A0A087XKJ6_POEFO Loading...

EvC ciliary complex subunit 1

AlphaFold DB , UniProt , Accession A0A087XKJ6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 916 aa.

						>A0A087XKJ6_POEFO|A0A087XKJ6
MKPLLLTRQVYNARRLLEPDIGNIDYNQSDCVSNREKEAPGGSANDKEKKRPPMNSDVAAFASRAKVVYPINQKYRPLADGASNPSLHEQSKLPPMPNEDSSSDGESLSQEQDNNDSSQFLSNMELPKSLQNQSFTRVFHYPDTLTHTGFEGRISLYCLALQEVQQRSFQLQEEKNLIFLQMLKVIFSSRFPKDKNDADFAKDTLLMQEKKLNELRKPLATGQTTKETIQDASCSLEEIERAQKDLLERNLQTSKSFSSQLEDLCQLLLRRRSGFSPEEAHDDILSVVQTLLSAEEHLTTLQEADLKRTLERLLWWEELSGLVQSQPALLRWEVTLRMGLIATRLEQLTNGKSSKLNPAETILSEIQAALTEGLQRSTEECTKKTRELAAEKCRKKESKKKKLQKSQMNERSKALELGLTRCDLQEQTSIYQELLMRQRKQISDLELHQDNKIAEALCSLWKKLRALWSNRLSEIARDIFLASVPTQLSLTTERCESLWLEVEQELADELQQAESTARQQLDDIRTELEKDQQVWIEGMALGQCCLKHLGEQQMEIIQAMVARQSYTLSSDMGKLIEKKHKHLSLLMERSFTVRHFSLQMLKEMRLSKLKVFSQTDFRALLAEEPSKTQPCVDSALKNSRASLAERHLGPESKLLENNLQQEFLSELEAATELLQSHAQLALGNALSHAIHHKMEAVPTQSQSSSKHDPSLKHHLTEAAAESVYLTKDSLRALVHIYYSDLRDISSNLQLDQSNLNHEMNKRKDGRSQLSRALLRELMNWGKRPASAEFQQRVELNKKTLLEQSHLDQERIYEELRKKKVELDQNMERIKAQLMEAEESFITELAAVARVSVHSADQKSSSEEDNSAGEQSTKILDLLALNPALDPALNPSLTPLFATPVVKSKPKKKEERESHLS
					

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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	26	Very low	29.8	Very low	220 Å²	220	141.5 Å²	141.5	100%	1.084	71%	0.708	S	S	*	*				0	122.7	0	-40.1	-43.3	-93.1	0	0	108.6
2	K	29.2	Very low	30.4	Very low	199 Å²	199	135.8 Å²	135.8	87%	0.865	68%	0.682	S	S	*	*				29.5	141.7	-55.2	-55.9	173.8	-178.4	175.3	0	118
3	P	32.2	Very low	30.9	Very low	113 Å²	113	127.2 Å²	127.2	73%	0.734	64%	0.644	S	S	*	*			cis	-103	178.7	-1.8	40.1	-32.9	0	0	0	112.5
4	L	24.2	Very low	31.3	Very low	156 Å²	156	128.6 Å²	128.6	82%	0.817	64%	0.638	S	S	*	*	S	Bend	trans	175.6	-24.2	132.7	-99	164.2	0	0	0	114.5	L6	L4-L6 PolarHBondContact O-N 3.37Å
5	L	25.6	Very low	31.9	Very low	171 Å²	171	131.3 Å²	131.3	90%	0.895	64%	0.638	S	S	*	*			trans	-101.4	72.3	-178	-66.4	175	0	0	0	112.3
6	L	26.7	Very low	32.5	Very low	122 Å²	122	128.6 Å²	128.6	64%	0.639	63%	0.626	S	S	*	*			trans	-144.6	54.4	-177.8	-113.4	171.2	0	0	0	113.3	L4 Q9	L4-L6 PolarHBondContact O-N 3.37Å; L6-Q9 HydrophobicContact CD2-CB 4.09Å
7	T	28.2	Very low	32.8	Very low	138 Å²	138	127.7 Å²	127.7	85%	0.847	63%	0.625	S	S	*	*	S	Bend	trans	-118.4	-0.4	178.1	42.8	0	0	0	0	114.6
8	R	32.8	Very low	33	Very low	209 Å²	209	127.1 Å²	127.1	79%	0.789	62%	0.62	S	S	*	*	S	Bend	trans	-129.5	17.2	-178.2	-139.1	178.6	-173.3	-172.2	0.4	115.2
9	Q	31.6	Very low	33	Very low	101 Å²	101	126.8 Å²	126.8	47%	0.472	63%	0.629	S	S	.	*	S	Bend	trans	-115.5	5.7	178.8	-68.6	-165.2	5.8	0	0	114.8	L6	L6-Q9 HydrophobicContact CD2-CB 4.09Å
10	V	37.8	Very low	33	Very low	69 Å²	69	128.3 Å²	128.3	42%	0.418	64%	0.639	S	S	.	*	S	Bend	trans	-97.1	-21.8	-172.4	-159.3	0	0	0	0	113.3	L447	V10-L447 HydrophobicContact CG1-CD1 4.24Å; V10-L447 HydrophobicContact CG1-CD2 3.83Å; V10-L447 HydrophobicContact CG1-CG 4.26Å
11	Y	33.3	Very low	32.8	Very low	59 Å²	59	130.8 Å²	130.8	23%	0.231	65%	0.653	C	S	.	*	S	Bend	trans	-113.3	100.4	163.6	-68.5	-66.3	0	0	0	107.9	W315 L447	Y11-W315 HydrophobicContact CD1-CB 3.99Å; Y11-W315 AromaticContact CD1-CD1 3.87Å; Y11-W315 AromaticContact CD1-CD2 3.54Å; Y11-W315 HydrophobicContact CD1-CD2 3.54Å; Y11-W315 AromaticContact CD1-CE2 3.92Å; Y11-W315 HydrophobicContact CD1-CE3 4.07Å; Y11-W315 AromaticContact CD1-CG 3.49Å; Y11-W315 HydrophobicContact CD1-CG 3.49Å; Y11-W315 VanDerWaalsContact CD1-CG 3.49Å; Y11-W315 HydrophobicContact CE1-CB 4.35Å; Y11-W315 AromaticContact CE1-CD2 3.71Å; Y11-W315 HydrophobicContact CE1-CD2 3.71Å; Y11-W315 AromaticContact CE1-CE3 3.72Å; Y11-W315 HydrophobicContact CE1-CE3 3.72Å; Y11-W315 HydrophobicContact CE1-CG 4Å; Y11-W315 HydrophobicContact CE1-CZ3 4.29Å; Y11-W315 HydrophobicContact CG-CG 4.29Å; Y11-L447 HydrophobicContact CD1-CD1 4.43Å; Y11-L447 HydrophobicContact CE1-CD1 3.69Å; Y11-L447 HydrophobicContact CE2-CD1 4.04Å; Y11-L447 VanDerWaalsContact CZ-CD1 3.48Å
12	N	37	Very low	32.9	Very low	73 Å²	73	123.4 Å²	123.4	39%	0.39	63%	0.634	S	S	.	*			trans	-160.5	88.6	178.7	-160	-70.2	0	0	0	109.5	R14 R15	N12-R14 PolarHBondContact O-N 2.96Å; N12-R14 WeakPolarHBondContact OD1-CB 3.32Å; N12-R15 PolarHBondContact O-N 2.71Å
13	A	36.9	Very low	32.9	Very low	23 Å²	23	121.5 Å²	121.5	19%	0.19	63%	0.633	C	S	.	*	G	3₁₀ helix	trans	-63.1	-28.3	-174.5	0	0	0	0	0	113	R15 L16 E318	A13-R15 PolarHBondContact O-N 3.09Å; A13-L16 WeakPolarHBondContact O-CB 3.41Å; A13-L16 PolarHBondContact O-N 3.29Å; A13-E318 WeakPolarHBondContact CB-OE1 3.15Å
14	R	37.3	Very low	32.7	Very low	148 Å²	148	124.4 Å²	124.4	56%	0.558	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-49.8	-25.5	175.6	-121.1	178.6	-174.2	-158.1	3.7	114.2	N12 L16 D522	N12-R14 PolarHBondContact O-N 2.96Å; N12-R14 WeakPolarHBondContact OD1-CB 3.32Å; R14-L16 VanDerWaalsContact C-N 3.33Å; R14-L16 PolarHBondContact O-N 3.29Å; R14-D522 IonicContact CZ-OD2 3.55Å; R14-D522 IonicContact NE-OD1 3.18Å; R14-D522 IonicContact NE-OD2 2.64Å; R14-D522 PolarHBondContact NE-OD2 3.43Å; R14-D522 IonicContact NH2-OD2 2.76Å; R14-D522 PolarHBondContact NH2-OD2 2.81Å
15	R	39.7	Very low	32.8	Very low	168 Å²	168	124 Å²	124	63%	0.634	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-76.4	-8.2	175.7	-84.3	-170.3	174.5	160.5	2.4	115.7	N12 A13	N12-R15 PolarHBondContact O-N 2.71Å; A13-R15 PolarHBondContact O-N 3.09Å
16	L	42	Very low	32.9	Very low	88 Å²	88	124.6 Å²	124.6	46%	0.461	63%	0.631	S	S	.	*	G	3₁₀ helix	trans	-88	-18	-178.8	-72.2	166.3	0	0	0	113.7	A13 R14 E455	A13-L16 WeakPolarHBondContact O-CB 3.41Å; A13-L16 PolarHBondContact O-N 3.29Å; R14-L16 VanDerWaalsContact C-N 3.33Å; R14-L16 PolarHBondContact O-N 3.29Å; L16-E455 HydrophobicContact CD2-CG 4.5Å
17	L	37.4	Very low	32.8	Very low	114 Å²	114	126.5 Å²	126.5	60%	0.597	64%	0.642	S	S	*	*	S	Bend	trans	-160.2	120	168.5	-75.4	-177.8	0	0	0	109	K462	L17-K462 VanDerWaalsContact CG-NZ 3.29Å
18	E	36.1	Very low	32.8	Very low	116 Å²	116	128.1 Å²	128.1	54%	0.542	64%	0.64	S	S	.	*			trans	138.4	152	147	-77.2	-172.3	130.8	0	0	115.6	R518	E18-R518 WeakPolarHBondContact OE1-CD 3.25Å; E18-R518 IonicContact OE1-CZ 3.94Å; E18-R518 IonicContact OE1-NE 2.69Å; E18-R518 IonicContact OE1-NH1 3.55Å; E18-R518 PolarHBondContact OE1-NH1 3.08Å; E18-R518 WeakPolarHBondContact OE2-CD 3.42Å
19	P	32.2	Very low	32.4	Very low	122 Å²	122	123.9 Å²	123.9	79%	0.792	64%	0.642	S	S	*	*			trans	-90.5	174.3	176.8	37.7	-35.4	0	0	0	113.7
20	D	34	Very low	32	Very low	156 Å²	156	125.9 Å²	125.9	83%	0.834	66%	0.656	S	S	*	*			trans	-73.3	174	-175.4	-83.2	-57.4	0	0	0	116.1
21	I	28.6	Very low	31.4	Very low	181 Å²	181	128.3 Å²	128.3	93%	0.928	68%	0.675	S	S	*	*			trans	90.3	131.9	179.7	-50.9	158.5	0	0	0	112.6
22	G	28.5	Very low	30.9	Very low	66 Å²	66	132.2 Å²	132.2	68%	0.68	70%	0.704	S	S	*	*			cis	177.6	152.3	-5.8	0	0	0	0	0	111.7
23	N	28.2	Very low	30.3	Very low	159 Å²	159	133.1 Å²	133.1	85%	0.85	72%	0.716	S	S	*	*			trans	-65	153.9	-172.6	-60.8	-3.1	0	0	0	114.8
24	I	28.1	Very low	29.7	Very low	173 Å²	173	138.8 Å²	138.8	89%	0.887	74%	0.744	S	S	*	*			trans	-162.4	157.5	132	-103.7	153.5	0	0	0	110.8
25	D	27	Very low	29.1	Very low	147 Å²	147	140.8 Å²	140.8	79%	0.786	75%	0.751	S	S	*	*			trans	-92.2	167.5	-158	-85.8	-67	0	0	0	118.2
26	Y	27.9	Very low	28.4	Very low	184 Å²	184	138.6 Å²	138.6	72%	0.722	75%	0.748	S	S	*	*			trans	-59.3	167.2	173	-76.8	-91.1	0	0	0	116
27	N	25	Very low	27.6	Very low	163 Å²	163	140.8 Å²	140.8	87%	0.872	75%	0.754	S	S	*	*			trans	-151.2	160.7	133.2	-106.5	-65.8	0	0	0	112.9
28	Q	26.8	Very low	26.9	Very low	172 Å²	172	143.1 Å²	143.1	80%	0.804	76%	0.762	S	S	*	*			trans	-112.8	164.7	-171.8	-54.2	166.6	-78.3	0	0	112.5
29	S	24.8	Very low	26.2	Very low	119 Å²	119	142 Å²	142	83%	0.832	77%	0.772	S	S	*	*			trans	-165.6	147.8	143.3	59.1	0	0	0	0	113.3
30	D	24.2	Very low	26.7	Very low	144 Å²	144	142.4 Å²	142.4	77%	0.77	78%	0.775	S	S	*	*			trans	-95.8	-175.9	-171.5	-59.7	-82	0	0	0	116.5
31	C	24.5	Very low	26.2	Very low	119 Å²	119	138.9 Å²	138.9	80%	0.804	78%	0.776	S	S	*	*			trans	121.7	110.5	154.7	-60.7	0	0	0	0	113.4
