61 WeakPolarHBondContact O-CB 2.97Å; D57-E61 PolarHBondContact O-N 2.88Å
58	F	75.9	Confident	70.6	Confident	10 Å²	10	87.8 Å²	87.8	4%	0.044	47%	0.467	C	S	.	.	H	α-helix	trans	-67.3	-41.9	176.1	177.5	-99.7	0	0	0	112.6	F43 F48 F53 K54 P55 L60 E61 Q62	F43-F58 HydrophobicContact CB-CE1 4.47Å; F43-F58 HydrophobicContact CB-CE2 4.06Å; F43-F58 HydrophobicContact CB-CZ 3.48Å; F43-F58 VanDerWaalsContact CB-CZ 3.48Å; F43-F58 HydrophobicContact CD1-CZ 4.42Å; F43-F58 HydrophobicContact CD2-CZ 4.33Å; F43-F58 AromaticContact CG-CZ 3.83Å; F43-F58 HydrophobicContact CG-CZ 3.83Å; F48-F58 HydrophobicContact CE1-CE1 4.02Å; F48-F58 HydrophobicContact CE1-CZ 4.07Å; F48-F58 HydrophobicContact CE2-CZ 4.13Å; F48-F58 AromaticContact CZ-CE1 3.75Å; F48-F58 HydrophobicContact CZ-CE1 3.75Å; F48-F58 HydrophobicContact CZ-CE2 4.35Å; F48-F58 AromaticContact CZ-CZ 3.54Å; F48-F58 HydrophobicContact CZ-CZ 3.54Å; F53-F58 HydrophobicContact CD2-CB 4.42Å; F53-F58 HydrophobicContact CE2-CB 3.48Å; F53-F58 VanDerWaalsContact CE2-CB 3.48Å; F53-F58 HydrophobicContact CE2-CD1 4.18Å; F53-F58 AromaticContact CE2-CD2 3.63Å; F53-F58 HydrophobicContact CE2-CD2 3.63Å; F53-F58 HydrophobicContact CE2-CE2 4.32Å; F53-F58 AromaticContact CE2-CG 3.5Å; F53-F58 HydrophobicContact CE2-CG 3.5Å; F53-F58 HydrophobicContact CZ-CB 3.64Å; F53-F58 AromaticContact CZ-CD1 3.96Å; F53-F58 HydrophobicContact CZ-CD1 3.96Å; F53-F58 HydrophobicContact CZ-CD2 4.25Å; F53-F58 AromaticContact CZ-CG 3.71Å; F53-F58 HydrophobicContact CZ-CG 3.71Å; K54-F58 PolarHBondContact O-N 3.49Å; P55-F58 PolarHBondContact O-N 2.93Å; F58-L60 VanDerWaalsContact C-N 3.31Å; F58-E61 PolarHBondContact O-N 3.47Å; F58-Q62 HydrophobicContact CE1-CG 4.36Å; F58-Q62 HydrophobicContact CE2-CG 4.25Å; F58-Q62 HydrophobicContact CZ-CG 4.18Å; F58-Q62 WeakPolarHBondContact O-CG 3.48Å; F58-Q62 PolarHBondContact O-N 2.82Å
59	I	73.6	Confident	70.5	Confident	75 Å²	75	89.8 Å²	89.8	39%	0.385	48%	0.48	S	S	.	.	H	α-helix	trans	-64	-41.3	174.7	-67.1	168.2	0	0	0	109.6	P55 D56 H63 L69	P55-I59 VanDerWaalsContact O-CG1 3.27Å; P55-I59 WeakPolarHBondContact O-CG1 3.38Å; P55-I59 PolarHBondContact O-N 3.29Å; D56-I59 PolarHBondContact O-N 2.9Å; I59-H63 WeakPolarHBondContact O-CB 3.4Å; I59-H63 PolarHBondContact O-N 3.44Å; I59-L69 HydrophobicContact CG2-CD1 4.44Å
60	L	72.6	Confident	71	Confident	102 Å²	102	94 Å²	94	53%	0.534	50%	0.498	S	S	.	.	H	α-helix	trans	-65	-40.8	175.3	-77.2	167.7	0	0	0	112.4	D56 D57 F58 H63 C64	D56-L60 WeakPolarHBondContact O-CB 3.15Å; D56-L60 VanDerWaalsContact O-CG 3.3Å; D56-L60 WeakPolarHBondContact O-CG 3.4Å; D56-L60 PolarHBondContact O-N 3.42Å; D57-L60 PolarHBondContact O-N 3.48Å; F58-L60 VanDerWaalsContact C-N 3.31Å; L60-H63 PolarHBondContact O-N 2.98Å; L60-C64 VanDerWaalsContact O-CB 3.28Å; L60-C64 WeakPolarHBondContact O-CB 3.35Å; L60-C64 PolarHBondContact O-N 2.96Å; L60-C64 PolarHBondContact O-SG 2.96Å
61	E	69.9	Low	71.4	Confident	103 Å²	103	95.1 Å²	95.1	48%	0.481	50%	0.498	S	S	.	.	H	α-helix	trans	-66.2	-41	179.1	-161.9	179	-172.8	0	0	111.4	D57 F58 C64 R65	D57-E61 VanDerWaalsContact O-CB 3.31Å; D57-E61 WeakPolarHBondContact O-CB 2.97Å; D57-E61 PolarHBondContact O-N 2.88Å; F58-E61 PolarHBondContact O-N 3.47Å; E61-C64 PolarHBondContact O-N 3.41Å; E61-R65 PolarHBondContact O-N 3.49Å
62	Q	68	Low	72	Confident	3 Å²	3	89.9 Å²	89.9	1%	0.014	47%	0.47	C	S	.	.	H	α-helix	trans	-76	-30.9	175.6	-61.7	-52.7	-3.8	0	0	113.8	F43 F58 C64 R65 I67 L72	F43-Q62 HydrophobicContact CB-CG 4.44Å; F58-Q62 HydrophobicContact CE1-CG 4.36Å; F58-Q62 HydrophobicContact CE2-CG 4.25Å; F58-Q62 HydrophobicContact CZ-CG 4.18Å; F58-Q62 WeakPolarHBondContact O-CG 3.48Å; F58-Q62 PolarHBondContact O-N 2.82Å; Q62-C64 VanDerWaalsContact C-N 3.35Å; Q62-R65 PolarHBondContact O-N 3.16Å; Q62-R65 VanDerWaalsContact OE1-CD 3.3Å; Q62-I67 HydrophobicContact CB-CD1 4.02Å; Q62-I67 HydrophobicContact CG-CD1 4.39Å; Q62-I67 PolarHBondContact O-N 3.37Å; Q62-L72 HydrophobicContact CB-CD1 3.88Å; Q62-L72 HydrophobicContact CG-CD1 4.04Å
63	H	67.2	Low	72.5	Confident	119 Å²	119	88 Å²	88	55%	0.551	46%	0.456	S	S	*	.	H	α-helix	trans	-66.7	-38.4	170.5	-169.4	-86.5	0	0	0	111.1	I59 L60 R65 G66	I59-H63 WeakPolarHBondContact O-CB 3.4Å; I59-H63 PolarHBondContact O-N 3.44Å; L60-H63 PolarHBondContact O-N 2.98Å; H63-R65 VanDerWaalsContact C-N 3.3Å; H63-R65 PolarHBondContact O-N 2.91Å; H63-G66 PolarHBondContact O-N 3Å; H63-G66 VanDerWaalsContact O-N 3.15Å
64	C	66.8	Low	73	Confident	110 Å²	110	89.3 Å²	89.3	74%	0.743	47%	0.466	S	S	*	.	H	α-helix	trans	-66.3	-27.7	172.6	-75.8	0	0	0	0	113.2	L60 E61 Q62 G66	L60-C64 VanDerWaalsContact O-CB 3.28Å; L60-C64 WeakPolarHBondContact O-CB 3.35Å; L60-C64 PolarHBondContact O-N 2.96Å; L60-C64 PolarHBondContact O-SG 2.96Å; E61-C64 PolarHBondContact O-N 3.41Å; Q62-C64 VanDerWaalsContact C-N 3.35Å; C64-G66 PolarHBondContact O-N 2.86Å
65	R	69.1	Low	73.4	Confident	168 Å²	168	84 Å²	84	63%	0.634	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	3.1	172.2	-77.5	-178.8	175.9	-174.6	6.2	114.3	E61 Q62 H63 I67	E61-R65 PolarHBondContact O-N 3.49Å; Q62-R65 PolarHBondContact O-N 3.16Å; Q62-R65 VanDerWaalsContact OE1-CD 3.3Å; H63-R65 VanDerWaalsContact C-N 3.3Å; H63-R65 PolarHBondContact O-N 2.91Å; R65-I67 HydrophobicContact CB-CD1 4.24Å
66	G	67.3	Low	73.8	Confident	69 Å²	69	83.5 Å²	83.5	71%	0.711	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	16.9	174.3	0	0	0	0	0	114.5	H63 C64	H63-G66 PolarHBondContact O-N 3Å; H63-G66 VanDerWaalsContact O-N 3.15Å; C64-G66 PolarHBondContact O-N 2.86Å
67	I	67.9	Low	74.2	Confident	34 Å²	34	81.9 Å²	81.9	17%	0.174	43%	0.428	C	S	.	.			trans	-81.3	124.8	177	-60	155.9	0	0	0	108.3	C42 Q62 R65 L69 K71 L72	C42-I67 HydrophobicContact CB-CD1 4Å; C42-I67 HydrophobicContact CB-CG1 4.29Å; C42-I67 HydrophobicContact CB-CG2 3.84Å; C42-I67 WeakPolarHBondContact O-CD1 3.23Å; Q62-I67 HydrophobicContact CB-CD1 4.02Å; Q62-I67 HydrophobicContact CG-CD1 4.39Å; Q62-I67 PolarHBondContact O-N 3.37Å; R65-I67 HydrophobicContact CB-CD1 4.24Å; I67-L69 PolarHBondContact O-N 3.1Å; I67-K71 HydrophobicContact CG2-CB 4.46Å; I67-L72 HydrophobicContact CG2-CB 4.18Å
68	S	72.9	Confident	74.7	Confident	64 Å²	64	82 Å²	82	45%	0.448	43%	0.426	S	S	.	.			trans	-60.2	136.5	174.6	57.6	0	0	0	0	110.6	E70 K71 L72	S68-E70 PolarHBondContact O-N 3.04Å; S68-E70 VanDerWaalsContact O-N 3.1Å; S68-K71 PolarHBondContact O-N 3.34Å; S68-K71 WeakPolarHBondContact OG-CB 3.31Å; S68-K71 PolarHBondContact OG-N 3.37Å; S68-L72 PolarHBondContact O-N 3.15Å
69	L	71.7	Confident	74.9	Confident	108 Å²	108	83.4 Å²	83.4	57%	0.565	43%	0.431	S	S	*	.	H	α-helix	trans	-55.2	-31.4	179.6	-137.2	91.2	0	0	0	112.9	I59 I67 H73	I59-L69 HydrophobicContact CG2-CD1 4.44Å; I67-L69 PolarHBondContact O-N 3.1Å; L69-H73 VanDerWaalsContact O-CB 3.3Å; L69-H73 WeakPolarHBondContact O-CB 3.27Å; L69-H73 PolarHBondContact O-N 2.64Å
70	E	77.8	Confident	75.4	Confident	157 Å²	157	82.1 Å²	82.1	73%	0.734	43%	0.429	S	S	*	.	H	α-helix	trans	-65.8	-47.6	175.8	-66.2	174.6	172.5	0	0	111.9	S68 H73 D74	S68-E70 PolarHBondContact O-N 3.04Å; S68-E70 VanDerWaalsContact O-N 3.1Å; E70-H73 WeakPolarHBondContact O-CB 3.35Å; E70-H73 PolarHBondContact O-N 3.29Å; E70-D74 PolarHBondContact O-N 3.19Å
71	K	77.5	Confident	75.9	Confident	123 Å²	123	81.3 Å²	81.3	54%	0.535	43%	0.425	S	S	.	.	H	α-helix	trans	-65.9	-38.8	176.2	-166.6	171.5	-175.9	174.8	0	112.3	I67 S68 H73 D74 D75	I67-K71 HydrophobicContact CG2-CB 4.46Å; S68-K71 PolarHBondContact O-N 3.34Å; S68-K71 WeakPolarHBondContact OG-CB 3.31Å; S68-K71 PolarHBondContact OG-N 3.37Å; K71-H73 VanDerWaalsContact C-N 3.34Å; K71-D74 PolarHBondContact O-N 2.85Å; K71-D75 WeakPolarHBondContact O-CB 3.48Å; K71-D75 PolarHBondContact O-N 3.41Å
72	L	78	Confident	76.4	Confident	11 Å²	11	77.5 Å²	77.5	6%	0.058	41%	0.408	C	S	.	.	H	α-helix	trans	-60.4	-45.4	173.2	-174.2	78.3	0	0	0	110.8	F43 Q62 I67 S68 L76	F43-L72 HydrophobicContact CD1-CD1 4.09Å; Q62-L72 HydrophobicContact CB-CD1 3.88Å; Q62-L72 HydrophobicContact CG-CD1 4.04Å; I67-L72 HydrophobicContact CG2-CB 4.18Å; S68-L72 PolarHBondContact O-N 3.15Å; L72-L76 HydrophobicContact CG-CD1 4.15Å; L72-L76 VanDerWaalsContact O-CB 3.28Å; L72-L76 WeakPolarHBondContact O-CB 3.38Å; L72-L76 PolarHBondContact O-N 3.35Å
73	H	80.5	Confident	76.9	Confident	109 Å²	109	81 Å²	81	51%	0.505	43%	0.426	S	S	.	.	H	α-helix	trans	-61	-47.9	176.3	170.3	-86.5	0	0	0	111.8	L69 E70 K71 L76 L77	L69-H73 VanDerWaalsContact O-CB 3.3Å; L69-H73 WeakPolarHBondContact O-CB 3.27Å; L69-H73 PolarHBondContact O-N 2.64Å; E70-H73 WeakPolarHBondContact O-CB 3.35Å; E70-H73 PolarHBondContact O-N 3.29Å; K71-H73 VanDerWaalsContact C-N 3.34Å; H73-L76 PolarHBondContact O-N 2.89Å; H73-L77 WeakPolarHBondContact O-CB 3.29Å; H73-L77 PolarHBondContact O-N 2.64Å
74	D	82.9	Confident	77.5	Confident	96 Å²	96	81 Å²	81	51%	0.513	43%	0.425	S	S	.	.	H	α-helix	trans	-66.5	-41.9	-177.8	-72.7	-8.7	0	0	0	112	E70 K71 L77 Q78	E70-D74 PolarHBondContact O-N 3.19Å; K71-D74 PolarHBondContact O-N 2.85Å; D74-L77 PolarHBondContact O-N 2.94Å; D74-Q78 VanDerWaalsContact O-CB 3.31Å; D74-Q78 WeakPolarHBondContact O-CB 3.39Å; D74-Q78 PolarHBondContact O-N 3.11Å
75	D	80.7	Confident	78.1	Confident	21 Å²	21	78.8 Å²	78.8	11%	0.112	41%	0.411	C	S	.	.	H	α-helix	trans	-66.5	-38.8	175.5	-77.3	0.2	0	0	0	111.2	F41 C42 F43 K71 Q78 Y79	F41-D75 HydrophobicContact CD1-CB 4.11Å; C42-D75 VanDerWaalsContact CB-OD2 3.28Å; C42-D75 WeakPolarHBondContact CB-OD2 3.4Å; C42-D75 PolarHBondContact N-OD2 2.97Å; C42-D75 PolarHBondContact SG-OD2 3.02Å; F43-D75 HydrophobicContact CE1-CB 3.88Å; K71-D75 WeakPolarHBondContact O-CB 3.48Å; K71-D75 PolarHBondContact O-N 3.41Å; D75-Q78 PolarHBondContact O-N 3.5Å; D75-Y79 VanDerWaalsContact O-CB 3.3Å; D75-Y79 WeakPolarHBondContact O-CB 3.48Å; D75-Y79 PolarHBondContact O-N 3.49Å
76	L	80.7	Confident	78.2	Confident	62 Å²	62	71.6 Å²	71.6	33%	0.325	39%	0.386	S	S	.	.	H	α-helix	trans	-65.2	-39.9	173.2	-102.7	153.5	0	0	0	112	F43 F48 L72 H73 Y79 S80	F43-L76 HydrophobicContact CE1-CB 4.44Å; F43-L76 HydrophobicContact CE1-CG 3.87Å; F43-L76 HydrophobicContact CZ-CG 4.23Å; F48-L76 HydrophobicContact CZ-CD2 4.19Å; L72-L76 HydrophobicContact CG-CD1 4.15Å; L72-L76 VanDerWaalsContact O-CB 3.28Å; L72-L76 WeakPolarHBondContact O-CB 3.38Å; L72-L76 PolarHBondContact O-N 3.35Å; H73-L76 PolarHBondContact O-N 2.89Å; L76-Y79 PolarHBondContact O-N 3.46Å; L76-S80 VanDerWaalsContact O-CB 3.22Å; L76-S80 WeakPolarHBondContact O-CB 3.26Å; L76-S80 PolarHBondContact O-N 3.29Å
77	L	85.2	Confident	78.6	Confident	87 Å²	87	73.2 Å²	73.2	46%	0.455	38%	0.378	S	S	.	.	H	α-helix	trans	-68.1	-40.3	177.8	-156.7	97.8	0	0	0	110.6	H73 D74 S80 N81	H73-L77 WeakPolarHBondContact O-CB 3.29Å; H73-L77 PolarHBondContact O-N 2.64Å; D74-L77 PolarHBondContact O-N 2.94Å; L77-S80 PolarHBondContact O-N 2.97Å; L77-N81 WeakPolarHBondContact O-CB 3.42Å; L77-N81 VanDerWaalsContact O-CG 3.24Å; L77-N81 PolarHBondContact O-N 3.2Å; L77-N81 PolarHBondContact O-ND2 3.34Å
78	Q	82.6	Confident	79.1	Confident	91 Å²	91	76.4 Å²	76.4	43%	0.425	39%	0.394	S	S	.	.	H	α-helix	trans	-65.5	-45.2	175.8	-165.7	175.4	63.1	0	0	110.8	F41 D74 D75 S80 N81 I82	F41-Q78 HydrophobicContact CE1-CB 4.45Å; D74-Q78 VanDerWaalsContact O-CB 3.31Å; D74-Q78 WeakPolarHBondContact O-CB 3.39Å; D74-Q78 PolarHBondContact O-N 3.11Å; D75-Q78 PolarHBondContact O-N 3.5Å; Q78-S80 VanDerWaalsContact C-N 3.35Å; Q78-S80 PolarHBondContact O-N 2.92Å; Q78-N81 PolarHBondContact O-N 3.16Å; Q78-I82 HydrophobicContact CG-CD1 4.2Å; Q78-I82 WeakPolarHBondContact O-CD1 3.37Å; Q78-I82 VanDerWaalsContact O-CG1 3.3Å; Q78-I82 WeakPolarHBondContact O-CG1 3.41Å; Q78-I82 PolarHBondContact O-N 2.94Å
79	Y	80.9	Confident	79.2	Confident	40 Å²	40	79.7 Å²	79.7	16%	0.157	40%	0.402	C	S	.	.	H	α-helix	trans	-62.5	-40.8	174.2	-172.3	-118.2	0	0	0	111.9	F41 F43 R45 F48 D75 L76 N81 I82 L83	F41-Y79 HydrophobicContact CD2-CD2 4.25Å; F41-Y79 HydrophobicContact CE1-CD2 4.31Å; F41-Y79 AromaticContact CE2-CD2 3.61Å; F41-Y79 HydrophobicContact CE2-CD2 3.61Å; F41-Y79 HydrophobicContact CE2-CE2 4.24Å; F41-Y79 HydrophobicContact CE2-CG 4.47Å; F41-Y79 AromaticContact CZ-CD2 3.66Å; F41-Y79 HydrophobicContact CZ-CD2 3.66Å; F41-Y79 HydrophobicContact CZ-CG 4.32Å; F43-Y79 HydrophobicContact CE2-CD1 4.23Å; F43-Y79 HydrophobicContact CE2-CG 4.33Å; F43-Y79 HydrophobicContact CZ-CD1 4.3Å; F43-Y79 HydrophobicContact CZ-CG 4.22Å; R45-Y79 HydrophobicContact CG-CE2 4.27Å; F48-Y79 HydrophobicContact CD2-CE1 4.46Å; F48-Y79 HydrophobicContact CE2-CE1 4.5Å; D75-Y79 VanDerWaalsContact O-CB 3.3Å; D75-Y79 WeakPolarHBondContact O-CB 3.48Å; D75-Y79 PolarHBondContact O-N 3.49Å; L76-Y79 PolarHBondContact O-N 3.46Å; Y79-N81 VanDerWaalsContact C-N 3.34Å; Y79-N81 PolarHBondContact O-N 3.34Å; Y79-I82 PolarHBondContact O-N 3.38Å; Y79-L83 HydrophobicContact CD1-CD1 3.66Å; Y79-L83 HydrophobicContact CE1-CD1 3.34Å; Y79-L83 HydrophobicContact CE1-CG 4.21Å; Y79-L83 HydrophobicContact CE2-CD1 4.38Å; Y79-L83 HydrophobicContact CE2-CG 4.41Å; Y79-L83 HydrophobicContact CG-CD1 4.31Å; Y79-L83 WeakPolarHBondContact O-CB 3.32Å; Y79-L83 WeakPolarHBondContact O-CG 3.49Å; Y79-L83 PolarHBondContact O-N 3.45Å
80	S	82.8	Confident	79.2	Confident	48 Å²	48	78.5 Å²	78.5	34%	0.336	40%	0.396	S	S	.	.	H	α-helix	trans	-61.6	-41.1	174	-179.5	0	0	0	0	112.3	L76 L77 Q78 K84	L76-S80 VanDerWaalsContact O-CB 3.22Å; L76-S80 WeakPolarHBondContact O-CB 3.26Å; L76-S80 PolarHBondContact O-N 3.29Å; L77-S80 PolarHBondContact O-N 2.97Å; Q78-S80 VanDerWaalsContact C-N 3.35Å; Q78-S80 PolarHBondContact O-N 2.92Å; S80-K84 WeakPolarHBondContact O-CB 3.38Å; S80-K84 WeakPolarHBondContact O-CG 3.42Å; S80-K84 PolarHBondContact O-N 2.88Å
81	N	82.7	Confident	78.8	Confident	84 Å²	84	74.3 Å²	74.3	45%	0.449	38%	0.378	S	S	.	.	H	α-helix	trans	-68.6	-41.7	177.2	-74.1	-29.4	0	0	0	111.6	L77 Q78 Y79 K84 S85	L77-N81 WeakPolarHBondContact O-CB 3.42Å; L77-N81 VanDerWaalsContact O-CG 3.24Å; L77-N81 PolarHBondContact O-N 3.2Å; L77-N81 PolarHBondContact O-ND2 3.34Å; Q78-N81 PolarHBondContact O-N 3.16Å; Y79-N81 VanDerWaalsContact C-N 3.34Å; Y79-N81 PolarHBondContact O-N 3.34Å; N81-K84 PolarHBondContact O-N 2.93Å; N81-S85 PolarHBondContact O-N 3.49Å; N81-S85 PolarHBondContact O-OG 3.43Å
82	I	80.6	Confident	78.6	Confident	23 Å²	23	73.6 Å²	73.6	12%	0.118	38%	0.38	C	S	.	.	H	α-helix	trans	-59.8	-50.1	174.3	-69.6	160.1	0	0	0	110	L39 F41 Q78 Y79 K84 S85 S86	L39-I82 HydrophobicContact CD1-CD1 3.76Å; F41-I82 HydrophobicContact CE1-CD1 4.29Å; F41-I82 HydrophobicContact CZ-CD1 3.75Å; Q78-I82 HydrophobicContact CG-CD1 4.2Å; Q78-I82 WeakPolarHBondContact O-CD1 3.37Å; Q78-I82 VanDerWaalsContact O-CG1 3.3Å; Q78-I82 WeakPolarHBondContact O-CG1 3.41Å; Q78-I82 PolarHBondContact O-N 2.94Å; Y79-I82 PolarHBondContact O-N 3.38Å; I82-K84 VanDerWaalsContact C-N 3.29Å; I82-K84 PolarHBondContact O-N 3.25Å; I82-S85 WeakPolarHBondContact CA-OG 3.43Å; I82-S85 PolarHBondContact O-N 3.24Å; I82-S85 PolarHBondContact O-OG 2.94Å; I82-S86 WeakPolarHBondContact O-CB 3.41Å; I82-S86 PolarHBondContact O-N 2.67Å; I82-S86 PolarHBondContact O-OG 2.77Å
83	L	78.5	Confident	78.4	Confident	77 Å²	77	80.7 Å²	80.7	40%	0.403	41%	0.413	S	S	.	.	H	α-helix	trans	-58.2	-39.3	175.2	-81.6	167.8	0	0	0	112.2	Y79 L87	Y79-L83 HydrophobicContact CD1-CD1 3.66Å; Y79-L83 HydrophobicContact CE1-CD1 3.34Å; Y79-L83 HydrophobicContact CE1-CG 4.21Å; Y79-L83 HydrophobicContact CE2-CD1 4.38Å; Y79-L83 HydrophobicContact CE2-CG 4.41Å; Y79-L83 HydrophobicContact CG-CD1 4.31Å; Y79-L83 WeakPolarHBondContact O-CB 3.32Å; Y79-L83 WeakPolarHBondContact O-CG 3.49Å; Y79-L83 PolarHBondContact O-N 3.45Å; L83-L87 WeakPolarHBondContact O-CB 3.29Å; L83-L87 PolarHBondContact O-N 3.33Å
84	K	80.8	Confident	77.8	Confident	119 Å²	119	78.3 Å²	78.3	52%	0.517	40%	0.404	S	S	.	.	H	α-helix	trans	-65.8	-45.4	175.1	-82.7	176.9	-179.9	170.5	0	112.3	S80 N81 I82 L87 I88	S80-K84 WeakPolarHBondContact O-CB 3.38Å; S80-K84 WeakPolarHBondContact O-CG 3.42Å; S80-K84 PolarHBondContact O-N 2.88Å; N81-K84 PolarHBondContact O-N 2.93Å; I82-K84 VanDerWaalsContact C-N 3.29Å; I82-K84 PolarHBondContact O-N 3.25Å; K84-L87 PolarHBondContact O-N 3.21Å; K84-I88 WeakPolarHBondContact O-CD1 3.4Å; K84-I88 VanDerWaalsContact O-CG1 3.24Å; K84-I88 WeakPolarHBondContact O-CG1 3.44Å; K84-I88 PolarHBondContact O-N 2.91Å
85	S	78.4	Confident	77.3	Confident	64 Å²	64	80.9 Å²	80.9	45%	0.448	41%	0.407	S	S	.	.	H	α-helix	trans	-64.3	-42.1	176.9	37.8	0	0	0	0	111.7	N81 I82 I88 E89	N81-S85 PolarHBondContact O-N 3.49Å; N81-S85 PolarHBondContact O-OG 3.43Å; I82-S85 WeakPolarHBondContact CA-OG 3.43Å; I82-S85 PolarHBondContact O-N 3.24Å; I82-S85 PolarHBondContact O-OG 2.94Å; S85-I88 PolarHBondContact O-N 3.4Å; S85-E89 PolarHBondContact O-N 2.97Å
86	S	72.1	Confident	76.8	Confident	17 Å²	17	83.2 Å²	83.2	12%	0.119	43%	0.43	C	S	.	.	H	α-helix	trans	-70.3	-34.8	177.1	-65.9	0	0	0	0	112.7	V34 I82 I88 E89 L90	V34-S86 WeakPolarHBondContact CG1-OG 3.48Å; I82-S86 WeakPolarHBondContact O-CB 3.41Å; I82-S86 PolarHBondContact O-N 2.67Å; I82-S86 PolarHBondContact O-OG 2.77Å; S86-I88 VanDerWaalsContact C-N 3.29Å; S86-I88 PolarHBondContact O-N 2.92Å; S86-E89 PolarHBondContact O-N 3.21Å; S86-L90 WeakPolarHBondContact O-CB 3.41Å; S86-L90 PolarHBondContact O-N 3.3Å
87	L	76.3	Confident	76.2	Confident	102 Å²	102	85.2 Å²	85.2	53%	0.534	44%	0.441	S	S	.	.	H	α-helix	trans	-61.3	-41.2	170.8	-179.1	73.1	0	0	0	110.5	L83 K84 I91	L83-L87 WeakPolarHBondContact O-CB 3.29Å; L83-L87 PolarHBondContact O-N 3.33Å; K84-L87 PolarHBondContact O-N 3.21Å; L87-I91 HydrophobicContact CD1-CD1 4.1Å; L87-I91 HydrophobicContact CD1-CG1 4.48Å; L87-I91 HydrophobicContact CD2-CD1 4.39Å; L87-I91 HydrophobicContact CG-CD1 3.8Å; L87-I91 HydrophobicContact CG-CG1 4.48Å; L87-I91 VanDerWaalsContact O-CB 3.28Å; L87-I91 WeakPolarHBondContact O-CB 3.33Å; L87-I91 WeakPolarHBondContact O-CD1 3.31Å; L87-I91 WeakPolarHBondContact O-CG1 3.49Å; L87-I91 PolarHBondContact O-N 2.73Å
88	I	78.2	Confident	75.4	Confident	101 Å²	101	86.8 Å²	86.8	52%	0.518	44%	0.444	S	S	.	.	H	α-helix	trans	-67.5	-39.8	175.9	-67.4	163.5	0	0	0	110.8	K84 S85 S86 N92	K84-I88 WeakPolarHBondContact O-CD1 3.4Å; K84-I88 VanDerWaalsContact O-CG1 3.24Å; K84-I88 WeakPolarHBondContact O-CG1 3.44Å; K84-I88 PolarHBondContact O-N 2.91Å; S85-I88 PolarHBondContact O-N 3.4Å; S86-I88 VanDerWaalsContact C-N 3.29Å; S86-I88 PolarHBondContact O-N 2.92Å; I88-N92 WeakPolarHBondContact CG2-ND2 3.4Å; I88-N92 VanDerWaalsContact O-CB 3.27Å; I88-N92 WeakPolarHBondContact O-CB 3.27Å; I88-N92 VanDerWaalsContact O-CG 3.23Å; I88-N92 PolarHBondContact O-N 3.04Å; I88-N92 PolarHBondContact O-ND2 3.41Å; I88-N92 VanDerWaalsContact O-ND2 3.13Å
89	E	74.7	Confident	74.7	Confident	134 Å²	134	85.4 Å²	85.4	63%	0.626	44%	0.442	S	S	*	.	H	α-helix	trans	-63.2	-47.4	173.7	-91.4	-177.7	159.7	0	0	112	S85 S86 N92 Q93	S85-E89 PolarHBondContact O-N 2.97Å; S86-E89 PolarHBondContact O-N 3.21Å; E89-N92 CarbonylContact O-C 3.52Å; E89-N92 PolarHBondContact O-N 3.17Å; E89-Q93 WeakPolarHBondContact O-CB 3.19Å; E89-Q93 PolarHBondContact O-N 3.25Å
90	L	71.7	Confident	74.1	Confident	83 Å²	83	85.9 Å²	85.9	44%	0.435	45%	0.451	S	S	.	.	H	α-helix	trans	-60.7	-45.2	175.8	-107.6	141.1	0	0	0	111.7	S86 N92 Q93 D94	S86-L90 WeakPolarHBondContact O-CB 3.41Å; S86-L90 PolarHBondContact O-N 3.3Å; L90-N92 VanDerWaalsContact C-N 3.28Å; L90-N92 PolarHBondContact O-N 2.68Å; L90-Q93 PolarHBondContact O-N 3.3Å; L90-D94 WeakPolarHBondContact O-CB 3.44Å; L90-D94 PolarHBondContact O-N 3.2Å
91	I	69.8	Low	73.2	Confident	68 Å²	68	88.2 Å²	88.2	35%	0.349	46%	0.459	S	S	.	.	H	α-helix	trans	-63.9	-34.9	176.6	-71.6	169.6	0	0	0	111.3	L87 Y95	L87-I91 HydrophobicContact CD1-CD1 4.1Å; L87-I91 HydrophobicContact CD1-CG1 4.48Å; L87-I91 HydrophobicContact CD2-CD1 4.39Å; L87-I91 HydrophobicContact CG-CD1 3.8Å; L87-I91 HydrophobicContact CG-CG1 4.48Å; L87-I91 VanDerWaalsContact O-CB 3.28Å; L87-I91 WeakPolarHBondContact O-CB 3.33Å; L87-I91 WeakPolarHBondContact O-CD1 3.31Å; L87-I91 WeakPolarHBondContact O-CG1 3.49Å; L87-I91 PolarHBondContact O-N 2.73Å; I91-Y95 WeakPolarHBondContact O-CA 3.29Å; I91-Y95 VanDerWaalsContact O-CB 3.29Å; I91-Y95 WeakPolarHBondContact O-CB 3.38Å; I91-Y95 PolarHBondContact O-N 2.86Å
92	N	73.6	Confident	72.4	Confident	109 Å²	109	87.2 Å²	87.2	58%	0.583	46%	0.459	S	S	*	.	H	α-helix	trans	-79.8	-35.4	178.7	-76.1	-31.4	0	0	0	112.9	I88 E89 L90	I88-N92 WeakPolarHBondContact CG2-ND2 3.4Å; I88-N92 VanDerWaalsContact O-CB 3.27Å; I88-N92 WeakPolarHBondContact O-CB 3.27Å; I88-N92 VanDerWaalsContact O-CG 3.23Å; I88-N92 PolarHBondContact O-N 3.04Å; I88-N92 PolarHBondContact O-ND2 3.41Å; I88-N92 VanDerWaalsContact O-ND2 3.13Å; E89-N92 CarbonylContact O-C 3.52Å; E89-N92 PolarHBondContact O-N 3.17Å; L90-N92 VanDerWaalsContact C-N 3.28Å; L90-N92 PolarHBondContact O-N 2.68Å
93	Q	72.6	Confident	71.8	Confident	160 Å²	160	90.6 Å²	90.6	75%	0.748	48%	0.481	S	S	*	.	H	α-helix	trans	-66.1	-48.8	174.5	-113.6	176.5	-12	0	0	110.4	E89 L90 Y95	E89-Q93 WeakPolarHBondContact O-CB 3.19Å; E89-Q93 PolarHBondContact O-N 3.25Å; L90-Q93 PolarHBondContact O-N 3.3Å; Q93-Y95 VanDerWaalsContact C-N 3.3Å; Q93-Y95 PolarHBondContact O-N 3.49Å
94	D	68	Low	71.2	Confident	58 Å²	58	92.7 Å²	92.7	31%	0.31	49%	0.492	S	S	.	.	S	Bend	trans	-95.3	19.1	-176.9	-60.9	-20.8	0	0	0	111.1	L90 A96 D97 F98	L90-D94 WeakPolarHBondContact O-CB 3.44Å; L90-D94 PolarHBondContact O-N 3.2Å; D94-A96 PolarHBondContact O-N 3.48Å; D94-D97 HydrophobicContact CB-CB 4.23Å; D94-D97 CarbonylContact O-C 3.54Å; D94-D97 WeakPolarHBondContact O-CA 3.4Å; D94-D97 PolarHBondContact O-N 3.28Å; D94-F98 HydrophobicContact CB-CD2 4.31Å; D94-F98 WeakPolarHBondContact O-CB 3.27Å; D94-F98 PolarHBondContact O-N 3.33Å
95	Y	73.2	Confident	70.4	Confident	150 Å²	150	90.9 Å²	90.9	59%	0.588	49%	0.488	S	S	*	.	H	α-helix	trans	-56.8	-40.4	179.7	-176.4	-98.1	0	0	0	111	I91 Q93 D97 F98 V99	I91-Y95 WeakPolarHBondContact O-CA 3.29Å; I91-Y95 VanDerWaalsContact O-CB 3.29Å; I91-Y95 WeakPolarHBondContact O-CB 3.38Å; I91-Y95 PolarHBondContact O-N 2.86Å; Q93-Y95 VanDerWaalsContact C-N 3.3Å; Q93-Y95 PolarHBondContact O-N 3.49Å; Y95-D97 VanDerWaalsContact C-N 3.32Å; Y95-D97 PolarHBondContact O-N 3.48Å; Y95-F98 PolarHBondContact O-N 2.96Å; Y95-V99 HydrophobicContact CD1-CG2 4.09Å; Y95-V99 HydrophobicContact CE1-CG2 3.68Å; Y95-V99 HydrophobicContact CE2-CG2 4.19Å; Y95-V99 WeakPolarHBondContact O-CB 3.42Å; Y95-V99 VanDerWaalsContact O-CG2 3.24Å; Y95-V99 WeakPolarHBondContact O-CG2 3.36Å; Y95-V99 PolarHBondContact O-N 3.47Å
96	A	68.8	Low	69.7	Low	71 Å²	71	93.8 Å²	93.8	59%	0.587	50%	0.503	S	S	*	.	H	α-helix	trans	-64.3	-37.6	175.7	0	0	0	0	0	112.1	D94 S100	D94-A96 PolarHBondContact O-N 3.48Å; A96-S100 WeakPolarHBondContact O-CB 3.41Å; A96-S100 PolarHBondContact O-N 3.45Å; A96-S100 PolarHBondContact O-OG 2.9Å
97	D	69.3	Low	69.5	Low	103 Å²	103	94.8 Å²	94.8	55%	0.551	52%	0.516	S	S	*	.	H	α-helix	trans	-76.9	-36.8	178.6	-73.5	-12.9	0	0	0	111.9	D94 Y95 S100 L101	D94-D97 HydrophobicContact CB-CB 4.23Å; D94-D97 CarbonylContact O-C 3.54Å; D94-D97 WeakPolarHBondContact O-CA 3.4Å; D94-D97 PolarHBondContact O-N 3.28Å; Y95-D97 VanDerWaalsContact C-N 3.32Å; Y95-D97 PolarHBondContact O-N 3.48Å; D97-S100 PolarHBondContact O-N 3.18Å; D97-S100 PolarHBondContact O-OG 3.12Å; D97-S100 VanDerWaalsContact O-OG 3.11Å; D97-L101 WeakPolarHBondContact O-CB 3.22Å; D97-L101 PolarHBondContact O-N 3.21Å
98	F	67	Low	69.1	Low	121 Å²	121	93.5 Å²	93.5	53%	0.531	51%	0.509	S	S	.	.	H	α-helix	trans	-62.9	-42.5	170.6	-102.7	-83.9	0	0	0	111.8	D94 Y95 S102	D94-F98 HydrophobicContact CB-CD2 4.31Å; D94-F98 WeakPolarHBondContact O-CB 3.27Å; D94-F98 PolarHBondContact O-N 3.33Å; Y95-F98 PolarHBondContact O-N 2.96Å; F98-S102 WeakPolarHBondContact O-CB 3.23Å; F98-S102 PolarHBondContact O-N 3.44Å; F98-S102 PolarHBondContact O-OG 2.85Å
99	V	68.2	Low	68.7	Low	61 Å²	61	94.1 Å²	94.1	37%	0.37	51%	0.513	S	S	.	.	H	α-helix	trans	-69.2	-42.7	176.3	174.7	0	0	0	0	110.2	Y95 L101 S102 T103	Y95-V99 HydrophobicContact CD1-CG2 4.09Å; Y95-V99 HydrophobicContact CE1-CG2 3.68Å; Y95-V99 HydrophobicContact CE2-CG2 4.19Å; Y95-V99 WeakPolarHBondContact O-CB 3.42Å; Y95-V99 VanDerWaalsContact O-CG2 3.24Å; Y95-V99 WeakPolarHBondContact O-CG2 3.36Å; Y95-V99 PolarHBondContact O-N 3.47Å; V99-L101 PolarHBondContact O-N 3.29Å; V99-S102 PolarHBondContact O-N 2.74Å; V99-S102 PolarHBondContact O-OG 2.71Å; V99-T103 PolarHBondContact O-N 3.37Å; V99-T103 PolarHBondContact O-OG1 3Å
100	S	68.5	Low	68.7	Low	50 Å²	50	95.6 Å²	95.6	35%	0.35	52%	0.517	S	S	.	.	H	α-helix	trans	-66.3	-37	176.6	82.2	0	0	0	0	112.5	A96 D97 T103 N104	A96-S100 WeakPolarHBondContact O-CB 3.41Å; A96-S100 PolarHBondContact O-N 3.45Å; A96-S100 PolarHBondContact O-OG 2.9Å; D97-S100 PolarHBondContact O-N 3.18Å; D97-S100 PolarHBondContact O-OG 3.12Å; D97-S100 VanDerWaalsContact O-OG 3.11Å; S100-T103 PolarHBondContact O-N 2.97Å; S100-N104 WeakPolarHBondContact O-CB 3.21Å; S100-N104 VanDerWaalsContact O-CG 3.3Å; S100-N104 PolarHBondContact O-N 2.93Å; S100-N104 PolarHBondContact O-ND2 3.3Å
101	L	64.9	Low	68.7	Low	97 Å²	97	94.6 Å²	94.6	51%	0.508	52%	0.518	S	S	.	.	H	α-helix	trans	-64.9	-43.7	174.1	-163.6	79.7	0	0	0	110.5	D97 V99 T103 N104 L105	D97-L101 WeakPolarHBondContact O-CB 3.22Å; D97-L101 PolarHBondContact O-N 3.21Å; V99-L101 PolarHBondContact O-N 3.29Å; L101-T103 VanDerWaalsContact C-N 3.25Å; L101-T103 PolarHBondContact O-N 3.34Å; L101-N104 PolarHBondContact O-N 3.41Å; L101-L105 HydrophobicContact CD2-CD1 4.05Å; L101-L105 HydrophobicContact CG-CD1 3.75Å; L101-L105 WeakPolarHBondContact O-CB 3.46Å; L101-L105 WeakPolarHBondContact O-CD1 3.3Å; L101-L105 WeakPolarHBondContact O-CG 3.46Å; L101-L105 PolarHBondContact O-N 3.27Å
102	S	65.6	Low	68.8	Low	64 Å²	64	94.9 Å²	94.9	45%	0.448	52%	0.519	S	S	.	.	H	α-helix	trans	-62.5	-34.2	174.6	75.5	0	0	0	0	112.2	F98 V99 V106	F98-S102 WeakPolarHBondContact O-CB 3.23Å; F98-S102 PolarHBondContact O-N 3.44Å; F98-S102 PolarHBondContact O-OG 2.85Å; V99-S102 PolarHBondContact O-N 2.74Å; V99-S102 PolarHBondContact O-OG 2.71Å; S102-V106 WeakPolarHBondContact O-CG2 3.49Å; S102-V106 PolarHBondContact O-N 2.9Å
103	T	67.1	Low	69	Low	93 Å²	93	94.6 Å²	94.6	57%	0.571	52%	0.517	S	S	*	.	H	α-helix	trans	-75.4	-35.9	178.5	-35	0	0	0	0	111.6	V99 S100 L101	V99-T103 PolarHBondContact O-N 3.37Å; V99-T103 PolarHBondContact O-OG1 3Å; S100-T103 PolarHBondContact O-N 2.97Å; L101-T103 VanDerWaalsContact C-N 3.25Å; L101-T103 PolarHBondContact O-N 3.34Å
104	N	66.7	Low	69.2	Low	121 Å²	121	91.8 Å²	91.8	65%	0.647	51%	0.511	S	S	*	.	H	α-helix	trans	-78.7	-23.9	176.5	-70.5	-29.1	0	0	0	113.2	S100 L101	S100-N104 WeakPolarHBondContact O-CB 3.21Å; S100-N104 VanDerWaalsContact O-CG 3.3Å; S100-N104 PolarHBondContact O-N 2.93Å; S100-N104 PolarHBondContact O-ND2 3.3Å; L101-N104 PolarHBondContact O-N 3.41Å
105	L	64.2	Low	69.6	Low	82 Å²	82	94.1 Å²	94.1	43%	0.429	52%	0.523	S	S	.	.	H	α-helix	trans	-75	-27.9	175.2	-88.9	155.9	0	0	0	112.5	L101 G107 L108	L101-L105 HydrophobicContact CD2-CD1 4.05Å; L101-L105 HydrophobicContact CG-CD1 3.75Å; L101-L105 WeakPolarHBondContact O-CB 3.46Å; L101-L105 WeakPolarHBondContact O-CD1 3.3Å; L101-L105 WeakPolarHBondContact O-CG 3.46Å; L101-L105 PolarHBondContact O-N 3.27Å; L105-G107 PolarHBondContact O-N 3.35Å; L105-L108 HydrophobicContact CD2-CB 4.46Å; L105-L108 HydrophobicContact CD2-CD2 3.82Å; L105-L108 VanDerWaalsContact O-CB 3.31Å; L105-L108 WeakPolarHBondContact O-CB 3.4Å; L105-L108 PolarHBondContact O-N 2.93Å
106	V	62.6	Low	70	Confident	125 Å²	125	89.2 Å²	89.2	76%	0.758	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	102.5	177.7	175	0	0	0	0	109.7	S102	S102-V106 WeakPolarHBondContact O-CG2 3.49Å; S102-V106 PolarHBondContact O-N 2.9Å
107	G	68.8	Low	70.5	Confident	38 Å²	38	89.3 Å²	89.3	39%	0.392	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	114.8	-16.4	-175	0	0	0	0	0	113.5	L105 D109 K110 S111	L105-G107 PolarHBondContact O-N 3.35Å; G107-D109 PolarHBondContact O-N 3.29Å; G107-K110 PolarHBondContact O-N 2.66Å; G107-K110 VanDerWaalsContact O-N 3.1Å; G107-S111 PolarHBondContact O-N 3.17Å
108	L	68.2	Low	71.2	Confident	74 Å²	74	87.8 Å²	87.8	39%	0.387	50%	0.498	S	S	.	.	H	α-helix	trans	-61.3	-32.4	174.8	-155.1	85.3	0	0	0	111	L105 K110 S111 I112	L105-L108 HydrophobicContact CD2-CB 4.46Å; L105-L108 HydrophobicContact CD2-CD2 3.82Å; L105-L108 VanDerWaalsContact O-CB 3.31Å; L105-L108 WeakPolarHBondContact O-CB 3.4Å; L105-L108 PolarHBondContact O-N 2.93Å; L108-K110 VanDerWaalsContact C-N 3.25Å; L108-K110 PolarHBondContact O-N 2.94Å; L108-S111 CarbonylContact O-C 3.58Å; L108-S111 WeakPolarHBondContact O-CA 3.44Å; L108-S111 WeakPolarHBondContact O-CB 3.34Å; L108-S111 PolarHBondContact O-N 3.42Å; L108-I112 HydrophobicContact CD2-CD1 3.71Å; L108-I112 HydrophobicContact CD2-CG1 4.41Å; L108-I112 HydrophobicContact CG-CD1 3.95Å; L108-I112 HydrophobicContact CG-CG1 4.24Å; L108-I112 WeakPolarHBondContact O-CB 3.38Å; L108-I112 VanDerWaalsContact O-CG1 3.25Å; L108-I112 WeakPolarHBondContact O-CG1 3.28Å; L108-I112 PolarHBondContact O-N 3.29Å
109	D	69.6	Low	71.8	Confident	114 Å²	114	86.8 Å²	86.8	61%	0.61	50%	0.497	S	S	*	.	H	α-helix	trans	-55.7	-40	174.7	-59.9	-28.7	0	0	0	112.2	G107 I112 D113	G107-D109 PolarHBondContact O-N 3.29Å; D109-I112 PolarHBondContact O-N 3.38Å; D109-D113 WeakPolarHBondContact O-CB 3.43Å; D109-D113 PolarHBondContact O-N 3.08Å
110	K	73.4	Confident	72.5	Confident	165 Å²	165	90.3 Å²	90.3	72%	0.717	51%	0.508	S	S	*	.	H	α-helix	trans	-70.5	-40.7	176.9	-67.2	-175.8	179.9	178.6	0	111.1	G107 L108 I112 D113 T114	G107-K110 PolarHBondContact O-N 2.66Å; G107-K110 VanDerWaalsContact O-N 3.1Å; L108-K110 VanDerWaalsContact C-N 3.25Å; L108-K110 PolarHBondContact O-N 2.94Å; K110-I112 VanDerWaalsContact C-N 3.33Å; K110-D113 PolarHBondContact O-N 3.47Å; K110-T114 WeakPolarHBondContact O-CB 3.4Å; K110-T114 PolarHBondContact O-N 3.26Å; K110-T114 PolarHBondContact O-OG1 3.15Å
111	S	72.2	Confident	73.2	Confident	63 Å²	63	93.9 Å²	93.9	44%	0.441	52%	0.519	S	S	.	.	H	α-helix	trans	-63.8	-40.6	175.2	-53.9	0	0	0	0	111.5	G107 L108 T114 I115	G107-S111 PolarHBondContact O-N 3.17Å; L108-S111 CarbonylContact O-C 3.58Å; L108-S111 WeakPolarHBondContact O-CA 3.44Å; L108-S111 WeakPolarHBondContact O-CB 3.34Å; L108-S111 PolarHBondContact O-N 3.42Å; S111-T114 PolarHBondContact O-N 2.91Å; S111-I115 WeakPolarHBondContact O-CG1 3.23Å; S111-I115 PolarHBondContact O-N 3.08Å; S111-I115 VanDerWaalsContact O-N 3.12Å
112	I	71.9	Confident	74.1	Confident	74 Å²	74	94.1 Å²	94.1	38%	0.379	52%	0.52	S	S	.	.	H	α-helix	trans	-65.4	-48.5	175.5	-71.6	168.3	0	0	0	109.5	L108 D109 K110 T114 I115 V116	L108-I112 HydrophobicContact CD2-CD1 3.71Å; L108-I112 HydrophobicContact CD2-CG1 4.41Å; L108-I112 HydrophobicContact CG-CD1 3.95Å; L108-I112 HydrophobicContact CG-CG1 4.24Å; L108-I112 WeakPolarHBondContact O-CB 3.38Å; L108-I112 VanDerWaalsContact O-CG1 3.25Å; L108-I112 WeakPolarHBondContact O-CG1 3.28Å; L108-I112 PolarHBondContact O-N 3.29Å; D109-I112 PolarHBondContact O-N 3.38Å; K110-I112 VanDerWaalsContact C-N 3.33Å; I112-T114 PolarHBondContact O-N 3.23Å; I112-I115 CarbonylContact O-C 3.58Å; I112-I115 WeakPolarHBondContact O-CA 3.44Å; I112-I115 PolarHBondContact O-N 2.85Å; I112-V116 HydrophobicContact CG2-CG2 3.63Å; I112-V116 WeakPolarHBondContact O-CB 3.46Å; I112-V116 WeakPolarHBondContact O-CG2 3.41Å; I112-V116 PolarHBondContact O-N 3.46Å
113	D	77.4	Confident	75	Confident	102 Å²	102	97.7 Å²	97.7	55%	0.545	53%	0.53	S	S	.	.	H	α-helix	trans	-59.5	-37.7	176.2	-84.1	-19.7	0	0	0	111.8	D109 K110 I115 V116 T117	D109-D113 WeakPolarHBondContact O-CB 3.43Å; D109-D113 PolarHBondContact O-N 3.08Å; K110-D113 PolarHBondContact O-N 3.47Å; D113-I115 PolarHBondContact O-N 3.26Å; D113-V116 PolarHBondContact O-N 3.48Å; D113-T117 WeakPolarHBondContact O-CB 3.45Å; D113-T117 PolarHBondContact O-N 3.37Å; D113-T117 PolarHBondContact O-OG1 2.81Å
114	T	77.8	Confident	75.8	Confident	101 Å²	101	96.9 Å²	96.9	62%	0.62	53%	0.528	S	S	*	.	H	α-helix	trans	-65.6	-26.5	176	-45.3	0	0	0	0	112.4	K110 S111 I112 P118	K110-T114 WeakPolarHBondContact O-CB 3.4Å; K110-T114 PolarHBondContact O-N 3.26Å; K110-T114 PolarHBondContact O-OG1 3.15Å; S111-T114 PolarHBondContact O-N 2.91Å; I112-T114 PolarHBondContact O-N 3.23Å; T114-P118 WeakPolarHBondContact O-CD 3.35Å; T114-P118 VanDerWaalsContact O-CG 3.28Å; T114-P118 WeakPolarHBondContact O-CG 3.4Å
115	I	75.9	Confident	76.8	Confident	108 Å²	108	98.9 Å²	98.9	55%	0.554	53%	0.527	S	S	*	.	H	α-helix	trans	-92.2	-36.2	177	-66.8	167.1	0	0	0	112	S111 I112 D113 P118 L119	S111-I115 WeakPolarHBondContact O-CG1 3.23Å; S111-I115 PolarHBondContact O-N 3.08Å; S111-I115 VanDerWaalsContact O-N 3.12Å; I112-I115 CarbonylContact O-C 3.58Å; I112-I115 WeakPolarHBondContact O-CA 3.44Å; I112-I115 PolarHBondContact O-N 2.85Å; D113-I115 PolarHBondContact O-N 3.26Å; I115-P118 WeakPolarHBondContact O-CD 3.22Å; I115-L119 HydrophobicContact CG2-CD1 3.74Å; I115-L119 WeakPolarHBondContact O-CB 3.32Å; I115-L119 WeakPolarHBondContact O-CD1 3.36Å; I115-L119 WeakPolarHBondContact O-CG 3.38Å; I115-L119 PolarHBondContact O-N 3.07Å
116	V	82.2	Confident	77.8	Confident	46 Å²	46	98.7 Å²	98.7	28%	0.279	53%	0.529	S	S	.	.	H	α-helix	trans	-70.2	-35.6	-178.7	168.9	0	0	0	0	111	I112 D113 L119 K120	I112-V116 HydrophobicContact CG2-CG2 3.63Å; I112-V116 WeakPolarHBondContact O-CB 3.46Å; I112-V116 WeakPolarHBondContact O-CG2 3.41Å; I112-V116 PolarHBondContact O-N 3.46Å; D113-V116 PolarHBondContact O-N 3.48Å; V116-L119 PolarHBondContact O-N 3.09Å; V116-K120 HydrophobicContact CG1-CD 4.04Å; V116-K120 HydrophobicContact CG1-CG 4.21Å; V116-K120 WeakPolarHBondContact O-CB 3.2Å; V116-K120 WeakPolarHBondContact O-CG 3.36Å; V116-K120 PolarHBondContact O-N 2.68Å
117	T	79.8	Confident	78.9	Confident	74 Å²	74	95.7 Å²	95.7	45%	0.454	51%	0.514	S	S	.	.	H	α-helix	trans	-65	-49.5	-178.7	-42.1	0	0	0	0	112	D113 L119 K120 Q121	D113-T117 WeakPolarHBondContact O-CB 3.45Å; D113-T117 PolarHBondContact O-N 3.37Å; D113-T117 PolarHBondContact O-OG1 2.81Å; T117-L119 VanDerWaalsContact C-N 3.32Å; T117-L119 PolarHBondContact O-N 2.95Å; T117-K120 PolarHBondContact O-N 3.12Å; T117-Q121 WeakPolarHBondContact O-CG 3.22Å; T117-Q121 PolarHBondContact O-N 2.93Å
118	P	83.2	Confident	79.9	Confident	71 Å²	71	96.7 Å²	96.7	46%	0.461	52%	0.515	S	S	.	.	H	α-helix	trans	-61.2	-36.6	171.2	-21.7	31.6	0	0	0	113.4	T114 I115 Q121 L122	T114-P118 WeakPolarHBondContact O-CD 3.35Å; T114-P118 VanDerWaalsContact O-CG 3.28Å; T114-P118 WeakPolarHBondContact O-CG 3.4Å; I115-P118 WeakPolarHBondContact O-CD 3.22Å; P118-Q121 PolarHBondContact O-N 3.09Å; P118-L122 WeakPolarHBondContact O-CB 3.44Å; P118-L122 PolarHBondContact O-N 2.74Å
119	L	79.8	Confident	80.8	Confident	100 Å²	100	96.2 Å²	96.2	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-66.8	-39.9	177.4	-83.9	164.8	0	0	0	112.6	I115 V116 T117 L122 Q123	I115-L119 HydrophobicContact CG2-CD1 3.74Å; I115-L119 WeakPolarHBondContact O-CB 3.32Å; I115-L119 WeakPolarHBondContact O-CD1 3.36Å; I115-L119 WeakPolarHBondContact O-CG 3.38Å; I115-L119 PolarHBondContact O-N 3.07Å; V116-L119 PolarHBondContact O-N 3.09Å; T117-L119 VanDerWaalsContact C-N 3.32Å; T117-L119 PolarHBondContact O-N 2.95Å; L119-L122 PolarHBondContact O-N 2.97Å; L119-Q123 WeakPolarHBondContact O-CB 3.39Å; L119-Q123 PolarHBondContact O-N 2.9Å
120	K	82.7	Confident	81.7	Confident	135 Å²	135	94.3 Å²	94.3	59%	0.587	51%	0.507	S	S	*	.	H	α-helix	trans	-66.7	-38.6	173.4	-78.1	-177.7	177.8	175.9	0	111.8	V116 T117 Q123 S124	V116-K120 HydrophobicContact CG1-CD 4.04Å; V116-K120 HydrophobicContact CG1-CG 4.21Å; V116-K120 WeakPolarHBondContact O-CB 3.2Å; V116-K120 WeakPolarHBondContact O-CG 3.36Å; V116-K120 PolarHBondContact O-N 2.68Å; T117-K120 PolarHBondContact O-N 3.12Å; K120-Q123 PolarHBondContact O-N 2.95Å; K120-S124 PolarHBondContact O-N 3.15Å; K120-S124 PolarHBondContact O-OG 2.74Å
121	Q	83.9	Confident	82.4	Confident	125 Å²	125	90.9 Å²	90.9	58%	0.584	50%	0.497	S	S	*	.	H	α-helix	trans	-63.9	-45.7	173.4	-73.8	176	-10.4	0	0	111.2	T117 P118 Q123 S124 Y125	T117-Q121 WeakPolarHBondContact O-CG 3.22Å; T117-Q121 PolarHBondContact O-N 2.93Å; P118-Q121 PolarHBondContact O-N 3.09Å; Q121-Q123 VanDerWaalsContact C-N 3.34Å; Q121-Q123 PolarHBondContact O-N 3.45Å; Q121-S124 PolarHBondContact O-N 3.41Å; Q121-S124 PolarHBondContact O-OG 3.3Å; Q121-Y125 WeakPolarHBondContact O-CB 3.38Å; Q121-Y125 PolarHBondContact O-N 3.5Å
122	L	83	Confident	83.2	Confident	101 Å²	101	94 Å²	94	53%	0.529	50%	0.504	S	S	.	.	H	α-helix	trans	-60.2	-44	174.3	-174.7	70.8	0	0	0	111	P118 L119 S124 Y125 V126	P118-L122 WeakPolarHBondContact O-CB 3.44Å; P118-L122 PolarHBondContact O-N 2.74Å; L119-L122 PolarHBondContact O-N 2.97Å; L122-S124 VanDerWaalsContact C-N 3.35Å; L122-S124 PolarHBondContact O-N 3.44Å; L122-Y125 PolarHBondContact O-N 2.93Å; L122-V126 HydrophobicContact CD1-CG2 4.46Å; L122-V126 HydrophobicContact CG-CG2 4.33Å; L122-V126 WeakPolarHBondContact O-CB 3.41Å; L122-V126 VanDerWaalsContact O-CG2 3.26Å; L122-V126 WeakPolarHBondContact O-CG2 3.32Å; L122-V126 PolarHBondContact O-N 3.25Å
123	Q	84.3	Confident	84	Confident	140 Å²	140	95.8 Å²	95.8	65%	0.654	51%	0.514	S	S	*	.	H	α-helix	trans	-60.2	-44.2	175.9	-173.2	-177.7	23.3	0	0	111.5	L119 K120 Q121 Y125 V126 S127	L119-Q123 WeakPolarHBondContact O-CB 3.39Å; L119-Q123 PolarHBondContact O-N 2.9Å; K120-Q123 PolarHBondContact O-N 2.95Å; Q121-Q123 VanDerWaalsContact C-N 3.34Å; Q121-Q123 PolarHBondContact O-N 3.45Å; Q123-Y125 VanDerWaalsContact C-N 3.32Å; Q123-Y125 PolarHBondContact O-N 3.24Å; Q123-V126 PolarHBondContact O-N 2.84Å; Q123-S127 WeakPolarHBondContact O-CB 3.05Å; Q123-S127 PolarHBondContact O-N 3.35Å
124	S	84.1	Confident	84.5	Confident	76 Å²	76	96.2 Å²	96.2	53%	0.531	51%	0.513	S	S	.	.	H	α-helix	trans	-64.7	-37.5	176.7	70.7	0	0	0	0	112.5	K120 Q121 L122 S127 S128	K120-S124 PolarHBondContact O-N 3.15Å; K120-S124 PolarHBondContact O-OG 2.74Å; Q121-S124 PolarHBondContact O-N 3.41Å; Q121-S124 PolarHBondContact O-OG 3.3Å; L122-S124 VanDerWaalsContact C-N 3.35Å; L122-S124 PolarHBondContact O-N 3.44Å; S124-S127 PolarHBondContact O-N 2.87Å; S124-S128 WeakPolarHBondContact O-CB 3.28Å; S124-S128 PolarHBondContact O-N 2.9Å
125	Y	88.1	Confident	85	Confident	163 Å²	163	94.9 Å²	94.9	64%	0.639	51%	0.508	S	S	*	.	H	α-helix	trans	-69	-44.8	176.8	-169.9	-100.7	0	0	0	111.3	Q121 L122 Q123 S127 S128 V129	Q121-Y125 WeakPolarHBondContact O-CB 3.38Å; Q121-Y125 PolarHBondContact O-N 3.5Å; L122-Y125 PolarHBondContact O-N 2.93Å; Q123-Y125 VanDerWaalsContact C-N 3.32Å; Q123-Y125 PolarHBondContact O-N 3.24Å; Y125-S127 VanDerWaalsContact C-N 3.34Å; Y125-S127 PolarHBondContact O-N 2.95Å; Y125-S128 PolarHBondContact O-N 2.84Å; Y125-V129 HydrophobicContact CD1-CG2 4.17Å; Y125-V129 HydrophobicContact CE1-CG2 3.89Å; Y125-V129 VanDerWaalsContact O-CG2 3.3Å; Y125-V129 WeakPolarHBondContact O-CG2 3.18Å; Y125-V129 PolarHBondContact O-N 3.33Å
126	V	85.7	Confident	85.6	Confident	77 Å²	77	93.5 Å²	93.5	47%	0.467	51%	0.505	S	S	.	.	H	α-helix	trans	-61.6	-42.6	174.9	172.2	0	0	0	0	110.5	L122 Q123 S128 V129 V130	L122-V126 HydrophobicContact CD1-CG2 4.46Å; L122-V126 HydrophobicContact CG-CG2 4.33Å; L122-V126 WeakPolarHBondContact O-CB 3.41Å; L122-V126 VanDerWaalsContact O-CG2 3.26Å; L122-V126 WeakPolarHBondContact O-CG2 3.32Å; L122-V126 PolarHBondContact O-N 3.25Å; Q123-V126 PolarHBondContact O-N 2.84Å; V126-S128 PolarHBondContact O-N 3.47Å; V126-V129 PolarHBondContact O-N 3.29Å; V126-V130 HydrophobicContact CG1-CG2 4.29Å; V126-V130 WeakPolarHBondContact O-CB 3.41Å; V126-V130 VanDerWaalsContact O-CG2 3.24Å; V126-V130 WeakPolarHBondContact O-CG2 3.3Å; V126-V130 PolarHBondContact O-N 3.07Å
127	S	85.7	Confident	85.8	Confident	63 Å²	63	95.6 Å²	95.6	44%	0.441	51%	0.514	S	S	.	.	H	α-helix	trans	-62.5	-43.8	176.4	-157.7	0	0	0	0	111.7	Q123 S124 Y125 V129 V130 D131	Q123-S127 WeakPolarHBondContact O-CB 3.05Å; Q123-S127 PolarHBondContact O-N 3.35Å; S124-S127 PolarHBondContact O-N 2.87Å; Y125-S127 VanDerWaalsContact C-N 3.34Å; Y125-S127 PolarHBondContact O-N 2.95Å; S127-V129 VanDerWaalsContact C-N 3.33Å; S127-V129 PolarHBondContact O-N 3.39Å; S127-V130 PolarHBondContact O-N 2.66Å; S127-D131 VanDerWaalsContact O-CG 3.25Å; S127-D131 PolarHBondContact O-N 3.47Å
128	S	88.3	Confident	86.2	Confident	58 Å²	58	98 Å²	98	41%	0.406	52%	0.52	S	S	.	.	H	α-helix	trans	-61.6	-40.4	175.3	-175.6	0	0	0	0	112.3	S124 Y125 V126 D131 E132	S124-S128 WeakPolarHBondContact O-CB 3.28Å; S124-S128 PolarHBondContact O-N 2.9Å; Y125-S128 PolarHBondContact O-N 2.84Å; V126-S128 PolarHBondContact O-N 3.47Å; S128-D131 PolarHBondContact O-N 3.08Å; S128-E132 WeakPolarHBondContact O-CG 3.43Å; S128-E132 PolarHBondContact O-N 3.42Å
129	V	87.9	Confident	86.5	Confident	64 Å²	64	99.6 Å²	99.6	39%	0.388	52%	0.521	S	S	.	.	H	α-helix	trans	-68.9	-36.4	176.8	171.4	0	0	0	0	110.9	Y125 V126 S127 L133	Y125-V129 HydrophobicContact CD1-CG2 4.17Å; Y125-V129 HydrophobicContact CE1-CG2 3.89Å; Y125-V129 VanDerWaalsContact O-CG2 3.3Å; Y125-V129 WeakPolarHBondContact O-CG2 3.18Å; Y125-V129 PolarHBondContact O-N 3.33Å; V126-V129 PolarHBondContact O-N 3.29Å; S127-V129 VanDerWaalsContact C-N 3.33Å; S127-V129 PolarHBondContact O-N 3.39Å; V129-L133 VanDerWaalsContact O-CB 3.26Å; V129-L133 WeakPolarHBondContact O-CB 3.37Å; V129-L133 PolarHBondContact O-N 3.17Å
130	V	88.8	Confident	87	Confident	74 Å²	74	99.3 Å²	99.3	45%	0.448	52%	0.52	S	S	.	.	H	α-helix	trans	-65.8	-43	174.4	169.8	0	0	0	0	110.8	V126 S127 L133 E134	V126-V130 HydrophobicContact CG1-CG2 4.29Å; V126-V130 WeakPolarHBondContact O-CB 3.41Å; V126-V130 VanDerWaalsContact O-CG2 3.24Å; V126-V130 WeakPolarHBondContact O-CG2 3.3Å; V126-V130 PolarHBondContact O-N 3.07Å; S127-V130 PolarHBondContact O-N 2.66Å; V130-L133 WeakPolarHBondContact O-CB 3.37Å; V130-L133 PolarHBondContact O-N 3.19Å; V130-E134 WeakPolarHBondContact O-CB 3.39Å; V130-E134 PolarHBondContact O-N 3Å
131	D	87.1	Confident	87.3	Confident	94 Å²	94	95.1 Å²	95.1	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-64.5	-41.9	176.9	-66.4	-21.6	0	0	0	111.5	S127 S128 E134 S135	S127-D131 VanDerWaalsContact O-CG 3.25Å; S127-D131 PolarHBondContact O-N 3.47Å; S128-D131 PolarHBondContact O-N 3.08Å; D131-E134 PolarHBondContact O-N 2.96Å; D131-S135 WeakPolarHBondContact O-CB 3.35Å; D131-S135 PolarHBondContact O-N 3.36Å
132	E	89.3	Confident	87.4	Confident	127 Å²	127	92.1 Å²	92.1	59%	0.593	50%	0.504	S	S	*	.	H	α-helix	trans	-61.7	-43.7	172.1	-78.7	-176.3	177.7	0	0	111.2	S128 S135 T136	S128-E132 WeakPolarHBondContact O-CG 3.43Å; S128-E132 PolarHBondContact O-N 3.42Å; E132-S135 PolarHBondContact O-N 3.22Å; E132-T136 WeakPolarHBondContact O-CG2 3.42Å; E132-T136 PolarHBondContact O-N 3.19Å; E132-T136 PolarHBondContact O-OG1 3.03Å
133	L	88.3	Confident	87.7	Confident	113 Å²	113	92.7 Å²	92.7	59%	0.592	50%	0.502	S	S	*	.	H	α-helix	trans	-62.7	-44.3	178	-173.2	67.4	0	0	0	111.4	V129 V130 S135 T136 D137	V129-L133 VanDerWaalsContact O-CB 3.26Å; V129-L133 WeakPolarHBondContact O-CB 3.37Å; V129-L133 PolarHBondContact O-N 3.17Å; V130-L133 WeakPolarHBondContact O-CB 3.37Å; V130-L133 PolarHBondContact O-N 3.19Å; L133-S135 PolarHBondContact O-N 3.08Å; L133-T136 WeakPolarHBondContact CA-OG1 3.48Å; L133-T136 PolarHBondContact O-N 3.13Å; L133-T136 VanDerWaalsContact O-N 3.16Å; L133-T136 PolarHBondContact O-OG1 3.29Å; L133-D137 PolarHBondContact O-N 3.07Å
134	E	88.2	Confident	87.9	Confident	110 Å²	110	90.7 Å²	90.7	51%	0.514	50%	0.495	S	S	.	.	H	α-helix	trans	-64.9	-39.1	178.1	-164.4	173.7	-172	0	0	111.5	V130 D131 D137 Q138	V130-E134 WeakPolarHBondContact O-CB 3.39Å; V130-E134 PolarHBondContact O-N 3Å; D131-E134 PolarHBondContact O-N 2.96Å; E134-D137 PolarHBondContact O-N 3.12Å; E134-Q138 WeakPolarHBondContact O-CG 3.38Å; E134-Q138 PolarHBondContact O-N 3.24Å
135	S	88.4	Confident	88	Confident	74 Å²	74	94.2 Å²	94.2	52%	0.517	50%	0.501	S	S	.	.	H	α-helix	trans	-62.8	-41.6	171.4	-174.5	0	0	0	0	112	D131 E132 L133 D137 Q138 E139	D131-S135 WeakPolarHBondContact O-CB 3.35Å; D131-S135 PolarHBondContact O-N 3.36Å; E132-S135 PolarHBondContact O-N 3.22Å; L133-S135 PolarHBondContact O-N 3.08Å; S135-D137 VanDerWaalsContact C-N 3.33Å; S135-Q138 PolarHBondContact O-N 2.66Å; S135-E139 PolarHBondContact O-N 2.9Å; S135-E139 VanDerWaalsContact O-N 3.09Å
136	T	88.3	Confident	87.9	Confident	79 Å²	79	89.3 Å²	89.3	49%	0.485	49%	0.491	S	S	.	.	H	α-helix	trans	-67.4	-34.1	176.9	61	0	0	0	0	112.2	E132 L133 E139 L140	E132-T136 WeakPolarHBondContact O-CG2 3.42Å; E132-T136 PolarHBondContact O-N 3.19Å; E132-T136 PolarHBondContact O-OG1 3.03Å; L133-T136 WeakPolarHBondContact CA-OG1 3.48Å; L133-T136 PolarHBondContact O-N 3.13Å; L133-T136 VanDerWaalsContact O-N 3.16Å; L133-T136 PolarHBondContact O-OG1 3.29Å; T136-E139 PolarHBondContact O-N 3.05Å; T136-L140 VanDerWaalsContact O-CB 3.24Å; T136-L140 WeakPolarHBondContact O-CB 3.47Å; T136-L140 PolarHBondContact O-N 3.42Å
137	D	87.5	Confident	88	Confident	89 Å²	89	90.6 Å²	90.6	48%	0.476	50%	0.495	S	S	.	.	H	α-helix	trans	-68.2	-39.1	176.2	-173.7	54.7	0	0	0	112	L133 E134 S135 L140 S141	L133-D137 PolarHBondContact O-N 3.07Å; E134-D137 PolarHBondContact O-N 3.12Å; S135-D137 VanDerWaalsContact C-N 3.33Å; D137-L140 PolarHBondContact O-N 3.39Å; D137-S141 VanDerWaalsContact O-CB 3.23Å; D137-S141 WeakPolarHBondContact O-CB 3.15Å; D137-S141 PolarHBondContact O-N 2.93Å; D137-S141 PolarHBondContact O-OG 3.37Å
138	Q	87.5	Confident	88	Confident	125 Å²	125	93.3 Å²	93.3	58%	0.584	50%	0.5	S	S	*	.	H	α-helix	trans	-64	-43.5	173.4	-71	178.8	15.3	0	0	112.1	E134 S135 S141 A142	E134-Q138 WeakPolarHBondContact O-CG 3.38Å; E134-Q138 PolarHBondContact O-N 3.24Å; S135-Q138 PolarHBondContact O-N 2.66Å; Q138-S141 PolarHBondContact O-N 3.47Å; Q138-A142 PolarHBondContact O-N 3.37Å
139	E	90.1	Very high	87.9	Confident	104 Å²	104	95.9 Å²	95.9	49%	0.486	51%	0.505	S	S	.	.	H	α-helix	trans	-65.1	-42.8	175.7	-166.9	-173.3	161	0	0	111.4	S135 T136 A142 K143	S135-E139 PolarHBondContact O-N 2.9Å; S135-E139 VanDerWaalsContact O-N 3.09Å; T136-E139 PolarHBondContact O-N 3.05Å; E139-A142 PolarHBondContact O-N 2.98Å; E139-K143 WeakPolarHBondContact O-CG 3.23Å; E139-K143 PolarHBondContact O-N 3.14Å; E139-K143 WeakPolarHBondContact OE1-CE 3.27Å; E139-K143 IonicContact OE1-NZ 3.9Å; E139-K143 PolarHBondContact OE1-NZ 3.04Å
140	L	89.1	Confident	87.8	Confident	95 Å²	95	96.6 Å²	96.6	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-61.3	-45.3	176.1	-178.4	63.2	0	0	0	111	T136 D137 A142 K143 L144	T136-L140 VanDerWaalsContact O-CB 3.24Å; T136-L140 WeakPolarHBondContact O-CB 3.47Å; T136-L140 PolarHBondContact O-N 3.42Å; D137-L140 PolarHBondContact O-N 3.39Å; L140-A142 VanDerWaalsContact C-N 3.34Å; L140-A142 PolarHBondContact O-N 2.73Å; L140-K143 CarbonylContact O-C 3.59Å; L140-K143 PolarHBondContact O-N 2.95Å; L140-L144 HydrophobicContact CD1-CG 4.45Å; L140-L144 HydrophobicContact CG-CD1 4.15Å; L140-L144 HydrophobicContact CG-CG 4.46Å; L140-L144 WeakPolarHBondContact O-CB 3.35Å; L140-L144 WeakPolarHBondContact O-CG 3.35Å; L140-L144 PolarHBondContact O-N 3.48Å
141	S	89	Confident	87.6	Confident	47 Å²	47	99.1 Å²	99.1	33%	0.329	51%	0.511	S	S	.	.	H	α-helix	trans	-61.5	-39.6	176.5	-73.4	0	0	0	0	112.4	D137 Q138 L144 K145	D137-S141 VanDerWaalsContact O-CB 3.23Å; D137-S141 WeakPolarHBondContact O-CB 3.15Å; D137-S141 PolarHBondContact O-N 2.93Å; D137-S141 PolarHBondContact O-OG 3.37Å; Q138-S141 PolarHBondContact O-N 3.47Å; S141-L144 PolarHBondContact O-N 3.43Å; S141-K145 WeakPolarHBondContact O-CG 3.23Å; S141-K145 PolarHBondContact O-N 2.94Å; S141-K145 VanDerWaalsContact O-N 3.1Å
142	A	87.2	Confident	87.5	Confident	61 Å²	61	99 Å²	99	50%	0.504	51%	0.511	S	S	.	.	H	α-helix	trans	-66.2	-42.8	174.5	0	0	0	0	0	111.9	Q138 E139 L140 K145 S146	Q138-A142 PolarHBondContact O-N 3.37Å; E139-A142 PolarHBondContact O-N 2.98Å; L140-A142 VanDerWaalsContact C-N 3.34Å; L140-A142 PolarHBondContact O-N 2.73Å; A142-K145 PolarHBondContact O-N 2.9Å; A142-S146 PolarHBondContact O-N 3.43Å
143	K	89.9	Confident	87.2	Confident	113 Å²	113	98.4 Å²	98.4	49%	0.491	51%	0.508	S	S	.	.	H	α-helix	trans	-66.9	-35.6	175.1	-73.9	-177.7	-175.8	165.9	0	112.7	E139 L140 K145 S146 L147	E139-K143 WeakPolarHBondContact O-CG 3.23Å; E139-K143 PolarHBondContact O-N 3.14Å; E139-K143 WeakPolarHBondContact OE1-CE 3.27Å; E139-K143 IonicContact OE1-NZ 3.9Å; E139-K143 PolarHBondContact OE1-NZ 3.04Å; L140-K143 CarbonylContact O-C 3.59Å; L140-K143 PolarHBondContact O-N 2.95Å; K143-K145 VanDerWaalsContact C-N 3.35Å; K143-S146 PolarHBondContact O-N 3.4Å; K143-S146 PolarHBondContact O-OG 3.05Å; K143-L147 WeakPolarHBondContact O-CB 3.38Å; K143-L147 VanDerWaalsContact O-CG 3.29Å; K143-L147 WeakPolarHBondContact O-CG 3.39Å; K143-L147 PolarHBondContact O-N 3.4Å
144	L	86.9	Confident	87.1	Confident	98 Å²	98	98.5 Å²	98.5	51%	0.513	51%	0.505	S	S	.	.	H	α-helix	trans	-64.7	-39.6	174.3	-76.9	172.9	0	0	0	111.4	L140 S141 L147 Q148	L140-L144 HydrophobicContact CD1-CG 4.45Å; L140-L144 HydrophobicContact CG-CD1 4.15Å; L140-L144 HydrophobicContact CG-CG 4.46Å; L140-L144 WeakPolarHBondContact O-CB 3.35Å; L140-L144 WeakPolarHBondContact O-CG 3.35Å; L140-L144 PolarHBondContact O-N 3.48Å; S141-L144 PolarHBondContact O-N 3.43Å; L144-L147 PolarHBondContact O-N 2.84Å; L144-Q148 WeakPolarHBondContact O-CB 3.4Å; L144-Q148 PolarHBondContact O-N 3.38Å
145	K	87.7	Confident	86.9	Confident	151 Å²	151	96.5 Å²	96.5	66%	0.657	50%	0.498	S	S	*	.	H	α-helix	trans	-65.1	-42.1	173.7	-73	175.1	-177.6	175.9	0	112.4	S141 A142 K143 Q148 H149	S141-K145 WeakPolarHBondContact O-CG 3.23Å; S141-K145 PolarHBondContact O-N 2.94Å; S141-K145 VanDerWaalsContact O-N 3.1Å; A142-K145 PolarHBondContact O-N 2.9Å; K143-K145 VanDerWaalsContact C-N 3.35Å; K145-Q148 PolarHBondContact O-N 2.91Å; K145-H149 PolarHBondContact O-N 3.4Å
146	S	85.6	Confident	86.7	Confident	59 Å²	59	96.6 Å²	96.6	41%	0.413	49%	0.488	S	S	.	.	H	α-helix	trans	-67.5	-38.6	176	70	0	0	0	0	112	A142 K143 Q148 H149 I150	A142-S146 PolarHBondContact O-N 3.43Å; K143-S146 PolarHBondContact O-N 3.4Å; K143-S146 PolarHBondContact O-OG 3.05Å; S146-Q148 VanDerWaalsContact C-N 3.33Å; S146-Q148 PolarHBondContact O-N 3.42Å; S146-H149 WeakPolarHBondContact O-CB 3.31Å; S146-H149 PolarHBondContact O-N 2.91Å; S146-I150 WeakPolarHBondContact O-CG1 3.38Å; S146-I150 PolarHBondContact O-N 2.92Å
147	L	87.3	Confident	86.5	Confident	105 Å²	105	94.6 Å²	94.6	55%	0.55	48%	0.48	S	S	.	.	H	α-helix	trans	-61.3	-39.8	171.6	-77.4	173	0	0	0	111.9	K143 L144 I150 K151	K143-L147 WeakPolarHBondContact O-CB 3.38Å; K143-L147 VanDerWaalsContact O-CG 3.29Å; K143-L147 WeakPolarHBondContact O-CG 3.39Å; K143-L147 PolarHBondContact O-N 3.4Å; L144-L147 PolarHBondContact O-N 2.84Å; L147-I150 PolarHBondContact O-N 3.44Å; L147-K151 VanDerWaalsContact O-CB 3.24Å; L147-K151 WeakPolarHBondContact O-CB 3.49Å; L147-K151 PolarHBondContact O-N 3.23Å
148	Q	85.2	Confident	86.4	Confident	119 Å²	119	94.9 Å²	94.9	56%	0.556	48%	0.481	S	S	*	.	H	α-helix	trans	-64.6	-40.3	174.8	-173	177.8	0.8	0	0	111.8	L144 K145 S146 K151 N152	L144-Q148 WeakPolarHBondContact O-CB 3.4Å; L144-Q148 PolarHBondContact O-N 3.38Å; K145-Q148 PolarHBondContact O-N 2.91Å; S146-Q148 VanDerWaalsContact C-N 3.33Å; S146-Q148 PolarHBondContact O-N 3.42Å; Q148-K151 PolarHBondContact O-N 2.96Å; Q148-N152 PolarHBondContact O-N 3.37Å; Q148-N152 PolarHBondContact O-ND2 2.83Å; Q148-N152 PolarHBondContact O-OD1 3.47Å
149	H	87.3	Confident	86.3	Confident	112 Å²	112	89.2 Å²	89.2	52%	0.519	46%	0.455	S	S	.	.	H	α-helix	trans	-62.4	-49.3	174.6	-173.6	-80.3	0	0	0	111.7	K145 S146 K151 N152 E153	K145-H149 PolarHBondContact O-N 3.4Å; S146-H149 WeakPolarHBondContact O-CB 3.31Å; S146-H149 PolarHBondContact O-N 2.91Å; H149-K151 VanDerWaalsContact C-N 3.29Å; H149-K151 PolarHBondContact O-N 3.38Å; H149-N152 PolarHBondContact O-N 3.19Å; H149-E153 VanDerWaalsContact CE1-CD 3.41Å; H149-E153 IonicContact CE1-OE1 2.79Å; H149-E153 PolarHBondContact CE1-OE1 2.95Å; H149-E153 VanDerWaalsContact CE1-OE1 3.24Å; H149-E153 IonicContact CE1-OE2 3.25Å; H149-E153 IonicContact ND1-OE1 3.71Å; H149-E153 IonicContact ND1-OE2 2.84Å; H149-E153 PolarHBondContact O-N 3.33Å
150	I	85.9	Confident	86	Confident	80 Å²	80	85.2 Å²	85.2	41%	0.41	44%	0.437	S	S	.	.	H	α-helix	trans	-60.5	-41.7	177.7	-67.3	166.6	0	0	0	110.4	S146 L147 N152 E153 Q154	S146-I150 WeakPolarHBondContact O-CG1 3.38Å; S146-I150 PolarHBondContact O-N 2.92Å; L147-I150 PolarHBondContact O-N 3.44Å; I150-N152 PolarHBondContact O-N 2.73Å; I150-E153 PolarHBondContact O-N 3.05Å; I150-Q154 HydrophobicContact CG2-CG 4.43Å; I150-Q154 WeakPolarHBondContact O-CB 3.49Å; I150-Q154 WeakPolarHBondContact O-CG 3.42Å; I150-Q154 PolarHBondContact O-N 3.4Å
151	K	84.8	Confident	85.8	Confident	126 Å²	126	87.9 Å²	87.9	55%	0.548	45%	0.445	S	S	.	.	H	α-helix	trans	-62.8	-41.3	176.4	-173.3	174.1	179.9	173	0	112.1	L147 Q148 H149 E153 Q154 D155	L147-K151 VanDerWaalsContact O-CB 3.24Å; L147-K151 WeakPolarHBondContact O-CB 3.49Å; L147-K151 PolarHBondContact O-N 3.23Å; Q148-K151 PolarHBondContact O-N 2.96Å; H149-K151 VanDerWaalsContact C-N 3.29Å; H149-K151 PolarHBondContact O-N 3.38Å; K151-E153 VanDerWaalsContact C-N 3.34Å; K151-E153 PolarHBondContact O-N 2.84Å; K151-Q154 PolarHBondContact O-N 2.94Å; K151-D155 WeakPolarHBondContact O-CB 3.42Å; K151-D155 PolarHBondContact O-N 3.31Å
152	N	84.3	Confident	85.7	Confident	92 Å²	92	88.2 Å²	88.2	49%	0.492	45%	0.445	S	S	.	.	H	α-helix	trans	-64.7	-38.5	175.6	-69.4	-19	0	0	0	112.2	Q148 H149 I150 Y156	Q148-N152 PolarHBondContact O-N 3.37Å; Q148-N152 PolarHBondContact O-ND2 2.83Å; Q148-N152 PolarHBondContact O-OD1 3.47Å; H149-N152 PolarHBondContact O-N 3.19Å; I150-N152 PolarHBondContact O-N 2.73Å; N152-Y156 WeakPolarHBondContact O-CB 3.33Å; N152-Y156 PolarHBondContact O-N 2.96Å
153	E	82.9	Confident	85.6	Confident	115 Å²	115	85.3 Å²	85.3	54%	0.537	42%	0.421	S	S	.	.	H	α-helix	trans	-66.9	-40.7	174.5	-73.1	-172.7	146.1	0	0	111.9	H149 I150 K151 Y156 A157	H149-E153 VanDerWaalsContact CE1-CD 3.41Å; H149-E153 IonicContact CE1-OE1 2.79Å; H149-E153 PolarHBondContact CE1-OE1 2.95Å; H149-E153 VanDerWaalsContact CE1-OE1 3.24Å; H149-E153 IonicContact CE1-OE2 3.25Å; H149-E153 IonicContact ND1-OE1 3.71Å; H149-E153 IonicContact ND1-OE2 2.84Å; H149-E153 PolarHBondContact O-N 3.33Å; I150-E153 PolarHBondContact O-N 3.05Å; K151-E153 VanDerWaalsContact C-N 3.34Å; K151-E153 PolarHBondContact O-N 2.84Å; E153-Y156 PolarHBondContact O-N 3.43Å; E153-A157 PolarHBondContact O-N 2.9Å
154	Q	85.8	Confident	85.4	Confident	114 Å²	114	83.1 Å²	83.1	53%	0.533	42%	0.415	S	S	.	.	H	α-helix	trans	-61	-50.5	172.1	-74.7	177.2	-19.2	0	0	111.1	I150 K151 Y156 A157 D158	I150-Q154 HydrophobicContact CG2-CG 4.43Å; I150-Q154 WeakPolarHBondContact O-CB 3.49Å; I150-Q154 WeakPolarHBondContact O-CG 3.42Å; I150-Q154 PolarHBondContact O-N 3.4Å; K151-Q154 PolarHBondContact O-N 2.94Å; Q154-Y156 PolarHBondContact O-N 3.4Å; Q154-A157 PolarHBondContact O-N 3.26Å; Q154-A157 VanDerWaalsContact O-N 3.09Å; Q154-D158 WeakPolarHBondContact O-CB 3.46Å; Q154-D158 PolarHBondContact O-N 3.47Å
155	D	84	Confident	85.4	Confident	69 Å²	69	80.5 Å²	80.5	37%	0.369	41%	0.407	S	S	.	.	H	α-helix	trans	-58.5	-33.3	176.9	-72.5	-16.2	0	0	0	111.7	K151 S159	K151-D155 WeakPolarHBondContact O-CB 3.42Å; K151-D155 PolarHBondContact O-N 3.31Å; D155-S159 WeakPolarHBondContact O-CB 3.5Å; D155-S159 PolarHBondContact O-N 3.45Å; D155-S159 PolarHBondContact O-OG 3.29Å
156	Y	84.6	Confident	85.3	Confident	75 Å²	75	73.4 Å²	73.4	29%	0.294	38%	0.377	S	S	.	.	H	α-helix	trans	-73.7	-41.5	175.9	-171.8	-99.9	0	0	0	112.5	N152 E153 Q154 S159 L160 C261 H264	N152-Y156 WeakPolarHBondContact O-CB 3.33Å; N152-Y156 PolarHBondContact O-N 2.96Å; E153-Y156 PolarHBondContact O-N 3.43Å; Q154-Y156 PolarHBondContact O-N 3.4Å; Y156-S159 WeakPolarHBondContact O-CB 3.49Å; Y156-S159 PolarHBondContact O-N 3.42Å; Y156-L160 HydrophobicContact CD1-CD1 4.08Å; Y156-L160 HydrophobicContact CE1-CD1 3.76Å; Y156-L160 HydrophobicContact CE1-CG 4.39Å; Y156-L160 PolarHBondContact O-N 2.86Å; Y156-L160 VanDerWaalsContact O-N 3.08Å; Y156-C261 HydrophobicContact CE2-CB 4.44Å; Y156-H264 AromaticContact CE1-CD2 3.95Å; Y156-H264 WeakPolarHBondContact OH-CB 3.39Å
157	A	83.7	Confident	85.4	Confident	38 Å²	38	70.6 Å²	70.6	31%	0.314	36%	0.357	S	S	.	.	H	α-helix	trans	-63.1	-44.9	173.1	0	0	0	0	0	111.2	E153 Q154 S159 L160 F161	E153-A157 PolarHBondContact O-N 2.9Å; Q154-A157 PolarHBondContact O-N 3.26Å; Q154-A157 VanDerWaalsContact O-N 3.09Å; A157-S159 VanDerWaalsContact C-N 3.26Å; A157-S159 PolarHBondContact O-N 2.94Å; A157-L160 WeakPolarHBondContact O-CA 3.44Å; A157-L160 WeakPolarHBondContact O-CB 3.28Å; A157-L160 PolarHBondContact O-N 3.37Å; A157-F161 WeakPolarHBondContact O-CD2 3.43Å; A157-F161 PolarHBondContact O-N 2.84Å
158	D	86.1	Confident	85.3	Confident	94 Å²	94	67.8 Å²	67.8	50%	0.503	35%	0.346	S	S	.	.	H	α-helix	trans	-61.3	-37	174.4	-71.1	-16.9	0	0	0	111.3	Q154 L160 F161 T162	Q154-D158 WeakPolarHBondContact O-CB 3.46Å; Q154-D158 PolarHBondContact O-N 3.47Å; D158-L160 VanDerWaalsContact C-N 3.29Å; D158-L160 PolarHBondContact O-N 2.79Å; D158-F161 PolarHBondContact O-N 3.2Å; D158-T162 WeakPolarHBondContact O-CB 3.4Å; D158-T162 VanDerWaalsContact O-CG2 3.27Å; D158-T162 WeakPolarHBondContact O-CG2 3.1Å; D158-T162 PolarHBondContact O-N 2.97Å; D158-T162 PolarHBondContact O-OG1 2.85Å
159	S	84.3	Confident	85.3	Confident	6 Å²	6	66.9 Å²	66.9	4%	0.042	34%	0.338	C	S	.	.	H	α-helix	trans	-63.2	-32.9	173	-60.6	0	0	0	0	112.6	D155 Y156 A157 T162 L163 K260	D155-S159 WeakPolarHBondContact O-CB 3.5Å; D155-S159 PolarHBondContact O-N 3.45Å; D155-S159 PolarHBondContact O-OG 3.29Å; Y156-S159 WeakPolarHBondContact O-CB 3.49Å; Y156-S159 PolarHBondContact O-N 3.42Å; A157-S159 VanDerWaalsContact C-N 3.26Å; A157-S159 PolarHBondContact O-N 2.94Å; S159-T162 VanDerWaalsContact CA-OG1 3.25Å; S159-T162 WeakPolarHBondContact CA-OG1 3.48Å; S159-T162 PolarHBondContact O-OG1 3.1Å; S159-L163 WeakPolarHBondContact O-CB 3.31Å; S159-L163 PolarHBondContact O-N 3.07Å; S159-K260 PolarHBondContact OG-NZ 3.26Å
160	L	84.4	Confident	85.2	Confident	21 Å²	21	61.6 Å²	61.6	11%	0.11	31%	0.313	C	S	.	.	H	α-helix	trans	-76.5	-40.3	175.8	-74.8	167.4	0	0	0	112.3	Y156 A157 D158 L163 D164 C261 H264	Y156-L160 HydrophobicContact CD1-CD1 4.08Å; Y156-L160 HydrophobicContact CE1-CD1 3.76Å; Y156-L160 HydrophobicContact CE1-CG 4.39Å; Y156-L160 PolarHBondContact O-N 2.86Å; Y156-L160 VanDerWaalsContact O-N 3.08Å; A157-L160 WeakPolarHBondContact O-CA 3.44Å; A157-L160 WeakPolarHBondContact O-CB 3.28Å; A157-L160 PolarHBondContact O-N 3.37Å; D158-L160 VanDerWaalsContact C-N 3.29Å; D158-L160 PolarHBondContact O-N 2.79Å; L160-L163 WeakPolarHBondContact O-CB 3.46Å; L160-L163 PolarHBondContact O-N 2.96Å; L160-D164 PolarHBondContact O-N 2.97Å; L160-D164 VanDerWaalsContact O-N 3.08Å; L160-C261 HydrophobicContact CD2-CB 3.89Å; L160-H264 HydrophobicContact CD2-CB 4.45Å
161	F	85	Confident	85.2	Confident	150 Å²	150	59.8 Å²	59.8	66%	0.658	30%	0.303	S	S	*	.	H	α-helix	trans	-65	-43.6	174.6	-76.3	-66	0	0	0	111.5	A157 D158 L163 D164 A165	A157-F161 WeakPolarHBondContact O-CD2 3.43Å; A157-F161 PolarHBondContact O-N 2.84Å; D158-F161 PolarHBondContact O-N 3.2Å; F161-L163 VanDerWaalsContact C-N 3.3Å; F161-L163 PolarHBondContact O-N 2.75Å; F161-D164 PolarHBondContact O-N 3.37Å; F161-A165 WeakPolarHBondContact O-CB 3.33Å; F161-A165 PolarHBondContact O-N 3.15Å
162	T	86.6	Confident	85.2	Confident	55 Å²	55	59.4 Å²	59.4	34%	0.337	30%	0.298	S	S	.	.	H	α-helix	trans	-63.6	-36.6	174.4	50.8	0	0	0	0	111.5	D158 S159 A165 C166	D158-T162 WeakPolarHBondContact O-CB 3.4Å; D158-T162 VanDerWaalsContact O-CG2 3.27Å; D158-T162 WeakPolarHBondContact O-CG2 3.1Å; D158-T162 PolarHBondContact O-N 2.97Å; D158-T162 PolarHBondContact O-OG1 2.85Å; S159-T162 VanDerWaalsContact CA-OG1 3.25Å; S159-T162 WeakPolarHBondContact CA-OG1 3.48Å; S159-T162 PolarHBondContact O-OG1 3.1Å; T162-A165 PolarHBondContact O-N 3.24Å; T162-C166 WeakPolarHBondContact O-CB 3.24Å; T162-C166 PolarHBondContact O-N 3.27Å; T162-C166 PolarHBondContact O-SG 3.16Å
163	L	85.9	Confident	85.1	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.9	-51.3	173	-176.6	74.3	0	0	0	111.9	S159 L160 F161 C166 V167 L254 F257 N258 L267 L270	S159-L163 WeakPolarHBondContact O-CB 3.31Å; S159-L163 PolarHBondContact O-N 3.07Å; L160-L163 WeakPolarHBondContact O-CB 3.46Å; L160-L163 PolarHBondContact O-N 2.96Å; F161-L163 VanDerWaalsContact C-N 3.3Å; F161-L163 PolarHBondContact O-N 2.75Å; L163-C166 WeakPolarHBondContact O-CB 3.26Å; L163-C166 PolarHBondContact O-N 2.9Å; L163-V167 WeakPolarHBondContact O-CG2 3.34Å; L163-V167 PolarHBondContact O-N 3.28Å; L163-L254 HydrophobicContact CD1-CD1 3.62Å; L163-L254 HydrophobicContact CD1-CG 4.47Å; L163-L254 HydrophobicContact CG-CD1 4.47Å; L163-F257 HydrophobicContact CB-CB 4.15Å; L163-F257 HydrophobicContact CD1-CB 3.66Å; L163-F257 HydrophobicContact CG-CB 4.48Å; L163-N258 HydrophobicContact CD1-CB 4.36Å; L163-L267 HydrophobicContact CD2-CD1 3.93Å; L163-L270 HydrophobicContact CD2-CD1 3.89Å; L163-L270 HydrophobicContact CG-CD1 4.2Å
164	D	85.6	Confident	84.9	Confident	66 Å²	66	51.6 Å²	51.6	35%	0.353	26%	0.257	S	S	.	.	H	α-helix	trans	-65.9	-38.1	179.9	-176.2	58.7	0	0	0	112.6	L160 F161 V167 S168 L270 R273	L160-D164 PolarHBondContact O-N 2.97Å; L160-D164 VanDerWaalsContact O-N 3.08Å; F161-D164 PolarHBondContact O-N 3.37Å; D164-V167 PolarHBondContact O-N 3.46Å; D164-S168 WeakPolarHBondContact O-CB 3.48Å; D164-S168 PolarHBondContact O-N 2.8Å; D164-S168 PolarHBondContact O-OG 3.03Å; D164-L270 HydrophobicContact CB-CD1 4.44Å; D164-R273 IonicContact OD1-NH1 3.91Å; D164-R273 PolarHBondContact OD1-NH1 3.28Å; D164-R273 VanDerWaalsContact OD1-NH1 3.08Å
165	A	86.2	Confident	84.5	Confident	44 Å²	44	50 Å²	50	36%	0.364	26%	0.255	S	S	.	.	H	α-helix	trans	-62.7	-42.1	172.5	0	0	0	0	0	111.8	F161 T162 S168 R169	F161-A165 WeakPolarHBondContact O-CB 3.33Å; F161-A165 PolarHBondContact O-N 3.15Å; T162-A165 PolarHBondContact O-N 3.24Å; A165-S168 PolarHBondContact O-N 2.9Å; A165-R169 WeakPolarHBondContact O-CB 3.35Å; A165-R169 VanDerWaalsContact O-CG 3.31Å; A165-R169 WeakPolarHBondContact O-CG 3.46Å; A165-R169 PolarHBondContact O-N 3.4Å