32	V	23.5	Very low	26	Very low	141 Å²	141	133.6 Å²	133.6	86%	0.855	77%	0.765	S	S	*	*				76.4	118.5	52.7	178.1	0	0	0	0	113.8
33	S	24.7	Very low	25.9	Very low	92 Å²	92	135.2 Å²	135.2	64%	0.643	77%	0.767	S	S	*	*				153	119.8	127.6	-170.2	0	0	0	0	115.7
34	N	23.5	Very low	25.8	Very low	143 Å²	143	130.5 Å²	130.5	77%	0.765	75%	0.749	S	S	*	*			trans	63.4	164.1	142.5	-66.7	-18.3	0	0	0	120
35	R	24.5	Very low	25.8	Very low	190 Å²	190	125.8 Å²	125.8	72%	0.717	73%	0.726	S	S	*	*			cis	-160	160.1	5.3	-138	172.9	162.7	172.7	-11.5	112.5
36	E	24.3	Very low	25.8	Very low	121 Å²	121	121 Å²	121	57%	0.565	70%	0.701	S	S	*	*			trans	34.1	151.6	140	-77.6	169.9	-132.4	0	0	121.9
37	K	25.7	Very low	25.9	Very low	135 Å²	135	116.9 Å²	116.9	59%	0.587	69%	0.686	S	S	*	*			cis	-172.9	158.2	27.1	-131.8	160.7	174.8	-80.7	0	114.1
38	E	22.8	Very low	26	Very low	162 Å²	162	115.4 Å²	115.4	76%	0.757	67%	0.674	S	S	*	*			trans	68.1	165.1	146.2	-85.3	146.4	-169.5	0	0	124
39	A	21.5	Very low	25.9	Very low	92 Å²	92	114.9 Å²	114.9	76%	0.76	67%	0.669	S	S	*	*			trans	-155.1	-149.8	-162.2	0	0	0	0	0	109.1
40	P	42.3	Very low	25.9	Very low	131 Å²	131	118.7 Å²	118.7	85%	0.851	67%	0.671	S	S	*	*			cis	-142	-174.3	-11.8	43.7	-24.9	0	0	0	116.9
41	G	23.6	Very low	26	Very low	83 Å²	83	122.4 Å²	122.4	86%	0.856	67%	0.674	S	S	*	*			trans	116.5	146.6	151.3	0	0	0	0	0	117.3
42	G	25.5	Very low	26.8	Very low	69 Å²	69	122.5 Å²	122.5	71%	0.711	67%	0.673	S	S	*	*			cis	171.9	146	-9.7	0	0	0	0	0	113.8
43	S	25	Very low	27.5	Very low	101 Å²	101	121.7 Å²	121.7	71%	0.706	67%	0.671	S	S	*	*			trans	54.3	117.1	176.6	54.1	0	0	0	0	118.1
44	A	26.7	Very low	27.5	Very low	59 Å²	59	124.7 Å²	124.7	49%	0.488	68%	0.677	S	S	.	*			cis	97.4	172.6	37.9	0	0	0	0	0	113.7	L87 H88	A44-L87 WeakPolarHBondContact CB-O 3.29Å; A44-H88 CarbonylContact C-O 3.58Å; A44-H88 HydrophobicContact CB-CB 4.24Å; A44-H88 WeakPolarHBondContact CB-O 3.2Å
45	N	27.5	Very low	27.7	Very low	74 Å²	74	124.9 Å²	124.9	40%	0.396	68%	0.678	S	S	.	*			trans	-165.2	-169.1	-159.2	-34.4	-23.8	0	0	0	116.5	H88 E89 Q90	N45-H88 CarbonylContact C-O 3.55Å; N45-H88 PolarHBondContact N-O 3.02Å; N45-H88 CarbonylContact O-C 3.51Å; N45-H88 PolarHBondContact OD1-ND1 3.3Å; N45-H88 PolarHBondContact OD1-O 2.94Å; N45-E89 PolarHBondContact O-N 3.21Å; N45-E89 WeakPolarHBondContact OD1-CA 3.31Å; N45-E89 PolarHBondContact OD1-N 3.42Å; N45-Q90 VanDerWaalsContact CB-C 3.4Å; N45-Q90 WeakPolarHBondContact CB-O 3.5Å; N45-Q90 VanDerWaalsContact CG-C 3.49Å; N45-Q90 PolarHBondContact ND2-O 3.04Å; N45-Q90 PolarHBondContact OD1-N 3.35Å
46	D	27.8	Very low	27.9	Very low	47 Å²	47	120.9 Å²	120.9	25%	0.251	68%	0.679	S	S	.	*			trans	-142.1	161.1	-152.8	-157.2	30.4	0	0	0	123.4	Q90	D46-Q90 VanDerWaalsContact CB-C 3.49Å; D46-Q90 VanDerWaalsContact CB-CA 3.4Å
47	K	29.2	Very low	28.7	Very low	97 Å²	97	121.6 Å²	121.6	42%	0.422	69%	0.687	S	S	.	*			trans	10.7	114.6	158.8	-80.9	168	-161.6	60.7	0	127	E89	K47-E89 IonicContact NZ-OE1 3.85Å; K47-E89 PolarHBondContact NZ-OE1 2.9Å; K47-E89 IonicContact NZ-OE2 3.61Å; K47-E89 PolarHBondContact NZ-OE2 3.09Å
48	E	26.6	Very low	29.5	Very low	132 Å²	132	121.3 Å²	121.3	62%	0.617	70%	0.696	S	S	*	*				70.7	135.6	106	-77.5	-163.2	106.7	0	0	125.3
49	K	25.3	Very low	30.1	Very low	161 Å²	161	117.4 Å²	117.4	70%	0.7	69%	0.691	S	S	*	*			trans	84.1	150.2	153.4	-68.9	147	-179.7	145.7	0	116.1
50	K	24.2	Very low	31.2	Very low	199 Å²	199	115.9 Å²	115.9	87%	0.865	68%	0.679	S	S	*	*			cis	-148.2	176.3	11.3	-143.2	174.7	-178.1	-179.5	0	114
51	R	27.2	Very low	31	Very low	222 Å²	222	118.9 Å²	118.9	84%	0.838	68%	0.679	S	S	*	*			trans	-94.9	176	171.2	-75.8	-176.9	-178.5	-179.9	0.1	110.9
52	P	40.3	Very low	32.1	Very low	121 Å²	121	118.9 Å²	118.9	79%	0.786	67%	0.67	S	S	*	*			cis	-141.4	-165.3	31.7	43	-20.2	0	0	0	114.5
53	P	38.1	Very low	32.7	Very low	124 Å²	124	120.1 Å²	120.1	81%	0.805	67%	0.668	S	S	*	*			cis	-132	-166.4	8.9	43.3	-23.3	0	0	0	117.6
54	M	26.6	Very low	33.4	Very low	156 Å²	156	126.1 Å²	126.1	77%	0.768	68%	0.675	S	S	*	*			trans	-114.1	167.6	-168.5	-60.5	161.5	55.9	0	0	110.5
55	N	27.1	Very low	33.8	Very low	147 Å²	147	127.1 Å²	127.1	79%	0.786	68%	0.683	S	S	*	*				-167.7	155.2	68.6	-91.7	-25.2	0	0	0	113.3
56	S	29	Very low	34.3	Very low	105 Å²	105	132.9 Å²	132.9	73%	0.734	71%	0.705	S	S	*	*			trans	-157.1	141.3	157.6	-174.7	0	0	0	0	110.2	V58	S56-V58 PolarHBondContact O-N 3.33Å
57	D	41.2	Very low	34.6	Very low	137 Å²	137	135.8 Å²	135.8	73%	0.733	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	11.3	-148.8	-74.1	-60.8	0	0	0	118.9	A59 A60	D57-A59 VanDerWaalsContact C-N 3.27Å; D57-A59 PolarHBondContact O-N 3.38Å; D57-A60 PolarHBondContact O-N 2.76Å
58	V	41	Very low	34.9	Very low	129 Å²	129	137 Å²	137	78%	0.782	74%	0.739	S	S	*	*	H	α-helix	trans	-62.8	-32.2	-176.9	-175.5	0	0	0	0	112.7	S56 A60	S56-V58 PolarHBondContact O-N 3.33Å; V58-A60 VanDerWaalsContact C-N 3.3Å; V58-A60 PolarHBondContact O-N 2.95Å
59	A	36.8	Very low	35.2	Very low	79 Å²	79	140 Å²	140	65%	0.653	75%	0.746	S	S	*	*	H	α-helix	trans	-70.7	-20	-178.4	0	0	0	0	0	114.4	D57 F61	D57-A59 VanDerWaalsContact C-N 3.27Å; D57-A59 PolarHBondContact O-N 3.38Å; A59-F61 PolarHBondContact O-N 2.74Å
60	A	43.3	Very low	35.7	Very low	61 Å²	61	138 Å²	138	50%	0.504	75%	0.75	S	S	.	*	H	α-helix	trans	-66.2	-39.4	-175.3	0	0	0	0	0	112.3	D57 V58 S63	D57-A60 PolarHBondContact O-N 2.76Å; V58-A60 VanDerWaalsContact C-N 3.3Å; V58-A60 PolarHBondContact O-N 2.95Å; A60-S63 PolarHBondContact O-N 3.2Å; A60-S63 PolarHBondContact O-OG 3.1Å
61	F	38.6	Very low	36.3	Very low	194 Å²	194	135.2 Å²	135.2	85%	0.851	74%	0.743	S	S	*	*	H	α-helix	trans	-68.6	-40.8	-175.3	-168.1	-102.2	0	0	0	112.9	A59 S63	A59-F61 PolarHBondContact O-N 2.74Å; F61-S63 PolarHBondContact O-N 3.37Å; F61-S63 VanDerWaalsContact O-N 3.17Å
62	A	47.3	Very low	36.5	Very low	82 Å²	82	132.6 Å²	132.6	68%	0.678	75%	0.746	S	S	*	*	H	α-helix	trans	-63.6	-21.5	-179.9	0	0	0	0	0	113.7	R64	A62-R64 VanDerWaalsContact C-N 3.33Å; A62-R64 PolarHBondContact O-N 2.69Å
63	S	37.6	Very low	36.5	Very low	95 Å²	95	134.9 Å²	134.9	66%	0.664	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-9.3	-172.3	73.2	0	0	0	0	116	A60 F61	A60-S63 PolarHBondContact O-N 3.2Å; A60-S63 PolarHBondContact O-OG 3.1Å; F61-S63 PolarHBondContact O-N 3.37Å; F61-S63 VanDerWaalsContact O-N 3.17Å
64	R	39.8	Very low	36.5	Very low	227 Å²	227	137.9 Å²	137.9	86%	0.857	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.3	-5.8	-172.2	-79.2	-177.1	166.1	178.1	-4.2	116.4	A62 K66	A62-R64 VanDerWaalsContact C-N 3.33Å; A62-R64 PolarHBondContact O-N 2.69Å; R64-K66 PolarHBondContact O-N 3.14Å
65	A	35.5	Very low	37	Very low	80 Å²	80	141 Å²	141	66%	0.661	75%	0.751	S	S	*	*			trans	-80.4	79.8	179.9	0	0	0	0	0	112.6	V67	A65-V67 VanDerWaalsContact C-N 3.33Å; A65-V67 PolarHBondContact O-N 3.03Å
66	K	37.4	Very low	37.6	Very low	196 Å²	196	144.9 Å²	144.9	85%	0.852	76%	0.755	S	S	*	*			trans	-80.9	68.1	-175.7	-162.3	176.9	-175.9	178.6	0	113.3	R64 V68	R64-K66 PolarHBondContact O-N 3.14Å; K66-V68 PolarHBondContact O-N 2.74Å
67	V	35.1	Very low	37.9	Very low	108 Å²	108	145.5 Å²	145.5	66%	0.655	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-78.7	117.7	175.1	-175.9	0	0	0	0	110.4	A65 Y69	A65-V67 VanDerWaalsContact C-N 3.33Å; A65-V67 PolarHBondContact O-N 3.03Å; V67-Y69 HydrophobicContact CG1-CD2 3.91Å; V67-Y69 HydrophobicContact CG1-CE2 3.63Å
68	V	35.8	Very low	37.7	Very low	122 Å²	122	146.8 Å²	146.8	74%	0.739	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-96.6	118.3	176.5	178.7	0	0	0	0	109.6	K66	K66-V68 PolarHBondContact O-N 2.74Å
69	Y	32.9	Very low	37.3	Very low	194 Å²	194	144.9 Å²	144.9	76%	0.761	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-102.9	134.9	166.5	-84.1	-81.9	0	0	0	110.4	V67	V67-Y69 HydrophobicContact CG1-CD2 3.91Å; V67-Y69 HydrophobicContact CG1-CE2 3.63Å
70	P	34.3	Very low	37.2	Very low	119 Å²	119	149 Å²	149	77%	0.773	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-69.2	136.6	176.2	28.5	-33.6	0	0	0	111	N72	P70-N72 PolarHBondContact O-N 3.09Å
71	I	38.3	Very low	36.6	Very low	142 Å²	142	149.1 Å²	149.1	73%	0.728	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-73.6	122.2	-176.6	-61.1	173.1	0	0	0	110	Q73	I71-Q73 HydrophobicContact CG2-CG 3.95Å
72	N	29.6	Very low	36.3	Very low	167 Å²	167	145.4 Å²	145.4	89%	0.893	78%	0.783	S	S	*	*			trans	-141.7	86.2	161.4	-127.6	-26	0	0	0	110.1	P70 K74	P70-N72 PolarHBondContact O-N 3.09Å; N72-K74 PolarHBondContact O-N 3.39Å
73	Q	42.1	Very low	35.4	Very low	168 Å²	168	147.1 Å²	147.1	79%	0.785	79%	0.79	S	S	*	*			trans	-75.5	112.3	-178.4	-67.5	171.9	-11.2	0	0	110.7	I71	I71-Q73 HydrophobicContact CG2-CG 3.95Å
74	K	38	Very low	35	Very low	187 Å²	187	150.4 Å²	150.4	81%	0.813	80%	0.801	S	S	*	*	S	Bend	trans	-163.5	-14.7	153.4	-115.3	155.1	-170.2	174.9	0	118.2	N72	N72-K74 PolarHBondContact O-N 3.39Å
75	Y	36.9	Very low	34.8	Very low	222 Å²	222	145.2 Å²	145.2	87%	0.871	80%	0.796	S	S	*	*			trans	-132.7	105	178.4	-64	-75.2	0	0	0	112.4
76	R	39.3	Very low	34.6	Very low	228 Å²	228	147 Å²	147	86%	0.86	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-103.8	120.7	155.1	-95.5	-169.7	174.1	-165.1	-1.4	107.7
77	P	35.6	Very low	34.4	Very low	119 Å²	119	144.7 Å²	144.7	77%	0.773	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-63.6	139.2	148.7	-11.6	28.5	0	0	0	108.2
78	L	35.6	Very low	34.1	Very low	163 Å²	163	143.6 Å²	143.6	85%	0.853	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-84.6	129.2	165.1	-68.4	167.8	0	0	0	107.6
79	A	32.7	Very low	33.9	Very low	89 Å²	89	142.4 Å²	142.4	74%	0.736	77%	0.774	S	S	*	*			trans	-114.4	131	169.9	0	0	0	0	0	107.5
80	D	35.6	Very low	33.7	Very low	167 Å²	167	139.9 Å²	139.9	89%	0.893	77%	0.769	S	S	*	*			trans	56.1	160.6	-177.4	-56.6	-31.5	0	0	0	115.2
81	G	30.9	Very low	33.3	Very low	63 Å²	63	137.4 Å²	137.4	65%	0.649	76%	0.755	S	S	*	*			cis	178.5	148.4	-2.7	0	0	0	0	0	106.8	S83	G81-S83 PolarHBondContact O-N 3.49Å
82	A	31.1	Very low	33	Very low	115 Å²	115	139.8 Å²	139.8	95%	0.95	76%	0.76	S	S	*	*			trans	-74.2	103.4	-165.7	0	0	0	0	0	113.4
83	S	28.6	Very low	33.3	Very low	119 Å²	119	139.7 Å²	139.7	83%	0.832	76%	0.758	S	S	*	*			trans	-118.5	107.4	161.6	-65.7	0	0	0	0	108.9	G81	G81-S83 PolarHBondContact O-N 3.49Å
84	N	30.7	Very low	33	Very low	164 Å²	164	137.4 Å²	137.4	88%	0.877	76%	0.758	S	S	*	*			trans	-84.1	146.2	177.5	-126.9	2	0	0	0	110.4
85	P	35	Very low	32.8	Very low	117 Å²	117	134 Å²	134	76%	0.76	76%	0.755	S	S	*	*			trans	-93.4	151	-164.9	35.5	-35.8	0	0	0	114.6
86	S	30.9	Very low	32.5	Very low	119 Å²	119	131.2 Å²	131.2	83%	0.832	75%	0.752	S	S	*	*			trans	-144.6	113.7	161	58.8	0	0	0	0	111.9
87	L	33	Very low	32.4	Very low	147 Å²	147	125.3 Å²	125.3	77%	0.77	74%	0.743	S	S	*	*			trans	-69.2	174.4	161.2	-71.5	165.9	0	0	0	109.8	A44	A44-L87 WeakPolarHBondContact CB-O 3.29Å
88	H	29.5	Very low	31.9	Very low	85 Å²	85	125.4 Å²	125.4	39%	0.394	74%	0.737	S	S	.	*			cis	-152.5	175.1	25	176.2	-93.3	0	0	0	105.4	A44 N45	A44-H88 CarbonylContact C-O 3.58Å; A44-H88 HydrophobicContact CB-CB 4.24Å; A44-H88 WeakPolarHBondContact CB-O 3.2Å; N45-H88 CarbonylContact C-O 3.55Å; N45-H88 PolarHBondContact N-O 3.02Å; N45-H88 CarbonylContact O-C 3.51Å; N45-H88 PolarHBondContact OD1-ND1 3.3Å; N45-H88 PolarHBondContact OD1-O 2.94Å
89	E	31.1	Very low	31.5	Very low	96 Å²	96	125 Å²	125	45%	0.449	73%	0.731	S	S	.	*			cis	145.6	-3.4	-3.9	5	-173.4	-48.3	0	0	118.9	N45 K47	N45-E89 PolarHBondContact O-N 3.21Å; N45-E89 WeakPolarHBondContact OD1-CA 3.31Å; N45-E89 PolarHBondContact OD1-N 3.42Å; K47-E89 IonicContact NZ-OE1 3.85Å; K47-E89 PolarHBondContact NZ-OE1 2.9Å; K47-E89 IonicContact NZ-OE2 3.61Å; K47-E89 PolarHBondContact NZ-OE2 3.09Å
90	Q	28.1	Very low	31.1	Very low	142 Å²	142	127.3 Å²	127.3	66%	0.664	73%	0.731	S	S	*	*			trans	-169.5	103.6	172.9	-114.5	158.5	107.3	0	0	119.7	N45 D46	N45-Q90 VanDerWaalsContact CB-C 3.4Å; N45-Q90 WeakPolarHBondContact CB-O 3.5Å; N45-Q90 VanDerWaalsContact CG-C 3.49Å; N45-Q90 PolarHBondContact ND2-O 3.04Å; N45-Q90 PolarHBondContact OD1-N 3.35Å; D46-Q90 VanDerWaalsContact CB-C 3.49Å; D46-Q90 VanDerWaalsContact CB-CA 3.4Å
91	S	27.2	Very low	30.7	Very low	67 Å²	67	124.9 Å²	124.9	47%	0.469	73%	0.727	S	S	.	*			trans	-123.5	137.3	175.6	86	0	0	0	0	112.6
92	K	31.1	Very low	30.4	Very low	192 Å²	192	127.4 Å²	127.4	84%	0.835	74%	0.735	S	S	*	*			trans	-176.6	148.9	168.4	-102.2	135.3	-162.5	153.8	0	114.2
93	L	36.6	Very low	30.1	Very low	165 Å²	165	126.4 Å²	126.4	86%	0.864	72%	0.721	S	S	*	*			trans	-91.1	165.6	170.2	-67.1	159	0	0	0	110.6
94	P	34.8	Very low	30	Very low	119 Å²	119	128.3 Å²	128.3	77%	0.773	72%	0.722	S	S	*	*				-148	-155	84.4	40.8	-18.3	0	0	0	113.1
95	P	33.9	Very low	29.9	Very low	117 Å²	117	123.8 Å²	123.8	76%	0.76	71%	0.713	S	S	*	*				-126.6	174.4	-94	40.1	-22.6	0	0	0	117
96	M	31.7	Very low	29.4	Very low	163 Å²	163	127.6 Å²	127.6	80%	0.803	72%	0.721	S	S	*	*			trans	-12.6	149.9	158.9	-68.5	-57	-78.4	0	0	118.9
97	P	36	Very low	29.2	Very low	104 Å²	104	127.3 Å²	127.3	68%	0.675	72%	0.719	S	S	*	*				-154	171.4	53.2	43.5	-23.2	0	0	0	121.1
98	N	25.7	Very low	28.9	Very low	120 Å²	120	128.5 Å²	128.5	64%	0.642	73%	0.726	S	S	*	*			trans	68	140.9	144	-80.1	41.9	0	0	0	120.4
99	E	27.4	Very low	28.8	Very low	154 Å²	154	130.5 Å²	130.5	72%	0.72	75%	0.749	S	S	*	*			cis	-144.2	177.7	-3	-57.9	-155.6	125.1	0	0	113.1
100	D	24.4	Very low	28.7	Very low	138 Å²	138	133.9 Å²	133.9	74%	0.738	77%	0.765	S	S	*	*			trans	83.5	120.9	146.5	-74.5	-18.1	0	0	0	125.3
101	S	27.3	Very low	28.5	Very low	117 Å²	117	136.6 Å²	136.6	82%	0.818	78%	0.777	S	S	*	*			trans	70.8	139.6	142.4	-66.3	0	0	0	0	120.4
102	S	24.1	Very low	28.8	Very low	116 Å²	116	140.7 Å²	140.7	81%	0.811	79%	0.789	S	S	*	*			cis	-150.5	159.6	-7.7	-175	0	0	0	0	111.9
103	S	25.2	Very low	28.5	Very low	93 Å²	93	139.2 Å²	139.2	65%	0.65	79%	0.79	S	S	*	*			trans	-66.3	149.7	-177.2	-175.7	0	0	0	0	116
104	D	27.2	Very low	28.3	Very low	160 Å²	160	137.5 Å²	137.5	86%	0.856	78%	0.782	S	S	*	*				154	135.1	126.3	-77.4	-4	0	0	0	111.2
105	G	27.4	Very low	28	Very low	68 Å²	68	138.8 Å²	138.8	70%	0.701	78%	0.782	S	S	*	*			cis	172.3	104.6	-8.7	0	0	0	0	0	113.3
106	E	25.5	Very low	27.7	Very low	197 Å²	197	140 Å²	140	92%	0.921	78%	0.783	S	S	*	*			trans	62.2	159.8	167.8	-56.1	-165.9	130.8	0	0	117.7
107	S	26.1	Very low	27.7	Very low	113 Å²	113	138.2 Å²	138.2	79%	0.79	79%	0.786	S	S	*	*			cis	-128.1	159.1	6.7	-52.7	0	0	0	0	113.3
108	L	27.1	Very low	27.4	Very low	173 Å²	173	137.8 Å²	137.8	91%	0.906	79%	0.785	S	S	*	*			trans	-88.4	146.6	177.9	-66.7	161.3	0	0	0	112.7
109	S	26.5	Very low	27.6	Very low	126 Å²	126	139.9 Å²	139.9	88%	0.881	79%	0.791	S	S	*	*			trans	-138.7	148.1	139.7	63.6	0	0	0	0	109.2
110	Q	29.1	Very low	27.8	Very low	168 Å²	168	142.3 Å²	142.3	79%	0.785	80%	0.8	S	S	*	*			trans	-126.2	107.8	-156.3	177.1	-176.4	-9.4	0	0	110.4
111	E	25.4	Very low	28.3	Very low	198 Å²	198	140.6 Å²	140.6	93%	0.925	79%	0.79	S	S	*	*			trans	-110.1	148.7	165.5	-68	-164.7	143.6	0	0	110.5
112	Q	31.5	Very low	28.5	Very low	153 Å²	153	138.3 Å²	138.3	72%	0.715	77%	0.774	S	S	*	*			trans	-123.2	79.3	-154	-171.4	177.1	0.8	0	0	110.8	N114	Q112-N114 PolarHBondContact O-N 3.33Å
113	D	26.8	Very low	28.7	Very low	161 Å²	161	141.1 Å²	141.1	86%	0.861	78%	0.78	S	S	*	*			trans	-64.9	93.1	-177.8	-95.6	-30.4	0	0	0	112.8
114	N	32.5	Very low	28.9	Very low	130 Å²	130	143.4 Å²	143.4	70%	0.695	78%	0.782	S	S	*	*			trans	-100.7	95.2	157.2	-75.7	-72	0	0	0	108.5	Q112	Q112-N114 PolarHBondContact O-N 3.33Å
115	N	27.6	Very low	29.2	Very low	145 Å²	145	145.3 Å²	145.3	78%	0.775	79%	0.786	S	S	*	*			trans	-153.3	70	170.9	-99.8	-41.3	0	0	0	113.2	S117	N115-S117 PolarHBondContact O-N 3.34Å
116	D	26.9	Very low	29.8	Very low	144 Å²	144	144.7 Å²	144.7	77%	0.77	77%	0.766	S	S	*	*			trans	-72.8	97.3	158.5	-102	-37.1	0	0	0	109.5
117	S	32	Very low	30.2	Very low	124 Å²	124	139.2 Å²	139.2	87%	0.867	75%	0.748	S	S	*	*			trans	177.1	64	152.8	-81.5	0	0	0	0	113.9	N115	N115-S117 PolarHBondContact O-N 3.34Å
118	S	29.7	Very low	31	Very low	95 Å²	95	143.2 Å²	143.2	66%	0.664	75%	0.751	S	S	*	*			trans	-148.4	20.3	173.3	60.3	0	0	0	0	115.5	F120	S118-F120 PolarHBondContact O-N 3.44Å
119	Q	30.3	Very low	32	Very low	165 Å²	165	138 Å²	138	77%	0.771	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	57	-174.2	-62.3	-172	10.8	0	0	114.8