166	C	86.3	Confident	83.6	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.007	26%	0.255	C	S	.	.	H	α-helix	trans	-61.8	-46.5	175.1	-70.2	0	0	0	0	111.5	T162 L163 S168 R169 L170 E250 L254	T162-C166 WeakPolarHBondContact O-CB 3.24Å; T162-C166 PolarHBondContact O-N 3.27Å; T162-C166 PolarHBondContact O-SG 3.16Å; L163-C166 WeakPolarHBondContact O-CB 3.26Å; L163-C166 PolarHBondContact O-N 2.9Å; C166-S168 VanDerWaalsContact C-N 3.34Å; C166-S168 PolarHBondContact O-N 3.25Å; C166-R169 PolarHBondContact O-N 3.41Å; C166-R169 PolarHBondContact SG-NH2 3.47Å; C166-R169 VanDerWaalsContact SG-NH2 3.4Å; C166-L170 WeakPolarHBondContact O-CB 3.21Å; C166-L170 VanDerWaalsContact O-CG 3.28Å; C166-L170 WeakPolarHBondContact O-CG 3.3Å; C166-L170 PolarHBondContact O-N 3.16Å; C166-E250 PolarHBondContact SG-OE2 3.29Å; C166-E250 VanDerWaalsContact SG-OE2 3.4Å; C166-L254 HydrophobicContact CB-CB 4.45Å; C166-L254 HydrophobicContact CB-CD1 4.06Å
167	V	86.7	Confident	82.3	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-57.2	-48.6	176.2	174.5	0	0	0	0	110.3	L163 D164 R169 L170 E171 L254 R273 I274 I277	L163-V167 WeakPolarHBondContact O-CG2 3.34Å; L163-V167 PolarHBondContact O-N 3.28Å; D164-V167 PolarHBondContact O-N 3.46Å; V167-R169 PolarHBondContact O-N 3.2Å; V167-L170 PolarHBondContact O-N 2.82Å; V167-E171 HydrophobicContact CG1-CG 4.48Å; V167-E171 WeakPolarHBondContact O-CB 3.19Å; V167-E171 WeakPolarHBondContact O-CG 3.37Å; V167-E171 PolarHBondContact O-N 2.78Å; V167-L254 HydrophobicContact CB-CD1 4.47Å; V167-L254 HydrophobicContact CG2-CD1 3.37Å; V167-R273 HydrophobicContact CG1-CB 3.7Å; V167-R273 VanDerWaalsContact CG1-CZ 3.47Å; V167-I274 HydrophobicContact CG2-CG1 3.93Å; V167-I277 HydrophobicContact CB-CD1 4.19Å; V167-I277 HydrophobicContact CG1-CD1 3.77Å; V167-I277 HydrophobicContact CG2-CD1 4.4Å
168	S	85.2	Confident	80.7	Confident	46 Å²	46	51.2 Å²	51.2	32%	0.322	26%	0.262	S	S	.	.	H	α-helix	trans	-66.6	-38.9	-177.2	-57.9	0	0	0	0	112.7	D164 A165 C166 R172 R273	D164-S168 WeakPolarHBondContact O-CB 3.48Å; D164-S168 PolarHBondContact O-N 2.8Å; D164-S168 PolarHBondContact O-OG 3.03Å; A165-S168 PolarHBondContact O-N 2.9Å; C166-S168 VanDerWaalsContact C-N 3.34Å; C166-S168 PolarHBondContact O-N 3.25Å; S168-R172 WeakPolarHBondContact O-CB 3.35Å; S168-R172 PolarHBondContact O-N 3.32Å; S168-R172 VanDerWaalsContact O-N 3.08Å; S168-R273 PolarHBondContact OG-NH2 2.71Å
169	R	86.6	Confident	78.2	Confident	101 Å²	101	54.5 Å²	54.5	38%	0.381	27%	0.274	S	S	.	.	H	α-helix	trans	-62.7	-48.4	172.8	-74.6	-172.2	-62.3	-164.3	1.7	111.6	A165 C166 V167 E171 R172 W173 E250	A165-R169 WeakPolarHBondContact O-CB 3.35Å; A165-R169 VanDerWaalsContact O-CG 3.31Å; A165-R169 WeakPolarHBondContact O-CG 3.46Å; A165-R169 PolarHBondContact O-N 3.4Å; C166-R169 PolarHBondContact O-N 3.41Å; C166-R169 PolarHBondContact SG-NH2 3.47Å; C166-R169 VanDerWaalsContact SG-NH2 3.4Å; V167-R169 PolarHBondContact O-N 3.2Å; R169-E171 PolarHBondContact O-N 2.87Å; R169-R172 PolarHBondContact O-N 3.45Å; R169-W173 HydrophobicContact CB-CZ2 4.44Å; R169-W173 WeakPolarHBondContact O-CB 3.47Å; R169-W173 PolarHBondContact O-N 3.07Å; R169-E250 IonicContact CZ-OE1 3.24Å; R169-E250 IonicContact CZ-OE2 3.13Å; R169-E250 IonicContact NE-OE2 3.79Å; R169-E250 IonicContact NH2-OE1 3.69Å; R169-E250 IonicContact NH2-OE2 2.67Å; R169-E250 PolarHBondContact NH2-OE2 3.4Å
170	L	85.2	Confident	75.6	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.4	-41.1	179.9	-74	168.1	0	0	0	111.9	C166 V167 W173 L174 I247 E250 Y251 L254 I277	C166-L170 WeakPolarHBondContact O-CB 3.21Å; C166-L170 VanDerWaalsContact O-CG 3.28Å; C166-L170 WeakPolarHBondContact O-CG 3.3Å; C166-L170 PolarHBondContact O-N 3.16Å; V167-L170 PolarHBondContact O-N 2.82Å; L170-W173 HydrophobicContact CD2-CE3 4.45Å; L170-W173 PolarHBondContact O-N 3.45Å; L170-L174 VanDerWaalsContact O-CB 3.27Å; L170-L174 WeakPolarHBondContact O-CB 3.37Å; L170-L174 VanDerWaalsContact O-CG 3.29Å; L170-L174 WeakPolarHBondContact O-CG 3.31Å; L170-L174 PolarHBondContact O-N 3.3Å; L170-I247 HydrophobicContact CD2-CB 4.48Å; L170-I247 HydrophobicContact CD2-CG2 3.81Å; L170-I247 WeakPolarHBondContact CD2-O 3.48Å; L170-E250 HydrophobicContact CD1-CB 4.47Å; L170-E250 HydrophobicContact CD2-CB 3.78Å; L170-E250 HydrophobicContact CG-CB 4.15Å; L170-Y251 HydrophobicContact CD1-CD2 4.49Å; L170-L254 HydrophobicContact CD1-CB 3.99Å; L170-L254 HydrophobicContact CD1-CD2 3.8Å; L170-L254 HydrophobicContact CD1-CG 4.37Å; L170-I277 HydrophobicContact CB-CD1 3.8Å; L170-I277 HydrophobicContact CB-CG1 4.18Å; L170-I277 HydrophobicContact CB-CG2 4.05Å; L170-I277 HydrophobicContact CD1-CD1 4.37Å; L170-I277 HydrophobicContact CD1-CG2 4.05Å
171	E	85.4	Confident	73	Confident	43 Å²	43	63.7 Å²	63.7	20%	0.201	34%	0.338	C	S	.	.	H	α-helix	trans	-59.9	-46.6	173.9	-78.8	177.5	168.5	0	0	112.2	V167 R169 T175 R273 W276 I277	V167-E171 HydrophobicContact CG1-CG 4.48Å; V167-E171 WeakPolarHBondContact O-CB 3.19Å; V167-E171 WeakPolarHBondContact O-CG 3.37Å; V167-E171 PolarHBondContact O-N 2.78Å; R169-E171 PolarHBondContact O-N 2.87Å; E171-T175 VanDerWaalsContact O-CB 3.27Å; E171-T175 WeakPolarHBondContact O-CB 3.36Å; E171-T175 PolarHBondContact O-N 2.89Å; E171-T175 PolarHBondContact O-OG1 2.92Å; E171-R273 VanDerWaalsContact CD-NE 3.33Å; E171-R273 WeakPolarHBondContact OE1-CB 3.35Å; E171-R273 WeakPolarHBondContact OE1-CG 3.21Å; E171-R273 IonicContact OE1-CZ 3.87Å; E171-R273 IonicContact OE1-NE 2.6Å; E171-R273 PolarHBondContact OE1-NE 2.86Å; E171-R273 IonicContact OE1-NH2 2.77Å; E171-R273 IonicContact OE2-CZ 3.74Å; E171-R273 VanDerWaalsContact OE2-CZ 3.32Å; E171-R273 IonicContact OE2-NE 2.75Å; E171-R273 PolarHBondContact OE2-NE 2.76Å; E171-R273 VanDerWaalsContact OE2-NE 3.13Å; E171-R273 IonicContact OE2-NH2 3.77Å; E171-R273 PolarHBondContact OE2-NH2 3.25Å; E171-W276 HydrophobicContact CB-CZ3 4.34Å; E171-W276 HydrophobicContact CG-CE3 4.06Å; E171-W276 HydrophobicContact CG-CZ3 3.97Å; E171-I277 HydrophobicContact CG-CD1 4.12Å; E171-I277 HydrophobicContact CG-CG1 4.01Å
172	R	83.7	Confident	70.3	Confident	117 Å²	117	61.6 Å²	61.6	44%	0.442	34%	0.338	S	S	.	.	H	α-helix	trans	-61.7	-46.2	177.2	-177	174.9	174.5	172.9	-3.7	111.5	S168 R169 Q176	S168-R172 WeakPolarHBondContact O-CB 3.35Å; S168-R172 PolarHBondContact O-N 3.32Å; S168-R172 VanDerWaalsContact O-N 3.08Å; R169-R172 PolarHBondContact O-N 3.45Å; R172-Q176 WeakPolarHBondContact O-CG 3.27Å; R172-Q176 PolarHBondContact O-N 3.25Å
173	W	82.7	Confident	67.5	Low	43 Å²	43	65.6 Å²	65.6	16%	0.163	36%	0.357	C	S	.	.	H	α-helix	trans	-68.6	-38.8	-177.4	-65.5	-14.4	0	0	0	113	R169 L170 R243 R246 I247 E250	R169-W173 HydrophobicContact CB-CZ2 4.44Å; R169-W173 WeakPolarHBondContact O-CB 3.47Å; R169-W173 PolarHBondContact O-N 3.07Å; L170-W173 HydrophobicContact CD2-CE3 4.45Å; L170-W173 PolarHBondContact O-N 3.45Å; W173-R243 PolarHBondContact O-NH2 3.03Å; W173-R246 HydrophobicContact CZ3-CB 4.38Å; W173-I247 HydrophobicContact CB-CD1 4.29Å; W173-I247 HydrophobicContact CB-CG1 4.09Å; W173-I247 HydrophobicContact CE3-CG1 3.88Å; W173-E250 HydrophobicContact CH2-CG 3.66Å; W173-E250 HydrophobicContact CZ3-CB 3.91Å; W173-E250 HydrophobicContact CZ3-CG 3.38Å
174	L	78.4	Confident	64.9	Low	1 Å²	1	75.1 Å²	75.1	1%	0.005	40%	0.398	C	S	.	.	H	α-helix	trans	-73.1	-38.5	177.6	-73.8	169.6	0	0	0	112.1	L170 Q176 S177 I247 W276 I277 N280 L281	L170-L174 VanDerWaalsContact O-CB 3.27Å; L170-L174 WeakPolarHBondContact O-CB 3.37Å; L170-L174 VanDerWaalsContact O-CG 3.29Å; L170-L174 WeakPolarHBondContact O-CG 3.31Å; L170-L174 PolarHBondContact O-N 3.3Å; L174-Q176 PolarHBondContact O-N 3.34Å; L174-S177 WeakPolarHBondContact O-CB 3.13Å; L174-S177 PolarHBondContact O-N 3.38Å; L174-S177 VanDerWaalsContact O-N 3.16Å; L174-S177 PolarHBondContact O-OG 3.49Å; L174-I247 HydrophobicContact CD2-CD1 4.5Å; L174-I247 HydrophobicContact CD2-CG2 4.22Å; L174-W276 HydrophobicContact CB-CH2 3.88Å; L174-W276 HydrophobicContact CB-CZ3 3.94Å; L174-W276 HydrophobicContact CD1-CZ3 4.05Å; L174-I277 HydrophobicContact CD1-CB 4.23Å; L174-I277 HydrophobicContact CD1-CG1 4.37Å; L174-I277 HydrophobicContact CD1-CG2 3.85Å; L174-N280 HydrophobicContact CD1-CB 4.46Å; L174-L281 HydrophobicContact CD2-CB 4.46Å; L174-L281 HydrophobicContact CD2-CD1 4.45Å
175	T	77.9	Confident	62.2	Low	80 Å²	80	80.3 Å²	80.3	49%	0.491	42%	0.42	S	S	.	.	H	α-helix	trans	-65.3	-40.6	179.4	-54.9	0	0	0	0	112	E171 S177 N178	E171-T175 VanDerWaalsContact O-CB 3.27Å; E171-T175 WeakPolarHBondContact O-CB 3.36Å; E171-T175 PolarHBondContact O-N 2.89Å; E171-T175 PolarHBondContact O-OG1 2.92Å; T175-S177 PolarHBondContact O-N 2.89Å; T175-N178 PolarHBondContact O-N 3.2Å; T175-N178 VanDerWaalsContact O-N 3.16Å
176	Q	65.1	Low	59.7	Low	80 Å²	80	87.3 Å²	87.3	37%	0.374	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-64.8	-20.7	176.1	-77.2	177.2	-1.5	0	0	113.5	R172 L174 N178 R243	R172-Q176 WeakPolarHBondContact O-CG 3.27Å; R172-Q176 PolarHBondContact O-N 3.25Å; L174-Q176 PolarHBondContact O-N 3.34Å; Q176-N178 VanDerWaalsContact C-N 3.33Å; Q176-R243 VanDerWaalsContact OE1-NH2 3.09Å
177	S	57.4	Low	57.1	Low	44 Å²	44	93.9 Å²	93.9	31%	0.308	49%	0.486	S	S	.	.	G	3₁₀ helix	trans	-76.5	-20.8	175.8	82	0	0	0	0	113.3	L174 T175 Q179 Q284	L174-S177 WeakPolarHBondContact O-CB 3.13Å; L174-S177 PolarHBondContact O-N 3.38Å; L174-S177 VanDerWaalsContact O-N 3.16Å; L174-S177 PolarHBondContact O-OG 3.49Å; T175-S177 PolarHBondContact O-N 2.89Å; S177-Q179 VanDerWaalsContact C-N 3.32Å; S177-Q179 PolarHBondContact O-N 2.95Å; S177-Q284 PolarHBondContact OG-NE2 3.25Å
178	N	50.4	Low	54.4	Low	84 Å²	84	98.9 Å²	98.9	45%	0.449	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	-85.1	3	-177.2	-76.6	-5.5	0	0	0	113.9	T175 Q176 P180 Q284	T175-N178 PolarHBondContact O-N 3.2Å; T175-N178 VanDerWaalsContact O-N 3.16Å; Q176-N178 VanDerWaalsContact C-N 3.33Å; N178-P180 WeakPolarHBondContact O-CD 3.32Å; N178-Q284 PolarHBondContact OD1-NE2 3.2Å
179	Q	34.1	Very low	52.1	Low	162 Å²	162	103.8 Å²	103.8	76%	0.757	54%	0.543	S	S	*	.	S	Bend	trans	-85.5	108.2	171.2	-72.9	-166.8	-10.2	0	0	109.7	S177 S181	S177-Q179 VanDerWaalsContact C-N 3.32Å; S177-Q179 PolarHBondContact O-N 2.95Å; Q179-S181 PolarHBondContact O-N 3.32Å
180	P	29.8	Very low	49.8	Very low	105 Å²	105	107.7 Å²	107.7	68%	0.682	57%	0.566	S	S	*	*			trans	-60.9	130.2	171.6	25.9	-31.4	0	0	0	107.8	N178 V182	N178-P180 WeakPolarHBondContact O-CD 3.32Å; P180-V182 VanDerWaalsContact C-N 3.26Å; P180-V182 PolarHBondContact O-N 2.95Å
181	S	28.8	Very low	47.4	Very low	116 Å²	116	116 Å²	116	81%	0.811	61%	0.61	S	S	*	*			trans	-57.8	88.1	171.8	44.9	0	0	0	0	110.3	Q179	Q179-S181 PolarHBondContact O-N 3.32Å
182	V	28	Very low	44.8	Very low	106 Å²	106	121.6 Å²	121.6	64%	0.642	64%	0.64	S	S	*	*			trans	-89.8	123.3	167.8	174.6	0	0	0	0	106.5	P180	P180-V182 VanDerWaalsContact C-N 3.26Å; P180-V182 PolarHBondContact O-N 2.95Å
183	N	28.2	Very low	42.4	Very low	138 Å²	138	124.8 Å²	124.8	74%	0.738	66%	0.659	S	S	*	*			trans	83	68.7	170.1	-51.3	-17.9	0	0	0	117.5
184	K	30.3	Very low	40.3	Very low	200 Å²	200	132.6 Å²	132.6	87%	0.87	69%	0.694	S	S	*	*			trans	-104.1	46.5	153.2	-81.4	-172.2	177.1	178	0	111.4
185	E	29.4	Very low	38.1	Very low	175 Å²	175	137.7 Å²	137.7	82%	0.818	73%	0.73	S	S	*	*	S	Bend	trans	-149.6	84.6	168.4	-71.8	-173.8	167	0	0	107.3
186	Q	34.4	Very low	35.9	Very low	192 Å²	192	140.8 Å²	140.8	90%	0.897	74%	0.743	S	S	*	*	S	Bend	trans	172.1	-2.3	155.8	-97.1	162.8	18.7	0	0	116.7
187	T	31.9	Very low	34.5	Very low	139 Å²	139	144 Å²	144	85%	0.853	76%	0.763	S	S	*	*			trans	-118.3	25.4	-174	45.6	0	0	0	0	115.7
188	S	29.7	Very low	33.5	Very low	104 Å²	104	149.3 Å²	149.3	73%	0.727	79%	0.787	S	S	*	*	S	Bend	trans	-85.6	-2.8	177	42.6	0	0	0	0	115.7
189	D	36.1	Very low	32.7	Very low	149 Å²	149	153.9 Å²	153.9	80%	0.797	80%	0.802	S	S	*	*	S	Bend	trans	-116.8	9.8	-167.2	-77.6	-7.5	0	0	0	117.1
190	Q	39.3	Very low	32.6	Very low	184 Å²	184	153.7 Å²	153.7	86%	0.86	81%	0.806	S	S	*	*	S	Bend	trans	-131.3	5.9	-173	-71.4	-169.7	0.7	0	0	118.9
191	L	34.5	Very low	32.9	Very low	175 Å²	175	156.3 Å²	156.3	92%	0.916	81%	0.814	S	S	*	*			trans	-122.2	20.6	178.5	-68.1	173.6	0	0	0	115.5	H193	L191-H193 VanDerWaalsContact C-N 3.32Å; L191-H193 PolarHBondContact O-N 3.47Å
192	L	30.7	Very low	33.2	Very low	159 Å²	159	157.8 Å²	157.8	83%	0.832	81%	0.813	S	S	*	*			trans	-87.1	57.2	164	-83.2	161.8	0	0	0	111.4
193	H	34.2	Very low	33.7	Very low	184 Å²	184	157.8 Å²	157.8	85%	0.852	82%	0.818	S	S	*	*			trans	-165	76.5	164.4	-90.1	-53.7	0	0	0	111.2	L191	L191-H193 VanDerWaalsContact C-N 3.32Å; L191-H193 PolarHBondContact O-N 3.47Å
194	K	38.2	Very low	34.1	Very low	208 Å²	208	157.7 Å²	157.7	90%	0.904	82%	0.817	S	S	*	*			trans	-175.4	67.6	148.9	-105.7	167.8	-177.8	-178.4	0	109.8
195	S	31	Very low	34.3	Very low	107 Å²	107	154.2 Å²	154.2	75%	0.748	81%	0.808	S	S	*	*			trans	-107.5	139.5	157.8	-55.2	0	0	0	0	107.9
196	N	32.3	Very low	34.7	Very low	145 Å²	145	153 Å²	153	78%	0.775	81%	0.807	S	S	*	*			trans	110.9	128.3	161.2	-57.5	-17.3	0	0	0	116
197	N	34.9	Very low	34.7	Very low	148 Å²	148	150.3 Å²	150.3	79%	0.791	80%	0.799	S	S	*	*			trans	99	120.8	163.9	-60.1	-15.6	0	0	0	114
198	I	36.3	Very low	35	Very low	156 Å²	156	151.5 Å²	151.5	80%	0.8	80%	0.8	S	S	*	*			cis	-162.7	153	18.4	-94.3	146.3	0	0	0	108.9
199	K	35.2	Very low	35.3	Very low	179 Å²	179	154.6 Å²	154.6	78%	0.778	80%	0.803	S	S	*	*			trans	-32.4	141.3	172.1	-74.5	167.4	168.1	179.1	0	120.3
200	L	31.6	Very low	35.2	Very low	159 Å²	159	153.2 Å²	153.2	83%	0.832	80%	0.8	S	S	*	*				27.5	120.4	121.2	-61.9	155.5	0	0	0	118.1
201	D	35.2	Very low	35	Very low	159 Å²	159	149.1 Å²	149.1	85%	0.85	79%	0.792	S	S	*	*				-167	153.1	117.6	-122.7	-10.4	0	0	0	113.1
202	D	35.7	Very low	35	Very low	148 Å²	148	149.5 Å²	149.5	79%	0.791	79%	0.786	S	S	*	*			trans	-68.7	155.8	-170.8	-67.3	-46	0	0	0	116.4
203	S	38	Very low	35.2	Very low	106 Å²	106	148 Å²	148	74%	0.741	78%	0.779	S	S	*	*				140.2	117.5	121.8	97.7	0	0	0	0	115.3
204	D	36.7	Very low	35.3	Very low	135 Å²	135	145.3 Å²	145.3	72%	0.722	77%	0.77	S	S	*	*				54.5	122.2	128.2	-73.6	0.6	0	0	0	123.2
205	N	35.3	Very low	35.1	Very low	127 Å²	127	142.2 Å²	142.2	68%	0.679	76%	0.763	S	S	*	*				65.4	113.3	129.5	-63.1	-27.6	0	0	0	119.4
206	N	37.6	Very low	35.2	Very low	150 Å²	150	141.7 Å²	141.7	80%	0.802	76%	0.759	S	S	*	*				172.9	144.6	91.9	-98.7	-31.7	0	0	0	112
207	D	34.7	Very low	35.3	Very low	136 Å²	136	142.2 Å²	142.2	73%	0.727	76%	0.762	S	S	*	*			trans	-51.9	146.3	169.2	-53.7	-54.5	0	0	0	112.9
208	N	38.4	Very low	35.1	Very low	163 Å²	163	138.7 Å²	138.7	87%	0.872	76%	0.76	S	S	*	*				-175.5	131.3	116.4	-90	-37.1	0	0	0	113.5
209	E	34.8	Very low	35	Very low	169 Å²	169	138.5 Å²	138.5	79%	0.79	76%	0.761	S	S	*	*			trans	-43.9	155.1	167.7	-87	178.5	161.8	0	0	118.3
210	T	33.8	Very low	34.7	Very low	120 Å²	120	138.7 Å²	138.7	74%	0.736	77%	0.765	S	S	*	*			trans	102.3	127.8	136.1	57.6	0	0	0	0	122.1
211	S	36.6	Very low	34.7	Very low	99 Å²	99	138.3 Å²	138.3	69%	0.692	76%	0.764	S	S	*	*			trans	82.9	103.6	139.5	65.9	0	0	0	0	116.6
212	K	33.6	Very low	34.5	Very low	183 Å²	183	139.9 Å²	139.9	80%	0.796	77%	0.766	S	S	*	*				79.1	111.3	94.5	-87.8	-174.9	178.9	175.2	0	111.5
213	D	34.1	Very low	34.3	Very low	128 Å²	128	140 Å²	140	68%	0.684	77%	0.765	S	S	*	*				160	132.9	97	-96.4	-19	0	0	0	113
214	I	38.3	Very low	34.1	Very low	126 Å²	126	140.8 Å²	140.8	65%	0.646	76%	0.761	S	S	*	*			trans	88.2	106	130.5	-65.6	170.2	0	0	0	119.4
215	N	33.8	Very low	34	Very low	144 Å²	144	141.8 Å²	141.8	77%	0.77	77%	0.765	S	S	*	*			trans	68.8	123	134.8	-54.5	-5.6	0	0	0	120.6
216	S	33.1	Very low	34.3	Very low	96 Å²	96	142.7 Å²	142.7	67%	0.671	76%	0.759	S	S	*	*				165.6	128	81.8	-140.7	0	0	0	0	110.3
217	D	32.6	Very low	34.2	Very low	156 Å²	156	139.2 Å²	139.2	83%	0.834	75%	0.745	S	S	*	*			trans	59.2	121.7	146	-51.8	-38.1	0	0	0	122.2
218	G	31.2	Very low	34.3	Very low	73 Å²	73	139.9 Å²	139.9	75%	0.753	75%	0.747	S	S	*	*			trans	132.1	113	136.9	0	0	0	0	0	116.5
219	D	33.9	Very low	34.4	Very low	152 Å²	152	140 Å²	140	81%	0.813	74%	0.742	S	S	*	*			trans	77	86.8	156.3	-68	-8.9	0	0	0	119.9	N221	D219-N221 PolarHBondContact O-N 3.41Å
220	E	30.1	Very low	34.7	Very low	183 Å²	183	138.3 Å²	138.3	86%	0.855	73%	0.732	S	S	*	*				16.2	88.7	121.2	-60.1	-177	177	0	0	116.3
221	N	31.6	Very low	35.2	Very low	152 Å²	152	139 Å²	139	81%	0.813	72%	0.722	S	S	*	*			trans	-169.5	64.7	154.7	-89.9	-39.2	0	0	0	110.3	D219 L223	D219-N221 PolarHBondContact O-N 3.41Å; N221-L223 PolarHBondContact O-N 3.29Å
222	E	30.1	Very low	35.3	Very low	192 Å²	192	137.6 Å²	137.6	90%	0.897	72%	0.717	S	S	*	*			trans	-94.4	79.8	171.8	-141.3	168.2	-160	0	0	108.7	D224	E222-D224 PolarHBondContact O-N 2.85Å
223	L	32.7	Very low	35.8	Very low	149 Å²	149	134.2 Å²	134.2	78%	0.78	71%	0.708	S	S	*	*			trans	-75.4	109.7	162.5	-107.7	135.7	0	0	0	106.7	N221 I225	N221-L223 PolarHBondContact O-N 3.29Å; L223-I225 PolarHBondContact O-N 2.76Å
224	D	32.8	Very low	36	Very low	123 Å²	123	130.8 Å²	130.8	66%	0.658	69%	0.693	S	S	*	*			trans	-47.1	95.9	175.8	-77	-40.5	0	0	0	112.1	E222 W226	E222-D224 PolarHBondContact O-N 2.85Å; D224-W226 PolarHBondContact O-N 2.98Å
225	I	34.4	Very low	36.1	Very low	156 Å²	156	128.4 Å²	128.4	80%	0.8	69%	0.688	S	S	*	*			trans	-80.5	96.2	166.9	-63.2	169.8	0	0	0	106.2	L223	L223-I225 PolarHBondContact O-N 2.76Å
226	W	41.3	Very low	36.6	Very low	147 Å²	147	130.1 Å²	130.1	56%	0.557	70%	0.696	S	S	*	*			trans	-62.2	152	175.5	-73.7	79.8	0	0	0	111.4	D224 I228 F230 Y231	D224-W226 PolarHBondContact O-N 2.98Å; W226-I228 PolarHBondContact O-N 3.43Å; W226-F230 HydrophobicContact CB-CB 4.46Å; W226-Y231 HydrophobicContact CB-CE2 3.93Å; W226-Y231 WeakPolarHBondContact O-CE2 3.3Å
227	P	36.2	Very low	37.3	Very low	76 Å²	76	134.1 Å²	134.1	49%	0.494	70%	0.704	S	S	.	*			trans	-49.7	139.5	176.5	-26.1	33.8	0	0	0	112.2	E229 F230	P227-E229 PolarHBondContact O-N 2.96Å; P227-F230 WeakPolarHBondContact O-CB 3.46Å; P227-F230 PolarHBondContact O-N 2.92Å
228	I	36.5	Very low	38.3	Very low	150 Å²	150	128.7 Å²	128.7	77%	0.769	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-55.2	-23.5	-176.1	-103.4	161.4	0	0	0	113.5	W226 F230 Y231 A232	W226-I228 PolarHBondContact O-N 3.43Å; I228-F230 PolarHBondContact O-N 3.43Å; I228-Y231 PolarHBondContact O-N 3.44Å; I228-A232 PolarHBondContact O-N 3.2Å
229	E	40.6	Very low	40	Very low	167 Å²	167	129 Å²	129	78%	0.78	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-62.4	-27.8	174.4	-47.1	-179.4	-126.9	0	0	112.6	P227	P227-E229 PolarHBondContact O-N 2.96Å
230	F	41.3	Very low	41.6	Very low	133 Å²	133	126 Å²	126	58%	0.583	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-86.8	-12.6	178.7	-121.9	-93.8	0	0	0	113.6	W226 P227 I228	W226-F230 HydrophobicContact CB-CB 4.46Å; P227-F230 WeakPolarHBondContact O-CB 3.46Å; P227-F230 PolarHBondContact O-N 2.92Å; I228-F230 PolarHBondContact O-N 3.43Å
231	Y	44.5	Very low	43.4	Very low	133 Å²	133	118 Å²	118	52%	0.522	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.6	-10.5	173.9	-75.4	-84.5	0	0	0	112.8	W226 I228 D233	W226-Y231 HydrophobicContact CB-CE2 3.93Å; W226-Y231 WeakPolarHBondContact O-CE2 3.3Å; I228-Y231 PolarHBondContact O-N 3.44Å; Y231-D233 PolarHBondContact O-N 3.45Å
232	A	38.6	Very low	45.4	Very low	71 Å²	71	115.6 Å²	115.6	59%	0.587	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-18.1	-173.3	0	0	0	0	0	115	I228 C234	I228-A232 PolarHBondContact O-N 3.2Å; A232-C234 PolarHBondContact O-N 3.35Å
233	D	43.5	Very low	47.5	Very low	112 Å²	112	109.3 Å²	109.3	60%	0.599	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-3	-170.8	-99.9	0.5	0	0	0	115.9	Y231 R246	Y231-D233 PolarHBondContact O-N 3.45Å; D233-R246 PolarHBondContact O-NH1 3.25Å
234	C	39.1	Very low	49.6	Very low	56 Å²	56	103 Å²	103	38%	0.378	53%	0.526	S	S	.	.			trans	-126	67.6	173.2	-68.2	0	0	0	0	109.9	A232	A232-C234 PolarHBondContact O-N 3.35Å
235	S	39.7	Very low	51.7	Low	76 Å²	76	99.6 Å²	99.6	53%	0.531	51%	0.507	S	S	.	.			trans	-59.7	140.9	167.8	78.3	0	0	0	0	109.5	H237 E238	S235-H237 PolarHBondContact O-N 3.43Å; S235-E238 PolarHBondContact O-N 2.82Å
236	L	43.9	Very low	54	Low	179 Å²	179	97.1 Å²	97.1	94%	0.937	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	13.2	179.7	-77.4	149.1	0	0	0	114.9
237	H	47.7	Very low	55.9	Low	180 Å²	180	90.2 Å²	90.2	83%	0.833	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.1	7.9	-176.6	-77.1	-46	0	0	0	115	S235 D239	S235-H237 PolarHBondContact O-N 3.43Å; H237-D239 PolarHBondContact O-N 2.9Å
238	E	55	Low	58.1	Low	42 Å²	42	86.7 Å²	86.7	20%	0.196	44%	0.439	C	S	.	.			trans	-68.8	126	178.6	-163.1	173.1	159.6	0	0	111.7	S235 I240 Q242 R243 R246	S235-E238 PolarHBondContact O-N 2.82Å; E238-I240 PolarHBondContact O-N 3.3Å; E238-Q242 HydrophobicContact CG-CB 4.34Å; E238-R243 PolarHBondContact OE1-N 3.38Å; E238-R246 VanDerWaalsContact CD-NH2 3.35Å; E238-R246 WeakPolarHBondContact OE1-CD 3.11Å; E238-R246 IonicContact OE1-CZ 2.65Å; E238-R246 IonicContact OE1-NE 2.93Å; E238-R246 PolarHBondContact OE1-NE 2.78Å; E238-R246 VanDerWaalsContact OE1-NE 3.12Å; E238-R246 IonicContact OE1-NH1 2.82Å; E238-R246 PolarHBondContact OE1-NH1 2.67Å; E238-R246 IonicContact OE1-NH2 3.92Å; E238-R246 PolarHBondContact OE1-NH2 2.61Å; E238-R246 VanDerWaalsContact OE1-NH2 3.13Å; E238-R246 IonicContact OE2-CZ 3.26Å; E238-R246 IonicContact OE2-NH1 3.21Å; E238-R246 PolarHBondContact OE2-NH1 3.35Å; E238-R246 IonicContact OE2-NH2 2.96Å
239	D	65.9	Low	60.4	Low	79 Å²	79	83.7 Å²	83.7	42%	0.422	43%	0.425	S	S	.	.			trans	-62.3	135.5	175.3	-171	0.7	0	0	0	109.6	H237 G241 Q242 R243	H237-D239 PolarHBondContact O-N 2.9Å; D239-G241 PolarHBondContact O-N 3.48Å; D239-G241 VanDerWaalsContact O-N 3.16Å; D239-Q242 HydrophobicContact CB-CG 4.22Å; D239-Q242 PolarHBondContact O-N 2.96Å; D239-R243 PolarHBondContact O-N 2.95Å; D239-R243 VanDerWaalsContact O-N 3.1Å
240	I	68.2	Low	62.4	Low	91 Å²	91	76.4 Å²	76.4	47%	0.467	39%	0.39	S	S	.	.	H	α-helix	trans	-62.2	-30.9	-173	-53.4	167	0	0	0	110.4	E238 M244	E238-I240 PolarHBondContact O-N 3.3Å; I240-M244 WeakPolarHBondContact O-CG 3.27Å; I240-M244 PolarHBondContact O-N 3.47Å
241	G	67.9	Low	64.5	Low	13 Å²	13	70.8 Å²	70.8	13%	0.134	37%	0.365	C	S	.	.	H	α-helix	trans	-60.4	-51	172.2	0	0	0	0	0	113.1	D239 R243 M244 D245 Q319	D239-G241 PolarHBondContact O-N 3.48Å; D239-G241 VanDerWaalsContact O-N 3.16Å; G241-R243 VanDerWaalsContact C-N 3.27Å; G241-R243 PolarHBondContact O-N 2.93Å; G241-M244 WeakPolarHBondContact O-CB 3.31Å; G241-M244 PolarHBondContact O-N 2.66Å; G241-D245 PolarHBondContact O-N 3.02Å; G241-Q319 PolarHBondContact O-NE2 3.08Å; G241-Q319 VanDerWaalsContact O-NE2 3.09Å
242	Q	73.5	Confident	66.4	Low	102 Å²	102	67.1 Å²	67.1	48%	0.477	36%	0.355	S	S	.	.	H	α-helix	trans	-61.7	-38.3	179.9	-65.6	179.6	3.4	0	0	111.6	E238 D239 M244 D245 R246	E238-Q242 HydrophobicContact CG-CB 4.34Å; D239-Q242 HydrophobicContact CB-CG 4.22Å; D239-Q242 PolarHBondContact O-N 2.96Å; Q242-M244 VanDerWaalsContact C-N 3.33Å; Q242-M244 PolarHBondContact O-N 3.26Å; Q242-D245 PolarHBondContact O-N 3.33Å; Q242-R246 WeakPolarHBondContact O-CG 3.49Å; Q242-R246 PolarHBondContact O-N 3.16Å
243	R	74.8	Confident	68.6	Low	61 Å²	61	68.5 Å²	68.5	23%	0.23	35%	0.347	C	S	.	.	H	α-helix	trans	-61.2	-42	173.4	-174.7	179.9	179.1	149.4	7.8	111.7	W173 Q176 E238 D239 G241 R246 I247	W173-R243 PolarHBondContact O-NH2 3.03Å; Q176-R243 VanDerWaalsContact OE1-NH2 3.09Å; E238-R243 PolarHBondContact OE1-N 3.38Å; D239-R243 PolarHBondContact O-N 2.95Å; D239-R243 VanDerWaalsContact O-N 3.1Å; G241-R243 VanDerWaalsContact C-N 3.27Å; G241-R243 PolarHBondContact O-N 2.93Å; R243-R246 PolarHBondContact O-N 3.22Å; R243-I247 HydrophobicContact CG-CD1 4.02Å; R243-I247 VanDerWaalsContact O-CG1 3.24Å; R243-I247 WeakPolarHBondContact O-CG1 3.29Å; R243-I247 PolarHBondContact O-N 3.4Å
244	M	76.9	Confident	70.6	Confident	17 Å²	17	63.2 Å²	63.2	8%	0.084	32%	0.319	C	S	.	.	H	α-helix	trans	-67.7	-37.4	178	-71.7	-61.5	-67.4	0	0	112.5	I240 G241 Q242 R246 I247 A248 L281 Q284 L285 I323	I240-M244 WeakPolarHBondContact O-CG 3.27Å; I240-M244 PolarHBondContact O-N 3.47Å; G241-M244 WeakPolarHBondContact O-CB 3.31Å; G241-M244 PolarHBondContact O-N 2.66Å; Q242-M244 VanDerWaalsContact C-N 3.33Å; Q242-M244 PolarHBondContact O-N 3.26Å; M244-R246 VanDerWaalsContact C-N 3.33Å; M244-R246 PolarHBondContact O-N 3.5Å; M244-I247 PolarHBondContact O-N 3.31Å; M244-I247 HydrophobicContact SD-CD1 3.98Å; M244-A248 WeakPolarHBondContact O-CB 3.35Å; M244-A248 PolarHBondContact O-N 2.87Å; M244-L281 HydrophobicContact CE-CD1 3.89Å; M244-Q284 HydrophobicContact CE-CB 4.26Å; M244-L285 HydrophobicContact CE-CD2 3.42Å; M244-L285 VanDerWaalsContact CE-CD2 3.42Å; M244-L285 HydrophobicContact CE-CG 3.67Å; M244-I323 HydrophobicContact CB-CD1 3.8Å
245	D	76.6	Confident	72.8	Confident	51 Å²	51	62.9 Å²	62.9	27%	0.273	31%	0.312	S	S	.	.	H	α-helix	trans	-61.7	-41.7	171.9	-75.8	-30.1	0	0	0	111.5	G241 Q242 A248 N249 Q319 I323	G241-D245 PolarHBondContact O-N 3.02Å; Q242-D245 PolarHBondContact O-N 3.33Å; D245-A248 PolarHBondContact O-N 3.33Å; D245-N249 WeakPolarHBondContact O-CB 3.43Å; D245-N249 VanDerWaalsContact O-CG 3.29Å; D245-N249 PolarHBondContact O-N 2.96Å; D245-N249 PolarHBondContact O-ND2 3.4Å; D245-N249 VanDerWaalsContact O-ND2 3.09Å; D245-Q319 PolarHBondContact OD2-NE2 3.1Å; D245-I323 WeakPolarHBondContact OD1-CD1 3.45Å; D245-I323 WeakPolarHBondContact OD1-CG1 3.44Å
246	R	81.4	Confident	74.9	Confident	104 Å²	104	65.2 Å²	65.2	39%	0.392	31%	0.313	S	S	.	.	H	α-helix	trans	-62.6	-45.3	174.6	-70	-176.7	-167.9	168.3	16.6	111.7	W173 D233 E238 Q242 R243 M244 A248 N249 E250	W173-R246 HydrophobicContact CZ3-CB 4.38Å; D233-R246 PolarHBondContact O-NH1 3.25Å; E238-R246 VanDerWaalsContact CD-NH2 3.35Å; E238-R246 WeakPolarHBondContact OE1-CD 3.11Å; E238-R246 IonicContact OE1-CZ 2.65Å; E238-R246 IonicContact OE1-NE 2.93Å; E238-R246 PolarHBondContact OE1-NE 2.78Å; E238-R246 VanDerWaalsContact OE1-NE 3.12Å; E238-R246 IonicContact OE1-NH1 2.82Å; E238-R246 PolarHBondContact OE1-NH1 2.67Å; E238-R246 IonicContact OE1-NH2 3.92Å; E238-R246 PolarHBondContact OE1-NH2 2.61Å; E238-R246 VanDerWaalsContact OE1-NH2 3.13Å; E238-R246 IonicContact OE2-CZ 3.26Å; E238-R246 IonicContact OE2-NH1 3.21Å; E238-R246 PolarHBondContact OE2-NH1 3.35Å; E238-R246 IonicContact OE2-NH2 2.96Å; Q242-R246 WeakPolarHBondContact O-CG 3.49Å; Q242-R246 PolarHBondContact O-N 3.16Å; R243-R246 PolarHBondContact O-N 3.22Å; M244-R246 VanDerWaalsContact C-N 3.33Å; M244-R246 PolarHBondContact O-N 3.5Å; R246-A248 VanDerWaalsContact C-N 3.33Å; R246-A248 PolarHBondContact O-N 2.97Å; R246-N249 PolarHBondContact O-N 2.79Å; R246-E250 PolarHBondContact O-N 3.04Å
247	I	82.7	Confident	76.8	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-61.1	-44	176.5	-67.3	164.3	0	0	0	110.3	L170 W173 L174 R243 M244 E250 Y251 L281	L170-I247 HydrophobicContact CD2-CB 4.48Å; L170-I247 HydrophobicContact CD2-CG2 3.81Å; L170-I247 WeakPolarHBondContact CD2-O 3.48Å; W173-I247 HydrophobicContact CB-CD1 4.29Å; W173-I247 HydrophobicContact CB-CG1 4.09Å; W173-I247 HydrophobicContact CE3-CG1 3.88Å; L174-I247 HydrophobicContact CD2-CD1 4.5Å; L174-I247 HydrophobicContact CD2-CG2 4.22Å; R243-I247 HydrophobicContact CG-CD1 4.02Å; R243-I247 VanDerWaalsContact O-CG1 3.24Å; R243-I247 WeakPolarHBondContact O-CG1 3.29Å; R243-I247 PolarHBondContact O-N 3.4Å; M244-I247 PolarHBondContact O-N 3.31Å; M244-I247 HydrophobicContact SD-CD1 3.98Å; I247-E250 PolarHBondContact O-N 3.38Å; I247-Y251 VanDerWaalsContact O-CB 3.28Å; I247-Y251 WeakPolarHBondContact O-CB 3.5Å; I247-Y251 PolarHBondContact O-N 2.95Å; I247-L281 HydrophobicContact CG2-CD1 3.56Å
248	A	82.1	Confident	78.6	Confident	2 Å²	2	52.2 Å²	52.2	2%	0.017	25%	0.248	C	C	.	.	H	α-helix	trans	-62.1	-46.1	177.8	0	0	0	0	0	111.9	M244 D245 R246 E250 Y251 I252 I323 I327	M244-A248 WeakPolarHBondContact O-CB 3.35Å; M244-A248 PolarHBondContact O-N 2.87Å; D245-A248 PolarHBondContact O-N 3.33Å; R246-A248 VanDerWaalsContact C-N 3.33Å; R246-A248 PolarHBondContact O-N 2.97Å; A248-E250 PolarHBondContact O-N 3.35Å; A248-Y251 CarbonylContact O-C 3.59Å; A248-Y251 WeakPolarHBondContact O-CB 3.5Å; A248-Y251 PolarHBondContact O-N 3.41Å; A248-Y251 VanDerWaalsContact O-N 3.15Å; A248-I252 VanDerWaalsContact O-CG1 3.26Å; A248-I252 WeakPolarHBondContact O-CG1 3.47Å; A248-I252 PolarHBondContact O-N 3.39Å; A248-I323 HydrophobicContact CB-CB 4.44Å; A248-I323 HydrophobicContact CB-CG1 4.29Å; A248-I323 HydrophobicContact CB-CG2 3.55Å; A248-I327 HydrophobicContact CB-CD1 3.97Å; A248-I327 HydrophobicContact CB-CG1 4.19Å
249	N	84.2	Confident	80	Confident	88 Å²	88	56 Å²	56	47%	0.471	26%	0.264	S	S	.	.	H	α-helix	trans	-62.5	-42.9	177.3	-75.3	-37.2	0	0	0	112.4	D245 R246 Y251 I252 K253	D245-N249 WeakPolarHBondContact O-CB 3.43Å; D245-N249 VanDerWaalsContact O-CG 3.29Å; D245-N249 PolarHBondContact O-N 2.96Å; D245-N249 PolarHBondContact O-ND2 3.4Å; D245-N249 VanDerWaalsContact O-ND2 3.09Å; R246-N249 PolarHBondContact O-N 2.79Å; N249-Y251 VanDerWaalsContact C-N 3.32Å; N249-I252 PolarHBondContact O-N 2.99Å; N249-K253 WeakPolarHBondContact O-CG 3.45Å; N249-K253 PolarHBondContact O-N 3.2Å
250	E	83.7	Confident	80.8	Confident	13 Å²	13	56.9 Å²	56.9	6%	0.061	26%	0.264	C	S	.	.	H	α-helix	trans	-67.1	-33.5	173.4	-77.8	-59.7	136.7	0	0	112.3	C166 R169 L170 W173 R246 I247 A248 K253 L254	C166-E250 PolarHBondContact SG-OE2 3.29Å; C166-E250 VanDerWaalsContact SG-OE2 3.4Å; R169-E250 IonicContact CZ-OE1 3.24Å; R169-E250 IonicContact CZ-OE2 3.13Å; R169-E250 IonicContact NE-OE2 3.79Å; R169-E250 IonicContact NH2-OE1 3.69Å; R169-E250 IonicContact NH2-OE2 2.67Å; R169-E250 PolarHBondContact NH2-OE2 3.4Å; L170-E250 HydrophobicContact CD1-CB 4.47Å; L170-E250 HydrophobicContact CD2-CB 3.78Å; L170-E250 HydrophobicContact CG-CB 4.15Å; W173-E250 HydrophobicContact CH2-CG 3.66Å; W173-E250 HydrophobicContact CZ3-CB 3.91Å; W173-E250 HydrophobicContact CZ3-CG 3.38Å; R246-E250 PolarHBondContact O-N 3.04Å; I247-E250 PolarHBondContact O-N 3.38Å; A248-E250 PolarHBondContact O-N 3.35Å; E250-K253 WeakPolarHBondContact O-CB 3.45Å; E250-K253 PolarHBondContact O-N 2.98Å; E250-K253 WeakPolarHBondContact OE1-CD 3.43Å; E250-K253 IonicContact OE1-NZ 3.42Å; E250-K253 PolarHBondContact OE1-NZ 3.47Å; E250-L254 WeakPolarHBondContact O-CB 3.43Å; E250-L254 PolarHBondContact O-N 3.16Å
251	Y	85.3	Confident	81.3	Confident	15 Å²	15	52.6 Å²	52.6	6%	0.059	24%	0.242	C	C	.	.	H	α-helix	trans	-68.1	-37.4	173.8	-176.5	-106.7	0	0	0	112.4	L170 I247 A248 N249 L254 Q255 I277 T278 L281 I327	L170-Y251 HydrophobicContact CD1-CD2 4.49Å; I247-Y251 VanDerWaalsContact O-CB 3.28Å; I247-Y251 WeakPolarHBondContact O-CB 3.5Å; I247-Y251 PolarHBondContact O-N 2.95Å; A248-Y251 CarbonylContact O-C 3.59Å; A248-Y251 WeakPolarHBondContact O-CB 3.5Å; A248-Y251 PolarHBondContact O-N 3.41Å; A248-Y251 VanDerWaalsContact O-N 3.15Å; N249-Y251 VanDerWaalsContact C-N 3.32Å; Y251-L254 HydrophobicContact CD2-CD2 4.01Å; Y251-L254 HydrophobicContact CE2-CD2 4.22Å; Y251-L254 WeakPolarHBondContact O-CB 3.43Å; Y251-L254 PolarHBondContact O-N 3.36Å; Y251-Q255 HydrophobicContact CD1-CG 4.38Å; Y251-Q255 HydrophobicContact CE1-CG 4.01Å; Y251-Q255 WeakPolarHBondContact O-CG 3.31Å; Y251-Q255 PolarHBondContact O-N 3.38Å; Y251-Q255 PolarHBondContact OH-NE2 3.32Å; Y251-I277 HydrophobicContact CD2-CG2 3.85Å; Y251-I277 HydrophobicContact CE2-CG2 4.12Å; Y251-T278 WeakPolarHBondContact CE2-OG1 3.48Å; Y251-T278 VanDerWaalsContact OH-CG2 3.26Å; Y251-T278 WeakPolarHBondContact OH-CG2 3.31Å; Y251-T278 PolarHBondContact OH-OG1 3.1Å; Y251-L281 HydrophobicContact CD1-CD2 3.62Å; Y251-L281 HydrophobicContact CD2-CD2 3.86Å; Y251-L281 HydrophobicContact CE1-CD2 4.12Å; Y251-L281 HydrophobicContact CE2-CD2 4.37Å; Y251-L281 HydrophobicContact CG-CD2 3.46Å; Y251-L281 VanDerWaalsContact CG-CD2 3.46Å; Y251-I327 HydrophobicContact CD1-CD1 4.45Å; Y251-I327 HydrophobicContact CD1-CG1 4.21Å; Y251-I327 HydrophobicContact CD1-CG2 3.67Å; Y251-I327 HydrophobicContact CE1-CG2 3.48Å; Y251-I327 VanDerWaalsContact CE1-CG2 3.48Å
252	I	84.1	Confident	81.7	Confident	57 Å²	57	60.6 Å²	60.6	29%	0.292	27%	0.269	S	S	.	.	H	α-helix	trans	-63.2	-43.9	172.5	-67.4	161.2	0	0	0	110.1	A248 N249 L254 Q255 F256 A326	A248-I252 VanDerWaalsContact O-CG1 3.26Å; A248-I252 WeakPolarHBondContact O-CG1 3.47Å; A248-I252 PolarHBondContact O-N 3.39Å; N249-I252 PolarHBondContact O-N 2.99Å; I252-L254 VanDerWaalsContact C-N 3.34Å; I252-L254 PolarHBondContact O-N 3.17Å; I252-Q255 PolarHBondContact O-N 3.43Å; I252-F256 PolarHBondContact O-N 3.14Å; I252-A326 HydrophobicContact CD1-CB 3.76Å; I252-A326 WeakPolarHBondContact CD1-O 3.42Å; I252-A326 WeakPolarHBondContact CG1-O 3.35Å
253	K	85	Confident	81.7	Confident	100 Å²	100	59.5 Å²	59.5	44%	0.435	29%	0.285	S	S	.	.	H	α-helix	trans	-58.9	-45.8	172.3	-69.6	176.6	-168.1	172.3	0	111.3	N249 E250 Q255 F256 F257	N249-K253 WeakPolarHBondContact O-CG 3.45Å; N249-K253 PolarHBondContact O-N 3.2Å; E250-K253 WeakPolarHBondContact O-CB 3.45Å; E250-K253 PolarHBondContact O-N 2.98Å; E250-K253 WeakPolarHBondContact OE1-CD 3.43Å; E250-K253 IonicContact OE1-NZ 3.42Å; E250-K253 PolarHBondContact OE1-NZ 3.47Å; K253-Q255 VanDerWaalsContact C-N 3.33Å; K253-Q255 PolarHBondContact O-N 3.31Å; K253-F256 WeakPolarHBondContact O-CB 3.5Å; K253-F256 PolarHBondContact O-N 3.19Å; K253-F257 HydrophobicContact CB-CD2 4.49Å; K253-F257 HydrophobicContact CB-CE2 4.42Å; K253-F257 WeakPolarHBondContact O-CD2 3.32Å; K253-F257 PolarHBondContact O-N 3.15Å
254	L	85.4	Confident	82	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-57.1	-46.4	175.8	-178.8	77.5	0	0	0	111.2	L163 C166 V167 L170 E250 Y251 I252 F256 F257 N258 I274 I277	L163-L254 HydrophobicContact CD1-CD1 3.62Å; L163-L254 HydrophobicContact CD1-CG 4.47Å; L163-L254 HydrophobicContact CG-CD1 4.47Å; C166-L254 HydrophobicContact CB-CB 4.45Å; C166-L254 HydrophobicContact CB-CD1 4.06Å; V167-L254 HydrophobicContact CB-CD1 4.47Å; V167-L254 HydrophobicContact CG2-CD1 3.37Å; L170-L254 HydrophobicContact CD1-CB 3.99Å; L170-L254 HydrophobicContact CD1-CD2 3.8Å; L170-L254 HydrophobicContact CD1-CG 4.37Å; E250-L254 WeakPolarHBondContact O-CB 3.43Å; E250-L254 PolarHBondContact O-N 3.16Å; Y251-L254 HydrophobicContact CD2-CD2 4.01Å; Y251-L254 HydrophobicContact CE2-CD2 4.22Å; Y251-L254 WeakPolarHBondContact O-CB 3.43Å; Y251-L254 PolarHBondContact O-N 3.36Å; I252-L254 VanDerWaalsContact C-N 3.34Å; I252-L254 PolarHBondContact O-N 3.17Å; L254-F256 VanDerWaalsContact C-N 3.34Å; L254-F256 PolarHBondContact O-N 3.49Å; L254-F257 PolarHBondContact O-N 3.3Å; L254-N258 WeakPolarHBondContact O-CB 3.46Å; L254-N258 PolarHBondContact O-N 2.95Å; L254-I274 HydrophobicContact CD1-CG1 4.44Å; L254-I274 HydrophobicContact CD2-CG1 4.31Å; L254-I274 HydrophobicContact CD2-CG2 4.19Å; L254-I277 HydrophobicContact CD2-CD1 4.28Å; L254-I277 HydrophobicContact CD2-CG2 4.38Å
255	Q	84.7	Confident	82	Confident	48 Å²	48	62.7 Å²	62.7	22%	0.224	31%	0.31	C	S	.	.	H	α-helix	trans	-62.7	-40.1	177	-74.4	-163.6	8.1	0	0	112.4	Y251 I252 K253 N258 K259	Y251-Q255 HydrophobicContact CD1-CG 4.38Å; Y251-Q255 HydrophobicContact CE1-CG 4.01Å; Y251-Q255 WeakPolarHBondContact O-CG 3.31Å; Y251-Q255 PolarHBondContact O-N 3.38Å; Y251-Q255 PolarHBondContact OH-NE2 3.32Å; I252-Q255 PolarHBondContact O-N 3.43Å; K253-Q255 VanDerWaalsContact C-N 3.33Å; K253-Q255 PolarHBondContact O-N 3.31Å; Q255-N258 PolarHBondContact O-N 3.4Å; Q255-K259 WeakPolarHBondContact O-CB 3.49Å; Q255-K259 WeakPolarHBondContact O-CG 3.47Å; Q255-K259 PolarHBondContact O-N 3.36Å
256	F	84.9	Confident	82.1	Confident	126 Å²	126	64 Å²	64	55%	0.553	32%	0.316	S	S	*	.	H	α-helix	trans	-61	-50.7	175.7	174.7	-95.6	0	0	0	111.5	I252 K253 L254 N258 K259 K260	I252-F256 PolarHBondContact O-N 3.14Å; K253-F256 WeakPolarHBondContact O-CB 3.5Å; K253-F256 PolarHBondContact O-N 3.19Å; L254-F256 VanDerWaalsContact C-N 3.34Å; L254-F256 PolarHBondContact O-N 3.49Å; F256-N258 VanDerWaalsContact C-N 3.35Å; F256-N258 PolarHBondContact O-N 2.99Å; F256-K259 PolarHBondContact O-N 2.86Å; F256-K260 HydrophobicContact CE1-CD 4.19Å; F256-K260 WeakPolarHBondContact O-CB 3.49Å; F256-K260 PolarHBondContact O-N 3.47Å
257	F	83.8	Confident	81.9	Confident	37 Å²	37	59.5 Å²	59.5	16%	0.162	30%	0.299	C	S	.	.	H	α-helix	trans	-67.4	-35	178.3	-70.4	-64.1	0	0	0	112.4	L163 K253 L254 K259 K260 C261	L163-F257 HydrophobicContact CB-CB 4.15Å; L163-F257 HydrophobicContact CD1-CB 3.66Å; L163-F257 HydrophobicContact CG-CB 4.48Å; K253-F257 HydrophobicContact CB-CD2 4.49Å; K253-F257 HydrophobicContact CB-CE2 4.42Å; K253-F257 WeakPolarHBondContact O-CD2 3.32Å; K253-F257 PolarHBondContact O-N 3.15Å; L254-F257 PolarHBondContact O-N 3.3Å; F257-K259 VanDerWaalsContact C-N 3.32Å; F257-K259 PolarHBondContact O-N 2.99Å; F257-K260 PolarHBondContact O-N 2.87Å; F257-C261 WeakPolarHBondContact O-CB 3.44Å; F257-C261 PolarHBondContact O-N 2.88Å; F257-C261 PolarHBondContact O-SG 2.97Å
258	N	84.5	Confident	81.6	Confident	48 Å²	48	64.1 Å²	64.1	26%	0.257	32%	0.324	S	S	.	.	H	α-helix	trans	-62.8	-38.3	172.9	-175.1	11.5	0	0	0	111.5	L163 L254 Q255 F256 R262 L267	L163-N258 HydrophobicContact CD1-CB 4.36Å; L254-N258 WeakPolarHBondContact O-CB 3.46Å; L254-N258 PolarHBondContact O-N 2.95Å; Q255-N258 PolarHBondContact O-N 3.4Å; F256-N258 VanDerWaalsContact C-N 3.35Å; F256-N258 PolarHBondContact O-N 2.99Å; N258-R262 WeakPolarHBondContact O-CG 3.3Å; N258-L267 VanDerWaalsContact OD1-CD1 3.32Å; N258-L267 WeakPolarHBondContact OD1-CD1 3.31Å; N258-L267 WeakPolarHBondContact OD1-CD2 3.21Å
259	K	84.2	Confident	81.6	Confident	121 Å²	121	67.7 Å²	67.7	53%	0.526	35%	0.349	S	S	.	.	H	α-helix	trans	-68.6	-41.3	171.8	-74.7	177.7	-177.3	173.1	0	112.1	Q255 F256 F257 R262	Q255-K259 WeakPolarHBondContact O-CB 3.49Å; Q255-K259 WeakPolarHBondContact O-CG 3.47Å; Q255-K259 PolarHBondContact O-N 3.36Å; F256-K259 PolarHBondContact O-N 2.86Å; F257-K259 VanDerWaalsContact C-N 3.32Å; F257-K259 PolarHBondContact O-N 2.99Å; K259-R262 VanDerWaalsContact O-CG 3.31Å; K259-R262 WeakPolarHBondContact O-CG 3.43Å
260	K	82.5	Confident	81.6	Confident	99 Å²	99	63.8 Å²	63.8	43%	0.43	33%	0.328	S	S	.	.	H	α-helix	trans	-67.8	-37.1	-179.2	-167.6	179.1	179.1	-167.7	0	112.9	S159 F256 F257	S159-K260 PolarHBondContact OG-NZ 3.26Å; F256-K260 HydrophobicContact CE1-CD 4.19Å; F256-K260 WeakPolarHBondContact O-CB 3.49Å; F256-K260 PolarHBondContact O-N 3.47Å; F257-K260 PolarHBondContact O-N 2.87Å
261	C	80	Confident	81.6	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	22.3	-176.8	-60.4	0	0	0	0	113.9	Y156 L160 F257 G263 H264	Y156-C261 HydrophobicContact CE2-CB 4.44Å; L160-C261 HydrophobicContact CD2-CB 3.89Å; F257-C261 WeakPolarHBondContact O-CB 3.44Å; F257-C261 PolarHBondContact O-N 2.88Å; F257-C261 PolarHBondContact O-SG 2.97Å; C261-G263 PolarHBondContact O-N 3.4Å; C261-H264 PolarHBondContact O-N 3.43Å
262	R	76.3	Confident	81.7	Confident	182 Å²	182	71.2 Å²	71.2	69%	0.687	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	123.7	179.8	-79.5	178.4	177.7	-175.3	-0.6	110.9	N258 K259	N258-R262 WeakPolarHBondContact O-CG 3.3Å; K259-R262 VanDerWaalsContact O-CG 3.31Å; K259-R262 WeakPolarHBondContact O-CG 3.43Å
263	G	73.6	Confident	81.8	Confident	79 Å²	79	71.8 Å²	71.8	81%	0.814	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.3	-11.5	175.7	0	0	0	0	0	115	C261	C261-G263 PolarHBondContact O-N 3.4Å
264	H	79.5	Confident	81.8	Confident	54 Å²	54	67.5 Å²	67.5	25%	0.25	35%	0.349	C	S	.	.			trans	-75.6	140.4	178.1	-157.9	-99.9	0	0	0	112.3	Y156 L160 C261 I266 L267	Y156-H264 AromaticContact CE1-CD2 3.95Å; Y156-H264 WeakPolarHBondContact OH-CB 3.39Å; L160-H264 HydrophobicContact CD2-CB 4.45Å; C261-H264 PolarHBondContact O-N 3.43Å; H264-I266 VanDerWaalsContact C-N 3.31Å; H264-I266 VanDerWaalsContact CE1-CD1 3.48Å; H264-I266 WeakPolarHBondContact CE1-CD1 3.3Å; H264-I266 PolarHBondContact ND1-N 3.44Å; H264-I266 PolarHBondContact O-N 2.9Å; H264-L267 VanDerWaalsContact O-CB 3.28Å; H264-L267 WeakPolarHBondContact O-CB 3.25Å; H264-L267 PolarHBondContact O-N 3.22Å
265	P	78.6	Confident	81.8	Confident	91 Å²	91	72.4 Å²	72.4	59%	0.591	38%	0.376	S	S	*	.	H	α-helix	trans	-61	-32.5	179.9	20.5	-32.5	0	0	0	114.2	L267 N268	P265-L267 PolarHBondContact O-N 3.37Å; P265-N268 VanDerWaalsContact O-CB 3.3Å; P265-N268 WeakPolarHBondContact O-CB 3.27Å; P265-N268 PolarHBondContact O-N 3.4Å
266	I	76.8	Confident	82	Confident	77 Å²	77	75.1 Å²	75.1	40%	0.395	38%	0.384	S	S	.	.	H	α-helix	trans	-60.7	-30.7	175.5	-62	173.5	0	0	0	111.3	H264 N268 S269 L270	H264-I266 VanDerWaalsContact C-N 3.31Å; H264-I266 VanDerWaalsContact CE1-CD1 3.48Å; H264-I266 WeakPolarHBondContact CE1-CD1 3.3Å; H264-I266 PolarHBondContact ND1-N 3.44Å; H264-I266 PolarHBondContact O-N 2.9Å; I266-N268 PolarHBondContact O-N 3.1Å; I266-S269 PolarHBondContact O-N 2.86Å; I266-S269 VanDerWaalsContact O-N 3.14Å; I266-S269 PolarHBondContact O-OG 3.41Å; I266-L270 HydrophobicContact CG2-CD1 4.05Å; I266-L270 HydrophobicContact CG2-CG 4.37Å; I266-L270 PolarHBondContact O-N 2.92Å; I266-L270 VanDerWaalsContact O-N 3.13Å
267	L	77.3	Confident	82	Confident	10 Å²	10	69.1 Å²	69.1	5%	0.052	36%	0.357	C	S	.	.	H	α-helix	trans	-63.6	-31.2	175.8	-170.5	65.3	0	0	0	111.2	L163 N258 H264 P265 S269 L270 K271 I274	L163-L267 HydrophobicContact CD2-CD1 3.93Å; N258-L267 VanDerWaalsContact OD1-CD1 3.32Å; N258-L267 WeakPolarHBondContact OD1-CD1 3.31Å; N258-L267 WeakPolarHBondContact OD1-CD2 3.21Å; H264-L267 VanDerWaalsContact O-CB 3.28Å; H264-L267 WeakPolarHBondContact O-CB 3.25Å; H264-L267 PolarHBondContact O-N 3.22Å; P265-L267 PolarHBondContact O-N 3.37Å; L267-S269 VanDerWaalsContact C-N 3.33Å; L267-S269 PolarHBondContact O-N 3.43Å; L267-L270 PolarHBondContact O-N 3.11Å; L267-K271 VanDerWaalsContact O-CG 3.31Å; L267-K271 WeakPolarHBondContact O-CG 3.01Å; L267-K271 PolarHBondContact O-N 3.35Å; L267-I274 HydrophobicContact CD1-CD1 4.05Å
268	N	76.9	Confident	82.1	Confident	98 Å²	98	68.6 Å²	68.6	52%	0.524	36%	0.357	S	S	.	.	H	α-helix	trans	-67.1	-32.5	176.8	-66.3	-31.3	0	0	0	112.8	P265 I266 K271	P265-N268 VanDerWaalsContact O-CB 3.3Å; P265-N268 WeakPolarHBondContact O-CB 3.27Å; P265-N268 PolarHBondContact O-N 3.4Å; I266-N268 PolarHBondContact O-N 3.1Å; N268-K271 WeakPolarHBondContact OD1-CE 3.26Å; N268-K271 PolarHBondContact OD1-NZ 3.25Å
269	S	81.9	Confident	82.1	Confident	78 Å²	78	70.4 Å²	70.4	55%	0.545	37%	0.37	S	S	.	.	H	α-helix	trans	-75.9	-30.6	174	61.5	0	0	0	0	112.5	I266 L267 P272	I266-S269 PolarHBondContact O-N 2.86Å; I266-S269 VanDerWaalsContact O-N 3.14Å; I266-S269 PolarHBondContact O-OG 3.41Å; L267-S269 VanDerWaalsContact C-N 3.33Å; L267-S269 PolarHBondContact O-N 3.43Å; S269-P272 WeakPolarHBondContact O-CD 3.43Å
270	L	84	Confident	82.2	Confident	6 Å²	6	65 Å²	65	3%	0.031	35%	0.347	C	S	.	.	H	α-helix	trans	-83.6	-21.7	178.9	-66.1	176.8	0	0	0	114.5	L163 D164 I266 L267 R273 I274	L163-L270 HydrophobicContact CD2-CD1 3.89Å; L163-L270 HydrophobicContact CG-CD1 4.2Å; D164-L270 HydrophobicContact CB-CD1 4.44Å; I266-L270 HydrophobicContact CG2-CD1 4.05Å; I266-L270 HydrophobicContact CG2-CG 4.37Å; I266-L270 PolarHBondContact O-N 2.92Å; I266-L270 VanDerWaalsContact O-N 3.13Å; L267-L270 PolarHBondContact O-N 3.11Å; L270-R273 WeakPolarHBondContact O-CB 3.45Å; L270-R273 PolarHBondContact O-N 2.74Å; L270-I274 HydrophobicContact CB-CD1 4.17Å; L270-I274 WeakPolarHBondContact O-CG1 3.33Å; L270-I274 PolarHBondContact O-N 2.81Å
271	K	83.8	Confident	82.3	Confident	100 Å²	100	60.5 Å²	60.5	44%	0.435	33%	0.327	S	S	.	.	H	α-helix	trans	-44.2	-51.2	177.1	-89.1	172.9	-171.1	172	0	115.4	L267 N268 R273 I274 N275	L267-K271 VanDerWaalsContact O-CG 3.31Å; L267-K271 WeakPolarHBondContact O-CG 3.01Å; L267-K271 PolarHBondContact O-N 3.35Å; N268-K271 WeakPolarHBondContact OD1-CE 3.26Å; N268-K271 PolarHBondContact OD1-NZ 3.25Å; K271-R273 VanDerWaalsContact C-N 3.3Å; K271-R273 PolarHBondContact O-N 3.24Å; K271-I274 PolarHBondContact O-N 3.34Å; K271-N275 WeakPolarHBondContact O-CB 3.42Å; K271-N275 VanDerWaalsContact O-CG 3.31Å; K271-N275 PolarHBondContact O-N 3.27Å
272	P	86.9	Confident	82.5	Confident	83 Å²	83	63.7 Å²	63.7	54%	0.539	34%	0.342	S	S	.	.	H	α-helix	trans	-62.2	-37.7	179.6	22.9	-33.7	0	0	0	112.6	S269 N275 W276	S269-P272 WeakPolarHBondContact O-CD 3.43Å; P272-N275 PolarHBondContact O-N 2.81Å; P272-W276 PolarHBondContact O-N 3.38Å
273	R	86.4	Confident	82.9	Confident	69 Å²	69	60.2 Å²	60.2	26%	0.26	33%	0.334	S	S	.	.	H	α-helix	trans	-66.2	-46.4	176.4	-66.9	176.5	70.5	-161.9	3.9	111.4	D164 V167 S168 E171 L270 K271 N275 W276 I277	D164-R273 IonicContact OD1-NH1 3.91Å; D164-R273 PolarHBondContact OD1-NH1 3.28Å; D164-R273 VanDerWaalsContact OD1-NH1 3.08Å; V167-R273 HydrophobicContact CG1-CB 3.7Å; V167-R273 VanDerWaalsContact CG1-CZ 3.47Å; S168-R273 PolarHBondContact OG-NH2 2.71Å; E171-R273 VanDerWaalsContact CD-NE 3.33Å; E171-R273 WeakPolarHBondContact OE1-CB 3.35Å; E171-R273 WeakPolarHBondContact OE1-CG 3.21Å; E171-R273 IonicContact OE1-CZ 3.87Å; E171-R273 IonicContact OE1-NE 2.6Å; E171-R273 PolarHBondContact OE1-NE 2.86Å; E171-R273 IonicContact OE1-NH2 2.77Å; E171-R273 IonicContact OE2-CZ 3.74Å; E171-R273 VanDerWaalsContact OE2-CZ 3.32Å; E171-R273 IonicContact OE2-NE 2.75Å; E171-R273 PolarHBondContact OE2-NE 2.76Å; E171-R273 VanDerWaalsContact OE2-NE 3.13Å; E171-R273 IonicContact OE2-NH2 3.77Å; E171-R273 PolarHBondContact OE2-NH2 3.25Å; L270-R273 WeakPolarHBondContact O-CB 3.45Å; L270-R273 PolarHBondContact O-N 2.74Å; K271-R273 VanDerWaalsContact C-N 3.3Å; K271-R273 PolarHBondContact O-N 3.24Å; R273-N275 VanDerWaalsContact C-N 3.3Å; R273-N275 PolarHBondContact O-N 3.03Å; R273-W276 WeakPolarHBondContact O-CB 3.24Å; R273-W276 PolarHBondContact O-N 2.64Å; R273-I277 WeakPolarHBondContact O-CG1 3.1Å; R273-I277 PolarHBondContact O-N 3.46Å
274	I	85	Confident	83.3	Confident	11 Å²	11	58.1 Å²	58.1	6%	0.056	30%	0.303	C	S	.	.	H	α-helix	trans	-60.9	-39.6	175.7	-64.2	170.7	0	0	0	111.4	V167 L254 L267 L270 K271 I277 T278	V167-I274 HydrophobicContact CG2-CG1 3.93Å; L254-I274 HydrophobicContact CD1-CG1 4.44Å; L254-I274 HydrophobicContact CD2-CG1 4.31Å; L254-I274 HydrophobicContact CD2-CG2 4.19Å; L267-I274 HydrophobicContact CD1-CD1 4.05Å; L270-I274 HydrophobicContact CB-CD1 4.17Å; L270-I274 WeakPolarHBondContact O-CG1 3.33Å; L270-I274 PolarHBondContact O-N 2.81Å; K271-I274 PolarHBondContact O-N 3.34Å; I274-I277 PolarHBondContact O-N 2.92Å; I274-T278 WeakPolarHBondContact O-CB 3.41Å; I274-T278 PolarHBondContact O-N 3.12Å; I274-T278 PolarHBondContact O-OG1 3.49Å
275	N	85.8	Confident	83.5	Confident	104 Å²	104	55.8 Å²	55.8	56%	0.556	29%	0.292	S	S	*	.	H	α-helix	trans	-64	-44.3	175.2	-76.1	-8.5	0	0	0	111.4	K271 P272 R273 T278 V279	K271-N275 WeakPolarHBondContact O-CB 3.42Å; K271-N275 VanDerWaalsContact O-CG 3.31Å; K271-N275 PolarHBondContact O-N 3.27Å; P272-N275 PolarHBondContact O-N 2.81Å; R273-N275 VanDerWaalsContact C-N 3.3Å; R273-N275 PolarHBondContact O-N 3.03Å; N275-T278 PolarHBondContact O-N 2.94Å; N275-V279 WeakPolarHBondContact O-CG2 3.39Å; N275-V279 PolarHBondContact O-N 3.07Å
276	W	89.9	Confident	83.8	Confident	104 Å²	104	54.1 Å²	54.1	39%	0.394	28%	0.277	S	S	.	.	H	α-helix	trans	-59.7	-46.4	175.1	-179.9	90.7	0	0	0	111.8	E171 L174 P272 R273 T278 V279 N280	E171-W276 HydrophobicContact CB-CZ3 4.34Å; E171-W276 HydrophobicContact CG-CE3 4.06Å; E171-W276 HydrophobicContact CG-CZ3 3.97Å; L174-W276 HydrophobicContact CB-CH2 3.88Å; L174-W276 HydrophobicContact CB-CZ3 3.94Å; L174-W276 HydrophobicContact CD1-CZ3 4.05Å; P272-W276 PolarHBondContact O-N 3.38Å; R273-W276 WeakPolarHBondContact O-CB 3.24Å; R273-W276 PolarHBondContact O-N 2.64Å; W276-T278 VanDerWaalsContact C-N 3.31Å; W276-T278 PolarHBondContact O-N 3.37Å; W276-V279 PolarHBondContact O-N 3.1Å; W276-N280 VanDerWaalsContact CH2-ND2 3.28Å; W276-N280 WeakPolarHBondContact CH2-ND2 3.49Å; W276-N280 HydrophobicContact CZ2-CB 4.48Å; W276-N280 VanDerWaalsContact CZ2-ND2 3.34Å; W276-N280 WeakPolarHBondContact CZ2-ND2 3.5Å; W276-N280 VanDerWaalsContact O-CB 3.31Å; W276-N280 WeakPolarHBondContact O-CB 3.37Å; W276-N280 PolarHBondContact O-N 2.88Å
277	I	85.4	Confident	84.2	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-57	-47.1	175.8	-69.2	166.8	0	0	0	110.2	V167 L170 E171 L174 Y251 L254 R273 I274 L281	V167-I277 HydrophobicContact CB-CD1 4.19Å; V167-I277 HydrophobicContact CG1-CD1 3.77Å; V167-I277 HydrophobicContact CG2-CD1 4.4Å; L170-I277 HydrophobicContact CB-CD1 3.8Å; L170-I277 HydrophobicContact CB-CG1 4.18Å; L170-I277 HydrophobicContact CB-CG2 4.05Å; L170-I277 HydrophobicContact CD1-CD1 4.37Å; L170-I277 HydrophobicContact CD1-CG2 4.05Å; E171-I277 HydrophobicContact CG-CD1 4.12Å; E171-I277 HydrophobicContact CG-CG1 4.01Å; L174-I277 HydrophobicContact CD1-CB 4.23Å; L174-I277 HydrophobicContact CD1-CG1 4.37Å; L174-I277 HydrophobicContact CD1-CG2 3.85Å; Y251-I277 HydrophobicContact CD2-CG2 3.85Å; Y251-I277 HydrophobicContact CE2-CG2 4.12Å; L254-I277 HydrophobicContact CD2-CD1 4.28Å; L254-I277 HydrophobicContact CD2-CG2 4.38Å; R273-I277 WeakPolarHBondContact O-CG1 3.1Å; R273-I277 PolarHBondContact O-N 3.46Å; I274-I277 PolarHBondContact O-N 2.92Å; I277-L281 WeakPolarHBondContact O-CB 3.38Å; I277-L281 PolarHBondContact O-N 3.44Å
278	T	84.7	Confident	84.5	Confident	26 Å²	26	56.4 Å²	56.4	16%	0.16	28%	0.284	C	S	.	.	H	α-helix	trans	-62.4	-47.8	-178.1	-58.7	0	0	0	0	111.4	Y251 I274 N275 W276 Q282	Y251-T278 WeakPolarHBondContact CE2-OG1 3.48Å; Y251-T278 VanDerWaalsContact OH-CG2 3.26Å; Y251-T278 WeakPolarHBondContact OH-CG2 3.31Å; Y251-T278 PolarHBondContact OH-OG1 3.1Å; I274-T278 WeakPolarHBondContact O-CB 3.41Å; I274-T278 PolarHBondContact O-N 3.12Å; I274-T278 PolarHBondContact O-OG1 3.49Å; N275-T278 PolarHBondContact O-N 2.94Å; W276-T278 VanDerWaalsContact C-N 3.31Å; W276-T278 PolarHBondContact O-N 3.37Å; T278-Q282 WeakPolarHBondContact O-CB 3.26Å; T278-Q282 VanDerWaalsContact O-CG 3.22Å; T278-Q282 WeakPolarHBondContact O-CG 3.34Å; T278-Q282 PolarHBondContact O-N 3.02Å
279	V	85.2	Confident	84.8	Confident	87 Å²	87	51.8 Å²	51.8	53%	0.527	26%	0.259	S	S	.	.	H	α-helix	trans	-64.2	-47.1	179.9	172.2	0	0	0	0	111	N275 W276 Q282 E283	N275-V279 WeakPolarHBondContact O-CG2 3.39Å; N275-V279 PolarHBondContact O-N 3.07Å; W276-V279 PolarHBondContact O-N 3.1Å; V279-Q282 PolarHBondContact O-N 3.38Å; V279-E283 WeakPolarHBondContact O-CB 3.21Å; V279-E283 PolarHBondContact O-N 3.34Å
280	N	85	Confident	84.9	Confident	8 Å²	8	50.8 Å²	50.8	4%	0.043	25%	0.245	C	C	.	.	H	α-helix	trans	-69.9	-37.4	-177	-164.1	21.7	0	0	0	111.8	L174 W276 E283 Q284	L174-N280 HydrophobicContact CD1-CB 4.46Å; W276-N280 VanDerWaalsContact CH2-ND2 3.28Å; W276-N280 WeakPolarHBondContact CH2-ND2 3.49Å; W276-N280 HydrophobicContact CZ2-CB 4.48Å; W276-N280 VanDerWaalsContact CZ2-ND2 3.34Å; W276-N280 WeakPolarHBondContact CZ2-ND2 3.5Å; W276-N280 VanDerWaalsContact O-CB 3.31Å; W276-N280 WeakPolarHBondContact O-CB 3.37Å; W276-N280 PolarHBondContact O-N 2.88Å; N280-E283 PolarHBondContact O-N 3.14Å; N280-Q284 WeakPolarHBondContact O-CB 3.49Å; N280-Q284 VanDerWaalsContact O-CG 3.29Å; N280-Q284 WeakPolarHBondContact O-CG 3.37Å; N280-Q284 PolarHBondContact O-N 3.08Å
281	L	84.6	Confident	84.8	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.016	27%	0.265	C	S	.	.	H	α-helix	trans	-62.3	-44.8	172	-180	60.7	0	0	0	111.3	L174 M244 I247 Y251 I277 Q284 L285 I327	L174-L281 HydrophobicContact CD2-CB 4.46Å; L174-L281 HydrophobicContact CD2-CD1 4.45Å; M244-L281 HydrophobicContact CE-CD1 3.89Å; I247-L281 HydrophobicContact CG2-CD1 3.56Å; Y251-L281 HydrophobicContact CD1-CD2 3.62Å; Y251-L281 HydrophobicContact CD2-CD2 3.86Å; Y251-L281 HydrophobicContact CE1-CD2 4.12Å; Y251-L281 HydrophobicContact CE2-CD2 4.37Å; Y251-L281 HydrophobicContact CG-CD2 3.46Å; Y251-L281 VanDerWaalsContact CG-CD2 3.46Å; I277-L281 WeakPolarHBondContact O-CB 3.38Å; I277-L281 PolarHBondContact O-N 3.44Å; L281-Q284 PolarHBondContact O-N 3.2Å; L281-L285 HydrophobicContact CD1-CD1 3.99Å; L281-L285 HydrophobicContact CD1-CG 4.18Å; L281-L285 HydrophobicContact CG-CD1 3.89Å; L281-L285 HydrophobicContact CG-CG 4.47Å; L281-L285 WeakPolarHBondContact O-CB 3.04Å; L281-L285 VanDerWaalsContact O-CG 3.27Å; L281-L285 WeakPolarHBondContact O-CG 3.48Å; L281-L285 PolarHBondContact O-N 3.45Å; L281-I327 HydrophobicContact CD2-CD1 4.01Å
282	Q	84.2	Confident	84.6	Confident	67 Å²	67	50.5 Å²	50.5	31%	0.313	25%	0.245	S	C	.	.	H	α-helix	trans	-62.5	-43	177	-77.5	179.2	-38.9	0	0	112	T278 V279 L285 E286 D332	T278-Q282 WeakPolarHBondContact O-CB 3.26Å; T278-Q282 VanDerWaalsContact O-CG 3.22Å; T278-Q282 WeakPolarHBondContact O-CG 3.34Å; T278-Q282 PolarHBondContact O-N 3.02Å; V279-Q282 PolarHBondContact O-N 3.38Å; Q282-L285 PolarHBondContact O-N 3.36Å; Q282-E286 VanDerWaalsContact O-CB 3.23Å; Q282-E286 WeakPolarHBondContact O-CB 3.45Å; Q282-E286 PolarHBondContact O-N 3.18Å; Q282-D332 PolarHBondContact NE2-OD2 3.42Å
283	E	85.3	Confident	84.3	Confident	110 Å²	110	46.8 Å²	46.8	51%	0.514	22%	0.221	S	C	.	.	H	α-helix	trans	-62.9	-46.7	177.8	-175.2	172.7	-167.7	0	0	111.6	V279 N280 E286 I287	V279-E283 WeakPolarHBondContact O-CB 3.21Å; V279-E283 PolarHBondContact O-N 3.34Å; N280-E283 PolarHBondContact O-N 3.14Å; E283-E286 PolarHBondContact O-N 3.15Å; E283-I287 HydrophobicContact CG-CD1 4.15Å; E283-I287 VanDerWaalsContact O-CG1 3.28Å; E283-I287 WeakPolarHBondContact O-CG1 3.46Å; E283-I287 PolarHBondContact O-N 3.33Å
284	Q	82.9	Confident	84	Confident	35 Å²	35	50.4 Å²	50.4	16%	0.164	24%	0.238	C	C	.	.	H	α-helix	trans	-62.9	-43.7	176.7	-72.2	-70.7	-10.6	0	0	112.2	S177 N178 M244 N280 L281 I287 R288	S177-Q284 PolarHBondContact OG-NE2 3.25Å; N178-Q284 PolarHBondContact OD1-NE2 3.2Å; M244-Q284 HydrophobicContact CE-CB 4.26Å; N280-Q284 WeakPolarHBondContact O-CB 3.49Å; N280-Q284 VanDerWaalsContact O-CG 3.29Å; N280-Q284 WeakPolarHBondContact O-CG 3.37Å; N280-Q284 PolarHBondContact O-N 3.08Å; L281-Q284 PolarHBondContact O-N 3.2Å; Q284-I287 PolarHBondContact O-N 3.2Å; Q284-R288 WeakPolarHBondContact O-CB 3.3Å; Q284-R288 VanDerWaalsContact O-CG 3.31Å; Q284-R288 WeakPolarHBondContact O-CG 3.4Å; Q284-R288 PolarHBondContact O-N 3.04Å; Q284-R288 VanDerWaalsContact O-N 3.08Å
285	L	83.6	Confident	83.5	Confident	5 Å²	5	51.6 Å²	51.6	3%	0.026	25%	0.25	C	C	.	.	H	α-helix	trans	-64.8	-39.7	175.4	-75.1	172	0	0	0	112.1	M244 L281 Q282 R288 L289 I323 Y324 I327	M244-L285 HydrophobicContact CE-CD2 3.42Å; M244-L285 VanDerWaalsContact CE-CD2 3.42Å; M244-L285 HydrophobicContact CE-CG 3.67Å; L281-L285 HydrophobicContact CD1-CD1 3.99Å; L281-L285 HydrophobicContact CD1-CG 4.18Å; L281-L285 HydrophobicContact CG-CD1 3.89Å; L281-L285 HydrophobicContact CG-CG 4.47Å; L281-L285 WeakPolarHBondContact O-CB 3.04Å; L281-L285 VanDerWaalsContact O-CG 3.27Å; L281-L285 WeakPolarHBondContact O-CG 3.48Å; L281-L285 PolarHBondContact O-N 3.45Å; Q282-L285 PolarHBondContact O-N 3.36Å; L285-R288 PolarHBondContact O-N 3.29Å; L285-L289 VanDerWaalsContact O-CB 3.24Å; L285-L289 WeakPolarHBondContact O-CB 3.41Å; L285-L289 PolarHBondContact O-N 3.5Å; L285-I323 HydrophobicContact CD1-CG2 3.89Å; L285-I323 HydrophobicContact CD2-CB 4.2Å; L285-I323 HydrophobicContact CD2-CD1 4.34Å; L285-I323 HydrophobicContact CD2-CG2 3.52Å; L285-I323 HydrophobicContact CG-CG2 4.37Å; L285-Y324 HydrophobicContact CB-CE2 3.79Å; L285-I327 HydrophobicContact CD1-CD1 3.61Å
286	E	85	Confident	82.7	Confident	55 Å²	55	46.8 Å²	46.8	26%	0.257	23%	0.225	S	C	.	.	H	α-helix	trans	-65.6	-42.4	178.2	177.4	176	170	0	0	111.4	Q282 E283 L289 K290 Y324 L336	Q282-E286 VanDerWaalsContact O-CB 3.23Å; Q282-E286 WeakPolarHBondContact O-CB 3.45Å; Q282-E286 PolarHBondContact O-N 3.18Å; E283-E286 PolarHBondContact O-N 3.15Å; E286-L289 PolarHBondContact O-N 3.21Å; E286-K290 HydrophobicContact CG-CD 4.25Å; E286-K290 VanDerWaalsContact CG-CE 3.49Å; E286-K290 VanDerWaalsContact O-CG 3.27Å; E286-K290 WeakPolarHBondContact O-CG 3.49Å; E286-K290 PolarHBondContact O-N 3.23Å; E286-K290 WeakPolarHBondContact OE1-CE 3.35Å; E286-K290 IonicContact OE1-NZ 3.32Å; E286-K290 PolarHBondContact OE1-NZ 2.96Å; E286-Y324 WeakPolarHBondContact CA-OH 3.33Å; E286-Y324 PolarHBondContact N-OH 3.33Å; E286-L336 HydrophobicContact CB-CD1 4.19Å; E286-L336 HydrophobicContact CG-CD1 4.01Å; E286-L336 HydrophobicContact CG-CD2 3.82Å; E286-L336 WeakPolarHBondContact OE1-CD2 3.26Å
287	I	84.7	Confident	81.7	Confident	68 Å²	68	43.6 Å²	43.6	35%	0.349	22%	0.218	S	C	.	.	H	α-helix	trans	-60.1	-48.8	175.2	-68.6	164.6	0	0	0	109.9	E283 Q284 L289 K290 E291	E283-I287 HydrophobicContact CG-CD1 4.15Å; E283-I287 VanDerWaalsContact O-CG1 3.28Å; E283-I287 WeakPolarHBondContact O-CG1 3.46Å; E283-I287 PolarHBondContact O-N 3.33Å; Q284-I287 PolarHBondContact O-N 3.2Å; I287-L289 VanDerWaalsContact C-N 3.34Å; I287-L289 PolarHBondContact O-N 3.4Å; I287-K290 WeakPolarHBondContact O-CB 3.25Å; I287-K290 PolarHBondContact O-N 3Å; I287-E291 WeakPolarHBondContact O-CG 3.22Å; I287-E291 PolarHBondContact O-N 3.26Å
288	R	82.8	Confident	80.8	Confident	67 Å²	67	43.7 Å²	43.7	25%	0.253	22%	0.218	S	C	.	.	H	α-helix	trans	-63.5	-38.6	178.5	-72.5	-66.6	-174.4	177.1	-1.9	113.2	Q284 L285 E291 S292 V320	Q284-R288 WeakPolarHBondContact O-CB 3.3Å; Q284-R288 VanDerWaalsContact O-CG 3.31Å; Q284-R288 WeakPolarHBondContact O-CG 3.4Å; Q284-R288 PolarHBondContact O-N 3.04Å; Q284-R288 VanDerWaalsContact O-N 3.08Å; L285-R288 PolarHBondContact O-N 3.29Å; R288-E291 IonicContact NH1-OE2 2.84Å; R288-E291 PolarHBondContact O-N 3.04Å; R288-S292 WeakPolarHBondContact O-CB 3.42Å; R288-S292 PolarHBondContact O-N 3.44Å; R288-S292 PolarHBondContact O-OG 2.96Å; R288-V320 HydrophobicContact CB-CG2 4.03Å
289	L	84.6	Confident	79.7	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-63	-44	175.1	-171.9	73.9	0	0	0	110.8	L285 E286 I287 S292 F293 L317 V320 L321 Y324 L333 L336	L285-L289 VanDerWaalsContact O-CB 3.24Å; L285-L289 WeakPolarHBondContact O-CB 3.41Å; L285-L289 PolarHBondContact O-N 3.5Å; E286-L289 PolarHBondContact O-N 3.21Å; I287-L289 VanDerWaalsContact C-N 3.34Å; I287-L289 PolarHBondContact O-N 3.4Å; L289-S292 WeakPolarHBondContact CA-OG 3.47Å; L289-S292 PolarHBondContact O-N 3.11Å; L289-S292 PolarHBondContact O-OG 2.75Å; L289-F293 HydrophobicContact CD1-CE1 3.88Å; L289-F293 HydrophobicContact CD1-CE2 4.05Å; L289-F293 HydrophobicContact CD1-CZ 3.56Å; L289-F293 HydrophobicContact CD2-CE2 3.66Å; L289-F293 HydrophobicContact CD2-CZ 3.81Å; L289-F293 HydrophobicContact CG-CD2 4.07Å; L289-F293 HydrophobicContact CG-CE1 4.2Å; L289-F293 HydrophobicContact CG-CE2 3.47Å; L289-F293 VanDerWaalsContact CG-CE2 3.47Å; L289-F293 HydrophobicContact CG-CZ 3.54Å; L289-F293 WeakPolarHBondContact O-CB 3.44Å; L289-F293 WeakPolarHBondContact O-CD2 3.5Å; L289-F293 WeakPolarHBondContact O-CG 3.42Å; L289-F293 PolarHBondContact O-N 3.15Å; L289-L317 HydrophobicContact CD1-CD1 4.28Å; L289-V320 HydrophobicContact CB-CG1 3.94Å; L289-V320 HydrophobicContact CD1-CG1 3.73Å; L289-V320 HydrophobicContact CG-CG1 4.45Å; L289-L321 HydrophobicContact CD1-CD2 4.37Å; L289-Y324 HydrophobicContact CB-CE2 4.11Å; L289-Y324 HydrophobicContact CD1-CD2 4.47Å; L289-Y324 HydrophobicContact CD1-CE2 4.29Å; L289-Y324 HydrophobicContact CD2-CE2 4.03Å; L289-Y324 HydrophobicContact CG-CE2 4.37Å; L289-L333 HydrophobicContact CD1-CD1 3.65Å; L289-L333 HydrophobicContact CD2-CD1 3.58Å; L289-L333 HydrophobicContact CG-CD1 4.27Å; L289-L336 HydrophobicContact CD2-CB 3.8Å; L289-L336 HydrophobicContact CD2-CD1 3.88Å
290	K	83.5	Confident	78.6	Confident	57 Å²	57	44.1 Å²	44.1	25%	0.248	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-43.1	175.6	-71.5	166.2	-176.6	172.6	0	112.6	E286 I287 K294 F340	E286-K290 HydrophobicContact CG-CD 4.25Å; E286-K290 VanDerWaalsContact CG-CE 3.49Å; E286-K290 VanDerWaalsContact O-CG 3.27Å; E286-K290 WeakPolarHBondContact O-CG 3.49Å; E286-K290 PolarHBondContact O-N 3.23Å; E286-K290 WeakPolarHBondContact OE1-CE 3.35Å; E286-K290 IonicContact OE1-NZ 3.32Å; E286-K290 PolarHBondContact OE1-NZ 2.96Å; I287-K290 WeakPolarHBondContact O-CB 3.25Å; I287-K290 PolarHBondContact O-N 3Å; K290-K294 WeakPolarHBondContact O-CG 3.48Å; K290-K294 PolarHBondContact O-N 3.04Å; K290-K294 VanDerWaalsContact O-N 3.09Å; K290-F340 HydrophobicContact CD-CD1 4.42Å; K290-F340 HydrophobicContact CD-CE1 4.3Å; K290-F340 HydrophobicContact CD-CE2 4.46Å; K290-F340 HydrophobicContact CD-CZ 4.35Å; K290-F340 VanDerWaalsContact CE-CE1 3.43Å; K290-F340 HydrophobicContact CG-CD1 4.35Å; K290-F340 HydrophobicContact CG-CD2 4.23Å; K290-F340 HydrophobicContact CG-CG 4.14Å; K290-F340 VanDerWaalsContact NZ-CZ 3.32Å
291	E	82.5	Confident	77.1	Confident	97 Å²	97	48.2 Å²	48.2	45%	0.453	24%	0.242	S	C	.	.	H	α-helix	trans	-62.7	-45.4	176.8	-73.4	176.7	171.9	0	0	111.2	I287 R288 K294 A295	I287-E291 WeakPolarHBondContact O-CG 3.22Å; I287-E291 PolarHBondContact O-N 3.26Å; R288-E291 IonicContact NH1-OE2 2.84Å; R288-E291 PolarHBondContact O-N 3.04Å; E291-K294 PolarHBondContact O-N 3.28Å; E291-A295 VanDerWaalsContact O-CB 3.29Å; E291-A295 WeakPolarHBondContact O-CB 3.47Å; E291-A295 PolarHBondContact O-N 3.07Å
292	S	78.4	Confident	75.7	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-66.9	-37.8	178.8	57.1	0	0	0	0	112.7	R288 L289 A295 C296 L317	R288-S292 WeakPolarHBondContact O-CB 3.42Å; R288-S292 PolarHBondContact O-N 3.44Å; R288-S292 PolarHBondContact O-OG 2.96Å; L289-S292 WeakPolarHBondContact CA-OG 3.47Å; L289-S292 PolarHBondContact O-N 3.11Å; L289-S292 PolarHBondContact O-OG 2.75Å; S292-A295 PolarHBondContact O-N 3.07Å; S292-C296 WeakPolarHBondContact O-CB 3.29Å; S292-C296 PolarHBondContact O-N 3.03Å; S292-C296 PolarHBondContact O-SG 2.91Å; S292-L317 WeakPolarHBondContact OG-CD1 3.49Å
293	F	81.4	Confident	74.1	Confident	5 Å²	5	55.2 Å²	55.2	2%	0.022	29%	0.285	C	S	.	.	H	α-helix	trans	-61.5	-43.3	171.6	-70	-26.3	0	0	0	112.8	L289 C297 L298 L317 Y337 V341	L289-F293 HydrophobicContact CD1-CE1 3.88Å; L289-F293 HydrophobicContact CD1-CE2 4.05Å; L289-F293 HydrophobicContact CD1-CZ 3.56Å; L289-F293 HydrophobicContact CD2-CE2 3.66Å; L289-F293 HydrophobicContact CD2-CZ 3.81Å; L289-F293 HydrophobicContact CG-CD2 4.07Å; L289-F293 HydrophobicContact CG-CE1 4.2Å; L289-F293 HydrophobicContact CG-CE2 3.47Å; L289-F293 VanDerWaalsContact CG-CE2 3.47Å; L289-F293 HydrophobicContact CG-CZ 3.54Å; L289-F293 WeakPolarHBondContact O-CB 3.44Å; L289-F293 WeakPolarHBondContact O-CD2 3.5Å; L289-F293 WeakPolarHBondContact O-CG 3.42Å; L289-F293 PolarHBondContact O-N 3.15Å; F293-C297 PolarHBondContact O-N 2.93Å; F293-L298 HydrophobicContact CD1-CD1 3.8Å; F293-L298 HydrophobicContact CE1-CD1 4.4Å; F293-L298 PolarHBondContact O-N 3.18Å; F293-L298 VanDerWaalsContact O-N 3.11Å; F293-L317 HydrophobicContact CD1-CD1 3.64Å; F293-L317 HydrophobicContact CD1-CD2 4.38Å; F293-L317 HydrophobicContact CE1-CD1 3.64Å; F293-Y337 AromaticContact CE1-CD2 3.98Å; F293-Y337 HydrophobicContact CE1-CD2 3.98Å; F293-Y337 HydrophobicContact CE2-CD2 4.29Å; F293-Y337 AromaticContact CZ-CD2 3.7Å; F293-Y337 HydrophobicContact CZ-CD2 3.7Å; F293-Y337 HydrophobicContact CZ-CG 4.42Å; F293-V341 HydrophobicContact CB-CG2 3.96Å; F293-V341 HydrophobicContact CD1-CG2 4.02Å; F293-V341 HydrophobicContact CD2-CG2 3.36Å; F293-V341 HydrophobicContact CE1-CG2 4.3Å; F293-V341 HydrophobicContact CE2-CG2 3.7Å; F293-V341 HydrophobicContact CG-CG2 3.53Å; F293-V341 HydrophobicContact CZ-CG2 4.16Å
294	K	79.1	Confident	72.3	Confident	145 Å²	145	57.4 Å²	57.4	63%	0.63	30%	0.3	S	S	*	.	H	α-helix	trans	-65.8	-43.5	175.5	-73.3	176.7	-179.6	-179	0	111.7	K290 E291 C296 C297 T299	K290-K294 WeakPolarHBondContact O-CG 3.48Å; K290-K294 PolarHBondContact O-N 3.04Å; K290-K294 VanDerWaalsContact O-N 3.09Å; E291-K294 PolarHBondContact O-N 3.28Å; K294-C296 VanDerWaalsContact C-N 3.29Å; K294-C296 PolarHBondContact O-N 3.33Å; K294-C297 PolarHBondContact O-N 2.84Å; K294-T299 HydrophobicContact CG-CG2 4.38Å
295	A	74.8	Confident	70.5	Confident	36 Å²	36	59.9 Å²	59.9	30%	0.298	32%	0.318	S	S	.	.	H	α-helix	trans	-66.7	-30.1	-179.6	0	0	0	0	0	112.9	E291 S292 C297	E291-A295 VanDerWaalsContact O-CB 3.29Å; E291-A295 WeakPolarHBondContact O-CB 3.47Å; E291-A295 PolarHBondContact O-N 3.07Å; S292-A295 PolarHBondContact O-N 3.07Å; A295-C297 PolarHBondContact O-N 3.37Å
296	C	70.3	Confident	68.8	Low	4 Å²	4	67.7 Å²	67.7	3%	0.027	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	10.3	172.7	-65.3	0	0	0	0	113.5	S292 K294 L298 I309 S313 L317	S292-C296 WeakPolarHBondContact O-CB 3.29Å; S292-C296 PolarHBondContact O-N 3.03Å; S292-C296 PolarHBondContact O-SG 2.91Å; K294-C296 VanDerWaalsContact C-N 3.29Å; K294-C296 PolarHBondContact O-N 3.33Å; C296-L298 HydrophobicContact CB-CD1 4.31Å; C296-L298 HydrophobicContact CB-CG 4Å; C296-L298 PolarHBondContact O-N 3.27Å; C296-I309 HydrophobicContact CB-CG2 4.45Å; C296-I309 VanDerWaalsContact O-CD1 3.27Å; C296-I309 WeakPolarHBondContact O-CD1 3.44Å; C296-S313 VanDerWaalsContact SG-C 3.6Å; C296-S313 PolarHBondContact SG-O 2.83Å; C296-S313 VanDerWaalsContact SG-O 3.33Å; C296-L317 HydrophobicContact CB-CD2 4.15Å
297	C	68.9	Low	67.3	Low	36 Å²	36	68 Å²	68	24%	0.243	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	18.5	-178.7	-61.1	0	0	0	0	115	F293 K294 A295 T299 V300	F293-C297 PolarHBondContact O-N 2.93Å; K294-C297 PolarHBondContact O-N 2.84Å; A295-C297 PolarHBondContact O-N 3.37Å; C297-T299 PolarHBondContact O-N 3.49Å; C297-T299 VanDerWaalsContact O-N 3.11Å; C297-V300 HydrophobicContact CB-CG2 4.35Å; C297-V300 PolarHBondContact O-N 3.32Å
298	L	65.8	Low	66.1	Low	3 Å²	3	71 Å²	71	2%	0.016	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-19.4	-178.9	-64.9	177.6	0	0	0	112.2	F293 C296 L317 V341 Q345 Q384 Y387	F293-L298 HydrophobicContact CD1-CD1 3.8Å; F293-L298 HydrophobicContact CE1-CD1 4.4Å; F293-L298 PolarHBondContact O-N 3.18Å; F293-L298 VanDerWaalsContact O-N 3.11Å; C296-L298 HydrophobicContact CB-CD1 4.31Å; C296-L298 HydrophobicContact CB-CG 4Å; C296-L298 PolarHBondContact O-N 3.27Å; L298-L317 HydrophobicContact CD1-CD2 3.84Å; L298-V341 HydrophobicContact CB-CG1 3.83Å; L298-V341 WeakPolarHBondContact O-CG1 3.26Å; L298-Q345 PolarHBondContact O-NE2 3.46Å; L298-Q345 VanDerWaalsContact O-NE2 3.09Å; L298-Q384 PolarHBondContact O-NE2 3.5Å; L298-Y387 VanDerWaalsContact CD2-CB 3.45Å; L298-Y387 HydrophobicContact CD2-CD2 3.98Å; L298-Y387 HydrophobicContact CD2-CG 3.92Å
299	T	60.2	Low	65.3	Low	46 Å²	46	69.1 Å²	69.1	28%	0.282	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-9.6	177.9	60.4	0	0	0	0	113.8	K294 C297 Q345	K294-T299 HydrophobicContact CG-CG2 4.38Å; C297-T299 PolarHBondContact O-N 3.49Å; C297-T299 VanDerWaalsContact O-N 3.11Å; T299-Q345 PolarHBondContact O-NE2 2.94Å
300	V	62.6	Low	64.6	Low	76 Å²	76	72.7 Å²	72.7	46%	0.461	41%	0.407	S	S	.	.			trans	-92.2	133.9	-172.5	-177.3	0	0	0	0	111.4	C297	C297-V300 HydrophobicContact CB-CG2 4.35Å; C297-V300 PolarHBondContact O-N 3.32Å
301	I	54.8	Low	64	Low	94 Å²	94	77.3 Å²	77.3	48%	0.482	43%	0.427	S	S	.	.			trans	-82	-21.3	-171	-64.8	167.7	0	0	0	112.7	T303 Q345	I301-T303 PolarHBondContact O-N 3.39Å; I301-Q345 HydrophobicContact CG1-CG 4.18Å
302	D	54.1	Low	63.6	Low	117 Å²	117	77.5 Å²	77.5	63%	0.626	43%	0.427	S	S	*	.			trans	-88.8	103.8	-169.5	-73.5	-30.9	0	0	0	112.9	N304	D302-N304 PolarHBondContact O-N 3.05Å; D302-N304 VanDerWaalsContact O-N 3.15Å
303	T	50.7	Low	63.4	Low	99 Å²	99	77.9 Å²	77.9	61%	0.607	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	8	172.6	43	0	0	0	0	114.1	I301	I301-T303 PolarHBondContact O-N 3.39Å
304	N	46.8	Very low	63	Low	157 Å²	157	78.6 Å²	78.6	84%	0.84	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	14.5	-172.7	-92.8	3.2	0	0	0	114.6	D302	D302-N304 PolarHBondContact O-N 3.05Å; D302-N304 VanDerWaalsContact O-N 3.15Å
305	V	46.5	Very low	62.8	Low	87 Å²	87	76.6 Å²	76.6	53%	0.527	43%	0.427	S	S	.	.	S	Bend	trans	-119.3	121.9	172.8	-167.8	0	0	0	0	107.8	C307	V305-C307 WeakPolarHBondContact CG1-SG 3.45Å; V305-C307 PolarHBondContact O-N 3.19Å
306	D	48.2	Very low	62.9	Low	169 Å²	169	77.5 Å²	77.5	90%	0.904	43%	0.425	S	S	*	.			trans	-63.1	71.1	162.7	-74.8	-36.3	0	0	0	108.5	T308	D306-T308 PolarHBondContact O-N 3.4Å; D306-T308 VanDerWaalsContact O-N 3.14Å
307	C	53.2	Low	63.3	Low	60 Å²	60	77.3 Å²	77.3	41%	0.405	42%	0.424	S	S	.	.			trans	-78.8	97.6	175.8	-82.6	0	0	0	0	107.5	V305 I309	V305-C307 WeakPolarHBondContact CG1-SG 3.45Å; V305-C307 PolarHBondContact O-N 3.19Å; C307-I309 PolarHBondContact O-N 3.14Å
308	T	59.9	Low	63.7	Low	133 Å²	133	78.9 Å²	78.9	82%	0.816	42%	0.424	S	S	*	.			trans	-63.8	101.3	164.2	52.9	0	0	0	0	108.2	D306	D306-T308 PolarHBondContact O-N 3.4Å; D306-T308 VanDerWaalsContact O-N 3.14Å
309	I	65.1	Low	64.3	Low	27 Å²	27	80.8 Å²	80.8	14%	0.138	43%	0.433	C	S	.	.			trans	-64.7	129.7	175.2	-60	170.3	0	0	0	107.9	C296 C307 K311 I314 Y387	C296-I309 HydrophobicContact CB-CG2 4.45Å; C296-I309 VanDerWaalsContact O-CD1 3.27Å; C296-I309 WeakPolarHBondContact O-CD1 3.44Å; C307-I309 PolarHBondContact O-N 3.14Å; I309-K311 PolarHBondContact O-N 2.93Å; I309-I314 HydrophobicContact CB-CD1 4.27Å; I309-I314 HydrophobicContact CB-CG1 4.43Å; I309-I314 HydrophobicContact CG2-CD1 4.11Å; I309-I314 HydrophobicContact CG2-CG1 3.75Å; I309-Y387 HydrophobicContact CD1-CD1 3.39Å; I309-Y387 HydrophobicContact CD1-CE1 3.44Å; I309-Y387 VanDerWaalsContact CD1-CE1 3.44Å; I309-Y387 HydrophobicContact CD1-CG 4.42Å; I309-Y387 HydrophobicContact CG1-CE1 4.38Å
310	P	69.3	Low	65.3	Low	76 Å²	76	79.2 Å²	79.2	49%	0.494	42%	0.423	S	S	.	.			trans	-58	130.4	174.9	-19.7	30	0	0	0	110.3	H312 S313 I314	P310-H312 PolarHBondContact O-N 3.47Å; P310-H312 VanDerWaalsContact O-N 3.12Å; P310-S313 WeakPolarHBondContact O-CB 3.33Å; P310-S313 PolarHBondContact O-N 2.9Å; P310-I314 PolarHBondContact O-N 2.85Å
311	K	71.1	Confident	66.2	Low	154 Å²	154	75.7 Å²	75.7	67%	0.67	40%	0.402	S	S	*	.	H	α-helix	trans	-50.8	-39.3	177.9	-71	-174.4	175.9	-175.5	0	112.6	I309 S313 I314 E315	I309-K311 PolarHBondContact O-N 2.93Å; K311-S313 VanDerWaalsContact C-N 3.3Å; K311-S313 PolarHBondContact O-N 2.9Å; K311-I314 WeakPolarHBondContact O-CB 3.36Å; K311-I314 PolarHBondContact O-N 3.1Å; K311-I314 VanDerWaalsContact O-N 3.13Å; K311-E315 WeakPolarHBondContact O-CG 3.28Å; K311-E315 PolarHBondContact O-N 3.29Å
312	H	74.2	Confident	67.3	Low	101 Å²	101	73 Å²	73	47%	0.468	39%	0.392	S	S	.	.	H	α-helix	trans	-57.7	-38.4	175.9	179.8	-92.7	0	0	0	113.2	P310 E315 Q316	P310-H312 PolarHBondContact O-N 3.47Å; P310-H312 VanDerWaalsContact O-N 3.12Å; H312-E315 PolarHBondContact O-N 3.41Å; H312-Q316 VanDerWaalsContact CE1-CD 3.4Å; H312-Q316 PolarHBondContact CE1-NE2 2.74Å; H312-Q316 WeakPolarHBondContact O-CB 3.39Å; H312-Q316 VanDerWaalsContact O-CG 3.27Å; H312-Q316 WeakPolarHBondContact O-CG 2.95Å; H312-Q316 PolarHBondContact O-N 2.92Å
313	S	75.2	Confident	68.6	Low	11 Å²	11	67.6 Å²	67.6	8%	0.077	36%	0.363	C	S	.	.	H	α-helix	trans	-67.2	-37.8	177.1	-54.8	0	0	0	0	111.9	C296 P310 K311 Q316 L317	C296-S313 VanDerWaalsContact SG-C 3.6Å; C296-S313 PolarHBondContact SG-O 2.83Å; C296-S313 VanDerWaalsContact SG-O 3.33Å; P310-S313 WeakPolarHBondContact O-CB 3.33Å; P310-S313 PolarHBondContact O-N 2.9Å; K311-S313 VanDerWaalsContact C-N 3.3Å; K311-S313 PolarHBondContact O-N 2.9Å; S313-Q316 PolarHBondContact O-N 3.29Å; S313-L317 PolarHBondContact O-N 3.27Å
314	I	73.1	Confident	70.1	Confident	20 Å²	20	63.3 Å²	63.3	10%	0.103	34%	0.336	C	S	.	.	H	α-helix	trans	-66.7	-44.1	176	-61.9	165.6	0	0	0	109.8	I309 P310 K311 L317 R318 Q391 I392	I309-I314 HydrophobicContact CB-CD1 4.27Å; I309-I314 HydrophobicContact CB-CG1 4.43Å; I309-I314 HydrophobicContact CG2-CD1 4.11Å; I309-I314 HydrophobicContact CG2-CG1 3.75Å; P310-I314 PolarHBondContact O-N 2.85Å; K311-I314 WeakPolarHBondContact O-CB 3.36Å; K311-I314 PolarHBondContact O-N 3.1Å; K311-I314 VanDerWaalsContact O-N 3.13Å; I314-L317 PolarHBondContact O-N 3.2Å; I314-R318 VanDerWaalsContact O-CB 3.3Å; I314-R318 WeakPolarHBondContact O-CB 3.34Å; I314-R318 PolarHBondContact O-N 3.02Å; I314-Q391 HydrophobicContact CD1-CB 4.09Å; I314-Q391 WeakPolarHBondContact CG2-O 3.4Å; I314-I392 HydrophobicContact CG2-CG1 4.49Å
315	E	73.9	Confident	71.7	Confident	103 Å²	103	57 Å²	57	48%	0.481	30%	0.302	S	S	.	.	H	α-helix	trans	-62.1	-42.2	176.6	-73.9	167.2	-165.9	0	0	111.8	K311 H312 R318 Q319	K311-E315 WeakPolarHBondContact O-CG 3.28Å; K311-E315 PolarHBondContact O-N 3.29Å; H312-E315 PolarHBondContact O-N 3.41Å; E315-R318 PolarHBondContact O-N 3.08Å; E315-Q319 WeakPolarHBondContact O-CB 3.46Å; E315-Q319 PolarHBondContact O-N 3.14Å
316	Q	76.6	Confident	73.3	Confident	54 Å²	54	55.2 Å²	55.2	25%	0.252	30%	0.296	S	S	.	.	H	α-helix	trans	-60.7	-47.4	173.5	-77.2	-177.2	-25.5	0	0	112.1	H312 S313 R318 Q319 V320	H312-Q316 VanDerWaalsContact CE1-CD 3.4Å; H312-Q316 PolarHBondContact CE1-NE2 2.74Å; H312-Q316 WeakPolarHBondContact O-CB 3.39Å; H312-Q316 VanDerWaalsContact O-CG 3.27Å; H312-Q316 WeakPolarHBondContact O-CG 2.95Å; H312-Q316 PolarHBondContact O-N 2.92Å; S313-Q316 PolarHBondContact O-N 3.29Å; Q316-R318 VanDerWaalsContact C-N 3.33Å; Q316-R318 PolarHBondContact O-N 3.33Å; Q316-Q319 PolarHBondContact O-N 3.11Å; Q316-V320 VanDerWaalsContact O-CG2 3.28Å; Q316-V320 WeakPolarHBondContact O-CG2 3.45Å; Q316-V320 PolarHBondContact O-N 3.27Å
317	L	79.6	Confident	74.9	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-61.8	-44.2	177.3	-179.4	56	0	0	0	110.9	L289 S292 F293 C296 L298 S313 I314 Q319 V320 L321 I392	L289-L317 HydrophobicContact CD1-CD1 4.28Å; S292-L317 WeakPolarHBondContact OG-CD1 3.49Å; F293-L317 HydrophobicContact CD1-CD1 3.64Å; F293-L317 HydrophobicContact CD1-CD2 4.38Å; F293-L317 HydrophobicContact CE1-CD1 3.64Å; C296-L317 HydrophobicContact CB-CD2 4.15Å; L298-L317 HydrophobicContact CD1-CD2 3.84Å; S313-L317 PolarHBondContact O-N 3.27Å; I314-L317 PolarHBondContact O-N 3.2Å; L317-Q319 VanDerWaalsContact C-N 3.33Å; L317-Q319 PolarHBondContact O-N 3.01Å; L317-V320 PolarHBondContact O-N 2.95Å; L317-L321 HydrophobicContact CD1-CD1 4.11Å; L317-L321 HydrophobicContact CD1-CG 4.05Å; L317-L321 HydrophobicContact CG-CD1 3.92Å; L317-L321 HydrophobicContact CG-CG 4.32Å; L317-L321 WeakPolarHBondContact O-CB 3.43Å; L317-L321 WeakPolarHBondContact O-CG 3.46Å; L317-L321 PolarHBondContact O-N 3.42Å; L317-I392 HydrophobicContact CD2-CD1 3.37Å; L317-I392 HydrophobicContact CD2-CG1 4.35Å; L317-I392 HydrophobicContact CG-CD1 4.08Å
318	R	77.8	Confident	76.2	Confident	69 Å²	69	50.9 Å²	50.9	26%	0.26	27%	0.269	S	S	.	.	H	α-helix	trans	-59.5	-44.3	177.7	-166.3	-177.7	65.7	178.3	-1.7	111.8	I314 E315 Q316 L321 S322 I392 Y395 L403	I314-R318 VanDerWaalsContact O-CB 3.3Å; I314-R318 WeakPolarHBondContact O-CB 3.34Å; I314-R318 PolarHBondContact O-N 3.02Å; E315-R318 PolarHBondContact O-N 3.08Å; Q316-R318 VanDerWaalsContact C-N 3.33Å; Q316-R318 PolarHBondContact O-N 3.33Å; R318-L321 PolarHBondContact O-N 3.49Å; R318-S322 VanDerWaalsContact O-CB 3.31Å; R318-S322 WeakPolarHBondContact O-CB 3.18Å; R318-S322 PolarHBondContact O-N 3.1Å; R318-I392 HydrophobicContact CG-CG2 4.49Å; R318-Y395 PolarHBondContact NH1-O 2.84Å; R318-L403 HydrophobicContact CG-CD1 3.46Å; R318-L403 VanDerWaalsContact CG-CD1 3.46Å
319	Q	77.6	Confident	77.2	Confident	42 Å²	42	47.4 Å²	47.4	20%	0.196	24%	0.242	C	C	.	.	H	α-helix	trans	-63.5	-48.6	177.5	-175.2	174.4	35.5	0	0	111.1	G241 D245 E315 Q316 L317 L321 S322 I323	G241-Q319 PolarHBondContact O-NE2 3.08Å; G241-Q319 VanDerWaalsContact O-NE2 3.09Å; D245-Q319 PolarHBondContact OD2-NE2 3.1Å; E315-Q319 WeakPolarHBondContact O-CB 3.46Å; E315-Q319 PolarHBondContact O-N 3.14Å; Q316-Q319 PolarHBondContact O-N 3.11Å; L317-Q319 VanDerWaalsContact C-N 3.33Å; L317-Q319 PolarHBondContact O-N 3.01Å; Q319-L321 PolarHBondContact O-N 3.31Å; Q319-S322 WeakPolarHBondContact O-CB 3.35Å; Q319-S322 PolarHBondContact O-N 3.5Å; Q319-I323 HydrophobicContact CG-CD1 4.12Å; Q319-I323 VanDerWaalsContact O-CG1 3.29Å; Q319-I323 WeakPolarHBondContact O-CG1 3.48Å; Q319-I323 PolarHBondContact O-N 3.46Å
320	V	80.6	Confident	78.1	Confident	13 Å²	13	48.5 Å²	48.5	8%	0.079	25%	0.248	C	C	.	.	H	α-helix	trans	-61.8	-43.5	178.1	177.5	0	0	0	0	111.1	R288 L289 Q316 L317 S322 I323 Y324	R288-V320 HydrophobicContact CB-CG2 4.03Å; L289-V320 HydrophobicContact CB-CG1 3.94Å; L289-V320 HydrophobicContact CD1-CG1 3.73Å; L289-V320 HydrophobicContact CG-CG1 4.45Å; Q316-V320 VanDerWaalsContact O-CG2 3.28Å; Q316-V320 WeakPolarHBondContact O-CG2 3.45Å; Q316-V320 PolarHBondContact O-N 3.27Å; L317-V320 PolarHBondContact O-N 2.95Å; V320-S322 PolarHBondContact O-N 3.06Å; V320-I323 PolarHBondContact O-N 3.27Å; V320-Y324 HydrophobicContact CG1-CD2 3.92Å; V320-Y324 HydrophobicContact CG1-CE2 3.91Å; V320-Y324 WeakPolarHBondContact O-CD2 3.45Å; V320-Y324 PolarHBondContact O-N 3.02Å
321	L	81.4	Confident	78.7	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-59.9	-45.6	174.4	-70.6	171.5	0	0	0	111.6	L289 L317 R318 Q319 I323 Y324 L325 L333 I392 L403 F406	L289-L321 HydrophobicContact CD1-CD2 4.37Å; L317-L321 HydrophobicContact CD1-CD1 4.11Å; L317-L321 HydrophobicContact CD1-CG 4.05Å; L317-L321 HydrophobicContact CG-CD1 3.92Å; L317-L321 HydrophobicContact CG-CG 4.32Å; L317-L321 WeakPolarHBondContact O-CB 3.43Å; L317-L321 WeakPolarHBondContact O-CG 3.46Å; L317-L321 PolarHBondContact O-N 3.42Å; R318-L321 PolarHBondContact O-N 3.49Å; Q319-L321 PolarHBondContact O-N 3.31Å; L321-I323 VanDerWaalsContact C-N 3.28Å; L321-I323 PolarHBondContact O-N 3.43Å; L321-Y324 PolarHBondContact O-N 3.33Å; L321-L325 VanDerWaalsContact O-CG 3.25Å; L321-L325 WeakPolarHBondContact O-CG 3.39Å; L321-L325 PolarHBondContact O-N 2.91Å; L321-L333 HydrophobicContact CD2-CD1 3.66Å; L321-L333 HydrophobicContact CD2-CD2 3.61Å; L321-L333 HydrophobicContact CD2-CG 4.16Å; L321-I392 HydrophobicContact CD1-CD1 4.37Å; L321-I392 HydrophobicContact CD1-CG2 4.08Å; L321-L403 HydrophobicContact CB-CD2 3.54Å; L321-L403 HydrophobicContact CD1-CD2 4.25Å; L321-F406 HydrophobicContact CD2-CD2 4.44Å; L321-F406 HydrophobicContact CD2-CE2 4.45Å
322	S	79.5	Confident	79.4	Confident	38 Å²	38	43 Å²	43	27%	0.266	23%	0.228	S	C	.	.	H	α-helix	trans	-60	-38.7	176.2	-171	0	0	0	0	111.9	R318 Q319 V320 L325 A326	R318-S322 VanDerWaalsContact O-CB 3.31Å; R318-S322 WeakPolarHBondContact O-CB 3.18Å; R318-S322 PolarHBondContact O-N 3.1Å; Q319-S322 WeakPolarHBondContact O-CB 3.35Å; Q319-S322 PolarHBondContact O-N 3.5Å; V320-S322 PolarHBondContact O-N 3.06Å; S322-L325 PolarHBondContact O-N 2.9Å; S322-A326 VanDerWaalsContact O-CB 3.26Å; S322-A326 WeakPolarHBondContact O-CB 3.46Å; S322-A326 PolarHBondContact O-N 3.47Å
323	I	80.6	Confident	79.9	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-65.2	-46.4	175.7	-67.8	162	0	0	0	110.9	M244 D245 A248 L285 Q319 V320 L321 L325 A326 I327	M244-I323 HydrophobicContact CB-CD1 3.8Å; D245-I323 WeakPolarHBondContact OD1-CD1 3.45Å; D245-I323 WeakPolarHBondContact OD1-CG1 3.44Å; A248-I323 HydrophobicContact CB-CB 4.44Å; A248-I323 HydrophobicContact CB-CG1 4.29Å; A248-I323 HydrophobicContact CB-CG2 3.55Å; L285-I323 HydrophobicContact CD1-CG2 3.89Å; L285-I323 HydrophobicContact CD2-CB 4.2Å; L285-I323 HydrophobicContact CD2-CD1 4.34Å; L285-I323 HydrophobicContact CD2-CG2 3.52Å; L285-I323 HydrophobicContact CG-CG2 4.37Å; Q319-I323 HydrophobicContact CG-CD1 4.12Å; Q319-I323 VanDerWaalsContact O-CG1 3.29Å; Q319-I323 WeakPolarHBondContact O-CG1 3.48Å; Q319-I323 PolarHBondContact O-N 3.46Å; V320-I323 PolarHBondContact O-N 3.27Å; L321-I323 VanDerWaalsContact C-N 3.28Å; L321-I323 PolarHBondContact O-N 3.43Å; I323-L325 VanDerWaalsContact C-N 3.27Å; I323-L325 PolarHBondContact O-N 3.45Å; I323-A326 PolarHBondContact O-N 3.25Å; I323-I327 HydrophobicContact CG2-CD1 3.44Å; I323-I327 VanDerWaalsContact CG2-CD1 3.44Å; I323-I327 HydrophobicContact CG2-CG1 4.26Å; I323-I327 WeakPolarHBondContact O-CB 3.42Å; I323-I327 VanDerWaalsContact O-CG1 3.23Å; I323-I327 WeakPolarHBondContact O-CG1 3.34Å; I323-I327 PolarHBondContact O-N 2.95Å
324	Y	82.8	Confident	80.5	Confident	9 Å²	9	38.8 Å²	38.8	4%	0.035	21%	0.208	C	C	.	.	H	α-helix	trans	-59.1	-39.5	176.6	-92.9	-81.9	0	0	0	112.5	L285 E286 L289 V320 L321 D328 K329 L333 L336	L285-Y324 HydrophobicContact CB-CE2 3.79Å; E286-Y324 WeakPolarHBondContact CA-OH 3.33Å; E286-Y324 PolarHBondContact N-OH 3.33Å; L289-Y324 HydrophobicContact CB-CE2 4.11Å; L289-Y324 HydrophobicContact CD1-CD2 4.47Å; L289-Y324 HydrophobicContact CD1-CE2 4.29Å; L289-Y324 HydrophobicContact CD2-CE2 4.03Å; L289-Y324 HydrophobicContact CG-CE2 4.37Å; V320-Y324 HydrophobicContact CG1-CD2 3.92Å; V320-Y324 HydrophobicContact CG1-CE2 3.91Å; V320-Y324 WeakPolarHBondContact O-CD2 3.45Å; V320-Y324 PolarHBondContact O-N 3.02Å; L321-Y324 PolarHBondContact O-N 3.33Å; Y324-D328 PolarHBondContact O-N 3.2Å; Y324-K329 HydrophobicContact CD1-CB 4.14Å; Y324-K329 PolarHBondContact O-N 2.89Å; Y324-L333 HydrophobicContact CD1-CB 3.86Å; Y324-L333 HydrophobicContact CD2-CD1 4.12Å; Y324-L333 HydrophobicContact CE1-CB 4.45Å; Y324-L333 HydrophobicContact CG-CB 4.04Å; Y324-L333 HydrophobicContact CG-CD1 4.16Å; Y324-L333 HydrophobicContact CG-CG 4.46Å; Y324-L336 HydrophobicContact CE1-CD1 4.31Å; Y324-L336 WeakPolarHBondContact OH-CD1 3.26Å
325	L	79.6	Confident	81.1	Confident	24 Å²	24	42.5 Å²	42.5	13%	0.126	23%	0.227	C	C	.	.	H	α-helix	trans	-70.3	-42.5	177.4	-67.2	166.7	0	0	0	111.5	L321 S322 I323 I327 D328 L330 P402 L403 D405	L321-L325 VanDerWaalsContact O-CG 3.25Å; L321-L325 WeakPolarHBondContact O-CG 3.39Å; L321-L325 PolarHBondContact O-N 2.91Å; S322-L325 PolarHBondContact O-N 2.9Å; I323-L325 VanDerWaalsContact C-N 3.27Å; I323-L325 PolarHBondContact O-N 3.45Å; L325-I327 VanDerWaalsContact C-N 3.28Å; L325-I327 PolarHBondContact O-N 3.25Å; L325-D328 PolarHBondContact O-N 3.19Å; L325-L330 HydrophobicContact CD2-CB 4.38Å; L325-L330 HydrophobicContact CD2-CD1 3.77Å; L325-L330 HydrophobicContact CD2-CG 4.28Å; L325-P402 WeakPolarHBondContact CD1-O 3.48Å; L325-L403 HydrophobicContact CD1-CD2 3.77Å; L325-L403 HydrophobicContact CD1-CG 4.41Å; L325-D405 HydrophobicContact CD2-CB 4.27Å
326	A	80	Confident	81.7	Confident	50 Å²	50	38.5 Å²	38.5	41%	0.413	21%	0.208	S	C	.	.	H	α-helix	trans	-64.1	-32.7	176.7	0	0	0	0	0	112.6	I252 S322 I323 D328	I252-A326 HydrophobicContact CD1-CB 3.76Å; I252-A326 WeakPolarHBondContact CD1-O 3.42Å; I252-A326 WeakPolarHBondContact CG1-O 3.35Å; S322-A326 VanDerWaalsContact O-CB 3.26Å; S322-A326 WeakPolarHBondContact O-CB 3.46Å; S322-A326 PolarHBondContact O-N 3.47Å; I323-A326 PolarHBondContact O-N 3.25Å; A326-D328 PolarHBondContact O-N 2.85Å
327	I	81	Confident	82.2	Confident	9 Å²	9	36 Å²	36	5%	0.046	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-0.6	176.4	-60.5	167	0	0	0	112.2	A248 Y251 L281 L285 I323 L325 K329	A248-I327 HydrophobicContact CB-CD1 3.97Å; A248-I327 HydrophobicContact CB-CG1 4.19Å; Y251-I327 HydrophobicContact CD1-CD1 4.45Å; Y251-I327 HydrophobicContact CD1-CG1 4.21Å; Y251-I327 HydrophobicContact CD1-CG2 3.67Å; Y251-I327 HydrophobicContact CE1-CG2 3.48Å; Y251-I327 VanDerWaalsContact CE1-CG2 3.48Å; L281-I327 HydrophobicContact CD2-CD1 4.01Å; L285-I327 HydrophobicContact CD1-CD1 3.61Å; I323-I327 HydrophobicContact CG2-CD1 3.44Å; I323-I327 VanDerWaalsContact CG2-CD1 3.44Å; I323-I327 HydrophobicContact CG2-CG1 4.26Å; I323-I327 WeakPolarHBondContact O-CB 3.42Å; I323-I327 VanDerWaalsContact O-CG1 3.23Å; I323-I327 WeakPolarHBondContact O-CG1 3.34Å; I323-I327 PolarHBondContact O-N 2.95Å; L325-I327 VanDerWaalsContact C-N 3.28Å; L325-I327 PolarHBondContact O-N 3.25Å; I327-K329 VanDerWaalsContact C-N 3.33Å; I327-K329 HydrophobicContact CG2-CG 3.85Å; I327-K329 PolarHBondContact O-N 3.45Å
328	D	80.7	Confident	82.6	Confident	129 Å²	129	38.4 Å²	38.4	69%	0.69	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	41.5	-178.9	-164.6	24.7	0	0	0	112.4	Y324 L325 A326	Y324-D328 PolarHBondContact O-N 3.2Å; L325-D328 PolarHBondContact O-N 3.19Å; A326-D328 PolarHBondContact O-N 2.85Å
329	K	82.1	Confident	83.1	Confident	59 Å²	59	41.2 Å²	41.2	26%	0.257	22%	0.22	S	C	.	.			trans	-119	39.4	-177.6	-72	-60.2	-150.3	147.5	0	113	Y324 I327 S331 D332 L333	Y324-K329 HydrophobicContact CD1-CB 4.14Å; Y324-K329 PolarHBondContact O-N 2.89Å; I327-K329 VanDerWaalsContact C-N 3.33Å; I327-K329 HydrophobicContact CG2-CG 3.85Å; I327-K329 PolarHBondContact O-N 3.45Å; K329-S331 VanDerWaalsContact C-N 3.32Å; K329-S331 PolarHBondContact O-N 3.48Å; K329-D332 HydrophobicContact CB-CB 4.49Å; K329-D332 WeakPolarHBondContact CD-OD2 3.4Å; K329-D332 WeakPolarHBondContact CE-OD2 3.27Å; K329-D332 IonicContact NZ-OD2 3.75Å; K329-D332 PolarHBondContact NZ-OD2 3.31Å; K329-D332 PolarHBondContact O-N 3.29Å; K329-L333 PolarHBondContact O-N 2.98Å; K329-L333 VanDerWaalsContact O-N 3.1Å
330	L	82.5	Confident	83.4	Confident	51 Å²	51	42.4 Å²	42.4	27%	0.267	22%	0.224	S	C	.	.	H	α-helix	trans	-60	-38.7	179.8	-174.7	154.3	0	0	0	112.7	L325 D332 L333 L334 D405	L325-L330 HydrophobicContact CD2-CB 4.38Å; L325-L330 HydrophobicContact CD2-CD1 3.77Å; L325-L330 HydrophobicContact CD2-CG 4.28Å; L330-D332 PolarHBondContact O-N 3Å; L330-L333 WeakPolarHBondContact O-CB 3.33Å; L330-L333 PolarHBondContact O-N 3.43Å; L330-L334 HydrophobicContact CD2-CD1 3.45Å; L330-L334 VanDerWaalsContact CD2-CD1 3.45Å; L330-L334 HydrophobicContact CD2-CG 4.03Å; L330-L334 WeakPolarHBondContact O-CG 3.25Å; L330-L334 PolarHBondContact O-N 3.27Å; L330-D405 HydrophobicContact CD1-CB 3.7Å; L330-D405 WeakPolarHBondContact CD1-O 3.3Å
331	S	83.8	Confident	83.5	Confident	70 Å²	70	41.8 Å²	41.8	49%	0.49	22%	0.221	S	C	.	.	H	α-helix	trans	-60.5	-45.2	177.5	57.9	0	0	0	0	112.4	K329 L334 I335	K329-S331 VanDerWaalsContact C-N 3.32Å; K329-S331 PolarHBondContact O-N 3.48Å; S331-L334 PolarHBondContact O-N 3.04Å; S331-I335 VanDerWaalsContact O-CG1 3.28Å; S331-I335 WeakPolarHBondContact O-CG1 3.32Å; S331-I335 PolarHBondContact O-N 2.93Å
332	D	84.7	Confident	83.7	Confident	45 Å²	45	41.7 Å²	41.7	24%	0.241	22%	0.22	C	C	.	.	H	α-helix	trans	-67.4	-42.3	-178.4	-61.8	-8.3	0	0	0	109.1	Q282 K329 L330 L334 I335 L336	Q282-D332 PolarHBondContact NE2-OD2 3.42Å; K329-D332 HydrophobicContact CB-CB 4.49Å; K329-D332 WeakPolarHBondContact CD-OD2 3.4Å; K329-D332 WeakPolarHBondContact CE-OD2 3.27Å; K329-D332 IonicContact NZ-OD2 3.75Å; K329-D332 PolarHBondContact NZ-OD2 3.31Å; K329-D332 PolarHBondContact O-N 3.29Å; L330-D332 PolarHBondContact O-N 3Å; D332-L334 PolarHBondContact O-N 2.86Å; D332-I335 PolarHBondContact O-N 3.06Å; D332-L336 VanDerWaalsContact O-CG 3.25Å; D332-L336 WeakPolarHBondContact O-CG 3.31Å; D332-L336 PolarHBondContact O-N 3.21Å
333	L	85.8	Confident	84.1	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.9	-47.7	173.6	172.7	63.8	0	0	0	112.3	L289 L321 Y324 K329 L330 L336 Y337 F406	L289-L333 HydrophobicContact CD1-CD1 3.65Å; L289-L333 HydrophobicContact CD2-CD1 3.58Å; L289-L333 HydrophobicContact CG-CD1 4.27Å; L321-L333 HydrophobicContact CD2-CD1 3.66Å; L321-L333 HydrophobicContact CD2-CD2 3.61Å; L321-L333 HydrophobicContact CD2-CG 4.16Å; Y324-L333 HydrophobicContact CD1-CB 3.86Å; Y324-L333 HydrophobicContact CD2-CD1 4.12Å; Y324-L333 HydrophobicContact CE1-CB 4.45Å; Y324-L333 HydrophobicContact CG-CB 4.04Å; Y324-L333 HydrophobicContact CG-CD1 4.16Å; Y324-L333 HydrophobicContact CG-CG 4.46Å; K329-L333 PolarHBondContact O-N 2.98Å; K329-L333 VanDerWaalsContact O-N 3.1Å; L330-L333 WeakPolarHBondContact O-CB 3.33Å; L330-L333 PolarHBondContact O-N 3.43Å; L333-L336 PolarHBondContact O-N 3.06Å; L333-Y337 WeakPolarHBondContact O-CB 3.39Å; L333-Y337 PolarHBondContact O-N 3.4Å; L333-F406 HydrophobicContact CD2-CD2 3.59Å; L333-F406 HydrophobicContact CD2-CE2 3.95Å; L333-F406 HydrophobicContact CD2-CG 4.5Å; L333-F406 HydrophobicContact CG-CD2 4.09Å; L333-F406 HydrophobicContact CG-CE2 3.95Å
334	L	85.9	Confident	84.3	Confident	23 Å²	23	47.7 Å²	47.7	12%	0.12	25%	0.247	C	C	.	.	H	α-helix	trans	-65	-39.3	178.7	-74	176.4	0	0	0	112.1	L330 S331 D332 L336 Y337 R338 F406	L330-L334 HydrophobicContact CD2-CD1 3.45Å; L330-L334 VanDerWaalsContact CD2-CD1 3.45Å; L330-L334 HydrophobicContact CD2-CG 4.03Å; L330-L334 WeakPolarHBondContact O-CG 3.25Å; L330-L334 PolarHBondContact O-N 3.27Å; S331-L334 PolarHBondContact O-N 3.04Å; D332-L334 PolarHBondContact O-N 2.86Å; L334-L336 VanDerWaalsContact C-N 3.34Å; L334-Y337 PolarHBondContact O-N 3.36Å; L334-R338 WeakPolarHBondContact O-CB 3.49Å; L334-R338 VanDerWaalsContact O-CG 3.23Å; L334-R338 WeakPolarHBondContact O-CG 3.31Å; L334-R338 PolarHBondContact O-N 3.33Å; L334-F406 HydrophobicContact CD2-CD2 3.95Å; L334-F406 HydrophobicContact CD2-CE2 3.66Å
335	I	87.4	Confident	84.4	Confident	98 Å²	98	47.8 Å²	47.8	50%	0.503	25%	0.247	S	C	.	.	H	α-helix	trans	-62.2	-44.2	175.1	-68.6	164	0	0	0	110.5	S331 D332 R338 K339	S331-I335 VanDerWaalsContact O-CG1 3.28Å; S331-I335 WeakPolarHBondContact O-CG1 3.32Å; S331-I335 PolarHBondContact O-N 2.93Å; D332-I335 PolarHBondContact O-N 3.06Å; I335-R338 PolarHBondContact O-N 3.47Å; I335-K339 VanDerWaalsContact O-CB 3.28Å; I335-K339 WeakPolarHBondContact O-CB 3.48Å; I335-K339 PolarHBondContact O-N 3.23Å
336	L	86.3	Confident	84.8	Confident	19 Å²	19	46.6 Å²	46.6	10%	0.099	24%	0.241	C	C	.	.	H	α-helix	trans	-65	-43.3	176.8	-67.4	173.6	0	0	0	111.4	E286 L289 Y324 D332 L333 L334 K339 F340	E286-L336 HydrophobicContact CB-CD1 4.19Å; E286-L336 HydrophobicContact CG-CD1 4.01Å; E286-L336 HydrophobicContact CG-CD2 3.82Å; E286-L336 WeakPolarHBondContact OE1-CD2 3.26Å; L289-L336 HydrophobicContact CD2-CB 3.8Å; L289-L336 HydrophobicContact CD2-CD1 3.88Å; Y324-L336 HydrophobicContact CE1-CD1 4.31Å; Y324-L336 WeakPolarHBondContact OH-CD1 3.26Å; D332-L336 VanDerWaalsContact O-CG 3.25Å; D332-L336 WeakPolarHBondContact O-CG 3.31Å; D332-L336 PolarHBondContact O-N 3.21Å; L333-L336 PolarHBondContact O-N 3.06Å; L334-L336 VanDerWaalsContact C-N 3.34Å; L336-K339 PolarHBondContact O-N 3.48Å; L336-F340 HydrophobicContact CB-CD2 4.28Å; L336-F340 HydrophobicContact CD2-CD2 3.98Å; L336-F340 HydrophobicContact CD2-CE2 3.55Å; L336-F340 WeakPolarHBondContact O-CB 3.35Å; L336-F340 VanDerWaalsContact O-CD2 3.3Å; L336-F340 WeakPolarHBondContact O-CD2 3.21Å; L336-F340 PolarHBondContact O-N 3.46Å
337	Y	86.3	Confident	85.2	Confident	1 Å²	1	45.6 Å²	45.6	0%	0.004	23%	0.231	C	C	.	.	H	α-helix	trans	-58.7	-49	175.4	178.6	-109.7	0	0	0	111.4	F293 L333 L334 K339 V341 L342 Q384 F406 C408	F293-Y337 AromaticContact CE1-CD2 3.98Å; F293-Y337 HydrophobicContact CE1-CD2 3.98Å; F293-Y337 HydrophobicContact CE2-CD2 4.29Å; F293-Y337 AromaticContact CZ-CD2 3.7Å; F293-Y337 HydrophobicContact CZ-CD2 3.7Å; F293-Y337 HydrophobicContact CZ-CG 4.42Å; L333-Y337 WeakPolarHBondContact O-CB 3.39Å; L333-Y337 PolarHBondContact O-N 3.4Å; L334-Y337 PolarHBondContact O-N 3.36Å; Y337-K339 PolarHBondContact O-N 3.23Å; Y337-V341 HydrophobicContact CD2-CB 3.91Å; Y337-V341 HydrophobicContact CD2-CG1 4.37Å; Y337-V341 HydrophobicContact CD2-CG2 3.66Å; Y337-V341 HydrophobicContact CE2-CB 3.85Å; Y337-V341 HydrophobicContact CE2-CG1 3.8Å; Y337-V341 HydrophobicContact CE2-CG2 3.89Å; Y337-V341 WeakPolarHBondContact O-CA 3.42Å; Y337-V341 VanDerWaalsContact O-CB 3.25Å; Y337-V341 WeakPolarHBondContact O-CB 3.5Å; Y337-V341 PolarHBondContact O-N 2.94Å; Y337-L342 HydrophobicContact CD1-CD1 3.85Å; Y337-L342 HydrophobicContact CD1-CG 4.39Å; Y337-L342 HydrophobicContact CE1-CD1 3.46Å; Y337-L342 VanDerWaalsContact CE1-CD1 3.46Å; Y337-L342 HydrophobicContact CE1-CD2 4.42Å; Y337-L342 HydrophobicContact CE1-CG 3.92Å; Y337-L342 PolarHBondContact O-N 3.5Å; Y337-Q384 PolarHBondContact OH-OE1 2.85Å; Y337-F406 HydrophobicContact CD1-CZ 4.07Å; Y337-F406 HydrophobicContact CD2-CZ 4.01Å; Y337-F406 HydrophobicContact CE1-CZ 4.38Å; Y337-F406 HydrophobicContact CE2-CZ 4.34Å; Y337-F406 HydrophobicContact CG-CE2 4.42Å; Y337-F406 AromaticContact CG-CZ 3.88Å; Y337-F406 HydrophobicContact CG-CZ 3.88Å; Y337-C408 HydrophobicContact CE1-CB 4.02Å
338	R	89.1	Confident	85.5	Confident	52 Å²	52	49.1 Å²	49.1	20%	0.196	25%	0.247	C	C	.	.	I	π-helix	trans	-56.1	-51.5	174.6	-74.3	175.1	57.5	179.9	1.8	111.7	L334 I335 L342 H343 E416 D419	L334-R338 WeakPolarHBondContact O-CB 3.49Å; L334-R338 VanDerWaalsContact O-CG 3.23Å; L334-R338 WeakPolarHBondContact O-CG 3.31Å; L334-R338 PolarHBondContact O-N 3.33Å; I335-R338 PolarHBondContact O-N 3.47Å; R338-L342 PolarHBondContact O-N 2.98Å; R338-H343 VanDerWaalsContact O-CB 3.28Å; R338-H343 WeakPolarHBondContact O-CB 3.23Å; R338-H343 PolarHBondContact O-N 3.28Å; R338-E416 HydrophobicContact CB-CB 4.49Å; R338-E416 HydrophobicContact CG-CB 4.21Å; R338-E416 IonicContact CZ-OE2 3.62Å; R338-E416 VanDerWaalsContact CZ-OE2 3.25Å; R338-E416 IonicContact NE-OE2 3.5Å; R338-E416 PolarHBondContact NE-OE2 2.95Å; R338-E416 IonicContact NH2-OE2 3.91Å; R338-E416 PolarHBondContact NH2-OE2 2.65Å; R338-D419 IonicContact CZ-OD2 3.98Å; R338-D419 IonicContact NH1-OD2 2.76Å; R338-D419 IonicContact NH2-OD2 3.05Å; R338-D419 PolarHBondContact NH2-OD2 3.06Å
339	K	87.8	Confident	85.9	Confident	127 Å²	127	43.3 Å²	43.3	55%	0.552	22%	0.216	S	C	*	.	I	π-helix	trans	-67.9	-41.2	-175.1	-177.2	176.9	177.1	-178.5	0	113.9	I335 L336 Y337 H343	I335-K339 VanDerWaalsContact O-CB 3.28Å; I335-K339 WeakPolarHBondContact O-CB 3.48Å; I335-K339 PolarHBondContact O-N 3.23Å; L336-K339 PolarHBondContact O-N 3.48Å; Y337-K339 PolarHBondContact O-N 3.23Å; K339-H343 WeakPolarHBondContact O-CB 3.47Å
340	F	83	Confident	86.2	Confident	67 Å²	67	40.5 Å²	40.5	29%	0.294	20%	0.204	S	C	.	.	I	π-helix	trans	-100.6	-24	-169.9	-68.4	-68.4	0	0	0	114.3	K290 L336	K290-F340 HydrophobicContact CD-CD1 4.42Å; K290-F340 HydrophobicContact CD-CE1 4.3Å; K290-F340 HydrophobicContact CD-CE2 4.46Å; K290-F340 HydrophobicContact CD-CZ 4.35Å; K290-F340 VanDerWaalsContact CE-CE1 3.43Å; K290-F340 HydrophobicContact CG-CD1 4.35Å; K290-F340 HydrophobicContact CG-CD2 4.23Å; K290-F340 HydrophobicContact CG-CG 4.14Å; K290-F340 VanDerWaalsContact NZ-CZ 3.32Å; L336-F340 HydrophobicContact CB-CD2 4.28Å; L336-F340 HydrophobicContact CD2-CD2 3.98Å; L336-F340 HydrophobicContact CD2-CE2 3.55Å; L336-F340 WeakPolarHBondContact O-CB 3.35Å; L336-F340 VanDerWaalsContact O-CD2 3.3Å; L336-F340 WeakPolarHBondContact O-CD2 3.21Å; L336-F340 PolarHBondContact O-N 3.46Å
341	V	82.6	Confident	86.5	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.006	21%	0.206	C	C	.	.	I	π-helix	trans	-102.7	-54.3	179.5	-176.1	0	0	0	0	110.7	F293 L298 Y337	F293-V341 HydrophobicContact CB-CG2 3.96Å; F293-V341 HydrophobicContact CD1-CG2 4.02Å; F293-V341 HydrophobicContact CD2-CG2 3.36Å; F293-V341 HydrophobicContact CE1-CG2 4.3Å; F293-V341 HydrophobicContact CE2-CG2 3.7Å; F293-V341 HydrophobicContact CG-CG2 3.53Å; F293-V341 HydrophobicContact CZ-CG2 4.16Å; L298-V341 HydrophobicContact CB-CG1 3.83Å; L298-V341 WeakPolarHBondContact O-CG1 3.26Å; Y337-V341 HydrophobicContact CD2-CB 3.91Å; Y337-V341 HydrophobicContact CD2-CG1 4.37Å; Y337-V341 HydrophobicContact CD2-CG2 3.66Å; Y337-V341 HydrophobicContact CE2-CB 3.85Å; Y337-V341 HydrophobicContact CE2-CG1 3.8Å; Y337-V341 HydrophobicContact CE2-CG2 3.89Å; Y337-V341 WeakPolarHBondContact O-CA 3.42Å; Y337-V341 VanDerWaalsContact O-CB 3.25Å; Y337-V341 WeakPolarHBondContact O-CB 3.5Å; Y337-V341 PolarHBondContact O-N 2.94Å
342	L	86.3	Confident	86.6	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.209	C	C	.	.	I	π-helix	trans	-88.5	-38.7	-168.1	-63.6	172.5	0	0	0	113.6	Y337 R338 D344 Q345 L346 V380 Q384 G412 F413 E416	Y337-L342 HydrophobicContact CD1-CD1 3.85Å; Y337-L342 HydrophobicContact CD1-CG 4.39Å; Y337-L342 HydrophobicContact CE1-CD1 3.46Å; Y337-L342 VanDerWaalsContact CE1-CD1 3.46Å; Y337-L342 HydrophobicContact CE1-CD2 4.42Å; Y337-L342 HydrophobicContact CE1-CG 3.92Å; Y337-L342 PolarHBondContact O-N 3.5Å; R338-L342 PolarHBondContact O-N 2.98Å; L342-D344 PolarHBondContact O-N 3.25Å; L342-Q345 PolarHBondContact O-N 3.48Å; L342-L346 HydrophobicContact CB-CD1 4.1Å; L342-L346 WeakPolarHBondContact O-CB 3.49Å; L342-L346 WeakPolarHBondContact O-CG 3.24Å; L342-L346 PolarHBondContact O-N 3.39Å; L342-V380 HydrophobicContact CD2-CG1 4.42Å; L342-Q384 HydrophobicContact CD2-CG 3.95Å; L342-G412 VanDerWaalsContact CD1-C 3.42Å; L342-F413 HydrophobicContact CD1-CB 4.37Å; L342-E416 HydrophobicContact CB-CG 4.26Å
343	H	88.1	Confident	86.6	Confident	79 Å²	79	42.9 Å²	42.9	37%	0.366	21%	0.212	S	C	.	.	H	α-helix	trans	-59.6	-46.8	-168.7	-177.5	74.6	0	0	0	112.8	R338 K339 Q345 S347 E416	R338-H343 VanDerWaalsContact O-CB 3.28Å; R338-H343 WeakPolarHBondContact O-CB 3.23Å; R338-H343 PolarHBondContact O-N 3.28Å; K339-H343 WeakPolarHBondContact O-CB 3.47Å; H343-Q345 PolarHBondContact O-N 3.1Å; H343-S347 WeakPolarHBondContact O-CA 3.35Å; H343-S347 WeakPolarHBondContact O-CB 2.95Å; H343-S347 PolarHBondContact O-N 2.91Å; H343-S347 PolarHBondContact O-OG 3.01Å; H343-E416 IonicContact CE1-OE1 3.82Å; H343-E416 IonicContact CG-OE1 2.68Å; H343-E416 IonicContact ND1-OE1 3.08Å; H343-E416 PolarHBondContact ND1-OE1 3.28Å
344	D	85.4	Confident	86.3	Confident	89 Å²	89	46.3 Å²	46.3	48%	0.476	23%	0.234	S	C	.	.	H	α-helix	trans	-62.7	-45.1	179	-174.5	40.3	0	0	0	111.2	L342 S347 Q348	L342-D344 PolarHBondContact O-N 3.25Å; D344-S347 PolarHBondContact O-OG 3.3Å; D344-S347 VanDerWaalsContact O-OG 3.11Å; D344-Q348 VanDerWaalsContact CG-NE2 3.31Å; D344-Q348 WeakPolarHBondContact O-CG 3.4Å; D344-Q348 PolarHBondContact O-N 2.94Å; D344-Q348 PolarHBondContact OD1-NE2 2.85Å; D344-Q348 PolarHBondContact OD2-NE2 3.42Å
345	Q	83.9	Confident	86.3	Confident	10 Å²	10	47.6 Å²	47.6	5%	0.047	24%	0.24	C	C	.	.	H	α-helix	trans	-64.8	-46.6	179.5	-61.2	-176.4	-4.8	0	0	112.2	L298 T299 I301 L342 H343 I349 V380	L298-Q345 PolarHBondContact O-NE2 3.46Å; L298-Q345 VanDerWaalsContact O-NE2 3.09Å; T299-Q345 PolarHBondContact O-NE2 2.94Å; I301-Q345 HydrophobicContact CG1-CG 4.18Å; L342-Q345 PolarHBondContact O-N 3.48Å; H343-Q345 PolarHBondContact O-N 3.1Å; Q345-I349 WeakPolarHBondContact O-CD1 3.46Å; Q345-I349 VanDerWaalsContact O-CG1 3.3Å; Q345-I349 WeakPolarHBondContact O-CG1 3.49Å; Q345-I349 PolarHBondContact O-N 3.05Å; Q345-V380 HydrophobicContact CB-CG1 4.44Å; Q345-V380 HydrophobicContact CB-CG2 4.43Å; Q345-V380 VanDerWaalsContact OE1-CG1 3.24Å
346	L	88.7	Confident	86	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-75.9	-35.2	-177.1	-68.2	-179.5	0	0	0	112.5	L342 Q348 I349 F350 A377 V380 F413 E416 T417 L420	L342-L346 HydrophobicContact CB-CD1 4.1Å; L342-L346 WeakPolarHBondContact O-CB 3.49Å; L342-L346 WeakPolarHBondContact O-CG 3.24Å; L342-L346 PolarHBondContact O-N 3.39Å; L346-Q348 VanDerWaalsContact C-N 3.34Å; L346-Q348 PolarHBondContact O-N 3.33Å; L346-I349 HydrophobicContact CD2-CD1 4.32Å; L346-I349 WeakPolarHBondContact O-CB 3.34Å; L346-I349 PolarHBondContact O-N 3.24Å; L346-I349 VanDerWaalsContact O-N 3.11Å; L346-F350 HydrophobicContact CB-CD2 4.43Å; L346-F350 HydrophobicContact CD2-CE2 4.22Å; L346-F350 WeakPolarHBondContact O-CD2 3.43Å; L346-F350 PolarHBondContact O-N 3.45Å; L346-A377 HydrophobicContact CD2-CB 4.16Å; L346-V380 HydrophobicContact CD2-CG1 4.44Å; L346-F413 HydrophobicContact CD1-CD2 4.3Å; L346-F413 HydrophobicContact CD1-CE2 4.49Å; L346-F413 HydrophobicContact CD2-CD2 4.44Å; L346-F413 HydrophobicContact CD2-CE2 3.92Å; L346-E416 HydrophobicContact CD1-CB 4.03Å; L346-E416 HydrophobicContact CD1-CG 3.9Å; L346-T417 WeakPolarHBondContact CD1-OG1 3.11Å; L346-L420 HydrophobicContact CB-CD1 3.37Å
347	S	87.7	Confident	85.7	Confident	29 Å²	29	44.3 Å²	44.3	20%	0.203	23%	0.225	C	C	.	.	H	α-helix	trans	-66.7	-35.7	177.4	63.8	0	0	0	0	111.9	H343 D344 I349 F350 T351	H343-S347 WeakPolarHBondContact O-CA 3.35Å; H343-S347 WeakPolarHBondContact O-CB 2.95Å; H343-S347 PolarHBondContact O-N 2.91Å; H343-S347 PolarHBondContact O-OG 3.01Å; D344-S347 PolarHBondContact O-OG 3.3Å; D344-S347 VanDerWaalsContact O-OG 3.11Å; S347-I349 VanDerWaalsContact C-N 3.26Å; S347-I349 PolarHBondContact O-N 2.83Å; S347-F350 CarbonylContact O-C 3.58Å; S347-T351 WeakPolarHBondContact O-CG2 3.35Å; S347-T351 PolarHBondContact O-N 3.37Å
348	Q	87.6	Confident	85.3	Confident	82 Å²	82	50 Å²	50	38%	0.383	25%	0.251	S	S	.	.	H	α-helix	trans	-65.9	-29	171.4	-69.9	174.4	30.7	0	0	112.6	D344 L346	D344-Q348 VanDerWaalsContact CG-NE2 3.31Å; D344-Q348 WeakPolarHBondContact O-CG 3.4Å; D344-Q348 PolarHBondContact O-N 2.94Å; D344-Q348 PolarHBondContact OD1-NE2 2.85Å; D344-Q348 PolarHBondContact OD2-NE2 3.42Å; L346-Q348 VanDerWaalsContact C-N 3.34Å; L346-Q348 PolarHBondContact O-N 3.33Å
349	I	88.1	Confident	84.3	Confident	7 Å²	7	49 Å²	49	4%	0.036	26%	0.255	C	S	.	.	H	α-helix	trans	-77.7	-54.8	176.2	-67.2	165.4	0	0	0	110.3	Q345 L346 S347 T351 M373 R376 A377 V380	Q345-I349 WeakPolarHBondContact O-CD1 3.46Å; Q345-I349 VanDerWaalsContact O-CG1 3.3Å; Q345-I349 WeakPolarHBondContact O-CG1 3.49Å; Q345-I349 PolarHBondContact O-N 3.05Å; L346-I349 HydrophobicContact CD2-CD1 4.32Å; L346-I349 WeakPolarHBondContact O-CB 3.34Å; L346-I349 PolarHBondContact O-N 3.24Å; L346-I349 VanDerWaalsContact O-N 3.11Å; S347-I349 VanDerWaalsContact C-N 3.26Å; S347-I349 PolarHBondContact O-N 2.83Å; I349-T351 PolarHBondContact O-N 2.9Å; I349-T351 VanDerWaalsContact O-N 3.08Å; I349-M373 HydrophobicContact CG2-CB 4.11Å; I349-M373 HydrophobicContact CG2-CG 4.45Å; I349-M373 VanDerWaalsContact CG2-O 3.25Å; I349-M373 WeakPolarHBondContact CG2-O 3.38Å; I349-M373 WeakPolarHBondContact O-CE 3.18Å; I349-R376 HydrophobicContact CD1-CB 4.04Å; I349-R376 HydrophobicContact CG1-CB 4.11Å; I349-R376 HydrophobicContact CG2-CB 4.07Å; I349-A377 HydrophobicContact CG2-CB 4.47Å; I349-V380 HydrophobicContact CD1-CG2 3.68Å
350	F	90	Very high	83.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.264	C	S	.	.	S	Bend	trans	-86.9	49.7	-178	-61.6	-67.2	0	0	0	112.2	L346 S347 M373 Y374 A377 T417 L420 I421 N424 L425	L346-F350 HydrophobicContact CB-CD2 4.43Å; L346-F350 HydrophobicContact CD2-CE2 4.22Å; L346-F350 WeakPolarHBondContact O-CD2 3.43Å; L346-F350 PolarHBondContact O-N 3.45Å; S347-F350 CarbonylContact O-C 3.58Å; F350-M373 HydrophobicContact CD1-CB 4.21Å; F350-M373 HydrophobicContact CD1-SD 4.4Å; F350-M373 HydrophobicContact CE1-CB 4.02Å; F350-Y374 AromaticContact CE1-CD1 3.91Å; F350-Y374 HydrophobicContact CE1-CD1 3.91Å; F350-Y374 AromaticContact CE1-CE1 3.99Å; F350-Y374 HydrophobicContact CE1-CE1 3.99Å; F350-Y374 HydrophobicContact CZ-CD1 4.11Å; F350-Y374 HydrophobicContact CZ-CE1 4.37Å; F350-A377 HydrophobicContact CE2-CB 3.92Å; F350-A377 HydrophobicContact CZ-CB 3.73Å; F350-T417 HydrophobicContact CE2-CG2 3.6Å; F350-T417 HydrophobicContact CZ-CG2 3.7Å; F350-L420 HydrophobicContact CB-CB 4.23Å; F350-L420 HydrophobicContact CD2-CB 4.28Å; F350-I421 HydrophobicContact CD1-CD1 4.48Å; F350-I421 HydrophobicContact CD1-CG1 3.74Å; F350-I421 HydrophobicContact CD2-CG1 4.45Å; F350-I421 HydrophobicContact CE1-CD1 3.92Å; F350-I421 HydrophobicContact CE1-CG1 3.68Å; F350-I421 HydrophobicContact CE2-CG1 4.4Å; F350-I421 HydrophobicContact CG-CG1 4.14Å; F350-I421 HydrophobicContact CZ-CD1 3.95Å; F350-I421 HydrophobicContact CZ-CG1 4.03Å; F350-N424 WeakPolarHBondContact O-CB 3.46Å; F350-N424 PolarHBondContact O-ND2 3.04Å; F350-L425 HydrophobicContact CD1-CD1 3.97Å
351	T	87.7	Confident	82.8	Confident	51 Å²	51	44.5 Å²	44.5	31%	0.313	26%	0.259	S	S	.	.			trans	-74	138	173.3	39.8	0	0	0	0	110.7	S347 I349 R353 M373	S347-T351 WeakPolarHBondContact O-CG2 3.35Å; S347-T351 PolarHBondContact O-N 3.37Å; I349-T351 PolarHBondContact O-N 2.9Å; I349-T351 VanDerWaalsContact O-N 3.08Å; T351-R353 PolarHBondContact O-N 3.39Å; T351-R353 VanDerWaalsContact O-N 3.1Å; T351-M373 WeakPolarHBondContact O-CE 3.46Å
352	P	85.7	Confident	82.9	Confident	84 Å²	84	49.4 Å²	49.4	55%	0.545	29%	0.285	S	S	.	.			trans	-58	118.1	173.7	-21.2	30.7	0	0	0	110.2	T357 N424	P352-T357 HydrophobicContact CB-CG2 3.98Å; P352-N424 HydrophobicContact CG-CB 4.13Å
353	R	84.9	Confident	82.9	Confident	81 Å²	81	52.8 Å²	52.8	31%	0.306	30%	0.302	S	S	.	.			trans	-117.9	134.4	-177.5	-86	-170.9	-173.5	-163.9	-1.4	109.2	T351 E355 L356 T357 T369 M373	T351-R353 PolarHBondContact O-N 3.39Å; T351-R353 VanDerWaalsContact O-N 3.1Å; R353-E355 VanDerWaalsContact CB-OE2 3.3Å; R353-E355 WeakPolarHBondContact CB-OE2 3.5Å; R353-E355 PolarHBondContact O-N 2.93Å; R353-L356 PolarHBondContact O-N 3.3Å; R353-T357 PolarHBondContact O-N 3.11Å; R353-T357 PolarHBondContact O-OG1 2.73Å; R353-T369 HydrophobicContact CB-CG2 4.47Å; R353-M373 HydrophobicContact CG-CE 4.18Å
354	P	81	Confident	82.9	Confident	72 Å²	72	52.2 Å²	52.2	47%	0.468	31%	0.311	S	S	.	.	H	α-helix	trans	-55.7	-30.3	-175.4	22.3	-32.5	0	0	0	112.7	L356 T357 H358	P354-L356 PolarHBondContact O-N 3.47Å; P354-T357 WeakPolarHBondContact CA-OG1 3.33Å; P354-H358 WeakPolarHBondContact O-CB 3.48Å; P354-H358 PolarHBondContact O-CD2 3.41Å; P354-H358 PolarHBondContact O-N 3.47Å
355	E	84.3	Confident	83.1	Confident	51 Å²	51	51.5 Å²	51.5	24%	0.238	31%	0.307	C	S	.	.	H	α-helix	trans	-62.7	-28.3	175.9	-55.7	80.2	-175.2	0	0	112.7	R353 S361 L365 A366 R436	R353-E355 VanDerWaalsContact CB-OE2 3.3Å; R353-E355 WeakPolarHBondContact CB-OE2 3.5Å; R353-E355 PolarHBondContact O-N 2.93Å; E355-S361 WeakPolarHBondContact O-CB 3.3Å; E355-S361 PolarHBondContact O-OG 3.04Å; E355-L365 HydrophobicContact CB-CD2 4.49Å; E355-L365 HydrophobicContact CG-CD2 3.48Å; E355-L365 VanDerWaalsContact CG-CD2 3.48Å; E355-L365 HydrophobicContact CG-CG 3.85Å; E355-A366 WeakPolarHBondContact O-CB 3.15Å; E355-R436 PolarHBondContact O-NH2 3.37Å
356	L	81.1	Confident	83.3	Confident	0 Å²	0	51 Å²	51	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-106.7	-23.3	-178.8	-67.4	173.7	0	0	0	113.2	R353 P354 A366 T369 L370 M373 L425 E427 I428 R436 L440	R353-L356 PolarHBondContact O-N 3.3Å; P354-L356 PolarHBondContact O-N 3.47Å; L356-A366 HydrophobicContact CD2-CB 4.15Å; L356-A366 WeakPolarHBondContact CD2-O 3.49Å; L356-T369 HydrophobicContact CD1-CG2 3.87Å; L356-T369 HydrophobicContact CG-CG2 4.26Å; L356-L370 HydrophobicContact CD1-CB 4.37Å; L356-L370 HydrophobicContact CD1-CD1 4.37Å; L356-L370 HydrophobicContact CD2-CB 4.1Å; L356-M373 HydrophobicContact CD1-CE 4.26Å; L356-M373 HydrophobicContact CD1-SD 3.52Å; L356-M373 VanDerWaalsContact CD1-SD 3.52Å; L356-L425 HydrophobicContact CB-CD2 4.03Å; L356-L425 HydrophobicContact CD1-CD1 4.34Å; L356-L425 HydrophobicContact CD1-CD2 4.1Å; L356-E427 WeakPolarHBondContact O-CB 3.34Å; L356-I428 HydrophobicContact CB-CG2 4.32Å; L356-I428 HydrophobicContact CD2-CG2 4.12Å; L356-R436 VanDerWaalsContact C-NH2 3.28Å; L356-R436 PolarHBondContact O-NH2 2.86Å; L356-L440 HydrophobicContact CD2-CD2 4.11Å
357	T	80.5	Confident	83.4	Confident	47 Å²	47	51.8 Å²	51.8	29%	0.288	31%	0.311	S	S	.	.	H	α-helix	trans	-93.5	-20.5	-179.6	59.3	0	0	0	0	114	P352 R353 P354 E427	P352-T357 HydrophobicContact CB-CG2 3.98Å; R353-T357 PolarHBondContact O-N 3.11Å; R353-T357 PolarHBondContact O-OG1 2.73Å; P354-T357 WeakPolarHBondContact CA-OG1 3.33Å; T357-E427 WeakPolarHBondContact O-CG 3.42Å
358	H	77.7	Confident	83.6	Confident	121 Å²	121	56.9 Å²	56.9	56%	0.56	33%	0.331	S	S	*	.	S	Bend	trans	-98.4	122.8	172.6	-66.3	-69.7	0	0	0	110.4	P354 G360 S361 R436	P354-H358 WeakPolarHBondContact O-CB 3.48Å; P354-H358 PolarHBondContact O-CD2 3.41Å; P354-H358 PolarHBondContact O-N 3.47Å; H358-G360 PolarHBondContact O-N 3.03Å; H358-G360 VanDerWaalsContact O-N 3.14Å; H358-S361 PolarHBondContact O-N 2.75Å; H358-S361 PolarHBondContact O-OG 3.29Å; H358-S361 VanDerWaalsContact O-OG 3.07Å; H358-R436 PolarHBondContact O-NH2 3.44Å
359	A	67.4	Low	83.8	Confident	32 Å²	32	53.5 Å²	53.5	26%	0.264	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.9	-177.8	0	0	0	0	0	114	H433	A359-H433 PolarHBondContact O-CE1 3.43Å; A359-H433 PolarHBondContact O-ND1 3.46Å
360	G	67.4	Low	84	Confident	73 Å²	73	53.2 Å²	53.2	75%	0.753	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	15.4	-179.3	0	0	0	0	0	115.6	H358	H358-G360 PolarHBondContact O-N 3.03Å; H358-G360 VanDerWaalsContact O-N 3.14Å
361	S	72.1	Confident	84.1	Confident	26 Å²	26	57.1 Å²	57.1	18%	0.182	34%	0.336	C	S	.	.	S	Bend	trans	-69.9	160.6	174.8	58.9	0	0	0	0	112.4	E355 H358 I363	E355-S361 WeakPolarHBondContact O-CB 3.3Å; E355-S361 PolarHBondContact O-OG 3.04Å; H358-S361 PolarHBondContact O-N 2.75Å; H358-S361 PolarHBondContact O-OG 3.29Å; H358-S361 VanDerWaalsContact O-OG 3.07Å; S361-I363 PolarHBondContact O-N 3.37Å
362	D	85.1	Confident	84.3	Confident	104 Å²	104	57.3 Å²	57.3	56%	0.556	34%	0.339	S	S	*	.			trans	-57.9	125.4	174.2	-174	-22.5	0	0	0	110.6	A364 L365 A366	D362-A364 VanDerWaalsContact C-N 3.29Å; D362-A364 PolarHBondContact O-N 2.74Å; D362-A364 PolarHBondContact OD1-N 3.44Å; D362-L365 HydrophobicContact CB-CB 3.95Å; D362-L365 PolarHBondContact O-N 3.07Å; D362-A366 WeakPolarHBondContact O-CB 3.24Å; D362-A366 PolarHBondContact O-N 3.28Å
363	I	86.4	Confident	84.7	Confident	71 Å²	71	53.3 Å²	53.3	36%	0.364	31%	0.313	S	S	.	.	H	α-helix	trans	-56.9	-43.9	-178.4	-59.1	165.6	0	0	0	110.7	S361 A367 D435 R436	S361-I363 PolarHBondContact O-N 3.37Å; I363-A367 VanDerWaalsContact O-CB 3.29Å; I363-A367 WeakPolarHBondContact O-CB 3.27Å; I363-A367 PolarHBondContact O-N 3.34Å; I363-D435 HydrophobicContact CD1-CB 3.83Å; I363-R436 HydrophobicContact CG1-CB 4.38Å
364	A	88.6	Confident	85.1	Confident	66 Å²	66	49.6 Å²	49.6	55%	0.545	30%	0.299	S	S	.	.	H	α-helix	trans	-68.4	-43.3	-177.1	0	0	0	0	0	111.1	D362 A367 E368	D362-A364 VanDerWaalsContact C-N 3.29Å; D362-A364 PolarHBondContact O-N 2.74Å; D362-A364 PolarHBondContact OD1-N 3.44Å; A364-A367 PolarHBondContact O-N 3.48Å; A364-E368 WeakPolarHBondContact O-CB 3.37Å; A364-E368 PolarHBondContact O-N 2.95Å
365	L	89	Confident	85.7	Confident	75 Å²	75	49.2 Å²	49.2	39%	0.393	30%	0.296	S	S	.	.	H	α-helix	trans	-66.9	-39.7	178.8	-169.9	69.2	0	0	0	111.8	E355 D362 T369	E355-L365 HydrophobicContact CB-CD2 4.49Å; E355-L365 HydrophobicContact CG-CD2 3.48Å; E355-L365 VanDerWaalsContact CG-CD2 3.48Å; E355-L365 HydrophobicContact CG-CG 3.85Å; D362-L365 HydrophobicContact CB-CB 3.95Å; D362-L365 PolarHBondContact O-N 3.07Å; L365-T369 VanDerWaalsContact O-CB 3.23Å; L365-T369 WeakPolarHBondContact O-CB 3.34Å; L365-T369 PolarHBondContact O-N 2.9Å; L365-T369 PolarHBondContact O-OG1 3.47Å
366	A	88.9	Confident	86	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.1	-46.8	174.4	0	0	0	0	0	111.2	E355 L356 D362 T369 L370 L440	E355-A366 WeakPolarHBondContact O-CB 3.15Å; L356-A366 HydrophobicContact CD2-CB 4.15Å; L356-A366 WeakPolarHBondContact CD2-O 3.49Å; D362-A366 WeakPolarHBondContact O-CB 3.24Å; D362-A366 PolarHBondContact O-N 3.28Å; A366-T369 PolarHBondContact O-N 3.49Å; A366-L370 WeakPolarHBondContact O-CB 3.47Å; A366-L370 PolarHBondContact O-N 3.16Å; A366-L440 HydrophobicContact CB-CD2 4.34Å
367	A	90.1	Very high	86.5	Confident	16 Å²	16	51.3 Å²	51.3	13%	0.132	30%	0.302	C	S	.	.	H	α-helix	trans	-59.9	-49	176.4	0	0	0	0	0	112.2	I363 A364 T369 L370 N371 I443	I363-A367 VanDerWaalsContact O-CB 3.29Å; I363-A367 WeakPolarHBondContact O-CB 3.27Å; I363-A367 PolarHBondContact O-N 3.34Å; A364-A367 PolarHBondContact O-N 3.48Å; A367-T369 VanDerWaalsContact C-N 3.35Å; A367-T369 PolarHBondContact O-N 3.38Å; A367-L370 PolarHBondContact O-N 3.2Å; A367-N371 VanDerWaalsContact O-CB 3.32Å; A367-N371 WeakPolarHBondContact O-CB 3.48Å; A367-N371 PolarHBondContact O-N 3.2Å; A367-I443 HydrophobicContact CB-CD1 3.52Å; A367-I443 WeakPolarHBondContact O-CD1 3.45Å
368	E	91.6	Very high	87	Confident	135 Å²	135	50.1 Å²	50.1	63%	0.631	29%	0.293	S	S	*	.	H	α-helix	trans	-61.4	-43.4	177.6	-174.2	178.7	-178.3	0	0	111.8	A364 N371 S372	A364-E368 WeakPolarHBondContact O-CB 3.37Å; A364-E368 PolarHBondContact O-N 2.95Å; E368-N371 PolarHBondContact O-N 2.93Å; E368-S372 VanDerWaalsContact O-CB 3.29Å; E368-S372 WeakPolarHBondContact O-CB 3.47Å; E368-S372 PolarHBondContact O-N 3.29Å
369	T	91.6	Very high	87.5	Confident	12 Å²	12	50.5 Å²	50.5	7%	0.074	29%	0.293	C	S	.	.	H	α-helix	trans	-61.6	-47.5	178.8	-62	0	0	0	0	111.4	R353 L356 L365 A366 A367 S372 M373	R353-T369 HydrophobicContact CB-CG2 4.47Å; L356-T369 HydrophobicContact CD1-CG2 3.87Å; L356-T369 HydrophobicContact CG-CG2 4.26Å; L365-T369 VanDerWaalsContact O-CB 3.23Å; L365-T369 WeakPolarHBondContact O-CB 3.34Å; L365-T369 PolarHBondContact O-N 2.9Å; L365-T369 PolarHBondContact O-OG1 3.47Å; A366-T369 PolarHBondContact O-N 3.49Å; A367-T369 VanDerWaalsContact C-N 3.35Å; A367-T369 PolarHBondContact O-N 3.38Å; T369-S372 PolarHBondContact O-N 2.82Å; T369-M373 HydrophobicContact CG2-SD 4.39Å; T369-M373 WeakPolarHBondContact O-CG 3.25Å; T369-M373 PolarHBondContact O-N 3.18Å
370	L	92.3	Very high	88.5	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.8	-43.2	178	-175	63.3	0	0	0	111.4	L356 A366 A367 S372 M373 Y374 L440 I443	L356-L370 HydrophobicContact CD1-CB 4.37Å; L356-L370 HydrophobicContact CD1-CD1 4.37Å; L356-L370 HydrophobicContact CD2-CB 4.1Å; A366-L370 WeakPolarHBondContact O-CB 3.47Å; A366-L370 PolarHBondContact O-N 3.16Å; A367-L370 PolarHBondContact O-N 3.2Å; L370-S372 VanDerWaalsContact C-N 3.31Å; L370-S372 PolarHBondContact O-N 3.14Å; L370-M373 WeakPolarHBondContact O-CB 3.36Å; L370-M373 PolarHBondContact O-N 3.44Å; L370-Y374 HydrophobicContact CD1-CD2 4.44Å; L370-Y374 HydrophobicContact CD1-CE1 4.01Å; L370-Y374 HydrophobicContact CD1-CE2 3.86Å; L370-Y374 HydrophobicContact CD2-CE2 3.77Å; L370-Y374 HydrophobicContact CG-CD2 4.01Å; L370-Y374 HydrophobicContact CG-CE2 3.53Å; L370-Y374 PolarHBondContact O-N 3.26Å; L370-L440 HydrophobicContact CB-CD2 4.14Å; L370-L440 HydrophobicContact CD2-CB 4.08Å; L370-L440 HydrophobicContact CD2-CD2 3.7Å; L370-L440 HydrophobicContact CD2-CG 4.43Å; L370-I443 HydrophobicContact CD2-CG2 4.3Å; L370-I443 HydrophobicContact CG-CG2 4.27Å
371	N	93.3	Very high	89.4	Confident	83 Å²	83	46.5 Å²	46.5	44%	0.444	25%	0.251	S	S	.	.	H	α-helix	trans	-63.2	-38.5	177.8	-170.6	50	0	0	0	111.9	A367 E368 Y374 T375 I443	A367-N371 VanDerWaalsContact O-CB 3.32Å; A367-N371 WeakPolarHBondContact O-CB 3.48Å; A367-N371 PolarHBondContact O-N 3.2Å; E368-N371 PolarHBondContact O-N 2.93Å; N371-Y374 PolarHBondContact O-N 3.33Å; N371-T375 WeakPolarHBondContact O-CB 3.49Å; N371-T375 PolarHBondContact O-N 2.84Å; N371-T375 PolarHBondContact O-OG1 2.81Å; N371-I443 HydrophobicContact CB-CD1 4.42Å; N371-I443 HydrophobicContact CB-CG2 3.98Å
372	S	92.2	Very high	90.1	Very high	54 Å²	54	49 Å²	49	38%	0.378	26%	0.262	S	S	.	.	H	α-helix	trans	-64.3	-43.4	173.8	-177.3	0	0	0	0	111.7	E368 T369 L370 T375 R376	E368-S372 VanDerWaalsContact O-CB 3.29Å; E368-S372 WeakPolarHBondContact O-CB 3.47Å; E368-S372 PolarHBondContact O-N 3.29Å; T369-S372 PolarHBondContact O-N 2.82Å; L370-S372 VanDerWaalsContact C-N 3.31Å; L370-S372 PolarHBondContact O-N 3.14Å; S372-T375 PolarHBondContact O-N 3.27Å; S372-R376 VanDerWaalsContact O-CG 3.31Å; S372-R376 WeakPolarHBondContact O-CG 3.46Å; S372-R376 PolarHBondContact O-N 2.9Å
373	M	92.3	Very high	89.9	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-59.2	-48.7	173.4	-73.5	172	147	0	0	111.7	I349 F350 T351 R353 L356 T369 L370 T375 R376 A377 L425	I349-M373 HydrophobicContact CG2-CB 4.11Å; I349-M373 HydrophobicContact CG2-CG 4.45Å; I349-M373 VanDerWaalsContact CG2-O 3.25Å; I349-M373 WeakPolarHBondContact CG2-O 3.38Å; I349-M373 WeakPolarHBondContact O-CE 3.18Å; F350-M373 HydrophobicContact CD1-CB 4.21Å; F350-M373 HydrophobicContact CD1-SD 4.4Å; F350-M373 HydrophobicContact CE1-CB 4.02Å; T351-M373 WeakPolarHBondContact O-CE 3.46Å; R353-M373 HydrophobicContact CG-CE 4.18Å; L356-M373 HydrophobicContact CD1-CE 4.26Å; L356-M373 HydrophobicContact CD1-SD 3.52Å; L356-M373 VanDerWaalsContact CD1-SD 3.52Å; T369-M373 HydrophobicContact CG2-SD 4.39Å; T369-M373 WeakPolarHBondContact O-CG 3.25Å; T369-M373 PolarHBondContact O-N 3.18Å; L370-M373 WeakPolarHBondContact O-CB 3.36Å; L370-M373 PolarHBondContact O-N 3.44Å; M373-T375 PolarHBondContact O-N 2.92Å; M373-R376 PolarHBondContact O-N 3.19Å; M373-A377 PolarHBondContact O-N 3.32Å; M373-L425 HydrophobicContact SD-CD1 4.14Å
374	Y	94.8	Very high	89.6	Confident	3 Å²	3	42 Å²	42	1%	0.012	23%	0.227	C	C	.	.	H	α-helix	trans	-62.4	-41.7	176.6	-71	-27.4	0	0	0	112.9	F350 L370 N371 R376 A377 L378 I421 I443 S444 F447	F350-Y374 AromaticContact CE1-CD1 3.91Å; F350-Y374 HydrophobicContact CE1-CD1 3.91Å; F350-Y374 AromaticContact CE1-CE1 3.99Å; F350-Y374 HydrophobicContact CE1-CE1 3.99Å; F350-Y374 HydrophobicContact CZ-CD1 4.11Å; F350-Y374 HydrophobicContact CZ-CE1 4.37Å; L370-Y374 HydrophobicContact CD1-CD2 4.44Å; L370-Y374 HydrophobicContact CD1-CE1 4.01Å; L370-Y374 HydrophobicContact CD1-CE2 3.86Å; L370-Y374 HydrophobicContact CD2-CE2 3.77Å; L370-Y374 HydrophobicContact CG-CD2 4.01Å; L370-Y374 HydrophobicContact CG-CE2 3.53Å; L370-Y374 PolarHBondContact O-N 3.26Å; N371-Y374 PolarHBondContact O-N 3.33Å; Y374-R376 VanDerWaalsContact C-N 3.31Å; Y374-R376 PolarHBondContact O-N 2.97Å; Y374-A377 PolarHBondContact O-N 2.88Å; Y374-L378 WeakPolarHBondContact O-CB 3.45Å; Y374-L378 VanDerWaalsContact O-CG 3.3Å; Y374-L378 WeakPolarHBondContact O-CG 3.46Å; Y374-L378 PolarHBondContact O-N 2.76Å; Y374-I421 HydrophobicContact CE1-CD1 3.73Å; Y374-I443 HydrophobicContact CD2-CG2 3.62Å; Y374-I443 HydrophobicContact CE2-CG2 3.82Å; Y374-S444 PolarHBondContact OH-OG 3.39Å; Y374-F447 HydrophobicContact CD1-CB 4.38Å; Y374-F447 HydrophobicContact CD1-CD1 4.07Å; Y374-F447 AromaticContact CD1-CD2 3.89Å; Y374-F447 HydrophobicContact CD1-CD2 3.89Å; Y374-F447 HydrophobicContact CD1-CE1 4.32Å; Y374-F447 HydrophobicContact CD1-CE2 4.15Å; Y374-F447 AromaticContact CD1-CG 3.84Å; Y374-F447 HydrophobicContact CD1-CG 3.84Å; Y374-F447 HydrophobicContact CD1-CZ 4.35Å; Y374-F447 HydrophobicContact CD2-CB 3.63Å; Y374-F447 HydrophobicContact CD2-CD2 4.42Å; Y374-F447 HydrophobicContact CD2-CG 4.01Å; Y374-F447 HydrophobicContact CE1-CD1 4.05Å; Y374-F447 HydrophobicContact CE1-CE1 4.34Å; Y374-F447 HydrophobicContact CE1-CG 4.22Å; Y374-F447 HydrophobicContact CE2-CB 3.97Å; Y374-F447 HydrophobicContact CE2-CG 4.36Å; Y374-F447 HydrophobicContact CG-CB 3.86Å; Y374-F447 HydrophobicContact CG-CD1 4.4Å; Y374-F447 AromaticContact CG-CD2 3.76Å; Y374-F447 HydrophobicContact CG-CD2 3.76Å; Y374-F447 HydrophobicContact CG-CE2 4.41Å; Y374-F447 AromaticContact CG-CG 3.74Å; Y374-F447 HydrophobicContact CG-CG 3.74Å
375	T	92.6	Very high	89.2	Confident	64 Å²	64	39.5 Å²	39.5	39%	0.393	20%	0.204	S	C	.	.	H	α-helix	trans	-61.6	-41.6	176.9	-58.6	0	0	0	0	111.2	N371 S372 M373 L378 K379	N371-T375 WeakPolarHBondContact O-CB 3.49Å; N371-T375 PolarHBondContact O-N 2.84Å; N371-T375 PolarHBondContact O-OG1 2.81Å; S372-T375 PolarHBondContact O-N 3.27Å; M373-T375 PolarHBondContact O-N 2.92Å; T375-L378 PolarHBondContact O-N 3.38Å; T375-K379 WeakPolarHBondContact O-CG 3.45Å; T375-K379 PolarHBondContact O-N 3.24Å; T375-K379 VanDerWaalsContact O-N 3.09Å
376	R	90.8	Very high	88.6	Confident	95 Å²	95	41.3 Å²	41.3	36%	0.358	21%	0.207	S	C	.	.	H	α-helix	trans	-65.9	-42.4	175.3	-71.3	173.5	66.3	-159.3	-1.6	111.8	I349 S372 M373 Y374 L378 K379 V380	I349-R376 HydrophobicContact CD1-CB 4.04Å; I349-R376 HydrophobicContact CG1-CB 4.11Å; I349-R376 HydrophobicContact CG2-CB 4.07Å; S372-R376 VanDerWaalsContact O-CG 3.31Å; S372-R376 WeakPolarHBondContact O-CG 3.46Å; S372-R376 PolarHBondContact O-N 2.9Å; M373-R376 PolarHBondContact O-N 3.19Å; Y374-R376 VanDerWaalsContact C-N 3.31Å; Y374-R376 PolarHBondContact O-N 2.97Å; R376-L378 VanDerWaalsContact C-N 3.32Å; R376-L378 PolarHBondContact O-N 3.36Å; R376-K379 WeakPolarHBondContact O-CB 3.44Å; R376-K379 PolarHBondContact O-N 3.25Å; R376-V380 PolarHBondContact O-N 3.28Å; R376-V380 VanDerWaalsContact O-N 3.13Å
377	A	91.7	Very high	87.8	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.1	-39.7	175.7	0	0	0	0	0	111.6	L346 I349 F350 M373 Y374 K379 V380 L381 F413	L346-A377 HydrophobicContact CD2-CB 4.16Å; I349-A377 HydrophobicContact CG2-CB 4.47Å; F350-A377 HydrophobicContact CE2-CB 3.92Å; F350-A377 HydrophobicContact CZ-CB 3.73Å; M373-A377 PolarHBondContact O-N 3.32Å; Y374-A377 PolarHBondContact O-N 2.88Å; A377-K379 VanDerWaalsContact C-N 3.32Å; A377-K379 PolarHBondContact O-N 3.39Å; A377-V380 WeakPolarHBondContact O-CB 3.47Å; A377-V380 PolarHBondContact O-N 3.39Å; A377-L381 PolarHBondContact O-N 2.95Å; A377-F413 HydrophobicContact CB-CE2 4.37Å; A377-F413 HydrophobicContact CB-CZ 4.12Å; A377-F413 VanDerWaalsContact O-CE2 3.24Å; A377-F413 WeakPolarHBondContact O-CE2 3.44Å; A377-F413 WeakPolarHBondContact O-CZ 3.32Å
378	L	91.6	Very high	87	Confident	22 Å²	22	42.6 Å²	42.6	12%	0.115	21%	0.209	C	C	.	.	H	α-helix	trans	-63.4	-35.7	175	-73.9	171.9	0	0	0	112.5	Y374 T375 R376 L381 D382 F447 T450 V451 K454	Y374-L378 WeakPolarHBondContact O-CB 3.45Å; Y374-L378 VanDerWaalsContact O-CG 3.3Å; Y374-L378 WeakPolarHBondContact O-CG 3.46Å; Y374-L378 PolarHBondContact O-N 2.76Å; T375-L378 PolarHBondContact O-N 3.38Å; R376-L378 VanDerWaalsContact C-N 3.32Å; R376-L378 PolarHBondContact O-N 3.36Å; L378-L381 HydrophobicContact CD2-CD2 4.41Å; L378-L381 WeakPolarHBondContact O-CB 3.46Å; L378-L381 PolarHBondContact O-N 3.18Å; L378-D382 PolarHBondContact O-N 3.03Å; L378-D382 VanDerWaalsContact O-OD2 3.09Å; L378-F447 HydrophobicContact CD1-CD2 4.16Å; L378-F447 HydrophobicContact CD2-CD2 4.11Å; L378-F447 HydrophobicContact CD2-CE2 3.85Å; L378-F447 HydrophobicContact CG-CD2 3.98Å; L378-F447 HydrophobicContact CG-CE2 3.87Å; L378-T450 HydrophobicContact CD1-CG2 3.65Å; L378-T450 HydrophobicContact CD2-CG2 4.09Å; L378-V451 HydrophobicContact CD2-CG2 3.84Å; L378-K454 HydrophobicContact CD2-CD 4.43Å; L378-K454 PolarHBondContact O-NZ 3.37Å
379	K	88.4	Confident	85.9	Confident	128 Å²	128	39.2 Å²	39.2	56%	0.557	19%	0.192	S	C	*	.	H	α-helix	trans	-65.2	-39.3	172.9	-71.9	-178.9	179.7	-171.6	0	112.3	T375 R376 A377 L381 D382 S383	T375-K379 WeakPolarHBondContact O-CG 3.45Å; T375-K379 PolarHBondContact O-N 3.24Å; T375-K379 VanDerWaalsContact O-N 3.09Å; R376-K379 WeakPolarHBondContact O-CB 3.44Å; R376-K379 PolarHBondContact O-N 3.25Å; A377-K379 VanDerWaalsContact C-N 3.32Å; A377-K379 PolarHBondContact O-N 3.39Å; K379-L381 VanDerWaalsContact C-N 3.34Å; K379-D382 PolarHBondContact O-N 3.43Å; K379-S383 PolarHBondContact O-N 2.92Å
380	V	86.8	Confident	84.6	Confident	20 Å²	20	42.3 Å²	42.3	12%	0.121	21%	0.206	C	C	.	.	H	α-helix	trans	-60.3	-47.7	172	172.1	0	0	0	0	109.6	L342 Q345 L346 I349 R376 A377 D382 S383 Q384	L342-V380 HydrophobicContact CD2-CG1 4.42Å; Q345-V380 HydrophobicContact CB-CG1 4.44Å; Q345-V380 HydrophobicContact CB-CG2 4.43Å; Q345-V380 VanDerWaalsContact OE1-CG1 3.24Å; L346-V380 HydrophobicContact CD2-CG1 4.44Å; I349-V380 HydrophobicContact CD1-CG2 3.68Å; R376-V380 PolarHBondContact O-N 3.28Å; R376-V380 VanDerWaalsContact O-N 3.13Å; A377-V380 WeakPolarHBondContact O-CB 3.47Å; A377-V380 PolarHBondContact O-N 3.39Å; V380-D382 PolarHBondContact O-N 2.92Å; V380-S383 WeakPolarHBondContact O-CB 3.31Å; V380-S383 PolarHBondContact O-N 3.5Å; V380-Q384 HydrophobicContact CG1-CG 4.27Å; V380-Q384 VanDerWaalsContact O-CG 3.28Å; V380-Q384 WeakPolarHBondContact O-CG 3.4Å; V380-Q384 PolarHBondContact O-N 2.9Å
381	L	87.3	Confident	83.3	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-57.6	-46.1	175.8	179.3	60.7	0	0	0	111.9	A377 L378 K379 S383 Q384 L385 L409 F413 V451 K454	A377-L381 PolarHBondContact O-N 2.95Å; L378-L381 HydrophobicContact CD2-CD2 4.41Å; L378-L381 WeakPolarHBondContact O-CB 3.46Å; L378-L381 PolarHBondContact O-N 3.18Å; K379-L381 VanDerWaalsContact C-N 3.34Å; L381-S383 VanDerWaalsContact C-N 3.33Å; L381-S383 PolarHBondContact O-N 2.9Å; L381-Q384 PolarHBondContact O-N 3.25Å; L381-L385 HydrophobicContact CD1-CD1 3.89Å; L381-L385 HydrophobicContact CD1-CD2 3.99Å; L381-L385 HydrophobicContact CD1-CG 3.74Å; L381-L385 HydrophobicContact CD2-CD1 4.41Å; L381-L385 HydrophobicContact CG-CD1 3.76Å; L381-L385 HydrophobicContact CG-CG 4.07Å; L381-L385 WeakPolarHBondContact O-CB 3.15Å; L381-L385 WeakPolarHBondContact O-CG 3.5Å; L381-L385 PolarHBondContact O-N 3.39Å; L381-L409 HydrophobicContact CD1-CD1 4.29Å; L381-L409 HydrophobicContact CD1-CG 4.31Å; L381-L409 HydrophobicContact CD2-CD1 4.28Å; L381-F413 HydrophobicContact CB-CD1 4.33Å; L381-F413 HydrophobicContact CB-CD2 3.94Å; L381-F413 HydrophobicContact CB-CE1 4.14Å; L381-F413 HydrophobicContact CB-CE2 3.72Å; L381-F413 HydrophobicContact CB-CG 4.25Å; L381-F413 HydrophobicContact CB-CZ 3.83Å; L381-F413 HydrophobicContact CD1-CB 3.95Å; L381-F413 HydrophobicContact CD1-CD1 3.89Å; L381-F413 HydrophobicContact CD1-CD2 4.18Å; L381-F413 HydrophobicContact CD1-CE1 4.47Å; L381-F413 HydrophobicContact CD1-CG 3.74Å; L381-F413 HydrophobicContact CD2-CD1 3.93Å; L381-F413 HydrophobicContact CD2-CE1 3.8Å; L381-F413 HydrophobicContact CD2-CZ 4.28Å; L381-F413 HydrophobicContact CG-CD1 4.27Å; L381-F413 HydrophobicContact CG-CE1 4.36Å; L381-F413 HydrophobicContact CG-CG 4.38Å; L381-V451 HydrophobicContact CD2-CG2 4.46Å; L381-K454 HydrophobicContact CD2-CD 3.61Å; L381-K454 HydrophobicContact CG-CD 4.18Å
382	D	86.2	Confident	81.8	Confident	79 Å²	79	41.1 Å²	41.1	42%	0.422	20%	0.198	S	C	.	.	H	α-helix	trans	-59.4	-43.6	178.4	-73	-35.6	0	0	0	112.5	L378 K379 V380 L385 Y386 K454	L378-D382 PolarHBondContact O-N 3.03Å; L378-D382 VanDerWaalsContact O-OD2 3.09Å; K379-D382 PolarHBondContact O-N 3.43Å; V380-D382 PolarHBondContact O-N 2.92Å; D382-L385 PolarHBondContact O-N 3.2Å; D382-Y386 WeakPolarHBondContact O-CB 3.27Å; D382-Y386 PolarHBondContact O-N 3.03Å; D382-K454 WeakPolarHBondContact OD1-CE 3.33Å; D382-K454 IonicContact OD1-NZ 2.67Å; D382-K454 PolarHBondContact OD1-NZ 3.48Å; D382-K454 IonicContact OD2-NZ 3.54Å; D382-K454 PolarHBondContact OD2-NZ 2.84Å