120	F	31.2	Very low	33	Very low	204 Å²	204	134.4 Å²	134.4	90%	0.895	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.5	9.5	168.6	-85.7	-70.3	0	0	0	114.6	S118	S118-F120 PolarHBondContact O-N 3.44Å
121	L	35.7	Very low	34.1	Very low	103 Å²	103	131.5 Å²	131.5	54%	0.539	69%	0.686	S	S	.	*	S	Bend	trans	-103.6	94.8	176.4	-66.7	179.7	0	0	0	112.9
122	S	31.6	Very low	35.8	Very low	68 Å²	68	126.3 Å²	126.3	48%	0.476	67%	0.665	S	S	.	*			trans	43.9	94	148.8	-173.4	0	0	0	0	119.3	M124	S122-M124 PolarHBondContact O-N 2.95Å; S122-M124 VanDerWaalsContact O-N 3.1Å
123	N	26.8	Very low	37.5	Very low	176 Å²	176	123.5 Å²	123.5	94%	0.941	65%	0.652	S	S	*	*			trans	-78.2	82.6	156.2	-85.9	-15.8	0	0	0	111.3
124	M	30.5	Very low	40	Very low	140 Å²	140	119.4 Å²	119.4	69%	0.69	64%	0.635	S	S	*	*	S	Bend	trans	-145.3	142.7	154.1	-87.6	-142.1	72.5	0	0	109	S122 L126	S122-M124 PolarHBondContact O-N 2.95Å; S122-M124 VanDerWaalsContact O-N 3.1Å; M124-L126 VanDerWaalsContact C-N 3.25Å; M124-L126 PolarHBondContact O-N 3.38Å
125	E	33.3	Very low	42.5	Very low	200 Å²	200	113.4 Å²	113.4	94%	0.935	60%	0.603	S	S	*	*			trans	-78.7	64.2	-170.4	-62.8	-177.2	121.6	0	0	113.6
126	L	39.6	Very low	45.2	Very low	56 Å²	56	109.1 Å²	109.1	29%	0.293	58%	0.582	S	S	.	*			trans	-72.6	138.4	150.5	-107.5	66.8	0	0	0	108.4	M124 K128 L130 E651	M124-L126 VanDerWaalsContact C-N 3.25Å; M124-L126 PolarHBondContact O-N 3.38Å; L126-K128 PolarHBondContact O-N 3.15Å; L126-L130 HydrophobicContact CB-CD1 4.26Å; L126-L130 HydrophobicContact CD2-CB 4.35Å; L126-L130 HydrophobicContact CD2-CD1 3.56Å; L126-L130 HydrophobicContact CG-CD1 3.69Å; L126-E651 WeakPolarHBondContact CD2-OE2 3.22Å
127	P	35.2	Very low	47.8	Very low	82 Å²	82	105.3 Å²	105.3	53%	0.532	56%	0.557	S	S	.	*			trans	-62.3	138.8	176.6	25.5	-34.1	0	0	0	110.7	S129 L130	P127-S129 PolarHBondContact O-N 3.44Å; P127-L130 HydrophobicContact CG-CD1 4.07Å; P127-L130 HydrophobicContact CG-CG 4.34Å; P127-L130 PolarHBondContact O-N 3.18Å
128	K	43.1	Very low	50.4	Low	196 Å²	196	100.1 Å²	100.1	85%	0.852	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-9.8	-176.8	-64.9	-172.3	178	-174.5	0	115.2	L126 L130	L126-K128 PolarHBondContact O-N 3.15Å; K128-L130 VanDerWaalsContact C-N 3.29Å; K128-L130 PolarHBondContact O-N 3.17Å
129	S	47.5	Very low	53	Low	64 Å²	64	99.3 Å²	99.3	45%	0.448	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-13.3	172.3	54	0	0	0	0	114.6	P127 Q133 K608	P127-S129 PolarHBondContact O-N 3.44Å; S129-Q133 WeakPolarHBondContact O-CG 3.36Å; S129-Q133 PolarHBondContact O-NE2 3.47Å; S129-Q133 PolarHBondContact O-OE1 2.94Å; S129-K608 PolarHBondContact O-NZ 3.49Å
130	L	47.1	Very low	55.9	Low	50 Å²	50	94.9 Å²	94.9	26%	0.262	48%	0.484	S	S	.	.	S	Bend	trans	-85.3	-36.2	179.6	-67.3	174.5	0	0	0	112.3	L126 P127 K128 K608 F612	L126-L130 HydrophobicContact CB-CD1 4.26Å; L126-L130 HydrophobicContact CD2-CB 4.35Å; L126-L130 HydrophobicContact CD2-CD1 3.56Å; L126-L130 HydrophobicContact CG-CD1 3.69Å; P127-L130 HydrophobicContact CG-CD1 4.07Å; P127-L130 HydrophobicContact CG-CG 4.34Å; P127-L130 PolarHBondContact O-N 3.18Å; K128-L130 VanDerWaalsContact C-N 3.29Å; K128-L130 PolarHBondContact O-N 3.17Å; L130-K608 HydrophobicContact CD2-CB 4.25Å; L130-K608 HydrophobicContact CD2-CD 3.64Å; L130-K608 PolarHBondContact O-NZ 2.94Å; L130-F612 HydrophobicContact CD2-CE2 4.4Å
131	Q	53.1	Low	58.8	Low	107 Å²	107	85.6 Å²	85.6	50%	0.5	44%	0.443	S	S	.	.	S	Bend	trans	-76.5	153.1	167.8	-70.1	169.6	-10.4	0	0	111	Q133	Q131-Q133 VanDerWaalsContact C-N 3.31Å; Q131-Q133 PolarHBondContact O-N 3.05Å
132	N	60.5	Low	61.5	Low	90 Å²	90	80.8 Å²	80.8	48%	0.481	42%	0.418	S	S	.	.	S	Bend	trans	52.2	28.9	160.7	-56.2	-1	0	0	0	118.6	E237	N132-E237 VanDerWaalsContact CG-CD 3.45Å; N132-E237 PolarHBondContact ND2-OE1 3.46Å; N132-E237 PolarHBondContact ND2-OE2 3.38Å; N132-E237 WeakPolarHBondContact OD1-CG 3.29Å; N132-E237 PolarHBondContact OD1-OE1 3.26Å
133	Q	67.3	Low	64.3	Low	94 Å²	94	78.9 Å²	78.9	44%	0.439	40%	0.402	S	S	.	.			trans	-74	135.3	162.8	-73.8	-177.6	-32.6	0	0	110.4	S129 Q131	S129-Q133 WeakPolarHBondContact O-CG 3.36Å; S129-Q133 PolarHBondContact O-NE2 3.47Å; S129-Q133 PolarHBondContact O-OE1 2.94Å; Q131-Q133 VanDerWaalsContact C-N 3.31Å; Q131-Q133 PolarHBondContact O-N 3.05Å
134	S	79.7	Confident	67.3	Low	74 Å²	74	70.6 Å²	70.6	52%	0.517	36%	0.358	S	S	.	.			trans	-78.6	156.5	169.4	55.6	0	0	0	0	111.6	C234	S134-C234 CarbonylContact C-O 3.54Å; S134-C234 WeakPolarHBondContact CA-O 3.46Å
135	F	84.3	Confident	70.1	Confident	5 Å²	5	64.5 Å²	64.5	2%	0.022	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	159.8	179.5	68.4	-87.3	0	0	0	111.9	R137 E151 I154 S155 C158 S233 C234 I239 M604	F135-R137 PolarHBondContact O-N 2.98Å; F135-E151 HydrophobicContact CB-CG 4.32Å; F135-I154 HydrophobicContact CB-CG2 3.99Å; F135-I154 HydrophobicContact CD1-CD1 3.81Å; F135-I154 HydrophobicContact CD1-CG1 4.22Å; F135-I154 HydrophobicContact CD1-CG2 3.91Å; F135-I154 HydrophobicContact CD2-CG2 3.73Å; F135-I154 HydrophobicContact CE1-CD1 3.62Å; F135-I154 HydrophobicContact CE1-CG1 3.83Å; F135-I154 HydrophobicContact CE1-CG2 4.27Å; F135-I154 HydrophobicContact CE2-CG1 4.46Å; F135-I154 HydrophobicContact CE2-CG2 4.09Å; F135-I154 HydrophobicContact CG-CG2 3.62Å; F135-I154 HydrophobicContact CZ-CD1 4.26Å; F135-I154 HydrophobicContact CZ-CG1 3.95Å; F135-I154 HydrophobicContact CZ-CG2 4.33Å; F135-S155 WeakPolarHBondContact CD2-OG 3.24Å; F135-C158 HydrophobicContact CE2-CB 4.05Å; F135-C158 HydrophobicContact CZ-CB 3.98Å; F135-S233 WeakPolarHBondContact O-CA 3.43Å; F135-C234 WeakPolarHBondContact CD1-O 3.23Å; F135-C234 PolarHBondContact N-O 3.14Å; F135-C234 PolarHBondContact O-N 3.42Å; F135-I239 HydrophobicContact CE1-CD1 3.8Å; F135-I239 HydrophobicContact CZ-CD1 3.53Å; F135-M604 HydrophobicContact CZ-CE 4.22Å
136	T	83.3	Confident	72.5	Confident	54 Å²	54	55.8 Å²	55.8	33%	0.331	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	119.2	178.7	-46.2	0	0	0	0	110.6	E151 S155	T136-E151 WeakPolarHBondContact CB-OE1 3.45Å; T136-E151 PolarHBondContact N-OE1 3.07Å; T136-E151 PolarHBondContact OG1-OE1 3.15Å; T136-S155 PolarHBondContact O-OG 3.25Å
137	R	82.2	Confident	74.5	Confident	65 Å²	65	54.9 Å²	54.9	25%	0.245	28%	0.283	C	S	.	.			trans	-72.3	141	172.2	-69	-175.6	179.9	172.5	6.6	110.6	F135 C234 E238	F135-R137 PolarHBondContact O-N 2.98Å; R137-C234 HydrophobicContact CG-CB 3.84Å; R137-C234 VanDerWaalsContact CZ-SG 3.58Å; R137-C234 VanDerWaalsContact NE-CB 3.25Å; R137-C234 PolarHBondContact NE-SG 3.37Å; R137-C234 PolarHBondContact NH2-SG 3.17Å; R137-E238 IonicContact NH2-OE2 2.61Å
138	V	86.6	Confident	76.4	Confident	15 Å²	15	56 Å²	56	9%	0.091	29%	0.289	C	S	.	.			trans	-118	166.1	173	-64.1	0	0	0	0	111.2	D143 T144 L159	V138-D143 HydrophobicContact CB-CB 4.02Å; V138-D143 HydrophobicContact CG1-CB 4.18Å; V138-T144 HydrophobicContact CG2-CG2 3.8Å; V138-L159 HydrophobicContact CG2-CD1 3.71Å; V138-L159 HydrophobicContact CG2-CD2 4.48Å; V138-L159 HydrophobicContact CG2-CG 3.99Å; V138-L159 VanDerWaalsContact O-CD2 3.3Å; V138-L159 WeakPolarHBondContact O-CD2 3.31Å
139	F	84.6	Confident	78.2	Confident	78 Å²	78	47.2 Å²	47.2	34%	0.342	25%	0.254	S	S	.	.	S	Bend	trans	-106.9	-22.6	-172.9	-69.7	-90.5	0	0	0	114.4	K226 I229 Q230	F139-K226 WeakPolarHBondContact CE1-O 3.38Å; F139-I229 VanDerWaalsContact CZ-O 3.25Å; F139-I229 WeakPolarHBondContact CZ-O 3.26Å; F139-Q230 HydrophobicContact CE2-CG 4.24Å
140	H	90.1	Very high	79.9	Confident	71 Å²	71	46 Å²	46	33%	0.329	24%	0.241	S	C	.	.	S	Bend	trans	-138.7	146	-179.9	-46.6	-58.4	0	0	0	111.6	P142 D143 C393	H140-P142 VanDerWaalsContact C-N 3.31Å; H140-D143 VanDerWaalsContact CB-OD2 3.3Å; H140-D143 WeakPolarHBondContact CB-OD2 3.32Å; H140-D143 IonicContact CD2-OD2 2.61Å; H140-D143 PolarHBondContact CD2-OD2 2.77Å; H140-D143 IonicContact CG-OD2 3.05Å; H140-D143 PolarHBondContact N-OD2 3.28Å; H140-D143 VanDerWaalsContact O-CB 3.26Å; H140-D143 WeakPolarHBondContact O-CB 3.41Å; H140-D143 PolarHBondContact O-N 2.96Å; H140-C393 HydrophobicContact CB-CB 4.43Å; H140-C393 VanDerWaalsContact CB-SG 3.56Å; H140-C393 WeakPolarHBondContact CD2-CB 3.49Å