383	S	81.5	Confident	80.4	Confident	24 Å²	24	41.5 Å²	41.5	17%	0.168	20%	0.195	C	C	.	.	H	α-helix	trans	-60.2	-48.6	175.3	-175.1	0	0	0	0	111.4	K379 V380 L381 Y386 Y387	K379-S383 PolarHBondContact O-N 2.92Å; V380-S383 WeakPolarHBondContact O-CB 3.31Å; V380-S383 PolarHBondContact O-N 3.5Å; L381-S383 VanDerWaalsContact C-N 3.33Å; L381-S383 PolarHBondContact O-N 2.9Å; S383-Y386 WeakPolarHBondContact O-CB 3.17Å; S383-Y386 PolarHBondContact O-N 3.15Å; S383-Y387 WeakPolarHBondContact O-CD2 3.41Å; S383-Y387 PolarHBondContact O-N 2.99Å; S383-Y387 VanDerWaalsContact O-N 3.07Å; S383-Y387 WeakPolarHBondContact OG-CE2 3.37Å
384	Q	79.9	Confident	78.9	Confident	3 Å²	3	50 Å²	50	1%	0.014	23%	0.227	C	C	.	.	H	α-helix	trans	-65.5	-41.9	179.7	-63.8	-63.6	-34.2	0	0	112.2	L298 Y337 L342 V380 L381 Y386 Y387 V388	L298-Q384 PolarHBondContact O-NE2 3.5Å; Y337-Q384 PolarHBondContact OH-OE1 2.85Å; L342-Q384 HydrophobicContact CD2-CG 3.95Å; V380-Q384 HydrophobicContact CG1-CG 4.27Å; V380-Q384 VanDerWaalsContact O-CG 3.28Å; V380-Q384 WeakPolarHBondContact O-CG 3.4Å; V380-Q384 PolarHBondContact O-N 2.9Å; L381-Q384 PolarHBondContact O-N 3.25Å; Q384-Y386 VanDerWaalsContact C-N 3.33Å; Q384-Y386 PolarHBondContact O-N 3.45Å; Q384-Y387 PolarHBondContact O-N 3.32Å; Q384-V388 VanDerWaalsContact O-CB 3.31Å; Q384-V388 WeakPolarHBondContact O-CB 3.35Å; Q384-V388 VanDerWaalsContact O-CG2 3.29Å; Q384-V388 WeakPolarHBondContact O-CG2 3.21Å; Q384-V388 PolarHBondContact O-N 3.18Å
385	L	80.1	Confident	76.8	Confident	14 Å²	14	57.3 Å²	57.3	7%	0.073	26%	0.256	C	S	.	.	H	α-helix	trans	-63.5	-39.8	175.9	-65.6	173.8	0	0	0	110.7	L381 D382 K389 L409 K454 W456	L381-L385 HydrophobicContact CD1-CD1 3.89Å; L381-L385 HydrophobicContact CD1-CD2 3.99Å; L381-L385 HydrophobicContact CD1-CG 3.74Å; L381-L385 HydrophobicContact CD2-CD1 4.41Å; L381-L385 HydrophobicContact CG-CD1 3.76Å; L381-L385 HydrophobicContact CG-CG 4.07Å; L381-L385 WeakPolarHBondContact O-CB 3.15Å; L381-L385 WeakPolarHBondContact O-CG 3.5Å; L381-L385 PolarHBondContact O-N 3.39Å; D382-L385 PolarHBondContact O-N 3.2Å; L385-K389 WeakPolarHBondContact O-CA 3.43Å; L385-K389 WeakPolarHBondContact O-CB 3.38Å; L385-K389 PolarHBondContact O-N 3.21Å; L385-L409 HydrophobicContact CD2-CB 4.38Å; L385-L409 HydrophobicContact CD2-CD1 4.4Å; L385-K454 HydrophobicContact CD1-CB 4.04Å; L385-K454 HydrophobicContact CD1-CD 4.24Å; L385-W456 HydrophobicContact CB-CZ2 4.14Å; L385-W456 HydrophobicContact CD2-CH2 4.02Å; L385-W456 HydrophobicContact CD2-CZ2 3.26Å; L385-W456 HydrophobicContact CG-CZ2 4.16Å
386	Y	77.1	Confident	74.7	Confident	114 Å²	114	56.5 Å²	56.5	45%	0.447	25%	0.253	S	S	.	.	I	π-helix	trans	-60.3	-52.6	175.9	176.3	-103.1	0	0	0	111.6	D382 S383 Q384 E390	D382-Y386 WeakPolarHBondContact O-CB 3.27Å; D382-Y386 PolarHBondContact O-N 3.03Å; S383-Y386 WeakPolarHBondContact O-CB 3.17Å; S383-Y386 PolarHBondContact O-N 3.15Å; Q384-Y386 VanDerWaalsContact C-N 3.33Å; Q384-Y386 PolarHBondContact O-N 3.45Å; Y386-E390 HydrophobicContact CD2-CB 4.47Å; Y386-E390 HydrophobicContact CD2-CG 4.23Å; Y386-E390 WeakPolarHBondContact CD2-OE2 3.24Å; Y386-E390 WeakPolarHBondContact CE2-OE2 3.18Å; Y386-E390 VanDerWaalsContact O-CB 3.26Å; Y386-E390 WeakPolarHBondContact O-CB 3.37Å; Y386-E390 PolarHBondContact O-N 3.46Å
387	Y	72.4	Confident	72.5	Confident	39 Å²	39	55.9 Å²	55.9	15%	0.153	26%	0.261	C	S	.	.	I	π-helix	trans	-68.2	-46.4	-178.5	-66.3	-62.7	0	0	0	112.7	L298 I309 S383 Q384 Q391 I392	L298-Y387 VanDerWaalsContact CD2-CB 3.45Å; L298-Y387 HydrophobicContact CD2-CD2 3.98Å; L298-Y387 HydrophobicContact CD2-CG 3.92Å; I309-Y387 HydrophobicContact CD1-CD1 3.39Å; I309-Y387 HydrophobicContact CD1-CE1 3.44Å; I309-Y387 VanDerWaalsContact CD1-CE1 3.44Å; I309-Y387 HydrophobicContact CD1-CG 4.42Å; I309-Y387 HydrophobicContact CG1-CE1 4.38Å; S383-Y387 WeakPolarHBondContact O-CD2 3.41Å; S383-Y387 PolarHBondContact O-N 2.99Å; S383-Y387 VanDerWaalsContact O-N 3.07Å; S383-Y387 WeakPolarHBondContact OG-CE2 3.37Å; Q384-Y387 PolarHBondContact O-N 3.32Å; Y387-Q391 HydrophobicContact CD1-CG 4.49Å; Y387-Q391 VanDerWaalsContact O-CB 3.25Å; Y387-Q391 WeakPolarHBondContact O-CB 3.35Å; Y387-Q391 PolarHBondContact O-N 3.33Å; Y387-I392 PolarHBondContact O-N 2.98Å
388	V	72.6	Confident	69.8	Low	3 Å²	3	65.7 Å²	65.7	2%	0.018	31%	0.307	C	S	.	.	I	π-helix	trans	-70.6	-46.3	-177.8	178.4	0	0	0	0	111.1	Q384 I392 I393 F406 C408	Q384-V388 VanDerWaalsContact O-CB 3.31Å; Q384-V388 WeakPolarHBondContact O-CB 3.35Å; Q384-V388 VanDerWaalsContact O-CG2 3.29Å; Q384-V388 WeakPolarHBondContact O-CG2 3.21Å; Q384-V388 PolarHBondContact O-N 3.18Å; V388-I392 HydrophobicContact CG2-CD1 4.34Å; V388-I392 VanDerWaalsContact O-CB 3.3Å; V388-I392 WeakPolarHBondContact O-CB 3.44Å; V388-I392 PolarHBondContact O-N 3.19Å; V388-I393 HydrophobicContact CG1-CD1 4.44Å; V388-I393 WeakPolarHBondContact O-CG1 3.2Å; V388-I393 PolarHBondContact O-N 2.86Å; V388-F406 HydrophobicContact CG1-CD1 4.22Å; V388-F406 HydrophobicContact CG1-CE1 4.09Å; V388-C408 HydrophobicContact CG1-CB 4.27Å; V388-C408 HydrophobicContact CG2-CB 4.36Å
389	K	69	Low	67.4	Low	65 Å²	65	68.7 Å²	68.7	28%	0.283	34%	0.343	S	S	.	.	I	π-helix	trans	-76.4	-50.5	-176	-162.8	-166.8	-168.3	168.8	0	112.8	L385 R394 W456	L385-K389 WeakPolarHBondContact O-CA 3.43Å; L385-K389 WeakPolarHBondContact O-CB 3.38Å; L385-K389 PolarHBondContact O-N 3.21Å; K389-R394 PolarHBondContact O-N 3.32Å; K389-W456 HydrophobicContact CB-CH2 3.54Å; K389-W456 HydrophobicContact CB-CZ2 3.61Å; K389-W456 HydrophobicContact CB-CZ3 4.27Å; K389-W456 HydrophobicContact CD-CD2 3.78Å; K389-W456 VanDerWaalsContact CD-CE2 3.42Å; K389-W456 HydrophobicContact CD-CE3 4.18Å; K389-W456 HydrophobicContact CD-CG 4.35Å; K389-W456 HydrophobicContact CD-CH2 3.94Å; K389-W456 HydrophobicContact CD-CZ2 3.47Å; K389-W456 VanDerWaalsContact CD-CZ2 3.47Å; K389-W456 HydrophobicContact CD-CZ3 4.27Å; K389-W456 HydrophobicContact CG-CD2 4.27Å; K389-W456 HydrophobicContact CG-CE3 4.17Å; K389-W456 HydrophobicContact CG-CH2 3.58Å; K389-W456 HydrophobicContact CG-CZ2 3.64Å; K389-W456 HydrophobicContact CG-CZ3 3.85Å
390	E	64.4	Low	65.1	Low	76 Å²	76	65.5 Å²	65.5	36%	0.355	34%	0.337	S	S	.	.	I	π-helix	trans	-82.8	-34.1	-171.7	-61	-150.1	140.7	0	0	112.6	Y386 R394	Y386-E390 HydrophobicContact CD2-CB 4.47Å; Y386-E390 HydrophobicContact CD2-CG 4.23Å; Y386-E390 WeakPolarHBondContact CD2-OE2 3.24Å; Y386-E390 WeakPolarHBondContact CE2-OE2 3.18Å; Y386-E390 VanDerWaalsContact O-CB 3.26Å; Y386-E390 WeakPolarHBondContact O-CB 3.37Å; Y386-E390 PolarHBondContact O-N 3.46Å; E390-R394 IonicContact OE1-NH1 3.68Å
391	Q	63.2	Low	63.2	Low	49 Å²	49	73.2 Å²	73.2	23%	0.229	37%	0.371	C	S	.	.	I	π-helix	trans	-94.7	-37.4	-176.1	-55.3	-66.3	-22	0	0	112.9	I314 Y387	I314-Q391 HydrophobicContact CD1-CB 4.09Å; I314-Q391 WeakPolarHBondContact CG2-O 3.4Å; Y387-Q391 HydrophobicContact CD1-CG 4.49Å; Y387-Q391 VanDerWaalsContact O-CB 3.25Å; Y387-Q391 WeakPolarHBondContact O-CB 3.35Å; Y387-Q391 PolarHBondContact O-N 3.33Å
392	I	63.3	Low	61.7	Low	9 Å²	9	75.5 Å²	75.5	5%	0.046	39%	0.387	C	S	.	.	I	π-helix	trans	-92.2	-45.3	-175.4	-51.4	174.5	0	0	0	111.9	I314 L317 R318 L321 Y387 V388 L403	I314-I392 HydrophobicContact CG2-CG1 4.49Å; L317-I392 HydrophobicContact CD2-CD1 3.37Å; L317-I392 HydrophobicContact CD2-CG1 4.35Å; L317-I392 HydrophobicContact CG-CD1 4.08Å; R318-I392 HydrophobicContact CG-CG2 4.49Å; L321-I392 HydrophobicContact CD1-CD1 4.37Å; L321-I392 HydrophobicContact CD1-CG2 4.08Å; Y387-I392 PolarHBondContact O-N 2.98Å; V388-I392 HydrophobicContact CG2-CD1 4.34Å; V388-I392 VanDerWaalsContact O-CB 3.3Å; V388-I392 WeakPolarHBondContact O-CB 3.44Å; V388-I392 PolarHBondContact O-N 3.19Å; I392-L403 HydrophobicContact CG2-CD1 4.44Å
393	I	63.1	Low	60.5	Low	63 Å²	63	72.9 Å²	72.9	32%	0.323	37%	0.372	S	S	.	.	I	π-helix	trans	-83	-42.6	-173.4	-61.7	172.6	0	0	0	112.5	V388 Y395 W456	V388-I393 HydrophobicContact CG1-CD1 4.44Å; V388-I393 WeakPolarHBondContact O-CG1 3.2Å; V388-I393 PolarHBondContact O-N 2.86Å; I393-Y395 PolarHBondContact O-N 3.23Å; I393-W456 HydrophobicContact CD1-CZ3 4.18Å
394	R	59	Low	59.7	Low	179 Å²	179	76 Å²	76	68%	0.675	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-22	-175.7	-84.7	-174.4	171.1	-179.5	-2	115.5	K389 E390 S396	K389-R394 PolarHBondContact O-N 3.32Å; E390-R394 IonicContact OE1-NH1 3.68Å; R394-S396 VanDerWaalsContact C-N 3.26Å; R394-S396 PolarHBondContact O-N 3.49Å
395	Y	52.2	Low	59.2	Low	157 Å²	157	81 Å²	81	62%	0.616	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	37.9	177.1	-84.5	-80.2	0	0	0	112.9	R318 I393 P397	R318-Y395 PolarHBondContact NH1-O 2.84Å; I393-Y395 PolarHBondContact O-N 3.23Å; Y395-P397 WeakPolarHBondContact O-CD 3.4Å
396	S	48.2	Very low	59	Low	47 Å²	47	80.9 Å²	80.9	33%	0.329	42%	0.42	S	S	.	.			trans	-81.6	116.3	166	-168.7	0	0	0	0	109.4	R394 S400	R394-S396 VanDerWaalsContact C-N 3.26Å; R394-S396 PolarHBondContact O-N 3.49Å; S396-S400 PolarHBondContact OG-O 3.3Å; S396-S400 PolarHBondContact OG-OG 3.06Å
397	P	44.1	Very low	59.3	Low	81 Å²	81	77 Å²	77	53%	0.526	41%	0.407	S	S	.	.			trans	-64.9	137.3	167.2	28.5	-30.1	0	0	0	108.3	Y395 G399	Y395-P397 WeakPolarHBondContact O-CD 3.4Å; P397-G399 PolarHBondContact O-N 3.21Å
398	E	34.5	Very low	59.9	Low	206 Å²	206	75.1 Å²	75.1	96%	0.963	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-30.6	107.1	179.4	-64.4	173.8	166.3	0	0	112.4
399	G	42.2	Very low	60.5	Low	85 Å²	85	75 Å²	75	88%	0.876	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	119.3	5.5	168	0	0	0	0	0	119.1	P397	P397-G399 PolarHBondContact O-N 3.21Å
400	S	40.3	Very low	61.4	Low	61 Å²	61	72.4 Å²	72.4	43%	0.427	39%	0.388	S	S	.	.			trans	-126	102.4	171.3	54.6	0	0	0	0	113.4	S396	S396-S400 PolarHBondContact OG-O 3.3Å; S396-S400 PolarHBondContact OG-OG 3.06Å
401	E	46.2	Very low	62.3	Low	182 Å²	182	69.4 Å²	69.4	85%	0.85	38%	0.378	S	S	*	.			trans	-116.1	109	169	-81.3	-176.2	156	0	0	109.8
402	P	55.9	Low	63.5	Low	50 Å²	50	67.1 Å²	67.1	33%	0.325	37%	0.367	S	S	.	.			trans	-129.2	-4.8	141.4	33.9	-24.1	0	0	0	113.7	L325 S404	L325-P402 WeakPolarHBondContact CD1-O 3.48Å; P402-S404 PolarHBondContact O-N 3.43Å
403	L	62	Low	64.8	Low	24 Å²	24	66.7 Å²	66.7	13%	0.126	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-76.3	-3.9	-171.4	-66.6	159.8	0	0	0	114.8	R318 L321 L325 I392 D405 F406	R318-L403 HydrophobicContact CG-CD1 3.46Å; R318-L403 VanDerWaalsContact CG-CD1 3.46Å; L321-L403 HydrophobicContact CB-CD2 3.54Å; L321-L403 HydrophobicContact CD1-CD2 4.25Å; L325-L403 HydrophobicContact CD1-CD2 3.77Å; L325-L403 HydrophobicContact CD1-CG 4.41Å; I392-L403 HydrophobicContact CG2-CD1 4.44Å; L403-D405 PolarHBondContact O-N 2.89Å; L403-F406 PolarHBondContact O-N 2.88Å
404	S	63.7	Low	66.2	Low	90 Å²	90	63.8 Å²	63.8	63%	0.629	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-58.9	-28.1	178.3	52.4	0	0	0	0	113.2	P402	P402-S404 PolarHBondContact O-N 3.43Å
405	D	70.9	Confident	67.8	Low	106 Å²	106	55.5 Å²	55.5	57%	0.567	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-80.9	-19.3	-173.1	-63.4	-6.1	0	0	0	112.3	L325 L330 L403 D407	L325-D405 HydrophobicContact CD2-CB 4.27Å; L330-D405 HydrophobicContact CD1-CB 3.7Å; L330-D405 WeakPolarHBondContact CD1-O 3.3Å; L403-D405 PolarHBondContact O-N 2.89Å; D405-D407 PolarHBondContact O-N 2.79Å; D405-D407 VanDerWaalsContact O-N 3.08Å
406	F	75.8	Confident	69.7	Low	13 Å²	13	48.8 Å²	48.8	6%	0.057	29%	0.294	C	S	.	.			trans	-78.3	95.3	176.6	-178.8	-102.7	0	0	0	111.3	L321 L333 L334 Y337 V388 L403 C408	L321-F406 HydrophobicContact CD2-CD2 4.44Å; L321-F406 HydrophobicContact CD2-CE2 4.45Å; L333-F406 HydrophobicContact CD2-CD2 3.59Å; L333-F406 HydrophobicContact CD2-CE2 3.95Å; L333-F406 HydrophobicContact CD2-CG 4.5Å; L333-F406 HydrophobicContact CG-CD2 4.09Å; L333-F406 HydrophobicContact CG-CE2 3.95Å; L334-F406 HydrophobicContact CD2-CD2 3.95Å; L334-F406 HydrophobicContact CD2-CE2 3.66Å; Y337-F406 HydrophobicContact CD1-CZ 4.07Å; Y337-F406 HydrophobicContact CD2-CZ 4.01Å; Y337-F406 HydrophobicContact CE1-CZ 4.38Å; Y337-F406 HydrophobicContact CE2-CZ 4.34Å; Y337-F406 HydrophobicContact CG-CE2 4.42Å; Y337-F406 AromaticContact CG-CZ 3.88Å; Y337-F406 HydrophobicContact CG-CZ 3.88Å; V388-F406 HydrophobicContact CG1-CD1 4.22Å; V388-F406 HydrophobicContact CG1-CE1 4.09Å; L403-F406 PolarHBondContact O-N 2.88Å; F406-C408 HydrophobicContact CE1-CB 4.05Å
407	D	83	Confident	71.8	Confident	31 Å²	31	46.5 Å²	46.5	17%	0.166	28%	0.278	C	S	.	.			trans	-95.7	99.5	176.5	-165.8	-28.7	0	0	0	112.3	D405 L409 V410 G411 G412 Q460	D405-D407 PolarHBondContact O-N 2.79Å; D405-D407 VanDerWaalsContact O-N 3.08Å; D407-L409 PolarHBondContact O-N 3.41Å; D407-L409 WeakPolarHBondContact OD1-CA 3.34Å; D407-L409 WeakPolarHBondContact OD1-CB 3.13Å; D407-L409 PolarHBondContact OD1-N 3.42Å; D407-V410 HydrophobicContact CB-CB 4.33Å; D407-V410 PolarHBondContact OD1-N 2.96Å; D407-V410 WeakPolarHBondContact OD2-CB 3.1Å; D407-V410 WeakPolarHBondContact OD2-CG2 3.37Å; D407-G411 WeakPolarHBondContact O-CA 3.49Å; D407-G411 PolarHBondContact O-N 2.89Å; D407-G412 PolarHBondContact O-N 3.49Å; D407-Q460 PolarHBondContact OD1-NE2 2.96Å; D407-Q460 VanDerWaalsContact OD2-CG 3.31Å; D407-Q460 WeakPolarHBondContact OD2-CG 3.28Å; D407-Q460 PolarHBondContact OD2-NE2 3.27Å
408	C	83.5	Confident	74.2	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.007	25%	0.253	C	S	.	.	I	π-helix	trans	-66.6	-22	178.2	64.1	0	0	0	0	113.7	Y337 V388 F406 G412 F413	Y337-C408 HydrophobicContact CE1-CB 4.02Å; V388-C408 HydrophobicContact CG1-CB 4.27Å; V388-C408 HydrophobicContact CG2-CB 4.36Å; F406-C408 HydrophobicContact CE1-CB 4.05Å; C408-G412 CarbonylContact O-C 3.53Å; C408-G412 WeakPolarHBondContact O-CA 3.31Å; C408-F413 PolarHBondContact O-N 2.8Å
409	L	86.9	Confident	76.9	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	22%	0.22	C	C	.	.	I	π-helix	trans	-86.7	-58.2	-179.7	-173.9	155.5	0	0	0	110.4	L381 L385 D407 W414 V451 K454 T455 L464	L381-L409 HydrophobicContact CD1-CD1 4.29Å; L381-L409 HydrophobicContact CD1-CG 4.31Å; L381-L409 HydrophobicContact CD2-CD1 4.28Å; L385-L409 HydrophobicContact CD2-CB 4.38Å; L385-L409 HydrophobicContact CD2-CD1 4.4Å; D407-L409 PolarHBondContact O-N 3.41Å; D407-L409 WeakPolarHBondContact OD1-CA 3.34Å; D407-L409 WeakPolarHBondContact OD1-CB 3.13Å; D407-L409 PolarHBondContact OD1-N 3.42Å; L409-W414 WeakPolarHBondContact O-CB 3.36Å; L409-W414 PolarHBondContact O-N 3.19Å; L409-V451 HydrophobicContact CD1-CG1 4.43Å; L409-V451 HydrophobicContact CD2-CG1 4.15Å; L409-V451 HydrophobicContact CG-CG1 4.49Å; L409-K454 HydrophobicContact CD1-CB 4.29Å; L409-T455 HydrophobicContact CD1-CG2 4.41Å; L409-T455 HydrophobicContact CD2-CG2 4.34Å; L409-L464 HydrophobicContact CD2-CD1 3.83Å; L409-L464 HydrophobicContact CD2-CD2 4.06Å; L409-L464 HydrophobicContact CD2-CG 4.45Å
410	V	86.6	Confident	79.2	Confident	10 Å²	10	31.7 Å²	31.7	6%	0.061	18%	0.181	C	C	.	.	I	π-helix	trans	-74.3	-43.3	-173.2	179.3	0	0	0	0	111.6	D407 P415 Q460 N463 L464 H467	D407-V410 HydrophobicContact CB-CB 4.33Å; D407-V410 PolarHBondContact OD1-N 2.96Å; D407-V410 WeakPolarHBondContact OD2-CB 3.1Å; D407-V410 WeakPolarHBondContact OD2-CG2 3.37Å; V410-P415 WeakPolarHBondContact O-CD 3.29Å; V410-Q460 HydrophobicContact CG2-CG 3.74Å; V410-N463 HydrophobicContact CG1-CB 4.19Å; V410-L464 HydrophobicContact CG2-CB 3.93Å; V410-L464 HydrophobicContact CG2-CD1 4.3Å; V410-H467 HydrophobicContact CG1-CB 4.39Å
411	G	84.2	Confident	81.7	Confident	14 Å²	14	28.8 Å²	28.8	14%	0.144	16%	0.161	C	C	.	.	I	π-helix	trans	-90.8	-18.5	-178.6	0	0	0	0	0	114.4	D407 P415	D407-G411 WeakPolarHBondContact O-CA 3.49Å; D407-G411 PolarHBondContact O-N 2.89Å; G411-P415 WeakPolarHBondContact O-CG 3.36Å
412	G	87	Confident	83.8	Confident	0 Å²	0	21 Å²	21	0%	0	13%	0.126	C	C	.	.	I	π-helix	trans	-109.3	-85.1	-175.2	0	0	0	0	0	113.5	L342 D407 C408 W414 P415 E416	L342-G412 VanDerWaalsContact CD1-C 3.42Å; D407-G412 PolarHBondContact O-N 3.49Å; C408-G412 CarbonylContact O-C 3.53Å; C408-G412 WeakPolarHBondContact O-CA 3.31Å; G412-W414 PolarHBondContact O-N 2.93Å; G412-P415 WeakPolarHBondContact O-CD 3.41Å; G412-P415 WeakPolarHBondContact O-CG 3.29Å; G412-E416 WeakPolarHBondContact O-CB 3.37Å; G412-E416 PolarHBondContact O-N 3.05Å
413	F	90.6	Very high	85.4	Confident	1 Å²	1	24.5 Å²	24.5	0%	0.004	14%	0.142	C	C	.	.	I	π-helix	trans	-57.8	-47.2	-171.6	173.9	-93.9	0	0	0	113.1	L342 L346 A377 L381 C408 T417 F447 V451	L342-F413 HydrophobicContact CD1-CB 4.37Å; L346-F413 HydrophobicContact CD1-CD2 4.3Å; L346-F413 HydrophobicContact CD1-CE2 4.49Å; L346-F413 HydrophobicContact CD2-CD2 4.44Å; L346-F413 HydrophobicContact CD2-CE2 3.92Å; A377-F413 HydrophobicContact CB-CE2 4.37Å; A377-F413 HydrophobicContact CB-CZ 4.12Å; A377-F413 VanDerWaalsContact O-CE2 3.24Å; A377-F413 WeakPolarHBondContact O-CE2 3.44Å; A377-F413 WeakPolarHBondContact O-CZ 3.32Å; L381-F413 HydrophobicContact CB-CD1 4.33Å; L381-F413 HydrophobicContact CB-CD2 3.94Å; L381-F413 HydrophobicContact CB-CE1 4.14Å; L381-F413 HydrophobicContact CB-CE2 3.72Å; L381-F413 HydrophobicContact CB-CG 4.25Å; L381-F413 HydrophobicContact CB-CZ 3.83Å; L381-F413 HydrophobicContact CD1-CB 3.95Å; L381-F413 HydrophobicContact CD1-CD1 3.89Å; L381-F413 HydrophobicContact CD1-CD2 4.18Å; L381-F413 HydrophobicContact CD1-CE1 4.47Å; L381-F413 HydrophobicContact CD1-CG 3.74Å; L381-F413 HydrophobicContact CD2-CD1 3.93Å; L381-F413 HydrophobicContact CD2-CE1 3.8Å; L381-F413 HydrophobicContact CD2-CZ 4.28Å; L381-F413 HydrophobicContact CG-CD1 4.27Å; L381-F413 HydrophobicContact CG-CE1 4.36Å; L381-F413 HydrophobicContact CG-CG 4.38Å; C408-F413 PolarHBondContact O-N 2.8Å; F413-T417 VanDerWaalsContact O-CB 3.22Å; F413-T417 WeakPolarHBondContact O-CB 3.16Å; F413-T417 PolarHBondContact O-N 2.96Å; F413-T417 PolarHBondContact O-OG1 3.4Å; F413-F447 HydrophobicContact CE1-CZ 4.2Å; F413-F447 HydrophobicContact CZ-CZ 4.37Å; F413-V451 HydrophobicContact CE1-CG2 4.4Å
414	W	93.4	Very high	86.7	Confident	1 Å²	1	25.7 Å²	25.7	0%	0.004	15%	0.148	C	C	.	.	H	α-helix	trans	-61.8	-59.4	-175.7	-175.6	-107.7	0	0	0	112.7	L409 G412 E416 T417 I418 F447 I448 V451 L464 S469 Y470	L409-W414 WeakPolarHBondContact O-CB 3.36Å; L409-W414 PolarHBondContact O-N 3.19Å; G412-W414 PolarHBondContact O-N 2.93Å; W414-E416 VanDerWaalsContact C-N 3.32Å; W414-E416 PolarHBondContact O-N 2.93Å; W414-T417 PolarHBondContact O-N 2.89Å; W414-I418 HydrophobicContact CD2-CD1 4.5Å; W414-I418 HydrophobicContact CD2-CG1 4.07Å; W414-I418 HydrophobicContact CG-CG1 4.49Å; W414-I418 HydrophobicContact CH2-CD1 3.87Å; W414-I418 HydrophobicContact CH2-CG1 4.39Å; W414-I418 HydrophobicContact CZ2-CD1 3.78Å; W414-I418 HydrophobicContact CZ2-CG1 3.9Å; W414-I418 HydrophobicContact CZ3-CD1 4.3Å; W414-I418 VanDerWaalsContact O-CG1 3.32Å; W414-I418 WeakPolarHBondContact O-CG1 3.41Å; W414-I418 PolarHBondContact O-N 3Å; W414-F447 HydrophobicContact CH2-CE1 4.42Å; W414-F447 HydrophobicContact CZ3-CD1 4.47Å; W414-F447 AromaticContact CZ3-CE1 3.8Å; W414-F447 HydrophobicContact CZ3-CE1 3.8Å; W414-F447 HydrophobicContact CZ3-CZ 4.45Å; W414-I448 HydrophobicContact CH2-CG1 3.82Å; W414-V451 HydrophobicContact CE3-CG1 3.9Å; W414-V451 HydrophobicContact CE3-CG2 4.49Å; W414-V451 HydrophobicContact CZ3-CB 4.23Å; W414-V451 HydrophobicContact CZ3-CG1 4.09Å; W414-V451 HydrophobicContact CZ3-CG2 4.14Å; W414-L464 HydrophobicContact CB-CD1 3.92Å; W414-L464 HydrophobicContact CD2-CD1 3.75Å; W414-L464 HydrophobicContact CE3-CD1 4.33Å; W414-L464 HydrophobicContact CG-CD1 3.51Å; W414-S469 PolarHBondContact NE1-OG 3.25Å; W414-Y470 AromaticContact CE2-CD2 3.79Å; W414-Y470 HydrophobicContact CH2-CD2 4.26Å; W414-Y470 AromaticContact CZ2-CD2 3.41Å; W414-Y470 HydrophobicContact CZ2-CD2 3.41Å; W414-Y470 VanDerWaalsContact CZ2-CD2 3.41Å; W414-Y470 HydrophobicContact CZ2-CE2 4.05Å; W414-Y470 HydrophobicContact CZ2-CG 4.27Å; W414-Y470 AromaticContact NE1-CD2 3.93Å
415	P	92.7	Very high	87.9	Confident	5 Å²	5	21.5 Å²	21.5	3%	0.032	12%	0.119	C	C	.	.	H	α-helix	trans	-59.9	-40.1	-179.6	21.2	-32.5	0	0	0	112.8	V410 G411 G412 T417 I418 D419	V410-P415 WeakPolarHBondContact O-CD 3.29Å; G411-P415 WeakPolarHBondContact O-CG 3.36Å; G412-P415 WeakPolarHBondContact O-CD 3.41Å; G412-P415 WeakPolarHBondContact O-CG 3.29Å; P415-T417 PolarHBondContact O-N 3.37Å; P415-I418 PolarHBondContact O-N 3.21Å; P415-D419 WeakPolarHBondContact O-CB 3.32Å; P415-D419 PolarHBondContact O-N 2.84Å
416	E	92.1	Very high	88.7	Confident	16 Å²	16	19.8 Å²	19.8	8%	0.075	12%	0.115	C	C	.	.	H	α-helix	trans	-64.7	-42.5	178.7	-167.6	59.9	-155.4	0	0	112.6	R338 L342 H343 L346 G412 W414 L420	R338-E416 HydrophobicContact CB-CB 4.49Å; R338-E416 HydrophobicContact CG-CB 4.21Å; R338-E416 IonicContact CZ-OE2 3.62Å; R338-E416 VanDerWaalsContact CZ-OE2 3.25Å; R338-E416 IonicContact NE-OE2 3.5Å; R338-E416 PolarHBondContact NE-OE2 2.95Å; R338-E416 IonicContact NH2-OE2 3.91Å; R338-E416 PolarHBondContact NH2-OE2 2.65Å; L342-E416 HydrophobicContact CB-CG 4.26Å; H343-E416 IonicContact CE1-OE1 3.82Å; H343-E416 IonicContact CG-OE1 2.68Å; H343-E416 IonicContact ND1-OE1 3.08Å; H343-E416 PolarHBondContact ND1-OE1 3.28Å; L346-E416 HydrophobicContact CD1-CB 4.03Å; L346-E416 HydrophobicContact CD1-CG 3.9Å; G412-E416 WeakPolarHBondContact O-CB 3.37Å; G412-E416 PolarHBondContact O-N 3.05Å; W414-E416 VanDerWaalsContact C-N 3.32Å; W414-E416 PolarHBondContact O-N 2.93Å; E416-L420 HydrophobicContact CG-CD1 4.28Å; E416-L420 WeakPolarHBondContact O-CB 3.23Å; E416-L420 WeakPolarHBondContact O-CG 3.28Å; E416-L420 PolarHBondContact O-N 3.45Å; E416-L420 VanDerWaalsContact O-N 3.09Å
417	T	92.8	Very high	89.2	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.2	-47.5	176.9	-63.4	0	0	0	0	111.1	L346 F350 F413 W414 P415 L420 I421 F447	L346-T417 WeakPolarHBondContact CD1-OG1 3.11Å; F350-T417 HydrophobicContact CE2-CG2 3.6Å; F350-T417 HydrophobicContact CZ-CG2 3.7Å; F413-T417 VanDerWaalsContact O-CB 3.22Å; F413-T417 WeakPolarHBondContact O-CB 3.16Å; F413-T417 PolarHBondContact O-N 2.96Å; F413-T417 PolarHBondContact O-OG1 3.4Å; W414-T417 PolarHBondContact O-N 2.89Å; P415-T417 PolarHBondContact O-N 3.37Å; T417-L420 PolarHBondContact O-N 3.06Å; T417-I421 HydrophobicContact CG2-CD1 3.58Å; T417-I421 HydrophobicContact CG2-CG1 4.45Å; T417-I421 WeakPolarHBondContact O-CD1 3.46Å; T417-I421 WeakPolarHBondContact O-CG1 3.43Å; T417-I421 PolarHBondContact O-N 2.93Å; T417-F447 HydrophobicContact CG2-CE1 4.28Å; T417-F447 HydrophobicContact CG2-CZ 3.99Å
418	I	93.5	Very high	89.5	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.9	-42.1	-178.2	-62.4	-52	0	0	0	111.4	W414 P415 L420 I421 C422 M472 F473	W414-I418 HydrophobicContact CD2-CD1 4.5Å; W414-I418 HydrophobicContact CD2-CG1 4.07Å; W414-I418 HydrophobicContact CG-CG1 4.49Å; W414-I418 HydrophobicContact CH2-CD1 3.87Å; W414-I418 HydrophobicContact CH2-CG1 4.39Å; W414-I418 HydrophobicContact CZ2-CD1 3.78Å; W414-I418 HydrophobicContact CZ2-CG1 3.9Å; W414-I418 HydrophobicContact CZ3-CD1 4.3Å; W414-I418 VanDerWaalsContact O-CG1 3.32Å; W414-I418 WeakPolarHBondContact O-CG1 3.41Å; W414-I418 PolarHBondContact O-N 3Å; P415-I418 PolarHBondContact O-N 3.21Å; I418-L420 VanDerWaalsContact C-N 3.34Å; I418-L420 PolarHBondContact O-N 3.28Å; I418-I421 HydrophobicContact CD1-CD1 4.37Å; I418-I421 PolarHBondContact O-N 2.82Å; I418-C422 WeakPolarHBondContact O-CB 3.39Å; I418-C422 PolarHBondContact O-N 3.03Å; I418-C422 PolarHBondContact O-SG 3.36Å; I418-C422 VanDerWaalsContact O-SG 3.42Å; I418-M472 HydrophobicContact CG2-CE 3.61Å; I418-F473 HydrophobicContact CD1-CB 4.02Å; I418-F473 HydrophobicContact CD1-CD1 4.28Å; I418-F473 HydrophobicContact CD1-CD2 3.68Å; I418-F473 HydrophobicContact CD1-CE2 4.16Å; I418-F473 HydrophobicContact CD1-CG 3.73Å; I418-F473 HydrophobicContact CG1-CB 4.42Å; I418-F473 HydrophobicContact CG2-CB 3.9Å; I418-F473 HydrophobicContact CG2-CD2 4.24Å; I418-F473 HydrophobicContact CG2-CG 4.46Å
419	D	91.5	Very high	89.8	Confident	49 Å²	49	21.8 Å²	21.8	26%	0.262	12%	0.123	S	C	.	.	H	α-helix	trans	-60.8	-44.1	177.4	-72.2	-17.8	0	0	0	111	R338 P415 C422 N423	R338-D419 IonicContact CZ-OD2 3.98Å; R338-D419 IonicContact NH1-OD2 2.76Å; R338-D419 IonicContact NH2-OD2 3.05Å; R338-D419 PolarHBondContact NH2-OD2 3.06Å; P415-D419 WeakPolarHBondContact O-CB 3.32Å; P415-D419 PolarHBondContact O-N 2.84Å; D419-C422 PolarHBondContact O-N 3.37Å; D419-N423 VanDerWaalsContact O-CB 3.25Å; D419-N423 WeakPolarHBondContact O-CB 3.47Å; D419-N423 PolarHBondContact O-N 2.75Å; D419-N423 PolarHBondContact O-ND2 3.14Å
420	L	91.3	Very high	89.9	Confident	12 Å²	12	23.5 Å²	23.5	6%	0.063	14%	0.135	C	C	.	.	H	α-helix	trans	-63.7	-42.6	176.1	-75.1	168.6	0	0	0	112.5	L346 F350 E416 T417 I418 N424	L346-L420 HydrophobicContact CB-CD1 3.37Å; F350-L420 HydrophobicContact CB-CB 4.23Å; F350-L420 HydrophobicContact CD2-CB 4.28Å; E416-L420 HydrophobicContact CG-CD1 4.28Å; E416-L420 WeakPolarHBondContact O-CB 3.23Å; E416-L420 WeakPolarHBondContact O-CG 3.28Å; E416-L420 PolarHBondContact O-N 3.45Å; E416-L420 VanDerWaalsContact O-N 3.09Å; T417-L420 PolarHBondContact O-N 3.06Å; I418-L420 VanDerWaalsContact C-N 3.34Å; I418-L420 PolarHBondContact O-N 3.28Å; L420-N424 WeakPolarHBondContact O-CB 3.44Å; L420-N424 PolarHBondContact O-N 2.97Å
421	I	92.2	Very high	89.9	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64	-47.3	176.8	-67.4	160.8	0	0	0	110.5	F350 Y374 T417 I418 N423 L425 I428 F429 F473	F350-I421 HydrophobicContact CD1-CD1 4.48Å; F350-I421 HydrophobicContact CD1-CG1 3.74Å; F350-I421 HydrophobicContact CD2-CG1 4.45Å; F350-I421 HydrophobicContact CE1-CD1 3.92Å; F350-I421 HydrophobicContact CE1-CG1 3.68Å; F350-I421 HydrophobicContact CE2-CG1 4.4Å; F350-I421 HydrophobicContact CG-CG1 4.14Å; F350-I421 HydrophobicContact CZ-CD1 3.95Å; F350-I421 HydrophobicContact CZ-CG1 4.03Å; Y374-I421 HydrophobicContact CE1-CD1 3.73Å; T417-I421 HydrophobicContact CG2-CD1 3.58Å; T417-I421 HydrophobicContact CG2-CG1 4.45Å; T417-I421 WeakPolarHBondContact O-CD1 3.46Å; T417-I421 WeakPolarHBondContact O-CG1 3.43Å; T417-I421 PolarHBondContact O-N 2.93Å; I418-I421 HydrophobicContact CD1-CD1 4.37Å; I418-I421 PolarHBondContact O-N 2.82Å; I421-N423 VanDerWaalsContact C-N 3.33Å; I421-N423 PolarHBondContact O-N 3.41Å; I421-L425 HydrophobicContact CG2-CB 4.45Å; I421-L425 CarbonylContact O-C 3.49Å; I421-L425 VanDerWaalsContact O-CA 3.3Å; I421-L425 WeakPolarHBondContact O-CA 3.47Å; I421-L425 VanDerWaalsContact O-CB 3.29Å; I421-L425 WeakPolarHBondContact O-CB 3.46Å; I421-L425 PolarHBondContact O-N 3.11Å; I421-I428 HydrophobicContact CG2-CD1 3.38Å; I421-F429 HydrophobicContact CG2-CE2 4.26Å; I421-F429 HydrophobicContact CG2-CZ 3.95Å; I421-F473 HydrophobicContact CG2-CE2 4.19Å
422	C	90.4	Very high	90.1	Very high	17 Å²	17	26.1 Å²	26.1	12%	0.115	16%	0.16	C	C	.	.	H	α-helix	trans	-65.6	-34.8	-178.7	-73.8	0	0	0	0	112.9	I418 D419 M472	I418-C422 WeakPolarHBondContact O-CB 3.39Å; I418-C422 PolarHBondContact O-N 3.03Å; I418-C422 PolarHBondContact O-SG 3.36Å; I418-C422 VanDerWaalsContact O-SG 3.42Å; D419-C422 PolarHBondContact O-N 3.37Å; C422-M472 HydrophobicContact CB-CE 4.47Å
423	N	89.5	Confident	90.1	Very high	124 Å²	124	30.5 Å²	30.5	66%	0.663	18%	0.18	S	C	*	.	H	α-helix	trans	-82.9	-43.1	-179.1	-68.3	-27.6	0	0	0	112.8	D419 I421	D419-N423 VanDerWaalsContact O-CB 3.25Å; D419-N423 WeakPolarHBondContact O-CB 3.47Å; D419-N423 PolarHBondContact O-N 2.75Å; D419-N423 PolarHBondContact O-ND2 3.14Å; I421-N423 VanDerWaalsContact C-N 3.33Å; I421-N423 PolarHBondContact O-N 3.41Å
424	N	89.9	Confident	90.1	Very high	50 Å²	50	31 Å²	31	27%	0.267	18%	0.183	S	C	.	.	H	α-helix	trans	-92.6	-25	-173.2	-63.6	-9.4	0	0	0	113.3	F350 P352 L420	F350-N424 WeakPolarHBondContact O-CB 3.46Å; F350-N424 PolarHBondContact O-ND2 3.04Å; P352-N424 HydrophobicContact CG-CB 4.13Å; L420-N424 WeakPolarHBondContact O-CB 3.44Å; L420-N424 PolarHBondContact O-N 2.97Å
425	L	88.7	Confident	90	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	20%	0.204	C	C	.	.			trans	-125.6	42	-171	-55.1	176.3	0	0	0	111.5	F350 L356 M373 I421 E427 I428	F350-L425 HydrophobicContact CD1-CD1 3.97Å; L356-L425 HydrophobicContact CB-CD2 4.03Å; L356-L425 HydrophobicContact CD1-CD1 4.34Å; L356-L425 HydrophobicContact CD1-CD2 4.1Å; M373-L425 HydrophobicContact SD-CD1 4.14Å; I421-L425 HydrophobicContact CG2-CB 4.45Å; I421-L425 CarbonylContact O-C 3.49Å; I421-L425 VanDerWaalsContact O-CA 3.3Å; I421-L425 WeakPolarHBondContact O-CA 3.47Å; I421-L425 VanDerWaalsContact O-CB 3.29Å; I421-L425 WeakPolarHBondContact O-CB 3.46Å; I421-L425 PolarHBondContact O-N 3.11Å; L425-E427 PolarHBondContact O-N 3.5Å; L425-I428 HydrophobicContact CB-CD1 4.16Å; L425-I428 HydrophobicContact CB-CG2 3.91Å; L425-I428 WeakPolarHBondContact O-CG1 3.11Å; L425-I428 WeakPolarHBondContact O-CG2 3.4Å; L425-I428 PolarHBondContact O-N 3.36Å
426	S	86.5	Confident	90	Very high	71 Å²	71	34.9 Å²	34.9	50%	0.497	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-57	-32.6	-177.5	57.3	0	0	0	0	114.2	I428 F429	S426-I428 PolarHBondContact O-N 3.14Å; S426-F429 WeakPolarHBondContact O-CD2 3.04Å; S426-F429 PolarHBondContact O-N 2.92Å
427	E	86.2	Confident	90	Very high	70 Å²	70	34.2 Å²	34.2	33%	0.327	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-73.1	-8.3	-178	-72.7	-67.7	164.9	0	0	114.7	L356 T357 L425 F429 S430 R436	L356-E427 WeakPolarHBondContact O-CB 3.34Å; T357-E427 WeakPolarHBondContact O-CG 3.42Å; L425-E427 PolarHBondContact O-N 3.5Å; E427-F429 PolarHBondContact O-N 3.39Å; E427-S430 WeakPolarHBondContact O-CB 3.34Å; E427-S430 PolarHBondContact O-N 3.09Å; E427-S430 WeakPolarHBondContact OE2-CB 3.26Å; E427-S430 PolarHBondContact OE2-OG 3.13Å; E427-R436 PolarHBondContact O-NH1 3.39Å
428	I	89.1	Confident	90	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.005	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-70.5	-26.1	173.6	76.2	-172.4	0	0	0	111.5	L356 I421 L425 S426 L440 W477	L356-I428 HydrophobicContact CB-CG2 4.32Å; L356-I428 HydrophobicContact CD2-CG2 4.12Å; I421-I428 HydrophobicContact CG2-CD1 3.38Å; L425-I428 HydrophobicContact CB-CD1 4.16Å; L425-I428 HydrophobicContact CB-CG2 3.91Å; L425-I428 WeakPolarHBondContact O-CG1 3.11Å; L425-I428 WeakPolarHBondContact O-CG2 3.4Å; L425-I428 PolarHBondContact O-N 3.36Å; S426-I428 PolarHBondContact O-N 3.14Å; I428-L440 HydrophobicContact CB-CD1 4.05Å; I428-L440 HydrophobicContact CG2-CD1 4.35Å; I428-W477 HydrophobicContact CG1-CH2 4.4Å; I428-W477 HydrophobicContact CG1-CZ2 4.47Å; I428-W477 WeakPolarHBondContact O-CH2 3.28Å; I428-W477 WeakPolarHBondContact O-CZ3 3.22Å
429	F	90.5	Very high	90	Very high	15 Å²	15	37.5 Å²	37.5	7%	0.066	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-87.4	-6.9	-178.4	-55.2	-75.3	0	0	0	112.7	I421 S426 E427 P431 F437 F473 K476 W477	I421-F429 HydrophobicContact CG2-CE2 4.26Å; I421-F429 HydrophobicContact CG2-CZ 3.95Å; S426-F429 WeakPolarHBondContact O-CD2 3.04Å; S426-F429 PolarHBondContact O-N 2.92Å; E427-F429 PolarHBondContact O-N 3.39Å; F429-P431 VanDerWaalsContact O-CD 3.28Å; F429-P431 WeakPolarHBondContact O-CD 3.44Å; F429-F437 WeakPolarHBondContact O-CE2 3.4Å; F429-F473 AromaticContact CE1-CD2 3.93Å; F429-F473 HydrophobicContact CE1-CD2 3.93Å; F429-F473 AromaticContact CE1-CE2 3.69Å; F429-F473 HydrophobicContact CE1-CE2 3.69Å; F429-F473 HydrophobicContact CE1-CZ 4.46Å; F429-F473 AromaticContact CZ-CD2 3.9Å; F429-F473 HydrophobicContact CZ-CD2 3.9Å; F429-F473 AromaticContact CZ-CE2 3.71Å; F429-F473 HydrophobicContact CZ-CE2 3.71Å; F429-K476 HydrophobicContact CD1-CB 3.63Å; F429-K476 HydrophobicContact CD2-CB 4.44Å; F429-K476 HydrophobicContact CE1-CB 3.79Å; F429-K476 HydrophobicContact CG-CB 3.98Å; F429-K476 HydrophobicContact CZ-CB 4.28Å; F429-W477 AromaticContact CD1-CD2 3.81Å; F429-W477 HydrophobicContact CD1-CD2 3.81Å; F429-W477 AromaticContact CD1-CE2 3.59Å; F429-W477 HydrophobicContact CD1-CE3 4.33Å; F429-W477 HydrophobicContact CD1-CG 4.17Å; F429-W477 HydrophobicContact CD1-CH2 4.41Å; F429-W477 AromaticContact CD1-CZ2 3.9Å; F429-W477 HydrophobicContact CD1-CZ2 3.9Å; F429-W477 AromaticContact CD1-NE1 3.8Å; F429-W477 HydrophobicContact CE1-CD2 4.3Å; F429-W477 AromaticContact CE1-CE2 3.65Å; F429-W477 AromaticContact CE1-CZ2 3.93Å; F429-W477 HydrophobicContact CE1-CZ2 3.93Å; F429-W477 AromaticContact CE1-NE1 3.5Å
430	S	88.4	Confident	90.1	Very high	36 Å²	36	35.1 Å²	35.1	25%	0.252	20%	0.204	S	C	.	.			trans	-67.7	114.5	-176	-68.4	0	0	0	0	111.1	E427 G432	E427-S430 WeakPolarHBondContact O-CB 3.34Å; E427-S430 PolarHBondContact O-N 3.09Å; E427-S430 WeakPolarHBondContact OE2-CB 3.26Å; E427-S430 PolarHBondContact OE2-OG 3.13Å; S430-G432 PolarHBondContact O-N 3.21Å
431	P	88.6	Confident	90.2	Very high	25 Å²	25	35.3 Å²	35.3	16%	0.162	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-7.4	-178	32.7	-37.5	0	0	0	113.6	F429 H433 F437 S478 V481 I485	F429-P431 VanDerWaalsContact O-CD 3.28Å; F429-P431 WeakPolarHBondContact O-CD 3.44Å; P431-H433 PolarHBondContact O-N 2.98Å; P431-H433 VanDerWaalsContact O-N 3.11Å; P431-F437 HydrophobicContact CB-CD2 4.12Å; P431-F437 HydrophobicContact CB-CE2 4.17Å; P431-S478 WeakPolarHBondContact CG-OG 3.44Å; P431-V481 HydrophobicContact CB-CB 4.22Å; P431-V481 HydrophobicContact CB-CG1 3.94Å; P431-V481 HydrophobicContact CG-CB 3.97Å; P431-V481 HydrophobicContact CG-CG1 3.49Å; P431-V481 VanDerWaalsContact CG-CG1 3.49Å; P431-I485 HydrophobicContact CB-CD1 4.27Å; P431-I485 WeakPolarHBondContact O-CD1 3.45Å
432	G	86.4	Confident	90.2	Very high	54 Å²	54	37.5 Å²	37.5	56%	0.557	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-24	-172.3	0	0	0	0	0	115.3	S430	S430-G432 PolarHBondContact O-N 3.21Å
433	H	88.4	Confident	90.4	Very high	92 Å²	92	37.9 Å²	37.9	43%	0.426	22%	0.218	S	C	.	.	S	Bend	trans	-115.5	95.6	170.7	-64.6	86.9	0	0	0	108.4	A359 P431 D435 R436 F437	A359-H433 PolarHBondContact O-CE1 3.43Å; A359-H433 PolarHBondContact O-ND1 3.46Å; P431-H433 PolarHBondContact O-N 2.98Å; P431-H433 VanDerWaalsContact O-N 3.11Å; H433-D435 PolarHBondContact O-N 3.39Å; H433-R436 HydrophobicContact CB-CB 3.92Å; H433-R436 PolarHBondContact O-N 2.76Å; H433-F437 WeakPolarHBondContact O-CB 3.32Å; H433-F437 PolarHBondContact O-N 3.5Å
434	P	91	Very high	90.6	Very high	11 Å²	11	32 Å²	32	7%	0.071	19%	0.186	C	C	.	.	H	α-helix	trans	-68.4	-32.8	-167.3	27	-35.8	0	0	0	113.3	F437 Y438 Y482 I485 R486 E489	P434-F437 PolarHBondContact O-N 3.4Å; P434-Y438 WeakPolarHBondContact O-CB 3.5Å; P434-Y438 PolarHBondContact O-N 3.37Å; P434-Y482 HydrophobicContact CB-CD2 4.03Å; P434-Y482 HydrophobicContact CB-CE2 3.76Å; P434-Y482 WeakPolarHBondContact O-CE2 3.44Å; P434-I485 HydrophobicContact CB-CG2 4.32Å; P434-I485 HydrophobicContact CG-CG2 3.9Å; P434-R486 HydrophobicContact CB-CG 4.46Å; P434-E489 VanDerWaalsContact CG-OE1 3.32Å; P434-E489 WeakPolarHBondContact CG-OE1 3.3Å
435	D	91.5	Very high	90.8	Very high	81 Å²	81	30.9 Å²	30.9	43%	0.433	18%	0.18	S	C	.	.	H	α-helix	trans	-65.6	-43.2	175.7	-57.4	-39.9	0	0	0	111.7	I363 H433 Y438 S439 R486	I363-D435 HydrophobicContact CD1-CB 3.83Å; H433-D435 PolarHBondContact O-N 3.39Å; D435-Y438 PolarHBondContact O-N 2.97Å; D435-S439 PolarHBondContact O-N 3.23Å; D435-S439 VanDerWaalsContact O-N 3.1Å; D435-S439 PolarHBondContact O-OG 2.99Å; D435-R486 IonicContact OD1-CZ 2.67Å; D435-R486 VanDerWaalsContact OD1-CZ 3.26Å; D435-R486 IonicContact OD1-NH1 3.85Å; D435-R486 PolarHBondContact OD1-NH1 3.32Å; D435-R486 IonicContact OD1-NH2 3.35Å; D435-R486 PolarHBondContact OD1-NH2 2.57Å
436	R	90.8	Very high	91	Very high	7 Å²	7	34.7 Å²	34.7	3%	0.026	20%	0.2	C	C	.	.	H	α-helix	trans	-61.9	-49.4	173.3	-174.5	174.6	179.3	-102.9	2.5	110.4	E355 L356 H358 I363 E427 H433 Y438 S439 L440	E355-R436 PolarHBondContact O-NH2 3.37Å; L356-R436 VanDerWaalsContact C-NH2 3.28Å; L356-R436 PolarHBondContact O-NH2 2.86Å; H358-R436 PolarHBondContact O-NH2 3.44Å; I363-R436 HydrophobicContact CG1-CB 4.38Å; E427-R436 PolarHBondContact O-NH1 3.39Å; H433-R436 HydrophobicContact CB-CB 3.92Å; H433-R436 PolarHBondContact O-N 2.76Å; R436-Y438 VanDerWaalsContact C-N 3.31Å; R436-Y438 PolarHBondContact O-N 3.24Å; R436-S439 PolarHBondContact O-N 3.4Å; R436-S439 PolarHBondContact O-OG 3.02Å; R436-L440 HydrophobicContact CG-CD1 3.85Å; R436-L440 HydrophobicContact CG-CG 4.35Å; R436-L440 VanDerWaalsContact O-CG 3.31Å; R436-L440 WeakPolarHBondContact O-CG 3.35Å; R436-L440 PolarHBondContact O-N 3.05Å
437	F	93.1	Very high	91.3	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.009	18%	0.177	C	C	.	.	H	α-helix	trans	-55.8	-44.8	177	-177.2	-85.1	0	0	0	112	F429 P431 H433 P434 Y441 W477 L479 Y482	F429-F437 WeakPolarHBondContact O-CE2 3.4Å; P431-F437 HydrophobicContact CB-CD2 4.12Å; P431-F437 HydrophobicContact CB-CE2 4.17Å; H433-F437 WeakPolarHBondContact O-CB 3.32Å; H433-F437 PolarHBondContact O-N 3.5Å; P434-F437 PolarHBondContact O-N 3.4Å; F437-Y441 WeakPolarHBondContact O-CB 3.45Å; F437-Y441 PolarHBondContact O-N 2.9Å; F437-W477 HydrophobicContact CD2-CE3 4.03Å; F437-W477 HydrophobicContact CD2-CZ3 4Å; F437-W477 HydrophobicContact CE1-CE3 4.16Å; F437-W477 AromaticContact CE2-CE3 3.49Å; F437-W477 HydrophobicContact CE2-CE3 3.49Å; F437-W477 VanDerWaalsContact CE2-CE3 3.49Å; F437-W477 AromaticContact CE2-CZ3 3.95Å; F437-W477 HydrophobicContact CE2-CZ3 3.95Å; F437-W477 HydrophobicContact CG-CZ3 4.44Å; F437-W477 HydrophobicContact CZ-CB 4.38Å; F437-W477 AromaticContact CZ-CE3 3.58Å; F437-W477 HydrophobicContact CZ-CE3 3.58Å; F437-W477 HydrophobicContact CZ-CZ3 4.31Å; F437-L479 HydrophobicContact CE1-CD2 4Å; F437-L479 HydrophobicContact CZ-CD2 4.21Å; F437-Y482 HydrophobicContact CB-CD2 4.25Å; F437-Y482 AromaticContact CD1-CD2 3.25Å; F437-Y482 HydrophobicContact CD1-CD2 3.25Å; F437-Y482 AromaticContact CD1-CE2 3.84Å; F437-Y482 HydrophobicContact CD1-CE2 3.84Å; F437-Y482 AromaticContact CD1-CG 3.76Å; F437-Y482 HydrophobicContact CD1-CG 3.76Å; F437-Y482 AromaticContact CE1-CD2 3.77Å; F437-Y482 HydrophobicContact CE1-CD2 3.77Å; F437-Y482 AromaticContact CE1-CG 3.76Å; F437-Y482 HydrophobicContact CE1-CG 3.76Å; F437-Y482 AromaticContact CG-CD2 3.97Å; F437-Y482 HydrophobicContact CG-CD2 3.97Å
438	Y	93.6	Very high	91.7	Very high	48 Å²	48	28.6 Å²	28.6	19%	0.188	16%	0.164	C	C	.	.	H	α-helix	trans	-59.2	-49.7	178	175.4	-88	0	0	0	112.4	P434 D435 R436 T442 G531 Y533 L534	P434-Y438 WeakPolarHBondContact O-CB 3.5Å; P434-Y438 PolarHBondContact O-N 3.37Å; D435-Y438 PolarHBondContact O-N 2.97Å; R436-Y438 VanDerWaalsContact C-N 3.31Å; R436-Y438 PolarHBondContact O-N 3.24Å; Y438-T442 WeakPolarHBondContact O-CB 3.46Å; Y438-T442 PolarHBondContact O-N 3.11Å; Y438-T442 PolarHBondContact O-OG1 3.1Å; Y438-G531 WeakPolarHBondContact CD2-O 3.38Å; Y438-G531 VanDerWaalsContact CZ-CA 3.49Å; Y438-G531 PolarHBondContact OH-N 3.48Å; Y438-Y533 VanDerWaalsContact CE2-O 3.31Å; Y438-Y533 WeakPolarHBondContact CE2-O 3.41Å; Y438-L534 HydrophobicContact CD2-CD2 3.46Å; Y438-L534 VanDerWaalsContact CD2-CD2 3.46Å; Y438-L534 HydrophobicContact CD2-CG 3.92Å; Y438-L534 HydrophobicContact CE2-CD2 3.46Å; Y438-L534 VanDerWaalsContact CE2-CD2 3.46Å; Y438-L534 HydrophobicContact CE2-CG 4.11Å
439	S	92.4	Very high	91.7	Very high	21 Å²	21	33.5 Å²	33.5	15%	0.147	19%	0.185	C	C	.	.	H	α-helix	trans	-63.4	-47.5	-178.1	63.4	0	0	0	0	111.6	D435 R436 T442 I443	D435-S439 PolarHBondContact O-N 3.23Å; D435-S439 VanDerWaalsContact O-N 3.1Å; D435-S439 PolarHBondContact O-OG 2.99Å; R436-S439 PolarHBondContact O-N 3.4Å; R436-S439 PolarHBondContact O-OG 3.02Å; S439-T442 PolarHBondContact O-N 2.86Å; S439-I443 WeakPolarHBondContact O-CG1 3.25Å; S439-I443 PolarHBondContact O-N 2.82Å; S439-I443 VanDerWaalsContact O-N 3.13Å
440	L	93	Very high	91.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65.6	-44.5	179	-60.2	178.6	0	0	0	111.3	L356 A366 L370 I428 R436 T442 I443 S444 W477	L356-L440 HydrophobicContact CD2-CD2 4.11Å; A366-L440 HydrophobicContact CB-CD2 4.34Å; L370-L440 HydrophobicContact CB-CD2 4.14Å; L370-L440 HydrophobicContact CD2-CB 4.08Å; L370-L440 HydrophobicContact CD2-CD2 3.7Å; L370-L440 HydrophobicContact CD2-CG 4.43Å; I428-L440 HydrophobicContact CB-CD1 4.05Å; I428-L440 HydrophobicContact CG2-CD1 4.35Å; R436-L440 HydrophobicContact CG-CD1 3.85Å; R436-L440 HydrophobicContact CG-CG 4.35Å; R436-L440 VanDerWaalsContact O-CG 3.31Å; R436-L440 WeakPolarHBondContact O-CG 3.35Å; R436-L440 PolarHBondContact O-N 3.05Å; L440-T442 VanDerWaalsContact C-N 3.34Å; L440-T442 PolarHBondContact O-N 3.03Å; L440-I443 PolarHBondContact O-N 3.34Å; L440-S444 WeakPolarHBondContact O-CB 3.41Å; L440-S444 PolarHBondContact O-N 3.39Å; L440-S444 PolarHBondContact O-OG 2.91Å; L440-S444 VanDerWaalsContact O-OG 3.11Å; L440-W477 HydrophobicContact CB-CH2 3.96Å; L440-W477 HydrophobicContact CB-CZ3 4.49Å
441	Y	94	Very high	91.9	Very high	16 Å²	16	33.7 Å²	33.7	6%	0.063	19%	0.186	C	C	.	.	H	α-helix	trans	-56.9	-47	175.5	174.7	-93.4	0	0	0	111.5	F437 I443 S444 M445 W477 L479 L534 K536	F437-Y441 WeakPolarHBondContact O-CB 3.45Å; F437-Y441 PolarHBondContact O-N 2.9Å; Y441-I443 VanDerWaalsContact C-N 3.32Å; Y441-I443 PolarHBondContact O-N 3.27Å; Y441-S444 PolarHBondContact O-N 3.13Å; Y441-M445 HydrophobicContact CD1-CG 3.98Å; Y441-M445 HydrophobicContact CD2-CE 3.9Å; Y441-M445 HydrophobicContact CD2-CG 4.33Å; Y441-M445 HydrophobicContact CE1-CG 3.5Å; Y441-M445 HydrophobicContact CE1-SD 4.37Å; Y441-M445 HydrophobicContact CE2-CE 3.56Å; Y441-M445 HydrophobicContact CE2-CG 3.91Å; Y441-M445 HydrophobicContact CE2-SD 3.83Å; Y441-M445 HydrophobicContact CG-CG 4.37Å; Y441-M445 VanDerWaalsContact CZ-CG 3.46Å; Y441-M445 VanDerWaalsContact O-CG 3.3Å; Y441-M445 WeakPolarHBondContact O-CG 3.46Å; Y441-M445 PolarHBondContact O-N 2.88Å; Y441-W477 HydrophobicContact CD2-CB 4.12Å; Y441-W477 AromaticContact CD2-CD2 3.67Å; Y441-W477 HydrophobicContact CD2-CD2 3.67Å; Y441-W477 AromaticContact CD2-CE3 3.76Å; Y441-W477 HydrophobicContact CD2-CE3 3.76Å; Y441-W477 AromaticContact CD2-CG 3.82Å; Y441-W477 HydrophobicContact CD2-CG 3.82Å; Y441-W477 HydrophobicContact CD2-CZ3 4.46Å; Y441-W477 HydrophobicContact CE2-CB 4.24Å; Y441-W477 HydrophobicContact CE2-CG 4.21Å; Y441-W477 HydrophobicContact CG-CE3 4.32Å; Y441-L479 HydrophobicContact CD2-CD2 4.11Å; Y441-L479 HydrophobicContact CE2-CD1 4.49Å; Y441-L479 HydrophobicContact CE2-CD2 3.76Å; Y441-L534 HydrophobicContact CD1-CD1 4.19Å; Y441-L534 HydrophobicContact CD1-CD2 3.63Å; Y441-L534 HydrophobicContact CE1-CD1 4.34Å; Y441-L534 HydrophobicContact CE1-CD2 3.82Å; Y441-K536 VanDerWaalsContact OH-CD 3.24Å; Y441-K536 WeakPolarHBondContact OH-CD 3.42Å; Y441-K536 WeakPolarHBondContact OH-CE 3.35Å
442	T	93.2	Very high	92	Very high	45 Å²	45	34 Å²	34	28%	0.276	19%	0.185	S	C	.	.	H	α-helix	trans	-60.9	-43	-179.3	-58.4	0	0	0	0	111.4	Y438 S439 L440 M445 N446	Y438-T442 WeakPolarHBondContact O-CB 3.46Å; Y438-T442 PolarHBondContact O-N 3.11Å; Y438-T442 PolarHBondContact O-OG1 3.1Å; S439-T442 PolarHBondContact O-N 2.86Å; L440-T442 VanDerWaalsContact C-N 3.34Å; L440-T442 PolarHBondContact O-N 3.03Å; T442-M445 PolarHBondContact O-N 3.28Å; T442-N446 PolarHBondContact O-N 2.77Å; T442-N446 PolarHBondContact O-ND2 3.25Å
443	I	93.8	Very high	92.1	Very high	26 Å²	26	36.7 Å²	36.7	13%	0.133	19%	0.191	C	C	.	.	H	α-helix	trans	-64.8	-44.3	176.8	-69.8	165.6	0	0	0	110.9	A367 L370 N371 Y374 S439 L440 Y441 M445 N446 F447	A367-I443 HydrophobicContact CB-CD1 3.52Å; A367-I443 WeakPolarHBondContact O-CD1 3.45Å; L370-I443 HydrophobicContact CD2-CG2 4.3Å; L370-I443 HydrophobicContact CG-CG2 4.27Å; N371-I443 HydrophobicContact CB-CD1 4.42Å; N371-I443 HydrophobicContact CB-CG2 3.98Å; Y374-I443 HydrophobicContact CD2-CG2 3.62Å; Y374-I443 HydrophobicContact CE2-CG2 3.82Å; S439-I443 WeakPolarHBondContact O-CG1 3.25Å; S439-I443 PolarHBondContact O-N 2.82Å; S439-I443 VanDerWaalsContact O-N 3.13Å; L440-I443 PolarHBondContact O-N 3.34Å; Y441-I443 VanDerWaalsContact C-N 3.32Å; Y441-I443 PolarHBondContact O-N 3.27Å; I443-M445 VanDerWaalsContact C-N 3.34Å; I443-M445 PolarHBondContact O-N 3.41Å; I443-N446 PolarHBondContact O-N 3.44Å; I443-F447 PolarHBondContact O-N 2.93Å
444	S	94.2	Very high	92	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63	-36.9	175.8	-63.8	0	0	0	0	113.2	Y374 L440 Y441 F447 I448 W477	Y374-S444 PolarHBondContact OH-OG 3.39Å; L440-S444 WeakPolarHBondContact O-CB 3.41Å; L440-S444 PolarHBondContact O-N 3.39Å; L440-S444 PolarHBondContact O-OG 2.91Å; L440-S444 VanDerWaalsContact O-OG 3.11Å; Y441-S444 PolarHBondContact O-N 3.13Å; S444-F447 WeakPolarHBondContact O-CB 3.49Å; S444-F447 PolarHBondContact O-N 2.86Å; S444-I448 WeakPolarHBondContact O-CG1 3.36Å; S444-I448 PolarHBondContact O-N 3.36Å; S444-W477 WeakPolarHBondContact OG-CZ2 3.47Å
445	M	93.3	Very high	91.5	Very high	26 Å²	26	34.6 Å²	34.6	13%	0.128	18%	0.182	C	C	.	.	H	α-helix	trans	-69.6	-36.3	175.2	-66.3	-52.8	107.1	0	0	111.9	Y441 T442 I443 F447 I448 K449 F473	Y441-M445 HydrophobicContact CD1-CG 3.98Å; Y441-M445 HydrophobicContact CD2-CE 3.9Å; Y441-M445 HydrophobicContact CD2-CG 4.33Å; Y441-M445 HydrophobicContact CE1-CG 3.5Å; Y441-M445 HydrophobicContact CE1-SD 4.37Å; Y441-M445 HydrophobicContact CE2-CE 3.56Å; Y441-M445 HydrophobicContact CE2-CG 3.91Å; Y441-M445 HydrophobicContact CE2-SD 3.83Å; Y441-M445 HydrophobicContact CG-CG 4.37Å; Y441-M445 VanDerWaalsContact CZ-CG 3.46Å; Y441-M445 VanDerWaalsContact O-CG 3.3Å; Y441-M445 WeakPolarHBondContact O-CG 3.46Å; Y441-M445 PolarHBondContact O-N 2.88Å; T442-M445 PolarHBondContact O-N 3.28Å; I443-M445 VanDerWaalsContact C-N 3.34Å; I443-M445 PolarHBondContact O-N 3.41Å; M445-F447 VanDerWaalsContact C-N 3.34Å; M445-I448 HydrophobicContact CE-CD1 3.6Å; M445-I448 PolarHBondContact O-N 3.38Å; M445-I448 HydrophobicContact SD-CD1 3.85Å; M445-K449 WeakPolarHBondContact O-CG 3.33Å; M445-K449 PolarHBondContact O-N 3.4Å; M445-F473 HydrophobicContact CE-CE1 4.37Å
446	N	92.8	Very high	90.7	Very high	81 Å²	81	35.2 Å²	35.2	43%	0.433	18%	0.178	S	C	.	.	H	α-helix	trans	-66.8	-37.5	172.9	-72	-19.2	0	0	0	111.8	T442 I443 K449 T450	T442-N446 PolarHBondContact O-N 2.77Å; T442-N446 PolarHBondContact O-ND2 3.25Å; I443-N446 PolarHBondContact O-N 3.44Å; N446-K449 PolarHBondContact O-N 3.46Å; N446-T450 WeakPolarHBondContact O-CB 3.31Å; N446-T450 PolarHBondContact O-N 3.36Å; N446-T450 PolarHBondContact O-OG1 2.85Å
447	F	93.8	Very high	90	Very high	5 Å²	5	37.7 Å²	37.7	2%	0.022	20%	0.196	C	C	.	.	H	α-helix	trans	-59.4	-48.9	171.4	171.3	-107.8	0	0	0	111.4	Y374 L378 F413 W414 T417 I443 S444 M445 K449 T450 V451	Y374-F447 HydrophobicContact CD1-CB 4.38Å; Y374-F447 HydrophobicContact CD1-CD1 4.07Å; Y374-F447 AromaticContact CD1-CD2 3.89Å; Y374-F447 HydrophobicContact CD1-CD2 3.89Å; Y374-F447 HydrophobicContact CD1-CE1 4.32Å; Y374-F447 HydrophobicContact CD1-CE2 4.15Å; Y374-F447 AromaticContact CD1-CG 3.84Å; Y374-F447 HydrophobicContact CD1-CG 3.84Å; Y374-F447 HydrophobicContact CD1-CZ 4.35Å; Y374-F447 HydrophobicContact CD2-CB 3.63Å; Y374-F447 HydrophobicContact CD2-CD2 4.42Å; Y374-F447 HydrophobicContact CD2-CG 4.01Å; Y374-F447 HydrophobicContact CE1-CD1 4.05Å; Y374-F447 HydrophobicContact CE1-CE1 4.34Å; Y374-F447 HydrophobicContact CE1-CG 4.22Å; Y374-F447 HydrophobicContact CE2-CB 3.97Å; Y374-F447 HydrophobicContact CE2-CG 4.36Å; Y374-F447 HydrophobicContact CG-CB 3.86Å; Y374-F447 HydrophobicContact CG-CD1 4.4Å; Y374-F447 AromaticContact CG-CD2 3.76Å; Y374-F447 HydrophobicContact CG-CD2 3.76Å; Y374-F447 HydrophobicContact CG-CE2 4.41Å; Y374-F447 AromaticContact CG-CG 3.74Å; Y374-F447 HydrophobicContact CG-CG 3.74Å; L378-F447 HydrophobicContact CD1-CD2 4.16Å; L378-F447 HydrophobicContact CD2-CD2 4.11Å; L378-F447 HydrophobicContact CD2-CE2 3.85Å; L378-F447 HydrophobicContact CG-CD2 3.98Å; L378-F447 HydrophobicContact CG-CE2 3.87Å; F413-F447 HydrophobicContact CE1-CZ 4.2Å; F413-F447 HydrophobicContact CZ-CZ 4.37Å; W414-F447 HydrophobicContact CH2-CE1 4.42Å; W414-F447 HydrophobicContact CZ3-CD1 4.47Å; W414-F447 AromaticContact CZ3-CE1 3.8Å; W414-F447 HydrophobicContact CZ3-CE1 3.8Å; W414-F447 HydrophobicContact CZ3-CZ 4.45Å; T417-F447 HydrophobicContact CG2-CE1 4.28Å; T417-F447 HydrophobicContact CG2-CZ 3.99Å; I443-F447 PolarHBondContact O-N 2.93Å; S444-F447 WeakPolarHBondContact O-CB 3.49Å; S444-F447 PolarHBondContact O-N 2.86Å; M445-F447 VanDerWaalsContact C-N 3.34Å; F447-K449 PolarHBondContact O-N 3Å; F447-T450 PolarHBondContact O-N 2.85Å; F447-T450 VanDerWaalsContact O-N 3.13Å; F447-V451 HydrophobicContact CD2-CG2 4.25Å; F447-V451 HydrophobicContact CE1-CG2 4.21Å; F447-V451 HydrophobicContact CE2-CG2 3.82Å; F447-V451 HydrophobicContact CZ-CG2 3.8Å; F447-V451 WeakPolarHBondContact O-CG2 3.3Å; F447-V451 PolarHBondContact O-N 3.39Å
448	I	93	Very high	89.5	Confident	8 Å²	8	42.9 Å²	42.9	4%	0.041	23%	0.229	C	C	.	.	H	α-helix	trans	-54.8	-52.3	174.6	-71.3	159.4	0	0	0	110.9	W414 S444 M445 T450 V451 E452 Y470 F473	W414-I448 HydrophobicContact CH2-CG1 3.82Å; S444-I448 WeakPolarHBondContact O-CG1 3.36Å; S444-I448 PolarHBondContact O-N 3.36Å; M445-I448 HydrophobicContact CE-CD1 3.6Å; M445-I448 PolarHBondContact O-N 3.38Å; M445-I448 HydrophobicContact SD-CD1 3.85Å; I448-T450 PolarHBondContact O-N 2.73Å; I448-V451 PolarHBondContact O-N 2.92Å; I448-E452 HydrophobicContact CG2-CG 4.14Å; I448-E452 WeakPolarHBondContact O-CG 3.48Å; I448-E452 PolarHBondContact O-N 2.97Å; I448-Y470 HydrophobicContact CG2-CE2 3.88Å; I448-F473 HydrophobicContact CD1-CD1 3.9Å; I448-F473 HydrophobicContact CD1-CE1 3.71Å; I448-F473 HydrophobicContact CG1-CD1 4.48Å; I448-F473 HydrophobicContact CG1-CE1 4.22Å
449	K	91	Very high	88.9	Confident	104 Å²	104	46.1 Å²	46.1	45%	0.452	25%	0.249	S	C	.	.	H	α-helix	trans	-55.5	-39	179.5	-73.2	175.6	-179.2	179.3	0	111.9	M445 N446 F447 E452 T453	M445-K449 WeakPolarHBondContact O-CG 3.33Å; M445-K449 PolarHBondContact O-N 3.4Å; N446-K449 PolarHBondContact O-N 3.46Å; F447-K449 PolarHBondContact O-N 3Å; K449-E452 PolarHBondContact O-N 3.36Å; K449-T453 WeakPolarHBondContact O-CG2 3.3Å; K449-T453 PolarHBondContact O-N 3.39Å; K449-T453 VanDerWaalsContact O-N 3.09Å
450	T	91.6	Very high	88.4	Confident	55 Å²	55	45.7 Å²	45.7	34%	0.337	25%	0.245	S	C	.	.	H	α-helix	trans	-73	-30	178.9	-49.8	0	0	0	0	112.7	L378 N446 F447 I448 T453 K454	L378-T450 HydrophobicContact CD1-CG2 3.65Å; L378-T450 HydrophobicContact CD2-CG2 4.09Å; N446-T450 WeakPolarHBondContact O-CB 3.31Å; N446-T450 PolarHBondContact O-N 3.36Å; N446-T450 PolarHBondContact O-OG1 2.85Å; F447-T450 PolarHBondContact O-N 2.85Å; F447-T450 VanDerWaalsContact O-N 3.13Å; I448-T450 PolarHBondContact O-N 2.73Å; T450-T453 PolarHBondContact O-OG1 3.07Å; T450-K454 WeakPolarHBondContact O-CG 3.39Å
451	V	91.2	Very high	88.1	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-73.7	-40.8	172.2	175	0	0	0	0	110.5	L378 L381 L409 F413 W414 F447 I448 T453 K454 L464	L378-V451 HydrophobicContact CD2-CG2 3.84Å; L381-V451 HydrophobicContact CD2-CG2 4.46Å; L409-V451 HydrophobicContact CD1-CG1 4.43Å; L409-V451 HydrophobicContact CD2-CG1 4.15Å; L409-V451 HydrophobicContact CG-CG1 4.49Å; F413-V451 HydrophobicContact CE1-CG2 4.4Å; W414-V451 HydrophobicContact CE3-CG1 3.9Å; W414-V451 HydrophobicContact CE3-CG2 4.49Å; W414-V451 HydrophobicContact CZ3-CB 4.23Å; W414-V451 HydrophobicContact CZ3-CG1 4.09Å; W414-V451 HydrophobicContact CZ3-CG2 4.14Å; F447-V451 HydrophobicContact CD2-CG2 4.25Å; F447-V451 HydrophobicContact CE1-CG2 4.21Å; F447-V451 HydrophobicContact CE2-CG2 3.82Å; F447-V451 HydrophobicContact CZ-CG2 3.8Å; F447-V451 WeakPolarHBondContact O-CG2 3.3Å; F447-V451 PolarHBondContact O-N 3.39Å; I448-V451 PolarHBondContact O-N 2.92Å; V451-T453 VanDerWaalsContact C-N 3.31Å; V451-T453 PolarHBondContact O-N 3Å; V451-K454 WeakPolarHBondContact O-CB 3.31Å; V451-K454 PolarHBondContact O-N 3.28Å; V451-L464 HydrophobicContact CG1-CD2 4.09Å
452	E	90.6	Very high	87.8	Confident	31 Å²	31	50.3 Å²	50.3	15%	0.145	27%	0.273	C	S	.	.	H	α-helix	trans	-60.2	-39.3	176.6	-71	-170.2	157.3	0	0	111.9	I448 K449 K454 T455 L461 L464 R465 Y470	I448-E452 HydrophobicContact CG2-CG 4.14Å; I448-E452 WeakPolarHBondContact O-CG 3.48Å; I448-E452 PolarHBondContact O-N 2.97Å; K449-E452 PolarHBondContact O-N 3.36Å; E452-K454 PolarHBondContact O-N 2.91Å; E452-T455 WeakPolarHBondContact O-CB 3.45Å; E452-T455 PolarHBondContact O-N 3.31Å; E452-T455 PolarHBondContact O-OG1 3.31Å; E452-L461 HydrophobicContact CB-CD1 3.77Å; E452-L461 HydrophobicContact CG-CD1 3.72Å; E452-L464 HydrophobicContact CG-CD2 4.22Å; E452-R465 VanDerWaalsContact CD-NH2 3.3Å; E452-R465 IonicContact OE1-CZ 3.95Å; E452-R465 IonicContact OE1-NE 3.66Å; E452-R465 PolarHBondContact OE1-NE 3.04Å; E452-R465 IonicContact OE1-NH2 3.78Å; E452-R465 PolarHBondContact OE1-NH2 2.95Å; E452-R465 IonicContact OE2-CZ 3.7Å; E452-R465 IonicContact OE2-NE 2.95Å; E452-R465 IonicContact OE2-NH2 2.82Å; E452-R465 PolarHBondContact OE2-NH2 3.09Å; E452-Y470 PolarHBondContact OE1-OH 3.29Å
453	T	88.3	Confident	87.5	Confident	112 Å²	112	52.5 Å²	52.5	69%	0.687	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-15.4	176.8	60.9	0	0	0	0	113.7	K449 T450 V451	K449-T453 WeakPolarHBondContact O-CG2 3.3Å; K449-T453 PolarHBondContact O-N 3.39Å; K449-T453 VanDerWaalsContact O-N 3.09Å; T450-T453 PolarHBondContact O-OG1 3.07Å; V451-T453 VanDerWaalsContact C-N 3.31Å; V451-T453 PolarHBondContact O-N 3Å
454	K	85.1	Confident	87.3	Confident	32 Å²	32	51.2 Å²	51.2	14%	0.139	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-4.6	176.3	-70.3	179.8	179.3	-162.3	0	113.6	L378 L381 D382 L385 L409 T450 V451 E452 W456	L378-K454 HydrophobicContact CD2-CD 4.43Å; L378-K454 PolarHBondContact O-NZ 3.37Å; L381-K454 HydrophobicContact CD2-CD 3.61Å; L381-K454 HydrophobicContact CG-CD 4.18Å; D382-K454 WeakPolarHBondContact OD1-CE 3.33Å; D382-K454 IonicContact OD1-NZ 2.67Å; D382-K454 PolarHBondContact OD1-NZ 3.48Å; D382-K454 IonicContact OD2-NZ 3.54Å; D382-K454 PolarHBondContact OD2-NZ 2.84Å; L385-K454 HydrophobicContact CD1-CB 4.04Å; L385-K454 HydrophobicContact CD1-CD 4.24Å; L409-K454 HydrophobicContact CD1-CB 4.29Å; T450-K454 WeakPolarHBondContact O-CG 3.39Å; V451-K454 WeakPolarHBondContact O-CB 3.31Å; V451-K454 PolarHBondContact O-N 3.28Å; E452-K454 PolarHBondContact O-N 2.91Å; K454-W456 PolarHBondContact O-NE1 2.8Å; K454-W456 VanDerWaalsContact O-NE1 3.09Å
455	T	82.3	Confident	87	Confident	26 Å²	26	56.7 Å²	56.7	16%	0.16	30%	0.297	C	S	.	.			trans	-70.5	146.7	172.4	63.8	0	0	0	0	110.8	L409 E452 Q460 L461 L464	L409-T455 HydrophobicContact CD1-CG2 4.41Å; L409-T455 HydrophobicContact CD2-CG2 4.34Å; E452-T455 WeakPolarHBondContact O-CB 3.45Å; E452-T455 PolarHBondContact O-N 3.31Å; E452-T455 PolarHBondContact O-OG1 3.31Å; T455-Q460 HydrophobicContact CG2-CG 4.2Å; T455-L461 HydrophobicContact CG2-CD1 4.35Å; T455-L464 HydrophobicContact CG2-CD2 4.05Å
456	W	74.6	Confident	86.9	Confident	95 Å²	95	61 Å²	61	36%	0.36	32%	0.32	S	S	.	.			trans	-105.6	-14.1	-172.8	-43.8	-33.1	0	0	0	113.8	L385 K389 I393 K454	L385-W456 HydrophobicContact CB-CZ2 4.14Å; L385-W456 HydrophobicContact CD2-CH2 4.02Å; L385-W456 HydrophobicContact CD2-CZ2 3.26Å; L385-W456 HydrophobicContact CG-CZ2 4.16Å; K389-W456 HydrophobicContact CB-CH2 3.54Å; K389-W456 HydrophobicContact CB-CZ2 3.61Å; K389-W456 HydrophobicContact CB-CZ3 4.27Å; K389-W456 HydrophobicContact CD-CD2 3.78Å; K389-W456 VanDerWaalsContact CD-CE2 3.42Å; K389-W456 HydrophobicContact CD-CE3 4.18Å; K389-W456 HydrophobicContact CD-CG 4.35Å; K389-W456 HydrophobicContact CD-CH2 3.94Å; K389-W456 HydrophobicContact CD-CZ2 3.47Å; K389-W456 VanDerWaalsContact CD-CZ2 3.47Å; K389-W456 HydrophobicContact CD-CZ3 4.27Å; K389-W456 HydrophobicContact CG-CD2 4.27Å; K389-W456 HydrophobicContact CG-CE3 4.17Å; K389-W456 HydrophobicContact CG-CH2 3.58Å; K389-W456 HydrophobicContact CG-CZ2 3.64Å; K389-W456 HydrophobicContact CG-CZ3 3.85Å; I393-W456 HydrophobicContact CD1-CZ3 4.18Å; K454-W456 PolarHBondContact O-NE1 2.8Å; K454-W456 VanDerWaalsContact O-NE1 3.09Å
457	S	76.1	Confident	86.8	Confident	58 Å²	58	59.4 Å²	59.4	41%	0.406	31%	0.31	S	S	.	.	S	Bend	trans	-140	153.3	178.3	72.1	0	0	0	0	110.6	N459 Q460 L461	S457-N459 PolarHBondContact O-N 3Å; S457-Q460 PolarHBondContact O-N 3.21Å; S457-Q460 VanDerWaalsContact OG-CB 3.3Å; S457-Q460 WeakPolarHBondContact OG-CB 3.3Å; S457-Q460 PolarHBondContact OG-N 3.4Å; S457-L461 PolarHBondContact O-N 3.34Å; S457-L461 VanDerWaalsContact O-N 3.09Å
458	T	82.4	Confident	86.7	Confident	112 Å²	112	63.9 Å²	63.9	69%	0.687	34%	0.34	S	S	*	.	H	α-helix	trans	-60.3	-37.8	174	48.4	0	0	0	0	111.3	Q460 L461 V462	T458-Q460 PolarHBondContact O-N 3.36Å; T458-L461 PolarHBondContact O-N 3.15Å; T458-V462 WeakPolarHBondContact O-CG2 3.46Å; T458-V462 PolarHBondContact O-N 3.06Å
459	N	80.3	Confident	86.7	Confident	116 Å²	116	63.8 Å²	63.8	62%	0.62	34%	0.34	S	S	*	.	H	α-helix	trans	-61.7	-42	174.6	-72	-16	0	0	0	112.1	S457 L461 V462 N463	S457-N459 PolarHBondContact O-N 3Å; N459-L461 PolarHBondContact O-N 3.48Å; N459-V462 PolarHBondContact O-N 3.19Å; N459-N463 WeakPolarHBondContact O-CB 3.3Å; N459-N463 PolarHBondContact O-N 2.76Å; N459-N463 PolarHBondContact O-ND2 3.44Å; N459-N463 PolarHBondContact O-OD1 3.18Å
460	Q	81.8	Confident	86.8	Confident	11 Å²	11	60.2 Å²	60.2	5%	0.051	32%	0.324	C	S	.	.	H	α-helix	trans	-64.2	-40.5	176.3	-177.6	174.4	49.6	0	0	111.8	D407 V410 T455 S457 T458 N463 L464	D407-Q460 PolarHBondContact OD1-NE2 2.96Å; D407-Q460 VanDerWaalsContact OD2-CG 3.31Å; D407-Q460 WeakPolarHBondContact OD2-CG 3.28Å; D407-Q460 PolarHBondContact OD2-NE2 3.27Å; V410-Q460 HydrophobicContact CG2-CG 3.74Å; T455-Q460 HydrophobicContact CG2-CG 4.2Å; S457-Q460 PolarHBondContact O-N 3.21Å; S457-Q460 VanDerWaalsContact OG-CB 3.3Å; S457-Q460 WeakPolarHBondContact OG-CB 3.3Å; S457-Q460 PolarHBondContact OG-N 3.4Å; T458-Q460 PolarHBondContact O-N 3.36Å; Q460-N463 PolarHBondContact O-N 3.49Å; Q460-L464 WeakPolarHBondContact O-CB 3.36Å; Q460-L464 PolarHBondContact O-N 3.09Å
461	L	87.2	Confident	86.7	Confident	40 Å²	40	60.2 Å²	60.2	21%	0.209	33%	0.327	C	S	.	.	H	α-helix	trans	-63.1	-41.6	175.1	-178.8	63.5	0	0	0	112	E452 T455 S457 T458 N459 L464 R465	E452-L461 HydrophobicContact CB-CD1 3.77Å; E452-L461 HydrophobicContact CG-CD1 3.72Å; T455-L461 HydrophobicContact CG2-CD1 4.35Å; S457-L461 PolarHBondContact O-N 3.34Å; S457-L461 VanDerWaalsContact O-N 3.09Å; T458-L461 PolarHBondContact O-N 3.15Å; N459-L461 PolarHBondContact O-N 3.48Å; L461-L464 PolarHBondContact O-N 2.77Å; L461-R465 WeakPolarHBondContact O-CG 3.3Å; L461-R465 PolarHBondContact O-N 2.69Å
462	V	87.6	Confident	86.8	Confident	74 Å²	74	63.3 Å²	63.3	45%	0.448	34%	0.342	S	S	.	.	H	α-helix	trans	-63.6	-44.6	174.7	171.9	0	0	0	0	110.5	T458 N459 L464 R465 N466	T458-V462 WeakPolarHBondContact O-CG2 3.46Å; T458-V462 PolarHBondContact O-N 3.06Å; N459-V462 PolarHBondContact O-N 3.19Å; V462-L464 VanDerWaalsContact C-N 3.34Å; V462-L464 PolarHBondContact O-N 3.24Å; V462-R465 PolarHBondContact O-N 3.28Å; V462-N466 WeakPolarHBondContact CG1-ND2 3.15Å; V462-N466 VanDerWaalsContact O-CB 3.3Å; V462-N466 WeakPolarHBondContact O-CB 3.49Å; V462-N466 VanDerWaalsContact O-CG 3.28Å; V462-N466 PolarHBondContact O-N 3.06Å; V462-N466 PolarHBondContact O-ND2 2.94Å
463	N	86.9	Confident	86.9	Confident	90 Å²	90	61.9 Å²	61.9	48%	0.481	34%	0.335	S	S	.	.	H	α-helix	trans	-62.9	-40.1	177.2	-70.3	-13	0	0	0	111.9	V410 N459 Q460 N466 H467	V410-N463 HydrophobicContact CG1-CB 4.19Å; N459-N463 WeakPolarHBondContact O-CB 3.3Å; N459-N463 PolarHBondContact O-N 2.76Å; N459-N463 PolarHBondContact O-ND2 3.44Å; N459-N463 PolarHBondContact O-OD1 3.18Å; Q460-N463 PolarHBondContact O-N 3.49Å; N463-N466 PolarHBondContact O-N 2.85Å; N463-H467 WeakPolarHBondContact O-CB 3.31Å; N463-H467 PolarHBondContact O-N 2.99Å
464	L	89.2	Confident	87.1	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.2	-49.2	174.3	-177.6	63.3	0	0	0	111.4	L409 V410 W414 V451 E452 T455 Q460 L461 V462 N466 H467 Y470	L409-L464 HydrophobicContact CD2-CD1 3.83Å; L409-L464 HydrophobicContact CD2-CD2 4.06Å; L409-L464 HydrophobicContact CD2-CG 4.45Å; V410-L464 HydrophobicContact CG2-CB 3.93Å; V410-L464 HydrophobicContact CG2-CD1 4.3Å; W414-L464 HydrophobicContact CB-CD1 3.92Å; W414-L464 HydrophobicContact CD2-CD1 3.75Å; W414-L464 HydrophobicContact CE3-CD1 4.33Å; W414-L464 HydrophobicContact CG-CD1 3.51Å; V451-L464 HydrophobicContact CG1-CD2 4.09Å; E452-L464 HydrophobicContact CG-CD2 4.22Å; T455-L464 HydrophobicContact CG2-CD2 4.05Å; Q460-L464 WeakPolarHBondContact O-CB 3.36Å; Q460-L464 PolarHBondContact O-N 3.09Å; L461-L464 PolarHBondContact O-N 2.77Å; V462-L464 VanDerWaalsContact C-N 3.34Å; V462-L464 PolarHBondContact O-N 3.24Å; L464-N466 VanDerWaalsContact C-N 3.33Å; L464-N466 PolarHBondContact O-N 3.01Å; L464-H467 VanDerWaalsContact O-CB 3.28Å; L464-H467 WeakPolarHBondContact O-CB 3.28Å; L464-H467 PolarHBondContact O-N 3.38Å; L464-Y470 HydrophobicContact CG-CD2 4.41Å; L464-Y470 WeakPolarHBondContact O-CB 3.34Å
465	R	88.9	Confident	87.3	Confident	114 Å²	114	63.2 Å²	63.2	43%	0.43	34%	0.339	S	S	.	.	H	α-helix	trans	-68.8	-30.5	-178.7	-72.8	178.1	173	169.6	2.7	113	E452 L461 V462 H467 Y470	E452-R465 VanDerWaalsContact CD-NH2 3.3Å; E452-R465 IonicContact OE1-CZ 3.95Å; E452-R465 IonicContact OE1-NE 3.66Å; E452-R465 PolarHBondContact OE1-NE 3.04Å; E452-R465 IonicContact OE1-NH2 3.78Å; E452-R465 PolarHBondContact OE1-NH2 2.95Å; E452-R465 IonicContact OE2-CZ 3.7Å; E452-R465 IonicContact OE2-NE 2.95Å; E452-R465 IonicContact OE2-NH2 2.82Å; E452-R465 PolarHBondContact OE2-NH2 3.09Å; L461-R465 WeakPolarHBondContact O-CG 3.3Å; L461-R465 PolarHBondContact O-N 2.69Å; V462-R465 PolarHBondContact O-N 3.28Å; R465-H467 VanDerWaalsContact C-N 3.35Å; R465-Y470 HydrophobicContact CB-CE1 4.37Å; R465-Y470 HydrophobicContact CG-CE1 4.24Å; R465-Y470 VanDerWaalsContact O-CD1 3.3Å; R465-Y470 WeakPolarHBondContact O-CD1 3.37Å
466	N	90.3	Very high	87.8	Confident	116 Å²	116	67.2 Å²	67.2	62%	0.62	35%	0.354	S	S	*	.	H	α-helix	trans	-85.8	-7.3	175.8	-69.4	-18.5	0	0	0	113.1	V462 N463 L464	V462-N466 WeakPolarHBondContact CG1-ND2 3.15Å; V462-N466 VanDerWaalsContact O-CB 3.3Å; V462-N466 WeakPolarHBondContact O-CB 3.49Å; V462-N466 VanDerWaalsContact O-CG 3.28Å; V462-N466 PolarHBondContact O-N 3.06Å; V462-N466 PolarHBondContact O-ND2 2.94Å; N463-N466 PolarHBondContact O-N 2.85Å; L464-N466 VanDerWaalsContact C-N 3.33Å; L464-N466 PolarHBondContact O-N 3.01Å
467	H	91.2	Very high	88.7	Confident	48 Å²	48	63.1 Å²	63.1	22%	0.222	34%	0.339	C	S	.	.	S	Bend	trans	-65.5	136	-178	-167.1	-87.9	0	0	0	110.6	V410 N463 L464 R465 S469 Y470 S471	V410-H467 HydrophobicContact CG1-CB 4.39Å; N463-H467 WeakPolarHBondContact O-CB 3.31Å; N463-H467 PolarHBondContact O-N 2.99Å; L464-H467 VanDerWaalsContact O-CB 3.28Å; L464-H467 WeakPolarHBondContact O-CB 3.28Å; L464-H467 PolarHBondContact O-N 3.38Å; R465-H467 VanDerWaalsContact C-N 3.35Å; H467-S469 VanDerWaalsContact C-N 3.27Å; H467-S469 PolarHBondContact CE1-OG 2.75Å; H467-S469 PolarHBondContact ND1-N 2.6Å; H467-S469 PolarHBondContact ND1-OG 3.04Å; H467-S469 PolarHBondContact O-N 3.28Å; H467-S469 VanDerWaalsContact O-N 3.15Å; H467-Y470 VanDerWaalsContact O-CB 3.26Å; H467-Y470 WeakPolarHBondContact O-CB 3.3Å; H467-Y470 PolarHBondContact O-N 3.11Å; H467-S471 PolarHBondContact O-N 2.87Å
468	P	92	Very high	89.5	Confident	99 Å²	99	61.9 Å²	61.9	64%	0.643	33%	0.33	S	S	*	.	H	α-helix	trans	-54.7	-37.9	-177.5	-28.6	34.7	0	0	0	114.5	Y470 S471 M472	P468-Y470 VanDerWaalsContact C-N 3.3Å; P468-Y470 PolarHBondContact O-N 3.26Å; P468-S471 PolarHBondContact O-N 3.41Å; P468-M472 WeakPolarHBondContact O-CB 3.41Å; P468-M472 PolarHBondContact O-N 2.78Å
469	S	91.7	Very high	90	Very high	7 Å²	7	57.7 Å²	57.7	5%	0.049	30%	0.303	C	S	.	.	H	α-helix	trans	-68.6	-26.5	177.4	67.8	0	0	0	0	113.2	W414 H467 F473	W414-S469 PolarHBondContact NE1-OG 3.25Å; H467-S469 VanDerWaalsContact C-N 3.27Å; H467-S469 PolarHBondContact CE1-OG 2.75Å; H467-S469 PolarHBondContact ND1-N 2.6Å; H467-S469 PolarHBondContact ND1-OG 3.04Å; H467-S469 PolarHBondContact O-N 3.28Å; H467-S469 VanDerWaalsContact O-N 3.15Å; S469-F473 WeakPolarHBondContact O-CB 3.41Å; S469-F473 PolarHBondContact O-N 3.43Å
470	Y	92.6	Very high	90.7	Very high	29 Å²	29	55.6 Å²	55.6	11%	0.114	30%	0.296	C	S	.	.	H	α-helix	trans	-67.2	-49.6	175	-172.3	-89.3	0	0	0	110.6	W414 I448 E452 L464 R465 H467 P468 F473 I474	W414-Y470 AromaticContact CE2-CD2 3.79Å; W414-Y470 HydrophobicContact CH2-CD2 4.26Å; W414-Y470 AromaticContact CZ2-CD2 3.41Å; W414-Y470 HydrophobicContact CZ2-CD2 3.41Å; W414-Y470 VanDerWaalsContact CZ2-CD2 3.41Å; W414-Y470 HydrophobicContact CZ2-CE2 4.05Å; W414-Y470 HydrophobicContact CZ2-CG 4.27Å; W414-Y470 AromaticContact NE1-CD2 3.93Å; I448-Y470 HydrophobicContact CG2-CE2 3.88Å; E452-Y470 PolarHBondContact OE1-OH 3.29Å; L464-Y470 HydrophobicContact CG-CD2 4.41Å; L464-Y470 WeakPolarHBondContact O-CB 3.34Å; R465-Y470 HydrophobicContact CB-CE1 4.37Å; R465-Y470 HydrophobicContact CG-CE1 4.24Å; R465-Y470 VanDerWaalsContact O-CD1 3.3Å; R465-Y470 WeakPolarHBondContact O-CD1 3.37Å; H467-Y470 VanDerWaalsContact O-CB 3.26Å; H467-Y470 WeakPolarHBondContact O-CB 3.3Å; H467-Y470 PolarHBondContact O-N 3.11Å; P468-Y470 VanDerWaalsContact C-N 3.3Å; P468-Y470 PolarHBondContact O-N 3.26Å; Y470-F473 PolarHBondContact O-N 3.03Å; Y470-I474 HydrophobicContact CD1-CD1 3.75Å; Y470-I474 HydrophobicContact CE1-CD1 3.21Å; Y470-I474 HydrophobicContact CE1-CG1 4.32Å; Y470-I474 PolarHBondContact O-N 3.35Å; Y470-I474 VanDerWaalsContact O-N 3.1Å
471	S	91.4	Very high	91.2	Very high	55 Å²	55	58.5 Å²	58.5	39%	0.385	31%	0.314	S	S	.	.	H	α-helix	trans	-60.2	-46.2	174	-57.9	0	0	0	0	111.4	H467 P468 F473 I474 D475	H467-S471 PolarHBondContact O-N 2.87Å; P468-S471 PolarHBondContact O-N 3.41Å; S471-F473 VanDerWaalsContact C-N 3.32Å; S471-F473 PolarHBondContact O-N 3.18Å; S471-I474 PolarHBondContact O-N 3.22Å; S471-D475 WeakPolarHBondContact O-CB 3.3Å; S471-D475 PolarHBondContact O-N 3.13Å
472	M	92.1	Very high	91.6	Very high	64 Å²	64	56.6 Å²	56.6	32%	0.315	30%	0.304	S	S	.	.	H	α-helix	trans	-55.4	-45.8	176.2	-176.2	-178.4	73	0	0	112.1	I418 C422 P468 D475 K476	I418-M472 HydrophobicContact CG2-CE 3.61Å; C422-M472 HydrophobicContact CB-CE 4.47Å; P468-M472 WeakPolarHBondContact O-CB 3.41Å; P468-M472 PolarHBondContact O-N 2.78Å; M472-D475 PolarHBondContact O-N 2.93Å; M472-K476 WeakPolarHBondContact O-CG 3.31Å; M472-K476 PolarHBondContact O-N 2.83Å; M472-K476 VanDerWaalsContact O-N 3.08Å
473	F	92.8	Very high	92	Very high	1 Å²	1	53.9 Å²	53.9	0%	0.004	29%	0.286	C	S	.	.	H	α-helix	trans	-63.4	-42.5	179.5	-175.9	-110.2	0	0	0	112.1	I418 I421 F429 M445 I448 S469 Y470 S471 W477	I418-F473 HydrophobicContact CD1-CB 4.02Å; I418-F473 HydrophobicContact CD1-CD1 4.28Å; I418-F473 HydrophobicContact CD1-CD2 3.68Å; I418-F473 HydrophobicContact CD1-CE2 4.16Å; I418-F473 HydrophobicContact CD1-CG 3.73Å; I418-F473 HydrophobicContact CG1-CB 4.42Å; I418-F473 HydrophobicContact CG2-CB 3.9Å; I418-F473 HydrophobicContact CG2-CD2 4.24Å; I418-F473 HydrophobicContact CG2-CG 4.46Å; I421-F473 HydrophobicContact CG2-CE2 4.19Å; F429-F473 AromaticContact CE1-CD2 3.93Å; F429-F473 HydrophobicContact CE1-CD2 3.93Å; F429-F473 AromaticContact CE1-CE2 3.69Å; F429-F473 HydrophobicContact CE1-CE2 3.69Å; F429-F473 HydrophobicContact CE1-CZ 4.46Å; F429-F473 AromaticContact CZ-CD2 3.9Å; F429-F473 HydrophobicContact CZ-CD2 3.9Å; F429-F473 AromaticContact CZ-CE2 3.71Å; F429-F473 HydrophobicContact CZ-CE2 3.71Å; M445-F473 HydrophobicContact CE-CE1 4.37Å; I448-F473 HydrophobicContact CD1-CD1 3.9Å; I448-F473 HydrophobicContact CD1-CE1 3.71Å; I448-F473 HydrophobicContact CG1-CD1 4.48Å; I448-F473 HydrophobicContact CG1-CE1 4.22Å; S469-F473 WeakPolarHBondContact O-CB 3.41Å; S469-F473 PolarHBondContact O-N 3.43Å; Y470-F473 PolarHBondContact O-N 3.03Å; S471-F473 VanDerWaalsContact C-N 3.32Å; S471-F473 PolarHBondContact O-N 3.18Å; F473-W477 AromaticContact CE1-NE1 3.7Å; F473-W477 AromaticContact CE2-NE1 3.98Å; F473-W477 AromaticContact CZ-NE1 3.58Å
474	I	91.8	Very high	92.4	Very high	44 Å²	44	54.2 Å²	54.2	23%	0.226	29%	0.285	C	S	.	.	H	α-helix	trans	-66.3	-44.5	177.7	-68.9	178.9	0	0	0	111	Y470 S471 K476 W477	Y470-I474 HydrophobicContact CD1-CD1 3.75Å; Y470-I474 HydrophobicContact CE1-CD1 3.21Å; Y470-I474 HydrophobicContact CE1-CG1 4.32Å; Y470-I474 PolarHBondContact O-N 3.35Å; Y470-I474 VanDerWaalsContact O-N 3.1Å; S471-I474 PolarHBondContact O-N 3.22Å; I474-K476 VanDerWaalsContact C-N 3.27Å; I474-K476 PolarHBondContact O-N 3.09Å; I474-W477 WeakPolarHBondContact O-CB 3.15Å; I474-W477 PolarHBondContact O-N 3.29Å
475	D	91	Very high	92.7	Very high	129 Å²	129	56 Å²	56	69%	0.69	30%	0.295	S	S	*	.	H	α-helix	trans	-67.8	-27.6	-176.5	-70.2	-20.3	0	0	0	112.7	S471 M472 W477	S471-D475 WeakPolarHBondContact O-CB 3.3Å; S471-D475 PolarHBondContact O-N 3.13Å; M472-D475 PolarHBondContact O-N 2.93Å; D475-W477 PolarHBondContact O-N 3.41Å
476	K	91.9	Very high	93	Very high	110 Å²	110	50.6 Å²	50.6	48%	0.478	27%	0.274	S	S	.	.	H	α-helix	trans	-62.7	-28.7	172.1	-73.2	-79.1	-177.5	176.7	0	112.4	F429 M472 I474 S478	F429-K476 HydrophobicContact CD1-CB 3.63Å; F429-K476 HydrophobicContact CD2-CB 4.44Å; F429-K476 HydrophobicContact CE1-CB 3.79Å; F429-K476 HydrophobicContact CG-CB 3.98Å; F429-K476 HydrophobicContact CZ-CB 4.28Å; M472-K476 WeakPolarHBondContact O-CG 3.31Å; M472-K476 PolarHBondContact O-N 2.83Å; M472-K476 VanDerWaalsContact O-N 3.08Å; I474-K476 VanDerWaalsContact C-N 3.27Å; I474-K476 PolarHBondContact O-N 3.09Å; K476-S478 PolarHBondContact O-N 3.48Å; K476-S478 VanDerWaalsContact O-N 3.1Å
477	W	93.4	Very high	93.3	Very high	9 Å²	9	48.1 Å²	48.1	3%	0.034	26%	0.258	C	S	.	.	S	Bend	trans	-77.6	95.3	173.5	-65.9	100.2	0	0	0	110.3	I428 F429 F437 L440 Y441 S444 F473 I474 D475 L479	I428-W477 HydrophobicContact CG1-CH2 4.4Å; I428-W477 HydrophobicContact CG1-CZ2 4.47Å; I428-W477 WeakPolarHBondContact O-CH2 3.28Å; I428-W477 WeakPolarHBondContact O-CZ3 3.22Å; F429-W477 AromaticContact CD1-CD2 3.81Å; F429-W477 HydrophobicContact CD1-CD2 3.81Å; F429-W477 AromaticContact CD1-CE2 3.59Å; F429-W477 HydrophobicContact CD1-CE3 4.33Å; F429-W477 HydrophobicContact CD1-CG 4.17Å; F429-W477 HydrophobicContact CD1-CH2 4.41Å; F429-W477 AromaticContact CD1-CZ2 3.9Å; F429-W477 HydrophobicContact CD1-CZ2 3.9Å; F429-W477 AromaticContact CD1-NE1 3.8Å; F429-W477 HydrophobicContact CE1-CD2 4.3Å; F429-W477 AromaticContact CE1-CE2 3.65Å; F429-W477 AromaticContact CE1-CZ2 3.93Å; F429-W477 HydrophobicContact CE1-CZ2 3.93Å; F429-W477 AromaticContact CE1-NE1 3.5Å; F437-W477 HydrophobicContact CD2-CE3 4.03Å; F437-W477 HydrophobicContact CD2-CZ3 4Å; F437-W477 HydrophobicContact CE1-CE3 4.16Å; F437-W477 AromaticContact CE2-CE3 3.49Å; F437-W477 HydrophobicContact CE2-CE3 3.49Å; F437-W477 VanDerWaalsContact CE2-CE3 3.49Å; F437-W477 AromaticContact CE2-CZ3 3.95Å; F437-W477 HydrophobicContact CE2-CZ3 3.95Å; F437-W477 HydrophobicContact CG-CZ3 4.44Å; F437-W477 HydrophobicContact CZ-CB 4.38Å; F437-W477 AromaticContact CZ-CE3 3.58Å; F437-W477 HydrophobicContact CZ-CE3 3.58Å; F437-W477 HydrophobicContact CZ-CZ3 4.31Å; L440-W477 HydrophobicContact CB-CH2 3.96Å; L440-W477 HydrophobicContact CB-CZ3 4.49Å; Y441-W477 HydrophobicContact CD2-CB 4.12Å; Y441-W477 AromaticContact CD2-CD2 3.67Å; Y441-W477 HydrophobicContact CD2-CD2 3.67Å; Y441-W477 AromaticContact CD2-CE3 3.76Å; Y441-W477 HydrophobicContact CD2-CE3 3.76Å; Y441-W477 AromaticContact CD2-CG 3.82Å; Y441-W477 HydrophobicContact CD2-CG 3.82Å; Y441-W477 HydrophobicContact CD2-CZ3 4.46Å; Y441-W477 HydrophobicContact CE2-CB 4.24Å; Y441-W477 HydrophobicContact CE2-CG 4.21Å; Y441-W477 HydrophobicContact CG-CE3 4.32Å; S444-W477 WeakPolarHBondContact OG-CZ2 3.47Å; F473-W477 AromaticContact CE1-NE1 3.7Å; F473-W477 AromaticContact CE2-NE1 3.98Å; F473-W477 AromaticContact CZ-NE1 3.58Å; I474-W477 WeakPolarHBondContact O-CB 3.15Å; I474-W477 PolarHBondContact O-N 3.29Å; D475-W477 PolarHBondContact O-N 3.41Å; W477-L479 PolarHBondContact O-N 3.24Å
478	S	92.8	Very high	93.5	Very high	32 Å²	32	51.6 Å²	51.6	22%	0.224	27%	0.274	C	S	.	.			trans	-72.7	64.8	-179.5	59.4	0	0	0	0	113.6	P431 K476 P480 V481 Y482	P431-S478 WeakPolarHBondContact CG-OG 3.44Å; K476-S478 PolarHBondContact O-N 3.48Å; K476-S478 VanDerWaalsContact O-N 3.1Å; S478-P480 VanDerWaalsContact C-N 3.26Å; S478-P480 VanDerWaalsContact O-N 3.15Å; S478-V481 PolarHBondContact O-N 2.91Å; S478-Y482 PolarHBondContact O-N 3.36Å
479	L	93.7	Very high	93.6	Very high	24 Å²	24	49.4 Å²	49.4	13%	0.126	26%	0.255	C	S	.	.	H	α-helix	trans	-51.8	-35.4	177.7	-58.4	-176.9	0	0	0	114.1	F437 Y441 W477 V481 F483 L534 K536 L537	F437-L479 HydrophobicContact CE1-CD2 4Å; F437-L479 HydrophobicContact CZ-CD2 4.21Å; Y441-L479 HydrophobicContact CD2-CD2 4.11Å; Y441-L479 HydrophobicContact CE2-CD1 4.49Å; Y441-L479 HydrophobicContact CE2-CD2 3.76Å; W477-L479 PolarHBondContact O-N 3.24Å; L479-V481 PolarHBondContact O-N 3.47Å; L479-F483 PolarHBondContact O-N 2.89Å; L479-L534 HydrophobicContact CD2-CD1 4.08Å; L479-K536 HydrophobicContact CD1-CB 3.81Å; L479-K536 HydrophobicContact CD1-CD 3.88Å; L479-K536 HydrophobicContact CD1-CG 4.43Å; L479-L537 HydrophobicContact CB-CD1 4.33Å; L479-L537 HydrophobicContact CB-CD2 4.03Å; L479-L537 HydrophobicContact CB-CG 4.36Å
480	P	93.4	Very high	93.8	Very high	72 Å²	72	49 Å²	49	47%	0.468	25%	0.253	S	S	.	.	H	α-helix	trans	-63.2	-38.6	174.3	-25.2	36.3	0	0	0	113.9	S478 Q484	S478-P480 VanDerWaalsContact C-N 3.26Å; S478-P480 VanDerWaalsContact O-N 3.15Å; P480-Q484 PolarHBondContact O-N 3.48Å
481	V	93.9	Very high	93.9	Very high	71 Å²	71	48.5 Å²	48.5	43%	0.43	26%	0.255	S	S	.	.	H	α-helix	trans	-72.5	-42.5	179.1	-177.7	0	0	0	0	109.9	P431 S478 L479 F483 Q484 I485	P431-V481 HydrophobicContact CB-CB 4.22Å; P431-V481 HydrophobicContact CB-CG1 3.94Å; P431-V481 HydrophobicContact CG-CB 3.97Å; P431-V481 HydrophobicContact CG-CG1 3.49Å; P431-V481 VanDerWaalsContact CG-CG1 3.49Å; S478-V481 PolarHBondContact O-N 2.91Å; L479-V481 PolarHBondContact O-N 3.47Å; V481-F483 VanDerWaalsContact C-N 3.33Å; V481-F483 PolarHBondContact O-N 3.28Å; V481-Q484 WeakPolarHBondContact O-CB 3.26Å; V481-Q484 PolarHBondContact O-N 2.81Å; V481-Q484 VanDerWaalsContact O-N 3.11Å; V481-I485 HydrophobicContact CG1-CD1 4.31Å; V481-I485 WeakPolarHBondContact O-CG1 3.37Å; V481-I485 PolarHBondContact O-N 2.97Å
482	Y	95.7	Very high	94	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-52.9	-50.8	171.1	172.7	-95.4	0	0	0	111.8	P434 F437 S478 Q484 I485 R486 I532 L534 L537	P434-Y482 HydrophobicContact CB-CD2 4.03Å; P434-Y482 HydrophobicContact CB-CE2 3.76Å; P434-Y482 WeakPolarHBondContact O-CE2 3.44Å; F437-Y482 HydrophobicContact CB-CD2 4.25Å; F437-Y482 AromaticContact CD1-CD2 3.25Å; F437-Y482 HydrophobicContact CD1-CD2 3.25Å; F437-Y482 AromaticContact CD1-CE2 3.84Å; F437-Y482 HydrophobicContact CD1-CE2 3.84Å; F437-Y482 AromaticContact CD1-CG 3.76Å; F437-Y482 HydrophobicContact CD1-CG 3.76Å; F437-Y482 AromaticContact CE1-CD2 3.77Å; F437-Y482 HydrophobicContact CE1-CD2 3.77Å; F437-Y482 AromaticContact CE1-CG 3.76Å; F437-Y482 HydrophobicContact CE1-CG 3.76Å; F437-Y482 AromaticContact CG-CD2 3.97Å; F437-Y482 HydrophobicContact CG-CD2 3.97Å; S478-Y482 PolarHBondContact O-N 3.36Å; Y482-Q484 VanDerWaalsContact C-N 3.29Å; Y482-Q484 PolarHBondContact O-N 3.42Å; Y482-I485 PolarHBondContact O-N 3.5Å; Y482-R486 HydrophobicContact CD1-CG 4.4Å; Y482-R486 HydrophobicContact CE1-CG 3.88Å; Y482-R486 HydrophobicContact CE2-CG 4.13Å; Y482-R486 PolarHBondContact O-N 2.96Å; Y482-R486 PolarHBondContact OH-NE 3.42Å; Y482-I532 PolarHBondContact OH-O 3.44Å; Y482-L534 HydrophobicContact CD1-CD1 3.78Å; Y482-L534 HydrophobicContact CE1-CD1 3.52Å; Y482-L534 HydrophobicContact CE1-CG 4.04Å; Y482-L534 HydrophobicContact CG-CD1 4.48Å; Y482-L537 HydrophobicContact CD1-CD1 3.61Å; Y482-L537 HydrophobicContact CE1-CD1 4.11Å
483	F	95.7	Very high	94.2	Very high	17 Å²	17	47.1 Å²	47.1	8%	0.075	25%	0.25	C	S	.	.	H	α-helix	trans	-61.5	-38.7	177.8	-177.4	-97.3	0	0	0	111.8	L479 V481 I485 R486 F487 L537 R540 F541 L544	L479-F483 PolarHBondContact O-N 2.89Å; V481-F483 VanDerWaalsContact C-N 3.33Å; V481-F483 PolarHBondContact O-N 3.28Å; F483-I485 VanDerWaalsContact C-N 3.33Å; F483-I485 PolarHBondContact O-N 3.4Å; F483-R486 PolarHBondContact O-N 3.22Å; F483-F487 HydrophobicContact CD1-CB 4.39Å; F483-F487 HydrophobicContact CE1-CB 4.04Å; F483-F487 HydrophobicContact CE1-CD2 4.16Å; F483-F487 HydrophobicContact CE1-CG 4.46Å; F483-F487 HydrophobicContact CZ-CB 4.38Å; F483-F487 HydrophobicContact CZ-CD2 4.31Å; F483-F487 WeakPolarHBondContact O-CB 2.91Å; F483-F487 PolarHBondContact O-N 3.42Å; F483-L537 HydrophobicContact CB-CD1 4.04Å; F483-L537 HydrophobicContact CB-CD2 4.37Å; F483-R540 HydrophobicContact CD1-CB 4.07Å; F483-R540 HydrophobicContact CD1-CG 4.45Å; F483-R540 HydrophobicContact CD2-CB 3.64Å; F483-R540 HydrophobicContact CE1-CB 3.8Å; F483-R540 HydrophobicContact CE1-CG 4.5Å; F483-R540 HydrophobicContact CE2-CB 3.35Å; F483-R540 HydrophobicContact CG-CB 3.99Å; F483-R540 HydrophobicContact CG-CG 4.46Å; F483-R540 HydrophobicContact CZ-CB 3.44Å; F483-R540 VanDerWaalsContact CZ-CB 3.44Å; F483-R540 WeakPolarHBondContact CZ-O 3.42Å; F483-F541 HydrophobicContact CD2-CD2 4.41Å; F483-F541 HydrophobicContact CD2-CE1 4.43Å; F483-F541 HydrophobicContact CD2-CE2 4.16Å; F483-F541 HydrophobicContact CD2-CZ 4.18Å; F483-F541 HydrophobicContact CE2-CD1 4.1Å; F483-F541 HydrophobicContact CE2-CD2 4.36Å; F483-F541 HydrophobicContact CE2-CE1 4.21Å; F483-F541 HydrophobicContact CE2-CE2 4.46Å; F483-F541 HydrophobicContact CE2-CG 4.18Å; F483-F541 HydrophobicContact CE2-CZ 4.4Å; F483-L544 HydrophobicContact CZ-CB 4.28Å; F483-L544 HydrophobicContact CZ-CD2 4.38Å
484	Q	95.6	Very high	94.3	Very high	97 Å²	97	47.2 Å²	47.2	45%	0.453	25%	0.251	S	S	.	.	H	α-helix	trans	-61.4	-41.6	179	-172.9	68.5	7.6	0	0	112	P480 V481 Y482 F487 Q488	P480-Q484 PolarHBondContact O-N 3.48Å; V481-Q484 WeakPolarHBondContact O-CB 3.26Å; V481-Q484 PolarHBondContact O-N 2.81Å; V481-Q484 VanDerWaalsContact O-N 3.11Å; Y482-Q484 VanDerWaalsContact C-N 3.29Å; Y482-Q484 PolarHBondContact O-N 3.42Å; Q484-F487 PolarHBondContact O-N 3.07Å; Q484-Q488 WeakPolarHBondContact O-CG 3.49Å; Q484-Q488 PolarHBondContact O-N 3.03Å
485	I	94.5	Very high	94.4	Very high	39 Å²	39	47.9 Å²	47.9	20%	0.2	25%	0.253	C	S	.	.	H	α-helix	trans	-66	-49.3	176.6	-62.8	166.3	0	0	0	109.9	P431 P434 V481 Y482 F483 F487 Q488 E489	P431-I485 HydrophobicContact CB-CD1 4.27Å; P431-I485 WeakPolarHBondContact O-CD1 3.45Å; P434-I485 HydrophobicContact CB-CG2 4.32Å; P434-I485 HydrophobicContact CG-CG2 3.9Å; V481-I485 HydrophobicContact CG1-CD1 4.31Å; V481-I485 WeakPolarHBondContact O-CG1 3.37Å; V481-I485 PolarHBondContact O-N 2.97Å; Y482-I485 PolarHBondContact O-N 3.5Å; F483-I485 VanDerWaalsContact C-N 3.33Å; F483-I485 PolarHBondContact O-N 3.4Å; I485-F487 VanDerWaalsContact C-N 3.3Å; I485-F487 PolarHBondContact O-N 3.27Å; I485-Q488 PolarHBondContact O-N 3.4Å; I485-Q488 VanDerWaalsContact O-N 3.14Å; I485-E489 PolarHBondContact O-N 3.14Å
486	R	95.7	Very high	94.5	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61	-38	176.9	-68.9	-56.6	-158.1	-165.7	1.1	112.8	P434 D435 Y482 F483 E489 I490 G531 I532	P434-R486 HydrophobicContact CB-CG 4.46Å; D435-R486 IonicContact OD1-CZ 2.67Å; D435-R486 VanDerWaalsContact OD1-CZ 3.26Å; D435-R486 IonicContact OD1-NH1 3.85Å; D435-R486 PolarHBondContact OD1-NH1 3.32Å; D435-R486 IonicContact OD1-NH2 3.35Å; D435-R486 PolarHBondContact OD1-NH2 2.57Å; Y482-R486 HydrophobicContact CD1-CG 4.4Å; Y482-R486 HydrophobicContact CE1-CG 3.88Å; Y482-R486 HydrophobicContact CE2-CG 4.13Å; Y482-R486 PolarHBondContact O-N 2.96Å; Y482-R486 PolarHBondContact OH-NE 3.42Å; F483-R486 PolarHBondContact O-N 3.22Å; R486-E489 IonicContact NH1-OE1 2.73Å; R486-E489 IonicContact NH1-OE2 2.73Å; R486-E489 PolarHBondContact NH1-OE2 3.15Å; R486-E489 PolarHBondContact O-N 2.95Å; R486-I490 WeakPolarHBondContact O-CB 3.4Å; R486-I490 WeakPolarHBondContact O-CG1 3.28Å; R486-I490 PolarHBondContact O-N 2.83Å; R486-G531 PolarHBondContact NH2-O 3.47Å; R486-I532 HydrophobicContact CG-CG2 4.31Å
487	F	95.9	Very high	94.5	Very high	64 Å²	64	41 Å²	41	28%	0.281	22%	0.222	S	C	.	.	H	α-helix	trans	-60.5	-47.2	174.1	174.5	-86.2	0	0	0	110.9	F483 Q484 I485 I490 A491 L544	F483-F487 HydrophobicContact CD1-CB 4.39Å; F483-F487 HydrophobicContact CE1-CB 4.04Å; F483-F487 HydrophobicContact CE1-CD2 4.16Å; F483-F487 HydrophobicContact CE1-CG 4.46Å; F483-F487 HydrophobicContact CZ-CB 4.38Å; F483-F487 HydrophobicContact CZ-CD2 4.31Å; F483-F487 WeakPolarHBondContact O-CB 2.91Å; F483-F487 PolarHBondContact O-N 3.42Å; Q484-F487 PolarHBondContact O-N 3.07Å; I485-F487 VanDerWaalsContact C-N 3.3Å; I485-F487 PolarHBondContact O-N 3.27Å; F487-I490 PolarHBondContact O-N 3.14Å; F487-A491 HydrophobicContact CD1-CB 4.42Å; F487-A491 HydrophobicContact CE1-CB 4.09Å; F487-A491 HydrophobicContact CE2-CB 4.29Å; F487-A491 HydrophobicContact CZ-CB 4.02Å; F487-A491 WeakPolarHBondContact O-CA 3.2Å; F487-A491 WeakPolarHBondContact O-CB 3.32Å; F487-A491 PolarHBondContact O-N 3.49Å; F487-L544 HydrophobicContact CD2-CD1 3.66Å; F487-L544 HydrophobicContact CD2-CD2 4.29Å; F487-L544 HydrophobicContact CD2-CG 4.48Å; F487-L544 HydrophobicContact CE2-CD1 3.69Å
488	Q	95.1	Very high	94.5	Very high	120 Å²	120	41 Å²	41	56%	0.561	22%	0.222	S	C	*	.	H	α-helix	trans	-65.4	-39	178.4	-74.2	178.6	-9	0	0	112.5	Q484 I485 G492	Q484-Q488 WeakPolarHBondContact O-CG 3.49Å; Q484-Q488 PolarHBondContact O-N 3.03Å; I485-Q488 PolarHBondContact O-N 3.4Å; I485-Q488 VanDerWaalsContact O-N 3.14Å; Q488-G492 WeakPolarHBondContact O-CA 3.41Å; Q488-G492 PolarHBondContact O-N 2.84Å
489	E	94.5	Very high	94.4	Very high	53 Å²	53	47.2 Å²	47.2	25%	0.248	25%	0.245	C	C	.	.	H	α-helix	trans	-60.2	-51.6	173.7	-73.3	176.9	-171.4	0	0	111.4	P434 I485 R486 N493 R526	P434-E489 VanDerWaalsContact CG-OE1 3.32Å; P434-E489 WeakPolarHBondContact CG-OE1 3.3Å; I485-E489 PolarHBondContact O-N 3.14Å; R486-E489 IonicContact NH1-OE1 2.73Å; R486-E489 IonicContact NH1-OE2 2.73Å; R486-E489 PolarHBondContact NH1-OE2 3.15Å; R486-E489 PolarHBondContact O-N 2.95Å; E489-N493 WeakPolarHBondContact O-CB 3.25Å; E489-N493 PolarHBondContact O-N 2.71Å; E489-N493 PolarHBondContact O-ND2 2.83Å; E489-R526 IonicContact OE2-CZ 3.41Å; E489-R526 IonicContact OE2-NH2 3.32Å; E489-R526 PolarHBondContact OE2-NH2 3.31Å
490	I	95.8	Very high	94.1	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-72.9	-59.3	-174.4	-63.3	170.7	0	0	0	110.2	R486 F487 G492 N493 V494 Q523 R526 I532 F541 L544 I548	R486-I490 WeakPolarHBondContact O-CB 3.4Å; R486-I490 WeakPolarHBondContact O-CG1 3.28Å; R486-I490 PolarHBondContact O-N 2.83Å; F487-I490 PolarHBondContact O-N 3.14Å; I490-G492 VanDerWaalsContact C-N 3.32Å; I490-G492 PolarHBondContact O-N 2.9Å; I490-N493 PolarHBondContact O-N 3.24Å; I490-V494 PolarHBondContact O-N 2.94Å; I490-Q523 HydrophobicContact CG2-CB 3.77Å; I490-Q523 HydrophobicContact CG2-CG 4.18Å; I490-R526 HydrophobicContact CD1-CG 4.46Å; I490-R526 HydrophobicContact CG1-CG 4.33Å; I490-I532 HydrophobicContact CD1-CG2 4.37Å; I490-F541 HydrophobicContact CD1-CE1 4.41Å; I490-L544 HydrophobicContact CB-CD2 4.29Å; I490-L544 HydrophobicContact CD1-CD2 4.12Å; I490-L544 HydrophobicContact CG2-CD2 4.16Å; I490-I548 HydrophobicContact CG2-CD1 3.76Å
491	A	94.9	Very high	93.8	Very high	18 Å²	18	49 Å²	49	15%	0.149	25%	0.248	C	C	.	.	H	α-helix	trans	-65.6	-34.5	-178.1	0	0	0	0	0	112.2	F487 N493 V494 E495 L544	F487-A491 HydrophobicContact CD1-CB 4.42Å; F487-A491 HydrophobicContact CE1-CB 4.09Å; F487-A491 HydrophobicContact CE2-CB 4.29Å; F487-A491 HydrophobicContact CZ-CB 4.02Å; F487-A491 WeakPolarHBondContact O-CA 3.2Å; F487-A491 WeakPolarHBondContact O-CB 3.32Å; F487-A491 PolarHBondContact O-N 3.49Å; A491-N493 PolarHBondContact O-N 3.5Å; A491-V494 PolarHBondContact O-N 3.31Å; A491-E495 WeakPolarHBondContact O-CG 3.31Å; A491-E495 PolarHBondContact O-N 3.41Å; A491-L544 HydrophobicContact CB-CD1 4.47Å
492	G	94.8	Very high	93.6	Very high	25 Å²	25	47.2 Å²	47.2	26%	0.258	24%	0.236	S	C	.	.	H	α-helix	trans	-63.2	-40.1	176.3	0	0	0	0	0	112.6	Q488 I490 E495 N496	Q488-G492 WeakPolarHBondContact O-CA 3.41Å; Q488-G492 PolarHBondContact O-N 2.84Å; I490-G492 VanDerWaalsContact C-N 3.32Å; I490-G492 PolarHBondContact O-N 2.9Å; G492-E495 PolarHBondContact O-N 2.88Å; G492-N496 VanDerWaalsContact O-CB 3.27Å; G492-N496 WeakPolarHBondContact O-CB 3.3Å; G492-N496 PolarHBondContact O-N 3.33Å; G492-N496 PolarHBondContact O-ND2 3.43Å
493	N	94.7	Very high	93.1	Very high	65 Å²	65	50.4 Å²	50.4	35%	0.348	25%	0.253	S	S	.	.	H	α-helix	trans	-63	-42.8	173.5	-72.7	-23	0	0	0	111.8	E489 I490 A491 N496 A497 V519 Q523	E489-N493 WeakPolarHBondContact O-CB 3.25Å; E489-N493 PolarHBondContact O-N 2.71Å; E489-N493 PolarHBondContact O-ND2 2.83Å; I490-N493 PolarHBondContact O-N 3.24Å; A491-N493 PolarHBondContact O-N 3.5Å; N493-N496 PolarHBondContact O-N 3.26Å; N493-A497 WeakPolarHBondContact O-CB 3.22Å; N493-A497 PolarHBondContact O-N 2.95Å; N493-V519 HydrophobicContact CB-CG1 4.36Å; N493-Q523 HydrophobicContact CB-CG 4.08Å; N493-Q523 PolarHBondContact ND2-OE1 3.07Å
494	V	94.9	Very high	92.7	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.018	27%	0.27	C	S	.	.	H	α-helix	trans	-61.8	-50.1	176.6	177.3	0	0	0	0	111.2	I490 A491 N496 A497 M498 V520 Q523 I548	I490-V494 PolarHBondContact O-N 2.94Å; A491-V494 PolarHBondContact O-N 3.31Å; V494-N496 VanDerWaalsContact C-N 3.35Å; V494-N496 PolarHBondContact O-N 3.1Å; V494-A497 PolarHBondContact O-N 2.92Å; V494-M498 HydrophobicContact CG1-CE 3.48Å; V494-M498 VanDerWaalsContact CG1-CE 3.48Å; V494-M498 HydrophobicContact CG1-CG 4.41Å; V494-M498 HydrophobicContact CG1-SD 3.84Å; V494-M498 WeakPolarHBondContact O-CG 3.24Å; V494-M498 PolarHBondContact O-N 2.85Å; V494-V520 HydrophobicContact CG1-CG2 3.93Å; V494-V520 HydrophobicContact CG2-CG2 4.46Å; V494-Q523 HydrophobicContact CG2-CB 3.7Å; V494-Q523 HydrophobicContact CG2-CG 3.55Å; V494-I548 HydrophobicContact CG2-CG2 4.37Å
495	E	94	Very high	92.1	Very high	58 Å²	58	51.1 Å²	51.1	27%	0.271	26%	0.257	S	S	.	.	H	α-helix	trans	-64.3	-38	179.6	-71.9	-61.6	146.5	0	0	112.4	A491 G492 A497 M498 K499 R551	A491-E495 WeakPolarHBondContact O-CG 3.31Å; A491-E495 PolarHBondContact O-N 3.41Å; G492-E495 PolarHBondContact O-N 2.88Å; E495-A497 VanDerWaalsContact C-N 3.34Å; E495-M498 PolarHBondContact O-N 3.42Å; E495-K499 WeakPolarHBondContact O-CB 3.22Å; E495-K499 VanDerWaalsContact O-CG 3.27Å; E495-K499 WeakPolarHBondContact O-CG 3.29Å; E495-K499 PolarHBondContact O-N 2.82Å; E495-R551 WeakPolarHBondContact OE1-CD 3.35Å; E495-R551 WeakPolarHBondContact OE1-CG 3.44Å; E495-R551 IonicContact OE1-CZ 3.79Å; E495-R551 IonicContact OE1-NE 3.25Å; E495-R551 PolarHBondContact OE1-NE 3.46Å; E495-R551 IonicContact OE1-NH2 2.76Å; E495-R551 IonicContact OE2-CZ 2.68Å; E495-R551 IonicContact OE2-NE 3.99Å; E495-R551 IonicContact OE2-NH2 3.15Å; E495-R551 PolarHBondContact OE2-NH2 3.39Å
496	N	93.7	Very high	91	Very high	90 Å²	90	59 Å²	59	48%	0.481	29%	0.29	S	S	.	.	H	α-helix	trans	-64.9	-39.5	176.2	-74	-20.8	0	0	0	111.7	G492 N493 V494 K500	G492-N496 VanDerWaalsContact O-CB 3.27Å; G492-N496 WeakPolarHBondContact O-CB 3.3Å; G492-N496 PolarHBondContact O-N 3.33Å; G492-N496 PolarHBondContact O-ND2 3.43Å; N493-N496 PolarHBondContact O-N 3.26Å; V494-N496 VanDerWaalsContact C-N 3.35Å; V494-N496 PolarHBondContact O-N 3.1Å; N496-K500 WeakPolarHBondContact O-CG 3.38Å; N496-K500 PolarHBondContact O-N 3.27Å
497	A	92.6	Very high	89.9	Confident	4 Å²	4	67.6 Å²	67.6	3%	0.033	33%	0.33	C	S	.	.	H	α-helix	trans	-66.2	-47.4	173.9	0	0	0	0	0	111	N493 V494 E495 K499 K500 V516 V519	N493-A497 WeakPolarHBondContact O-CB 3.22Å; N493-A497 PolarHBondContact O-N 2.95Å; V494-A497 PolarHBondContact O-N 2.92Å; E495-A497 VanDerWaalsContact C-N 3.34Å; A497-K499 VanDerWaalsContact C-N 3.3Å; A497-K499 PolarHBondContact O-N 3.48Å; A497-K500 WeakPolarHBondContact O-CB 3.47Å; A497-K500 PolarHBondContact O-N 3.13Å; A497-V516 HydrophobicContact CB-CG1 4.49Å; A497-V516 HydrophobicContact CB-CG2 4.3Å; A497-V516 WeakPolarHBondContact O-CG2 3.02Å; A497-V519 HydrophobicContact CB-CB 3.92Å; A497-V519 HydrophobicContact CB-CG1 3.87Å; A497-V519 HydrophobicContact CB-CG2 3.99Å
498	M	92.5	Very high	88.8	Confident	9 Å²	9	66.5 Å²	66.5	4%	0.044	33%	0.33	C	S	.	.	H	α-helix	trans	-58.4	-38.8	178.1	-72.7	176.4	175.2	0	0	112.7	V494 E495 K500 G501 V516 V520 R551 Y552 F555	V494-M498 HydrophobicContact CG1-CE 3.48Å; V494-M498 VanDerWaalsContact CG1-CE 3.48Å; V494-M498 HydrophobicContact CG1-CG 4.41Å; V494-M498 HydrophobicContact CG1-SD 3.84Å; V494-M498 WeakPolarHBondContact O-CG 3.24Å; V494-M498 PolarHBondContact O-N 2.85Å; E495-M498 PolarHBondContact O-N 3.42Å; M498-K500 VanDerWaalsContact C-N 3.26Å; M498-K500 PolarHBondContact O-N 3.45Å; M498-G501 PolarHBondContact O-N 3.22Å; M498-G501 VanDerWaalsContact O-N 3.11Å; M498-V516 HydrophobicContact CG-CG1 3.69Å; M498-V520 HydrophobicContact CE-CG2 4.24Å; M498-R551 HydrophobicContact CE-CG 4Å; M498-R551 HydrophobicContact SD-CG 3.73Å; M498-Y552 HydrophobicContact CE-CD2 4.02Å; M498-F555 HydrophobicContact CB-CD2 3.75Å; M498-F555 HydrophobicContact CB-CE2 3.91Å; M498-F555 HydrophobicContact CB-CG 4.44Å; M498-F555 HydrophobicContact CE-CB 3.99Å; M498-F555 HydrophobicContact CE-CG 4.39Å; M498-F555 HydrophobicContact CG-CB 4.34Å; M498-F555 HydrophobicContact CG-CD2 3.77Å; M498-F555 HydrophobicContact CG-CE2 4.17Å; M498-F555 HydrophobicContact CG-CG 3.95Å; M498-F555 VanDerWaalsContact O-CE2 3.26Å; M498-F555 WeakPolarHBondContact O-CE2 3.37Å; M498-F555 HydrophobicContact SD-CB 4.02Å; M498-F555 HydrophobicContact SD-CD2 4.38Å; M498-F555 HydrophobicContact SD-CG 4.29Å
499	K	90.7	Very high	87.7	Confident	162 Å²	162	71.7 Å²	71.7	70%	0.704	34%	0.344	S	S	*	.	H	α-helix	trans	-62.6	-28.9	175.8	-77.2	172.4	-175.2	174.1	0	114	E495 A497 G501	E495-K499 WeakPolarHBondContact O-CB 3.22Å; E495-K499 VanDerWaalsContact O-CG 3.27Å; E495-K499 WeakPolarHBondContact O-CG 3.29Å; E495-K499 PolarHBondContact O-N 2.82Å; A497-K499 VanDerWaalsContact C-N 3.3Å; A497-K499 PolarHBondContact O-N 3.48Å; K499-G501 PolarHBondContact O-N 3.38Å
500	K	88.1	Confident	86.7	Confident	122 Å²	122	71.5 Å²	71.5	53%	0.53	34%	0.343	S	S	.	.	H	α-helix	trans	-74.1	-16.3	177	-65.6	177.8	-171.1	178.5	0	112.8	N496 A497 M498 I503 E515	N496-K500 WeakPolarHBondContact O-CG 3.38Å; N496-K500 PolarHBondContact O-N 3.27Å; A497-K500 WeakPolarHBondContact O-CB 3.47Å; A497-K500 PolarHBondContact O-N 3.13Å; M498-K500 VanDerWaalsContact C-N 3.26Å; M498-K500 PolarHBondContact O-N 3.45Å; K500-I503 HydrophobicContact CB-CD1 3.78Å; K500-I503 HydrophobicContact CD-CD1 4.14Å; K500-E515 IonicContact NZ-OE1 2.79Å; K500-E515 PolarHBondContact NZ-OE1 3.49Å; K500-E515 IonicContact NZ-OE2 3.13Å
501	G	87.1	Confident	85.9	Confident	13 Å²	13	74.6 Å²	74.6	13%	0.134	36%	0.364	C	S	.	.			trans	76.2	-156.6	-176.4	0	0	0	0	0	113	M498 K499 I503 V516	M498-G501 PolarHBondContact O-N 3.22Å; M498-G501 VanDerWaalsContact O-N 3.11Å; K499-G501 PolarHBondContact O-N 3.38Å; G501-I503 PolarHBondContact O-N 3.47Å; G501-V516 WeakPolarHBondContact O-CG2 3.28Å
502	L	88.5	Confident	85.3	Confident	32 Å²	32	73.9 Å²	73.9	17%	0.168	36%	0.358	C	S	.	.			trans	-83	109	-176.7	-56.6	178.8	0	0	0	110.8	I514 F555 Q559 L590 F593	L502-I514 HydrophobicContact CD2-CG2 4.04Å; L502-F555 HydrophobicContact CD2-CE1 4.07Å; L502-F555 HydrophobicContact CD2-CZ 4.22Å; L502-Q559 HydrophobicContact CD2-CG 4.49Å; L502-L590 HydrophobicContact CD1-CD2 4.23Å; L502-F593 HydrophobicContact CD1-CB 4.34Å; L502-F593 HydrophobicContact CD1-CD1 4.19Å; L502-F593 HydrophobicContact CD1-CG 4.26Å; L502-F593 HydrophobicContact CD2-CB 4.3Å; L502-F593 HydrophobicContact CD2-CD1 4.12Å; L502-F593 HydrophobicContact CD2-CD2 3.61Å; L502-F593 HydrophobicContact CD2-CE1 4.31Å; L502-F593 HydrophobicContact CD2-CE2 3.83Å; L502-F593 HydrophobicContact CD2-CG 3.76Å; L502-F593 HydrophobicContact CD2-CZ 4.16Å
503	I	87.1	Confident	84.9	Confident	68 Å²	68	74.4 Å²	74.4	35%	0.349	36%	0.355	S	S	.	.			trans	-120.8	129	176.5	-61.7	177	0	0	0	109	K500 G501 I514 E515	K500-I503 HydrophobicContact CB-CD1 3.78Å; K500-I503 HydrophobicContact CD-CD1 4.14Å; G501-I503 PolarHBondContact O-N 3.47Å; I503-I514 CarbonylContact O-C 3.59Å; I503-I514 WeakPolarHBondContact O-CA 3.47Å; I503-E515 HydrophobicContact CB-CB 4.23Å; I503-E515 PolarHBondContact O-N 3.3Å
504	E	86.6	Confident	84.7	Confident	95 Å²	95	71.3 Å²	71.3	44%	0.444	34%	0.339	S	S	.	.	B	Isolated β-bridge	trans	-71.3	136.4	175.3	-174.2	-176.2	167.2	0	0	111.9	L513 L589 Y592	E504-L513 CarbonylContact C-O 3.55Å; E504-L513 WeakPolarHBondContact CA-O 3.19Å; E504-L589 HydrophobicContact CB-CD2 3.75Å; E504-Y592 HydrophobicContact CG-CD2 4.12Å; E504-Y592 HydrophobicContact CG-CE2 4.06Å
505	I	82.1	Confident	84.5	Confident	33 Å²	33	73.6 Å²	73.6	17%	0.169	35%	0.349	C	S	.	.			trans	-96.9	126.8	175.3	-48.3	-179	0	0	0	109.5	E507 L513 I514 E515 E518	I505-E507 VanDerWaalsContact CG2-C 3.5Å; I505-E507 VanDerWaalsContact CG2-O 3.24Å; I505-E507 WeakPolarHBondContact CG2-O 3.36Å; I505-L513 PolarHBondContact N-O 3.32Å; I505-I514 VanDerWaalsContact CD1-C 3.47Å; I505-E515 VanDerWaalsContact CD1-CA 3.46Å; I505-E515 HydrophobicContact CD1-CB 4.44Å; I505-E515 HydrophobicContact CG1-CB 4.15Å; I505-E515 VanDerWaalsContact CG1-N 3.28Å; I505-E518 HydrophobicContact CD1-CB 3.58Å; I505-E518 HydrophobicContact CD1-CG 4.34Å; I505-E518 WeakPolarHBondContact CD1-OE2 3.29Å
506	K	72.9	Confident	84.5	Confident	206 Å²	206	70.9 Å²	70.9	90%	0.896	34%	0.336	S	S	*	.	S	Bend	trans	-80.4	-31.6	175.1	-64.5	-175.6	178.8	-178.1	0	113.3
507	E	71.4	Confident	84.4	Confident	180 Å²	180	66.6 Å²	66.6	84%	0.841	31%	0.313	S	S	*	.	S	Bend	trans	-137	103.1	-179.5	-68.1	179.9	-179.4	0	0	109.2	I505	I505-E507 VanDerWaalsContact CG2-C 3.5Å; I505-E507 VanDerWaalsContact CG2-O 3.24Å; I505-E507 WeakPolarHBondContact CG2-O 3.36Å
508	S	73.9	Confident	84.4	Confident	40 Å²	40	67.5 Å²	67.5	28%	0.28	32%	0.317	S	S	.	.			trans	-103	140.4	179.8	-176.7	0	0	0	0	111.8	K510 S511 C512 E518	S508-K510 PolarHBondContact OG-N 3.22Å; S508-S511 PolarHBondContact OG-N 3.41Å; S508-C512 WeakPolarHBondContact CB-O 3.43Å; S508-C512 PolarHBondContact OG-N 3.04Å; S508-C512 PolarHBondContact OG-O 2.86Å; S508-E518 WeakPolarHBondContact CA-OE2 3.46Å; S508-E518 VanDerWaalsContact CB-OE2 3.26Å; S508-E518 WeakPolarHBondContact CB-OE2 3.2Å; S508-E518 PolarHBondContact OG-OE1 2.97Å; S508-E518 PolarHBondContact OG-OE2 3.43Å
509	R	72	Confident	84.5	Confident	230 Å²	230	68.5 Å²	68.5	87%	0.868	32%	0.323	S	S	*	.	S	Bend	trans	-84.7	-21.1	173.1	-60.5	-179.1	-175.3	179.8	1.8	112.7	E518	R509-E518 WeakPolarHBondContact CB-OE1 3.36Å; R509-E518 PolarHBondContact N-OE1 2.84Å
510	K	72.3	Confident	84.7	Confident	48 Å²	48	60.8 Å²	60.8	21%	0.209	29%	0.29	C	S	.	.	S	Bend	trans	-113.1	11.3	-173	-71.2	-67.5	-168	168.8	0	113.6	S508 C512 E518 I521 R599	S508-K510 PolarHBondContact OG-N 3.22Å; K510-C512 PolarHBondContact O-N 2.84Å; K510-E518 HydrophobicContact CB-CG 4.48Å; K510-I521 HydrophobicContact CB-CG2 4.4Å; K510-I521 HydrophobicContact CD-CG2 4.12Å; K510-I521 HydrophobicContact CG-CG2 4.09Å; K510-R599 PolarHBondContact O-NE 2.72Å; K510-R599 PolarHBondContact O-NH2 2.81Å
511	S	79.1	Confident	85	Confident	65 Å²	65	55 Å²	55	46%	0.455	27%	0.265	S	S	.	.	S	Bend	trans	60.3	30.5	-174.8	-49.5	0	0	0	0	112.6	S508	S508-S511 PolarHBondContact OG-N 3.41Å
512	C	83.4	Confident	85.3	Confident	4 Å²	4	56.5 Å²	56.5	3%	0.027	27%	0.273	C	S	.	.			trans	-90.9	159.3	172.2	-57.9	0	0	0	0	110	S508 K510 E518 I521 D596	S508-C512 WeakPolarHBondContact CB-O 3.43Å; S508-C512 PolarHBondContact OG-N 3.04Å; S508-C512 PolarHBondContact OG-O 2.86Å; K510-C512 PolarHBondContact O-N 2.84Å; C512-E518 HydrophobicContact CB-CB 3.89Å; C512-I521 VanDerWaalsContact SG-CD1 3.53Å; C512-D596 WeakPolarHBondContact CA-OD1 3.28Å
513	L	86.5	Confident	85.7	Confident	36 Å²	36	55.8 Å²	55.8	19%	0.188	27%	0.268	C	S	.	.	S	Bend	trans	-111.6	-21.4	-178.3	-58.8	163.4	0	0	0	111.7	E504 I505 Y592 V595 D596 L716	E504-L513 CarbonylContact C-O 3.55Å; E504-L513 WeakPolarHBondContact CA-O 3.19Å; I505-L513 PolarHBondContact N-O 3.32Å; L513-Y592 HydrophobicContact CB-CD1 4.45Å; L513-Y592 HydrophobicContact CB-CD2 4.47Å; L513-Y592 HydrophobicContact CB-CG 3.99Å; L513-Y592 HydrophobicContact CD1-CD1 3.76Å; L513-Y592 HydrophobicContact CD1-CG 4.11Å; L513-V595 HydrophobicContact CD1-CB 4.36Å; L513-V595 HydrophobicContact CD1-CG1 4.22Å; L513-D596 VanDerWaalsContact N-CG 3.33Å; L513-D596 PolarHBondContact N-OD1 2.91Å; L513-D596 PolarHBondContact N-OD2 3.32Å; L513-D596 VanDerWaalsContact N-OD2 3.1Å; L513-L716 HydrophobicContact CD1-CD2 3.35Å; L513-L716 HydrophobicContact CD2-CD2 4.38Å; L513-L716 HydrophobicContact CG-CD2 4.5Å
514	I	90.3	Very high	86	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-117.1	130.3	-178.1	-57.5	-61.8	0	0	0	111	L502 I503 I505 V516 T517 E518 L589 F593 D596	L502-I514 HydrophobicContact CD2-CG2 4.04Å; I503-I514 CarbonylContact O-C 3.59Å; I503-I514 WeakPolarHBondContact O-CA 3.47Å; I505-I514 VanDerWaalsContact CD1-C 3.47Å; I514-V516 VanDerWaalsContact C-N 3.27Å; I514-V516 HydrophobicContact CG2-CB 4.35Å; I514-V516 PolarHBondContact O-N 3.47Å; I514-T517 PolarHBondContact O-N 3.45Å; I514-E518 PolarHBondContact O-N 3.42Å; I514-L589 HydrophobicContact CD1-CD2 4.3Å; I514-F593 HydrophobicContact CG1-CB 4.11Å; I514-F593 HydrophobicContact CG1-CD2 4.48Å; I514-D596 WeakPolarHBondContact CA-OD2 3.11Å; I514-D596 VanDerWaalsContact CB-OD2 3.27Å; I514-D596 WeakPolarHBondContact CB-OD2 3.27Å; I514-D596 PolarHBondContact N-OD2 2.87Å
515	E	90.5	Very high	86.3	Confident	51 Å²	51	49.9 Å²	49.9	24%	0.238	24%	0.241	C	C	.	.	H	α-helix	trans	-51.6	-45.2	-175.7	-172.4	-174.5	164.8	0	0	111.8	K500 I503 I505 T517 E518 V519	K500-E515 IonicContact NZ-OE1 2.79Å; K500-E515 PolarHBondContact NZ-OE1 3.49Å; K500-E515 IonicContact NZ-OE2 3.13Å; I503-E515 HydrophobicContact CB-CB 4.23Å; I503-E515 PolarHBondContact O-N 3.3Å; I505-E515 VanDerWaalsContact CD1-CA 3.46Å; I505-E515 HydrophobicContact CD1-CB 4.44Å; I505-E515 HydrophobicContact CG1-CB 4.15Å; I505-E515 VanDerWaalsContact CG1-N 3.28Å; E515-T517 VanDerWaalsContact C-N 3.34Å; E515-T517 PolarHBondContact O-N 3.47Å; E515-E518 PolarHBondContact O-N 2.89Å; E515-V519 HydrophobicContact CG-CG2 4.38Å; E515-V519 VanDerWaalsContact O-CG2 3.28Å; E515-V519 WeakPolarHBondContact O-CG2 3.49Å; E515-V519 PolarHBondContact O-N 3.5Å
516	V	93.1	Very high	86.9	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-60.4	-42.9	-178.4	-174.2	0	0	0	0	111.8	A497 M498 G501 I514 V519 V520 Y552 F555	A497-V516 HydrophobicContact CB-CG1 4.49Å; A497-V516 HydrophobicContact CB-CG2 4.3Å; A497-V516 WeakPolarHBondContact O-CG2 3.02Å; M498-V516 HydrophobicContact CG-CG1 3.69Å; G501-V516 WeakPolarHBondContact O-CG2 3.28Å; I514-V516 VanDerWaalsContact C-N 3.27Å; I514-V516 HydrophobicContact CG2-CB 4.35Å; I514-V516 PolarHBondContact O-N 3.47Å; V516-V519 PolarHBondContact O-N 2.89Å; V516-V520 WeakPolarHBondContact O-CB 3.45Å; V516-V520 VanDerWaalsContact O-CG2 3.26Å; V516-V520 WeakPolarHBondContact O-CG2 3.35Å; V516-V520 PolarHBondContact O-N 3.45Å; V516-Y552 HydrophobicContact CG1-CD2 4.46Å; V516-Y552 HydrophobicContact CG1-CE2 4.25Å; V516-F555 HydrophobicContact CB-CE1 4.39Å; V516-F555 HydrophobicContact CG1-CD1 4.31Å; V516-F555 HydrophobicContact CG1-CE1 3.96Å; V516-F555 HydrophobicContact CG1-CZ 4.28Å; V516-F555 HydrophobicContact CG2-CE1 4.45Å; V516-F555 HydrophobicContact CG2-CZ 4.2Å
517	T	92.8	Very high	87.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-68.2	-43.1	-179.8	-44.7	0	0	0	0	111	I514 E515 V519 V520 I521 Y552 D596 L600	I514-T517 PolarHBondContact O-N 3.45Å; E515-T517 VanDerWaalsContact C-N 3.34Å; E515-T517 PolarHBondContact O-N 3.47Å; T517-V519 VanDerWaalsContact C-N 3.33Å; T517-V519 PolarHBondContact O-N 3.29Å; T517-V520 PolarHBondContact O-N 3.46Å; T517-I521 HydrophobicContact CG2-CD1 4.34Å; T517-I521 WeakPolarHBondContact O-CG1 3.41Å; T517-I521 PolarHBondContact O-N 3.03Å; T517-Y552 PolarHBondContact OG1-OH 2.97Å; T517-D596 WeakPolarHBondContact CB-OD2 3.45Å; T517-D596 HydrophobicContact CG2-CB 3.76Å; T517-D596 WeakPolarHBondContact CG2-O 3.14Å; T517-D596 WeakPolarHBondContact OG1-CB 3.38Å; T517-D596 PolarHBondContact OG1-OD2 3.48Å; T517-D596 VanDerWaalsContact OG1-OD2 3.11Å; T517-L600 HydrophobicContact CG2-CB 4.34Å
518	E	92.8	Very high	88.9	Confident	22 Å²	22	33.8 Å²	33.8	10%	0.103	16%	0.164	C	C	.	.	H	α-helix	trans	-60.6	-44	175.3	-177.5	158.5	-172.2	0	0	111.4	I505 S508 R509 K510 C512 I514 E515 V520 I521 C522	I505-E518 HydrophobicContact CD1-CB 3.58Å; I505-E518 HydrophobicContact CD1-CG 4.34Å; I505-E518 WeakPolarHBondContact CD1-OE2 3.29Å; S508-E518 WeakPolarHBondContact CA-OE2 3.46Å; S508-E518 VanDerWaalsContact CB-OE2 3.26Å; S508-E518 WeakPolarHBondContact CB-OE2 3.2Å; S508-E518 PolarHBondContact OG-OE1 2.97Å; S508-E518 PolarHBondContact OG-OE2 3.43Å; R509-E518 WeakPolarHBondContact CB-OE1 3.36Å; R509-E518 PolarHBondContact N-OE1 2.84Å; K510-E518 HydrophobicContact CB-CG 4.48Å; C512-E518 HydrophobicContact CB-CB 3.89Å; I514-E518 PolarHBondContact O-N 3.42Å; E515-E518 PolarHBondContact O-N 2.89Å; E518-V520 VanDerWaalsContact C-N 3.34Å; E518-V520 PolarHBondContact O-N 3.4Å; E518-I521 PolarHBondContact O-N 3.29Å; E518-C522 WeakPolarHBondContact O-CB 3.47Å; E518-C522 PolarHBondContact O-N 3.1Å; E518-C522 PolarHBondContact O-SG 2.93Å
519	V	93.5	Very high	89.7	Confident	30 Å²	30	36.5 Å²	36.5	18%	0.182	17%	0.173	C	C	.	.	H	α-helix	trans	-61.8	-43.3	177.2	171.9	0	0	0	0	110.9	N493 A497 E515 V516 T517 C522 Q523	N493-V519 HydrophobicContact CB-CG1 4.36Å; A497-V519 HydrophobicContact CB-CB 3.92Å; A497-V519 HydrophobicContact CB-CG1 3.87Å; A497-V519 HydrophobicContact CB-CG2 3.99Å; E515-V519 HydrophobicContact CG-CG2 4.38Å; E515-V519 VanDerWaalsContact O-CG2 3.28Å; E515-V519 WeakPolarHBondContact O-CG2 3.49Å; E515-V519 PolarHBondContact O-N 3.5Å; V516-V519 PolarHBondContact O-N 2.89Å; T517-V519 VanDerWaalsContact C-N 3.33Å; T517-V519 PolarHBondContact O-N 3.29Å; V519-C522 PolarHBondContact O-N 3.18Å; V519-Q523 HydrophobicContact CG1-CG 4.13Å; V519-Q523 VanDerWaalsContact O-CB 3.31Å; V519-Q523 WeakPolarHBondContact O-CB 3.3Å; V519-Q523 VanDerWaalsContact O-CG 3.23Å; V519-Q523 WeakPolarHBondContact O-CG 3.46Å; V519-Q523 PolarHBondContact O-N 2.85Å
520	V	95.4	Very high	90.4	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.5	-48.7	177.2	165.9	0	0	0	0	111.5	V494 M498 V516 T517 E518 C522 Q523 L524 I548 Y552 L600	V494-V520 HydrophobicContact CG1-CG2 3.93Å; V494-V520 HydrophobicContact CG2-CG2 4.46Å; M498-V520 HydrophobicContact CE-CG2 4.24Å; V516-V520 WeakPolarHBondContact O-CB 3.45Å; V516-V520 VanDerWaalsContact O-CG2 3.26Å; V516-V520 WeakPolarHBondContact O-CG2 3.35Å; V516-V520 PolarHBondContact O-N 3.45Å; T517-V520 PolarHBondContact O-N 3.46Å; E518-V520 VanDerWaalsContact C-N 3.34Å; E518-V520 PolarHBondContact O-N 3.4Å; V520-C522 VanDerWaalsContact C-N 3.34Å; V520-C522 PolarHBondContact O-N 3.33Å; V520-Q523 PolarHBondContact O-N 3.35Å; V520-L524 HydrophobicContact CG1-CD1 3.93Å; V520-L524 HydrophobicContact CG1-CG 4.4Å; V520-L524 WeakPolarHBondContact O-CB 3.47Å; V520-L524 VanDerWaalsContact O-CG 3.31Å; V520-L524 WeakPolarHBondContact O-CG 3.1Å; V520-L524 PolarHBondContact O-N 3.36Å; V520-I548 HydrophobicContact CG1-CG2 3.89Å; V520-Y552 HydrophobicContact CB-CD2 4.39Å; V520-Y552 HydrophobicContact CG1-CD2 4.4Å; V520-Y552 HydrophobicContact CG2-CD2 3.76Å; V520-Y552 HydrophobicContact CG2-CE2 4.31Å; V520-L600 HydrophobicContact CG1-CD1 4.06Å; V520-L600 HydrophobicContact CG1-CD2 4.2Å
521	I	94.4	Very high	91.2	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-60.3	-45.7	176.9	-69.1	178	0	0	0	110.6	K510 C512 T517 E518 Q523 L524 N525 L600 Y603	K510-I521 HydrophobicContact CB-CG2 4.4Å; K510-I521 HydrophobicContact CD-CG2 4.12Å; K510-I521 HydrophobicContact CG-CG2 4.09Å; C512-I521 VanDerWaalsContact SG-CD1 3.53Å; T517-I521 HydrophobicContact CG2-CD1 4.34Å; T517-I521 WeakPolarHBondContact O-CG1 3.41Å; T517-I521 PolarHBondContact O-N 3.03Å; E518-I521 PolarHBondContact O-N 3.29Å; I521-Q523 VanDerWaalsContact C-N 3.33Å; I521-Q523 PolarHBondContact O-N 3.43Å; I521-L524 PolarHBondContact O-N 3.48Å; I521-N525 PolarHBondContact O-N 3.33Å; I521-L600 HydrophobicContact CD1-CD1 4.41Å; I521-L600 HydrophobicContact CG1-CD1 3.67Å; I521-Y603 HydrophobicContact CD1-CG 4.4Å; I521-Y603 HydrophobicContact CG1-CD1 4.24Å; I521-Y603 HydrophobicContact CG1-CG 4.26Å; I521-Y603 HydrophobicContact CG2-CD1 4.08Å; I521-Y603 HydrophobicContact CG2-CD2 3.7Å; I521-Y603 HydrophobicContact CG2-CE1 4.08Å; I521-Y603 HydrophobicContact CG2-CE2 3.69Å; I521-Y603 HydrophobicContact CG2-CG 3.91Å
522	C	93.9	Very high	91.8	Very high	44 Å²	44	30 Å²	30	30%	0.297	15%	0.149	S	C	.	.	H	α-helix	trans	-61.6	-41.2	177.5	-68.7	0	0	0	0	112	E518 V519 V520 R526	E518-C522 WeakPolarHBondContact O-CB 3.47Å; E518-C522 PolarHBondContact O-N 3.1Å; E518-C522 PolarHBondContact O-SG 2.93Å; V519-C522 PolarHBondContact O-N 3.18Å; V520-C522 VanDerWaalsContact C-N 3.34Å; V520-C522 PolarHBondContact O-N 3.33Å; C522-R526 VanDerWaalsContact O-CB 3.26Å; C522-R526 WeakPolarHBondContact O-CB 3.3Å; C522-R526 PolarHBondContact O-N 3.08Å
523	Q	94.9	Very high	92.2	Very high	16 Å²	16	30.7 Å²	30.7	8%	0.075	15%	0.151	C	C	.	.	H	α-helix	trans	-71.8	-33.7	178.9	-73.8	-18.4	-80.9	0	0	112.6	I490 N493 V494 V519 V520 I521 R526 C527	I490-Q523 HydrophobicContact CG2-CB 3.77Å; I490-Q523 HydrophobicContact CG2-CG 4.18Å; N493-Q523 HydrophobicContact CB-CG 4.08Å; N493-Q523 PolarHBondContact ND2-OE1 3.07Å; V494-Q523 HydrophobicContact CG2-CB 3.7Å; V494-Q523 HydrophobicContact CG2-CG 3.55Å; V519-Q523 HydrophobicContact CG1-CG 4.13Å; V519-Q523 VanDerWaalsContact O-CB 3.31Å; V519-Q523 WeakPolarHBondContact O-CB 3.3Å; V519-Q523 VanDerWaalsContact O-CG 3.23Å; V519-Q523 WeakPolarHBondContact O-CG 3.46Å; V519-Q523 PolarHBondContact O-N 2.85Å; V520-Q523 PolarHBondContact O-N 3.35Å; I521-Q523 VanDerWaalsContact C-N 3.33Å; I521-Q523 PolarHBondContact O-N 3.43Å; Q523-R526 PolarHBondContact O-N 3.23Å; Q523-C527 PolarHBondContact O-N 2.86Å; Q523-C527 PolarHBondContact O-SG 3.36Å; Q523-C527 VanDerWaalsContact O-SG 3.36Å
524	L	95	Very high	92.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.9	-45.5	172.4	-73.1	169.7	0	0	0	111.2	V520 I521 R526 C527 T545 I548 L549 L600 Y603 L608	V520-L524 HydrophobicContact CG1-CD1 3.93Å; V520-L524 HydrophobicContact CG1-CG 4.4Å; V520-L524 WeakPolarHBondContact O-CB 3.47Å; V520-L524 VanDerWaalsContact O-CG 3.31Å; V520-L524 WeakPolarHBondContact O-CG 3.1Å; V520-L524 PolarHBondContact O-N 3.36Å; I521-L524 PolarHBondContact O-N 3.48Å; L524-R526 VanDerWaalsContact C-N 3.32Å; L524-R526 PolarHBondContact O-N 2.95Å; L524-C527 WeakPolarHBondContact O-CB 3.15Å; L524-C527 PolarHBondContact O-N 3.31Å; L524-T545 HydrophobicContact CD2-CG2 3.91Å; L524-I548 HydrophobicContact CD2-CB 3.91Å; L524-I548 HydrophobicContact CD2-CD1 4.25Å; L524-I548 HydrophobicContact CD2-CG2 3.77Å; L524-I548 HydrophobicContact CG-CG2 3.94Å; L524-L549 HydrophobicContact CD1-CD2 3.75Å; L524-L549 HydrophobicContact CD1-CG 4.48Å; L524-L549 HydrophobicContact CD2-CD2 4.45Å; L524-L549 HydrophobicContact CD2-CG 4.32Å; L524-L600 HydrophobicContact CD1-CD1 3.87Å; L524-Y603 HydrophobicContact CB-CE1 4.04Å; L524-Y603 HydrophobicContact CD1-CE1 4.4Å; L524-L608 HydrophobicContact CB-CD1 4.43Å; L524-L608 HydrophobicContact CD1-CD2 4.5Å; L524-L608 HydrophobicContact CD2-CD2 4.47Å
525	N	93.2	Very high	92.2	Very high	40 Å²	40	32.6 Å²	32.6	21%	0.214	16%	0.162	C	C	.	.	H	α-helix	trans	-58.1	-47	172.7	-169.3	-6	0	0	0	110.9	I521 C527 W528 E529 Y603	I521-N525 PolarHBondContact O-N 3.33Å; N525-C527 PolarHBondContact O-N 3.3Å; N525-C527 VanDerWaalsContact O-N 3.1Å; N525-W528 PolarHBondContact O-N 2.95Å; N525-E529 PolarHBondContact O-N 3.1Å; N525-Y603 WeakPolarHBondContact CA-OH 3.2Å; N525-Y603 VanDerWaalsContact CB-OH 3.29Å; N525-Y603 WeakPolarHBondContact CB-OH 3.38Å; N525-Y603 PolarHBondContact N-OH 3.26Å
526	R	93	Very high	92.1	Very high	69 Å²	69	34.6 Å²	34.6	26%	0.26	17%	0.17	S	C	.	.	H	α-helix	trans	-57.9	-27.8	-179.3	-166.2	174.9	171.9	159.1	-5	113.6	E489 I490 C522 Q523 L524 W528 I532	E489-R526 IonicContact OE2-CZ 3.41Å; E489-R526 IonicContact OE2-NH2 3.32Å; E489-R526 PolarHBondContact OE2-NH2 3.31Å; I490-R526 HydrophobicContact CD1-CG 4.46Å; I490-R526 HydrophobicContact CG1-CG 4.33Å; C522-R526 VanDerWaalsContact O-CB 3.26Å; C522-R526 WeakPolarHBondContact O-CB 3.3Å; C522-R526 PolarHBondContact O-N 3.08Å; Q523-R526 PolarHBondContact O-N 3.23Å; L524-R526 VanDerWaalsContact C-N 3.32Å; L524-R526 PolarHBondContact O-N 2.95Å; R526-W528 PolarHBondContact O-N 2.87Å; R526-I532 HydrophobicContact CB-CD1 4.43Å; R526-I532 HydrophobicContact CG-CD1 3.16Å; R526-I532 WeakPolarHBondContact O-CG2 3.41Å
527	C	93.5	Very high	92.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63	-29.1	173.9	-72.1	0	0	0	0	113.6	Q523 L524 N525 F541	Q523-C527 PolarHBondContact O-N 2.86Å; Q523-C527 PolarHBondContact O-SG 3.36Å; Q523-C527 VanDerWaalsContact O-SG 3.36Å; L524-C527 WeakPolarHBondContact O-CB 3.15Å; L524-C527 PolarHBondContact O-N 3.31Å; N525-C527 PolarHBondContact O-N 3.3Å; N525-C527 VanDerWaalsContact O-N 3.1Å; C527-F541 HydrophobicContact CB-CD1 4.13Å; C527-F541 VanDerWaalsContact O-CD1 3.24Å; C527-F541 WeakPolarHBondContact O-CD1 3.41Å
528	W	92.8	Very high	92	Very high	11 Å²	11	36.1 Å²	36.1	4%	0.042	18%	0.177	C	C	.	.	H	α-helix	trans	-116.1	1.3	-173	-56.7	98.6	0	0	0	112.9	N525 R526 Y533 I538 F541 W542 T545 I612 C615	N525-W528 PolarHBondContact O-N 2.95Å; R526-W528 PolarHBondContact O-N 2.87Å; W528-Y533 AromaticContact CE3-CD2 3.7Å; W528-Y533 HydrophobicContact CE3-CD2 3.7Å; W528-Y533 AromaticContact CE3-CE2 3.7Å; W528-Y533 HydrophobicContact CE3-CE2 3.7Å; W528-Y533 HydrophobicContact CE3-CG 4.44Å; W528-Y533 AromaticContact CZ3-CD2 3.99Å; W528-Y533 HydrophobicContact CZ3-CD2 3.99Å; W528-Y533 AromaticContact CZ3-CE2 3.53Å; W528-Y533 HydrophobicContact CZ3-CE2 3.53Å; W528-I538 HydrophobicContact CH2-CG1 4.35Å; W528-I538 HydrophobicContact CZ3-CG1 4.15Å; W528-F541 HydrophobicContact CH2-CB 4.44Å; W528-F541 HydrophobicContact CZ2-CB 4.47Å; W528-W542 HydrophobicContact CH2-CB 4.15Å; W528-W542 HydrophobicContact CH2-CE3 4.31Å; W528-W542 HydrophobicContact CZ2-CB 4.35Å; W528-W542 HydrophobicContact CZ2-CE3 4.06Å; W528-T545 PolarHBondContact NE1-OG1 3.36Å; W528-I612 HydrophobicContact CD2-CG1 3.75Å; W528-I612 HydrophobicContact CE3-CG1 4.25Å; W528-I612 HydrophobicContact CG-CG1 4.08Å; W528-I612 HydrophobicContact CH2-CG1 4.33Å; W528-I612 HydrophobicContact CH2-CG2 4.24Å; W528-I612 HydrophobicContact CZ2-CD1 3.89Å; W528-I612 HydrophobicContact CZ2-CG1 3.84Å; W528-I612 HydrophobicContact CZ2-CG2 4.45Å; W528-I612 HydrophobicContact CZ3-CG2 4.46Å; W528-C615 HydrophobicContact CE3-CB 4.4Å
529	E	91	Very high	91.9	Very high	97 Å²	97	40.5 Å²	40.5	45%	0.453	20%	0.198	S	C	.	.	S	Bend	trans	-67.8	142.4	179.1	-168.5	178.9	-176.1	0	0	112.5	N525 G531 I532 Y533	N525-E529 PolarHBondContact O-N 3.1Å; E529-G531 PolarHBondContact O-N 2.82Å; E529-I532 PolarHBondContact O-N 3.28Å; E529-I532 VanDerWaalsContact O-N 3.15Å; E529-Y533 PolarHBondContact O-N 2.93Å
530	K	87.5	Confident	91.9	Very high	178 Å²	178	42.8 Å²	42.8	77%	0.774	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	126.8	170.6	-66.1	-176.8	-179.6	179	0	109.4
531	G	88.7	Confident	91.9	Very high	21 Å²	21	42.8 Å²	42.8	22%	0.216	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	111.9	-19.7	-170.1	0	0	0	0	0	113.6	Y438 R486 E529	Y438-G531 WeakPolarHBondContact CD2-O 3.38Å; Y438-G531 VanDerWaalsContact CZ-CA 3.49Å; Y438-G531 PolarHBondContact OH-N 3.48Å; R486-G531 PolarHBondContact NH2-O 3.47Å; E529-G531 PolarHBondContact O-N 2.82Å
532	I	91.4	Very high	91.8	Very high	9 Å²	9	44.9 Å²	44.9	5%	0.046	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.3	-47.4	-174.8	-58.8	177.8	0	0	0	110.4	Y482 R486 I490 R526 E529 L534 F541	Y482-I532 PolarHBondContact OH-O 3.44Å; R486-I532 HydrophobicContact CG-CG2 4.31Å; I490-I532 HydrophobicContact CD1-CG2 4.37Å; R526-I532 HydrophobicContact CB-CD1 4.43Å; R526-I532 HydrophobicContact CG-CD1 3.16Å; R526-I532 WeakPolarHBondContact O-CG2 3.41Å; E529-I532 PolarHBondContact O-N 3.28Å; E529-I532 VanDerWaalsContact O-N 3.15Å; I532-L534 PolarHBondContact O-N 3.4Å; I532-F541 HydrophobicContact CG2-CE1 4Å; I532-F541 HydrophobicContact CG2-CZ 4.08Å; I532-F541 WeakPolarHBondContact O-CZ 3.3Å
533	Y	91.9	Very high	91.8	Very high	17 Å²	17	48.9 Å²	48.9	7%	0.067	22%	0.223	C	C	.	.			trans	-72.2	125	-178.7	171.1	-99.8	0	0	0	112.3	Y438 W528 E529 D535 I538 F541 C615	Y438-Y533 VanDerWaalsContact CE2-O 3.31Å; Y438-Y533 WeakPolarHBondContact CE2-O 3.41Å; W528-Y533 AromaticContact CE3-CD2 3.7Å; W528-Y533 HydrophobicContact CE3-CD2 3.7Å; W528-Y533 AromaticContact CE3-CE2 3.7Å; W528-Y533 HydrophobicContact CE3-CE2 3.7Å; W528-Y533 HydrophobicContact CE3-CG 4.44Å; W528-Y533 AromaticContact CZ3-CD2 3.99Å; W528-Y533 HydrophobicContact CZ3-CD2 3.99Å; W528-Y533 AromaticContact CZ3-CE2 3.53Å; W528-Y533 HydrophobicContact CZ3-CE2 3.53Å; E529-Y533 PolarHBondContact O-N 2.93Å; Y533-D535 WeakPolarHBondContact CE1-OD1 3.15Å; Y533-D535 PolarHBondContact OH-OD1 3.23Å; Y533-I538 HydrophobicContact CE2-CB 4.24Å; Y533-I538 HydrophobicContact CE2-CG1 4.12Å; Y533-I538 WeakPolarHBondContact OH-CD1 3.22Å; Y533-F541 HydrophobicContact CD2-CB 4.38Å; Y533-F541 AromaticContact CD2-CD2 4Å; Y533-F541 HydrophobicContact CD2-CD2 4Å; Y533-F541 HydrophobicContact CD2-CG 4.29Å; Y533-C615 HydrophobicContact CE1-CB 4Å
534	L	91.4	Very high	91.9	Very high	7 Å²	7	48.2 Å²	48.2	4%	0.037	22%	0.22	C	C	.	.			trans	-117.1	130.2	172.9	-69.3	178.1	0	0	0	110.6	Y438 Y441 L479 Y482 I532 K536 L537 I538	Y438-L534 HydrophobicContact CD2-CD2 3.46Å; Y438-L534 VanDerWaalsContact CD2-CD2 3.46Å; Y438-L534 HydrophobicContact CD2-CG 3.92Å; Y438-L534 HydrophobicContact CE2-CD2 3.46Å; Y438-L534 VanDerWaalsContact CE2-CD2 3.46Å; Y438-L534 HydrophobicContact CE2-CG 4.11Å; Y441-L534 HydrophobicContact CD1-CD1 4.19Å; Y441-L534 HydrophobicContact CD1-CD2 3.63Å; Y441-L534 HydrophobicContact CE1-CD1 4.34Å; Y441-L534 HydrophobicContact CE1-CD2 3.82Å; L479-L534 HydrophobicContact CD2-CD1 4.08Å; Y482-L534 HydrophobicContact CD1-CD1 3.78Å; Y482-L534 HydrophobicContact CE1-CD1 3.52Å; Y482-L534 HydrophobicContact CE1-CG 4.04Å; Y482-L534 HydrophobicContact CG-CD1 4.48Å; I532-L534 PolarHBondContact O-N 3.4Å; L534-K536 VanDerWaalsContact C-N 3.26Å; L534-K536 PolarHBondContact O-N 3.32Å; L534-K536 VanDerWaalsContact O-N 3.14Å; L534-L537 HydrophobicContact CB-CB 4.44Å; L534-L537 HydrophobicContact CB-CD1 4.25Å; L534-L537 HydrophobicContact CB-CG 4.46Å; L534-L537 HydrophobicContact CD1-CD1 4.16Å; L534-L537 WeakPolarHBondContact O-CA 3.36Å; L534-L537 PolarHBondContact O-N 3.47Å; L534-I538 PolarHBondContact O-N 3.27Å
535	D	86.7	Confident	91.9	Very high	70 Å²	70	48.2 Å²	48.2	37%	0.374	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-54.6	-38	-177.1	-66.3	-30.8	0	0	0	114	Y533 L537 I538 R619	Y533-D535 WeakPolarHBondContact CE1-OD1 3.15Å; Y533-D535 PolarHBondContact OH-OD1 3.23Å; D535-L537 PolarHBondContact O-N 2.75Å; D535-I538 WeakPolarHBondContact O-CB 3.37Å; D535-I538 WeakPolarHBondContact O-CG2 3.22Å; D535-I538 PolarHBondContact O-N 2.7Å; D535-R619 PolarHBondContact O-NH1 2.86Å
536	K	88	Confident	91.9	Very high	93 Å²	93	48.6 Å²	48.6	40%	0.404	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-66.6	-18.4	178.4	-67.4	-160.9	-175.5	177.2	0	112.8	Y441 L479 L534	Y441-K536 VanDerWaalsContact OH-CD 3.24Å; Y441-K536 WeakPolarHBondContact OH-CD 3.42Å; Y441-K536 WeakPolarHBondContact OH-CE 3.35Å; L479-K536 HydrophobicContact CD1-CB 3.81Å; L479-K536 HydrophobicContact CD1-CD 3.88Å; L479-K536 HydrophobicContact CD1-CG 4.43Å; L534-K536 VanDerWaalsContact C-N 3.26Å; L534-K536 PolarHBondContact O-N 3.32Å; L534-K536 VanDerWaalsContact O-N 3.14Å
537	L	91.7	Very high	92.1	Very high	5 Å²	5	49.2 Å²	49.2	3%	0.026	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-106.5	12.5	-178.3	-65.2	175.4	0	0	0	113.3	L479 Y482 F483 L534 D535 H539 R540 F541	L479-L537 HydrophobicContact CB-CD1 4.33Å; L479-L537 HydrophobicContact CB-CD2 4.03Å; L479-L537 HydrophobicContact CB-CG 4.36Å; Y482-L537 HydrophobicContact CD1-CD1 3.61Å; Y482-L537 HydrophobicContact CE1-CD1 4.11Å; F483-L537 HydrophobicContact CB-CD1 4.04Å; F483-L537 HydrophobicContact CB-CD2 4.37Å; L534-L537 HydrophobicContact CB-CB 4.44Å; L534-L537 HydrophobicContact CB-CD1 4.25Å; L534-L537 HydrophobicContact CB-CG 4.46Å; L534-L537 HydrophobicContact CD1-CD1 4.16Å; L534-L537 WeakPolarHBondContact O-CA 3.36Å; L534-L537 PolarHBondContact O-N 3.47Å; D535-L537 PolarHBondContact O-N 2.75Å; L537-H539 VanDerWaalsContact C-N 3.3Å; L537-H539 PolarHBondContact O-N 3.48Å; L537-R540 HydrophobicContact CD2-CG 4.44Å; L537-R540 WeakPolarHBondContact O-CA 3.19Å; L537-R540 WeakPolarHBondContact O-CB 3.46Å; L537-R540 PolarHBondContact O-N 2.95Å; L537-F541 HydrophobicContact CB-CD2 3.91Å; L537-F541 HydrophobicContact CB-CE2 3.88Å; L537-F541 HydrophobicContact CD1-CE2 4.35Å; L537-F541 PolarHBondContact O-N 3.17Å
538	I	90.5	Very high	92.2	Very high	27 Å²	27	49.5 Å²	49.5	14%	0.138	23%	0.229	C	C	.	.	H	α-helix	trans	-51.2	-45.7	-177.2	-167.7	168.9	0	0	0	113.6	W528 Y533 L534 D535 R540 F541 W542 L616	W528-I538 HydrophobicContact CH2-CG1 4.35Å; W528-I538 HydrophobicContact CZ3-CG1 4.15Å; Y533-I538 HydrophobicContact CE2-CB 4.24Å; Y533-I538 HydrophobicContact CE2-CG1 4.12Å; Y533-I538 WeakPolarHBondContact OH-CD1 3.22Å; L534-I538 PolarHBondContact O-N 3.27Å; D535-I538 WeakPolarHBondContact O-CB 3.37Å; D535-I538 WeakPolarHBondContact O-CG2 3.22Å; D535-I538 PolarHBondContact O-N 2.7Å; I538-R540 PolarHBondContact O-N 3.18Å; I538-F541 PolarHBondContact O-N 2.97Å; I538-W542 VanDerWaalsContact O-CB 3.24Å; I538-W542 WeakPolarHBondContact O-CB 3.39Å; I538-W542 PolarHBondContact O-N 3.08Å; I538-L616 HydrophobicContact CD1-CD2 3.19Å; I538-L616 HydrophobicContact CD1-CG 3.97Å; I538-L616 HydrophobicContact CG1-CD2 4.42Å
539	H	91.4	Very high	92.3	Very high	115 Å²	115	49 Å²	49	53%	0.532	23%	0.227	S	C	.	.	H	α-helix	trans	-60.6	-30.1	178.8	64	-78.7	0	0	0	112.6	L537 K543	L537-H539 VanDerWaalsContact C-N 3.3Å; L537-H539 PolarHBondContact O-N 3.48Å; H539-K543 WeakPolarHBondContact O-CB 3.27Å; H539-K543 PolarHBondContact O-N 3.07Å
540	R	94.1	Very high	92.4	Very high	78 Å²	78	46.8 Å²	46.8	29%	0.294	22%	0.223	S	C	.	.	H	α-helix	trans	-82.2	-41.8	178.5	-54.5	-161.4	178.5	-167.3	-5.4	112.4	F483 L537 I538 W542 K543 L544	F483-R540 HydrophobicContact CD1-CB 4.07Å; F483-R540 HydrophobicContact CD1-CG 4.45Å; F483-R540 HydrophobicContact CD2-CB 3.64Å; F483-R540 HydrophobicContact CE1-CB 3.8Å; F483-R540 HydrophobicContact CE1-CG 4.5Å; F483-R540 HydrophobicContact CE2-CB 3.35Å; F483-R540 HydrophobicContact CG-CB 3.99Å; F483-R540 HydrophobicContact CG-CG 4.46Å; F483-R540 HydrophobicContact CZ-CB 3.44Å; F483-R540 VanDerWaalsContact CZ-CB 3.44Å; F483-R540 WeakPolarHBondContact CZ-O 3.42Å; L537-R540 HydrophobicContact CD2-CG 4.44Å; L537-R540 WeakPolarHBondContact O-CA 3.19Å; L537-R540 WeakPolarHBondContact O-CB 3.46Å; L537-R540 PolarHBondContact O-N 2.95Å; I538-R540 PolarHBondContact O-N 3.18Å; R540-W542 VanDerWaalsContact C-N 3.35Å; R540-K543 PolarHBondContact O-N 3.43Å; R540-L544 WeakPolarHBondContact O-CB 3.35Å; R540-L544 PolarHBondContact O-N 3.1Å
541	F	94.3	Very high	92.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-66.7	-37.3	174.6	-78.1	-71.1	0	0	0	112.1	F483 I490 C527 W528 I532 Y533 L537 I538 L544 T545	F483-F541 HydrophobicContact CD2-CD2 4.41Å; F483-F541 HydrophobicContact CD2-CE1 4.43Å; F483-F541 HydrophobicContact CD2-CE2 4.16Å; F483-F541 HydrophobicContact CD2-CZ 4.18Å; F483-F541 HydrophobicContact CE2-CD1 4.1Å; F483-F541 HydrophobicContact CE2-CD2 4.36Å; F483-F541 HydrophobicContact CE2-CE1 4.21Å; F483-F541 HydrophobicContact CE2-CE2 4.46Å; F483-F541 HydrophobicContact CE2-CG 4.18Å; F483-F541 HydrophobicContact CE2-CZ 4.4Å; I490-F541 HydrophobicContact CD1-CE1 4.41Å; C527-F541 HydrophobicContact CB-CD1 4.13Å; C527-F541 VanDerWaalsContact O-CD1 3.24Å; C527-F541 WeakPolarHBondContact O-CD1 3.41Å; W528-F541 HydrophobicContact CH2-CB 4.44Å; W528-F541 HydrophobicContact CZ2-CB 4.47Å; I532-F541 HydrophobicContact CG2-CE1 4Å; I532-F541 HydrophobicContact CG2-CZ 4.08Å; I532-F541 WeakPolarHBondContact O-CZ 3.3Å; Y533-F541 HydrophobicContact CD2-CB 4.38Å; Y533-F541 AromaticContact CD2-CD2 4Å; Y533-F541 HydrophobicContact CD2-CD2 4Å; Y533-F541 HydrophobicContact CD2-CG 4.29Å; L537-F541 HydrophobicContact CB-CD2 3.91Å; L537-F541 HydrophobicContact CB-CE2 3.88Å; L537-F541 HydrophobicContact CD1-CE2 4.35Å; L537-F541 PolarHBondContact O-N 3.17Å; I538-F541 PolarHBondContact O-N 2.97Å; F541-L544 PolarHBondContact O-N 3.39Å; F541-T545 WeakPolarHBondContact O-CB 3.48Å; F541-T545 PolarHBondContact O-N 3.15Å; F541-T545 PolarHBondContact O-OG1 3.06Å
542	W	93.2	Very high	93	Very high	45 Å²	45	40.8 Å²	40.8	17%	0.17	19%	0.188	C	C	.	.	H	α-helix	trans	-58.7	-50.5	169.6	177.2	-110	0	0	0	111.8	W528 I538 R540 L544 T545 L546 I612 L640 C643 L644	W528-W542 HydrophobicContact CH2-CB 4.15Å; W528-W542 HydrophobicContact CH2-CE3 4.31Å; W528-W542 HydrophobicContact CZ2-CB 4.35Å; W528-W542 HydrophobicContact CZ2-CE3 4.06Å; I538-W542 VanDerWaalsContact O-CB 3.24Å; I538-W542 WeakPolarHBondContact O-CB 3.39Å; I538-W542 PolarHBondContact O-N 3.08Å; R540-W542 VanDerWaalsContact C-N 3.35Å; W542-L544 VanDerWaalsContact C-N 3.32Å; W542-L544 PolarHBondContact O-N 3.47Å; W542-T545 WeakPolarHBondContact O-CB 3.42Å; W542-T545 PolarHBondContact O-N 2.83Å; W542-L546 HydrophobicContact CH2-CD2 4.46Å; W542-L546 HydrophobicContact CZ2-CD1 4.05Å; W542-L546 HydrophobicContact CZ2-CD2 4.16Å; W542-L546 HydrophobicContact CZ2-CG 4.31Å; W542-L546 PolarHBondContact O-N 3.22Å; W542-L546 VanDerWaalsContact O-N 3.16Å; W542-I612 HydrophobicContact CE3-CD1 4.27Å; W542-I612 HydrophobicContact CE3-CG2 4.43Å; W542-I612 HydrophobicContact CZ3-CD1 3.88Å; W542-I612 HydrophobicContact CZ3-CG2 4.24Å; W542-L640 HydrophobicContact CD2-CD2 4.03Å; W542-L640 HydrophobicContact CE3-CD2 4.27Å; W542-L640 HydrophobicContact CH2-CB 4.11Å; W542-L640 HydrophobicContact CH2-CD2 3.62Å; W542-L640 HydrophobicContact CH2-CG 4.45Å; W542-L640 HydrophobicContact CZ2-CD2 3.34Å; W542-L640 HydrophobicContact CZ3-CD2 4.08Å; W542-C643 HydrophobicContact CH2-CB 4.42Å; W542-C643 HydrophobicContact CZ2-CB 3.91Å; W542-L644 HydrophobicContact CH2-CD2 3.94Å; W542-L644 HydrophobicContact CH2-CG 3.91Å; W542-L644 HydrophobicContact CZ3-CD2 4.13Å; W542-L644 HydrophobicContact CZ3-CG 4.33Å
543	K	94.7	Very high	93.1	Very high	128 Å²	128	40.4 Å²	40.4	56%	0.557	19%	0.187	S	C	*	.	H	α-helix	trans	-57.3	-45.1	175.2	-176.8	-179.7	178.9	179.6	0	111.9	H539 R540 T545 L546 Q547	H539-K543 WeakPolarHBondContact O-CB 3.27Å; H539-K543 PolarHBondContact O-N 3.07Å; R540-K543 PolarHBondContact O-N 3.43Å; K543-T545 VanDerWaalsContact C-N 3.33Å; K543-T545 PolarHBondContact O-N 3.11Å; K543-L546 PolarHBondContact O-N 3.22Å; K543-Q547 HydrophobicContact CG-CG 4.37Å; K543-Q547 WeakPolarHBondContact O-CB 3.38Å; K543-Q547 VanDerWaalsContact O-CG 3.25Å; K543-Q547 WeakPolarHBondContact O-CG 3.41Å; K543-Q547 PolarHBondContact O-N 2.84Å
544	L	95.4	Very high	93.1	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-61.3	-40.9	178.3	178.3	55.4	0	0	0	111.9	F483 F487 I490 A491 R540 F541 W542 L546 Q547 I548	F483-L544 HydrophobicContact CZ-CB 4.28Å; F483-L544 HydrophobicContact CZ-CD2 4.38Å; F487-L544 HydrophobicContact CD2-CD1 3.66Å; F487-L544 HydrophobicContact CD2-CD2 4.29Å; F487-L544 HydrophobicContact CD2-CG 4.48Å; F487-L544 HydrophobicContact CE2-CD1 3.69Å; I490-L544 HydrophobicContact CB-CD2 4.29Å; I490-L544 HydrophobicContact CD1-CD2 4.12Å; I490-L544 HydrophobicContact CG2-CD2 4.16Å; A491-L544 HydrophobicContact CB-CD1 4.47Å; R540-L544 WeakPolarHBondContact O-CB 3.35Å; R540-L544 PolarHBondContact O-N 3.1Å; F541-L544 PolarHBondContact O-N 3.39Å; W542-L544 VanDerWaalsContact C-N 3.32Å; W542-L544 PolarHBondContact O-N 3.47Å; L544-L546 PolarHBondContact O-N 2.83Å; L544-Q547 WeakPolarHBondContact O-CB 3.13Å; L544-Q547 PolarHBondContact O-N 2.91Å; L544-I548 HydrophobicContact CD1-CD1 3.99Å; L544-I548 HydrophobicContact CD1-CG1 4.04Å; L544-I548 HydrophobicContact CG-CD1 3.95Å; L544-I548 HydrophobicContact CG-CG1 4.46Å; L544-I548 WeakPolarHBondContact O-CG1 3.39Å; L544-I548 PolarHBondContact O-N 2.88Å