141	Y	92.3	Very high	81.7	Confident	9 Å²	9	46.5 Å²	46.5	4%	0.035	24%	0.241	C	C	.	.	H	α-helix	trans	-51.8	-36.7	179.2	-70.9	-107	0	0	0	115	D143 T144 L156 L159 A160 E163 R312 W316	Y141-D143 PolarHBondContact O-N 3.12Å; Y141-T144 PolarHBondContact O-N 3.41Å; Y141-T144 PolarHBondContact O-OG1 3.11Å; Y141-L156 HydrophobicContact CD1-CD1 3.44Å; Y141-L156 VanDerWaalsContact CD1-CD1 3.44Å; Y141-L156 HydrophobicContact CE1-CD1 3.81Å; Y141-L159 HydrophobicContact CD2-CD1 4.3Å; Y141-L159 HydrophobicContact CE2-CB 4.43Å; Y141-L159 HydrophobicContact CG-CD1 4.22Å; Y141-A160 HydrophobicContact CE1-CB 4.45Å; Y141-A160 WeakPolarHBondContact OH-CA 3.4Å; Y141-E163 VanDerWaalsContact CE2-OE2 3.28Å; Y141-E163 WeakPolarHBondContact CE2-OE2 3.2Å; Y141-E163 PolarHBondContact OH-OE2 3.42Å; Y141-R312 HydrophobicContact CE1-CG 4.38Å; Y141-W316 HydrophobicContact CD1-CB 4.02Å; Y141-W316 AromaticContact CD1-CD1 3.24Å; Y141-W316 HydrophobicContact CD1-CD2 4.45Å; Y141-W316 AromaticContact CD1-CG 3.66Å; Y141-W316 HydrophobicContact CD1-CG 3.66Å; Y141-W316 AromaticContact CD1-NE1 3.87Å; Y141-W316 AromaticContact CE1-CD1 4Å; Y141-W316 AromaticContact CG-CD1 3.66Å; Y141-W316 HydrophobicContact CG-CD2 4.48Å; Y141-W316 HydrophobicContact CG-CG 4.12Å; Y141-W316 AromaticContact CG-NE1 3.79Å
142	P	92.4	Very high	83.3	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.019	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-21.3	175.2	-20.5	32.5	0	0	0	114.6	H140 W316 A389 I453	H140-P142 VanDerWaalsContact C-N 3.31Å; P142-W316 HydrophobicContact CB-CH2 4.03Å; P142-W316 HydrophobicContact CB-CZ3 4.12Å; P142-W316 HydrophobicContact CG-CH2 3.57Å; P142-W316 HydrophobicContact CG-CZ2 4.03Å; P142-W316 HydrophobicContact CG-CZ3 4.11Å; P142-A389 HydrophobicContact CB-CB 4.01Å; P142-I453 HydrophobicContact CB-CG2 3.75Å; P142-I453 HydrophobicContact CG-CD1 3.99Å; P142-I453 HydrophobicContact CG-CG2 3.68Å
143	D	90.2	Very high	84.7	Confident	27 Å²	27	38.3 Å²	38.3	14%	0.144	20%	0.202	C	C	.	.	H	α-helix	trans	-78.3	-25.9	-175.3	-48.2	-31.3	0	0	0	111	V138 H140 Y141 L145 T146	V138-D143 HydrophobicContact CB-CB 4.02Å; V138-D143 HydrophobicContact CG1-CB 4.18Å; H140-D143 VanDerWaalsContact CB-OD2 3.3Å; H140-D143 WeakPolarHBondContact CB-OD2 3.32Å; H140-D143 IonicContact CD2-OD2 2.61Å; H140-D143 PolarHBondContact CD2-OD2 2.77Å; H140-D143 IonicContact CG-OD2 3.05Å; H140-D143 PolarHBondContact N-OD2 3.28Å; H140-D143 VanDerWaalsContact O-CB 3.26Å; H140-D143 WeakPolarHBondContact O-CB 3.41Å; H140-D143 PolarHBondContact O-N 2.96Å; Y141-D143 PolarHBondContact O-N 3.12Å; D143-L145 PolarHBondContact O-N 2.93Å; D143-T146 WeakPolarHBondContact O-CB 3.39Å; D143-T146 PolarHBondContact O-N 2.86Å; D143-T146 PolarHBondContact O-OG1 3.28Å
144	T	90.8	Very high	85.8	Confident	3 Å²	3	33.9 Å²	33.9	2%	0.018	18%	0.181	C	C	.	.	H	α-helix	trans	-59.8	-32.3	176.3	67.8	0	0	0	0	111.8	V138 Y141 T146 H147 L156 L159	V138-T144 HydrophobicContact CG2-CG2 3.8Å; Y141-T144 PolarHBondContact O-N 3.41Å; Y141-T144 PolarHBondContact O-OG1 3.11Å; T144-T146 PolarHBondContact O-N 2.66Å; T144-T146 VanDerWaalsContact O-N 3.09Å; T144-H147 PolarHBondContact O-N 2.92Å; T144-L156 HydrophobicContact CG2-CB 4Å; T144-L159 HydrophobicContact CG2-CD1 3.72Å
145	L	88.6	Confident	86.2	Confident	12 Å²	12	30.5 Å²	30.5	6%	0.063	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-5.5	176.7	-56.4	176.3	0	0	0	113.7	D143 W316 L319 S320 V323 L457	D143-L145 PolarHBondContact O-N 2.93Å; L145-W316 HydrophobicContact CD1-CE3 3.99Å; L145-W316 HydrophobicContact CD1-CZ3 3.68Å; L145-W316 HydrophobicContact CG-CE3 4.45Å; L145-L319 HydrophobicContact CD1-CD2 4.11Å; L145-L319 HydrophobicContact CD1-CG 4.16Å; L145-S320 VanDerWaalsContact CD2-CA 3.44Å; L145-V323 HydrophobicContact CD1-CG2 4.34Å; L145-V323 HydrophobicContact CD2-CG2 4.38Å; L145-L457 HydrophobicContact CD1-CD1 3.69Å
146	T	83.5	Confident	86.6	Confident	17 Å²	17	30.4 Å²	30.4	10%	0.104	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-5.6	173.2	74.6	0	0	0	0	113.2	D143 T144 T385 R386	D143-T146 WeakPolarHBondContact O-CB 3.39Å; D143-T146 PolarHBondContact O-N 2.86Å; D143-T146 PolarHBondContact O-OG1 3.28Å; T144-T146 PolarHBondContact O-N 2.66Å; T144-T146 VanDerWaalsContact O-N 3.09Å; T146-T385 HydrophobicContact CG2-CG2 4.11Å; T146-R386 HydrophobicContact CG2-CB 3.76Å; T146-R386 HydrophobicContact CG2-CG 4.16Å
147	H	82.4	Confident	87.1	Confident	37 Å²	37	27.9 Å²	27.9	17%	0.171	14%	0.142	C	C	.	.	S	Bend	trans	-110.4	156.6	171.9	-58.3	-99.3	0	0	0	109.5	T144 E151	T144-H147 PolarHBondContact O-N 2.92Å; H147-E151 HydrophobicContact CB-CB 4.31Å; H147-E151 HydrophobicContact CB-CG 4.17Å; H147-E151 IonicContact CE1-OE2 3.48Å; H147-E151 IonicContact CG-OE2 2.8Å; H147-E151 IonicContact ND1-OE1 3Å; H147-E151 IonicContact ND1-OE2 2.76Å; H147-E151 PolarHBondContact ND1-OE2 3.12Å
148	T	75.9	Confident	87.6	Confident	106 Å²	106	25.1 Å²	25.1	65%	0.65	13%	0.132	S	C	*	.			trans	-124.5	145.7	-174.6	54.8	0	0	0	0	112.5
149	G	79	Confident	87.9	Confident	11 Å²	11	24.9 Å²	24.9	11%	0.113	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	-133.7	-178.7	0	0	0	0	0	113.1	E151 G152 R153 Q324	G149-E151 PolarHBondContact O-N 2.99Å; G149-G152 PolarHBondContact O-N 3.18Å; G149-R153 PolarHBondContact O-N 2.67Å; G149-R153 VanDerWaalsContact O-N 3.13Å; G149-Q324 VanDerWaalsContact N-OE1 3.17Å
150	F	83.5	Confident	88.4	Confident	39 Å²	39	21.2 Å²	21.2	17%	0.171	11%	0.114	C	C	.	.	H	α-helix	trans	-52.7	-47.6	-172.3	167.3	-114	0	0	0	113.8	G152 R153 I154 K608	F150-G152 PolarHBondContact O-N 3.08Å; F150-R153 PolarHBondContact O-N 2.91Å; F150-I154 HydrophobicContact CD2-CB 4.32Å; F150-I154 HydrophobicContact CD2-CG2 4.39Å; F150-I154 HydrophobicContact CE1-CG2 4.22Å; F150-I154 HydrophobicContact CE2-CB 3.8Å; F150-I154 HydrophobicContact CE2-CD1 3.74Å; F150-I154 HydrophobicContact CE2-CG1 4.31Å; F150-I154 HydrophobicContact CE2-CG2 3.96Å; F150-I154 HydrophobicContact CZ-CB 4.12Å; F150-I154 HydrophobicContact CZ-CD1 3.59Å; F150-I154 HydrophobicContact CZ-CG1 4.45Å; F150-I154 HydrophobicContact CZ-CG2 3.86Å; F150-I154 WeakPolarHBondContact O-CG2 3.49Å; F150-I154 PolarHBondContact O-N 2.81Å; F150-K608 HydrophobicContact CB-CG 4.28Å; F150-K608 HydrophobicContact CD1-CG 4.2Å; F150-K608 HydrophobicContact CD2-CB 4.32Å; F150-K608 HydrophobicContact CD2-CD 4.35Å; F150-K608 HydrophobicContact CD2-CG 3.29Å; F150-K608 VanDerWaalsContact CE1-CE 3.45Å; F150-K608 HydrophobicContact CE1-CG 4.41Å; F150-K608 HydrophobicContact CE2-CD 4.3Å; F150-K608 HydrophobicContact CE2-CG 3.54Å; F150-K608 HydrophobicContact CG-CG 3.65Å; F150-K608 HydrophobicContact CZ-CD 4.42Å; F150-K608 VanDerWaalsContact CZ-CE 3.45Å; F150-K608 HydrophobicContact CZ-CG 4.11Å
151	E	86.1	Confident	88.6	Confident	59 Å²	59	18 Å²	18	28%	0.276	10%	0.099	S	C	.	.	H	α-helix	trans	-64.4	-41.1	-175.3	-175.7	172.5	-135	0	0	111.8	F135 T136 H147 G149 S155	F135-E151 HydrophobicContact CB-CG 4.32Å; T136-E151 WeakPolarHBondContact CB-OE1 3.45Å; T136-E151 PolarHBondContact N-OE1 3.07Å; T136-E151 PolarHBondContact OG1-OE1 3.15Å; H147-E151 HydrophobicContact CB-CB 4.31Å; H147-E151 HydrophobicContact CB-CG 4.17Å; H147-E151 IonicContact CE1-OE2 3.48Å; H147-E151 IonicContact CG-OE2 2.8Å; H147-E151 IonicContact ND1-OE1 3Å; H147-E151 IonicContact ND1-OE2 2.76Å; H147-E151 PolarHBondContact ND1-OE2 3.12Å; G149-E151 PolarHBondContact O-N 2.99Å; E151-S155 WeakPolarHBondContact O-CB 3.47Å; E151-S155 PolarHBondContact O-N 3.44Å; E151-S155 VanDerWaalsContact O-N 3.13Å; E151-S155 PolarHBondContact O-OG 3.04Å
152	G	87	Confident	88.5	Confident	9 Å²	9	20 Å²	20	9%	0.093	11%	0.109	C	C	.	.	H	α-helix	trans	-62.7	-42.7	174.3	0	0	0	0	0	112.3	G149 F150 L156	G149-G152 PolarHBondContact O-N 3.18Å; F150-G152 PolarHBondContact O-N 3.08Å; G152-L156 WeakPolarHBondContact O-CB 3.41Å; G152-L156 PolarHBondContact O-N 3.41Å; G152-L156 VanDerWaalsContact O-N 3.12Å
153	R	88.7	Confident	88.5	Confident	16 Å²	16	20.9 Å²	20.9	6%	0.06	11%	0.113	C	C	.	.	H	α-helix	trans	-65.3	-56.4	179	-168.2	177.9	179.3	102.8	25.7	111.8	G149 F150 S155 L156 Y157 E317 E603 S607 V611	G149-R153 PolarHBondContact O-N 2.67Å; G149-R153 VanDerWaalsContact O-N 3.13Å; F150-R153 PolarHBondContact O-N 2.91Å; R153-S155 VanDerWaalsContact C-N 3.27Å; R153-S155 PolarHBondContact O-N 3.06Å; R153-L156 WeakPolarHBondContact O-CB 3.44Å; R153-L156 PolarHBondContact O-N 3.1Å; R153-Y157 HydrophobicContact CG-CD2 4.13Å; R153-Y157 HydrophobicContact CG-CE2 3.79Å; R153-Y157 PolarHBondContact NH2-OH 2.97Å; R153-Y157 WeakPolarHBondContact O-CD2 3.48Å; R153-Y157 PolarHBondContact O-N 3.44Å; R153-E317 IonicContact CZ-OE1 3.07Å; R153-E317 IonicContact NH1-OE1 3.44Å; R153-E317 PolarHBondContact NH1-OE1 3.43Å; R153-E317 IonicContact NH2-OE1 3.04Å; R153-E317 PolarHBondContact NH2-OE1 2.93Å; R153-E317 IonicContact NH2-OE2 3.63Å; R153-E603 IonicContact NH2-OE2 2.74Å; R153-S607 WeakPolarHBondContact CD-OG 3.13Å; R153-S607 WeakPolarHBondContact CG-OG 3.23Å; R153-V611 HydrophobicContact CB-CG2 4.36Å
154	I	89.8	Confident	88.7	Confident	2 Å²	2	19.7 Å²	19.7	1%	0.01	11%	0.107	C	C	.	.	H	α-helix	trans	-63	-34.5	-177.2	-165.8	169.1	0	0	0	112.3	F135 F150 Y157 C158 L236 M604	F135-I154 HydrophobicContact CB-CG2 3.99Å; F135-I154 HydrophobicContact CD1-CD1 3.81Å; F135-I154 HydrophobicContact CD1-CG1 4.22Å; F135-I154 HydrophobicContact CD1-CG2 3.91Å; F135-I154 HydrophobicContact CD2-CG2 3.73Å; F135-I154 HydrophobicContact CE1-CD1 3.62Å; F135-I154 HydrophobicContact CE1-CG1 3.83Å; F135-I154 HydrophobicContact CE1-CG2 4.27Å; F135-I154 HydrophobicContact CE2-CG1 4.46Å; F135-I154 HydrophobicContact CE2-CG2 4.09Å; F135-I154 HydrophobicContact CG-CG2 3.62Å; F135-I154 HydrophobicContact CZ-CD1 4.26Å; F135-I154 HydrophobicContact CZ-CG1 3.95Å; F135-I154 HydrophobicContact CZ-CG2 4.33Å; F150-I154 HydrophobicContact CD2-CB 4.32Å; F150-I154 HydrophobicContact CD2-CG2 4.39Å; F150-I154 HydrophobicContact CE1-CG2 4.22Å; F150-I154 HydrophobicContact CE2-CB 3.8Å; F150-I154 HydrophobicContact CE2-CD1 3.74Å; F150-I154 HydrophobicContact CE2-CG1 4.31Å; F150-I154 HydrophobicContact CE2-CG2 3.96Å; F150-I154 HydrophobicContact CZ-CB 4.12Å; F150-I154 HydrophobicContact CZ-CD1 3.59Å; F150-I154 HydrophobicContact CZ-CG1 4.45Å; F150-I154 HydrophobicContact CZ-CG2 3.86Å; F150-I154 WeakPolarHBondContact O-CG2 3.49Å; F150-I154 PolarHBondContact O-N 2.81Å; I154-Y157 PolarHBondContact O-N 3.32Å; I154-C158 VanDerWaalsContact O-CB 3.3Å; I154-C158 WeakPolarHBondContact O-CB 3.46Å; I154-C158 PolarHBondContact O-N 2.67Å; I154-L236 HydrophobicContact CD1-CD1 4.48Å; I154-M604 HydrophobicContact CD1-CB 4.42Å; I154-M604 HydrophobicContact CD1-CE 4.21Å; I154-M604 HydrophobicContact CG1-CB 4.2Å; I154-M604 HydrophobicContact CG1-CE 3.56Å; I154-M604 HydrophobicContact CG1-CG 4.19Å
155	S	90	Very high	88.7	Confident	2 Å²	2	22.2 Å²	22.2	1%	0.014	12%	0.118	C	C	.	.	H	α-helix	trans	-64.5	-36.5	173	-75.7	0	0	0	0	113.6	F135 T136 E151 R153 C158 L159	F135-S155 WeakPolarHBondContact CD2-OG 3.24Å; T136-S155 PolarHBondContact O-OG 3.25Å; E151-S155 WeakPolarHBondContact O-CB 3.47Å; E151-S155 PolarHBondContact O-N 3.44Å; E151-S155 VanDerWaalsContact O-N 3.13Å; E151-S155 PolarHBondContact O-OG 3.04Å; R153-S155 VanDerWaalsContact C-N 3.27Å; R153-S155 PolarHBondContact O-N 3.06Å; S155-C158 PolarHBondContact O-N 3.09Å; S155-L159 PolarHBondContact O-N 3.43Å
156	L	92.8	Very high	88.8	Confident	3 Å²	3	24.9 Å²	24.9	2%	0.016	13%	0.13	C	C	.	.	H	α-helix	trans	-65.6	-45.9	175.8	174.3	57.2	0	0	0	111.9	Y141 T144 G152 R153 L159 A160 L313 W316 E317	Y141-L156 HydrophobicContact CD1-CD1 3.44Å; Y141-L156 VanDerWaalsContact CD1-CD1 3.44Å; Y141-L156 HydrophobicContact CE1-CD1 3.81Å; T144-L156 HydrophobicContact CG2-CB 4Å; G152-L156 WeakPolarHBondContact O-CB 3.41Å; G152-L156 PolarHBondContact O-N 3.41Å; G152-L156 VanDerWaalsContact O-N 3.12Å; R153-L156 WeakPolarHBondContact O-CB 3.44Å; R153-L156 PolarHBondContact O-N 3.1Å; L156-L159 PolarHBondContact O-N 3.22Å; L156-A160 PolarHBondContact O-N 3.17Å; L156-L313 HydrophobicContact CD1-CD1 4.09Å; L156-L313 HydrophobicContact CG-CD1 3.76Å; L156-W316 HydrophobicContact CD1-CB 3.74Å; L156-W316 HydrophobicContact CD2-CB 4.29Å; L156-E317 HydrophobicContact CD2-CB 3.88Å; L156-E317 HydrophobicContact CD2-CG 4.43Å
157	Y	93.4	Very high	89.1	Confident	2 Å²	2	25 Å²	25	1%	0.008	13%	0.129	C	C	.	.	H	α-helix	trans	-64.9	-39.5	172.9	-74.2	-89.1	0	0	0	112.1	R153 I154 L159 A160 L161 L313 E317 W535 M600 E603 M604	R153-Y157 HydrophobicContact CG-CD2 4.13Å; R153-Y157 HydrophobicContact CG-CE2 3.79Å; R153-Y157 PolarHBondContact NH2-OH 2.97Å; R153-Y157 WeakPolarHBondContact O-CD2 3.48Å; R153-Y157 PolarHBondContact O-N 3.44Å; I154-Y157 PolarHBondContact O-N 3.32Å; Y157-L159 VanDerWaalsContact C-N 3.34Å; Y157-L159 PolarHBondContact O-N 3.5Å; Y157-A160 PolarHBondContact O-N 2.89Å; Y157-L161 WeakPolarHBondContact O-CB 3.29Å; Y157-L161 PolarHBondContact O-N 3.37Å; Y157-L313 HydrophobicContact CD1-CD1 4.12Å; Y157-L313 HydrophobicContact CD1-CD2 3.94Å; Y157-L313 HydrophobicContact CE1-CD1 4.42Å; Y157-L313 HydrophobicContact CE1-CD2 3.69Å; Y157-L313 HydrophobicContact CG-CD1 4.27Å; Y157-E317 PolarHBondContact OH-OE2 2.89Å; Y157-W535 HydrophobicContact CE1-CZ2 4.26Å; Y157-M600 HydrophobicContact CD1-CG 4.46Å; Y157-E603 HydrophobicContact CD1-CB 3.91Å; Y157-E603 HydrophobicContact CE1-CB 3.33Å; Y157-E603 HydrophobicContact CE1-CG 3.79Å; Y157-E603 HydrophobicContact CE2-CB 4.22Å; Y157-M604 VanDerWaalsContact CB-CG 3.44Å; Y157-M604 HydrophobicContact CG-CG 4.11Å
158	C	92.2	Very high	89.6	Confident	7 Å²	7	24 Å²	24	5%	0.047	13%	0.126	C	C	.	.	H	α-helix	trans	-59.4	-41.7	176.2	-174.7	0	0	0	0	112.4	F135 I154 S155 Q162 M604	F135-C158 HydrophobicContact CE2-CB 4.05Å; F135-C158 HydrophobicContact CZ-CB 3.98Å; I154-C158 VanDerWaalsContact O-CB 3.3Å; I154-C158 WeakPolarHBondContact O-CB 3.46Å; I154-C158 PolarHBondContact O-N 2.67Å; S155-C158 PolarHBondContact O-N 3.09Å; C158-Q162 WeakPolarHBondContact O-CG 3.24Å; C158-Q162 PolarHBondContact O-N 2.85Å; C158-Q162 PolarHBondContact SG-NE2 3.33Å; C158-M604 HydrophobicContact CB-CE 3.89Å
159	L	92.6	Very high	90.2	Very high	10 Å²	10	21 Å²	21	5%	0.052	10%	0.104	C	C	.	.	H	α-helix	trans	-63.2	-45.7	174.2	-83.6	176.2	0	0	0	113	V138 Y141 T144 S155 L156 Y157 L161 Q162 E163	V138-L159 HydrophobicContact CG2-CD1 3.71Å; V138-L159 HydrophobicContact CG2-CD2 4.48Å; V138-L159 HydrophobicContact CG2-CG 3.99Å; V138-L159 VanDerWaalsContact O-CD2 3.3Å; V138-L159 WeakPolarHBondContact O-CD2 3.31Å; Y141-L159 HydrophobicContact CD2-CD1 4.3Å; Y141-L159 HydrophobicContact CE2-CB 4.43Å; Y141-L159 HydrophobicContact CG-CD1 4.22Å; T144-L159 HydrophobicContact CG2-CD1 3.72Å; S155-L159 PolarHBondContact O-N 3.43Å; L156-L159 PolarHBondContact O-N 3.22Å; Y157-L159 VanDerWaalsContact C-N 3.34Å; Y157-L159 PolarHBondContact O-N 3.5Å; L159-L161 VanDerWaalsContact C-N 3.32Å; L159-L161 PolarHBondContact O-N 3.24Å; L159-Q162 PolarHBondContact O-N 3.12Å; L159-E163 PolarHBondContact O-N 2.86Å
160	A	94.9	Very high	90.7	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-66.3	-37.5	-179.1	0	0	0	0	0	111.3	Y141 L156 Y157 E163 V164 T309 L313 M600	Y141-A160 HydrophobicContact CE1-CB 4.45Å; Y141-A160 WeakPolarHBondContact OH-CA 3.4Å; L156-A160 PolarHBondContact O-N 3.17Å; Y157-A160 PolarHBondContact O-N 2.89Å; A160-E163 WeakPolarHBondContact O-CB 3.14Å; A160-E163 PolarHBondContact O-N 3.11Å; A160-V164 PolarHBondContact O-N 3.1Å; A160-T309 HydrophobicContact CB-CG2 3.9Å; A160-L313 HydrophobicContact CB-CB 4.35Å; A160-L313 HydrophobicContact CB-CD1 3.66Å; A160-L313 HydrophobicContact CB-CG 4.49Å; A160-M600 HydrophobicContact CB-CE 3.4Å; A160-M600 HydrophobicContact CB-SD 4.34Å