545	T	95.3	Very high	93.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-56.6	-51.2	176	-59.4	0	0	0	0	111	L524 W528 F541 W542 K543 Q547 I548 L549 L608 I612	L524-T545 HydrophobicContact CD2-CG2 3.91Å; W528-T545 PolarHBondContact NE1-OG1 3.36Å; F541-T545 WeakPolarHBondContact O-CB 3.48Å; F541-T545 PolarHBondContact O-N 3.15Å; F541-T545 PolarHBondContact O-OG1 3.06Å; W542-T545 WeakPolarHBondContact O-CB 3.42Å; W542-T545 PolarHBondContact O-N 2.83Å; K543-T545 VanDerWaalsContact C-N 3.33Å; K543-T545 PolarHBondContact O-N 3.11Å; T545-Q547 VanDerWaalsContact C-N 3.33Å; T545-Q547 PolarHBondContact O-N 3.23Å; T545-I548 PolarHBondContact O-N 2.94Å; T545-L549 WeakPolarHBondContact O-CG 3.41Å; T545-L549 PolarHBondContact O-N 3.19Å; T545-L549 VanDerWaalsContact O-N 3.14Å; T545-L608 HydrophobicContact CG2-CD2 3.94Å; T545-I612 HydrophobicContact CG2-CD1 4.41Å
546	L	94.6	Very high	93.5	Very high	48 Å²	48	37.9 Å²	37.9	25%	0.251	18%	0.177	S	C	.	.	H	α-helix	trans	-65.2	-36.2	177.4	-62.4	179.5	0	0	0	112.4	W542 K543 L544 L549 S550	W542-L546 HydrophobicContact CH2-CD2 4.46Å; W542-L546 HydrophobicContact CZ2-CD1 4.05Å; W542-L546 HydrophobicContact CZ2-CD2 4.16Å; W542-L546 HydrophobicContact CZ2-CG 4.31Å; W542-L546 PolarHBondContact O-N 3.22Å; W542-L546 VanDerWaalsContact O-N 3.16Å; K543-L546 PolarHBondContact O-N 3.22Å; L544-L546 PolarHBondContact O-N 2.83Å; L546-L549 PolarHBondContact O-N 2.87Å; L546-S550 WeakPolarHBondContact O-CB 3.49Å; L546-S550 PolarHBondContact O-N 2.86Å
547	Q	95.3	Very high	93.6	Very high	82 Å²	82	36 Å²	36	38%	0.383	17%	0.171	S	C	.	.	H	α-helix	trans	-64.5	-41.8	176.3	-75.6	176.4	-42.4	0	0	112.2	K543 L544 T545 S550 R551	K543-Q547 HydrophobicContact CG-CG 4.37Å; K543-Q547 WeakPolarHBondContact O-CB 3.38Å; K543-Q547 VanDerWaalsContact O-CG 3.25Å; K543-Q547 WeakPolarHBondContact O-CG 3.41Å; K543-Q547 PolarHBondContact O-N 2.84Å; L544-Q547 WeakPolarHBondContact O-CB 3.13Å; L544-Q547 PolarHBondContact O-N 2.91Å; T545-Q547 VanDerWaalsContact C-N 3.33Å; T545-Q547 PolarHBondContact O-N 3.23Å; Q547-S550 PolarHBondContact O-N 3.34Å; Q547-R551 WeakPolarHBondContact O-CB 3.34Å; Q547-R551 PolarHBondContact O-N 3.21Å
548	I	95.9	Very high	93.5	Very high	6 Å²	6	40 Å²	40	3%	0.031	19%	0.19	C	C	.	.	H	α-helix	trans	-63.5	-46.5	176.6	-68.7	165.7	0	0	0	110.3	I490 V494 V520 L524 L544 T545 R551 Y552	I490-I548 HydrophobicContact CG2-CD1 3.76Å; V494-I548 HydrophobicContact CG2-CG2 4.37Å; V520-I548 HydrophobicContact CG1-CG2 3.89Å; L524-I548 HydrophobicContact CD2-CB 3.91Å; L524-I548 HydrophobicContact CD2-CD1 4.25Å; L524-I548 HydrophobicContact CD2-CG2 3.77Å; L524-I548 HydrophobicContact CG-CG2 3.94Å; L544-I548 HydrophobicContact CD1-CD1 3.99Å; L544-I548 HydrophobicContact CD1-CG1 4.04Å; L544-I548 HydrophobicContact CG-CD1 3.95Å; L544-I548 HydrophobicContact CG-CG1 4.46Å; L544-I548 WeakPolarHBondContact O-CG1 3.39Å; L544-I548 PolarHBondContact O-N 2.88Å; T545-I548 PolarHBondContact O-N 2.94Å; I548-R551 PolarHBondContact O-N 2.87Å; I548-Y552 PolarHBondContact O-N 2.8Å
549	L	95.3	Very high	93.4	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-61.5	-46.7	177.3	-67.7	174.9	0	0	0	112	L524 T545 L546 R551 Y552 S553 V604 L644 L651	L524-L549 HydrophobicContact CD1-CD2 3.75Å; L524-L549 HydrophobicContact CD1-CG 4.48Å; L524-L549 HydrophobicContact CD2-CD2 4.45Å; L524-L549 HydrophobicContact CD2-CG 4.32Å; T545-L549 WeakPolarHBondContact O-CG 3.41Å; T545-L549 PolarHBondContact O-N 3.19Å; T545-L549 VanDerWaalsContact O-N 3.14Å; L546-L549 PolarHBondContact O-N 2.87Å; L549-R551 VanDerWaalsContact C-N 3.33Å; L549-R551 PolarHBondContact O-N 3.34Å; L549-Y552 PolarHBondContact O-N 3.14Å; L549-S553 PolarHBondContact O-N 3.49Å; L549-V604 HydrophobicContact CD1-CG1 4.5Å; L549-V604 HydrophobicContact CD1-CG2 4.34Å; L549-V604 HydrophobicContact CD2-CG2 3.68Å; L549-L644 HydrophobicContact CD1-CD2 4.42Å; L549-L651 HydrophobicContact CD2-CD1 4.4Å
550	S	94.1	Very high	93.2	Very high	50 Å²	50	35.8 Å²	35.8	35%	0.35	17%	0.17	S	C	.	.	H	α-helix	trans	-63	-39.8	176.5	-177.1	0	0	0	0	112	L546 Q547 S553 S554	L546-S550 WeakPolarHBondContact O-CB 3.49Å; L546-S550 PolarHBondContact O-N 2.86Å; Q547-S550 PolarHBondContact O-N 3.34Å; S550-S553 PolarHBondContact O-N 3.27Å; S550-S554 PolarHBondContact O-N 3.42Å; S550-S554 PolarHBondContact O-OG 3.03Å
551	R	94.2	Very high	92.9	Very high	73 Å²	73	38 Å²	38	28%	0.275	18%	0.182	S	C	.	.	H	α-helix	trans	-67.3	-38.1	178.9	-177.7	57.2	175.3	142.3	5.9	111.3	E495 M498 Q547 I548 L549 S554 F555 E558	E495-R551 WeakPolarHBondContact OE1-CD 3.35Å; E495-R551 WeakPolarHBondContact OE1-CG 3.44Å; E495-R551 IonicContact OE1-CZ 3.79Å; E495-R551 IonicContact OE1-NE 3.25Å; E495-R551 PolarHBondContact OE1-NE 3.46Å; E495-R551 IonicContact OE1-NH2 2.76Å; E495-R551 IonicContact OE2-CZ 2.68Å; E495-R551 IonicContact OE2-NE 3.99Å; E495-R551 IonicContact OE2-NH2 3.15Å; E495-R551 PolarHBondContact OE2-NH2 3.39Å; M498-R551 HydrophobicContact CE-CG 4Å; M498-R551 HydrophobicContact SD-CG 3.73Å; Q547-R551 WeakPolarHBondContact O-CB 3.34Å; Q547-R551 PolarHBondContact O-N 3.21Å; I548-R551 PolarHBondContact O-N 2.87Å; L549-R551 VanDerWaalsContact C-N 3.33Å; L549-R551 PolarHBondContact O-N 3.34Å; R551-S554 PolarHBondContact O-N 3.3Å; R551-F555 WeakPolarHBondContact O-CB 3.17Å; R551-F555 PolarHBondContact O-N 3.34Å; R551-E558 IonicContact CZ-OE1 3.03Å; R551-E558 IonicContact NH1-OE1 2.95Å; R551-E558 PolarHBondContact NH1-OE1 2.87Å; R551-E558 IonicContact NH1-OE2 2.85Å
552	Y	94.7	Very high	92.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.5	-40.4	172.9	-171.4	-99.3	0	0	0	112.3	M498 V516 T517 V520 I548 L549 S554 F555 I556 F593 L600 L651	M498-Y552 HydrophobicContact CE-CD2 4.02Å; V516-Y552 HydrophobicContact CG1-CD2 4.46Å; V516-Y552 HydrophobicContact CG1-CE2 4.25Å; T517-Y552 PolarHBondContact OG1-OH 2.97Å; V520-Y552 HydrophobicContact CB-CD2 4.39Å; V520-Y552 HydrophobicContact CG1-CD2 4.4Å; V520-Y552 HydrophobicContact CG2-CD2 3.76Å; V520-Y552 HydrophobicContact CG2-CE2 4.31Å; I548-Y552 PolarHBondContact O-N 2.8Å; L549-Y552 PolarHBondContact O-N 3.14Å; Y552-S554 PolarHBondContact O-N 3.22Å; Y552-F555 HydrophobicContact CD2-CD1 4.49Å; Y552-F555 WeakPolarHBondContact O-CB 3.49Å; Y552-F555 PolarHBondContact O-N 2.78Å; Y552-I556 HydrophobicContact CD1-CD1 3.92Å; Y552-I556 HydrophobicContact CD1-CG1 4.38Å; Y552-I556 HydrophobicContact CE1-CD1 3.8Å; Y552-I556 HydrophobicContact CE1-CG1 4.21Å; Y552-I556 WeakPolarHBondContact O-CG1 3.46Å; Y552-I556 PolarHBondContact O-N 2.98Å; Y552-F593 HydrophobicContact CE2-CE2 4.39Å; Y552-F593 AromaticContact CZ-CE2 4Å; Y552-F593 WeakPolarHBondContact OH-CE2 3.36Å; Y552-L600 HydrophobicContact CD1-CD2 3.3Å; Y552-L600 HydrophobicContact CE1-CD2 3.39Å; Y552-L600 HydrophobicContact CG-CD2 3.94Å; Y552-L651 HydrophobicContact CD1-CD2 3.76Å; Y552-L651 HydrophobicContact CE1-CD2 4.42Å
553	S	93.1	Very high	92	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.007	20%	0.196	C	C	.	.	H	α-helix	trans	-58.9	-45.2	171	173.5	0	0	0	0	112.1	L549 S550 F555 I556 D557 R650	L549-S553 PolarHBondContact O-N 3.49Å; S550-S553 PolarHBondContact O-N 3.27Å; S553-F555 VanDerWaalsContact C-N 3.33Å; S553-F555 PolarHBondContact O-N 3.35Å; S553-I556 WeakPolarHBondContact O-CB 3.25Å; S553-I556 PolarHBondContact O-N 3.01Å; S553-D557 PolarHBondContact O-N 2.96Å; S553-R650 PolarHBondContact OG-NE 2.99Å; S553-R650 VanDerWaalsContact OG-NE 3.1Å
554	S	92.4	Very high	91.4	Very high	38 Å²	38	37.7 Å²	37.7	27%	0.266	19%	0.191	S	C	.	.	H	α-helix	trans	-64.7	-35.8	174.9	-61	0	0	0	0	113	S550 R551 Y552 I556 D557 E558	S550-S554 PolarHBondContact O-N 3.42Å; S550-S554 PolarHBondContact O-OG 3.03Å; R551-S554 PolarHBondContact O-N 3.3Å; Y552-S554 PolarHBondContact O-N 3.22Å; S554-I556 VanDerWaalsContact C-N 3.35Å; S554-D557 PolarHBondContact O-N 3.22Å; S554-E558 WeakPolarHBondContact O-CG 3.47Å; S554-E558 PolarHBondContact O-N 3.38Å
555	F	93.1	Very high	90.8	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.009	22%	0.218	C	C	.	.	H	α-helix	trans	-63	-40.2	174.2	173.7	-101.6	0	0	0	111.8	M498 L502 V516 R551 Y552 S553 D557 E558 Q559 F593	M498-F555 HydrophobicContact CB-CD2 3.75Å; M498-F555 HydrophobicContact CB-CE2 3.91Å; M498-F555 HydrophobicContact CB-CG 4.44Å; M498-F555 HydrophobicContact CE-CB 3.99Å; M498-F555 HydrophobicContact CE-CG 4.39Å; M498-F555 HydrophobicContact CG-CB 4.34Å; M498-F555 HydrophobicContact CG-CD2 3.77Å; M498-F555 HydrophobicContact CG-CE2 4.17Å; M498-F555 HydrophobicContact CG-CG 3.95Å; M498-F555 VanDerWaalsContact O-CE2 3.26Å; M498-F555 WeakPolarHBondContact O-CE2 3.37Å; M498-F555 HydrophobicContact SD-CB 4.02Å; M498-F555 HydrophobicContact SD-CD2 4.38Å; M498-F555 HydrophobicContact SD-CG 4.29Å; L502-F555 HydrophobicContact CD2-CE1 4.07Å; L502-F555 HydrophobicContact CD2-CZ 4.22Å; V516-F555 HydrophobicContact CB-CE1 4.39Å; V516-F555 HydrophobicContact CG1-CD1 4.31Å; V516-F555 HydrophobicContact CG1-CE1 3.96Å; V516-F555 HydrophobicContact CG1-CZ 4.28Å; V516-F555 HydrophobicContact CG2-CE1 4.45Å; V516-F555 HydrophobicContact CG2-CZ 4.2Å; R551-F555 WeakPolarHBondContact O-CB 3.17Å; R551-F555 PolarHBondContact O-N 3.34Å; Y552-F555 HydrophobicContact CD2-CD1 4.49Å; Y552-F555 WeakPolarHBondContact O-CB 3.49Å; Y552-F555 PolarHBondContact O-N 2.78Å; S553-F555 VanDerWaalsContact C-N 3.33Å; S553-F555 PolarHBondContact O-N 3.35Å; F555-D557 VanDerWaalsContact C-N 3.33Å; F555-D557 PolarHBondContact O-N 3.03Å; F555-E558 PolarHBondContact O-N 3.19Å; F555-Q559 HydrophobicContact CD1-CG 4.28Å; F555-Q559 HydrophobicContact CD2-CG 4.3Å; F555-Q559 HydrophobicContact CE1-CG 3.82Å; F555-Q559 HydrophobicContact CE2-CG 3.85Å; F555-Q559 HydrophobicContact CZ-CG 3.59Å; F555-Q559 WeakPolarHBondContact O-CG 3.36Å; F555-Q559 PolarHBondContact O-N 3.21Å; F555-F593 HydrophobicContact CD1-CE2 4.43Å; F555-F593 HydrophobicContact CD1-CZ 4.14Å; F555-F593 HydrophobicContact CE1-CE2 4.08Å; F555-F593 HydrophobicContact CE1-CZ 4.01Å
556	I	91.5	Very high	89.8	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-56.3	-50.1	172.1	-66.5	164	0	0	0	110	Y552 S553 S554 E558 Q559 I560 F593 L651 I658	Y552-I556 HydrophobicContact CD1-CD1 3.92Å; Y552-I556 HydrophobicContact CD1-CG1 4.38Å; Y552-I556 HydrophobicContact CE1-CD1 3.8Å; Y552-I556 HydrophobicContact CE1-CG1 4.21Å; Y552-I556 WeakPolarHBondContact O-CG1 3.46Å; Y552-I556 PolarHBondContact O-N 2.98Å; S553-I556 WeakPolarHBondContact O-CB 3.25Å; S553-I556 PolarHBondContact O-N 3.01Å; S554-I556 VanDerWaalsContact C-N 3.35Å; I556-E558 VanDerWaalsContact C-N 3.34Å; I556-E558 PolarHBondContact O-N 3.31Å; I556-Q559 PolarHBondContact O-N 3.37Å; I556-I560 HydrophobicContact CG2-CD1 3.61Å; I556-I560 HydrophobicContact CG2-CG1 4.39Å; I556-I560 WeakPolarHBondContact O-CD1 3.39Å; I556-I560 VanDerWaalsContact O-CG1 3.25Å; I556-I560 WeakPolarHBondContact O-CG1 3.38Å; I556-I560 PolarHBondContact O-N 3.43Å; I556-F593 HydrophobicContact CB-CE1 4.49Å; I556-F593 HydrophobicContact CB-CZ 4.3Å; I556-F593 HydrophobicContact CG1-CE1 4.09Å; I556-F593 HydrophobicContact CG1-CE2 4.44Å; I556-F593 HydrophobicContact CG1-CZ 3.55Å; I556-F593 HydrophobicContact CG2-CE1 4.41Å; I556-L651 HydrophobicContact CD1-CD2 3.9Å; I556-I658 HydrophobicContact CG2-CD1 3.75Å; I556-I658 HydrophobicContact CG2-CG1 4.01Å
557	D	90.2	Very high	88.4	Confident	53 Å²	53	48.9 Å²	48.9	28%	0.283	25%	0.246	S	C	.	.	H	α-helix	trans	-63.1	-38.4	-180	-60.7	-25.9	0	0	0	112.4	S553 S554 F555 I560 K561 S654	S553-D557 PolarHBondContact O-N 2.96Å; S554-D557 PolarHBondContact O-N 3.22Å; F555-D557 VanDerWaalsContact C-N 3.33Å; F555-D557 PolarHBondContact O-N 3.03Å; D557-I560 PolarHBondContact O-N 3.49Å; D557-K561 WeakPolarHBondContact O-CG 3.39Å; D557-K561 PolarHBondContact O-N 2.85Å; D557-S654 PolarHBondContact OD1-OG 3.09Å
558	E	90	Very high	86.8	Confident	91 Å²	91	47.8 Å²	47.8	43%	0.425	25%	0.252	S	S	.	.	H	α-helix	trans	-63.8	-44	174.8	-75.2	171.9	-161.2	0	0	111.9	R551 S554 F555 I556 K561 S562	R551-E558 IonicContact CZ-OE1 3.03Å; R551-E558 IonicContact NH1-OE1 2.95Å; R551-E558 PolarHBondContact NH1-OE1 2.87Å; R551-E558 IonicContact NH1-OE2 2.85Å; S554-E558 WeakPolarHBondContact O-CG 3.47Å; S554-E558 PolarHBondContact O-N 3.38Å; F555-E558 PolarHBondContact O-N 3.19Å; I556-E558 VanDerWaalsContact C-N 3.34Å; I556-E558 PolarHBondContact O-N 3.31Å; E558-K561 PolarHBondContact O-N 3.15Å; E558-S562 WeakPolarHBondContact O-CB 3.36Å; E558-S562 PolarHBondContact O-N 2.95Å
559	Q	89	Confident	84.9	Confident	39 Å²	39	51.3 Å²	51.3	18%	0.182	27%	0.274	C	S	.	.	H	α-helix	trans	-65.3	-41.4	176.7	-68.7	-57.7	-43.5	0	0	111.7	L502 F555 I556 K561 S562 I563	L502-Q559 HydrophobicContact CD2-CG 4.49Å; F555-Q559 HydrophobicContact CD1-CG 4.28Å; F555-Q559 HydrophobicContact CD2-CG 4.3Å; F555-Q559 HydrophobicContact CE1-CG 3.82Å; F555-Q559 HydrophobicContact CE2-CG 3.85Å; F555-Q559 HydrophobicContact CZ-CG 3.59Å; F555-Q559 WeakPolarHBondContact O-CG 3.36Å; F555-Q559 PolarHBondContact O-N 3.21Å; I556-Q559 PolarHBondContact O-N 3.37Å; Q559-K561 PolarHBondContact O-N 2.78Å; Q559-S562 PolarHBondContact O-N 3.23Å; Q559-I563 WeakPolarHBondContact O-CD1 3.46Å; Q559-I563 VanDerWaalsContact O-CG1 3.22Å; Q559-I563 WeakPolarHBondContact O-CG1 3.21Å; Q559-I563 PolarHBondContact O-N 3.2Å
560	I	86.9	Confident	82.9	Confident	14 Å²	14	54.7 Å²	54.7	7%	0.072	30%	0.302	C	S	.	.	H	α-helix	trans	-58.2	-49.7	175.6	-71.3	162.8	0	0	0	110.5	I556 D557 I563 Q564 I658 L661	I556-I560 HydrophobicContact CG2-CD1 3.61Å; I556-I560 HydrophobicContact CG2-CG1 4.39Å; I556-I560 WeakPolarHBondContact O-CD1 3.39Å; I556-I560 VanDerWaalsContact O-CG1 3.25Å; I556-I560 WeakPolarHBondContact O-CG1 3.38Å; I556-I560 PolarHBondContact O-N 3.43Å; D557-I560 PolarHBondContact O-N 3.49Å; I560-I563 PolarHBondContact O-N 2.89Å; I560-Q564 WeakPolarHBondContact O-CG 3.36Å; I560-Q564 PolarHBondContact O-N 2.91Å; I560-I658 HydrophobicContact CD1-CG1 4.05Å; I560-I658 HydrophobicContact CG1-CG1 4.26Å; I560-L661 HydrophobicContact CB-CD1 4.14Å; I560-L661 HydrophobicContact CG1-CD1 3.99Å; I560-L661 HydrophobicContact CG2-CD1 3.91Å
561	K	87.8	Confident	80.8	Confident	124 Å²	124	57 Å²	57	54%	0.539	32%	0.318	S	S	.	.	H	α-helix	trans	-61.7	-47.8	179.2	-73.3	174.1	-176.8	177.6	0	112.1	D557 E558 Q559 I563 Q564 E565	D557-K561 WeakPolarHBondContact O-CG 3.39Å; D557-K561 PolarHBondContact O-N 2.85Å; E558-K561 PolarHBondContact O-N 3.15Å; Q559-K561 PolarHBondContact O-N 2.78Å; K561-I563 VanDerWaalsContact C-N 3.27Å; K561-I563 PolarHBondContact O-N 2.87Å; K561-Q564 PolarHBondContact O-N 3.49Å; K561-Q564 VanDerWaalsContact O-N 3.11Å; K561-E565 WeakPolarHBondContact O-CG 3.27Å; K561-E565 PolarHBondContact O-N 3.31Å
562	S	86.6	Confident	78.3	Confident	50 Å²	50	62 Å²	62	35%	0.35	34%	0.344	S	S	.	.	H	α-helix	trans	-55.8	-41.8	177.6	176.9	0	0	0	0	112.1	E558 Q559 N566	E558-S562 WeakPolarHBondContact O-CB 3.36Å; E558-S562 PolarHBondContact O-N 2.95Å; Q559-S562 PolarHBondContact O-N 3.23Å; S562-N566 WeakPolarHBondContact O-CB 3.05Å; S562-N566 PolarHBondContact O-N 2.86Å; S562-N566 PolarHBondContact O-ND2 3.02Å
563	I	82.9	Confident	75.8	Confident	23 Å²	23	66.1 Å²	66.1	12%	0.118	37%	0.373	C	S	.	.	H	α-helix	trans	-69.2	-40	178	-66.7	163.1	0	0	0	111.8	Q559 I560 K561 N567 L590 L661	Q559-I563 WeakPolarHBondContact O-CD1 3.46Å; Q559-I563 VanDerWaalsContact O-CG1 3.22Å; Q559-I563 WeakPolarHBondContact O-CG1 3.21Å; Q559-I563 PolarHBondContact O-N 3.2Å; I560-I563 PolarHBondContact O-N 2.89Å; K561-I563 VanDerWaalsContact C-N 3.27Å; K561-I563 PolarHBondContact O-N 2.87Å; I563-N567 PolarHBondContact O-N 3.27Å; I563-L590 HydrophobicContact CD1-CD1 4.29Å; I563-L590 HydrophobicContact CD1-CD2 3.51Å; I563-L590 HydrophobicContact CD1-CG 4.4Å; I563-L661 HydrophobicContact CG2-CD1 4.41Å
564	Q	82	Confident	73	Confident	94 Å²	94	71.3 Å²	71.3	44%	0.439	41%	0.41	S	S	.	.	H	α-helix	trans	-66.1	-40.6	177.5	-71.9	174.3	-17.1	0	0	112.2	I560 K561 N567 A568 L661	I560-Q564 WeakPolarHBondContact O-CG 3.36Å; I560-Q564 PolarHBondContact O-N 2.91Å; K561-Q564 PolarHBondContact O-N 3.49Å; K561-Q564 VanDerWaalsContact O-N 3.11Å; Q564-N567 PolarHBondContact O-N 3.06Å; Q564-A568 PolarHBondContact O-N 2.92Å; Q564-L661 HydrophobicContact CG-CD2 3.79Å
565	E	81.5	Confident	70	Confident	127 Å²	127	76.9 Å²	76.9	59%	0.593	44%	0.436	S	S	*	.	H	α-helix	trans	-67.3	-40.1	177.5	-71.9	174.1	-177.2	0	0	112.3	K561 N567 A568 T569	K561-E565 WeakPolarHBondContact O-CG 3.27Å; K561-E565 PolarHBondContact O-N 3.31Å; E565-N567 VanDerWaalsContact C-N 3.29Å; E565-N567 PolarHBondContact O-N 2.97Å; E565-A568 PolarHBondContact O-N 3.5Å; E565-T569 PolarHBondContact O-N 3.32Å; E565-T569 PolarHBondContact O-OG1 3Å
566	N	74.7	Confident	67.2	Low	96 Å²	96	82.5 Å²	82.5	51%	0.513	48%	0.476	S	S	.	.	H	α-helix	trans	-62.6	-35.3	174.9	-73.3	-29	0	0	0	112.2	S562 T569 A570	S562-N566 WeakPolarHBondContact O-CB 3.05Å; S562-N566 PolarHBondContact O-N 2.86Å; S562-N566 PolarHBondContact O-ND2 3.02Å; N566-T569 WeakPolarHBondContact CA-OG1 3.2Å; N566-T569 PolarHBondContact O-OG1 2.82Å; N566-A570 WeakPolarHBondContact O-CB 3.33Å; N566-A570 PolarHBondContact O-N 3.42Å
567	N	66	Low	64.4	Low	61 Å²	61	90.1 Å²	90.1	33%	0.326	52%	0.515	S	S	.	.	H	α-helix	trans	-69	-37.1	174.5	-72.1	-11.7	0	0	0	112.5	I563 Q564 E565	I563-N567 PolarHBondContact O-N 3.27Å; Q564-N567 PolarHBondContact O-N 3.06Å; E565-N567 VanDerWaalsContact C-N 3.29Å; E565-N567 PolarHBondContact O-N 2.97Å
568	A	61.4	Low	61.5	Low	60 Å²	60	92.5 Å²	92.5	50%	0.496	54%	0.536	S	S	.	.	H	α-helix	trans	-71.1	-41.6	179.4	0	0	0	0	0	112.4	Q564 E565 S571	Q564-A568 PolarHBondContact O-N 2.92Å; E565-A568 PolarHBondContact O-N 3.5Å; A568-S571 WeakPolarHBondContact O-CB 3.49Å; A568-S571 PolarHBondContact O-N 3.34Å
569	T	56.5	Low	58.6	Low	80 Å²	80	95.6 Å²	95.6	49%	0.491	55%	0.554	S	S	.	*	H	α-helix	trans	-73.2	-32.3	-177.8	47.5	0	0	0	0	113.4	E565 N566 S571 Q572	E565-T569 PolarHBondContact O-N 3.32Å; E565-T569 PolarHBondContact O-OG1 3Å; N566-T569 WeakPolarHBondContact CA-OG1 3.2Å; N566-T569 PolarHBondContact O-OG1 2.82Å; T569-S571 PolarHBondContact O-N 3.43Å; T569-Q572 PolarHBondContact O-N 3.09Å
570	A	51.9	Low	55.9	Low	73 Å²	73	100.3 Å²	100.3	60%	0.603	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	-18.3	172.7	0	0	0	0	0	113.6	N566	N566-A570 WeakPolarHBondContact O-CB 3.33Å; N566-A570 PolarHBondContact O-N 3.42Å
571	S	49.6	Very low	53	Low	99 Å²	99	109.3 Å²	109.3	69%	0.692	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-8	178.9	-54.6	0	0	0	0	114.3	A568 T569	A568-S571 WeakPolarHBondContact O-CB 3.49Å; A568-S571 PolarHBondContact O-N 3.34Å; T569-S571 PolarHBondContact O-N 3.43Å
572	Q	43.4	Very low	50.3	Low	177 Å²	177	107.3 Å²	107.3	83%	0.827	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.8	-6.9	-167.4	-67.9	-173.3	7.1	0	0	117.3	T569	T569-Q572 PolarHBondContact O-N 3.09Å
573	S	41.1	Very low	47.9	Very low	86 Å²	86	111.2 Å²	111.2	60%	0.601	65%	0.648	S	S	*	*			trans	-152.7	99.5	177.3	55.1	0	0	0	0	113.3	D575	S573-D575 PolarHBondContact O-N 3.45Å
574	S	34.2	Very low	46.2	Very low	111 Å²	111	116 Å²	116	78%	0.776	67%	0.674	S	S	*	*			trans	-69.3	101	157.1	48.5	0	0	0	0	108.4
575	D	29.6	Very low	45.4	Very low	154 Å²	154	115.6 Å²	115.6	82%	0.824	68%	0.681	S	S	*	*			trans	146.9	83.4	152.3	-74	-17.6	0	0	0	111	S573	S573-D575 PolarHBondContact O-N 3.45Å
576	S	34.9	Very low	45.4	Very low	120 Å²	120	110.6 Å²	110.6	84%	0.839	66%	0.657	S	S	*	*			trans	-165.4	139.3	142.2	21.4	0	0	0	0	110.8
577	I	32.9	Very low	45.8	Very low	161 Å²	161	106.4 Å²	106.4	83%	0.826	64%	0.635	S	S	*	*			trans	-87.1	147.8	-162.9	-74	151.1	0	0	0	111
578	S	28.2	Very low	46.8	Very low	103 Å²	103	106.1 Å²	106.1	72%	0.72	63%	0.632	S	S	*	*			trans	75.8	119.5	164.6	80.2	0	0	0	0	115.1
579	L	29.8	Very low	48.1	Very low	155 Å²	155	106.7 Å²	106.7	81%	0.812	63%	0.626	S	S	*	*	S	Bend	cis	-149	150.9	36.4	-107.2	89.8	0	0	0	109.8
580	T	31.2	Very low	49.6	Very low	138 Å²	138	103.4 Å²	103.4	85%	0.847	61%	0.606	S	S	*	*			trans	74.2	91.2	-179.3	69.9	0	0	0	0	116
581	K	27.1	Very low	51.4	Low	203 Å²	203	100 Å²	100	88%	0.883	58%	0.577	S	S	*	*			trans	-60.4	151.3	167.6	-68.1	171.3	173.5	177.1	0	110.7
582	S	30.7	Very low	53.3	Low	82 Å²	82	96.3 Å²	96.3	57%	0.573	55%	0.548	S	S	*	.			trans	92	83.2	171.9	74.4	0	0	0	0	116.6	D584	S582-D584 PolarHBondContact O-N 2.93Å
583	T	35.8	Very low	55.6	Low	133 Å²	133	88 Å²	88	82%	0.816	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	18	165.4	-28.5	0	0	0	0	113.4
584	D	48.1	Very low	58	Low	123 Å²	123	83.9 Å²	83.9	66%	0.658	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.9	16.5	-177.6	-76.7	-41.8	0	0	0	112.5	S582	S582-D584 PolarHBondContact O-N 2.93Å
585	C	65.5	Low	60.7	Low	85 Å²	85	78.6 Å²	78.6	57%	0.574	44%	0.443	S	S	*	.			trans	-89.1	138.6	-173.9	-161.2	0	0	0	0	112.9
586	F	79.9	Confident	63.6	Low	23 Å²	23	71.2 Å²	71.2	10%	0.101	40%	0.404	C	S	.	.			trans	-56.2	137.8	173.6	179.1	-91.9	0	0	0	111.2	E588 I591 P705 K708 L709 L712	F586-E588 HydrophobicContact CD1-CB 3.95Å; F586-E588 HydrophobicContact CD1-CG 4.45Å; F586-E588 HydrophobicContact CE1-CB 4.33Å; F586-E588 PolarHBondContact O-N 2.95Å; F586-I591 HydrophobicContact CE1-CD1 3.49Å; F586-I591 VanDerWaalsContact CE1-CD1 3.49Å; F586-I591 HydrophobicContact CZ-CD1 3.52Å; F586-P705 WeakPolarHBondContact CE2-O 3.14Å; F586-K708 HydrophobicContact CB-CD 4.17Å; F586-K708 HydrophobicContact CD1-CD 3.72Å; F586-K708 VanDerWaalsContact CD1-CE 3.43Å; F586-K708 HydrophobicContact CD1-CG 4.22Å; F586-K708 HydrophobicContact CD2-CB 4.21Å; F586-K708 HydrophobicContact CD2-CD 3.84Å; F586-K708 HydrophobicContact CD2-CG 4.14Å; F586-K708 HydrophobicContact CE1-CD 4.04Å; F586-K708 HydrophobicContact CE1-CG 4.01Å; F586-K708 HydrophobicContact CE2-CB 3.86Å; F586-K708 HydrophobicContact CE2-CD 4.13Å; F586-K708 HydrophobicContact CE2-CG 3.91Å; F586-K708 HydrophobicContact CG-CD 3.63Å; F586-K708 HydrophobicContact CG-CG 4.3Å; F586-K708 HydrophobicContact CZ-CB 4.18Å; F586-K708 HydrophobicContact CZ-CD 4.23Å; F586-K708 HydrophobicContact CZ-CG 3.84Å; F586-L709 HydrophobicContact CE2-CB 4.28Å; F586-L709 HydrophobicContact CZ-CB 4.19Å; F586-L709 HydrophobicContact CZ-CD1 4.45Å; F586-L712 HydrophobicContact CD1-CD1 4.25Å; F586-L712 HydrophobicContact CE1-CD1 3.29Å; F586-L712 HydrophobicContact CZ-CD1 3.77Å
587	P	84.9	Confident	66.3	Low	8 Å²	8	65.6 Å²	65.6	5%	0.052	37%	0.365	C	S	.	.			trans	-77.9	51.3	-170.6	33.6	-37.5	0	0	0	114	L589 L590 I591 I662 K665 I666	P587-L589 PolarHBondContact O-N 3.42Å; P587-L590 HydrophobicContact CB-CB 4.41Å; P587-L590 HydrophobicContact CB-CD1 4.24Å; P587-L590 PolarHBondContact O-N 2.98Å; P587-I591 HydrophobicContact CG-CD1 4.41Å; P587-I591 WeakPolarHBondContact O-CG1 3.27Å; P587-I591 PolarHBondContact O-N 3.42Å; P587-I591 VanDerWaalsContact O-N 3.16Å; P587-I662 HydrophobicContact CG-CG2 4.26Å; P587-K665 HydrophobicContact CB-CB 4.17Å; P587-K665 HydrophobicContact CB-CD 3.91Å; P587-K665 HydrophobicContact CG-CB 4.17Å; P587-I666 HydrophobicContact CG-CD1 4.28Å; P587-I666 HydrophobicContact CG-CG1 3.79Å
588	E	86.9	Confident	69.1	Low	54 Å²	54	58 Å²	58	25%	0.252	33%	0.326	S	S	.	.	H	α-helix	trans	-59.7	-50.8	-172.5	-157.2	162.6	155.6	0	0	113	F586 L590 I591 Y592 K708 L712	F586-E588 HydrophobicContact CD1-CB 3.95Å; F586-E588 HydrophobicContact CD1-CG 4.45Å; F586-E588 HydrophobicContact CE1-CB 4.33Å; F586-E588 PolarHBondContact O-N 2.95Å; E588-L590 PolarHBondContact O-N 3.42Å; E588-I591 WeakPolarHBondContact O-CB 3.47Å; E588-I591 PolarHBondContact O-N 3.43Å; E588-I591 VanDerWaalsContact O-N 3.1Å; E588-Y592 HydrophobicContact CG-CD2 4.45Å; E588-Y592 HydrophobicContact CG-CE1 4.27Å; E588-Y592 HydrophobicContact CG-CE2 3.73Å; E588-Y592 PolarHBondContact O-N 3.07Å; E588-Y592 PolarHBondContact OE1-OH 3.28Å; E588-K708 WeakPolarHBondContact OE2-CE 3.42Å; E588-K708 IonicContact OE2-NZ 3.99Å; E588-K708 PolarHBondContact OE2-NZ 2.81Å; E588-L712 HydrophobicContact CG-CD1 4.26Å
589	L	87.2	Confident	72.1	Confident	73 Å²	73	55.4 Å²	55.4	38%	0.382	30%	0.3	S	S	.	.	H	α-helix	trans	-60.6	-31.2	178.7	-68.4	174.7	0	0	0	113.2	E504 I514 P587 F593	E504-L589 HydrophobicContact CB-CD2 3.75Å; I514-L589 HydrophobicContact CD1-CD2 4.3Å; P587-L589 PolarHBondContact O-N 3.42Å; L589-F593 VanDerWaalsContact O-CB 3.3Å; L589-F593 WeakPolarHBondContact O-CB 3.45Å; L589-F593 PolarHBondContact O-N 2.94Å
590	L	88.8	Confident	75	Confident	11 Å²	11	48 Å²	48	6%	0.058	26%	0.261	C	S	.	.	H	α-helix	trans	-74.7	-36.3	177.3	-73.3	170.8	0	0	0	111.9	L502 I563 P587 E588 F593 F594 I662 K665	L502-L590 HydrophobicContact CD1-CD2 4.23Å; I563-L590 HydrophobicContact CD1-CD1 4.29Å; I563-L590 HydrophobicContact CD1-CD2 3.51Å; I563-L590 HydrophobicContact CD1-CG 4.4Å; P587-L590 HydrophobicContact CB-CB 4.41Å; P587-L590 HydrophobicContact CB-CD1 4.24Å; P587-L590 PolarHBondContact O-N 2.98Å; E588-L590 PolarHBondContact O-N 3.42Å; L590-F593 PolarHBondContact O-N 3.34Å; L590-F594 VanDerWaalsContact O-CB 3.31Å; L590-F594 WeakPolarHBondContact O-CB 3.24Å; L590-F594 PolarHBondContact O-N 3.13Å; L590-I662 HydrophobicContact CB-CD1 4.35Å; L590-I662 HydrophobicContact CB-CG1 3.87Å; L590-K665 HydrophobicContact CD1-CD 3.75Å; L590-K665 VanDerWaalsContact CD1-NZ 3.3Å
591	I	89.3	Confident	78	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.3	-43.5	173.7	-63.9	160	0	0	0	109.5	F586 P587 E588 F594 V595 I662 L709 L716	F586-I591 HydrophobicContact CE1-CD1 3.49Å; F586-I591 VanDerWaalsContact CE1-CD1 3.49Å; F586-I591 HydrophobicContact CZ-CD1 3.52Å; P587-I591 HydrophobicContact CG-CD1 4.41Å; P587-I591 WeakPolarHBondContact O-CG1 3.27Å; P587-I591 PolarHBondContact O-N 3.42Å; P587-I591 VanDerWaalsContact O-N 3.16Å; E588-I591 WeakPolarHBondContact O-CB 3.47Å; E588-I591 PolarHBondContact O-N 3.43Å; E588-I591 VanDerWaalsContact O-N 3.1Å; I591-F594 WeakPolarHBondContact O-CB 3.41Å; I591-F594 PolarHBondContact O-N 2.85Å; I591-V595 WeakPolarHBondContact O-CG2 3.39Å; I591-V595 PolarHBondContact O-N 3.38Å; I591-I662 HydrophobicContact CD1-CG2 4.47Å; I591-I662 HydrophobicContact CG1-CD1 4.04Å; I591-I662 HydrophobicContact CG1-CG1 4.39Å; I591-I662 HydrophobicContact CG1-CG2 3.98Å; I591-L709 HydrophobicContact CD1-CD1 3.58Å; I591-L709 HydrophobicContact CG1-CD1 4.22Å; I591-L716 HydrophobicContact CG2-CD1 3.64Å
592	Y	90.3	Very high	80.9	Confident	22 Å²	22	32.6 Å²	32.6	9%	0.086	18%	0.184	C	C	.	.	H	α-helix	trans	-60.4	-46.1	173.6	-66.8	-15.2	0	0	0	112.1	E504 L513 E588 F594 V595 D596 L716	E504-Y592 HydrophobicContact CG-CD2 4.12Å; E504-Y592 HydrophobicContact CG-CE2 4.06Å; L513-Y592 HydrophobicContact CB-CD1 4.45Å; L513-Y592 HydrophobicContact CB-CD2 4.47Å; L513-Y592 HydrophobicContact CB-CG 3.99Å; L513-Y592 HydrophobicContact CD1-CD1 3.76Å; L513-Y592 HydrophobicContact CD1-CG 4.11Å; E588-Y592 HydrophobicContact CG-CD2 4.45Å; E588-Y592 HydrophobicContact CG-CE1 4.27Å; E588-Y592 HydrophobicContact CG-CE2 3.73Å; E588-Y592 PolarHBondContact O-N 3.07Å; E588-Y592 PolarHBondContact OE1-OH 3.28Å; Y592-F594 VanDerWaalsContact C-N 3.34Å; Y592-F594 PolarHBondContact O-N 2.96Å; Y592-V595 PolarHBondContact O-N 2.83Å; Y592-D596 VanDerWaalsContact O-CB 3.3Å; Y592-D596 WeakPolarHBondContact O-CB 3.48Å; Y592-D596 PolarHBondContact O-N 3.22Å; Y592-L716 HydrophobicContact CD1-CD1 4.08Å; Y592-L716 HydrophobicContact CD1-CD2 4.15Å; Y592-L716 HydrophobicContact CE1-CD1 4.14Å; Y592-L716 HydrophobicContact CE1-CD2 4.12Å
593	F	91.1	Very high	83.9	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.009	16%	0.157	C	C	.	.	H	α-helix	trans	-62.5	-39.6	176.7	-175.5	-130.2	0	0	0	113	L502 I514 Y552 F555 I556 L589 L590 D596 C597 I658	L502-F593 HydrophobicContact CD1-CB 4.34Å; L502-F593 HydrophobicContact CD1-CD1 4.19Å; L502-F593 HydrophobicContact CD1-CG 4.26Å; L502-F593 HydrophobicContact CD2-CB 4.3Å; L502-F593 HydrophobicContact CD2-CD1 4.12Å; L502-F593 HydrophobicContact CD2-CD2 3.61Å; L502-F593 HydrophobicContact CD2-CE1 4.31Å; L502-F593 HydrophobicContact CD2-CE2 3.83Å; L502-F593 HydrophobicContact CD2-CG 3.76Å; L502-F593 HydrophobicContact CD2-CZ 4.16Å; I514-F593 HydrophobicContact CG1-CB 4.11Å; I514-F593 HydrophobicContact CG1-CD2 4.48Å; Y552-F593 HydrophobicContact CE2-CE2 4.39Å; Y552-F593 AromaticContact CZ-CE2 4Å; Y552-F593 WeakPolarHBondContact OH-CE2 3.36Å; F555-F593 HydrophobicContact CD1-CE2 4.43Å; F555-F593 HydrophobicContact CD1-CZ 4.14Å; F555-F593 HydrophobicContact CE1-CE2 4.08Å; F555-F593 HydrophobicContact CE1-CZ 4.01Å; I556-F593 HydrophobicContact CB-CE1 4.49Å; I556-F593 HydrophobicContact CB-CZ 4.3Å; I556-F593 HydrophobicContact CG1-CE1 4.09Å; I556-F593 HydrophobicContact CG1-CE2 4.44Å; I556-F593 HydrophobicContact CG1-CZ 3.55Å; I556-F593 HydrophobicContact CG2-CE1 4.41Å; L589-F593 VanDerWaalsContact O-CB 3.3Å; L589-F593 WeakPolarHBondContact O-CB 3.45Å; L589-F593 PolarHBondContact O-N 2.94Å; L590-F593 PolarHBondContact O-N 3.34Å; F593-D596 PolarHBondContact O-N 2.87Å; F593-C597 PolarHBondContact O-N 2.98Å; F593-C597 PolarHBondContact O-SG 3.11Å; F593-I658 HydrophobicContact CD1-CD1 3.73Å; F593-I658 HydrophobicContact CE1-CD1 3.67Å
594	F	91.4	Very high	86.5	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.3	-49	174.8	173.9	-104.9	0	0	0	112	L590 I591 Y592 D596 C597 L598 I658 M659 I662 F726 L727	L590-F594 VanDerWaalsContact O-CB 3.31Å; L590-F594 WeakPolarHBondContact O-CB 3.24Å; L590-F594 PolarHBondContact O-N 3.13Å; I591-F594 WeakPolarHBondContact O-CB 3.41Å; I591-F594 PolarHBondContact O-N 2.85Å; Y592-F594 VanDerWaalsContact C-N 3.34Å; Y592-F594 PolarHBondContact O-N 2.96Å; F594-D596 VanDerWaalsContact C-N 3.33Å; F594-D596 PolarHBondContact O-N 3.32Å; F594-C597 PolarHBondContact O-N 3.36Å; F594-L598 HydrophobicContact CE1-CD1 3.96Å; F594-L598 HydrophobicContact CZ-CD1 4.07Å; F594-L598 PolarHBondContact O-N 3.05Å; F594-I658 HydrophobicContact CB-CG2 3.97Å; F594-I658 HydrophobicContact CD2-CB 4.33Å; F594-I658 HydrophobicContact CD2-CG2 4.39Å; F594-M659 HydrophobicContact CE2-CB 4.12Å; F594-M659 HydrophobicContact CE2-CE 3.96Å; F594-M659 HydrophobicContact CZ-CE 3.52Å; F594-I662 HydrophobicContact CB-CD1 3.96Å; F594-I662 HydrophobicContact CG-CD1 4.34Å; F594-F726 HydrophobicContact CE1-CB 4.05Å; F594-F726 HydrophobicContact CZ-CB 3.82Å; F594-L727 HydrophobicContact CD1-CD2 4.29Å; F594-L727 HydrophobicContact CE1-CD2 4.23Å
595	V	90.6	Very high	88.5	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-64.3	-40.6	178	172.5	0	0	0	0	111.2	L513 I591 Y592 C597 L598 R599 L716 V720 A723 L727	L513-V595 HydrophobicContact CD1-CB 4.36Å; L513-V595 HydrophobicContact CD1-CG1 4.22Å; I591-V595 WeakPolarHBondContact O-CG2 3.39Å; I591-V595 PolarHBondContact O-N 3.38Å; Y592-V595 PolarHBondContact O-N 2.83Å; V595-C597 VanDerWaalsContact C-N 3.34Å; V595-C597 PolarHBondContact O-N 3.11Å; V595-L598 WeakPolarHBondContact O-CB 3.2Å; V595-L598 PolarHBondContact O-N 3.45Å; V595-L598 VanDerWaalsContact O-N 3.16Å; V595-R599 PolarHBondContact O-N 3.09Å; V595-L716 HydrophobicContact CG2-CB 4.27Å; V595-L716 HydrophobicContact CG2-CD1 4.04Å; V595-V720 HydrophobicContact CG1-CB 4.04Å; V595-V720 HydrophobicContact CG1-CG2 3.77Å; V595-A723 HydrophobicContact CG1-CB 4.23Å; V595-A723 HydrophobicContact CG2-CB 4.42Å; V595-L727 HydrophobicContact CG2-CD1 4.16Å; V595-L727 HydrophobicContact CG2-CD2 3.96Å; V595-L727 HydrophobicContact CG2-CG 4.38Å
596	D	90.9	Very high	89.6	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-62.9	-36.1	176.8	-96.4	21.5	0	0	0	113.4	C512 L513 I514 T517 Y592 F593 F594 L598 R599 L600	C512-D596 WeakPolarHBondContact CA-OD1 3.28Å; L513-D596 VanDerWaalsContact N-CG 3.33Å; L513-D596 PolarHBondContact N-OD1 2.91Å; L513-D596 PolarHBondContact N-OD2 3.32Å; L513-D596 VanDerWaalsContact N-OD2 3.1Å; I514-D596 WeakPolarHBondContact CA-OD2 3.11Å; I514-D596 VanDerWaalsContact CB-OD2 3.27Å; I514-D596 WeakPolarHBondContact CB-OD2 3.27Å; I514-D596 PolarHBondContact N-OD2 2.87Å; T517-D596 WeakPolarHBondContact CB-OD2 3.45Å; T517-D596 HydrophobicContact CG2-CB 3.76Å; T517-D596 WeakPolarHBondContact CG2-O 3.14Å; T517-D596 WeakPolarHBondContact OG1-CB 3.38Å; T517-D596 PolarHBondContact OG1-OD2 3.48Å; T517-D596 VanDerWaalsContact OG1-OD2 3.11Å; Y592-D596 VanDerWaalsContact O-CB 3.3Å; Y592-D596 WeakPolarHBondContact O-CB 3.48Å; Y592-D596 PolarHBondContact O-N 3.22Å; F593-D596 PolarHBondContact O-N 2.87Å; F594-D596 VanDerWaalsContact C-N 3.33Å; F594-D596 PolarHBondContact O-N 3.32Å; D596-L598 VanDerWaalsContact C-N 3.31Å; D596-L598 PolarHBondContact O-N 3.22Å; D596-R599 WeakPolarHBondContact O-CB 3.39Å; D596-R599 PolarHBondContact O-N 3.11Å; D596-L600 PolarHBondContact O-N 3.49Å
597	C	92.2	Very high	90	Very high	1 Å²	1	25 Å²	25	1%	0.007	12%	0.118	C	C	.	.	H	α-helix	trans	-61.9	-41.5	173.6	-69	0	0	0	0	111.3	F593 F594 V595 L600 V601 T655	F593-C597 PolarHBondContact O-N 2.98Å; F593-C597 PolarHBondContact O-SG 3.11Å; F594-C597 PolarHBondContact O-N 3.36Å; V595-C597 VanDerWaalsContact C-N 3.34Å; V595-C597 PolarHBondContact O-N 3.11Å; C597-L600 PolarHBondContact O-N 3.06Å; C597-V601 WeakPolarHBondContact O-CG2 3.47Å; C597-V601 PolarHBondContact O-N 3.5Å; C597-V601 VanDerWaalsContact O-N 3.15Å; C597-T655 HydrophobicContact CB-CG2 3.38Å
598	L	91.4	Very high	90.3	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-68.3	-37.5	175.5	-60.4	175.1	0	0	0	111.4	F594 V595 D596 L600 V601 D602 T655 A723 F726	F594-L598 HydrophobicContact CE1-CD1 3.96Å; F594-L598 HydrophobicContact CZ-CD1 4.07Å; F594-L598 PolarHBondContact O-N 3.05Å; V595-L598 WeakPolarHBondContact O-CB 3.2Å; V595-L598 PolarHBondContact O-N 3.45Å; V595-L598 VanDerWaalsContact O-N 3.16Å; D596-L598 VanDerWaalsContact C-N 3.31Å; D596-L598 PolarHBondContact O-N 3.22Å; L598-L600 VanDerWaalsContact C-N 3.33Å; L598-L600 PolarHBondContact O-N 3.23Å; L598-V601 WeakPolarHBondContact O-CB 3.46Å; L598-V601 PolarHBondContact O-N 2.9Å; L598-D602 PolarHBondContact O-N 3.13Å; L598-T655 HydrophobicContact CD2-CG2 4.46Å; L598-A723 HydrophobicContact CD1-CB 3.95Å; L598-F726 HydrophobicContact CD1-CB 3.63Å; L598-F726 HydrophobicContact CD1-CD2 3.79Å; L598-F726 HydrophobicContact CD1-CG 3.74Å; L598-F726 HydrophobicContact CD2-CD1 4.39Å; L598-F726 HydrophobicContact CD2-CD2 4.09Å; L598-F726 HydrophobicContact CD2-CE1 4.43Å; L598-F726 HydrophobicContact CD2-CE2 4.13Å; L598-F726 HydrophobicContact CD2-CG 4.23Å; L598-F726 HydrophobicContact CD2-CZ 4.3Å
599	R	90	Very high	90.3	Very high	48 Å²	48	25.7 Å²	25.7	18%	0.181	12%	0.119	C	C	.	.	H	α-helix	trans	-61.5	-40.2	173.4	-178.3	60.8	176.3	156	6.9	112.1	K510 V595 D596 V601 D602 Y603 V720	K510-R599 PolarHBondContact O-NE 2.72Å; K510-R599 PolarHBondContact O-NH2 2.81Å; V595-R599 PolarHBondContact O-N 3.09Å; D596-R599 WeakPolarHBondContact O-CB 3.39Å; D596-R599 PolarHBondContact O-N 3.11Å; R599-V601 VanDerWaalsContact C-N 3.34Å; R599-D602 PolarHBondContact O-N 2.94Å; R599-Y603 WeakPolarHBondContact O-CB 3.47Å; R599-Y603 PolarHBondContact O-N 2.76Å; R599-V720 HydrophobicContact CB-CG1 4.38Å; R599-V720 HydrophobicContact CB-CG2 4.4Å
600	L	92.2	Very high	90.3	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.3	-41.1	174.3	177.8	63.2	0	0	0	111.3	T517 V520 I521 L524 Y552 D596 C597 L598 D602 Y603 V604 L651	T517-L600 HydrophobicContact CG2-CB 4.34Å; V520-L600 HydrophobicContact CG1-CD1 4.06Å; V520-L600 HydrophobicContact CG1-CD2 4.2Å; I521-L600 HydrophobicContact CD1-CD1 4.41Å; I521-L600 HydrophobicContact CG1-CD1 3.67Å; L524-L600 HydrophobicContact CD1-CD1 3.87Å; Y552-L600 HydrophobicContact CD1-CD2 3.3Å; Y552-L600 HydrophobicContact CE1-CD2 3.39Å; Y552-L600 HydrophobicContact CG-CD2 3.94Å; D596-L600 PolarHBondContact O-N 3.49Å; C597-L600 PolarHBondContact O-N 3.06Å; L598-L600 VanDerWaalsContact C-N 3.33Å; L598-L600 PolarHBondContact O-N 3.23Å; L600-D602 VanDerWaalsContact C-N 3.35Å; L600-Y603 WeakPolarHBondContact O-CB 3.35Å; L600-Y603 PolarHBondContact O-N 2.8Å; L600-V604 HydrophobicContact CD1-CG2 4.35Å; L600-V604 VanDerWaalsContact O-CG2 3.3Å; L600-V604 WeakPolarHBondContact O-CG2 3.37Å; L600-V604 PolarHBondContact O-N 3.48Å; L600-L651 HydrophobicContact CD2-CD1 3.97Å; L600-L651 HydrophobicContact CG-CD1 4.32Å
601	V	92.5	Very high	90.1	Very high	1 Å²	1	26 Å²	26	1%	0.006	13%	0.128	C	C	.	.	H	α-helix	trans	-61.1	-44	175.6	169.9	0	0	0	0	111.3	C597 L598 R599 V604 R605 C648 L651 I652	C597-V601 WeakPolarHBondContact O-CG2 3.47Å; C597-V601 PolarHBondContact O-N 3.5Å; C597-V601 VanDerWaalsContact O-N 3.15Å; L598-V601 WeakPolarHBondContact O-CB 3.46Å; L598-V601 PolarHBondContact O-N 2.9Å; R599-V601 VanDerWaalsContact C-N 3.34Å; V601-V604 PolarHBondContact O-N 2.91Å; V601-R605 WeakPolarHBondContact O-CG 3.23Å; V601-R605 PolarHBondContact O-N 3.3Å; V601-C648 HydrophobicContact CG1-CB 4.1Å; V601-L651 HydrophobicContact CG2-CB 3.91Å; V601-L651 HydrophobicContact CG2-CD1 4.27Å; V601-I652 HydrophobicContact CG1-CD1 4.12Å; V601-I652 HydrophobicContact CG1-CG1 4.29Å; V601-I652 HydrophobicContact CG2-CG1 4.05Å
602	D	89.7	Confident	90	Very high	17 Å²	17	26.1 Å²	26.1	9%	0.091	13%	0.128	C	C	.	.	H	α-helix	trans	-60.8	-46.1	174.8	-75.8	-14.2	0	0	0	112	L598 R599 L600 V604 R605 L606 N722	L598-D602 PolarHBondContact O-N 3.13Å; R599-D602 PolarHBondContact O-N 2.94Å; L600-D602 VanDerWaalsContact C-N 3.35Å; D602-V604 VanDerWaalsContact C-N 3.31Å; D602-V604 PolarHBondContact O-N 3.41Å; D602-R605 PolarHBondContact O-N 2.87Å; D602-L606 VanDerWaalsContact O-CB 3.32Å; D602-L606 WeakPolarHBondContact O-CB 3.39Å; D602-L606 WeakPolarHBondContact O-CG 3.27Å; D602-L606 PolarHBondContact O-N 3.44Å; D602-N722 WeakPolarHBondContact OD1-CB 3.48Å; D602-N722 PolarHBondContact OD1-ND2 2.94Å; D602-N722 WeakPolarHBondContact OD2-CB 3.34Å
603	Y	92	Very high	89.7	Confident	2 Å²	2	26.3 Å²	26.3	1%	0.008	13%	0.13	C	C	.	.	I	π-helix	trans	-57.2	-45.4	176.7	175.7	-96.6	0	0	0	111.4	I521 L524 N525 R599 L600 E607 L608	I521-Y603 HydrophobicContact CD1-CG 4.4Å; I521-Y603 HydrophobicContact CG1-CD1 4.24Å; I521-Y603 HydrophobicContact CG1-CG 4.26Å; I521-Y603 HydrophobicContact CG2-CD1 4.08Å; I521-Y603 HydrophobicContact CG2-CD2 3.7Å; I521-Y603 HydrophobicContact CG2-CE1 4.08Å; I521-Y603 HydrophobicContact CG2-CE2 3.69Å; I521-Y603 HydrophobicContact CG2-CG 3.91Å; L524-Y603 HydrophobicContact CB-CE1 4.04Å; L524-Y603 HydrophobicContact CD1-CE1 4.4Å; N525-Y603 WeakPolarHBondContact CA-OH 3.2Å; N525-Y603 VanDerWaalsContact CB-OH 3.29Å; N525-Y603 WeakPolarHBondContact CB-OH 3.38Å; N525-Y603 PolarHBondContact N-OH 3.26Å; R599-Y603 WeakPolarHBondContact O-CB 3.47Å; R599-Y603 PolarHBondContact O-N 2.76Å; L600-Y603 WeakPolarHBondContact O-CB 3.35Å; L600-Y603 PolarHBondContact O-N 2.8Å; Y603-E607 HydrophobicContact CD2-CB 3.72Å; Y603-E607 HydrophobicContact CD2-CG 4.15Å; Y603-E607 VanDerWaalsContact CD2-OE2 3.31Å; Y603-E607 WeakPolarHBondContact CD2-OE2 3.44Å; Y603-E607 HydrophobicContact CE2-CB 3.71Å; Y603-E607 HydrophobicContact CE2-CG 4.41Å; Y603-E607 VanDerWaalsContact CE2-OE2 3.25Å; Y603-E607 WeakPolarHBondContact CE2-OE2 3.45Å; Y603-E607 HydrophobicContact CG-CB 4.49Å; Y603-E607 WeakPolarHBondContact O-CB 3.3Å; Y603-E607 PolarHBondContact O-N 2.79Å; Y603-L608 HydrophobicContact CD1-CB 4.27Å; Y603-L608 HydrophobicContact CE1-CB 3.85Å; Y603-L608 HydrophobicContact CE1-CD1 4.33Å; Y603-L608 HydrophobicContact CE1-CD2 4.46Å; Y603-L608 HydrophobicContact CE1-CG 4.44Å; Y603-L608 PolarHBondContact O-N 3.08Å
604	V	92	Very high	89.4	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.006	15%	0.153	C	C	.	.	I	π-helix	trans	-63.2	-44.8	178.6	173.9	0	0	0	0	111.3	L549 L600 V601 D602 L608 K609 L644 C648	L549-V604 HydrophobicContact CD1-CG1 4.5Å; L549-V604 HydrophobicContact CD1-CG2 4.34Å; L549-V604 HydrophobicContact CD2-CG2 3.68Å; L600-V604 HydrophobicContact CD1-CG2 4.35Å; L600-V604 VanDerWaalsContact O-CG2 3.3Å; L600-V604 WeakPolarHBondContact O-CG2 3.37Å; L600-V604 PolarHBondContact O-N 3.48Å; V601-V604 PolarHBondContact O-N 2.91Å; D602-V604 VanDerWaalsContact C-N 3.31Å; D602-V604 PolarHBondContact O-N 3.41Å; V604-L608 HydrophobicContact CG1-CD2 4.42Å; V604-L608 HydrophobicContact CG2-CD2 4.16Å; V604-K609 WeakPolarHBondContact O-CB 3.25Å; V604-K609 PolarHBondContact O-N 3.01Å; V604-L644 HydrophobicContact CG1-CB 4.28Å; V604-L644 HydrophobicContact CG1-CD2 4.22Å; V604-C648 WeakPolarHBondContact CG1-SG 3.26Å
605	R	90.4	Very high	88.9	Confident	81 Å²	81	31 Å²	31	31%	0.306	16%	0.159	S	C	.	.	I	π-helix	trans	-71.9	-39.5	-176.9	-75.5	179	171.8	153.7	-1.6	113.8	V601 D602 E645	V601-R605 WeakPolarHBondContact O-CG 3.23Å; V601-R605 PolarHBondContact O-N 3.3Å; D602-R605 PolarHBondContact O-N 2.87Å; R605-E645 IonicContact CZ-OE1 3.34Å; R605-E645 IonicContact NE-OE1 3.51Å; R605-E645 PolarHBondContact NE-OE1 3.37Å; R605-E645 IonicContact NE-OE2 3.12Å; R605-E645 PolarHBondContact NE-OE2 3.23Å; R605-E645 IonicContact NH2-OE1 2.81Å; R605-E645 PolarHBondContact NH2-OE1 2.88Å; R605-E645 IonicContact NH2-OE2 3.56Å
606	L	87.1	Confident	88.4	Confident	132 Å²	132	32.5 Å²	32.5	69%	0.691	17%	0.167	S	C	*	.	I	π-helix	trans	-101.6	-43.6	-168.9	-60.4	175.6	0	0	0	113.3	D602	D602-L606 VanDerWaalsContact O-CB 3.32Å; D602-L606 WeakPolarHBondContact O-CB 3.39Å; D602-L606 WeakPolarHBondContact O-CG 3.27Å; D602-L606 PolarHBondContact O-N 3.44Å
607	E	89.8	Confident	87.5	Confident	69 Å²	69	35.5 Å²	35.5	32%	0.322	18%	0.183	S	C	.	.	I	π-helix	trans	-97.7	-60.4	-172.6	-65.7	179.4	-142.3	0	0	110.8	Y603 K609 G610 E611	Y603-E607 HydrophobicContact CD2-CB 3.72Å; Y603-E607 HydrophobicContact CD2-CG 4.15Å; Y603-E607 VanDerWaalsContact CD2-OE2 3.31Å; Y603-E607 WeakPolarHBondContact CD2-OE2 3.44Å; Y603-E607 HydrophobicContact CE2-CB 3.71Å; Y603-E607 HydrophobicContact CE2-CG 4.41Å; Y603-E607 VanDerWaalsContact CE2-OE2 3.25Å; Y603-E607 WeakPolarHBondContact CE2-OE2 3.45Å; Y603-E607 HydrophobicContact CG-CB 4.49Å; Y603-E607 WeakPolarHBondContact O-CB 3.3Å; Y603-E607 PolarHBondContact O-N 2.79Å; E607-K609 VanDerWaalsContact C-N 3.35Å; E607-K609 PolarHBondContact O-N 2.98Å; E607-G610 PolarHBondContact O-N 3.27Å; E607-E611 PolarHBondContact O-N 3.34Å
608	L	90.3	Very high	86.4	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.206	C	C	.	.	I	π-helix	trans	-60.9	-42.4	-174.4	-175.1	64.8	0	0	0	112.3	L524 T545 Y603 V604 G610 E611 I612	L524-L608 HydrophobicContact CB-CD1 4.43Å; L524-L608 HydrophobicContact CD1-CD2 4.5Å; L524-L608 HydrophobicContact CD2-CD2 4.47Å; T545-L608 HydrophobicContact CG2-CD2 3.94Å; Y603-L608 HydrophobicContact CD1-CB 4.27Å; Y603-L608 HydrophobicContact CE1-CB 3.85Å; Y603-L608 HydrophobicContact CE1-CD1 4.33Å; Y603-L608 HydrophobicContact CE1-CD2 4.46Å; Y603-L608 HydrophobicContact CE1-CG 4.44Å; Y603-L608 PolarHBondContact O-N 3.08Å; V604-L608 HydrophobicContact CG1-CD2 4.42Å; V604-L608 HydrophobicContact CG2-CD2 4.16Å; L608-G610 VanDerWaalsContact C-N 3.29Å; L608-G610 PolarHBondContact O-N 3.41Å; L608-E611 PolarHBondContact O-N 3.18Å; L608-I612 HydrophobicContact CD1-CD1 4.05Å; L608-I612 HydrophobicContact CD1-CG1 4.31Å; L608-I612 HydrophobicContact CD2-CD1 4.41Å; L608-I612 HydrophobicContact CG-CD1 3.79Å; L608-I612 HydrophobicContact CG-CG1 4.39Å; L608-I612 VanDerWaalsContact O-CG1 3.25Å; L608-I612 WeakPolarHBondContact O-CG1 3.45Å; L608-I612 PolarHBondContact O-N 2.99Å
609	K	88	Confident	85.2	Confident	78 Å²	78	44.6 Å²	44.6	34%	0.339	22%	0.221	S	C	.	.	H	α-helix	trans	-55.1	-45.5	175.7	-175.5	178.6	-179.5	175.4	0	111.3	V604 E607 F613 S641 L644	V604-K609 WeakPolarHBondContact O-CB 3.25Å; V604-K609 PolarHBondContact O-N 3.01Å; E607-K609 VanDerWaalsContact C-N 3.35Å; E607-K609 PolarHBondContact O-N 2.98Å; K609-F613 HydrophobicContact CD-CE2 4.14Å; K609-F613 HydrophobicContact CG-CD2 3.78Å; K609-F613 HydrophobicContact CG-CE2 3.42Å; K609-F613 VanDerWaalsContact CG-CE2 3.42Å; K609-F613 WeakPolarHBondContact O-CD2 3.49Å; K609-F613 PolarHBondContact O-N 2.63Å; K609-F613 VanDerWaalsContact O-N 3.15Å; K609-S641 WeakPolarHBondContact CE-OG 3.24Å; K609-S641 PolarHBondContact NZ-OG 3.45Å; K609-L644 HydrophobicContact CB-CD1 4.19Å; K609-L644 HydrophobicContact CG-CD1 4.33Å
610	G	85.7	Confident	83.7	Confident	35 Å²	35	45.5 Å²	45.5	36%	0.361	23%	0.229	S	C	.	.	H	α-helix	trans	-67.2	-41.1	178.9	0	0	0	0	0	113.2	E607 L608 T614	E607-G610 PolarHBondContact O-N 3.27Å; L608-G610 VanDerWaalsContact C-N 3.29Å; L608-G610 PolarHBondContact O-N 3.41Å; G610-T614 WeakPolarHBondContact O-CB 3.35Å; G610-T614 PolarHBondContact O-N 3.18Å; G610-T614 PolarHBondContact O-OG1 3.47Å
611	E	86.2	Confident	82	Confident	55 Å²	55	49.8 Å²	49.8	26%	0.257	26%	0.255	S	S	.	.	H	α-helix	trans	-61.3	-47.8	176.5	-70.5	176.4	171.7	0	0	111.6	E607 L608 F613 T614 C615	E607-E611 PolarHBondContact O-N 3.34Å; L608-E611 PolarHBondContact O-N 3.18Å; E611-F613 PolarHBondContact O-N 3.42Å; E611-T614 WeakPolarHBondContact O-CB 3.2Å; E611-T614 PolarHBondContact O-N 3.44Å; E611-C615 PolarHBondContact O-N 3.34Å; E611-C615 PolarHBondContact O-SG 3.06Å
612	I	87	Confident	80.1	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-61.5	-46	-180	-67.7	175	0	0	0	111	W528 W542 T545 L608 T614 C615 L616 L644	W528-I612 HydrophobicContact CD2-CG1 3.75Å; W528-I612 HydrophobicContact CE3-CG1 4.25Å; W528-I612 HydrophobicContact CG-CG1 4.08Å; W528-I612 HydrophobicContact CH2-CG1 4.33Å; W528-I612 HydrophobicContact CH2-CG2 4.24Å; W528-I612 HydrophobicContact CZ2-CD1 3.89Å; W528-I612 HydrophobicContact CZ2-CG1 3.84Å; W528-I612 HydrophobicContact CZ2-CG2 4.45Å; W528-I612 HydrophobicContact CZ3-CG2 4.46Å; W542-I612 HydrophobicContact CE3-CD1 4.27Å; W542-I612 HydrophobicContact CE3-CG2 4.43Å; W542-I612 HydrophobicContact CZ3-CD1 3.88Å; W542-I612 HydrophobicContact CZ3-CG2 4.24Å; T545-I612 HydrophobicContact CG2-CD1 4.41Å; L608-I612 HydrophobicContact CD1-CD1 4.05Å; L608-I612 HydrophobicContact CD1-CG1 4.31Å; L608-I612 HydrophobicContact CD2-CD1 4.41Å; L608-I612 HydrophobicContact CG-CD1 3.79Å; L608-I612 HydrophobicContact CG-CG1 4.39Å; L608-I612 VanDerWaalsContact O-CG1 3.25Å; L608-I612 WeakPolarHBondContact O-CG1 3.45Å; L608-I612 PolarHBondContact O-N 2.99Å; I612-T614 VanDerWaalsContact C-N 3.33Å; I612-T614 PolarHBondContact O-N 3.28Å; I612-C615 PolarHBondContact O-N 3.22Å; I612-L616 HydrophobicContact CG2-CD1 3.67Å; I612-L616 HydrophobicContact CG2-CG 4.47Å; I612-L616 WeakPolarHBondContact O-CB 3.28Å; I612-L616 WeakPolarHBondContact O-CG 3.29Å; I612-L616 PolarHBondContact O-N 3.14Å; I612-L644 HydrophobicContact CD1-CD1 4.49Å
613	F	83.7	Confident	78.2	Confident	27 Å²	27	58.8 Å²	58.8	12%	0.118	30%	0.3	C	S	.	.	H	α-helix	trans	-67.9	-33.3	178	-71.3	-49	0	0	0	113.1	K609 E611 C615 L616 N617 E637 L640 S641	K609-F613 HydrophobicContact CD-CE2 4.14Å; K609-F613 HydrophobicContact CG-CD2 3.78Å; K609-F613 HydrophobicContact CG-CE2 3.42Å; K609-F613 VanDerWaalsContact CG-CE2 3.42Å; K609-F613 WeakPolarHBondContact O-CD2 3.49Å; K609-F613 PolarHBondContact O-N 2.63Å; K609-F613 VanDerWaalsContact O-N 3.15Å; E611-F613 PolarHBondContact O-N 3.42Å; F613-C615 VanDerWaalsContact C-N 3.33Å; F613-C615 PolarHBondContact O-N 3.46Å; F613-L616 HydrophobicContact CD1-CD1 4.01Å; F613-L616 HydrophobicContact CE1-CD1 4.3Å; F613-L616 PolarHBondContact O-N 3.37Å; F613-N617 VanDerWaalsContact O-CB 3.27Å; F613-N617 WeakPolarHBondContact O-CB 3.38Å; F613-N617 PolarHBondContact O-N 3.47Å; F613-N617 PolarHBondContact O-ND2 3.49Å; F613-E637 HydrophobicContact CD1-CG 4.03Å; F613-E637 HydrophobicContact CE1-CB 3.92Å; F613-E637 HydrophobicContact CE1-CG 3.89Å; F613-E637 HydrophobicContact CZ-CB 4.2Å; F613-E637 WeakPolarHBondContact CZ-O 3.28Å; F613-L640 HydrophobicContact CE1-CB 4.15Å; F613-L640 HydrophobicContact CE1-CD1 4.16Å; F613-L640 HydrophobicContact CZ-CB 4.2Å; F613-S641 WeakPolarHBondContact CZ-OG 3.3Å
614	T	83.9	Confident	76.1	Confident	82 Å²	82	63.5 Å²	63.5	50%	0.503	33%	0.328	S	S	.	.	H	α-helix	trans	-62	-43	173.6	-57.6	0	0	0	0	111.1	G610 E611 I612 Q618	G610-T614 WeakPolarHBondContact O-CB 3.35Å; G610-T614 PolarHBondContact O-N 3.18Å; G610-T614 PolarHBondContact O-OG1 3.47Å; E611-T614 WeakPolarHBondContact O-CB 3.2Å; E611-T614 PolarHBondContact O-N 3.44Å; I612-T614 VanDerWaalsContact C-N 3.33Å; I612-T614 PolarHBondContact O-N 3.28Å; T614-Q618 WeakPolarHBondContact O-CG 3.43Å; T614-Q618 PolarHBondContact O-N 2.85Å
615	C	82.2	Confident	73.9	Confident	17 Å²	17	71 Å²	71	12%	0.115	37%	0.366	C	S	.	.	H	α-helix	trans	-67.3	-39.5	175.6	-69.5	0	0	0	0	112.8	W528 Y533 E611 I612 F613	W528-C615 HydrophobicContact CE3-CB 4.4Å; Y533-C615 HydrophobicContact CE1-CB 4Å; E611-C615 PolarHBondContact O-N 3.34Å; E611-C615 PolarHBondContact O-SG 3.06Å; I612-C615 PolarHBondContact O-N 3.22Å; F613-C615 VanDerWaalsContact C-N 3.33Å; F613-C615 PolarHBondContact O-N 3.46Å
616	L	78.9	Confident	71.8	Confident	33 Å²	33	73.5 Å²	73.5	17%	0.173	39%	0.385	C	S	.	.	H	α-helix	trans	-69.3	-44	178.8	-79	162.9	0	0	0	112.8	I538 I612 F613 Q618 R619 L620 L640	I538-L616 HydrophobicContact CD1-CD2 3.19Å; I538-L616 HydrophobicContact CD1-CG 3.97Å; I538-L616 HydrophobicContact CG1-CD2 4.42Å; I612-L616 HydrophobicContact CG2-CD1 3.67Å; I612-L616 HydrophobicContact CG2-CG 4.47Å; I612-L616 WeakPolarHBondContact O-CB 3.28Å; I612-L616 WeakPolarHBondContact O-CG 3.29Å; I612-L616 PolarHBondContact O-N 3.14Å; F613-L616 HydrophobicContact CD1-CD1 4.01Å; F613-L616 HydrophobicContact CE1-CD1 4.3Å; F613-L616 PolarHBondContact O-N 3.37Å; L616-Q618 VanDerWaalsContact C-N 3.28Å; L616-Q618 PolarHBondContact O-N 3.47Å; L616-R619 WeakPolarHBondContact O-CA 3.29Å; L616-R619 VanDerWaalsContact O-CB 3.3Å; L616-R619 WeakPolarHBondContact O-CB 3.17Å; L616-R619 PolarHBondContact O-N 3.33Å; L616-L620 PolarHBondContact O-N 3.31Å; L616-L640 HydrophobicContact CD1-CD1 3.34Å
617	N	72.6	Confident	69.7	Low	62 Å²	62	72.8 Å²	72.8	33%	0.332	38%	0.382	S	S	.	.	H	α-helix	trans	-66.9	-31.1	-177.3	-76.6	-22.6	0	0	0	112.1	F613 R619 L620 V621 E637	F613-N617 VanDerWaalsContact O-CB 3.27Å; F613-N617 WeakPolarHBondContact O-CB 3.38Å; F613-N617 PolarHBondContact O-N 3.47Å; F613-N617 PolarHBondContact O-ND2 3.49Å; N617-R619 PolarHBondContact O-N 3.08Å; N617-L620 PolarHBondContact O-N 2.87Å; N617-V621 VanDerWaalsContact O-CG2 3.32Å; N617-V621 WeakPolarHBondContact O-CG2 3.48Å; N617-V621 PolarHBondContact O-N 3.35Å; N617-E637 PolarHBondContact ND2-OE1 2.95Å; N617-E637 PolarHBondContact OD1-OE1 2.87Å
618	Q	69.7	Low	67.4	Low	105 Å²	105	78.2 Å²	78.2	49%	0.491	41%	0.413	S	S	.	.	H	α-helix	trans	-57.9	-30.6	170.4	-74.4	172.4	14.7	0	0	112.8	T614 L616 L622	T614-Q618 WeakPolarHBondContact O-CG 3.43Å; T614-Q618 PolarHBondContact O-N 2.85Å; L616-Q618 VanDerWaalsContact C-N 3.28Å; L616-Q618 PolarHBondContact O-N 3.47Å; Q618-L622 WeakPolarHBondContact O-CG 3.34Å
619	R	65.1	Low	65.3	Low	90 Å²	90	82.2 Å²	82.2	34%	0.34	44%	0.441	S	S	.	.	H	α-helix	trans	-79.8	-41.3	176.3	-174.8	177.9	-178.1	140.4	-0.8	112.6	D535 L616 N617 L622 Q623	D535-R619 PolarHBondContact O-NH1 2.86Å; L616-R619 WeakPolarHBondContact O-CA 3.29Å; L616-R619 VanDerWaalsContact O-CB 3.3Å; L616-R619 WeakPolarHBondContact O-CB 3.17Å; L616-R619 PolarHBondContact O-N 3.33Å; N617-R619 PolarHBondContact O-N 3.08Å; R619-L622 WeakPolarHBondContact O-CB 3.45Å; R619-L622 PolarHBondContact O-N 3.36Å; R619-Q623 PolarHBondContact O-N 3.43Å
620	L	58.3	Low	63	Low	67 Å²	67	86.6 Å²	86.6	35%	0.351	47%	0.468	S	S	.	.	H	α-helix	trans	-68.6	-36.3	-177.4	-72.1	169	0	0	0	112.3	L616 N617 L622 Q623 T624	L616-L620 PolarHBondContact O-N 3.31Å; N617-L620 PolarHBondContact O-N 2.87Å; L620-L622 PolarHBondContact O-N 2.86Å; L620-Q623 PolarHBondContact O-N 3.47Å; L620-T624 PolarHBondContact O-N 2.83Å; L620-T624 PolarHBondContact O-OG1 2.84Å
621	V	56.4	Low	61	Low	90 Å²	90	91.6 Å²	91.6	55%	0.545	49%	0.487	S	S	.	.	H	α-helix	trans	-60.4	-31.7	173.2	173.9	0	0	0	0	111.5	N617	N617-V621 VanDerWaalsContact O-CG2 3.32Å; N617-V621 WeakPolarHBondContact O-CG2 3.48Å; N617-V621 PolarHBondContact O-N 3.35Å
622	L	52.3	Low	59.1	Low	103 Å²	103	96 Å²	96	54%	0.539	51%	0.512	S	S	.	.	H	α-helix	trans	-78.5	-23.2	176.6	-66.4	171.3	0	0	0	113.3	Q618 R619 L620	Q618-L622 WeakPolarHBondContact O-CG 3.34Å; R619-L622 WeakPolarHBondContact O-CB 3.45Å; R619-L622 PolarHBondContact O-N 3.36Å; L620-L622 PolarHBondContact O-N 2.86Å
623	Q	50.6	Low	57.5	Low	104 Å²	104	102.4 Å²	102.4	49%	0.486	55%	0.552	S	S	.	*	H	α-helix	trans	-90.8	-32.8	-179.6	-69.8	-174.9	-46.8	0	0	112.7	R619 L620 M625 N626	R619-Q623 PolarHBondContact O-N 3.43Å; L620-Q623 PolarHBondContact O-N 3.47Å; Q623-M625 VanDerWaalsContact C-N 3.28Å; Q623-M625 PolarHBondContact O-N 2.73Å; Q623-N626 PolarHBondContact O-N 2.9Å
624	T	48.4	Very low	56.2	Low	100 Å²	100	104.3 Å²	104.3	61%	0.613	57%	0.565	S	S	*	*	H	α-helix	trans	-71.1	-18.7	179.9	36.7	0	0	0	0	113.9	L620 N626	L620-T624 PolarHBondContact O-N 2.83Å; L620-T624 PolarHBondContact O-OG1 2.84Å; T624-N626 VanDerWaalsContact C-N 3.27Å; T624-N626 PolarHBondContact O-N 2.79Å
625	M	44.6	Very low	55.6	Low	160 Å²	160	104.5 Å²	104.5	79%	0.788	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-9.9	171.7	-69.2	-68.4	-169.2	0	0	114	Q623	Q623-M625 VanDerWaalsContact C-N 3.28Å; Q623-M625 PolarHBondContact O-N 2.73Å
626	N	47.9	Very low	55.2	Low	133 Å²	133	110.1 Å²	110.1	71%	0.711	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.2	-8.6	-173.8	-79.2	-29.7	0	0	0	114.9	Q623 T624	Q623-N626 PolarHBondContact O-N 2.9Å; T624-N626 VanDerWaalsContact C-N 3.27Å; T624-N626 PolarHBondContact O-N 2.79Å
627	N	41.6	Very low	55.3	Low	117 Å²	117	112.6 Å²	112.6	63%	0.626	59%	0.594	S	S	*	*			trans	-133.7	97.6	-177.8	-80	-6.3	0	0	0	111.4	S629	N627-S629 PolarHBondContact O-N 3.48Å
628	D	41.5	Very low	55.8	Low	182 Å²	182	112.5 Å²	112.5	97%	0.973	60%	0.595	S	S	*	*			trans	-74.2	59.7	163	-85.4	-28.3	0	0	0	110.7
629	S	47.4	Very low	56.5	Low	84 Å²	84	111.4 Å²	111.4	59%	0.587	59%	0.592	S	S	*	*			trans	-131	106.7	171.8	32.2	0	0	0	0	110.4	N627 D631	N627-S629 PolarHBondContact O-N 3.48Å; S629-D631 VanDerWaalsContact C-N 3.27Å; S629-D631 PolarHBondContact O-N 3.4Å
630	N	38.4	Very low	57.5	Low	171 Å²	171	108.6 Å²	108.6	91%	0.914	58%	0.583	S	S	*	*			trans	-72.5	71.7	171.6	-72.4	-36.8	0	0	0	110.7
631	D	43.6	Very low	58.9	Low	140 Å²	140	106.6 Å²	106.6	75%	0.749	58%	0.575	S	S	*	*	S	Bend	trans	-135.5	118.3	168.1	-98	-23.8	0	0	0	110.2	S629	S629-D631 VanDerWaalsContact C-N 3.27Å; S629-D631 PolarHBondContact O-N 3.4Å
632	D	46.1	Very low	60.5	Low	146 Å²	146	107.9 Å²	107.9	78%	0.781	58%	0.575	S	S	*	*			trans	40.8	79	168.9	-65.4	-21.1	0	0	0	116.4	V634	D632-V634 PolarHBondContact O-N 3.12Å
633	T	53.5	Low	62.4	Low	138 Å²	138	104.8 Å²	104.8	85%	0.847	56%	0.562	S	S	*	*			trans	-64.6	84.5	157.7	54.1	0	0	0	0	108.3	N635	T633-N635 PolarHBondContact O-N 2.98Å; T633-N635 VanDerWaalsContact O-N 3.1Å
634	V	58	Low	64.4	Low	66 Å²	66	100.1 Å²	100.1	40%	0.4	54%	0.54	S	S	.	.			trans	-45.7	122.9	166.1	173.4	0	0	0	0	106.5	D632 Y636 I639	D632-V634 PolarHBondContact O-N 3.12Å; V634-Y636 HydrophobicContact CB-CD1 4.32Å; V634-Y636 HydrophobicContact CB-CD2 4.24Å; V634-Y636 HydrophobicContact CB-CE1 3.85Å; V634-Y636 HydrophobicContact CB-CE2 3.76Å; V634-Y636 HydrophobicContact CB-CG 4.5Å; V634-Y636 HydrophobicContact CG1-CD1 3.78Å; V634-Y636 HydrophobicContact CG1-CD2 4.44Å; V634-Y636 HydrophobicContact CG1-CE1 3.59Å; V634-Y636 HydrophobicContact CG1-CE2 4.28Å; V634-Y636 HydrophobicContact CG1-CG 4.2Å; V634-Y636 WeakPolarHBondContact O-CD2 3.47Å; V634-Y636 WeakPolarHBondContact O-CE2 3.28Å; V634-Y636 PolarHBondContact O-N 2.91Å; V634-I639 HydrophobicContact CG1-CD1 3.88Å
635	N	70.5	Confident	66.5	Low	86 Å²	86	98.4 Å²	98.4	46%	0.46	53%	0.525	S	S	.	.			trans	-75.1	72.9	-178.2	-164.9	-16.2	0	0	0	108.8	T633 E637 T638 I639	T633-N635 PolarHBondContact O-N 2.98Å; T633-N635 VanDerWaalsContact O-N 3.1Å; N635-E637 PolarHBondContact O-N 3.42Å; N635-E637 VanDerWaalsContact O-N 3.14Å; N635-T638 HydrophobicContact CB-CG2 4.29Å; N635-T638 WeakPolarHBondContact CB-OG1 3.45Å; N635-T638 VanDerWaalsContact CG-CG2 3.43Å; N635-T638 WeakPolarHBondContact ND2-CG2 3.25Å; N635-T638 PolarHBondContact O-N 3.33Å; N635-T638 VanDerWaalsContact O-N 3.08Å; N635-T638 PolarHBondContact O-OG1 2.76Å; N635-T638 PolarHBondContact OD1-N 3.32Å; N635-I639 PolarHBondContact O-N 3.42Å
636	Y	74.8	Confident	68.8	Low	135 Å²	135	96.8 Å²	96.8	53%	0.529	52%	0.516	S	S	.	.	H	α-helix	trans	-57.5	-29	-179.4	-59.2	-76.6	0	0	0	110.8	V634 I639 L640	V634-Y636 HydrophobicContact CB-CD1 4.32Å; V634-Y636 HydrophobicContact CB-CD2 4.24Å; V634-Y636 HydrophobicContact CB-CE1 3.85Å; V634-Y636 HydrophobicContact CB-CE2 3.76Å; V634-Y636 HydrophobicContact CB-CG 4.5Å; V634-Y636 HydrophobicContact CG1-CD1 3.78Å; V634-Y636 HydrophobicContact CG1-CD2 4.44Å; V634-Y636 HydrophobicContact CG1-CE1 3.59Å; V634-Y636 HydrophobicContact CG1-CE2 4.28Å; V634-Y636 HydrophobicContact CG1-CG 4.2Å; V634-Y636 WeakPolarHBondContact O-CD2 3.47Å; V634-Y636 WeakPolarHBondContact O-CE2 3.28Å; V634-Y636 PolarHBondContact O-N 2.91Å; Y636-I639 PolarHBondContact O-N 2.85Å; Y636-L640 WeakPolarHBondContact O-CB 3.45Å; Y636-L640 WeakPolarHBondContact O-CG 3.31Å; Y636-L640 PolarHBondContact O-N 2.93Å
637	E	79.8	Confident	70.9	Confident	86 Å²	86	91.7 Å²	91.7	40%	0.402	49%	0.49	S	S	.	.	H	α-helix	trans	-64.5	-40.1	176.5	-62.2	-168.6	159	0	0	112.7	F613 N617 N635 S641	F613-E637 HydrophobicContact CD1-CG 4.03Å; F613-E637 HydrophobicContact CE1-CB 3.92Å; F613-E637 HydrophobicContact CE1-CG 3.89Å; F613-E637 HydrophobicContact CZ-CB 4.2Å; F613-E637 WeakPolarHBondContact CZ-O 3.28Å; N617-E637 PolarHBondContact ND2-OE1 2.95Å; N617-E637 PolarHBondContact OD1-OE1 2.87Å; N635-E637 PolarHBondContact O-N 3.42Å; N635-E637 VanDerWaalsContact O-N 3.14Å; E637-S641 WeakPolarHBondContact O-CB 3.34Å; E637-S641 PolarHBondContact O-N 3.38Å; E637-S641 PolarHBondContact O-OG 2.99Å
638	T	83	Confident	73.4	Confident	59 Å²	59	86.1 Å²	86.1	36%	0.362	46%	0.461	S	S	.	.	H	α-helix	trans	-68.3	-46.2	176	56.2	0	0	0	0	111	N635 L640 S641 E642	N635-T638 HydrophobicContact CB-CG2 4.29Å; N635-T638 WeakPolarHBondContact CB-OG1 3.45Å; N635-T638 VanDerWaalsContact CG-CG2 3.43Å; N635-T638 WeakPolarHBondContact ND2-CG2 3.25Å; N635-T638 PolarHBondContact O-N 3.33Å; N635-T638 VanDerWaalsContact O-N 3.08Å; N635-T638 PolarHBondContact O-OG1 2.76Å; N635-T638 PolarHBondContact OD1-N 3.32Å; T638-L640 PolarHBondContact O-N 3.47Å; T638-S641 WeakPolarHBondContact O-CB 3.37Å; T638-S641 PolarHBondContact O-N 3.33Å; T638-E642 WeakPolarHBondContact O-CB 3.25Å; T638-E642 WeakPolarHBondContact O-CG 3.4Å; T638-E642 PolarHBondContact O-N 2.78Å
639	I	85.2	Confident	75.8	Confident	83 Å²	83	82.6 Å²	82.6	43%	0.426	44%	0.438	S	S	.	.	H	α-helix	trans	-60.3	-47.1	-179.4	-60.9	172	0	0	0	110.9	V634 N635 Y636 S641 E642 C643	V634-I639 HydrophobicContact CG1-CD1 3.88Å; N635-I639 PolarHBondContact O-N 3.42Å; Y636-I639 PolarHBondContact O-N 2.85Å; I639-S641 VanDerWaalsContact C-N 3.34Å; I639-S641 PolarHBondContact O-N 3.37Å; I639-E642 PolarHBondContact O-N 2.71Å; I639-C643 PolarHBondContact O-N 3.49Å; I639-C643 PolarHBondContact O-SG 3.3Å
640	L	86	Confident	77.9	Confident	31 Å²	31	84.4 Å²	84.4	16%	0.162	43%	0.432	C	S	.	.	H	α-helix	trans	-67.2	-36.9	179.3	-66.6	172.6	0	0	0	111.8	W542 F613 L616 Y636 T638 C643 L644	W542-L640 HydrophobicContact CD2-CD2 4.03Å; W542-L640 HydrophobicContact CE3-CD2 4.27Å; W542-L640 HydrophobicContact CH2-CB 4.11Å; W542-L640 HydrophobicContact CH2-CD2 3.62Å; W542-L640 HydrophobicContact CH2-CG 4.45Å; W542-L640 HydrophobicContact CZ2-CD2 3.34Å; W542-L640 HydrophobicContact CZ3-CD2 4.08Å; F613-L640 HydrophobicContact CE1-CB 4.15Å; F613-L640 HydrophobicContact CE1-CD1 4.16Å; F613-L640 HydrophobicContact CZ-CB 4.2Å; L616-L640 HydrophobicContact CD1-CD1 3.34Å; Y636-L640 WeakPolarHBondContact O-CB 3.45Å; Y636-L640 WeakPolarHBondContact O-CG 3.31Å; Y636-L640 PolarHBondContact O-N 2.93Å; T638-L640 PolarHBondContact O-N 3.47Å; L640-C643 PolarHBondContact O-N 3.4Å; L640-L644 WeakPolarHBondContact O-CG 3.28Å; L640-L644 PolarHBondContact O-N 3.09Å; L640-L644 VanDerWaalsContact O-N 3.11Å
641	S	87.7	Confident	80.4	Confident	25 Å²	25	76.4 Å²	76.4	18%	0.175	39%	0.389	C	S	.	.	H	α-helix	trans	-62.7	-44.1	173.8	-65.1	0	0	0	0	111.8	K609 F613 E637 T638 I639 L644 E645	K609-S641 WeakPolarHBondContact CE-OG 3.24Å; K609-S641 PolarHBondContact NZ-OG 3.45Å; F613-S641 WeakPolarHBondContact CZ-OG 3.3Å; E637-S641 WeakPolarHBondContact O-CB 3.34Å; E637-S641 PolarHBondContact O-N 3.38Å; E637-S641 PolarHBondContact O-OG 2.99Å; T638-S641 WeakPolarHBondContact O-CB 3.37Å; T638-S641 PolarHBondContact O-N 3.33Å; I639-S641 VanDerWaalsContact C-N 3.34Å; I639-S641 PolarHBondContact O-N 3.37Å; S641-L644 PolarHBondContact O-N 3.17Å; S641-E645 WeakPolarHBondContact O-CB 3.33Å; S641-E645 PolarHBondContact O-N 3.23Å
642	E	90.8	Very high	82.7	Confident	116 Å²	116	71.3 Å²	71.3	54%	0.542	36%	0.362	S	S	.	.	H	α-helix	trans	-62.9	-40.7	177.2	-74.1	171.6	-162.5	0	0	111.6	T638 I639 E645 Q646	T638-E642 WeakPolarHBondContact O-CB 3.25Å; T638-E642 WeakPolarHBondContact O-CG 3.4Å; T638-E642 PolarHBondContact O-N 2.78Å; I639-E642 PolarHBondContact O-N 2.71Å; E642-E645 PolarHBondContact O-N 2.95Å; E642-Q646 WeakPolarHBondContact O-CG 3.32Å; E642-Q646 PolarHBondContact O-N 2.88Å
643	C	90.9	Very high	84.8	Confident	39 Å²	39	68.7 Å²	68.7	26%	0.264	35%	0.351	S	S	.	.	H	α-helix	trans	-63.2	-41.6	175.5	-68.9	0	0	0	0	113.2	W542 I639 L640 S647	W542-C643 HydrophobicContact CH2-CB 4.42Å; W542-C643 HydrophobicContact CZ2-CB 3.91Å; I639-C643 PolarHBondContact O-N 3.49Å; I639-C643 PolarHBondContact O-SG 3.3Å; L640-C643 PolarHBondContact O-N 3.4Å; C643-S647 PolarHBondContact O-N 2.87Å; C643-S647 PolarHBondContact O-OG 3.26Å; C643-S647 VanDerWaalsContact O-OG 3.08Å
644	L	92.4	Very high	86.4	Confident	6 Å²	6	62.6 Å²	62.6	3%	0.031	31%	0.314	C	S	.	.	H	α-helix	trans	-66.6	-40.6	175.1	-69.2	177.4	0	0	0	110.8	W542 L549 V604 K609 I612 L640 S641 S647 C648	W542-L644 HydrophobicContact CH2-CD2 3.94Å; W542-L644 HydrophobicContact CH2-CG 3.91Å; W542-L644 HydrophobicContact CZ3-CD2 4.13Å; W542-L644 HydrophobicContact CZ3-CG 4.33Å; L549-L644 HydrophobicContact CD1-CD2 4.42Å; V604-L644 HydrophobicContact CG1-CB 4.28Å; V604-L644 HydrophobicContact CG1-CD2 4.22Å; K609-L644 HydrophobicContact CB-CD1 4.19Å; K609-L644 HydrophobicContact CG-CD1 4.33Å; I612-L644 HydrophobicContact CD1-CD1 4.49Å; L640-L644 WeakPolarHBondContact O-CG 3.28Å; L640-L644 PolarHBondContact O-N 3.09Å; L640-L644 VanDerWaalsContact O-N 3.11Å; S641-L644 PolarHBondContact O-N 3.17Å; L644-S647 WeakPolarHBondContact O-CB 3.39Å; L644-S647 PolarHBondContact O-N 3.11Å; L644-S647 VanDerWaalsContact O-N 3.12Å; L644-C648 PolarHBondContact O-N 3.41Å; L644-C648 PolarHBondContact O-SG 3.38Å; L644-C648 VanDerWaalsContact O-SG 3.38Å