161	L	93.9	Very high	91.1	Very high	3 Å²	3	21.6 Å²	21.6	2%	0.016	10%	0.104	C	C	.	.	H	α-helix	trans	-61.4	-46.9	172.2	-170.7	58.3	0	0	0	111.5	Y157 L159 E163 V164 Q165 I239 Q243 S597 M600 L601 M604	Y157-L161 WeakPolarHBondContact O-CB 3.29Å; Y157-L161 PolarHBondContact O-N 3.37Å; L159-L161 VanDerWaalsContact C-N 3.32Å; L159-L161 PolarHBondContact O-N 3.24Å; L161-E163 VanDerWaalsContact C-N 3.29Å; L161-E163 PolarHBondContact O-N 3.21Å; L161-V164 PolarHBondContact O-N 3.46Å; L161-Q165 WeakPolarHBondContact O-CG 3.39Å; L161-Q165 PolarHBondContact O-N 2.94Å; L161-I239 HydrophobicContact CD2-CG2 3.52Å; L161-Q243 HydrophobicContact CD1-CG 4.43Å; L161-Q243 HydrophobicContact CD2-CG 4.18Å; L161-S597 VanDerWaalsContact CD1-OG 3.27Å; L161-S597 WeakPolarHBondContact CD1-OG 3.19Å; L161-M600 HydrophobicContact CB-SD 3.83Å; L161-M600 HydrophobicContact CD1-CB 4.37Å; L161-M600 HydrophobicContact CD1-SD 3.97Å; L161-M600 HydrophobicContact CG-SD 4.49Å; L161-L601 HydrophobicContact CD2-CD2 4.42Å; L161-M604 HydrophobicContact CD2-SD 4.27Å
162	Q	91.8	Very high	91.4	Very high	51 Å²	51	19.8 Å²	19.8	24%	0.238	10%	0.096	C	C	.	.	H	α-helix	trans	-61.5	-33.6	172.9	-72.1	176.7	46.5	0	0	113.1	C158 L159 Q166	C158-Q162 WeakPolarHBondContact O-CG 3.24Å; C158-Q162 PolarHBondContact O-N 2.85Å; C158-Q162 PolarHBondContact SG-NE2 3.33Å; L159-Q162 PolarHBondContact O-N 3.12Å; Q162-Q166 WeakPolarHBondContact O-CB 3.17Å; Q162-Q166 PolarHBondContact O-N 3.02Å
163	E	92.6	Very high	91.5	Very high	23 Å²	23	21.6 Å²	21.6	11%	0.107	10%	0.102	C	C	.	.	H	α-helix	trans	-66.9	-44.1	175.1	-178.2	172.5	174.6	0	0	111.6	Y141 L159 A160 L161 Q165 Q166 R167 T309 R312	Y141-E163 VanDerWaalsContact CE2-OE2 3.28Å; Y141-E163 WeakPolarHBondContact CE2-OE2 3.2Å; Y141-E163 PolarHBondContact OH-OE2 3.42Å; L159-E163 PolarHBondContact O-N 2.86Å; A160-E163 WeakPolarHBondContact O-CB 3.14Å; A160-E163 PolarHBondContact O-N 3.11Å; L161-E163 VanDerWaalsContact C-N 3.29Å; L161-E163 PolarHBondContact O-N 3.21Å; E163-Q165 PolarHBondContact O-N 2.97Å; E163-Q166 PolarHBondContact O-N 2.93Å; E163-R167 HydrophobicContact CG-CG 4.37Å; E163-R167 WeakPolarHBondContact O-CB 3.16Å; E163-R167 WeakPolarHBondContact O-CG 3.23Å; E163-R167 PolarHBondContact O-N 3.35Å; E163-R167 IonicContact OE1-CZ 3.86Å; E163-R167 VanDerWaalsContact OE1-CZ 3.26Å; E163-R167 IonicContact OE1-NE 3.34Å; E163-R167 PolarHBondContact OE1-NE 3.44Å; E163-R167 IonicContact OE1-NH2 2.61Å; E163-R167 PolarHBondContact OE1-NH2 3.21Å; E163-T309 HydrophobicContact CB-CG2 4.4Å; E163-T309 HydrophobicContact CG-CG2 4.5Å; E163-R312 IonicContact OE1-NH1 2.72Å; E163-R312 PolarHBondContact OE1-NH1 3.03Å; E163-R312 IonicContact OE2-CZ 2.64Å; E163-R312 IonicContact OE2-NH1 3.19Å; E163-R312 PolarHBondContact OE2-NH1 3.33Å
164	V	93.7	Very high	91.5	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.012	10%	0.102	C	C	.	.	H	α-helix	trans	-58.9	-47	173.9	171.3	0	0	0	0	111.2	A160 L161 Q166 R167 S168 L306 T309 V593 F596	A160-V164 PolarHBondContact O-N 3.1Å; L161-V164 PolarHBondContact O-N 3.46Å; V164-Q166 VanDerWaalsContact C-N 3.32Å; V164-Q166 PolarHBondContact O-N 3.34Å; V164-R167 PolarHBondContact O-N 3.44Å; V164-S168 WeakPolarHBondContact O-CB 3.43Å; V164-S168 PolarHBondContact O-N 2.99Å; V164-L306 HydrophobicContact CB-CD2 4.2Å; V164-L306 HydrophobicContact CG1-CD2 3.46Å; V164-L306 VanDerWaalsContact CG1-CD2 3.46Å; V164-L306 HydrophobicContact CG2-CD2 3.64Å; V164-T309 HydrophobicContact CG2-CG2 3.94Å; V164-V593 HydrophobicContact CG1-CB 4.46Å; V164-V593 HydrophobicContact CG1-CG1 3.79Å; V164-V593 HydrophobicContact CG1-CG2 4.01Å; V164-F596 HydrophobicContact CG2-CD1 3.91Å; V164-F596 HydrophobicContact CG2-CE1 3.6Å
165	Q	91.4	Very high	91.6	Very high	56 Å²	56	21.5 Å²	21.5	26%	0.262	10%	0.102	S	C	.	.	H	α-helix	trans	-57.2	-45.7	176.2	-66.9	-175.2	-18.1	0	0	111.7	L161 E163 S168 F169 Q243 L246	L161-Q165 WeakPolarHBondContact O-CG 3.39Å; L161-Q165 PolarHBondContact O-N 2.94Å; E163-Q165 PolarHBondContact O-N 2.97Å; Q165-S168 PolarHBondContact O-N 3.12Å; Q165-F169 PolarHBondContact O-N 2.87Å; Q165-Q243 VanDerWaalsContact NE2-CD 3.32Å; Q165-L246 HydrophobicContact CB-CD2 4.26Å; Q165-L246 HydrophobicContact CG-CD2 3.54Å
166	Q	89.9	Confident	91.7	Very high	67 Å²	67	21.6 Å²	21.6	31%	0.313	10%	0.102	S	C	.	.	H	α-helix	trans	-66.5	-39.3	179	-179.7	165.6	-21	0	0	112.8	Q162 E163 V164 Q170	Q162-Q166 WeakPolarHBondContact O-CB 3.17Å; Q162-Q166 PolarHBondContact O-N 3.02Å; E163-Q166 PolarHBondContact O-N 2.93Å; V164-Q166 VanDerWaalsContact C-N 3.32Å; V164-Q166 PolarHBondContact O-N 3.34Å; Q166-Q170 VanDerWaalsContact O-CG 3.29Å; Q166-Q170 WeakPolarHBondContact O-CG 3.47Å; Q166-Q170 PolarHBondContact O-N 2.92Å; Q166-Q170 VanDerWaalsContact O-N 3.08Å
167	R	90.1	Very high	91.5	Very high	20 Å²	20	23.4 Å²	23.4	8%	0.075	11%	0.112	C	C	.	.	H	α-helix	trans	-67.1	-38.5	175.3	-71.7	175.3	177.9	-77.2	-4.7	111.8	E163 V164 Q170 L171 D305 E446	E163-R167 HydrophobicContact CG-CG 4.37Å; E163-R167 WeakPolarHBondContact O-CB 3.16Å; E163-R167 WeakPolarHBondContact O-CG 3.23Å; E163-R167 PolarHBondContact O-N 3.35Å; E163-R167 IonicContact OE1-CZ 3.86Å; E163-R167 VanDerWaalsContact OE1-CZ 3.26Å; E163-R167 IonicContact OE1-NE 3.34Å; E163-R167 PolarHBondContact OE1-NE 3.44Å; E163-R167 IonicContact OE1-NH2 2.61Å; E163-R167 PolarHBondContact OE1-NH2 3.21Å; V164-R167 PolarHBondContact O-N 3.44Å; R167-Q170 PolarHBondContact O-N 3.48Å; R167-L171 WeakPolarHBondContact O-CG 3.49Å; R167-L171 PolarHBondContact O-N 3.06Å; R167-D305 WeakPolarHBondContact CD-OD2 3.49Å; R167-D305 IonicContact CZ-OD2 3.45Å; R167-D305 IonicContact NH1-OD1 2.99Å; R167-D305 PolarHBondContact NH1-OD1 3.17Å; R167-D305 IonicContact NH1-OD2 3.4Å; R167-D305 PolarHBondContact NH1-OD2 2.97Å; R167-E446 IonicContact NH2-OE2 2.65Å
168	S	91.4	Very high	91.4	Very high	15 Å²	15	23.5 Å²	23.5	11%	0.105	11%	0.113	C	C	.	.	H	α-helix	trans	-64.3	-43.9	175.3	-164	0	0	0	0	112.1	V164 Q165 Q170 L171 Q172	V164-S168 WeakPolarHBondContact O-CB 3.43Å; V164-S168 PolarHBondContact O-N 2.99Å; Q165-S168 PolarHBondContact O-N 3.12Å; S168-Q170 VanDerWaalsContact C-N 3.34Å; S168-Q170 PolarHBondContact O-N 3.21Å; S168-L171 WeakPolarHBondContact O-CB 3.32Å; S168-L171 PolarHBondContact O-N 2.65Å; S168-Q172 PolarHBondContact O-N 2.94Å; S168-Q172 VanDerWaalsContact O-N 3.09Å
169	F	89.1	Confident	91.4	Very high	44 Å²	44	23.2 Å²	23.2	19%	0.193	11%	0.111	C	C	.	.	H	α-helix	trans	-60.3	-42.1	172.5	173.2	-122.5	0	0	0	112.4	Q165 L171 Q172 E173 L219	Q165-F169 PolarHBondContact O-N 2.87Å; F169-L171 VanDerWaalsContact C-N 3.33Å; F169-L171 PolarHBondContact O-N 2.94Å; F169-Q172 PolarHBondContact O-N 3.17Å; F169-Q172 VanDerWaalsContact O-N 3.15Å; F169-E173 HydrophobicContact CD2-CG 4.06Å; F169-E173 HydrophobicContact CE1-CG 4.11Å; F169-E173 HydrophobicContact CE2-CG 3.51Å; F169-E173 HydrophobicContact CZ-CG 3.55Å; F169-E173 PolarHBondContact O-N 3.48Å; F169-L219 HydrophobicContact CD2-CD2 3.33Å; F169-L219 HydrophobicContact CD2-CG 3.77Å; F169-L219 HydrophobicContact CE2-CD2 3.83Å; F169-L219 HydrophobicContact CE2-CG 4.03Å; F169-L219 HydrophobicContact CG-CD2 4.21Å; F169-L219 HydrophobicContact CG-CG 4.42Å
170	Q	89.8	Confident	91.3	Very high	62 Å²	62	23 Å²	23	29%	0.29	11%	0.109	S	C	.	.	H	α-helix	trans	-62.7	-37.4	177.7	-73.9	171.8	-2.2	0	0	112.6	Q166 R167 S168 E173 E174	Q166-Q170 VanDerWaalsContact O-CG 3.29Å; Q166-Q170 WeakPolarHBondContact O-CG 3.47Å; Q166-Q170 PolarHBondContact O-N 2.92Å; Q166-Q170 VanDerWaalsContact O-N 3.08Å; R167-Q170 PolarHBondContact O-N 3.48Å; S168-Q170 VanDerWaalsContact C-N 3.34Å; S168-Q170 PolarHBondContact O-N 3.21Å; Q170-E173 PolarHBondContact O-N 2.72Å; Q170-E174 WeakPolarHBondContact O-CB 3.12Å; Q170-E174 WeakPolarHBondContact O-CG 3.33Å; Q170-E174 PolarHBondContact O-N 3.37Å
171	L	92.3	Very high	90.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-63.5	-41.3	171.8	-73.4	159.3	0	0	0	112.3	R167 S168 F169 E174 K175 L298 L301 Q302	R167-L171 WeakPolarHBondContact O-CG 3.49Å; R167-L171 PolarHBondContact O-N 3.06Å; S168-L171 WeakPolarHBondContact O-CB 3.32Å; S168-L171 PolarHBondContact O-N 2.65Å; F169-L171 VanDerWaalsContact C-N 3.33Å; F169-L171 PolarHBondContact O-N 2.94Å; L171-E174 PolarHBondContact O-N 3.29Å; L171-K175 PolarHBondContact O-N 3.47Å; L171-L298 HydrophobicContact CB-CD2 4.4Å; L171-L298 HydrophobicContact CD2-CB 4.18Å; L171-L298 HydrophobicContact CD2-CD2 3.46Å; L171-L298 VanDerWaalsContact CD2-CD2 3.46Å; L171-L298 HydrophobicContact CD2-CG 4.43Å; L171-L301 HydrophobicContact CD2-CB 3.94Å; L171-L301 HydrophobicContact CD2-CD1 4.37Å; L171-Q302 HydrophobicContact CD1-CB 3.58Å; L171-Q302 HydrophobicContact CD1-CG 3.67Å