645	E	93	Very high	87.8	Confident	64 Å²	64	59.4 Å²	59.4	30%	0.299	30%	0.295	S	S	.	.	H	α-helix	trans	-64.4	-42	179.2	-166.3	56.8	-147	0	0	111.8	R605 S641 E642 S647 C648 E649	R605-E645 IonicContact CZ-OE1 3.34Å; R605-E645 IonicContact NE-OE1 3.51Å; R605-E645 PolarHBondContact NE-OE1 3.37Å; R605-E645 IonicContact NE-OE2 3.12Å; R605-E645 PolarHBondContact NE-OE2 3.23Å; R605-E645 IonicContact NH2-OE1 2.81Å; R605-E645 PolarHBondContact NH2-OE1 2.88Å; R605-E645 IonicContact NH2-OE2 3.56Å; S641-E645 WeakPolarHBondContact O-CB 3.33Å; S641-E645 PolarHBondContact O-N 3.23Å; E642-E645 PolarHBondContact O-N 2.95Å; E645-S647 PolarHBondContact O-N 3.26Å; E645-C648 CarbonylContact O-C 3.57Å; E645-C648 WeakPolarHBondContact O-CA 3.47Å; E645-C648 WeakPolarHBondContact O-CB 3.24Å; E645-C648 PolarHBondContact O-N 2.85Å; E645-C648 VanDerWaalsContact O-N 3.07Å; E645-E649 WeakPolarHBondContact O-CG 3.2Å; E645-E649 PolarHBondContact O-N 3.04Å
646	Q	93	Very high	88.7	Confident	126 Å²	126	58.7 Å²	58.7	59%	0.589	29%	0.291	S	S	*	.	H	α-helix	trans	-58.1	-36.7	172.2	-73.3	175.2	10.2	0	0	112.6	E642 R650	E642-Q646 WeakPolarHBondContact O-CG 3.32Å; E642-Q646 PolarHBondContact O-N 2.88Å; Q646-R650 WeakPolarHBondContact O-CB 3.41Å; Q646-R650 PolarHBondContact O-N 2.87Å; Q646-R650 VanDerWaalsContact O-N 3.1Å
647	S	92.2	Very high	89.4	Confident	25 Å²	25	54.7 Å²	54.7	18%	0.175	28%	0.283	C	S	.	.	H	α-helix	trans	-68.9	-40.5	175.9	-57.2	0	0	0	0	111.3	C643 L644 E645 R650 L651	C643-S647 PolarHBondContact O-N 2.87Å; C643-S647 PolarHBondContact O-OG 3.26Å; C643-S647 VanDerWaalsContact O-OG 3.08Å; L644-S647 WeakPolarHBondContact O-CB 3.39Å; L644-S647 PolarHBondContact O-N 3.11Å; L644-S647 VanDerWaalsContact O-N 3.12Å; E645-S647 PolarHBondContact O-N 3.26Å; S647-R650 PolarHBondContact O-N 3.5Å; S647-L651 WeakPolarHBondContact O-CG 3.1Å; S647-L651 PolarHBondContact O-N 3.38Å; S647-L651 VanDerWaalsContact O-N 3.08Å
648	C	93	Very high	89.9	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.007	26%	0.264	C	S	.	.	H	α-helix	trans	-63.5	-47.2	174	-69.9	0	0	0	0	112.1	V601 V604 L644 E645 R650 L651 I652	V601-C648 HydrophobicContact CG1-CB 4.1Å; V604-C648 WeakPolarHBondContact CG1-SG 3.26Å; L644-C648 PolarHBondContact O-N 3.41Å; L644-C648 PolarHBondContact O-SG 3.38Å; L644-C648 VanDerWaalsContact O-SG 3.38Å; E645-C648 CarbonylContact O-C 3.57Å; E645-C648 WeakPolarHBondContact O-CA 3.47Å; E645-C648 WeakPolarHBondContact O-CB 3.24Å; E645-C648 PolarHBondContact O-N 2.85Å; E645-C648 VanDerWaalsContact O-N 3.07Å; C648-R650 VanDerWaalsContact C-N 3.29Å; C648-R650 PolarHBondContact O-N 2.99Å; C648-L651 WeakPolarHBondContact O-CB 3.47Å; C648-L651 PolarHBondContact O-N 3.42Å; C648-L651 VanDerWaalsContact O-N 3.14Å; C648-I652 VanDerWaalsContact O-CG1 3.31Å; C648-I652 WeakPolarHBondContact O-CG1 3.1Å; C648-I652 PolarHBondContact O-N 3.19Å
649	E	92.8	Very high	90.3	Very high	107 Å²	107	48 Å²	48	50%	0.5	25%	0.248	S	C	.	.	H	α-helix	trans	-58.4	-41.4	177.3	-74.3	179.4	173.4	0	0	111.8	E645 I652 T653	E645-E649 WeakPolarHBondContact O-CG 3.2Å; E645-E649 PolarHBondContact O-N 3.04Å; E649-I652 PolarHBondContact O-N 3.1Å; E649-T653 WeakPolarHBondContact O-CB 3.29Å; E649-T653 PolarHBondContact O-N 3.38Å; E649-T653 PolarHBondContact O-OG1 3.02Å
650	R	91.3	Very high	90.5	Very high	123 Å²	123	47.7 Å²	47.7	46%	0.464	25%	0.247	S	C	.	.	H	α-helix	trans	-62.8	-45.2	174.7	-176.4	176.5	176.6	165.2	3.6	111.9	S553 Q646 S647 C648 T653 S654	S553-R650 PolarHBondContact OG-NE 2.99Å; S553-R650 VanDerWaalsContact OG-NE 3.1Å; Q646-R650 WeakPolarHBondContact O-CB 3.41Å; Q646-R650 PolarHBondContact O-N 2.87Å; Q646-R650 VanDerWaalsContact O-N 3.1Å; S647-R650 PolarHBondContact O-N 3.5Å; C648-R650 VanDerWaalsContact C-N 3.29Å; C648-R650 PolarHBondContact O-N 2.99Å; R650-T653 PolarHBondContact O-N 3.35Å; R650-S654 PolarHBondContact O-N 3.35Å; R650-S654 PolarHBondContact O-OG 3.23Å
651	L	91.5	Very high	90.7	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-61.1	-47	176.3	-72.1	172.5	0	0	0	111.5	L549 Y552 I556 L600 V601 S647 C648 T653 S654 T655	L549-L651 HydrophobicContact CD2-CD1 4.4Å; Y552-L651 HydrophobicContact CD1-CD2 3.76Å; Y552-L651 HydrophobicContact CE1-CD2 4.42Å; I556-L651 HydrophobicContact CD1-CD2 3.9Å; L600-L651 HydrophobicContact CD2-CD1 3.97Å; L600-L651 HydrophobicContact CG-CD1 4.32Å; V601-L651 HydrophobicContact CG2-CB 3.91Å; V601-L651 HydrophobicContact CG2-CD1 4.27Å; S647-L651 WeakPolarHBondContact O-CG 3.1Å; S647-L651 PolarHBondContact O-N 3.38Å; S647-L651 VanDerWaalsContact O-N 3.08Å; C648-L651 WeakPolarHBondContact O-CB 3.47Å; C648-L651 PolarHBondContact O-N 3.42Å; C648-L651 VanDerWaalsContact O-N 3.14Å; L651-T653 VanDerWaalsContact C-N 3.31Å; L651-T653 PolarHBondContact O-N 3.47Å; L651-S654 PolarHBondContact O-N 3.37Å; L651-T655 VanDerWaalsContact O-CG2 3.26Å; L651-T655 WeakPolarHBondContact O-CG2 3.46Å; L651-T655 PolarHBondContact O-N 2.96Å
652	I	90.5	Very high	90.8	Very high	34 Å²	34	45.2 Å²	45.2	17%	0.174	23%	0.232	C	C	.	.	H	α-helix	trans	-58.4	-44.4	176.4	-66.4	166.4	0	0	0	110.3	V601 C648 E649 S654 T655 N656 F726	V601-I652 HydrophobicContact CG1-CD1 4.12Å; V601-I652 HydrophobicContact CG1-CG1 4.29Å; V601-I652 HydrophobicContact CG2-CG1 4.05Å; C648-I652 VanDerWaalsContact O-CG1 3.31Å; C648-I652 WeakPolarHBondContact O-CG1 3.1Å; C648-I652 PolarHBondContact O-N 3.19Å; E649-I652 PolarHBondContact O-N 3.1Å; I652-S654 VanDerWaalsContact C-N 3.34Å; I652-S654 PolarHBondContact O-N 2.95Å; I652-T655 WeakPolarHBondContact O-CB 3.35Å; I652-T655 PolarHBondContact O-N 3.47Å; I652-T655 PolarHBondContact O-OG1 2.95Å; I652-N656 PolarHBondContact O-N 3.28Å; I652-F726 HydrophobicContact CG2-CE1 4.45Å
653	T	91.1	Very high	90.8	Very high	90 Å²	90	40.4 Å²	40.4	55%	0.552	21%	0.21	S	C	*	.	H	α-helix	trans	-60.4	-43.7	178.3	-56.5	0	0	0	0	111.4	E649 R650 L651 T655 N656	E649-T653 WeakPolarHBondContact O-CB 3.29Å; E649-T653 PolarHBondContact O-N 3.38Å; E649-T653 PolarHBondContact O-OG1 3.02Å; R650-T653 PolarHBondContact O-N 3.35Å; L651-T653 VanDerWaalsContact C-N 3.31Å; L651-T653 PolarHBondContact O-N 3.47Å; T653-T655 VanDerWaalsContact C-N 3.28Å; T653-T655 PolarHBondContact O-N 3.43Å; T653-N656 WeakPolarHBondContact O-CB 3.23Å; T653-N656 PolarHBondContact O-N 2.92Å
654	S	87	Confident	90.8	Very high	10 Å²	10	42.6 Å²	42.6	7%	0.07	22%	0.216	C	C	.	.	H	α-helix	trans	-64.1	-29.6	174.1	-68.4	0	0	0	0	112.9	D557 R650 L651 I652 N656 S657	D557-S654 PolarHBondContact OD1-OG 3.09Å; R650-S654 PolarHBondContact O-N 3.35Å; R650-S654 PolarHBondContact O-OG 3.23Å; L651-S654 PolarHBondContact O-N 3.37Å; I652-S654 VanDerWaalsContact C-N 3.34Å; I652-S654 PolarHBondContact O-N 2.95Å; S654-N656 VanDerWaalsContact C-N 3.31Å; S654-N656 PolarHBondContact O-N 3.29Å; S654-S657 PolarHBondContact O-N 2.88Å
655	T	87.4	Confident	90.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.8	-27.6	176.6	69.7	0	0	0	0	113.9	C597 L598 L651 I652 T653 S657 I658 M659	C597-T655 HydrophobicContact CB-CG2 3.38Å; L598-T655 HydrophobicContact CD2-CG2 4.46Å; L651-T655 VanDerWaalsContact O-CG2 3.26Å; L651-T655 WeakPolarHBondContact O-CG2 3.46Å; L651-T655 PolarHBondContact O-N 2.96Å; I652-T655 WeakPolarHBondContact O-CB 3.35Å; I652-T655 PolarHBondContact O-N 3.47Å; I652-T655 PolarHBondContact O-OG1 2.95Å; T653-T655 VanDerWaalsContact C-N 3.28Å; T653-T655 PolarHBondContact O-N 3.43Å; T655-S657 VanDerWaalsContact C-N 3.28Å; T655-S657 PolarHBondContact O-N 2.86Å; T655-I658 WeakPolarHBondContact O-CB 3.32Å; T655-I658 PolarHBondContact O-N 3.35Å; T655-I658 VanDerWaalsContact O-N 3.1Å; T655-M659 PolarHBondContact O-N 3.31Å
656	N	89.2	Confident	90.3	Very high	70 Å²	70	41.7 Å²	41.7	37%	0.374	21%	0.211	S	C	.	.	H	α-helix	trans	-61	-39.5	176.4	-69.4	-34.4	0	0	0	111.5	I652 T653 S654 I658 M659 D660	I652-N656 PolarHBondContact O-N 3.28Å; T653-N656 WeakPolarHBondContact O-CB 3.23Å; T653-N656 PolarHBondContact O-N 2.92Å; S654-N656 VanDerWaalsContact C-N 3.31Å; S654-N656 PolarHBondContact O-N 3.29Å; N656-I658 VanDerWaalsContact C-N 3.32Å; N656-I658 PolarHBondContact O-N 2.96Å; N656-M659 VanDerWaalsContact O-CB 3.31Å; N656-M659 WeakPolarHBondContact O-CB 3.47Å; N656-M659 PolarHBondContact O-N 3.4Å; N656-M659 VanDerWaalsContact O-N 3.17Å; N656-D660 PolarHBondContact O-N 2.86Å
657	S	89.4	Confident	90.2	Very high	52 Å²	52	38.2 Å²	38.2	36%	0.364	20%	0.195	S	C	.	.	H	α-helix	trans	-64.7	-35	175.4	-57.4	0	0	0	0	112.5	S654 T655 L661	S654-S657 PolarHBondContact O-N 2.88Å; T655-S657 VanDerWaalsContact C-N 3.28Å; T655-S657 PolarHBondContact O-N 2.86Å; S657-L661 WeakPolarHBondContact O-CG 3.47Å; S657-L661 PolarHBondContact O-N 3.21Å; S657-L661 VanDerWaalsContact O-N 3.14Å
658	I	90.1	Very high	90	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-66.3	-43.5	172.9	-54.1	173.3	0	0	0	109.8	I556 I560 F593 F594 T655 N656 D660 L661 I662	I556-I658 HydrophobicContact CG2-CD1 3.75Å; I556-I658 HydrophobicContact CG2-CG1 4.01Å; I560-I658 HydrophobicContact CD1-CG1 4.05Å; I560-I658 HydrophobicContact CG1-CG1 4.26Å; F593-I658 HydrophobicContact CD1-CD1 3.73Å; F593-I658 HydrophobicContact CE1-CD1 3.67Å; F594-I658 HydrophobicContact CB-CG2 3.97Å; F594-I658 HydrophobicContact CD2-CB 4.33Å; F594-I658 HydrophobicContact CD2-CG2 4.39Å; T655-I658 WeakPolarHBondContact O-CB 3.32Å; T655-I658 PolarHBondContact O-N 3.35Å; T655-I658 VanDerWaalsContact O-N 3.1Å; N656-I658 VanDerWaalsContact C-N 3.32Å; N656-I658 PolarHBondContact O-N 2.96Å; I658-D660 VanDerWaalsContact C-N 3.33Å; I658-D660 PolarHBondContact O-N 3.4Å; I658-L661 WeakPolarHBondContact O-CB 3.34Å; I658-L661 PolarHBondContact O-N 2.97Å; I658-I662 HydrophobicContact CG2-CD1 4.01Å; I658-I662 HydrophobicContact CG2-CG1 4.43Å; I658-I662 WeakPolarHBondContact O-CG1 3.34Å; I658-I662 PolarHBondContact O-N 3.46Å
659	M	90.9	Very high	89.6	Confident	4 Å²	4	43.2 Å²	43.2	2%	0.02	22%	0.216	C	C	.	.	H	α-helix	trans	-56.5	-47.1	176.7	-170.6	-172.2	-72.1	0	0	111.1	F594 T655 N656 L661 I662 I663 F726 T729 L730 K733	F594-M659 HydrophobicContact CE2-CB 4.12Å; F594-M659 HydrophobicContact CE2-CE 3.96Å; F594-M659 HydrophobicContact CZ-CE 3.52Å; T655-M659 PolarHBondContact O-N 3.31Å; N656-M659 VanDerWaalsContact O-CB 3.31Å; N656-M659 WeakPolarHBondContact O-CB 3.47Å; N656-M659 PolarHBondContact O-N 3.4Å; N656-M659 VanDerWaalsContact O-N 3.17Å; M659-L661 VanDerWaalsContact C-N 3.35Å; M659-L661 PolarHBondContact O-N 2.81Å; M659-I662 PolarHBondContact O-N 3.44Å; M659-I663 HydrophobicContact CG-CD1 4.1Å; M659-I663 VanDerWaalsContact O-CG1 3.3Å; M659-I663 WeakPolarHBondContact O-CG1 3.27Å; M659-I663 PolarHBondContact O-N 3.4Å; M659-F726 HydrophobicContact CE-CD1 4.47Å; M659-T729 HydrophobicContact SD-CG2 4.44Å; M659-L730 HydrophobicContact CG-CB 4.17Å; M659-L730 HydrophobicContact CG-CD1 3.59Å; M659-L730 HydrophobicContact CG-CG 4.43Å; M659-L730 HydrophobicContact SD-CB 4.49Å; M659-K733 HydrophobicContact SD-CD 4.18Å
660	D	90.9	Very high	89.4	Confident	76 Å²	76	38.1 Å²	38.1	41%	0.406	19%	0.192	S	C	.	.	H	α-helix	trans	-62.6	-39.1	178	-68.4	-23.5	0	0	0	112.3	N656 I658 I663 Q664	N656-D660 PolarHBondContact O-N 2.86Å; I658-D660 VanDerWaalsContact C-N 3.33Å; I658-D660 PolarHBondContact O-N 3.4Å; D660-I663 PolarHBondContact O-N 2.91Å; D660-Q664 VanDerWaalsContact O-CG 3.29Å; D660-Q664 WeakPolarHBondContact O-CG 3.34Å; D660-Q664 PolarHBondContact O-N 2.75Å
661	L	89.2	Confident	89.2	Confident	3 Å²	3	34.3 Å²	34.3	2%	0.016	18%	0.181	C	C	.	.	H	α-helix	trans	-64.8	-39.2	173.9	-74.9	-179.1	0	0	0	113	I560 I563 Q564 S657 I658 M659 Q664 K665	I560-L661 HydrophobicContact CB-CD1 4.14Å; I560-L661 HydrophobicContact CG1-CD1 3.99Å; I560-L661 HydrophobicContact CG2-CD1 3.91Å; I563-L661 HydrophobicContact CG2-CD1 4.41Å; Q564-L661 HydrophobicContact CG-CD2 3.79Å; S657-L661 WeakPolarHBondContact O-CG 3.47Å; S657-L661 PolarHBondContact O-N 3.21Å; S657-L661 VanDerWaalsContact O-N 3.14Å; I658-L661 WeakPolarHBondContact O-CB 3.34Å; I658-L661 PolarHBondContact O-N 2.97Å; M659-L661 VanDerWaalsContact C-N 3.35Å; M659-L661 PolarHBondContact O-N 2.81Å; L661-Q664 PolarHBondContact O-N 3.34Å; L661-K665 WeakPolarHBondContact O-CG 3.49Å; L661-K665 PolarHBondContact O-N 2.92Å
662	I	90.2	Very high	88.9	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.7	-46.5	175.7	-65.2	163.5	0	0	0	109.4	P587 L590 I591 F594 I658 M659 Q664 K665 I666 L730	P587-I662 HydrophobicContact CG-CG2 4.26Å; L590-I662 HydrophobicContact CB-CD1 4.35Å; L590-I662 HydrophobicContact CB-CG1 3.87Å; I591-I662 HydrophobicContact CD1-CG2 4.47Å; I591-I662 HydrophobicContact CG1-CD1 4.04Å; I591-I662 HydrophobicContact CG1-CG1 4.39Å; I591-I662 HydrophobicContact CG1-CG2 3.98Å; F594-I662 HydrophobicContact CB-CD1 3.96Å; F594-I662 HydrophobicContact CG-CD1 4.34Å; I658-I662 HydrophobicContact CG2-CD1 4.01Å; I658-I662 HydrophobicContact CG2-CG1 4.43Å; I658-I662 WeakPolarHBondContact O-CG1 3.34Å; I658-I662 PolarHBondContact O-N 3.46Å; M659-I662 PolarHBondContact O-N 3.44Å; I662-Q664 VanDerWaalsContact C-N 3.34Å; I662-Q664 PolarHBondContact O-N 3.23Å; I662-K665 PolarHBondContact O-N 2.88Å; I662-I666 HydrophobicContact CG2-CD1 3.74Å; I662-I666 HydrophobicContact CG2-CG1 4.32Å; I662-I666 WeakPolarHBondContact O-CG1 3.45Å; I662-I666 PolarHBondContact O-N 2.89Å; I662-L730 HydrophobicContact CB-CD1 4.09Å; I662-L730 HydrophobicContact CD1-CD2 4.3Å; I662-L730 HydrophobicContact CG2-CD1 3.9Å; I662-L730 HydrophobicContact CG2-CD2 4.18Å
663	I	91.1	Very high	88.7	Confident	16 Å²	16	37 Å²	37	8%	0.082	20%	0.197	C	C	.	.	H	α-helix	trans	-56.6	-48.8	176.6	-66.7	161.3	0	0	0	110.2	M659 D660 K665 I666 Q667 L730 K733	M659-I663 HydrophobicContact CG-CD1 4.1Å; M659-I663 VanDerWaalsContact O-CG1 3.3Å; M659-I663 WeakPolarHBondContact O-CG1 3.27Å; M659-I663 PolarHBondContact O-N 3.4Å; D660-I663 PolarHBondContact O-N 2.91Å; I663-K665 PolarHBondContact O-N 3.49Å; I663-I666 PolarHBondContact O-N 3.49Å; I663-Q667 WeakPolarHBondContact O-CB 3.31Å; I663-Q667 PolarHBondContact O-N 3.11Å; I663-L730 HydrophobicContact CD1-CD1 4.32Å; I663-L730 HydrophobicContact CG1-CD1 3.76Å; I663-K733 HydrophobicContact CD1-CB 3.67Å; I663-K733 HydrophobicContact CD1-CD 3.73Å; I663-K733 HydrophobicContact CD1-CG 4.37Å; I663-K733 HydrophobicContact CG1-CB 4.33Å
664	Q	89.7	Confident	88.5	Confident	84 Å²	84	32.7 Å²	32.7	39%	0.393	17%	0.171	S	C	.	.	H	α-helix	trans	-59.7	-43.8	178.9	-74.1	173.1	11	0	0	112.7	D660 L661 I662 Q667 Q668	D660-Q664 VanDerWaalsContact O-CG 3.29Å; D660-Q664 WeakPolarHBondContact O-CG 3.34Å; D660-Q664 PolarHBondContact O-N 2.75Å; L661-Q664 PolarHBondContact O-N 3.34Å; I662-Q664 VanDerWaalsContact C-N 3.34Å; I662-Q664 PolarHBondContact O-N 3.23Å; Q664-Q667 PolarHBondContact O-N 3.11Å; Q664-Q668 WeakPolarHBondContact O-CB 3.33Å; Q664-Q668 VanDerWaalsContact O-CG 3.27Å; Q664-Q668 WeakPolarHBondContact O-CG 3.14Å; Q664-Q668 PolarHBondContact O-N 3.27Å
665	K	87.1	Confident	88.6	Confident	51 Å²	51	38.6 Å²	38.6	22%	0.222	19%	0.191	C	C	.	.	H	α-helix	trans	-67.4	-41.3	179	-76.1	-174	178.4	-171.1	0	112.4	P587 L590 L661 I662 I663 Q668 N669	P587-K665 HydrophobicContact CB-CB 4.17Å; P587-K665 HydrophobicContact CB-CD 3.91Å; P587-K665 HydrophobicContact CG-CB 4.17Å; L590-K665 HydrophobicContact CD1-CD 3.75Å; L590-K665 VanDerWaalsContact CD1-NZ 3.3Å; L661-K665 WeakPolarHBondContact O-CG 3.49Å; L661-K665 PolarHBondContact O-N 2.92Å; I662-K665 PolarHBondContact O-N 2.88Å; I663-K665 PolarHBondContact O-N 3.49Å; K665-Q668 PolarHBondContact O-N 3.47Å; K665-N669 VanDerWaalsContact O-CG 3.31Å; K665-N669 PolarHBondContact O-N 2.94Å; K665-N669 VanDerWaalsContact O-N 3.07Å
666	I	88.8	Confident	88.6	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-67	-43.9	176.6	-65.9	179.3	0	0	0	110.1	P587 I662 I663 Q668 N669 C670 L706 L709	P587-I666 HydrophobicContact CG-CD1 4.28Å; P587-I666 HydrophobicContact CG-CG1 3.79Å; I662-I666 HydrophobicContact CG2-CD1 3.74Å; I662-I666 HydrophobicContact CG2-CG1 4.32Å; I662-I666 WeakPolarHBondContact O-CG1 3.45Å; I662-I666 PolarHBondContact O-N 2.89Å; I663-I666 PolarHBondContact O-N 3.49Å; I666-Q668 PolarHBondContact O-N 3.42Å; I666-N669 PolarHBondContact O-N 3.02Å; I666-C670 WeakPolarHBondContact O-CB 3.27Å; I666-C670 PolarHBondContact O-N 2.73Å; I666-C670 PolarHBondContact O-SG 3.47Å; I666-C670 VanDerWaalsContact O-SG 3.38Å; I666-L706 HydrophobicContact CG2-CD2 4.04Å; I666-L709 HydrophobicContact CD1-CB 4.35Å; I666-L709 HydrophobicContact CD1-CD1 3.98Å; I666-L709 HydrophobicContact CD1-CD2 3.72Å; I666-L709 HydrophobicContact CD1-CG 4.22Å
667	Q	90.1	Very high	88.4	Confident	53 Å²	53	39 Å²	39	25%	0.248	19%	0.191	C	C	.	.	H	α-helix	trans	-56.7	-47.6	174.6	-175.3	-174.2	4.8	0	0	111.3	I663 Q664 N669 C670 L671 T737 D741	I663-Q667 WeakPolarHBondContact O-CB 3.31Å; I663-Q667 PolarHBondContact O-N 3.11Å; Q664-Q667 PolarHBondContact O-N 3.11Å; Q667-N669 PolarHBondContact O-N 3.36Å; Q667-C670 PolarHBondContact O-N 3.09Å; Q667-L671 VanDerWaalsContact O-CB 3.26Å; Q667-L671 WeakPolarHBondContact O-CB 3.5Å; Q667-L671 PolarHBondContact O-N 3.43Å; Q667-T737 HydrophobicContact CB-CG2 4.44Å; Q667-T737 HydrophobicContact CG-CG2 3.92Å; Q667-D741 VanDerWaalsContact CG-OD2 3.24Å; Q667-D741 WeakPolarHBondContact CG-OD2 3.32Å; Q667-D741 PolarHBondContact NE2-OD2 3.39Å
668	Q	87.7	Confident	88.2	Confident	98 Å²	98	40.3 Å²	40.3	46%	0.458	19%	0.193	S	C	.	.	H	α-helix	trans	-60.1	-43.9	177.1	-76.4	175.1	-1.1	0	0	112.5	Q664 K665 I666 L671 N672	Q664-Q668 WeakPolarHBondContact O-CB 3.33Å; Q664-Q668 VanDerWaalsContact O-CG 3.27Å; Q664-Q668 WeakPolarHBondContact O-CG 3.14Å; Q664-Q668 PolarHBondContact O-N 3.27Å; K665-Q668 PolarHBondContact O-N 3.47Å; I666-Q668 PolarHBondContact O-N 3.42Å; Q668-L671 PolarHBondContact O-N 3.35Å; Q668-N672 PolarHBondContact O-N 3.03Å
669	N	85.7	Confident	88	Confident	32 Å²	32	43.6 Å²	43.6	17%	0.171	21%	0.211	C	C	.	.	H	α-helix	trans	-62.9	-42.7	176.8	-72.9	-6.3	0	0	0	111.8	K665 I666 Q667	K665-N669 VanDerWaalsContact O-CG 3.31Å; K665-N669 PolarHBondContact O-N 2.94Å; K665-N669 VanDerWaalsContact O-N 3.07Å; I666-N669 PolarHBondContact O-N 3.02Å; Q667-N669 PolarHBondContact O-N 3.36Å
670	C	88.2	Confident	87.7	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-69.4	-37.8	176.4	-69	0	0	0	0	111.9	I666 Q667 N672 S673 I674 I702 V738	I666-C670 WeakPolarHBondContact O-CB 3.27Å; I666-C670 PolarHBondContact O-N 2.73Å; I666-C670 PolarHBondContact O-SG 3.47Å; I666-C670 VanDerWaalsContact O-SG 3.38Å; Q667-C670 PolarHBondContact O-N 3.09Å; C670-N672 VanDerWaalsContact C-N 3.28Å; C670-N672 PolarHBondContact O-N 2.83Å; C670-S673 CarbonylContact O-C 3.37Å; C670-S673 WeakPolarHBondContact O-CA 3.38Å; C670-S673 WeakPolarHBondContact O-CB 3.41Å; C670-S673 PolarHBondContact O-N 3.03Å; C670-I674 HydrophobicContact CB-CD1 4.46Å; C670-I674 WeakPolarHBondContact O-CG1 3.21Å; C670-I674 PolarHBondContact O-N 3.34Å; C670-I702 HydrophobicContact CB-CG2 4.41Å; C670-I702 PolarHBondContact SG-O 3.12Å; C670-I702 VanDerWaalsContact SG-O 3.4Å; C670-V738 HydrophobicContact CB-CG1 3.82Å; C670-V738 HydrophobicContact CB-CG2 3.88Å
671	L	88.2	Confident	87.3	Confident	44 Å²	44	40.5 Å²	40.5	23%	0.23	20%	0.195	C	C	.	.	H	α-helix	trans	-59.9	-37.6	-179.1	-170.8	70	0	0	0	112.1	Q667 Q668 S673 I674 R675	Q667-L671 VanDerWaalsContact O-CB 3.26Å; Q667-L671 WeakPolarHBondContact O-CB 3.5Å; Q667-L671 PolarHBondContact O-N 3.43Å; Q668-L671 PolarHBondContact O-N 3.35Å; L671-S673 PolarHBondContact O-N 2.99Å; L671-I674 PolarHBondContact O-N 3.47Å; L671-R675 WeakPolarHBondContact O-CG 3.49Å; L671-R675 PolarHBondContact O-N 3.16Å
672	N	83.4	Confident	87	Confident	75 Å²	75	49.9 Å²	49.9	40%	0.401	23%	0.23	S	C	.	.	H	α-helix	trans	-59.3	-34.9	173.9	-71.6	-19	0	0	0	112.2	Q668 C670	Q668-N672 PolarHBondContact O-N 3.03Å; C670-N672 VanDerWaalsContact C-N 3.28Å; C670-N672 PolarHBondContact O-N 2.83Å
673	S	86.7	Confident	86.7	Confident	17 Å²	17	52.9 Å²	52.9	12%	0.119	24%	0.244	C	C	.	.	H	α-helix	trans	-81.3	-37.7	175.1	-59.9	0	0	0	0	112.3	C670 L671 R675 Q676 N701	C670-S673 CarbonylContact O-C 3.37Å; C670-S673 WeakPolarHBondContact O-CA 3.38Å; C670-S673 WeakPolarHBondContact O-CB 3.41Å; C670-S673 PolarHBondContact O-N 3.03Å; L671-S673 PolarHBondContact O-N 2.99Å; S673-R675 VanDerWaalsContact C-N 3.31Å; S673-R675 PolarHBondContact O-N 3.33Å; S673-Q676 WeakPolarHBondContact O-CB 3.35Å; S673-Q676 WeakPolarHBondContact O-CG 3.4Å; S673-Q676 PolarHBondContact O-N 3.5Å; S673-N701 WeakPolarHBondContact OG-CB 3.12Å
674	I	88.3	Confident	86.3	Confident	0 Å²	0	53 Å²	53	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.2	-38.6	176	-69.4	167.5	0	0	0	111.4	C670 L671 Q676 V677 I702 V738 D741 Y742 Q745	C670-I674 HydrophobicContact CB-CD1 4.46Å; C670-I674 WeakPolarHBondContact O-CG1 3.21Å; C670-I674 PolarHBondContact O-N 3.34Å; L671-I674 PolarHBondContact O-N 3.47Å; I674-Q676 PolarHBondContact O-N 3.25Å; I674-V677 VanDerWaalsContact O-CB 3.28Å; I674-V677 WeakPolarHBondContact O-CB 3.26Å; I674-V677 WeakPolarHBondContact O-CG2 3.45Å; I674-V677 PolarHBondContact O-N 3.38Å; I674-I702 HydrophobicContact CB-CD1 4.44Å; I674-I702 HydrophobicContact CG1-CD1 3.66Å; I674-I702 HydrophobicContact CG1-CG1 3.88Å; I674-I702 HydrophobicContact CG1-CG2 4.27Å; I674-V738 HydrophobicContact CD1-CG1 4.16Å; I674-D741 HydrophobicContact CD1-CB 3.96Å; I674-Y742 HydrophobicContact CG1-CD2 4.25Å; I674-Y742 HydrophobicContact CG2-CD2 4.27Å; I674-Q745 HydrophobicContact CG2-CB 3.65Å; I674-Q745 HydrophobicContact CG2-CG 3.87Å
675	R	88	Confident	85.6	Confident	134 Å²	134	51.6 Å²	51.6	51%	0.506	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-58.8	-22	178.3	-76.8	174.8	-178.8	165.5	1.3	113.8	L671 S673 V677 L678	L671-R675 WeakPolarHBondContact O-CG 3.49Å; L671-R675 PolarHBondContact O-N 3.16Å; S673-R675 VanDerWaalsContact C-N 3.31Å; S673-R675 PolarHBondContact O-N 3.33Å; R675-V677 PolarHBondContact O-N 3.08Å; R675-L678 VanDerWaalsContact O-CB 3.27Å; R675-L678 WeakPolarHBondContact O-CB 3.37Å; R675-L678 PolarHBondContact O-N 3.48Å; R675-L678 VanDerWaalsContact O-N 3.07Å
676	Q	86.8	Confident	84.7	Confident	79 Å²	79	60.6 Å²	60.6	37%	0.369	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-65.8	-16.9	177.1	-58.4	-177.9	26.7	0	0	112.8	S673 I674 L678 D679 Y698	S673-Q676 WeakPolarHBondContact O-CB 3.35Å; S673-Q676 WeakPolarHBondContact O-CG 3.4Å; S673-Q676 PolarHBondContact O-N 3.5Å; I674-Q676 PolarHBondContact O-N 3.25Å; Q676-L678 PolarHBondContact O-N 2.96Å; Q676-D679 PolarHBondContact O-N 3.3Å; Q676-D679 VanDerWaalsContact O-N 3.13Å; Q676-Y698 HydrophobicContact CB-CD1 4.21Å; Q676-Y698 HydrophobicContact CB-CG 3.97Å; Q676-Y698 VanDerWaalsContact OE1-CB 3.24Å
677	V	86.4	Confident	84.1	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-57.7	-33.4	170.6	-179.6	0	0	0	0	111.2	I674 R675 D679 I680 Y698 Y742 Q745 L746 V749 L796	I674-V677 VanDerWaalsContact O-CB 3.28Å; I674-V677 WeakPolarHBondContact O-CB 3.26Å; I674-V677 WeakPolarHBondContact O-CG2 3.45Å; I674-V677 PolarHBondContact O-N 3.38Å; R675-V677 PolarHBondContact O-N 3.08Å; V677-D679 PolarHBondContact O-N 2.64Å; V677-I680 HydrophobicContact CB-CD1 4.44Å; V677-I680 HydrophobicContact CG1-CD1 4.06Å; V677-I680 WeakPolarHBondContact O-CB 3.47Å; V677-I680 WeakPolarHBondContact O-CG1 3.44Å; V677-I680 PolarHBondContact O-N 2.67Å; V677-Y698 HydrophobicContact CG2-CD2 4.21Å; V677-Y698 HydrophobicContact CG2-CE1 4.35Å; V677-Y698 HydrophobicContact CG2-CE2 3.41Å; V677-Y698 VanDerWaalsContact CG2-CE2 3.41Å; V677-Y742 HydrophobicContact CG2-CD2 4.17Å; V677-Y742 HydrophobicContact CG2-CE2 3.63Å; V677-Q745 HydrophobicContact CB-CG 4.21Å; V677-L746 HydrophobicContact CG1-CD2 3.91Å; V677-V749 HydrophobicContact CG1-CB 4.31Å; V677-V749 HydrophobicContact CG1-CG2 3.95Å; V677-L796 HydrophobicContact CG1-CD2 4.16Å
678	L	85.1	Confident	83.3	Confident	78 Å²	78	68.5 Å²	68.5	41%	0.408	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-63.6	-21.2	179	-67.4	172	0	0	0	113.3	R675 Q676 P681 Q745 V749	R675-L678 VanDerWaalsContact O-CB 3.27Å; R675-L678 WeakPolarHBondContact O-CB 3.37Å; R675-L678 PolarHBondContact O-N 3.48Å; R675-L678 VanDerWaalsContact O-N 3.07Å; Q676-L678 PolarHBondContact O-N 2.96Å; L678-P681 WeakPolarHBondContact O-CD 3.26Å; L678-Q745 VanDerWaalsContact CD2-NE2 3.25Å; L678-V749 HydrophobicContact CD2-CG2 3.78Å
679	D	84.6	Confident	82.7	Confident	71 Å²	71	69.9 Å²	69.9	38%	0.38	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-86	-15.2	179.8	-71.1	-41.6	0	0	0	113.1	Q676 V677 R682 Q683	Q676-D679 PolarHBondContact O-N 3.3Å; Q676-D679 VanDerWaalsContact O-N 3.13Å; V677-D679 PolarHBondContact O-N 2.64Å; D679-R682 WeakPolarHBondContact O-CB 3.24Å; D679-R682 PolarHBondContact O-N 3.45Å; D679-Q683 WeakPolarHBondContact O-CG 3.43Å; D679-Q683 PolarHBondContact O-N 3.3Å; D679-Q683 VanDerWaalsContact O-N 3.09Å
680	I	84.9	Confident	82.3	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-55.4	-45.9	-178.6	-60.2	170.5	0	0	0	112	V677 R682 Q683 Y684 Y698 I792 Q795 L796 D799	V677-I680 HydrophobicContact CB-CD1 4.44Å; V677-I680 HydrophobicContact CG1-CD1 4.06Å; V677-I680 WeakPolarHBondContact O-CB 3.47Å; V677-I680 WeakPolarHBondContact O-CG1 3.44Å; V677-I680 PolarHBondContact O-N 2.67Å; I680-R682 VanDerWaalsContact C-N 3.27Å; I680-R682 PolarHBondContact O-N 2.98Å; I680-Q683 WeakPolarHBondContact O-CB 3.42Å; I680-Q683 PolarHBondContact O-N 3.35Å; I680-Q683 VanDerWaalsContact O-N 3.08Å; I680-Y684 HydrophobicContact CG2-CD2 4.05Å; I680-Y684 HydrophobicContact CG2-CE2 4.23Å; I680-Y684 PolarHBondContact O-N 3.22Å; I680-Y698 HydrophobicContact CD1-CE1 3.88Å; I680-Y698 HydrophobicContact CG1-CE1 4.35Å; I680-I792 HydrophobicContact CG2-CG2 4.23Å; I680-Q795 HydrophobicContact CG2-CB 4.15Å; I680-Q795 HydrophobicContact CG2-CG 4.05Å; I680-L796 HydrophobicContact CD1-CD2 3.59Å; I680-D799 WeakPolarHBondContact CD1-OD2 3.28Å
681	P	83.8	Confident	81.8	Confident	14 Å²	14	80.2 Å²	80.2	9%	0.091	36%	0.361	C	S	.	.	H	α-helix	trans	-58.7	-37.5	176.2	-25.2	35.5	0	0	0	113.2	L678 Q683 R685 V749 V753 I792	L678-P681 WeakPolarHBondContact O-CD 3.26Å; P681-Q683 VanDerWaalsContact C-N 3.29Å; P681-Q683 PolarHBondContact O-N 2.72Å; P681-R685 WeakPolarHBondContact O-CB 3.44Å; P681-R685 VanDerWaalsContact O-CG 3.3Å; P681-R685 WeakPolarHBondContact O-CG 3.23Å; P681-R685 PolarHBondContact O-N 3.26Å; P681-V749 HydrophobicContact CG-CG1 3.7Å; P681-V753 HydrophobicContact CG-CG2 4.26Å; P681-I792 HydrophobicContact CB-CD1 4.45Å
682	R	82.9	Confident	81.4	Confident	200 Å²	200	78.5 Å²	78.5	76%	0.755	35%	0.352	S	S	*	.	H	α-helix	trans	-68.7	-29.6	177.9	-67	179.6	172	-171.2	-1.9	112.1	D679 I680	D679-R682 WeakPolarHBondContact O-CB 3.24Å; D679-R682 PolarHBondContact O-N 3.45Å; I680-R682 VanDerWaalsContact C-N 3.27Å; I680-R682 PolarHBondContact O-N 2.98Å
683	Q	82.4	Confident	81.4	Confident	63 Å²	63	79.3 Å²	79.3	29%	0.294	36%	0.364	S	S	.	.	H	α-helix	trans	-72.7	-30.9	-179.4	-68.5	180	29.2	0	0	113.5	D679 I680 P681 T687 R689	D679-Q683 WeakPolarHBondContact O-CG 3.43Å; D679-Q683 PolarHBondContact O-N 3.3Å; D679-Q683 VanDerWaalsContact O-N 3.09Å; I680-Q683 WeakPolarHBondContact O-CB 3.42Å; I680-Q683 PolarHBondContact O-N 3.35Å; I680-Q683 VanDerWaalsContact O-N 3.08Å; P681-Q683 VanDerWaalsContact C-N 3.29Å; P681-Q683 PolarHBondContact O-N 2.72Å; Q683-T687 WeakPolarHBondContact O-CB 3.34Å; Q683-T687 VanDerWaalsContact O-CG2 3.22Å; Q683-T687 WeakPolarHBondContact O-CG2 3.13Å; Q683-T687 PolarHBondContact O-OG1 3.29Å; Q683-R689 WeakPolarHBondContact O-CD 3.29Å
684	Y	82.6	Confident	81.3	Confident	19 Å²	19	84.4 Å²	84.4	8%	0.075	39%	0.39	C	S	.	.	H	α-helix	trans	-111.8	-24.6	-175.1	-69.1	-75	0	0	0	114.6	I680 W686 T687 R689 P692 K791 I792 Q795	I680-Y684 HydrophobicContact CG2-CD2 4.05Å; I680-Y684 HydrophobicContact CG2-CE2 4.23Å; I680-Y684 PolarHBondContact O-N 3.22Å; Y684-W686 PolarHBondContact O-N 2.89Å; Y684-T687 WeakPolarHBondContact CA-OG1 3.22Å; Y684-T687 PolarHBondContact O-N 3.38Å; Y684-T687 PolarHBondContact O-OG1 3.47Å; Y684-R689 HydrophobicContact CD1-CB 4.33Å; Y684-R689 HydrophobicContact CE1-CB 4.26Å; Y684-P692 HydrophobicContact CE1-CB 4.44Å; Y684-P692 HydrophobicContact CE1-CG 4.41Å; Y684-K791 HydrophobicContact CD1-CB 3.91Å; Y684-K791 HydrophobicContact CD1-CD 4.26Å; Y684-K791 HydrophobicContact CG-CB 4.24Å; Y684-I792 HydrophobicContact CD2-CG1 4.41Å; Y684-I792 HydrophobicContact CG-CG1 4.36Å; Y684-Q795 HydrophobicContact CE2-CB 3.86Å; Y684-Q795 HydrophobicContact CE2-CG 3.88Å; Y684-Q795 PolarHBondContact OH-OE1 2.99Å
685	R	76.5	Confident	81.1	Confident	54 Å²	54	86.3 Å²	86.3	20%	0.204	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	121.4	176.2	-78.1	-171.5	174.4	149.3	3.7	110.4	P681 T687 M756 I792	P681-R685 WeakPolarHBondContact O-CB 3.44Å; P681-R685 VanDerWaalsContact O-CG 3.3Å; P681-R685 WeakPolarHBondContact O-CG 3.23Å; P681-R685 PolarHBondContact O-N 3.26Å; R685-T687 PolarHBondContact O-N 2.81Å; R685-M756 VanDerWaalsContact NH2-CB 3.26Å; R685-I792 HydrophobicContact CG-CD1 3.78Å
686	W	67.6	Low	81.1	Confident	241 Å²	241	80.9 Å²	80.9	91%	0.913	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	28.3	178	-47.4	-50.8	0	0	0	114.3	Y684	Y684-W686 PolarHBondContact O-N 2.89Å
687	T	77.3	Confident	81.1	Confident	45 Å²	45	84 Å²	84	28%	0.276	41%	0.406	S	S	.	.			trans	-111.1	147	173.7	72.5	0	0	0	0	111	Q683 Y684 R685 R689	Q683-T687 WeakPolarHBondContact O-CB 3.34Å; Q683-T687 VanDerWaalsContact O-CG2 3.22Å; Q683-T687 WeakPolarHBondContact O-CG2 3.13Å; Q683-T687 PolarHBondContact O-OG1 3.29Å; Y684-T687 WeakPolarHBondContact CA-OG1 3.22Å; Y684-T687 PolarHBondContact O-N 3.38Å; Y684-T687 PolarHBondContact O-OG1 3.47Å; R685-T687 PolarHBondContact O-N 2.81Å; T687-R689 PolarHBondContact O-N 2.88Å
688	N	71.8	Confident	81.2	Confident	174 Å²	174	84.3 Å²	84.3	93%	0.93	41%	0.408	S	S	*	.			trans	-82.1	21.6	174.8	-72.2	-18.5	0	0	0	112.5
689	R	76.1	Confident	81.3	Confident	128 Å²	128	80.9 Å²	80.9	48%	0.483	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-63.4	145.4	179.1	-71.6	-169.7	-179.6	-167.8	-0.7	110.7	Q683 Y684 T687 K791	Q683-R689 WeakPolarHBondContact O-CD 3.29Å; Y684-R689 HydrophobicContact CD1-CB 4.33Å; Y684-R689 HydrophobicContact CE1-CB 4.26Å; T687-R689 PolarHBondContact O-N 2.88Å; R689-K791 PolarHBondContact O-NZ 3.43Å
690	E	76.6	Confident	81.4	Confident	176 Å²	176	80.7 Å²	80.7	82%	0.822	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-61.1	165	174.8	-64.9	-175.3	170.5	0	0	111.4
691	F	77.6	Confident	81.5	Confident	72 Å²	72	84.2 Å²	84.2	32%	0.316	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-65.4	131.5	174.9	-163.9	-100.3	0	0	0	109	S693 F786 K791 H794	F691-S693 PolarHBondContact O-N 2.79Å; F691-F786 HydrophobicContact CD2-CB 4.12Å; F691-F786 HydrophobicContact CD2-CD1 4.39Å; F691-F786 HydrophobicContact CD2-CD2 4.22Å; F691-F786 AromaticContact CD2-CG 3.99Å; F691-F786 HydrophobicContact CD2-CG 3.99Å; F691-F786 HydrophobicContact CE2-CB 4.1Å; F691-F786 AromaticContact CE2-CD1 3.71Å; F691-F786 HydrophobicContact CE2-CD1 3.71Å; F691-F786 HydrophobicContact CE2-CD2 4.3Å; F691-F786 HydrophobicContact CE2-CE1 4.17Å; F691-F786 AromaticContact CE2-CG 3.78Å; F691-F786 HydrophobicContact CE2-CG 3.78Å; F691-F786 HydrophobicContact CZ-CD1 4.29Å; F691-F786 HydrophobicContact CZ-CE1 4.31Å; F691-K791 HydrophobicContact CD2-CG 3.77Å; F691-K791 HydrophobicContact CE2-CG 4.19Å; F691-H794 AromaticContact CD1-CD2 3.63Å; F691-H794 HydrophobicContact CE1-CB 4.26Å; F691-H794 AromaticContact CE1-CD2 2.97Å; F691-H794 WeakPolarHBondContact CE1-CD2 3.39Å; F691-H794 AromaticContact CE1-CG 3.74Å; F691-H794 AromaticContact CE1-NE2 3.54Å; F691-H794 HydrophobicContact CE2-CB 4.47Å; F691-H794 HydrophobicContact CZ-CB 3.83Å; F691-H794 AromaticContact CZ-CD2 3.48Å; F691-H794 VanDerWaalsContact CZ-CD2 3.48Å; F691-H794 WeakPolarHBondContact CZ-CD2 3.43Å; F691-H794 AromaticContact CZ-CG 3.78Å
692	P	80.7	Confident	81.8	Confident	8 Å²	8	83.5 Å²	83.5	5%	0.052	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-64.6	136.6	-172	22.6	-30.2	0	0	0	112.1	Y684 K791 H794 Q795 L798	Y684-P692 HydrophobicContact CE1-CB 4.44Å; Y684-P692 HydrophobicContact CE1-CG 4.41Å; P692-K791 WeakPolarHBondContact CG-O 3.3Å; P692-H794 HydrophobicContact CG-CB 4.14Å; P692-H794 PolarHBondContact O-CD2 3.45Å; P692-H794 PolarHBondContact O-NE2 2.81Å; P692-Q795 HydrophobicContact CB-CB 4.3Å; P692-Q795 HydrophobicContact CG-CB 4.12Å; P692-L798 HydrophobicContact CB-CD1 4.19Å
693	S	82.4	Confident	82	Confident	93 Å²	93	74.1 Å²	74.1	65%	0.65	37%	0.373	S	S	*	.			trans	-118.4	-23.7	-179.3	55.5	0	0	0	0	113.9	F691	F691-S693 PolarHBondContact O-N 2.79Å
694	N	85	Confident	82.3	Confident	124 Å²	124	77 Å²	77	66%	0.663	39%	0.386	S	S	*	.	S	Bend	trans	-123.8	153.8	-177.6	-65.1	-36.9	0	0	0	110.7	Q795	N694-Q795 PolarHBondContact O-NE2 3.44Å
695	A	84.4	Confident	82.5	Confident	40 Å²	40	76.8 Å²	76.8	33%	0.331	39%	0.388	S	S	.	.			trans	-64.5	151.9	170.4	0	0	0	0	0	111.5	D799 A802	A695-D799 WeakPolarHBondContact CA-OD1 3.28Å; A695-A802 HydrophobicContact CB-CB 3.46Å; A695-A802 VanDerWaalsContact CB-CB 3.46Å
696	S	87.9	Confident	83	Confident	19 Å²	19	74.4 Å²	74.4	13%	0.133	38%	0.379	C	S	.	.			trans	-68.1	144.4	178.4	-59.5	0	0	0	0	111.5	Y698 V699 Q795 D799	S696-Y698 PolarHBondContact O-N 2.91Å; S696-Y698 VanDerWaalsContact O-N 3.12Å; S696-V699 WeakPolarHBondContact O-CB 3.31Å; S696-V699 PolarHBondContact O-N 3.03Å; S696-V699 VanDerWaalsContact O-N 3.08Å; S696-Q795 PolarHBondContact OG-NE2 2.81Å; S696-D799 WeakPolarHBondContact CB-OD1 3.24Å; S696-D799 WeakPolarHBondContact CB-OD2 3.33Å; S696-D799 PolarHBondContact N-OD1 3.29Å; S696-D799 PolarHBondContact OG-OD1 3.1Å; S696-D799 VanDerWaalsContact OG-OD1 3.09Å; S696-D799 PolarHBondContact OG-OD2 3.49Å
697	L	86.4	Confident	83.9	Confident	144 Å²	144	66.7 Å²	66.7	75%	0.754	35%	0.354	S	S	*	.	H	α-helix	trans	-58	-29.4	-178.8	-67.6	170.3	0	0	0	113.6	V699 S700 N701	L697-V699 PolarHBondContact O-N 3.37Å; L697-S700 PolarHBondContact O-N 3.42Å; L697-S700 VanDerWaalsContact O-N 3.14Å; L697-S700 PolarHBondContact O-OG 3.15Å; L697-N701 PolarHBondContact O-N 3.34Å
698	Y	88.7	Confident	84.4	Confident	8 Å²	8	67.7 Å²	67.7	3%	0.031	35%	0.354	C	S	.	.	H	α-helix	trans	-62.4	-27.3	179.9	78.2	-100.3	0	0	0	112.2	Q676 V677 I680 S696 S700 N701 I702 Y742 D799	Q676-Y698 HydrophobicContact CB-CD1 4.21Å; Q676-Y698 HydrophobicContact CB-CG 3.97Å; Q676-Y698 VanDerWaalsContact OE1-CB 3.24Å; V677-Y698 HydrophobicContact CG2-CD2 4.21Å; V677-Y698 HydrophobicContact CG2-CE1 4.35Å; V677-Y698 HydrophobicContact CG2-CE2 3.41Å; V677-Y698 VanDerWaalsContact CG2-CE2 3.41Å; I680-Y698 HydrophobicContact CD1-CE1 3.88Å; I680-Y698 HydrophobicContact CG1-CE1 4.35Å; S696-Y698 PolarHBondContact O-N 2.91Å; S696-Y698 VanDerWaalsContact O-N 3.12Å; Y698-S700 VanDerWaalsContact C-N 3.31Å; Y698-S700 PolarHBondContact O-N 3.43Å; Y698-N701 CarbonylContact O-C 3.59Å; Y698-N701 WeakPolarHBondContact O-CA 3.34Å; Y698-N701 WeakPolarHBondContact O-CB 3.31Å; Y698-N701 PolarHBondContact O-N 3.47Å; Y698-I702 HydrophobicContact CD2-CD1 3.58Å; Y698-I702 HydrophobicContact CD2-CG1 4.31Å; Y698-I702 HydrophobicContact CE2-CD1 3.79Å; Y698-I702 WeakPolarHBondContact O-CG1 3.5Å; Y698-I702 PolarHBondContact O-N 2.92Å; Y698-Y742 AromaticContact CE2-CE2 3.81Å; Y698-Y742 HydrophobicContact CE2-CE2 3.81Å; Y698-Y742 PolarHBondContact OH-OH 3.46Å; Y698-D799 VanDerWaalsContact CE1-OD2 3.28Å; Y698-D799 WeakPolarHBondContact CE1-OD2 3.43Å; Y698-D799 VanDerWaalsContact OH-CB 3.23Å; Y698-D799 WeakPolarHBondContact OH-CB 3.49Å; Y698-D799 VanDerWaalsContact OH-CG 3.25Å; Y698-D799 PolarHBondContact OH-OD2 3.25Å
699	V	87.5	Confident	85.1	Confident	6 Å²	6	59.5 Å²	59.5	4%	0.036	31%	0.311	C	S	.	.	H	α-helix	trans	-60.1	-44.4	176.3	179.4	0	0	0	0	110	S696 L697 N701 I702 I703 D799 A802 Y803	S696-V699 WeakPolarHBondContact O-CB 3.31Å; S696-V699 PolarHBondContact O-N 3.03Å; S696-V699 VanDerWaalsContact O-N 3.08Å; L697-V699 PolarHBondContact O-N 3.37Å; V699-N701 VanDerWaalsContact C-N 3.28Å; V699-N701 PolarHBondContact O-N 3.38Å; V699-I702 PolarHBondContact O-N 2.83Å; V699-I703 VanDerWaalsContact O-CG1 3.3Å; V699-I703 WeakPolarHBondContact O-CG1 3.47Å; V699-I703 PolarHBondContact O-N 3.49Å; V699-I703 VanDerWaalsContact O-N 3.12Å; V699-D799 HydrophobicContact CG2-CB 3.81Å; V699-A802 HydrophobicContact CG1-CB 4.32Å; V699-Y803 HydrophobicContact CG1-CD2 4.45Å
700	S	87.3	Confident	85.6	Confident	67 Å²	67	55 Å²	55	47%	0.469	30%	0.296	S	S	.	.	H	α-helix	trans	-63.3	-33.9	175	70.7	0	0	0	0	112.7	L697 Y698 I703 H704	L697-S700 PolarHBondContact O-N 3.42Å; L697-S700 VanDerWaalsContact O-N 3.14Å; L697-S700 PolarHBondContact O-OG 3.15Å; Y698-S700 VanDerWaalsContact C-N 3.31Å; Y698-S700 PolarHBondContact O-N 3.43Å; S700-I703 PolarHBondContact O-N 2.94Å; S700-H704 WeakPolarHBondContact O-CB 3.4Å; S700-H704 PolarHBondContact O-N 2.96Å
701	N	87.1	Confident	86	Confident	73 Å²	73	49.8 Å²	49.8	39%	0.39	28%	0.279	S	S	.	.	H	α-helix	trans	-72.6	-31.8	177.1	-63.7	-23.5	0	0	0	112.8	S673 L697 Y698 V699 P705	S673-N701 WeakPolarHBondContact OG-CB 3.12Å; L697-N701 PolarHBondContact O-N 3.34Å; Y698-N701 CarbonylContact O-C 3.59Å; Y698-N701 WeakPolarHBondContact O-CA 3.34Å; Y698-N701 WeakPolarHBondContact O-CB 3.31Å; Y698-N701 PolarHBondContact O-N 3.47Å; V699-N701 VanDerWaalsContact C-N 3.28Å; V699-N701 PolarHBondContact O-N 3.38Å; N701-P705 WeakPolarHBondContact O-CD 3.39Å
702	I	88.5	Confident	86.5	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.8	-42.2	172.3	-62.1	166.8	0	0	0	110.1	C670 I674 Y698 V699 P705 V738 Y742 Y803	C670-I702 HydrophobicContact CB-CG2 4.41Å; C670-I702 PolarHBondContact SG-O 3.12Å; C670-I702 VanDerWaalsContact SG-O 3.4Å; I674-I702 HydrophobicContact CB-CD1 4.44Å; I674-I702 HydrophobicContact CG1-CD1 3.66Å; I674-I702 HydrophobicContact CG1-CG1 3.88Å; I674-I702 HydrophobicContact CG1-CG2 4.27Å; Y698-I702 HydrophobicContact CD2-CD1 3.58Å; Y698-I702 HydrophobicContact CD2-CG1 4.31Å; Y698-I702 HydrophobicContact CE2-CD1 3.79Å; Y698-I702 WeakPolarHBondContact O-CG1 3.5Å; Y698-I702 PolarHBondContact O-N 2.92Å; V699-I702 PolarHBondContact O-N 2.83Å; I702-P705 WeakPolarHBondContact O-CD 3.45Å; I702-V738 HydrophobicContact CG2-CG1 3.73Å; I702-Y742 HydrophobicContact CD1-CD2 3.93Å; I702-Y742 HydrophobicContact CD1-CE2 3.98Å; I702-Y803 HydrophobicContact CG2-CD2 4.39Å; I702-Y803 HydrophobicContact CG2-CE2 3.72Å
703	I	87.7	Confident	86.6	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.015	27%	0.268	C	S	.	.	H	α-helix	trans	-75.1	-33.4	-175.7	-66.8	-65.6	0	0	0	112.4	V699 S700 L706 M707 Y803 E806 V807 F810	V699-I703 VanDerWaalsContact O-CG1 3.3Å; V699-I703 WeakPolarHBondContact O-CG1 3.47Å; V699-I703 PolarHBondContact O-N 3.49Å; V699-I703 VanDerWaalsContact O-N 3.12Å; S700-I703 PolarHBondContact O-N 2.94Å; I703-L706 CarbonylContact O-C 3.56Å; I703-L706 WeakPolarHBondContact O-CA 3.41Å; I703-L706 WeakPolarHBondContact O-CB 3.43Å; I703-L706 PolarHBondContact O-N 3.3Å; I703-M707 HydrophobicContact CG2-CE 3.62Å; I703-M707 HydrophobicContact CG2-CG 3.73Å; I703-M707 HydrophobicContact CG2-SD 3.9Å; I703-M707 PolarHBondContact O-N 3.49Å; I703-Y803 HydrophobicContact CD1-CD2 3.71Å; I703-Y803 HydrophobicContact CD1-CE2 3.67Å; I703-Y803 HydrophobicContact CG1-CD2 4.18Å; I703-Y803 HydrophobicContact CG1-CE2 4.43Å; I703-E806 HydrophobicContact CD1-CB 3.82Å; I703-E806 HydrophobicContact CG1-CB 3.89Å; I703-E806 HydrophobicContact CG1-CG 4.37Å; I703-E806 HydrophobicContact CG2-CB 4.04Å; I703-E806 HydrophobicContact CG2-CG 4.42Å; I703-V807 HydrophobicContact CD1-CG2 3.8Å; I703-F810 HydrophobicContact CD1-CE2 4.37Å; I703-F810 HydrophobicContact CG2-CE2 4.14Å; I703-F810 HydrophobicContact CG2-CZ 3.9Å
704	H	88	Confident	86.7	Confident	122 Å²	122	46.8 Å²	46.8	57%	0.565	26%	0.258	S	S	*	.	H	α-helix	trans	-56.1	-46.6	-174.1	178.7	-81	0	0	0	114.6	S700 L706 M707 K708	S700-H704 WeakPolarHBondContact O-CB 3.4Å; S700-H704 PolarHBondContact O-N 2.96Å; H704-L706 VanDerWaalsContact C-N 3.28Å; H704-L706 PolarHBondContact O-N 3.38Å; H704-M707 PolarHBondContact O-N 3.31Å; H704-K708 PolarHBondContact O-N 3.49Å
705	P	87	Confident	86.6	Confident	16 Å²	16	46.8 Å²	46.8	10%	0.104	25%	0.254	C	S	.	.	H	α-helix	trans	-58.7	-36.9	172.2	-24.7	34.1	0	0	0	113.6	F586 N701 I702 K708 L709	F586-P705 WeakPolarHBondContact CE2-O 3.14Å; N701-P705 WeakPolarHBondContact O-CD 3.39Å; I702-P705 WeakPolarHBondContact O-CD 3.45Å; P705-K708 PolarHBondContact O-N 2.9Å; P705-L709 PolarHBondContact O-N 2.92Å
706	L	87.8	Confident	86.6	Confident	4 Å²	4	45 Å²	45	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-70	-40.6	177.3	-60.6	174.3	0	0	0	111.2	I666 I703 H704 K708 L709 D710 C734 I735 V738 F810	I666-L706 HydrophobicContact CG2-CD2 4.04Å; I703-L706 CarbonylContact O-C 3.56Å; I703-L706 WeakPolarHBondContact O-CA 3.41Å; I703-L706 WeakPolarHBondContact O-CB 3.43Å; I703-L706 PolarHBondContact O-N 3.3Å; H704-L706 VanDerWaalsContact C-N 3.28Å; H704-L706 PolarHBondContact O-N 3.38Å; L706-K708 VanDerWaalsContact C-N 3.32Å; L706-K708 PolarHBondContact O-N 3.36Å; L706-L709 PolarHBondContact O-N 3.13Å; L706-D710 WeakPolarHBondContact O-CB 3.36Å; L706-D710 PolarHBondContact O-N 3.03Å; L706-C734 HydrophobicContact CD2-CB 4.13Å; L706-I735 HydrophobicContact CD1-CG1 4.34Å; L706-I735 HydrophobicContact CD2-CG1 4.29Å; L706-V738 HydrophobicContact CD1-CB 4.49Å; L706-V738 HydrophobicContact CD1-CG1 4.21Å; L706-V738 HydrophobicContact CD2-CG2 4.46Å; L706-F810 HydrophobicContact CB-CE2 4.39Å; L706-F810 HydrophobicContact CB-CZ 4.38Å
707	M	86.7	Confident	86.4	Confident	78 Å²	78	45 Å²	45	38%	0.384	24%	0.239	S	C	.	.	H	α-helix	trans	-60.7	-40.7	171.8	-71.7	-172.7	162.7	0	0	112.4	I703 H704 L709 D710 S711 E806 F810	I703-M707 HydrophobicContact CG2-CE 3.62Å; I703-M707 HydrophobicContact CG2-CG 3.73Å; I703-M707 HydrophobicContact CG2-SD 3.9Å; I703-M707 PolarHBondContact O-N 3.49Å; H704-M707 PolarHBondContact O-N 3.31Å; M707-L709 VanDerWaalsContact C-N 3.35Å; M707-D710 PolarHBondContact O-N 3.49Å; M707-S711 WeakPolarHBondContact O-CB 3.37Å; M707-S711 PolarHBondContact O-N 3.1Å; M707-S711 PolarHBondContact O-OG 3.03Å; M707-E806 VanDerWaalsContact CE-OE2 3.23Å; M707-E806 WeakPolarHBondContact CE-OE2 3.36Å; M707-F810 HydrophobicContact CB-CE1 4.19Å; M707-F810 HydrophobicContact CB-CZ 4.27Å; M707-F810 HydrophobicContact CE-CZ 4.16Å; M707-F810 HydrophobicContact CG-CE1 3.59Å; M707-F810 HydrophobicContact CG-CZ 3.35Å
708	K	87.2	Confident	86.1	Confident	66 Å²	66	45.1 Å²	45.1	29%	0.287	24%	0.236	S	C	.	.	H	α-helix	trans	-65.7	-40.4	176	-171.8	173.4	173.8	-175.2	0	110.9	F586 E588 H704 P705 L706 S711 L712	F586-K708 HydrophobicContact CB-CD 4.17Å; F586-K708 HydrophobicContact CD1-CD 3.72Å; F586-K708 VanDerWaalsContact CD1-CE 3.43Å; F586-K708 HydrophobicContact CD1-CG 4.22Å; F586-K708 HydrophobicContact CD2-CB 4.21Å; F586-K708 HydrophobicContact CD2-CD 3.84Å; F586-K708 HydrophobicContact CD2-CG 4.14Å; F586-K708 HydrophobicContact CE1-CD 4.04Å; F586-K708 HydrophobicContact CE1-CG 4.01Å; F586-K708 HydrophobicContact CE2-CB 3.86Å; F586-K708 HydrophobicContact CE2-CD 4.13Å; F586-K708 HydrophobicContact CE2-CG 3.91Å; F586-K708 HydrophobicContact CG-CD 3.63Å; F586-K708 HydrophobicContact CG-CG 4.3Å; F586-K708 HydrophobicContact CZ-CB 4.18Å; F586-K708 HydrophobicContact CZ-CD 4.23Å; F586-K708 HydrophobicContact CZ-CG 3.84Å; E588-K708 WeakPolarHBondContact OE2-CE 3.42Å; E588-K708 IonicContact OE2-NZ 3.99Å; E588-K708 PolarHBondContact OE2-NZ 2.81Å; H704-K708 PolarHBondContact O-N 3.49Å; P705-K708 PolarHBondContact O-N 2.9Å; L706-K708 VanDerWaalsContact C-N 3.32Å; L706-K708 PolarHBondContact O-N 3.36Å; K708-S711 PolarHBondContact O-OG 3.49Å; K708-S711 VanDerWaalsContact O-OG 3.07Å; K708-L712 HydrophobicContact CG-CD1 4Å; K708-L712 WeakPolarHBondContact O-CB 3.28Å; K708-L712 WeakPolarHBondContact O-CD1 3.48Å; K708-L712 VanDerWaalsContact O-CG 3.28Å; K708-L712 WeakPolarHBondContact O-CG 3.37Å; K708-L712 PolarHBondContact O-N 2.92Å; K708-L712 VanDerWaalsContact O-N 3.1Å
709	L	87.7	Confident	85.4	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.016	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-43.3	175.1	-178.7	68.8	0	0	0	111.9	F586 I591 I666 P705 L706 M707 G713 L730 I731 C734	F586-L709 HydrophobicContact CE2-CB 4.28Å; F586-L709 HydrophobicContact CZ-CB 4.19Å; F586-L709 HydrophobicContact CZ-CD1 4.45Å; I591-L709 HydrophobicContact CD1-CD1 3.58Å; I591-L709 HydrophobicContact CG1-CD1 4.22Å; I666-L709 HydrophobicContact CD1-CB 4.35Å; I666-L709 HydrophobicContact CD1-CD1 3.98Å; I666-L709 HydrophobicContact CD1-CD2 3.72Å; I666-L709 HydrophobicContact CD1-CG 4.22Å; P705-L709 PolarHBondContact O-N 2.92Å; L706-L709 PolarHBondContact O-N 3.13Å; M707-L709 VanDerWaalsContact C-N 3.35Å; L709-G713 PolarHBondContact O-N 2.79Å; L709-L730 HydrophobicContact CD1-CD2 4.26Å; L709-I731 HydrophobicContact CD2-CG1 3.89Å; L709-I731 HydrophobicContact CG-CG1 3.98Å; L709-C734 HydrophobicContact CD2-CB 4.06Å
710	D	85.6	Confident	85	Confident	32 Å²	32	46.9 Å²	46.9	17%	0.171	25%	0.249	C	C	.	.	H	α-helix	trans	-63.6	-49.4	180	-175.9	73.7	0	0	0	112	L706 M707 L712 G713 L714 F810	L706-D710 WeakPolarHBondContact O-CB 3.36Å; L706-D710 PolarHBondContact O-N 3.03Å; M707-D710 PolarHBondContact O-N 3.49Å; D710-L712 PolarHBondContact O-N 3.49Å; D710-G713 PolarHBondContact O-N 3.07Å; D710-L714 PolarHBondContact O-N 3.44Å; D710-F810 HydrophobicContact CB-CD1 3.63Å; D710-F810 HydrophobicContact CB-CE1 3.94Å
711	S	85.9	Confident	84.6	Confident	67 Å²	67	48.4 Å²	48.4	47%	0.469	26%	0.258	S	S	.	.	H	α-helix	trans	-62.3	-42.9	177.6	53.6	0	0	0	0	112.6	M707 K708 H715	M707-S711 WeakPolarHBondContact O-CB 3.37Å; M707-S711 PolarHBondContact O-N 3.1Å; M707-S711 PolarHBondContact O-OG 3.03Å; K708-S711 PolarHBondContact O-OG 3.49Å; K708-S711 VanDerWaalsContact O-OG 3.07Å; S711-H715 PolarHBondContact O-N 3.45Å; S711-H715 VanDerWaalsContact O-N 3.15Å
712	L	86.4	Confident	84.2	Confident	23 Å²	23	47.5 Å²	47.5	12%	0.12	25%	0.253	C	S	.	.	H	α-helix	trans	-65.3	-44.1	173.8	-74.2	170.8	0	0	0	111.8	F586 E588 K708 D710 L714 H715 L716	F586-L712 HydrophobicContact CD1-CD1 4.25Å; F586-L712 HydrophobicContact CE1-CD1 3.29Å; F586-L712 HydrophobicContact CZ-CD1 3.77Å; E588-L712 HydrophobicContact CG-CD1 4.26Å; K708-L712 HydrophobicContact CG-CD1 4Å; K708-L712 WeakPolarHBondContact O-CB 3.28Å; K708-L712 WeakPolarHBondContact O-CD1 3.48Å; K708-L712 VanDerWaalsContact O-CG 3.28Å; K708-L712 WeakPolarHBondContact O-CG 3.37Å; K708-L712 PolarHBondContact O-N 2.92Å; K708-L712 VanDerWaalsContact O-N 3.1Å; D710-L712 PolarHBondContact O-N 3.49Å; L712-L714 VanDerWaalsContact C-N 3.32Å; L712-L714 PolarHBondContact O-N 2.89Å; L712-H715 PolarHBondContact O-N 2.97Å; L712-L716 WeakPolarHBondContact O-CB 3.45Å; L712-L716 WeakPolarHBondContact O-CG 3.29Å; L712-L716 PolarHBondContact O-N 3.29Å
713	G	83.9	Confident	83.9	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-59.3	-41.4	177.7	0	0	0	0	0	112.4	L709 D710 L716 S717	L709-G713 PolarHBondContact O-N 2.79Å; D710-G713 PolarHBondContact O-N 3.07Å; G713-L716 PolarHBondContact O-N 3Å; G713-S717 VanDerWaalsContact O-CB 3.27Å; G713-S717 WeakPolarHBondContact O-CB 3.27Å; G713-S717 PolarHBondContact O-N 3.24Å; G713-S717 PolarHBondContact O-OG 3.31Å
714	L	83.4	Confident	83.8	Confident	87 Å²	87	51.4 Å²	51.4	46%	0.455	27%	0.271	S	S	.	.	H	α-helix	trans	-62.6	-48.1	175.4	-160.9	92.4	0	0	0	111.2	D710 L712 S717 Q718	D710-L714 PolarHBondContact O-N 3.44Å; L712-L714 VanDerWaalsContact C-N 3.32Å; L712-L714 PolarHBondContact O-N 2.89Å; L714-S717 PolarHBondContact O-N 2.98Å; L714-S717 PolarHBondContact O-OG 3.41Å; L714-Q718 PolarHBondContact O-N 2.83Å
715	H	84	Confident	83.7	Confident	123 Å²	123	48.5 Å²	48.5	57%	0.569	26%	0.263	S	S	*	.	H	α-helix	trans	-62.1	-44.1	178.3	-178.1	-91.9	0	0	0	112.2	S711 L712 Q718 S719	S711-H715 PolarHBondContact O-N 3.45Å; S711-H715 VanDerWaalsContact O-N 3.15Å; L712-H715 PolarHBondContact O-N 2.97Å; H715-Q718 WeakPolarHBondContact O-CB 3.31Å; H715-Q718 PolarHBondContact O-N 3Å; H715-S719 PolarHBondContact O-N 2.88Å
716	L	85	Confident	83.7	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-70.7	-30.8	-180	-65.8	171.8	0	0	0	112.8	L513 I591 Y592 V595 L712 G713 Q718 S719 V720 L727	L513-L716 HydrophobicContact CD1-CD2 3.35Å; L513-L716 HydrophobicContact CD2-CD2 4.38Å; L513-L716 HydrophobicContact CG-CD2 4.5Å; I591-L716 HydrophobicContact CG2-CD1 3.64Å; Y592-L716 HydrophobicContact CD1-CD1 4.08Å; Y592-L716 HydrophobicContact CD1-CD2 4.15Å; Y592-L716 HydrophobicContact CE1-CD1 4.14Å; Y592-L716 HydrophobicContact CE1-CD2 4.12Å; V595-L716 HydrophobicContact CG2-CB 4.27Å; V595-L716 HydrophobicContact CG2-CD1 4.04Å; L712-L716 WeakPolarHBondContact O-CB 3.45Å; L712-L716 WeakPolarHBondContact O-CG 3.29Å; L712-L716 PolarHBondContact O-N 3.29Å; G713-L716 PolarHBondContact O-N 3Å; L716-Q718 VanDerWaalsContact C-N 3.26Å; L716-Q718 PolarHBondContact O-N 3Å; L716-S719 PolarHBondContact O-N 3.22Å; L716-S719 PolarHBondContact O-OG 3.19Å; L716-V720 PolarHBondContact O-N 3.47Å; L716-L727 HydrophobicContact CB-CD1 4Å
717	S	82.1	Confident	83.6	Confident	20 Å²	20	50 Å²	50	14%	0.14	27%	0.268	C	S	.	.	H	α-helix	trans	-68	-26.1	174.6	72.1	0	0	0	0	113.1	G713 L714 V720	G713-S717 VanDerWaalsContact O-CB 3.27Å; G713-S717 WeakPolarHBondContact O-CB 3.27Å; G713-S717 PolarHBondContact O-N 3.24Å; G713-S717 PolarHBondContact O-OG 3.31Å; L714-S717 PolarHBondContact O-N 2.98Å; L714-S717 PolarHBondContact O-OG 3.41Å; S717-V720 CarbonylContact O-C 3.56Å
718	Q	79.8	Confident	83.5	Confident	147 Å²	147	47 Å²	47	69%	0.687	26%	0.255	S	S	*	.	H	α-helix	trans	-74.6	-35.1	174.8	-67.8	174.5	-3.5	0	0	111.7	L714 H715 L716	L714-Q718 PolarHBondContact O-N 2.83Å; H715-Q718 WeakPolarHBondContact O-CB 3.31Å; H715-Q718 PolarHBondContact O-N 3Å; L716-Q718 VanDerWaalsContact C-N 3.26Å; L716-Q718 PolarHBondContact O-N 3Å
719	S	75.7	Confident	83.6	Confident	50 Å²	50	46.9 Å²	46.9	35%	0.35	26%	0.259	S	S	.	.	H	α-helix	trans	-79.9	-35.6	178.3	61.5	0	0	0	0	112.8	H715 L716	H715-S719 PolarHBondContact O-N 2.88Å; L716-S719 PolarHBondContact O-N 3.22Å; L716-S719 PolarHBondContact O-OG 3.19Å
720	V	78.8	Confident	83.6	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	26%	0.258	C	S	.	.			trans	-128.5	89.9	179.7	-171.6	0	0	0	0	109.4	V595 R599 L716 S717 N722 A723	V595-V720 HydrophobicContact CG1-CB 4.04Å; V595-V720 HydrophobicContact CG1-CG2 3.77Å; R599-V720 HydrophobicContact CB-CG1 4.38Å; R599-V720 HydrophobicContact CB-CG2 4.4Å; L716-V720 PolarHBondContact O-N 3.47Å; S717-V720 CarbonylContact O-C 3.56Å; V720-N722 VanDerWaalsContact C-N 3.27Å; V720-N722 PolarHBondContact O-N 3.42Å; V720-A723 HydrophobicContact CB-CB 4.02Å; V720-A723 HydrophobicContact CG1-CB 3.93Å; V720-A723 VanDerWaalsContact O-CB 3.31Å; V720-A723 WeakPolarHBondContact O-CB 3.46Å; V720-A723 PolarHBondContact O-N 3.17Å
721	P	77.6	Confident	83.7	Confident	99 Å²	99	45.4 Å²	45.4	64%	0.643	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-35.6	-176.3	-28.2	35.6	0	0	0	114.1	A723 Q724	P721-A723 PolarHBondContact O-N 2.92Å; P721-Q724 WeakPolarHBondContact O-CB 3.25Å; P721-Q724 PolarHBondContact O-N 3.46Å; P721-Q724 VanDerWaalsContact O-N 3.16Å
722	N	78.7	Confident	83.7	Confident	53 Å²	53	46 Å²	46	28%	0.283	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-18	178.1	-166.6	27.6	0	0	0	113.1	D602 V720 Q724 P725 F726	D602-N722 WeakPolarHBondContact OD1-CB 3.48Å; D602-N722 PolarHBondContact OD1-ND2 2.94Å; D602-N722 WeakPolarHBondContact OD2-CB 3.34Å; V720-N722 VanDerWaalsContact C-N 3.27Å; V720-N722 PolarHBondContact O-N 3.42Å; N722-Q724 VanDerWaalsContact C-N 3.26Å; N722-Q724 PolarHBondContact O-N 2.82Å; N722-P725 WeakPolarHBondContact O-CD 3.34Å; N722-F726 WeakPolarHBondContact O-CD2 3.17Å
723	A	82.9	Confident	83.8	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-75.3	-17	174.8	0	0	0	0	0	112.3	V595 L598 V720 P721 F726 L727	V595-A723 HydrophobicContact CG1-CB 4.23Å; V595-A723 HydrophobicContact CG2-CB 4.42Å; L598-A723 HydrophobicContact CD1-CB 3.95Å; V720-A723 HydrophobicContact CB-CB 4.02Å; V720-A723 HydrophobicContact CG1-CB 3.93Å; V720-A723 VanDerWaalsContact O-CB 3.31Å; V720-A723 WeakPolarHBondContact O-CB 3.46Å; V720-A723 PolarHBondContact O-N 3.17Å; P721-A723 PolarHBondContact O-N 2.92Å; A723-F726 PolarHBondContact O-N 2.67Å; A723-L727 HydrophobicContact CB-CD1 3.93Å; A723-L727 HydrophobicContact CB-CG 4.3Å; A723-L727 WeakPolarHBondContact O-CB 3.44Å; A723-L727 VanDerWaalsContact O-CG 3.3Å; A723-L727 WeakPolarHBondContact O-CG 3.5Å; A723-L727 PolarHBondContact O-N 3.44Å
724	Q	84.8	Confident	84	Confident	86 Å²	86	49.1 Å²	49.1	40%	0.402	26%	0.258	S	S	.	.	H	α-helix	trans	-52.3	-51.8	-177.2	-169.8	-77.4	-22.5	0	0	114.2	P721 N722 F726 L727 S728 W811	P721-Q724 WeakPolarHBondContact O-CB 3.25Å; P721-Q724 PolarHBondContact O-N 3.46Å; P721-Q724 VanDerWaalsContact O-N 3.16Å; N722-Q724 VanDerWaalsContact C-N 3.26Å; N722-Q724 PolarHBondContact O-N 2.82Å; Q724-F726 VanDerWaalsContact C-N 3.31Å; Q724-F726 PolarHBondContact O-N 3.4Å; Q724-L727 PolarHBondContact O-N 3.43Å; Q724-S728 WeakPolarHBondContact O-CB 3.49Å; Q724-S728 PolarHBondContact O-N 3.48Å; Q724-W811 HydrophobicContact CG-CH2 3.91Å; Q724-W811 VanDerWaalsContact NE2-CH2 3.34Å
725	P	85.9	Confident	84.2	Confident	61 Å²	61	45.1 Å²	45.1	40%	0.396	24%	0.237	S	C	.	.	H	α-helix	trans	-66	-35.1	-179.4	23.6	-35	0	0	0	112.6	N722 S728 T729	N722-P725 WeakPolarHBondContact O-CD 3.34Å; P725-S728 WeakPolarHBondContact O-CB 3.39Å; P725-T729 WeakPolarHBondContact O-CB 3.35Å; P725-T729 PolarHBondContact O-N 2.73Å; P725-T729 PolarHBondContact O-OG1 3.26Å
726	F	86.9	Confident	84.4	Confident	51 Å²	51	42.3 Å²	42.3	22%	0.224	23%	0.229	C	C	.	.	H	α-helix	trans	-71.6	-42.8	179	-70.9	-82.9	0	0	0	112	F594 L598 I652 M659 N722 A723 Q724 T729 L730	F594-F726 HydrophobicContact CE1-CB 4.05Å; F594-F726 HydrophobicContact CZ-CB 3.82Å; L598-F726 HydrophobicContact CD1-CB 3.63Å; L598-F726 HydrophobicContact CD1-CD2 3.79Å; L598-F726 HydrophobicContact CD1-CG 3.74Å; L598-F726 HydrophobicContact CD2-CD1 4.39Å; L598-F726 HydrophobicContact CD2-CD2 4.09Å; L598-F726 HydrophobicContact CD2-CE1 4.43Å; L598-F726 HydrophobicContact CD2-CE2 4.13Å; L598-F726 HydrophobicContact CD2-CG 4.23Å; L598-F726 HydrophobicContact CD2-CZ 4.3Å; I652-F726 HydrophobicContact CG2-CE1 4.45Å; M659-F726 HydrophobicContact CE-CD1 4.47Å; N722-F726 WeakPolarHBondContact O-CD2 3.17Å; A723-F726 PolarHBondContact O-N 2.67Å; Q724-F726 VanDerWaalsContact C-N 3.31Å; Q724-F726 PolarHBondContact O-N 3.4Å; F726-T729 PolarHBondContact O-N 2.85Å; F726-L730 WeakPolarHBondContact O-CB 3.48Å; F726-L730 PolarHBondContact O-N 2.92Å
727	L	87	Confident	84.5	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-65	-39.8	173.3	-71.3	171	0	0	0	111.2	F594 V595 L716 A723 Q724 T729 L730 I731	F594-L727 HydrophobicContact CD1-CD2 4.29Å; F594-L727 HydrophobicContact CE1-CD2 4.23Å; V595-L727 HydrophobicContact CG2-CD1 4.16Å; V595-L727 HydrophobicContact CG2-CD2 3.96Å; V595-L727 HydrophobicContact CG2-CG 4.38Å; L716-L727 HydrophobicContact CB-CD1 4Å; A723-L727 HydrophobicContact CB-CD1 3.93Å; A723-L727 HydrophobicContact CB-CG 4.3Å; A723-L727 WeakPolarHBondContact O-CB 3.44Å; A723-L727 VanDerWaalsContact O-CG 3.3Å; A723-L727 WeakPolarHBondContact O-CG 3.5Å; A723-L727 PolarHBondContact O-N 3.44Å; Q724-L727 PolarHBondContact O-N 3.43Å; L727-T729 VanDerWaalsContact C-N 3.29Å; L727-T729 PolarHBondContact O-N 2.81Å; L727-L730 HydrophobicContact CD2-CD2 4.35Å; L727-L730 PolarHBondContact O-N 3.4Å; L727-I731 VanDerWaalsContact O-CG1 3.31Å; L727-I731 WeakPolarHBondContact O-CG1 3.37Å; L727-I731 PolarHBondContact O-N 2.84Å
728	S	85.2	Confident	84.8	Confident	15 Å²	15	43.3 Å²	43.3	11%	0.105	23%	0.234	C	C	.	.	H	α-helix	trans	-54	-49.7	171.1	-160.3	0	0	0	0	111.4	Q724 P725 I731 K732 W811	Q724-S728 WeakPolarHBondContact O-CB 3.49Å; Q724-S728 PolarHBondContact O-N 3.48Å; P725-S728 WeakPolarHBondContact O-CB 3.39Å; S728-I731 PolarHBondContact O-N 3.25Å; S728-K732 WeakPolarHBondContact O-CB 3.24Å; S728-K732 VanDerWaalsContact O-CG 3.23Å; S728-K732 WeakPolarHBondContact O-CG 3.33Å; S728-K732 PolarHBondContact O-N 2.83Å; S728-W811 VanDerWaalsContact CA-CZ3 3.43Å; S728-W811 VanDerWaalsContact OG-CE3 3.3Å; S728-W811 WeakPolarHBondContact OG-CZ3 3.22Å
729	T	87.6	Confident	85.2	Confident	62 Å²	62	36.5 Å²	36.5	38%	0.38	20%	0.202	S	C	.	.	H	α-helix	trans	-65.6	-41.3	-177.9	-57	0	0	0	0	110.8	M659 P725 F726 L727 K733	M659-T729 HydrophobicContact SD-CG2 4.44Å; P725-T729 WeakPolarHBondContact O-CB 3.35Å; P725-T729 PolarHBondContact O-N 2.73Å; P725-T729 PolarHBondContact O-OG1 3.26Å; F726-T729 PolarHBondContact O-N 2.85Å; L727-T729 VanDerWaalsContact C-N 3.29Å; L727-T729 PolarHBondContact O-N 2.81Å; T729-K733 HydrophobicContact CG2-CD 4.27Å; T729-K733 HydrophobicContact CG2-CG 4.5Å; T729-K733 WeakPolarHBondContact O-CB 3.33Å; T729-K733 VanDerWaalsContact O-CG 3.31Å; T729-K733 WeakPolarHBondContact O-CG 3.38Å; T729-K733 PolarHBondContact O-N 2.88Å
730	L	88.7	Confident	85.8	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.3	-49.4	174.9	173.3	65.8	0	0	0	111.6	M659 I662 I663 L709 F726 L727 K733 C734	M659-L730 HydrophobicContact CG-CB 4.17Å; M659-L730 HydrophobicContact CG-CD1 3.59Å; M659-L730 HydrophobicContact CG-CG 4.43Å; M659-L730 HydrophobicContact SD-CB 4.49Å; I662-L730 HydrophobicContact CB-CD1 4.09Å; I662-L730 HydrophobicContact CD1-CD2 4.3Å; I662-L730 HydrophobicContact CG2-CD1 3.9Å; I662-L730 HydrophobicContact CG2-CD2 4.18Å; I663-L730 HydrophobicContact CD1-CD1 4.32Å; I663-L730 HydrophobicContact CG1-CD1 3.76Å; L709-L730 HydrophobicContact CD1-CD2 4.26Å; F726-L730 WeakPolarHBondContact O-CB 3.48Å; F726-L730 PolarHBondContact O-N 2.92Å; L727-L730 HydrophobicContact CD2-CD2 4.35Å; L727-L730 PolarHBondContact O-N 3.4Å; L730-K733 PolarHBondContact O-N 2.93Å; L730-C734 WeakPolarHBondContact O-CB 3.45Å; L730-C734 PolarHBondContact O-N 2.74Å; L730-C734 PolarHBondContact O-SG 2.94Å
731	I	87.3	Confident	86.3	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-61.6	-48.6	178.9	-68.4	165.5	0	0	0	110.2	L709 L727 S728 K733 C734 I735 W811	L709-I731 HydrophobicContact CD2-CG1 3.89Å; L709-I731 HydrophobicContact CG-CG1 3.98Å; L727-I731 VanDerWaalsContact O-CG1 3.31Å; L727-I731 WeakPolarHBondContact O-CG1 3.37Å; L727-I731 PolarHBondContact O-N 2.84Å; S728-I731 PolarHBondContact O-N 3.25Å; I731-K733 PolarHBondContact O-N 3.37Å; I731-C734 PolarHBondContact O-N 3.43Å; I731-I735 HydrophobicContact CG2-CD1 3.67Å; I731-I735 HydrophobicContact CG2-CG1 4.4Å; I731-I735 WeakPolarHBondContact O-CG1 3.48Å; I731-I735 PolarHBondContact O-N 3.44Å; I731-W811 HydrophobicContact CD1-CD2 4.41Å
732	K	85.5	Confident	86.8	Confident	78 Å²	78	35.6 Å²	35.6	34%	0.339	19%	0.185	S	C	.	.	H	α-helix	trans	-56.8	-47.5	177.1	-75	176.9	-179.2	-168.8	0	112	S728 I735 T736 L813	S728-K732 WeakPolarHBondContact O-CB 3.24Å; S728-K732 VanDerWaalsContact O-CG 3.23Å; S728-K732 WeakPolarHBondContact O-CG 3.33Å; S728-K732 PolarHBondContact O-N 2.83Å; K732-I735 PolarHBondContact O-N 3.46Å; K732-T736 WeakPolarHBondContact O-CB 3.38Å; K732-T736 PolarHBondContact O-N 2.9Å; K732-T736 PolarHBondContact O-OG1 3.43Å; K732-L813 HydrophobicContact CG-CD2 3.98Å
733	K	88.6	Confident	87.2	Confident	89 Å²	89	33.7 Å²	33.7	39%	0.387	18%	0.175	S	C	.	.	H	α-helix	trans	-63.1	-44.7	177.1	-77	-178.5	175	-175.1	0	111.7	M659 I663 T729 L730 I731 I735 T736 T737	M659-K733 HydrophobicContact SD-CD 4.18Å; I663-K733 HydrophobicContact CD1-CB 3.67Å; I663-K733 HydrophobicContact CD1-CD 3.73Å; I663-K733 HydrophobicContact CD1-CG 4.37Å; I663-K733 HydrophobicContact CG1-CB 4.33Å; T729-K733 HydrophobicContact CG2-CD 4.27Å; T729-K733 HydrophobicContact CG2-CG 4.5Å; T729-K733 WeakPolarHBondContact O-CB 3.33Å; T729-K733 VanDerWaalsContact O-CG 3.31Å; T729-K733 WeakPolarHBondContact O-CG 3.38Å; T729-K733 PolarHBondContact O-N 2.88Å; L730-K733 PolarHBondContact O-N 2.93Å; I731-K733 PolarHBondContact O-N 3.37Å; K733-I735 PolarHBondContact O-N 2.83Å; K733-T736 PolarHBondContact O-N 3.16Å; K733-T737 WeakPolarHBondContact O-CB 3.41Å; K733-T737 PolarHBondContact O-N 3.28Å; K733-T737 PolarHBondContact O-OG1 3.36Å
734	C	89.4	Confident	87.4	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.014	19%	0.193	C	C	.	.	H	α-helix	trans	-59.2	-47.6	177	-69.8	0	0	0	0	111.6	L706 L709 L730 I731 T737 V738	L706-C734 HydrophobicContact CD2-CB 4.13Å; L709-C734 HydrophobicContact CD2-CB 4.06Å; L730-C734 WeakPolarHBondContact O-CB 3.45Å; L730-C734 PolarHBondContact O-N 2.74Å; L730-C734 PolarHBondContact O-SG 2.94Å; I731-C734 PolarHBondContact O-N 3.43Å; C734-T737 PolarHBondContact O-N 2.76Å; C734-V738 WeakPolarHBondContact O-CB 3.25Å; C734-V738 VanDerWaalsContact O-CG2 3.23Å; C734-V738 WeakPolarHBondContact O-CG2 3.38Å; C734-V738 PolarHBondContact O-N 3.07Å
735	I	86.9	Confident	87.6	Confident	2 Å²	2	33 Å²	33	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-63.1	-46	179.4	-69	171.5	0	0	0	110.5	L706 I731 K732 K733 T737 V738 T739 V807 F810 L813	L706-I735 HydrophobicContact CD1-CG1 4.34Å; L706-I735 HydrophobicContact CD2-CG1 4.29Å; I731-I735 HydrophobicContact CG2-CD1 3.67Å; I731-I735 HydrophobicContact CG2-CG1 4.4Å; I731-I735 WeakPolarHBondContact O-CG1 3.48Å; I731-I735 PolarHBondContact O-N 3.44Å; K732-I735 PolarHBondContact O-N 3.46Å; K733-I735 PolarHBondContact O-N 2.83Å; I735-T737 PolarHBondContact O-N 3.31Å; I735-V738 PolarHBondContact O-N 3.1Å; I735-T739 WeakPolarHBondContact O-CB 3.49Å; I735-T739 PolarHBondContact O-N 2.76Å; I735-T739 PolarHBondContact O-OG1 3.27Å; I735-V807 HydrophobicContact CG2-CG1 3.6Å; I735-F810 HydrophobicContact CD1-CB 3.79Å; I735-F810 HydrophobicContact CD1-CD2 4.16Å; I735-F810 HydrophobicContact CD1-CG 4.16Å; I735-L813 HydrophobicContact CD1-CD1 3.56Å; I735-L813 HydrophobicContact CG2-CD1 4.24Å
736	T	87.2	Confident	87.6	Confident	64 Å²	64	30.1 Å²	30.1	39%	0.393	16%	0.161	S	C	.	.	H	α-helix	trans	-60.1	-48	179.5	-53.5	0	0	0	0	111.1	K732 K733 T739 H740	K732-T736 WeakPolarHBondContact O-CB 3.38Å; K732-T736 PolarHBondContact O-N 2.9Å; K732-T736 PolarHBondContact O-OG1 3.43Å; K733-T736 PolarHBondContact O-N 3.16Å; T736-T739 PolarHBondContact O-N 3.25Å; T736-H740 WeakPolarHBondContact O-CB 3.34Å; T736-H740 PolarHBondContact O-N 3.49Å
737	T	88.1	Confident	87.6	Confident	42 Å²	42	30.1 Å²	30.1	26%	0.258	17%	0.167	S	C	.	.	H	α-helix	trans	-63.9	-45.8	179.4	-55.9	0	0	0	0	112.1	Q667 K733 C734 I735 H740 D741	Q667-T737 HydrophobicContact CB-CG2 4.44Å; Q667-T737 HydrophobicContact CG-CG2 3.92Å; K733-T737 WeakPolarHBondContact O-CB 3.41Å; K733-T737 PolarHBondContact O-N 3.28Å; K733-T737 PolarHBondContact O-OG1 3.36Å; C734-T737 PolarHBondContact O-N 2.76Å; I735-T737 PolarHBondContact O-N 3.31Å; T737-H740 PolarHBondContact O-N 3.45Å; T737-D741 PolarHBondContact O-N 2.71Å
738	V	89.2	Confident	87.6	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.006	19%	0.192	C	C	.	.	H	α-helix	trans	-67.4	-38	179.3	173.7	0	0	0	0	111.4	C670 I674 I702 L706 C734 I735 Y742	C670-V738 HydrophobicContact CB-CG1 3.82Å; C670-V738 HydrophobicContact CB-CG2 3.88Å; I674-V738 HydrophobicContact CD1-CG1 4.16Å; I702-V738 HydrophobicContact CG2-CG1 3.73Å; L706-V738 HydrophobicContact CD1-CB 4.49Å; L706-V738 HydrophobicContact CD1-CG1 4.21Å; L706-V738 HydrophobicContact CD2-CG2 4.46Å; C734-V738 WeakPolarHBondContact O-CB 3.25Å; C734-V738 VanDerWaalsContact O-CG2 3.23Å; C734-V738 WeakPolarHBondContact O-CG2 3.38Å; C734-V738 PolarHBondContact O-N 3.07Å; I735-V738 PolarHBondContact O-N 3.1Å; V738-Y742 VanDerWaalsContact O-CB 3.32Å; V738-Y742 WeakPolarHBondContact O-CB 3.43Å; V738-Y742 PolarHBondContact O-N 3.12Å
739	T	87.7	Confident	87.7	Confident	4 Å²	4	34.8 Å²	34.8	3%	0.025	19%	0.188	C	C	.	.	H	α-helix	trans	-63.7	-45.6	176.2	-58.9	0	0	0	0	110.2	I735 T736 Y742 T743 Y803 L821	I735-T739 WeakPolarHBondContact O-CB 3.49Å; I735-T739 PolarHBondContact O-N 2.76Å; I735-T739 PolarHBondContact O-OG1 3.27Å; T736-T739 PolarHBondContact O-N 3.25Å; T739-Y742 PolarHBondContact O-N 3.31Å; T739-T743 PolarHBondContact O-N 2.96Å; T739-T743 PolarHBondContact O-OG1 2.9Å; T739-Y803 WeakPolarHBondContact CA-OH 3.49Å; T739-Y803 HydrophobicContact CG2-CE1 4.13Å; T739-Y803 PolarHBondContact N-OH 3.5Å; T739-Y803 PolarHBondContact OG1-OH 2.8Å; T739-Y803 VanDerWaalsContact OG1-OH 3.08Å; T739-L821 HydrophobicContact CG2-CD1 3.71Å
740	H	88.4	Confident	87.5	Confident	98 Å²	98	32.2 Å²	32.2	45%	0.454	17%	0.172	S	C	.	.	H	α-helix	trans	-60.5	-47.8	177.4	-175.6	70.1	0	0	0	112.3	T736 T737 Y742 T743 A744 E820	T736-H740 WeakPolarHBondContact O-CB 3.34Å; T736-H740 PolarHBondContact O-N 3.49Å; T737-H740 PolarHBondContact O-N 3.45Å; H740-Y742 VanDerWaalsContact C-N 3.29Å; H740-Y742 PolarHBondContact O-N 3.35Å; H740-T743 PolarHBondContact O-N 3.28Å; H740-A744 WeakPolarHBondContact O-CB 3.31Å; H740-A744 PolarHBondContact O-N 2.62Å; H740-E820 IonicContact ND1-OE1 2.83Å; H740-E820 IonicContact ND1-OE2 2.64Å; H740-E820 PolarHBondContact ND1-OE2 3.34Å; H740-E820 VanDerWaalsContact ND1-OE2 3.15Å
741	D	88.2	Confident	87.4	Confident	33 Å²	33	35.3 Å²	35.3	18%	0.176	19%	0.191	C	C	.	.	H	α-helix	trans	-59.8	-40.2	176	-76.1	-9.9	0	0	0	111.8	Q667 I674 T737 Q745	Q667-D741 VanDerWaalsContact CG-OD2 3.24Å; Q667-D741 WeakPolarHBondContact CG-OD2 3.32Å; Q667-D741 PolarHBondContact NE2-OD2 3.39Å; I674-D741 HydrophobicContact CD1-CB 3.96Å; T737-D741 PolarHBondContact O-N 2.71Å; D741-Q745 WeakPolarHBondContact O-CB 3.44Å; D741-Q745 PolarHBondContact O-N 2.87Å
742	Y	89.3	Confident	87.3	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-67.6	-46.1	178.1	-176.8	-127.9	0	0	0	111.9	I674 V677 Y698 I702 V738 T739 H740 A744 Q745 L746 Y803 L821	I674-Y742 HydrophobicContact CG1-CD2 4.25Å; I674-Y742 HydrophobicContact CG2-CD2 4.27Å; V677-Y742 HydrophobicContact CG2-CD2 4.17Å; V677-Y742 HydrophobicContact CG2-CE2 3.63Å; Y698-Y742 AromaticContact CE2-CE2 3.81Å; Y698-Y742 HydrophobicContact CE2-CE2 3.81Å; Y698-Y742 PolarHBondContact OH-OH 3.46Å; I702-Y742 HydrophobicContact CD1-CD2 3.93Å; I702-Y742 HydrophobicContact CD1-CE2 3.98Å; V738-Y742 VanDerWaalsContact O-CB 3.32Å; V738-Y742 WeakPolarHBondContact O-CB 3.43Å; V738-Y742 PolarHBondContact O-N 3.12Å; T739-Y742 PolarHBondContact O-N 3.31Å; H740-Y742 VanDerWaalsContact C-N 3.29Å; H740-Y742 PolarHBondContact O-N 3.35Å; Y742-A744 VanDerWaalsContact C-N 3.34Å; Y742-A744 PolarHBondContact O-N 2.98Å; Y742-Q745 PolarHBondContact O-N 2.71Å; Y742-L746 HydrophobicContact CD1-CD1 3.85Å; Y742-L746 HydrophobicContact CD2-CD1 4.32Å; Y742-L746 HydrophobicContact CD2-CG 4.19Å; Y742-L746 HydrophobicContact CE1-CD1 3.44Å; Y742-L746 VanDerWaalsContact CE1-CD1 3.44Å; Y742-L746 HydrophobicContact CE1-CG 4.24Å; Y742-L746 HydrophobicContact CE2-CD1 3.96Å; Y742-L746 HydrophobicContact CE2-CD2 4.11Å; Y742-L746 HydrophobicContact CE2-CG 3.82Å; Y742-L746 HydrophobicContact CG-CD1 4.26Å; Y742-L746 WeakPolarHBondContact O-CB 3.49Å; Y742-L746 WeakPolarHBondContact O-CG 3.35Å; Y742-L746 PolarHBondContact O-N 3.24Å; Y742-Y803 AromaticContact CD1-CD1 3.62Å; Y742-Y803 HydrophobicContact CD1-CD1 3.62Å; Y742-Y803 AromaticContact CD1-CD2 3.96Å; Y742-Y803 HydrophobicContact CD1-CD2 3.96Å; Y742-Y803 AromaticContact CD1-CE1 3.82Å; Y742-Y803 HydrophobicContact CD1-CE1 3.82Å; Y742-Y803 HydrophobicContact CD1-CE2 4.16Å; Y742-Y803 AromaticContact CD1-CG 3.69Å; Y742-Y803 HydrophobicContact CD1-CG 3.69Å; Y742-Y803 AromaticContact CE1-CD1 3.78Å; Y742-Y803 HydrophobicContact CE1-CD1 3.78Å; Y742-Y803 AromaticContact CE1-CD2 3.97Å; Y742-Y803 HydrophobicContact CE1-CD2 3.97Å; Y742-Y803 HydrophobicContact CE1-CE1 4.44Å; Y742-Y803 AromaticContact CE1-CG 3.51Å; Y742-Y803 HydrophobicContact CE1-CG 3.51Å; Y742-L821 HydrophobicContact CD1-CD1 3.82Å; Y742-L821 HydrophobicContact CE1-CD1 4.38Å; Y742-L821 HydrophobicContact CE1-CD2 4.49Å
743	T	86.1	Confident	87.2	Confident	13 Å²	13	33.9 Å²	33.9	8%	0.08	19%	0.191	C	C	.	.	H	α-helix	trans	-59.3	-44.8	174.9	-54.9	0	0	0	0	111.3	T739 H740 Q745 L746 S747 E820 L821	T739-T743 PolarHBondContact O-N 2.96Å; T739-T743 PolarHBondContact O-OG1 2.9Å; H740-T743 PolarHBondContact O-N 3.28Å; T743-Q745 PolarHBondContact O-N 3.23Å; T743-L746 PolarHBondContact O-N 3.37Å; T743-S747 VanDerWaalsContact O-CB 3.32Å; T743-S747 WeakPolarHBondContact O-CB 3.38Å; T743-S747 PolarHBondContact O-N 3Å; T743-S747 PolarHBondContact O-OG 3.31Å; T743-E820 HydrophobicContact CG2-CB 4.02Å; T743-L821 WeakPolarHBondContact OG1-CD1 3.39Å
744	A	87.8	Confident	86.9	Confident	46 Å²	46	33.5 Å²	33.5	38%	0.38	19%	0.187	S	C	.	.	H	α-helix	trans	-58.4	-48.9	176.9	0	0	0	0	0	111	H740 Y742 L746 S747 E748	H740-A744 WeakPolarHBondContact O-CB 3.31Å; H740-A744 PolarHBondContact O-N 2.62Å; Y742-A744 VanDerWaalsContact C-N 3.34Å; Y742-A744 PolarHBondContact O-N 2.98Å; A744-L746 PolarHBondContact O-N 3.36Å; A744-S747 PolarHBondContact O-N 3.27Å; A744-S747 PolarHBondContact O-OG 3.45Å; A744-E748 PolarHBondContact O-N 3.49Å
745	Q	88.1	Confident	86.7	Confident	27 Å²	27	40.8 Å²	40.8	13%	0.126	22%	0.219	C	C	.	.	H	α-helix	trans	-65.5	-39.9	179.1	-160.4	68.4	70.5	0	0	112.6	I674 V677 L678 D741 Y742 T743 E748 V749	I674-Q745 HydrophobicContact CG2-CB 3.65Å; I674-Q745 HydrophobicContact CG2-CG 3.87Å; V677-Q745 HydrophobicContact CB-CG 4.21Å; L678-Q745 VanDerWaalsContact CD2-NE2 3.25Å; D741-Q745 WeakPolarHBondContact O-CB 3.44Å; D741-Q745 PolarHBondContact O-N 2.87Å; Y742-Q745 PolarHBondContact O-N 2.71Å; T743-Q745 PolarHBondContact O-N 3.23Å; Q745-E748 PolarHBondContact NE2-OE2 2.91Å; Q745-E748 PolarHBondContact O-N 3.4Å; Q745-V749 WeakPolarHBondContact O-CG2 3.43Å; Q745-V749 PolarHBondContact O-N 3.39Å
746	L	87.5	Confident	86.4	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.8	-44.4	174.1	-80.2	175	0	0	0	111.6	V677 Y742 T743 A744 V749 S750 L796 A800 L821 F824	V677-L746 HydrophobicContact CG1-CD2 3.91Å; Y742-L746 HydrophobicContact CD1-CD1 3.85Å; Y742-L746 HydrophobicContact CD2-CD1 4.32Å; Y742-L746 HydrophobicContact CD2-CG 4.19Å; Y742-L746 HydrophobicContact CE1-CD1 3.44Å; Y742-L746 VanDerWaalsContact CE1-CD1 3.44Å; Y742-L746 HydrophobicContact CE1-CG 4.24Å; Y742-L746 HydrophobicContact CE2-CD1 3.96Å; Y742-L746 HydrophobicContact CE2-CD2 4.11Å; Y742-L746 HydrophobicContact CE2-CG 3.82Å; Y742-L746 HydrophobicContact CG-CD1 4.26Å; Y742-L746 WeakPolarHBondContact O-CB 3.49Å; Y742-L746 WeakPolarHBondContact O-CG 3.35Å; Y742-L746 PolarHBondContact O-N 3.24Å; T743-L746 PolarHBondContact O-N 3.37Å; A744-L746 PolarHBondContact O-N 3.36Å; L746-V749 PolarHBondContact O-N 2.97Å; L746-S750 VanDerWaalsContact O-CB 3.27Å; L746-S750 WeakPolarHBondContact O-CB 3.31Å; L746-S750 PolarHBondContact O-N 3.05Å; L746-L796 HydrophobicContact CD2-CD2 3.7Å; L746-A800 HydrophobicContact CD1-CB 4.17Å; L746-L821 HydrophobicContact CD1-CD2 4.24Å; L746-F824 HydrophobicContact CB-CE1 4.02Å; L746-F824 HydrophobicContact CB-CE2 4.39Å; L746-F824 HydrophobicContact CB-CZ 3.88Å; L746-F824 HydrophobicContact CD1-CD1 4.4Å; L746-F824 HydrophobicContact CD1-CE1 4.14Å; L746-F824 HydrophobicContact CD2-CE1 4.43Å; L746-F824 HydrophobicContact CG-CE1 4.46Å
747	S	86.1	Confident	86.1	Confident	50 Å²	50	42.4 Å²	42.4	35%	0.35	22%	0.223	S	C	.	.	H	α-helix	trans	-65.1	-39.4	178.6	78.9	0	0	0	0	111.9	T743 A744 S750 T751	T743-S747 VanDerWaalsContact O-CB 3.32Å; T743-S747 WeakPolarHBondContact O-CB 3.38Å; T743-S747 PolarHBondContact O-N 3Å; T743-S747 PolarHBondContact O-OG 3.31Å; A744-S747 PolarHBondContact O-N 3.27Å; A744-S747 PolarHBondContact O-OG 3.45Å; S747-S750 PolarHBondContact O-N 3.06Å; S747-T751 WeakPolarHBondContact O-CB 3.45Å; S747-T751 VanDerWaalsContact O-CG2 3.22Å; S747-T751 WeakPolarHBondContact O-CG2 3.48Å; S747-T751 PolarHBondContact O-N 2.85Å; S747-T751 PolarHBondContact O-OG1 3.4Å
748	E	87.2	Confident	85.6	Confident	111 Å²	111	43.9 Å²	43.9	52%	0.519	23%	0.229	S	C	.	.	H	α-helix	trans	-62.4	-47.7	175.1	-172.1	-175.2	-176.7	0	0	111	A744 Q745 T751 S752	A744-E748 PolarHBondContact O-N 3.49Å; Q745-E748 PolarHBondContact NE2-OE2 2.91Å; Q745-E748 PolarHBondContact O-N 3.4Å; E748-T751 PolarHBondContact O-N 3.48Å; E748-T751 PolarHBondContact O-OG1 3.33Å; E748-S752 WeakPolarHBondContact O-CB 3.42Å; E748-S752 PolarHBondContact O-N 2.95Å
749	V	87.6	Confident	85.1	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.018	25%	0.247	C	C	.	.	H	α-helix	trans	-64.8	-45.2	177.7	174.5	0	0	0	0	110.9	V677 L678 P681 Q745 L746 T751 S752 V753 L796	V677-V749 HydrophobicContact CG1-CB 4.31Å; V677-V749 HydrophobicContact CG1-CG2 3.95Å; L678-V749 HydrophobicContact CD2-CG2 3.78Å; P681-V749 HydrophobicContact CG-CG1 3.7Å; Q745-V749 WeakPolarHBondContact O-CG2 3.43Å; Q745-V749 PolarHBondContact O-N 3.39Å; L746-V749 PolarHBondContact O-N 2.97Å; V749-T751 PolarHBondContact O-N 3.49Å; V749-S752 PolarHBondContact O-N 3.08Å; V749-S752 PolarHBondContact O-OG 3.37Å; V749-V753 HydrophobicContact CG1-CG2 4.43Å; V749-V753 VanDerWaalsContact O-CG2 3.27Å; V749-V753 WeakPolarHBondContact O-CG2 3.37Å; V749-V753 PolarHBondContact O-N 3.44Å; V749-L796 HydrophobicContact CG1-CD1 4.21Å; V749-L796 HydrophobicContact CG1-CD2 4.27Å
750	S	83.9	Confident	84.6	Confident	9 Å²	9	49.3 Å²	49.3	6%	0.063	26%	0.262	C	S	.	.	H	α-helix	trans	-60.1	-46.5	178	-176	0	0	0	0	112.3	L746 S747 S752 V753 R754	L746-S750 VanDerWaalsContact O-CB 3.27Å; L746-S750 WeakPolarHBondContact O-CB 3.31Å; L746-S750 PolarHBondContact O-N 3.05Å; S747-S750 PolarHBondContact O-N 3.06Å; S750-S752 PolarHBondContact O-N 3.25Å; S750-V753 PolarHBondContact O-N 2.89Å; S750-R754 WeakPolarHBondContact O-CG 3.49Å; S750-R754 PolarHBondContact O-N 3.18Å
751	T	85.4	Confident	84	Confident	64 Å²	64	51.1 Å²	51.1	39%	0.393	27%	0.265	S	S	.	.	H	α-helix	trans	-65.8	-36.4	176.6	57	0	0	0	0	112.2	S747 E748 V749 V753 R754 K755	S747-T751 WeakPolarHBondContact O-CB 3.45Å; S747-T751 VanDerWaalsContact O-CG2 3.22Å; S747-T751 WeakPolarHBondContact O-CG2 3.48Å; S747-T751 PolarHBondContact O-N 2.85Å; S747-T751 PolarHBondContact O-OG1 3.4Å; E748-T751 PolarHBondContact O-N 3.48Å; E748-T751 PolarHBondContact O-OG1 3.33Å; V749-T751 PolarHBondContact O-N 3.49Å; T751-V753 VanDerWaalsContact C-N 3.32Å; T751-V753 PolarHBondContact O-N 2.93Å; T751-R754 PolarHBondContact O-N 3.38Å; T751-K755 WeakPolarHBondContact O-CB 3.46Å; T751-K755 VanDerWaalsContact O-CG 3.31Å; T751-K755 WeakPolarHBondContact O-CG 3.28Å; T751-K755 PolarHBondContact O-N 2.91Å
752	S	85.8	Confident	83.5	Confident	51 Å²	51	57.6 Å²	57.6	36%	0.357	29%	0.287	S	S	.	.	H	α-helix	trans	-64.1	-36.7	173.9	84.3	0	0	0	0	112.3	E748 V749 S750 M756	E748-S752 WeakPolarHBondContact O-CB 3.42Å; E748-S752 PolarHBondContact O-N 2.95Å; V749-S752 PolarHBondContact O-N 3.08Å; V749-S752 PolarHBondContact O-OG 3.37Å; S750-S752 PolarHBondContact O-N 3.25Å; S752-M756 WeakPolarHBondContact O-CB 3.38Å; S752-M756 PolarHBondContact O-N 3.35Å
753	V	83.6	Confident	82.7	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.012	31%	0.307	C	S	.	.	H	α-helix	trans	-70.5	-46.2	176.7	174.1	0	0	0	0	110.2	P681 V749 S750 T751 M756 E757 D789 I792	P681-V753 HydrophobicContact CG-CG2 4.26Å; V749-V753 HydrophobicContact CG1-CG2 4.43Å; V749-V753 VanDerWaalsContact O-CG2 3.27Å; V749-V753 WeakPolarHBondContact O-CG2 3.37Å; V749-V753 PolarHBondContact O-N 3.44Å; S750-V753 PolarHBondContact O-N 2.89Å; T751-V753 VanDerWaalsContact C-N 3.32Å; T751-V753 PolarHBondContact O-N 2.93Å; V753-M756 PolarHBondContact O-N 3.4Å; V753-E757 WeakPolarHBondContact O-CB 3.43Å; V753-E757 PolarHBondContact O-N 3.37Å; V753-D789 HydrophobicContact CG1-CB 4.36Å; V753-I792 HydrophobicContact CG1-CG2 4.38Å; V753-I792 HydrophobicContact CG2-CG2 3.77Å
754	R	82.6	Confident	82.1	Confident	81 Å²	81	67.3 Å²	67.3	31%	0.306	33%	0.328	S	S	.	.	H	α-helix	trans	-58.9	-49.8	175.6	-74.4	-177.4	179	179	0.5	112.3	S750 T751 M756 E757 D758 Q827	S750-R754 WeakPolarHBondContact O-CG 3.49Å; S750-R754 PolarHBondContact O-N 3.18Å; T751-R754 PolarHBondContact O-N 3.38Å; R754-M756 VanDerWaalsContact C-N 3.27Å; R754-M756 PolarHBondContact O-N 2.99Å; R754-E757 PolarHBondContact O-N 3.42Å; R754-E757 VanDerWaalsContact O-N 3.17Å; R754-D758 PolarHBondContact O-N 3.27Å; R754-Q827 PolarHBondContact NH2-O 2.93Å
755	K	83.8	Confident	81.4	Confident	155 Å²	155	71.3 Å²	71.3	67%	0.674	34%	0.339	S	S	*	.	H	α-helix	trans	-58.1	-40	177.7	-75.7	175.3	-178.8	173.7	0	112.2	T751 S759	T751-K755 WeakPolarHBondContact O-CB 3.46Å; T751-K755 VanDerWaalsContact O-CG 3.31Å; T751-K755 WeakPolarHBondContact O-CG 3.28Å; T751-K755 PolarHBondContact O-N 2.91Å; K755-S759 WeakPolarHBondContact O-CB 3.27Å; K755-S759 PolarHBondContact O-N 3.16Å
756	M	81.9	Confident	80.6	Confident	79 Å²	79	75 Å²	75	39%	0.389	36%	0.363	S	S	.	.	H	α-helix	trans	-68.8	-44.6	177	-173.8	63.7	63.6	0	0	111.5	R685 S752 V753 R754 D758 S759 L760	R685-M756 VanDerWaalsContact NH2-CB 3.26Å; S752-M756 WeakPolarHBondContact O-CB 3.38Å; S752-M756 PolarHBondContact O-N 3.35Å; V753-M756 PolarHBondContact O-N 3.4Å; R754-M756 VanDerWaalsContact C-N 3.27Å; R754-M756 PolarHBondContact O-N 2.99Å; M756-D758 PolarHBondContact O-N 3.49Å; M756-S759 PolarHBondContact O-N 2.95Å; M756-S759 PolarHBondContact O-OG 3.45Å; M756-L760 HydrophobicContact CG-CD1 4.3Å; M756-L760 WeakPolarHBondContact O-CG 3.28Å; M756-L760 PolarHBondContact O-N 2.61Å
757	E	79.7	Confident	79.5	Confident	22 Å²	22	83.4 Å²	83.4	10%	0.103	40%	0.395	C	S	.	.	H	α-helix	trans	-58.7	-46.6	176.2	-178	177.9	-168	0	0	111.3	V753 R754 S759 L760 R761 R793	V753-E757 WeakPolarHBondContact O-CB 3.43Å; V753-E757 PolarHBondContact O-N 3.37Å; R754-E757 PolarHBondContact O-N 3.42Å; R754-E757 VanDerWaalsContact O-N 3.17Å; E757-S759 VanDerWaalsContact C-N 3.32Å; E757-S759 PolarHBondContact O-N 3.18Å; E757-L760 PolarHBondContact O-N 2.9Å; E757-L760 VanDerWaalsContact O-N 3.16Å; E757-R761 HydrophobicContact CG-CG 4.42Å; E757-R761 WeakPolarHBondContact O-CB 3.48Å; E757-R761 WeakPolarHBondContact O-CG 3.48Å; E757-R761 PolarHBondContact O-N 3.38Å; E757-R761 IonicContact OE1-CZ 3.36Å; E757-R761 IonicContact OE1-NE 3.32Å; E757-R761 PolarHBondContact OE1-NE 3.29Å; E757-R761 IonicContact OE1-NH2 2.71Å; E757-R761 PolarHBondContact OE1-NH2 3.37Å; E757-R793 IonicContact OE1-NH1 2.73Å; E757-R793 IonicContact OE1-NH2 3.34Å; E757-R793 PolarHBondContact OE1-NH2 3.49Å; E757-R793 IonicContact OE2-CZ 3.71Å; E757-R793 IonicContact OE2-NH1 3.58Å; E757-R793 PolarHBondContact OE2-NH1 3.2Å; E757-R793 IonicContact OE2-NH2 3.39Å; E757-R793 PolarHBondContact OE2-NH2 2.97Å
758	D	78.9	Confident	78.3	Confident	72 Å²	72	90.8 Å²	90.8	39%	0.385	42%	0.415	S	S	.	.	H	α-helix	trans	-61	-40.8	176.5	-74.3	-21.2	0	0	0	111.7	R754 M756 L760 R761 R762	R754-D758 PolarHBondContact O-N 3.27Å; M756-D758 PolarHBondContact O-N 3.49Å; D758-L760 VanDerWaalsContact C-N 3.33Å; D758-L760 PolarHBondContact O-N 2.65Å; D758-R761 PolarHBondContact O-N 2.96Å; D758-R762 WeakPolarHBondContact O-CB 3.39Å; D758-R762 VanDerWaalsContact O-CG 3.23Å; D758-R762 WeakPolarHBondContact O-CG 3.34Å; D758-R762 PolarHBondContact O-N 3.22Å
759	S	77.7	Confident	76.8	Confident	55 Å²	55	88.6 Å²	88.6	39%	0.385	42%	0.422	S	S	.	.	H	α-helix	trans	-63.6	-38.9	176.1	79.4	0	0	0	0	112.2	K755 M756 E757 L763	K755-S759 WeakPolarHBondContact O-CB 3.27Å; K755-S759 PolarHBondContact O-N 3.16Å; M756-S759 PolarHBondContact O-N 2.95Å; M756-S759 PolarHBondContact O-OG 3.45Å; E757-S759 VanDerWaalsContact C-N 3.32Å; E757-S759 PolarHBondContact O-N 3.18Å; S759-L763 VanDerWaalsContact O-CB 3.27Å; S759-L763 WeakPolarHBondContact O-CB 3.01Å; S759-L763 PolarHBondContact O-N 2.8Å
760	L	76.6	Confident	75.3	Confident	65 Å²	65	93.6 Å²	93.6	34%	0.34	46%	0.457	S	S	.	.	H	α-helix	trans	-72.4	-38.3	177.5	-71.5	173	0	0	0	111.9	M756 E757 D758 L763 R764	M756-L760 HydrophobicContact CG-CD1 4.3Å; M756-L760 WeakPolarHBondContact O-CG 3.28Å; M756-L760 PolarHBondContact O-N 2.61Å; E757-L760 PolarHBondContact O-N 2.9Å; E757-L760 VanDerWaalsContact O-N 3.16Å; D758-L760 VanDerWaalsContact C-N 3.33Å; D758-L760 PolarHBondContact O-N 2.65Å; L760-L763 PolarHBondContact O-N 3.36Å; L760-R764 VanDerWaalsContact O-CG 3.27Å; L760-R764 WeakPolarHBondContact O-CG 3.26Å; L760-R764 PolarHBondContact O-N 2.64Å
761	R	76.7	Confident	73.7	Confident	135 Å²	135	97.8 Å²	97.8	51%	0.509	49%	0.486	S	S	.	.	H	α-helix	trans	-62	-51.2	173.1	-75.1	-178.4	-176.3	-157.7	3.8	110.6	E757 D758 L763 R764 E765	E757-R761 HydrophobicContact CG-CG 4.42Å; E757-R761 WeakPolarHBondContact O-CB 3.48Å; E757-R761 WeakPolarHBondContact O-CG 3.48Å; E757-R761 PolarHBondContact O-N 3.38Å; E757-R761 IonicContact OE1-CZ 3.36Å; E757-R761 IonicContact OE1-NE 3.32Å; E757-R761 PolarHBondContact OE1-NE 3.29Å; E757-R761 IonicContact OE1-NH2 2.71Å; E757-R761 PolarHBondContact OE1-NH2 3.37Å; D758-R761 PolarHBondContact O-N 2.96Å; R761-L763 VanDerWaalsContact C-N 3.3Å; R761-L763 PolarHBondContact O-N 3.32Å; R761-R764 WeakPolarHBondContact O-CB 3.49Å; R761-R764 PolarHBondContact O-N 3.04Å; R761-E765 PolarHBondContact O-N 3.44Å
762	R	77.2	Confident	71.9	Confident	169 Å²	169	103.4 Å²	103.4	64%	0.638	51%	0.508	S	S	*	.	H	α-helix	trans	-56.8	-42.4	175.2	-71.7	174.4	-165.3	177.5	6.2	112	D758 R764 E765 V766	D758-R762 WeakPolarHBondContact O-CB 3.39Å; D758-R762 VanDerWaalsContact O-CG 3.23Å; D758-R762 WeakPolarHBondContact O-CG 3.34Å; D758-R762 PolarHBondContact O-N 3.22Å; R762-R764 PolarHBondContact O-N 2.83Å; R762-E765 PolarHBondContact O-N 3.02Å; R762-V766 VanDerWaalsContact O-CG2 3.31Å; R762-V766 WeakPolarHBondContact O-CG2 3.33Å; R762-V766 PolarHBondContact O-N 3.47Å
763	L	72.2	Confident	70.1	Confident	82 Å²	82	108.6 Å²	108.6	43%	0.429	53%	0.53	S	S	.	.	H	α-helix	trans	-67.5	-34.2	178.5	-171.3	144.2	0	0	0	112.6	S759 L760 R761 R767	S759-L763 VanDerWaalsContact O-CB 3.27Å; S759-L763 WeakPolarHBondContact O-CB 3.01Å; S759-L763 PolarHBondContact O-N 2.8Å; L760-L763 PolarHBondContact O-N 3.36Å; R761-L763 VanDerWaalsContact C-N 3.3Å; R761-L763 PolarHBondContact O-N 3.32Å; L763-R767 WeakPolarHBondContact O-CG 3.47Å; L763-R767 PolarHBondContact O-N 3.4Å
764	R	73.9	Confident	67.9	Low	135 Å²	135	114 Å²	114	51%	0.509	57%	0.568	S	S	.	*	H	α-helix	trans	-69.9	-38.2	172	-72.1	172.5	-173.8	175	5.2	112	L760 R761 R762 R767 R768	L760-R764 VanDerWaalsContact O-CG 3.27Å; L760-R764 WeakPolarHBondContact O-CG 3.26Å; L760-R764 PolarHBondContact O-N 2.64Å; R761-R764 WeakPolarHBondContact O-CB 3.49Å; R761-R764 PolarHBondContact O-N 3.04Å; R762-R764 PolarHBondContact O-N 2.83Å; R764-R767 PolarHBondContact O-N 2.81Å; R764-R768 PolarHBondContact O-N 2.9Å
765	E	73.5	Confident	65.6	Low	130 Å²	130	117.7 Å²	117.7	61%	0.607	59%	0.594	S	S	*	*	H	α-helix	trans	-65.1	-44.2	175.2	-94.2	146.2	-176.4	0	0	112.5	R761 R762 R767 R768 G769	R761-E765 PolarHBondContact O-N 3.44Å; R762-E765 PolarHBondContact O-N 3.02Å; E765-R767 VanDerWaalsContact C-N 3.31Å; E765-R767 PolarHBondContact O-N 3.41Å; E765-R768 PolarHBondContact O-N 3.24Å; E765-R768 VanDerWaalsContact O-N 3.14Å; E765-G769 PolarHBondContact O-N 2.9Å
766	V	71	Confident	63.5	Low	105 Å²	105	118.8 Å²	118.8	64%	0.636	60%	0.602	S	S	*	*	H	α-helix	trans	-61.8	-40.1	175	173.7	0	0	0	0	111.2	R762 R768 G769 S770	R762-V766 VanDerWaalsContact O-CG2 3.31Å; R762-V766 WeakPolarHBondContact O-CG2 3.33Å; R762-V766 PolarHBondContact O-N 3.47Å; V766-R768 VanDerWaalsContact C-N 3.33Å; V766-R768 PolarHBondContact O-N 3.47Å; V766-G769 PolarHBondContact O-N 3.46Å; V766-S770 PolarHBondContact O-N 2.8Å
767	R	63.9	Low	61	Low	177 Å²	177	120 Å²	120	67%	0.668	62%	0.618	S	S	*	*	H	α-helix	trans	-66.7	-31.2	175.5	-75.4	179.7	-175.8	-178.3	2.3	113.4	L763 R764 E765 S771	L763-R767 WeakPolarHBondContact O-CG 3.47Å; L763-R767 PolarHBondContact O-N 3.4Å; R764-R767 PolarHBondContact O-N 2.81Å; E765-R767 VanDerWaalsContact C-N 3.31Å; E765-R767 PolarHBondContact O-N 3.41Å; R767-S771 PolarHBondContact O-OG 2.72Å
768	R	61	Low	58.9	Low	205 Å²	205	128 Å²	128	77%	0.774	66%	0.655	S	S	*	*	H	α-helix	trans	-75.5	-33.6	174	-79	180	169.5	174.5	-3.3	112.1	R764 E765 V766	R764-R768 PolarHBondContact O-N 2.9Å; E765-R768 PolarHBondContact O-N 3.24Å; E765-R768 VanDerWaalsContact O-N 3.14Å; V766-R768 VanDerWaalsContact C-N 3.33Å; V766-R768 PolarHBondContact O-N 3.47Å
769	G	56.4	Low	56.6	Low	64 Å²	64	130.4 Å²	130.4	66%	0.66	68%	0.677	S	S	*	*	H	α-helix	trans	-70.5	-28	177	0	0	0	0	0	114.6	E765 V766	E765-G769 PolarHBondContact O-N 2.9Å; V766-G769 PolarHBondContact O-N 3.46Å
770	S	56.1	Low	54.4	Low	109 Å²	109	134 Å²	134	76%	0.762	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-4.6	-178.4	-108	0	0	0	0	115.5	V766	V766-S770 PolarHBondContact O-N 2.8Å
771	S	50.3	Low	52.2	Low	97 Å²	97	138.8 Å²	138.8	68%	0.678	72%	0.723	S	S	*	*			trans	-125.8	61.7	-172.6	-60.8	0	0	0	0	111.7	R767	R767-S771 PolarHBondContact O-OG 2.72Å
772	Q	47.5	Very low	49.9	Very low	181 Å²	181	135.7 Å²	135.7	85%	0.846	73%	0.733	S	S	*	*			trans	-105	57	167.2	-78.9	-165.6	-16.4	0	0	111.4
773	I	47.3	Very low	47.7	Very low	160 Å²	160	132.9 Å²	132.9	82%	0.821	74%	0.739	S	S	*	*	S	Bend	trans	-142.8	125.4	160	-57.2	-179.8	0	0	0	108.4
774	S	38.8	Very low	46	Very low	116 Å²	116	134.9 Å²	134.9	81%	0.811	76%	0.76	S	S	*	*			trans	90.8	100.1	172.1	73.2	0	0	0	0	118.2
775	N	33	Very low	44.4	Very low	158 Å²	158	131.2 Å²	131.2	85%	0.845	76%	0.764	S	S	*	*			trans	-58.2	134.4	154.2	-77.1	-30.3	0	0	0	110.7
776	Q	39.7	Very low	43.5	Very low	179 Å²	179	131.3 Å²	131.3	84%	0.836	76%	0.763	S	S	*	*				171.1	117	121.6	-94.8	173.9	19.6	0	0	111.2
777	S	30.7	Very low	43.4	Very low	104 Å²	104	131.4 Å²	131.4	73%	0.727	76%	0.756	S	S	*	*			trans	33.1	108.8	141.5	53.8	0	0	0	0	119.3
778	Q	34.2	Very low	44	Very low	191 Å²	191	124.8 Å²	124.8	89%	0.893	74%	0.737	S	S	*	*			trans	-148.7	133.1	134.4	-107.7	168.9	27.6	0	0	110.3
779	S	31.5	Very low	44.9	Very low	121 Å²	121	115.7 Å²	115.7	85%	0.846	70%	0.703	S	S	*	*			trans	-52.5	123.7	-171.5	47.9	0	0	0	0	114.6
780	V	31.8	Very low	46.1	Very low	132 Å²	132	115 Å²	115	80%	0.8	69%	0.685	S	S	*	*			trans	-89	106.1	172.6	179.4	0	0	0	0	108.4	G782	V780-G782 VanDerWaalsContact C-N 3.3Å; V780-G782 PolarHBondContact O-N 3.42Å
781	N	29.9	Very low	47.4	Very low	164 Å²	164	111.6 Å²	111.6	88%	0.877	66%	0.656	S	S	*	*			trans	-67.7	96.7	156.2	-88.5	-14.1	0	0	0	107.2	S783	N781-S783 PolarHBondContact O-N 2.92Å
782	G	27.5	Very low	49	Very low	70 Å²	70	107 Å²	107	72%	0.722	62%	0.624	S	S	*	*			trans	-76.1	94.1	178	0	0	0	0	0	111	V780	V780-G782 VanDerWaalsContact C-N 3.3Å; V780-G782 PolarHBondContact O-N 3.42Å
783	S	32.5	Very low	50.7	Low	111 Å²	111	99.5 Å²	99.5	78%	0.776	59%	0.588	S	S	*	*			trans	-87.2	115.3	156.7	45.6	0	0	0	0	108.4	N781 G785	N781-S783 PolarHBondContact O-N 2.92Å; S783-G785 PolarHBondContact O-N 3.29Å
784	S	35	Very low	52.5	Low	124 Å²	124	92.9 Å²	92.9	87%	0.867	55%	0.554	S	S	*	*			trans	-67	53.1	173.3	58	0	0	0	0	112.3	F786	S784-F786 PolarHBondContact O-N 3.47Å
785	G	40.9	Very low	54.9	Low	57 Å²	57	87.7 Å²	87.7	59%	0.588	52%	0.516	S	S	*	.			trans	-83.1	112.8	-174.6	0	0	0	0	0	111.9	S783 H787	S783-G785 PolarHBondContact O-N 3.29Å; G785-H787 PolarHBondContact O-N 3.22Å
786	F	54.8	Low	57.5	Low	133 Å²	133	80.2 Å²	80.2	58%	0.583	48%	0.476	S	S	*	.			trans	-36	129.2	171.3	-75.2	-85	0	0	0	112.5	F691 S784 D790	F691-F786 HydrophobicContact CD2-CB 4.12Å; F691-F786 HydrophobicContact CD2-CD1 4.39Å; F691-F786 HydrophobicContact CD2-CD2 4.22Å; F691-F786 AromaticContact CD2-CG 3.99Å; F691-F786 HydrophobicContact CD2-CG 3.99Å; F691-F786 HydrophobicContact CE2-CB 4.1Å; F691-F786 AromaticContact CE2-CD1 3.71Å; F691-F786 HydrophobicContact CE2-CD1 3.71Å; F691-F786 HydrophobicContact CE2-CD2 4.3Å; F691-F786 HydrophobicContact CE2-CE1 4.17Å; F691-F786 AromaticContact CE2-CG 3.78Å; F691-F786 HydrophobicContact CE2-CG 3.78Å; F691-F786 HydrophobicContact CZ-CD1 4.29Å; F691-F786 HydrophobicContact CZ-CE1 4.31Å; S784-F786 PolarHBondContact O-N 3.47Å; F786-D790 HydrophobicContact CD1-CB 4.23Å
787	H	69.6	Low	59.7	Low	106 Å²	106	73.4 Å²	73.4	49%	0.491	44%	0.443	S	S	.	.			trans	-65.7	151.7	179	-77.9	-56	0	0	0	110.4	G785 D789 D790 K791	G785-H787 PolarHBondContact O-N 3.22Å; H787-D789 PolarHBondContact O-N 3.48Å; H787-D789 VanDerWaalsContact O-N 3.11Å; H787-D790 PolarHBondContact N-OD2 3.48Å; H787-D790 WeakPolarHBondContact O-CB 3.43Å; H787-D790 PolarHBondContact O-N 3.5Å; H787-K791 PolarHBondContact O-N 3.22Å
788	S	76	Confident	62.5	Low	39 Å²	39	69.9 Å²	69.9	27%	0.273	42%	0.416	S	S	.	.	H	α-helix	trans	-54.8	-30.9	177.8	52.1	0	0	0	0	112.7	K791 I792	S788-K791 PolarHBondContact O-N 2.83Å; S788-I792 WeakPolarHBondContact O-CG1 3.46Å; S788-I792 PolarHBondContact O-N 3.26Å
789	D	79.6	Confident	65.1	Low	13 Å²	13	60.8 Å²	60.8	7%	0.07	37%	0.374	C	S	.	.	H	α-helix	trans	-72.8	-30.7	178.2	-58.5	-34.1	0	0	0	112.2	V753 H787 I792 R793	V753-D789 HydrophobicContact CG1-CB 4.36Å; H787-D789 PolarHBondContact O-N 3.48Å; H787-D789 VanDerWaalsContact O-N 3.11Å; D789-I792 PolarHBondContact O-N 2.97Å; D789-R793 PolarHBondContact O-N 2.88Å
790	D	81.2	Confident	67.7	Low	50 Å²	50	55 Å²	55	27%	0.267	33%	0.333	S	S	.	.	H	α-helix	trans	-68.4	-37.1	173.5	-60.7	-35.2	0	0	0	111.4	F786 H787 I792 R793 H794	F786-D790 HydrophobicContact CD1-CB 4.23Å; H787-D790 PolarHBondContact N-OD2 3.48Å; H787-D790 WeakPolarHBondContact O-CB 3.43Å; H787-D790 PolarHBondContact O-N 3.5Å; D790-I792 VanDerWaalsContact C-N 3.35Å; D790-R793 IonicContact OD1-CZ 3.43Å; D790-R793 IonicContact OD1-NE 3.97Å; D790-R793 IonicContact OD1-NH2 2.73Å; D790-R793 PolarHBondContact OD1-NH2 3.34Å; D790-H794 WeakPolarHBondContact O-CB 3.49Å; D790-H794 PolarHBondContact O-N 2.85Å
791	K	83.8	Confident	70.3	Confident	37 Å²	37	53.1 Å²	53.1	16%	0.161	31%	0.314	C	S	.	.	H	α-helix	trans	-62.5	-42.3	173.7	-65.7	-177.4	-177.1	179.5	0	111.3	Y684 R689 F691 P692 H787 S788 H794 Q795	Y684-K791 HydrophobicContact CD1-CB 3.91Å; Y684-K791 HydrophobicContact CD1-CD 4.26Å; Y684-K791 HydrophobicContact CG-CB 4.24Å; R689-K791 PolarHBondContact O-NZ 3.43Å; F691-K791 HydrophobicContact CD2-CG 3.77Å; F691-K791 HydrophobicContact CE2-CG 4.19Å; P692-K791 WeakPolarHBondContact CG-O 3.3Å; H787-K791 PolarHBondContact O-N 3.22Å; S788-K791 PolarHBondContact O-N 2.83Å; K791-H794 PolarHBondContact O-N 3.01Å; K791-Q795 PolarHBondContact O-N 3.16Å
792	I	83.5	Confident	73.1	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.8	-50.3	178.6	-64.5	162.3	0	0	0	110.7	I680 P681 Y684 R685 V753 S788 D789 D790 H794 Q795 L796	I680-I792 HydrophobicContact CG2-CG2 4.23Å; P681-I792 HydrophobicContact CB-CD1 4.45Å; Y684-I792 HydrophobicContact CD2-CG1 4.41Å; Y684-I792 HydrophobicContact CG-CG1 4.36Å; R685-I792 HydrophobicContact CG-CD1 3.78Å; V753-I792 HydrophobicContact CG1-CG2 4.38Å; V753-I792 HydrophobicContact CG2-CG2 3.77Å; S788-I792 WeakPolarHBondContact O-CG1 3.46Å; S788-I792 PolarHBondContact O-N 3.26Å; D789-I792 PolarHBondContact O-N 2.97Å; D790-I792 VanDerWaalsContact C-N 3.35Å; I792-H794 VanDerWaalsContact C-N 3.26Å; I792-H794 PolarHBondContact O-N 3.31Å; I792-Q795 PolarHBondContact O-N 2.86Å; I792-L796 HydrophobicContact CG2-CD1 4.14Å; I792-L796 HydrophobicContact CG2-CG 4.47Å; I792-L796 WeakPolarHBondContact O-CG 3.39Å; I792-L796 PolarHBondContact O-N 2.85Å
793	R	83.5	Confident	75.9	Confident	24 Å²	24	43.3 Å²	43.3	9%	0.091	25%	0.249	C	C	.	.	H	α-helix	trans	-56.7	-41.9	175.8	-79.2	-174.2	-77.3	-91	10.2	111.9	E757 D789 D790 L796 Y797	E757-R793 IonicContact OE1-NH1 2.73Å; E757-R793 IonicContact OE1-NH2 3.34Å; E757-R793 PolarHBondContact OE1-NH2 3.49Å; E757-R793 IonicContact OE2-CZ 3.71Å; E757-R793 IonicContact OE2-NH1 3.58Å; E757-R793 PolarHBondContact OE2-NH1 3.2Å; E757-R793 IonicContact OE2-NH2 3.39Å; E757-R793 PolarHBondContact OE2-NH2 2.97Å; D789-R793 PolarHBondContact O-N 2.88Å; D790-R793 IonicContact OD1-CZ 3.43Å; D790-R793 IonicContact OD1-NE 3.97Å; D790-R793 IonicContact OD1-NH2 2.73Å; D790-R793 PolarHBondContact OD1-NH2 3.34Å; R793-L796 PolarHBondContact O-N 3.46Å; R793-Y797 WeakPolarHBondContact O-CB 3.26Å; R793-Y797 PolarHBondContact O-N 2.86Å
794	H	86	Confident	78.4	Confident	22 Å²	22	38.1 Å²	38.1	10%	0.102	21%	0.213	C	C	.	.	H	α-helix	trans	-67.2	-40.2	178.8	-171.1	36.1	0	0	0	112.7	F691 P692 D790 K791 I792 Y797 L798 R832	F691-H794 AromaticContact CD1-CD2 3.63Å; F691-H794 HydrophobicContact CE1-CB 4.26Å; F691-H794 AromaticContact CE1-CD2 2.97Å; F691-H794 WeakPolarHBondContact CE1-CD2 3.39Å; F691-H794 AromaticContact CE1-CG 3.74Å; F691-H794 AromaticContact CE1-NE2 3.54Å; F691-H794 HydrophobicContact CE2-CB 4.47Å; F691-H794 HydrophobicContact CZ-CB 3.83Å; F691-H794 AromaticContact CZ-CD2 3.48Å; F691-H794 VanDerWaalsContact CZ-CD2 3.48Å; F691-H794 WeakPolarHBondContact CZ-CD2 3.43Å; F691-H794 AromaticContact CZ-CG 3.78Å; P692-H794 HydrophobicContact CG-CB 4.14Å; P692-H794 PolarHBondContact O-CD2 3.45Å; P692-H794 PolarHBondContact O-NE2 2.81Å; D790-H794 WeakPolarHBondContact O-CB 3.49Å; D790-H794 PolarHBondContact O-N 2.85Å; K791-H794 PolarHBondContact O-N 3.01Å; I792-H794 VanDerWaalsContact C-N 3.26Å; I792-H794 PolarHBondContact O-N 3.31Å; H794-Y797 AromaticContact ND1-CD1 3.98Å; H794-Y797 WeakPolarHBondContact O-CB 3.23Å; H794-Y797 PolarHBondContact O-N 3.43Å; H794-L798 WeakPolarHBondContact O-CG 3.4Å; H794-L798 PolarHBondContact O-N 3.44Å; H794-R832 PolarHBondContact CE1-NH1 2.93Å; H794-R832 PolarHBondContact CE1-NH2 3.4Å; H794-R832 VanDerWaalsContact CG-NH2 3.32Å; H794-R832 PolarHBondContact ND1-NH1 2.67Å; H794-R832 PolarHBondContact ND1-NH2 3.24Å
795	Q	88.3	Confident	80.7	Confident	6 Å²	6	35.8 Å²	35.8	3%	0.028	19%	0.191	C	C	.	.	H	α-helix	trans	-61.7	-45.7	174.2	-173.3	68.3	63.3	0	0	111.2	I680 Y684 P692 N694 S696 K791 I792 Y797 L798 D799	I680-Q795 HydrophobicContact CG2-CB 4.15Å; I680-Q795 HydrophobicContact CG2-CG 4.05Å; Y684-Q795 HydrophobicContact CE2-CB 3.86Å; Y684-Q795 HydrophobicContact CE2-CG 3.88Å; Y684-Q795 PolarHBondContact OH-OE1 2.99Å; P692-Q795 HydrophobicContact CB-CB 4.3Å; P692-Q795 HydrophobicContact CG-CB 4.12Å; N694-Q795 PolarHBondContact O-NE2 3.44Å; S696-Q795 PolarHBondContact OG-NE2 2.81Å; K791-Q795 PolarHBondContact O-N 3.16Å; I792-Q795 PolarHBondContact O-N 2.86Å; Q795-Y797 VanDerWaalsContact C-N 3.26Å; Q795-Y797 PolarHBondContact O-N 3.44Å; Q795-L798 PolarHBondContact O-N 2.99Å; Q795-L798 VanDerWaalsContact O-N 3.16Å; Q795-D799 PolarHBondContact NE2-OD1 3.41Å; Q795-D799 WeakPolarHBondContact O-CB 3.49Å; Q795-D799 PolarHBondContact O-N 2.7Å
796	L	87	Confident	82.8	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-58.9	-39.3	177	-66.8	173.1	0	0	0	111.6	V677 I680 L746 V749 I792 R793 A800 I828	V677-L796 HydrophobicContact CG1-CD2 4.16Å; I680-L796 HydrophobicContact CD1-CD2 3.59Å; L746-L796 HydrophobicContact CD2-CD2 3.7Å; V749-L796 HydrophobicContact CG1-CD1 4.21Å; V749-L796 HydrophobicContact CG1-CD2 4.27Å; I792-L796 HydrophobicContact CG2-CD1 4.14Å; I792-L796 HydrophobicContact CG2-CG 4.47Å; I792-L796 WeakPolarHBondContact O-CG 3.39Å; I792-L796 PolarHBondContact O-N 2.85Å; R793-L796 PolarHBondContact O-N 3.46Å; L796-A800 WeakPolarHBondContact O-CB 3.4Å; L796-A800 PolarHBondContact O-N 3.36Å; L796-I828 HydrophobicContact CB-CD1 4.31Å
797	Y	87.1	Confident	84.1	Confident	36 Å²	36	29.4 Å²	29.4	14%	0.141	15%	0.147	C	C	.	.	H	α-helix	trans	-62.7	-47.6	173.5	171.8	-89.4	0	0	0	112.6	R793 H794 Q795 D799 A800 K801 I825 I828 D829	R793-Y797 WeakPolarHBondContact O-CB 3.26Å; R793-Y797 PolarHBondContact O-N 2.86Å; H794-Y797 AromaticContact ND1-CD1 3.98Å; H794-Y797 WeakPolarHBondContact O-CB 3.23Å; H794-Y797 PolarHBondContact O-N 3.43Å; Q795-Y797 VanDerWaalsContact C-N 3.26Å; Q795-Y797 PolarHBondContact O-N 3.44Å; Y797-D799 VanDerWaalsContact C-N 3.3Å; Y797-D799 PolarHBondContact O-N 2.78Å; Y797-A800 PolarHBondContact O-N 3.23Å; Y797-K801 HydrophobicContact CE1-CD 4.15Å; Y797-K801 VanDerWaalsContact O-CB 3.26Å; Y797-K801 WeakPolarHBondContact O-CB 3.44Å; Y797-K801 PolarHBondContact O-N 3.34Å; Y797-I825 HydrophobicContact CD2-CG2 4.02Å; Y797-I825 HydrophobicContact CE2-CG2 3.65Å; Y797-I828 HydrophobicContact CD2-CG2 4.39Å; Y797-D829 WeakPolarHBondContact CE2-OD1 3.42Å; Y797-D829 WeakPolarHBondContact CE2-OD2 3.47Å
798	L	87.8	Confident	84.7	Confident	31 Å²	31	29.4 Å²	29.4	16%	0.162	14%	0.143	C	C	.	.	H	α-helix	trans	-62.9	-40.4	179.1	-70.5	175.6	0	0	0	111.2	P692 H794 Q795 A802	P692-L798 HydrophobicContact CB-CD1 4.19Å; H794-L798 WeakPolarHBondContact O-CG 3.4Å; H794-L798 PolarHBondContact O-N 3.44Å; Q795-L798 PolarHBondContact O-N 2.99Å; Q795-L798 VanDerWaalsContact O-N 3.16Å; L798-A802 VanDerWaalsContact O-CB 3.29Å; L798-A802 WeakPolarHBondContact O-CB 3.29Å; L798-A802 PolarHBondContact O-N 2.85Å
799	D	89.7	Confident	84.8	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-66.7	-48.3	178.9	-66.6	-4.9	0	0	0	111.5	I680 A695 S696 Y698 V699 Q795 Y797 K801 A802 Y803	I680-D799 WeakPolarHBondContact CD1-OD2 3.28Å; A695-D799 WeakPolarHBondContact CA-OD1 3.28Å; S696-D799 WeakPolarHBondContact CB-OD1 3.24Å; S696-D799 WeakPolarHBondContact CB-OD2 3.33Å; S696-D799 PolarHBondContact N-OD1 3.29Å; S696-D799 PolarHBondContact OG-OD1 3.1Å; S696-D799 VanDerWaalsContact OG-OD1 3.09Å; S696-D799 PolarHBondContact OG-OD2 3.49Å; Y698-D799 VanDerWaalsContact CE1-OD2 3.28Å; Y698-D799 WeakPolarHBondContact CE1-OD2 3.43Å; Y698-D799 VanDerWaalsContact OH-CB 3.23Å; Y698-D799 WeakPolarHBondContact OH-CB 3.49Å; Y698-D799 VanDerWaalsContact OH-CG 3.25Å; Y698-D799 PolarHBondContact OH-OD2 3.25Å; V699-D799 HydrophobicContact CG2-CB 3.81Å; Q795-D799 PolarHBondContact NE2-OD1 3.41Å; Q795-D799 WeakPolarHBondContact O-CB 3.49Å; Q795-D799 PolarHBondContact O-N 2.7Å; Y797-D799 VanDerWaalsContact C-N 3.3Å; Y797-D799 PolarHBondContact O-N 2.78Å; D799-K801 PolarHBondContact O-N 2.89Å; D799-A802 PolarHBondContact O-N 2.94Å; D799-Y803 WeakPolarHBondContact O-CB 3.24Å; D799-Y803 PolarHBondContact O-N 3.43Å
800	A	86.7	Confident	84.5	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61	-44.4	177	0	0	0	0	0	111.9	L746 L796 Y797 Y803 I804 L821 F824 I825	L746-A800 HydrophobicContact CD1-CB 4.17Å; L796-A800 WeakPolarHBondContact O-CB 3.4Å; L796-A800 PolarHBondContact O-N 3.36Å; Y797-A800 PolarHBondContact O-N 3.23Å; A800-Y803 PolarHBondContact O-N 3.04Å; A800-I804 WeakPolarHBondContact O-CG1 3.39Å; A800-I804 PolarHBondContact O-N 3.39Å; A800-L821 HydrophobicContact CB-CD2 3.67Å; A800-F824 HydrophobicContact CB-CD1 4.49Å; A800-I825 HydrophobicContact CB-CD1 4.07Å; A800-I825 HydrophobicContact CB-CG1 3.95Å
801	K	86.7	Confident	83.6	Confident	92 Å²	92	33.6 Å²	33.6	40%	0.4	15%	0.152	S	C	.	.	H	α-helix	trans	-63.8	-46.4	177.5	-175.4	175	-178	173.7	0	112	Y797 D799 Y803 I804 D805 I825	Y797-K801 HydrophobicContact CE1-CD 4.15Å; Y797-K801 VanDerWaalsContact O-CB 3.26Å; Y797-K801 WeakPolarHBondContact O-CB 3.44Å; Y797-K801 PolarHBondContact O-N 3.34Å; D799-K801 PolarHBondContact O-N 2.89Å; K801-Y803 VanDerWaalsContact C-N 3.3Å; K801-Y803 PolarHBondContact O-N 3.44Å; K801-I804 PolarHBondContact O-N 3.47Å; K801-D805 WeakPolarHBondContact O-CB 3.35Å; K801-D805 PolarHBondContact O-N 2.94Å; K801-I825 HydrophobicContact CB-CD1 4.48Å
802	A	87.4	Confident	82.2	Confident	27 Å²	27	37.6 Å²	37.6	22%	0.223	19%	0.185	C	C	.	.	H	α-helix	trans	-62.6	-38.5	177.1	0	0	0	0	0	112	A695 V699 L798 D799 D805 E806	A695-A802 HydrophobicContact CB-CB 3.46Å; A695-A802 VanDerWaalsContact CB-CB 3.46Å; V699-A802 HydrophobicContact CG1-CB 4.32Å; L798-A802 VanDerWaalsContact O-CB 3.29Å; L798-A802 WeakPolarHBondContact O-CB 3.29Å; L798-A802 PolarHBondContact O-N 2.85Å; D799-A802 PolarHBondContact O-N 2.94Å; A802-D805 PolarHBondContact O-N 3.31Å; A802-E806 WeakPolarHBondContact O-CG 3.35Å; A802-E806 PolarHBondContact O-N 3.46Å
803	Y	87.8	Confident	81	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.2	-49.1	174.3	-179.2	-96.5	0	0	0	111.8	V699 I702 I703 T739 Y742 D799 A800 K801 D805 E806 V807 L821	V699-Y803 HydrophobicContact CG1-CD2 4.45Å; I702-Y803 HydrophobicContact CG2-CD2 4.39Å; I702-Y803 HydrophobicContact CG2-CE2 3.72Å; I703-Y803 HydrophobicContact CD1-CD2 3.71Å; I703-Y803 HydrophobicContact CD1-CE2 3.67Å; I703-Y803 HydrophobicContact CG1-CD2 4.18Å; I703-Y803 HydrophobicContact CG1-CE2 4.43Å; T739-Y803 WeakPolarHBondContact CA-OH 3.49Å; T739-Y803 HydrophobicContact CG2-CE1 4.13Å; T739-Y803 PolarHBondContact N-OH 3.5Å; T739-Y803 PolarHBondContact OG1-OH 2.8Å; T739-Y803 VanDerWaalsContact OG1-OH 3.08Å; Y742-Y803 AromaticContact CD1-CD1 3.62Å; Y742-Y803 HydrophobicContact CD1-CD1 3.62Å; Y742-Y803 AromaticContact CD1-CD2 3.96Å; Y742-Y803 HydrophobicContact CD1-CD2 3.96Å; Y742-Y803 AromaticContact CD1-CE1 3.82Å; Y742-Y803 HydrophobicContact CD1-CE1 3.82Å; Y742-Y803 HydrophobicContact CD1-CE2 4.16Å; Y742-Y803 AromaticContact CD1-CG 3.69Å; Y742-Y803 HydrophobicContact CD1-CG 3.69Å; Y742-Y803 AromaticContact CE1-CD1 3.78Å; Y742-Y803 HydrophobicContact CE1-CD1 3.78Å; Y742-Y803 AromaticContact CE1-CD2 3.97Å; Y742-Y803 HydrophobicContact CE1-CD2 3.97Å; Y742-Y803 HydrophobicContact CE1-CE1 4.44Å; Y742-Y803 AromaticContact CE1-CG 3.51Å; Y742-Y803 HydrophobicContact CE1-CG 3.51Å; D799-Y803 WeakPolarHBondContact O-CB 3.24Å; D799-Y803 PolarHBondContact O-N 3.43Å; A800-Y803 PolarHBondContact O-N 3.04Å; K801-Y803 VanDerWaalsContact C-N 3.3Å; K801-Y803 PolarHBondContact O-N 3.44Å; Y803-D805 PolarHBondContact O-N 2.85Å; Y803-E806 PolarHBondContact O-N 2.92Å; Y803-V807 HydrophobicContact CD1-CG2 3.99Å; Y803-V807 HydrophobicContact CD2-CG2 4.39Å; Y803-V807 HydrophobicContact CE1-CG2 3.57Å; Y803-V807 HydrophobicContact CE2-CG2 3.99Å; Y803-V807 HydrophobicContact CG-CG2 4.39Å; Y803-V807 WeakPolarHBondContact O-CG2 3.34Å; Y803-V807 PolarHBondContact O-N 2.99Å; Y803-L821 HydrophobicContact CD1-CD1 3.9Å; Y803-L821 HydrophobicContact CE1-CD1 3.95Å
804	I	84.3	Confident	79.6	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.015	22%	0.216	C	C	.	.	H	α-helix	trans	-60.1	-45.3	177.8	-70.9	178.6	0	0	0	111.4	A800 K801 E806 V807 R808 T818 L821 I825	A800-I804 WeakPolarHBondContact O-CG1 3.39Å; A800-I804 PolarHBondContact O-N 3.39Å; K801-I804 PolarHBondContact O-N 3.47Å; I804-E806 VanDerWaalsContact C-N 3.27Å; I804-E806 PolarHBondContact O-N 3.22Å; I804-V807 PolarHBondContact O-N 3.49Å; I804-R808 HydrophobicContact CG2-CG 4.2Å; I804-R808 VanDerWaalsContact CG2-NE 3.31Å; I804-R808 WeakPolarHBondContact O-CB 3.49Å; I804-R808 VanDerWaalsContact O-CG 3.29Å; I804-R808 WeakPolarHBondContact O-CG 3.19Å; I804-R808 PolarHBondContact O-N 2.81Å; I804-T818 HydrophobicContact CG1-CG2 4.3Å; I804-T818 HydrophobicContact CG2-CG2 4.25Å; I804-L821 HydrophobicContact CD1-CB 3.98Å; I804-L821 HydrophobicContact CD1-CD2 3.84Å; I804-L821 HydrophobicContact CG1-CB 4.29Å; I804-L821 HydrophobicContact CG1-CD2 3.86Å; I804-I825 HydrophobicContact CD1-CD1 3.32Å; I804-I825 HydrophobicContact CD1-CG1 4.46Å; I804-I825 HydrophobicContact CG1-CD1 4.44Å
805	D	84	Confident	78.1	Confident	75 Å²	75	51.8 Å²	51.8	40%	0.401	25%	0.248	S	C	.	.	H	α-helix	trans	-62.8	-34.8	-179.8	-73.6	-19.9	0	0	0	111.8	K801 A802 Y803 K809	K801-D805 WeakPolarHBondContact O-CB 3.35Å; K801-D805 PolarHBondContact O-N 2.94Å; A802-D805 PolarHBondContact O-N 3.31Å; Y803-D805 PolarHBondContact O-N 2.85Å; D805-K809 WeakPolarHBondContact O-CE 3.47Å; D805-K809 WeakPolarHBondContact O-CG 3.49Å
806	E	84.1	Confident	76.6	Confident	54 Å²	54	58.5 Å²	58.5	25%	0.252	28%	0.279	S	S	.	.	H	α-helix	trans	-74.8	-41.3	172.3	-68.8	-54.5	144.9	0	0	112.6	I703 M707 A802 Y803 I804 R808 K809 F810	I703-E806 HydrophobicContact CD1-CB 3.82Å; I703-E806 HydrophobicContact CG1-CB 3.89Å; I703-E806 HydrophobicContact CG1-CG 4.37Å; I703-E806 HydrophobicContact CG2-CB 4.04Å; I703-E806 HydrophobicContact CG2-CG 4.42Å; M707-E806 VanDerWaalsContact CE-OE2 3.23Å; M707-E806 WeakPolarHBondContact CE-OE2 3.36Å; A802-E806 WeakPolarHBondContact O-CG 3.35Å; A802-E806 PolarHBondContact O-N 3.46Å; Y803-E806 PolarHBondContact O-N 2.92Å; I804-E806 VanDerWaalsContact C-N 3.27Å; I804-E806 PolarHBondContact O-N 3.22Å; E806-R808 VanDerWaalsContact C-N 3.33Å; E806-R808 PolarHBondContact O-N 3.32Å; E806-K809 WeakPolarHBondContact O-CB 3.32Å; E806-K809 PolarHBondContact O-N 3.49Å; E806-K809 VanDerWaalsContact O-N 3.17Å; E806-K809 IonicContact OE1-NZ 3.19Å; E806-K809 PolarHBondContact OE1-NZ 2.86Å; E806-K809 IonicContact OE2-NZ 2.64Å; E806-K809 PolarHBondContact OE2-NZ 3.27Å; E806-F810 WeakPolarHBondContact O-CE2 3.27Å
807	V	83	Confident	75.1	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.012	29%	0.292	C	S	.	.	H	α-helix	trans	-63.8	-38.9	179.9	170.5	0	0	0	0	111.9	I703 I735 Y803 I804 K809 F810 L813 T818	I703-V807 HydrophobicContact CD1-CG2 3.8Å; I735-V807 HydrophobicContact CG2-CG1 3.6Å; Y803-V807 HydrophobicContact CD1-CG2 3.99Å; Y803-V807 HydrophobicContact CD2-CG2 4.39Å; Y803-V807 HydrophobicContact CE1-CG2 3.57Å; Y803-V807 HydrophobicContact CE2-CG2 3.99Å; Y803-V807 HydrophobicContact CG-CG2 4.39Å; Y803-V807 WeakPolarHBondContact O-CG2 3.34Å; Y803-V807 PolarHBondContact O-N 2.99Å; I804-V807 PolarHBondContact O-N 3.49Å; V807-K809 PolarHBondContact O-N 3.4Å; V807-K809 VanDerWaalsContact O-N 3.15Å; V807-F810 WeakPolarHBondContact O-CD2 3.41Å; V807-F810 PolarHBondContact O-N 3.18Å; V807-F810 VanDerWaalsContact O-N 3.08Å; V807-L813 HydrophobicContact CG1-CD1 4.42Å; V807-T818 HydrophobicContact CG1-CG2 4.36Å
808	R	80.5	Confident	73.8	Confident	106 Å²	106	60.3 Å²	60.3	40%	0.4	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-15.7	177.4	-75.5	176.8	177.7	162.4	5.7	113.8	I804 E806 T818 D822	I804-R808 HydrophobicContact CG2-CG 4.2Å; I804-R808 VanDerWaalsContact CG2-NE 3.31Å; I804-R808 WeakPolarHBondContact O-CB 3.49Å; I804-R808 VanDerWaalsContact O-CG 3.29Å; I804-R808 WeakPolarHBondContact O-CG 3.19Å; I804-R808 PolarHBondContact O-N 2.81Å; E806-R808 VanDerWaalsContact C-N 3.33Å; E806-R808 PolarHBondContact O-N 3.32Å; R808-T818 PolarHBondContact NH2-OG1 3.4Å; R808-D822 IonicContact CZ-OD1 3.57Å; R808-D822 IonicContact NH2-OD1 3.83Å; R808-D822 PolarHBondContact NH2-OD1 2.95Å; R808-D822 IonicContact NH2-OD2 2.76Å; R808-D822 PolarHBondContact NH2-OD2 3.05Å
809	K	79.5	Confident	72.5	Confident	135 Å²	135	61.6 Å²	61.6	59%	0.587	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-19.7	175.2	-64	171.9	-165.1	168.4	0	112.7	D805 E806 V807	D805-K809 WeakPolarHBondContact O-CE 3.47Å; D805-K809 WeakPolarHBondContact O-CG 3.49Å; E806-K809 WeakPolarHBondContact O-CB 3.32Å; E806-K809 PolarHBondContact O-N 3.49Å; E806-K809 VanDerWaalsContact O-N 3.17Å; E806-K809 IonicContact OE1-NZ 3.19Å; E806-K809 PolarHBondContact OE1-NZ 2.86Å; E806-K809 IonicContact OE2-NZ 2.64Å; E806-K809 PolarHBondContact OE2-NZ 3.27Å; V807-K809 PolarHBondContact O-N 3.4Å; V807-K809 VanDerWaalsContact O-N 3.15Å
810	F	72.4	Confident	71.1	Confident	7 Å²	7	66.6 Å²	66.6	3%	0.031	32%	0.321	C	S	.	.	S	Bend	trans	-77.9	134.7	179.5	-61.9	-62	0	0	0	111.6	I703 L706 M707 D710 I735 E806 V807 S812 L813	I703-F810 HydrophobicContact CD1-CE2 4.37Å; I703-F810 HydrophobicContact CG2-CE2 4.14Å; I703-F810 HydrophobicContact CG2-CZ 3.9Å; L706-F810 HydrophobicContact CB-CE2 4.39Å; L706-F810 HydrophobicContact CB-CZ 4.38Å; M707-F810 HydrophobicContact CB-CE1 4.19Å; M707-F810 HydrophobicContact CB-CZ 4.27Å; M707-F810 HydrophobicContact CE-CZ 4.16Å; M707-F810 HydrophobicContact CG-CE1 3.59Å; M707-F810 HydrophobicContact CG-CZ 3.35Å; D710-F810 HydrophobicContact CB-CD1 3.63Å; D710-F810 HydrophobicContact CB-CE1 3.94Å; I735-F810 HydrophobicContact CD1-CB 3.79Å; I735-F810 HydrophobicContact CD1-CD2 4.16Å; I735-F810 HydrophobicContact CD1-CG 4.16Å; E806-F810 WeakPolarHBondContact O-CE2 3.27Å; V807-F810 WeakPolarHBondContact O-CD2 3.41Å; V807-F810 PolarHBondContact O-N 3.18Å; V807-F810 VanDerWaalsContact O-N 3.08Å; F810-S812 PolarHBondContact O-N 2.99Å; F810-L813 HydrophobicContact CB-CD1 4.01Å; F810-L813 WeakPolarHBondContact O-CD1 3.49Å; F810-L813 PolarHBondContact O-N 2.82Å
811	W	61.8	Low	70.1	Confident	48 Å²	48	66.6 Å²	66.6	18%	0.182	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	26.6	59.7	165	-98.6	54	0	0	0	116.7	Q724 S728 I731 L813	Q724-W811 HydrophobicContact CG-CH2 3.91Å; Q724-W811 VanDerWaalsContact NE2-CH2 3.34Å; S728-W811 VanDerWaalsContact CA-CZ3 3.43Å; S728-W811 VanDerWaalsContact OG-CE3 3.3Å; S728-W811 WeakPolarHBondContact OG-CZ3 3.22Å; I731-W811 HydrophobicContact CD1-CD2 4.41Å; W811-L813 PolarHBondContact O-N 3.09Å
812	S	56.2	Low	69.2	Low	121 Å²	121	64.2 Å²	64.2	85%	0.846	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	40.9	44.5	171.5	-48.8	0	0	0	0	114.3	F810 D814	F810-S812 PolarHBondContact O-N 2.99Å; S812-D814 PolarHBondContact O-N 3.19Å
813	L	57.4	Low	68.3	Low	24 Å²	24	67.2 Å²	67.2	13%	0.126	33%	0.325	C	S	.	.			trans	-68.6	123.2	-179.8	-73.7	155.8	0	0	0	110	K732 I735 V807 F810 W811 Y817	K732-L813 HydrophobicContact CG-CD2 3.98Å; I735-L813 HydrophobicContact CD1-CD1 3.56Å; I735-L813 HydrophobicContact CG2-CD1 4.24Å; V807-L813 HydrophobicContact CG1-CD1 4.42Å; F810-L813 HydrophobicContact CB-CD1 4.01Å; F810-L813 WeakPolarHBondContact O-CD1 3.49Å; F810-L813 PolarHBondContact O-N 2.82Å; W811-L813 PolarHBondContact O-N 3.09Å; L813-Y817 HydrophobicContact CB-CD2 3.92Å; L813-Y817 HydrophobicContact CB-CE2 4.39Å; L813-Y817 HydrophobicContact CD2-CD2 3.46Å; L813-Y817 VanDerWaalsContact CD2-CD2 3.46Å; L813-Y817 HydrophobicContact CD2-CE2 3.61Å; L813-Y817 HydrophobicContact CD2-CG 4.05Å; L813-Y817 HydrophobicContact CG-CD2 4.29Å
814	D	54.6	Low	67.2	Low	117 Å²	117	67.8 Å²	67.8	63%	0.626	33%	0.328	S	S	*	.			trans	-61.3	157.6	169.6	-72.4	-45.1	0	0	0	111	S812 E816 Y817	S812-D814 PolarHBondContact O-N 3.19Å; D814-E816 PolarHBondContact O-N 2.87Å; D814-Y817 HydrophobicContact CB-CE2 4.49Å; D814-Y817 WeakPolarHBondContact O-CD2 3.37Å
815	R	53.9	Low	66.6	Low	202 Å²	202	68.7 Å²	68.7	76%	0.762	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-56.5	-17.9	-176.4	-75.4	-170.9	-176.5	-169.5	2	114.8	Y817 T818	R815-Y817 PolarHBondContact O-N 3.3Å; R815-Y817 VanDerWaalsContact O-N 3.12Å; R815-T818 PolarHBondContact O-N 2.95Å; R815-T818 PolarHBondContact O-OG1 2.89Å
816	E	57.5	Low	66	Low	147 Å²	147	71.5 Å²	71.5	69%	0.687	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-58.3	-27.2	-174.6	-65.2	-175.4	170.3	0	0	113.8	D814 C819	D814-E816 PolarHBondContact O-N 2.87Å; E816-C819 VanDerWaalsContact CA-SG 3.6Å; E816-C819 PolarHBondContact O-SG 2.95Å; E816-C819 VanDerWaalsContact O-SG 3.41Å
817	Y	55.7	Low	65.1	Low	70 Å²	70	73.6 Å²	73.6	28%	0.275	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-84	-14.6	-174	-53.6	-71.9	0	0	0	114.3	L813 D814 R815	L813-Y817 HydrophobicContact CB-CD2 3.92Å; L813-Y817 HydrophobicContact CB-CE2 4.39Å; L813-Y817 HydrophobicContact CD2-CD2 3.46Å; L813-Y817 VanDerWaalsContact CD2-CD2 3.46Å; L813-Y817 HydrophobicContact CD2-CE2 3.61Å; L813-Y817 HydrophobicContact CD2-CG 4.05Å; L813-Y817 HydrophobicContact CG-CD2 4.29Å; D814-Y817 HydrophobicContact CB-CE2 4.49Å; D814-Y817 WeakPolarHBondContact O-CD2 3.37Å; R815-Y817 PolarHBondContact O-N 3.3Å; R815-Y817 VanDerWaalsContact O-N 3.12Å
818	T	58.8	Low	64.2	Low	5 Å²	5	73.6 Å²	73.6	3%	0.031	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-103.5	1.7	176	58.8	0	0	0	0	112.5	I804 V807 R808 R815 E820 L821 D822	I804-T818 HydrophobicContact CG1-CG2 4.3Å; I804-T818 HydrophobicContact CG2-CG2 4.25Å; V807-T818 HydrophobicContact CG1-CG2 4.36Å; R808-T818 PolarHBondContact NH2-OG1 3.4Å; R815-T818 PolarHBondContact O-N 2.95Å; R815-T818 PolarHBondContact O-OG1 2.89Å; T818-E820 PolarHBondContact O-N 2.94Å; T818-L821 CarbonylContact O-C 3.48Å; T818-L821 WeakPolarHBondContact O-CA 3.28Å; T818-L821 WeakPolarHBondContact O-CB 3.3Å; T818-L821 PolarHBondContact O-N 2.74Å; T818-D822 WeakPolarHBondContact CB-OD2 3.41Å; T818-D822 PolarHBondContact O-N 3.4Å; T818-D822 PolarHBondContact OG1-OD2 3.26Å
819	C	61	Low	63.4	Low	59 Å²	59	71.3 Å²	71.3	40%	0.399	35%	0.348	S	S	.	.	H	α-helix	trans	-51.7	-47.5	-174.4	-72.6	0	0	0	0	113.8	E816 L821 D822 D823	E816-C819 VanDerWaalsContact CA-SG 3.6Å; E816-C819 PolarHBondContact O-SG 2.95Å; E816-C819 VanDerWaalsContact O-SG 3.41Å; C819-L821 PolarHBondContact O-N 3Å; C819-D822 PolarHBondContact O-N 3.08Å; C819-D823 WeakPolarHBondContact O-CB 3.43Å; C819-D823 VanDerWaalsContact O-CG 3.23Å; C819-D823 PolarHBondContact O-N 2.81Å
820	E	61.2	Low	62.5	Low	104 Å²	104	68.9 Å²	68.9	49%	0.486	35%	0.345	S	S	.	.	H	α-helix	trans	-62.1	-29.7	179.4	-57.1	-174	163.9	0	0	112.5	H740 T743 T818 F824	H740-E820 IonicContact ND1-OE1 2.83Å; H740-E820 IonicContact ND1-OE2 2.64Å; H740-E820 PolarHBondContact ND1-OE2 3.34Å; H740-E820 VanDerWaalsContact ND1-OE2 3.15Å; T743-E820 HydrophobicContact CG2-CB 4.02Å; T818-E820 PolarHBondContact O-N 2.94Å; E820-F824 PolarHBondContact O-N 3.13Å
821	L	63.8	Low	61.8	Low	0 Å²	0	71.4 Å²	71.4	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-88.9	-34	-178.3	-127.3	143.4	0	0	0	111.6	T739 Y742 T743 L746 A800 Y803 I804 T818 C819 F824 I825	T739-L821 HydrophobicContact CG2-CD1 3.71Å; Y742-L821 HydrophobicContact CD1-CD1 3.82Å; Y742-L821 HydrophobicContact CE1-CD1 4.38Å; Y742-L821 HydrophobicContact CE1-CD2 4.49Å; T743-L821 WeakPolarHBondContact OG1-CD1 3.39Å; L746-L821 HydrophobicContact CD1-CD2 4.24Å; A800-L821 HydrophobicContact CB-CD2 3.67Å; Y803-L821 HydrophobicContact CD1-CD1 3.9Å; Y803-L821 HydrophobicContact CE1-CD1 3.95Å; I804-L821 HydrophobicContact CD1-CB 3.98Å; I804-L821 HydrophobicContact CD1-CD2 3.84Å; I804-L821 HydrophobicContact CG1-CB 4.29Å; I804-L821 HydrophobicContact CG1-CD2 3.86Å; T818-L821 CarbonylContact O-C 3.48Å; T818-L821 WeakPolarHBondContact O-CA 3.28Å; T818-L821 WeakPolarHBondContact O-CB 3.3Å; T818-L821 PolarHBondContact O-N 2.74Å; C819-L821 PolarHBondContact O-N 3Å; L821-F824 PolarHBondContact O-N 3.29Å; L821-I825 VanDerWaalsContact O-CG1 3.32Å; L821-I825 WeakPolarHBondContact O-CG1 3.19Å; L821-I825 PolarHBondContact O-N 2.77Å
822	D	68.6	Low	61.4	Low	42 Å²	42	74.2 Å²	74.2	23%	0.225	37%	0.371	C	S	.	.	H	α-helix	trans	-62.7	-45.6	169.4	-73	-50	0	0	0	109.5	R808 T818 C819 F824 I825 E826	R808-D822 IonicContact CZ-OD1 3.57Å; R808-D822 IonicContact NH2-OD1 3.83Å; R808-D822 PolarHBondContact NH2-OD1 2.95Å; R808-D822 IonicContact NH2-OD2 2.76Å; R808-D822 PolarHBondContact NH2-OD2 3.05Å; T818-D822 WeakPolarHBondContact CB-OD2 3.41Å; T818-D822 PolarHBondContact O-N 3.4Å; T818-D822 PolarHBondContact OG1-OD2 3.26Å; C819-D822 PolarHBondContact O-N 3.08Å; D822-F824 VanDerWaalsContact C-N 3.3Å; D822-F824 PolarHBondContact O-N 3.08Å; D822-I825 PolarHBondContact O-N 3.26Å; D822-I825 VanDerWaalsContact O-N 3.15Å; D822-E826 PolarHBondContact O-N 3.08Å
823	D	69	Low	60.8	Low	91 Å²	91	73.4 Å²	73.4	49%	0.487	36%	0.362	S	S	.	.	H	α-helix	trans	-59	-40.3	173.4	-72.6	-11.4	0	0	0	111.7	C819 E826 Q827	C819-D823 WeakPolarHBondContact O-CB 3.43Å; C819-D823 VanDerWaalsContact O-CG 3.23Å; C819-D823 PolarHBondContact O-N 2.81Å; D823-E826 PolarHBondContact O-N 2.93Å; D823-Q827 VanDerWaalsContact O-CG 3.29Å; D823-Q827 WeakPolarHBondContact O-CG 3.38Å; D823-Q827 PolarHBondContact O-N 3.14Å
824	F	65.1	Low	59.6	Low	12 Å²	12	80.7 Å²	80.7	5%	0.053	40%	0.395	C	S	.	.	H	α-helix	trans	-66.3	-39.8	176.3	178.6	-100.1	0	0	0	112.3	L746 A800 E820 L821 D822 Q827 I828	L746-F824 HydrophobicContact CB-CE1 4.02Å; L746-F824 HydrophobicContact CB-CE2 4.39Å; L746-F824 HydrophobicContact CB-CZ 3.88Å; L746-F824 HydrophobicContact CD1-CD1 4.4Å; L746-F824 HydrophobicContact CD1-CE1 4.14Å; L746-F824 HydrophobicContact CD2-CE1 4.43Å; L746-F824 HydrophobicContact CG-CE1 4.46Å; A800-F824 HydrophobicContact CB-CD1 4.49Å; E820-F824 PolarHBondContact O-N 3.13Å; L821-F824 PolarHBondContact O-N 3.29Å; D822-F824 VanDerWaalsContact C-N 3.3Å; D822-F824 PolarHBondContact O-N 3.08Å; F824-Q827 PolarHBondContact O-N 2.91Å; F824-I828 HydrophobicContact CD1-CD1 3.91Å; F824-I828 HydrophobicContact CE1-CD1 3.29Å; F824-I828 HydrophobicContact CE1-CG1 4.32Å; F824-I828 HydrophobicContact CE2-CD1 4.39Å; F824-I828 HydrophobicContact CZ-CD1 3.58Å; F824-I828 HydrophobicContact CZ-CG1 4.39Å; F824-I828 PolarHBondContact O-N 3.29Å; F824-I828 VanDerWaalsContact O-N 3.1Å
825	I	70.5	Confident	58.5	Low	22 Å²	22	79.9 Å²	79.9	11%	0.113	40%	0.396	C	S	.	.	H	α-helix	trans	-65.5	-44.3	175.9	-72.4	175.9	0	0	0	110.6	Y797 A800 K801 I804 L821 D822 Q827 I828 D829	Y797-I825 HydrophobicContact CD2-CG2 4.02Å; Y797-I825 HydrophobicContact CE2-CG2 3.65Å; A800-I825 HydrophobicContact CB-CD1 4.07Å; A800-I825 HydrophobicContact CB-CG1 3.95Å; K801-I825 HydrophobicContact CB-CD1 4.48Å; I804-I825 HydrophobicContact CD1-CD1 3.32Å; I804-I825 HydrophobicContact CD1-CG1 4.46Å; I804-I825 HydrophobicContact CG1-CD1 4.44Å; L821-I825 VanDerWaalsContact O-CG1 3.32Å; L821-I825 WeakPolarHBondContact O-CG1 3.19Å; L821-I825 PolarHBondContact O-N 2.77Å; D822-I825 PolarHBondContact O-N 3.26Å; D822-I825 VanDerWaalsContact O-N 3.15Å; I825-Q827 VanDerWaalsContact C-N 3.28Å; I825-Q827 PolarHBondContact O-N 3.03Å; I825-I828 PolarHBondContact O-N 3.47Å; I825-D829 PolarHBondContact O-N 2.68Å
826	E	71	Confident	57.3	Low	133 Å²	133	78.2 Å²	78.2	62%	0.621	40%	0.402	S	S	*	.	H	α-helix	trans	-59.3	-39.5	174.3	-74.1	-167.7	169.4	0	0	111.7	D822 D823 I828 D829 T830	D822-E826 PolarHBondContact O-N 3.08Å; D823-E826 PolarHBondContact O-N 2.93Å; E826-I828 VanDerWaalsContact C-N 3.3Å; E826-I828 PolarHBondContact O-N 2.96Å; E826-D829 PolarHBondContact O-N 2.84Å; E826-T830 WeakPolarHBondContact O-CB 3.49Å; E826-T830 VanDerWaalsContact O-CG2 3.3Å; E826-T830 WeakPolarHBondContact O-CG2 3.34Å; E826-T830 PolarHBondContact O-N 3.48Å; E826-T830 PolarHBondContact O-OG1 3.43Å
827	Q	66.4	Low	56.1	Low	99 Å²	99	78.9 Å²	78.9	46%	0.463	41%	0.409	S	S	.	.	H	α-helix	trans	-66.2	-27.1	174.6	-75.2	178.6	33.6	0	0	113.9	R754 D823 F824 I825 T830 T831	R754-Q827 PolarHBondContact NH2-O 2.93Å; D823-Q827 VanDerWaalsContact O-CG 3.29Å; D823-Q827 WeakPolarHBondContact O-CG 3.38Å; D823-Q827 PolarHBondContact O-N 3.14Å; F824-Q827 PolarHBondContact O-N 2.91Å; I825-Q827 VanDerWaalsContact C-N 3.28Å; I825-Q827 PolarHBondContact O-N 3.03Å; Q827-T830 WeakPolarHBondContact CA-OG1 3.16Å; Q827-T830 PolarHBondContact O-OG1 3.09Å; Q827-T830 VanDerWaalsContact O-OG1 3.08Å; Q827-T831 WeakPolarHBondContact O-CG2 3.5Å
828	I	64.2	Low	54.9	Low	2 Å²	2	81.1 Å²	81.1	1%	0.01	43%	0.433	C	S	.	.	H	α-helix	trans	-80.4	-42.2	173.3	-66.8	173.5	0	0	0	110.1	L796 Y797 F824 I825 E826 T830 T831 R832	L796-I828 HydrophobicContact CB-CD1 4.31Å; Y797-I828 HydrophobicContact CD2-CG2 4.39Å; F824-I828 HydrophobicContact CD1-CD1 3.91Å; F824-I828 HydrophobicContact CE1-CD1 3.29Å; F824-I828 HydrophobicContact CE1-CG1 4.32Å; F824-I828 HydrophobicContact CE2-CD1 4.39Å; F824-I828 HydrophobicContact CZ-CD1 3.58Å; F824-I828 HydrophobicContact CZ-CG1 4.39Å; F824-I828 PolarHBondContact O-N 3.29Å; F824-I828 VanDerWaalsContact O-N 3.1Å; I825-I828 PolarHBondContact O-N 3.47Å; E826-I828 VanDerWaalsContact C-N 3.3Å; E826-I828 PolarHBondContact O-N 2.96Å; I828-T830 PolarHBondContact O-N 2.98Å; I828-T831 PolarHBondContact O-N 2.87Å; I828-T831 VanDerWaalsContact O-N 3.13Å; I828-T831 PolarHBondContact O-OG1 3.32Å; I828-R832 WeakPolarHBondContact O-CG 3.18Å; I828-R832 PolarHBondContact O-N 3.03Å; I828-R832 VanDerWaalsContact O-N 3.17Å
829	D	63.8	Low	53.5	Low	58 Å²	58	88.4 Å²	88.4	31%	0.31	47%	0.473	S	S	.	.	H	α-helix	trans	-66.4	-36.4	-179.7	-83.9	-15.4	0	0	0	112.9	Y797 I825 E826 T831 R832 T833	Y797-D829 WeakPolarHBondContact CE2-OD1 3.42Å; Y797-D829 WeakPolarHBondContact CE2-OD2 3.47Å; I825-D829 PolarHBondContact O-N 2.68Å; E826-D829 PolarHBondContact O-N 2.84Å; D829-T831 VanDerWaalsContact C-N 3.31Å; D829-T831 PolarHBondContact O-N 3.13Å; D829-R832 PolarHBondContact O-N 2.98Å; D829-R832 VanDerWaalsContact O-N 3.15Å; D829-T833 PolarHBondContact O-N 3.22Å; D829-T833 PolarHBondContact O-OG1 3.45Å
830	T	60.2	Low	52.1	Low	84 Å²	84	93.5 Å²	93.5	52%	0.515	49%	0.492	S	S	.	.	H	α-helix	trans	-60.1	-40	170.4	47.4	0	0	0	0	111.7	E826 Q827 I828 R832 T833	E826-T830 WeakPolarHBondContact O-CB 3.49Å; E826-T830 VanDerWaalsContact O-CG2 3.3Å; E826-T830 WeakPolarHBondContact O-CG2 3.34Å; E826-T830 PolarHBondContact O-N 3.48Å; E826-T830 PolarHBondContact O-OG1 3.43Å; Q827-T830 WeakPolarHBondContact CA-OG1 3.16Å; Q827-T830 PolarHBondContact O-OG1 3.09Å; Q827-T830 VanDerWaalsContact O-OG1 3.08Å; I828-T830 PolarHBondContact O-N 2.98Å; T830-R832 VanDerWaalsContact C-N 3.3Å; T830-R832 PolarHBondContact O-N 2.91Å; T830-T833 PolarHBondContact O-N 2.86Å; T830-T833 PolarHBondContact O-OG1 3.36Å; T830-T833 VanDerWaalsContact O-OG1 3.1Å
831	T	56.7	Low	50.9	Low	60 Å²	60	95 Å²	95	37%	0.368	50%	0.504	S	S	.	.	H	α-helix	trans	-72.7	-16.8	176.3	61	0	0	0	0	114.8	Q827 I828 D829	Q827-T831 WeakPolarHBondContact O-CG2 3.5Å; I828-T831 PolarHBondContact O-N 2.87Å; I828-T831 VanDerWaalsContact O-N 3.13Å; I828-T831 PolarHBondContact O-OG1 3.32Å; D829-T831 VanDerWaalsContact C-N 3.31Å; D829-T831 PolarHBondContact O-N 3.13Å
832	R	54.4	Low	49.4	Very low	106 Å²	106	100.8 Å²	100.8	40%	0.4	54%	0.539	S	S	.	.	H	α-helix	trans	-84.9	-18.3	175.2	-67.2	176.3	89	168.3	6.4	113	H794 I828 D829 T830	H794-R832 PolarHBondContact CE1-NH1 2.93Å; H794-R832 PolarHBondContact CE1-NH2 3.4Å; H794-R832 VanDerWaalsContact CG-NH2 3.32Å; H794-R832 PolarHBondContact ND1-NH1 2.67Å; H794-R832 PolarHBondContact ND1-NH2 3.24Å; I828-R832 WeakPolarHBondContact O-CG 3.18Å; I828-R832 PolarHBondContact O-N 3.03Å; I828-R832 VanDerWaalsContact O-N 3.17Å; D829-R832 PolarHBondContact O-N 2.98Å; D829-R832 VanDerWaalsContact O-N 3.15Å; T830-R832 VanDerWaalsContact C-N 3.3Å; T830-R832 PolarHBondContact O-N 2.91Å
833	T	43.8	Very low	47.8	Very low	104 Å²	104	106.4 Å²	106.4	64%	0.638	57%	0.567	S	S	*	*	S	Bend	trans	-102.2	2.3	-170.2	44.4	0	0	0	0	114.8	D829 T830 P835	D829-T833 PolarHBondContact O-N 3.22Å; D829-T833 PolarHBondContact O-OG1 3.45Å; T830-T833 PolarHBondContact O-N 2.86Å; T830-T833 PolarHBondContact O-OG1 3.36Å; T830-T833 VanDerWaalsContact O-OG1 3.1Å; T833-P835 VanDerWaalsContact C-CD 3.45Å; T833-P835 WeakPolarHBondContact O-CD 3.48Å
834	E	31.6	Very low	46.2	Very low	178 Å²	178	107.9 Å²	107.9	83%	0.832	58%	0.582	S	S	*	*			trans	-97	95.6	173.5	-71.7	-171.4	164.8	0	0	113.5
835	P	31.6	Very low	45	Very low	100 Å²	100	112.2 Å²	112.2	65%	0.649	62%	0.62	S	S	*	*			trans	-108.2	112.4	151.7	34.1	-24.3	0	0	0	110.3	T833 I837	T833-P835 VanDerWaalsContact C-CD 3.45Å; T833-P835 WeakPolarHBondContact O-CD 3.48Å; P835-I837 PolarHBondContact O-N 3.24Å
836	N	29.2	Very low	43.4	Very low	166 Å²	166	117.5 Å²	117.5	89%	0.888	65%	0.653	S	S	*	*			trans	31	79	151.6	-66.7	-41.8	0	0	0	118.2
837	I	32.6	Very low	41.7	Very low	161 Å²	161	116.4 Å²	116.4	83%	0.826	66%	0.66	S	S	*	*			trans	-139.7	97.3	153.8	-57.1	-178.3	0	0	0	111	P835	P835-I837 PolarHBondContact O-N 3.24Å
838	C	29.7	Very low	40.3	Very low	117 Å²	117	120.9 Å²	120.9	79%	0.791	68%	0.681	S	S	*	*			trans	34.4	124.5	140.9	-64.4	0	0	0	0	122.5
839	N	28.4	Very low	39	Very low	159 Å²	159	133.7 Å²	133.7	85%	0.85	74%	0.741	S	S	*	*			trans	4.2	118.1	133.7	-72.4	-17.2	0	0	0	117.1
840	M	33.1	Very low	37.7	Very low	165 Å²	165	137.5 Å²	137.5	81%	0.813	76%	0.762	S	S	*	*				169.2	116.2	120.4	-89	-84	-162.3	0	0	110.8
841	N	34.6	Very low	36.5	Very low	136 Å²	136	140.3 Å²	140.3	73%	0.727	78%	0.775	S	S	*	*			trans	55	108	138.5	-63.4	-10.3	0	0	0	121.9
842	T	33.5	Very low	35.4	Very low	122 Å²	122	144.7 Å²	144.7	75%	0.748	80%	0.798	S	S	*	*				36.4	120.1	122.6	26.7	0	0	0	0	120.3
843	I	34.6	Very low	34.3	Very low	159 Å²	159	147 Å²	147	82%	0.815	82%	0.821	S	S	*	*				179.1	135.6	109	-82.6	150.4	0	0	0	108.3
844	P	35.7	Very low	33.7	Very low	123 Å²	123	149.7 Å²	149.7	80%	0.799	83%	0.833	S	S	*	*			trans	-92.6	144.1	-177.7	35.7	-30.5	0	0	0	112.4
845	A	38.8	Very low	33.9	Very low	102 Å²	102	147.8 Å²	147.8	84%	0.843	83%	0.833	S	S	*	*			trans	-144.2	124.6	166.6	0	0	0	0	0	111.8
846	V	36.7	Very low	34	Very low	133 Å²	133	151.2 Å²	151.2	81%	0.806	85%	0.846	S	S	*	*			trans	-48.4	142.5	169.3	174.2	0	0	0	0	113.9
847	S	36.8	Very low	34.4	Very low	111 Å²	111	150.1 Å²	150.1	78%	0.776	84%	0.843	S	S	*	*			trans	-178.8	105.9	145.9	-67.2	0	0	0	0	108
848	Q	35.9	Very low	34.5	Very low	192 Å²	192	149.2 Å²	149.2	90%	0.897	84%	0.844	S	S	*	*				53.5	96	98.2	-88.3	-174.8	-22.7	0	0	115.4
849	E	36.9	Very low	35	Very low	271 Å²	271	152.1 Å²	152.1	100%	1.266	85%	0.849	S	S	*	*				-149.2	0	124	-107.1	179.9	-173.3	0	0	108.8

Retrieved 849 of 849 residues in 1708 ms (Link to these results)

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