172	Q	91.4	Very high	90.7	Very high	22 Å²	22	24.3 Å²	24.3	10%	0.103	12%	0.115	C	C	.	.	H	α-helix	trans	-67.4	-36.9	176.5	-172.8	57.6	31.3	0	0	112.3	S168 F169 K175 N176	S168-Q172 PolarHBondContact O-N 2.94Å; S168-Q172 VanDerWaalsContact O-N 3.09Å; F169-Q172 PolarHBondContact O-N 3.17Å; F169-Q172 VanDerWaalsContact O-N 3.15Å; Q172-K175 WeakPolarHBondContact O-CB 3.49Å; Q172-K175 PolarHBondContact O-N 2.84Å; Q172-N176 PolarHBondContact NE2-OD1 2.82Å; Q172-N176 WeakPolarHBondContact O-CB 3.31Å; Q172-N176 PolarHBondContact O-N 3.2Å; Q172-N176 PolarHBondContact O-ND2 2.64Å; Q172-N176 PolarHBondContact O-OD1 2.69Å
173	E	88.9	Confident	90.6	Very high	46 Å²	46	22 Å²	22	22%	0.215	11%	0.105	C	C	.	.	H	α-helix	trans	-67.5	-38.9	173.8	-78.9	-60.8	105.2	0	0	113	F169 Q170 N176 L177 R216	F169-E173 HydrophobicContact CD2-CG 4.06Å; F169-E173 HydrophobicContact CE1-CG 4.11Å; F169-E173 HydrophobicContact CE2-CG 3.51Å; F169-E173 HydrophobicContact CZ-CG 3.55Å; F169-E173 PolarHBondContact O-N 3.48Å; Q170-E173 PolarHBondContact O-N 2.72Å; E173-N176 PolarHBondContact O-N 3.41Å; E173-N176 PolarHBondContact OE1-ND2 2.67Å; E173-L177 WeakPolarHBondContact O-CB 3.27Å; E173-L177 PolarHBondContact O-N 3.38Å; E173-R216 WeakPolarHBondContact OE1-CG 3.31Å; E173-R216 IonicContact OE1-CZ 2.68Å; E173-R216 IonicContact OE1-NE 3.84Å; E173-R216 PolarHBondContact OE1-NE 3.2Å; E173-R216 IonicContact OE1-NH2 3.88Å; E173-R216 PolarHBondContact OE1-NH2 3.02Å; E173-R216 IonicContact OE2-CZ 2.63Å; E173-R216 IonicContact OE2-NE 3.92Å; E173-R216 PolarHBondContact OE2-NE 2.79Å; E173-R216 IonicContact OE2-NH2 3.5Å; E173-R216 PolarHBondContact OE2-NH2 3.02Å
174	E	90	Very high	90.4	Very high	14 Å²	14	23.7 Å²	23.7	7%	0.065	11%	0.112	C	C	.	.	H	α-helix	trans	-65.7	-37.7	174.1	-75.4	177.1	169.2	0	0	111.2	Q170 L171 L177 I178 R411 L435 R439	Q170-E174 WeakPolarHBondContact O-CB 3.12Å; Q170-E174 WeakPolarHBondContact O-CG 3.33Å; Q170-E174 PolarHBondContact O-N 3.37Å; L171-E174 PolarHBondContact O-N 3.29Å; E174-L177 PolarHBondContact O-N 2.93Å; E174-I178 WeakPolarHBondContact O-CB 3.32Å; E174-I178 WeakPolarHBondContact O-CD1 3.44Å; E174-I178 VanDerWaalsContact O-CG1 3.26Å; E174-I178 WeakPolarHBondContact O-CG1 3.32Å; E174-I178 PolarHBondContact O-N 2.98Å; E174-R411 IonicContact OE1-CZ 3.49Å; E174-R411 IonicContact OE1-NH1 3.19Å; E174-R411 IonicContact OE1-NH2 2.94Å; E174-R411 PolarHBondContact OE1-NH2 2.88Å; E174-L435 HydrophobicContact CB-CD1 3.96Å; E174-L435 HydrophobicContact CG-CD1 3.94Å; E174-L435 HydrophobicContact CG-CD2 4.07Å; E174-R439 IonicContact OE2-CZ 3.82Å; E174-R439 IonicContact OE2-NE 3.59Å; E174-R439 IonicContact OE2-NH2 3.64Å; E174-R439 PolarHBondContact OE2-NH2 2.74Å
175	K	92.3	Very high	90	Very high	3 Å²	3	24.6 Å²	24.6	1%	0.013	12%	0.117	C	C	.	.	H	α-helix	trans	-60	-52.9	168.3	-179.3	173.7	-174	146.9	0	112.9	L171 Q172 L177 I178 F179 E295 L298 H582 L586	L171-K175 PolarHBondContact O-N 3.47Å; Q172-K175 WeakPolarHBondContact O-CB 3.49Å; Q172-K175 PolarHBondContact O-N 2.84Å; K175-L177 PolarHBondContact O-N 3.3Å; K175-I178 PolarHBondContact O-N 3.33Å; K175-F179 PolarHBondContact O-N 3.49Å; K175-E295 WeakPolarHBondContact CD-OE2 3.29Å; K175-E295 WeakPolarHBondContact CE-OE2 3.36Å; K175-E295 IonicContact NZ-OE2 2.74Å; K175-E295 PolarHBondContact NZ-OE2 2.69Å; K175-L298 HydrophobicContact CB-CD1 3.74Å; K175-L298 HydrophobicContact CG-CD1 4.33Å; K175-H582 PolarHBondContact NZ-NE2 2.93Å; K175-L586 HydrophobicContact CD-CD2 4.21Å
176	N	91.1	Very high	89.7	Confident	4 Å²	4	22.6 Å²	22.6	2%	0.021	11%	0.108	C	C	.	.	H	α-helix	trans	-56.2	-39	-178.8	-69.5	-18.5	0	0	0	110.8	Q172 E173 L180 L212	Q172-N176 PolarHBondContact NE2-OD1 2.82Å; Q172-N176 WeakPolarHBondContact O-CB 3.31Å; Q172-N176 PolarHBondContact O-N 3.2Å; Q172-N176 PolarHBondContact O-ND2 2.64Å; Q172-N176 PolarHBondContact O-OD1 2.69Å; E173-N176 PolarHBondContact O-N 3.41Å; E173-N176 PolarHBondContact OE1-ND2 2.67Å; N176-L180 WeakPolarHBondContact O-CG 3.34Å; N176-L180 PolarHBondContact O-N 3.04Å; N176-L212 HydrophobicContact CB-CD1 4.46Å
177	L	88.6	Confident	89.4	Confident	41 Å²	41	19.8 Å²	19.8	22%	0.215	10%	0.095	C	C	.	.	H	α-helix	trans	-71.9	-44.5	177.9	-173.2	52.9	0	0	0	112.6	E173 E174 K175 F179 L180 Q181 L415 Y431	E173-L177 WeakPolarHBondContact O-CB 3.27Å; E173-L177 PolarHBondContact O-N 3.38Å; E174-L177 PolarHBondContact O-N 2.93Å; K175-L177 PolarHBondContact O-N 3.3Å; L177-F179 PolarHBondContact O-N 3.43Å; L177-L180 PolarHBondContact O-N 3.28Å; L177-Q181 WeakPolarHBondContact O-CG 3.38Å; L177-Q181 PolarHBondContact O-N 3.35Å; L177-Q181 VanDerWaalsContact O-N 3.14Å; L177-L415 HydrophobicContact CD1-CD1 4.49Å; L177-Y431 HydrophobicContact CD2-CE1 4.2Å; L177-Y431 WeakPolarHBondContact CD2-OH 3.45Å; L177-Y431 HydrophobicContact CG-CE1 4.15Å
178	I	90.6	Very high	89	Confident	4 Å²	4	22 Å²	22	2%	0.021	11%	0.114	C	C	.	.	H	α-helix	trans	-55.9	-50.3	174.1	-74.5	163.4	0	0	0	110.6	E174 K175 L180 Q181 M182 A294 T428 Y431 Q432 L435	E174-I178 WeakPolarHBondContact O-CB 3.32Å; E174-I178 WeakPolarHBondContact O-CD1 3.44Å; E174-I178 VanDerWaalsContact O-CG1 3.26Å; E174-I178 WeakPolarHBondContact O-CG1 3.32Å; E174-I178 PolarHBondContact O-N 2.98Å; K175-I178 PolarHBondContact O-N 3.33Å; I178-L180 VanDerWaalsContact C-N 3.35Å; I178-L180 PolarHBondContact O-N 3.25Å; I178-Q181 PolarHBondContact O-N 3.46Å; I178-M182 HydrophobicContact CG2-CG 4.34Å; I178-M182 HydrophobicContact CG2-SD 3.74Å; I178-M182 WeakPolarHBondContact O-CG 3.45Å; I178-M182 PolarHBondContact O-N 2.78Å; I178-A294 HydrophobicContact CG2-CB 4.38Å; I178-T428 HydrophobicContact CG2-CG2 3.78Å; I178-Y431 HydrophobicContact CG1-CD1 3.94Å; I178-Y431 HydrophobicContact CG1-CE1 4.48Å; I178-Q432 HydrophobicContact CD1-CG 3.97Å; I178-L435 HydrophobicContact CD1-CD1 4.18Å; I178-L435 HydrophobicContact CG1-CD1 4.44Å
179	F	93.1	Very high	88.4	Confident	1 Å²	1	25.3 Å²	25.3	0%	0.004	14%	0.136	C	C	.	.	H	α-helix	trans	-57.6	-44.7	179.9	178	-127.8	0	0	0	112.3	K175 L177 Q181 M182 L183 L212 F257 L261 L264 V287 L291	K175-F179 PolarHBondContact O-N 3.49Å; L177-F179 PolarHBondContact O-N 3.43Å; F179-Q181 VanDerWaalsContact C-N 3.28Å; F179-Q181 PolarHBondContact O-N 2.83Å; F179-M182 PolarHBondContact O-N 2.95Å; F179-L183 HydrophobicContact CD2-CG 4.39Å; F179-L183 HydrophobicContact CE1-CD1 4.17Å; F179-L183 HydrophobicContact CE2-CD1 4.09Å; F179-L183 HydrophobicContact CE2-CD2 3.99Å; F179-L183 HydrophobicContact CE2-CG 4.06Å; F179-L183 HydrophobicContact CZ-CD1 3.82Å; F179-L183 HydrophobicContact CZ-CD2 4.45Å; F179-L183 HydrophobicContact CZ-CG 4.32Å; F179-L183 WeakPolarHBondContact O-CG 3.47Å; F179-L183 PolarHBondContact O-N 3.09Å; F179-L183 VanDerWaalsContact O-N 3.12Å; F179-L212 HydrophobicContact CD1-CD1 4.11Å; F179-F257 HydrophobicContact CB-CZ 4.34Å; F179-F257 AromaticContact CD1-CE2 3.94Å; F179-F257 HydrophobicContact CD1-CE2 3.94Å; F179-F257 AromaticContact CD1-CZ 3.9Å; F179-F257 HydrophobicContact CD1-CZ 3.9Å; F179-F257 HydrophobicContact CE1-CE2 4.43Å; F179-F257 HydrophobicContact CE1-CZ 4.32Å; F179-F257 HydrophobicContact CG-CE2 4.41Å; F179-F257 HydrophobicContact CG-CZ 4Å; F179-L261 HydrophobicContact CE2-CD1 4.09Å; F179-L261 HydrophobicContact CZ-CD1 4.33Å; F179-L264 HydrophobicContact CE2-CD2 4.32Å; F179-L264 HydrophobicContact CZ-CD2 3.92Å; F179-V287 HydrophobicContact CE2-CG1 4.22Å; F179-L291 HydrophobicContact CB-CD2 4.15Å; F179-L291 HydrophobicContact CD2-CD1 4Å; F179-L291 HydrophobicContact CD2-CD2 4.01Å; F179-L291 HydrophobicContact CD2-CG 4.37Å; F179-L291 HydrophobicContact CE2-CD1 4.16Å; F179-L291 HydrophobicContact CG-CD2 4.39Å
180	L	90.2	Very high	87.8	Confident	4 Å²	4	26.4 Å²	26.4	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-64.1	-29.2	176	-74.5	175.4	0	0	0	113.6	N176 L177 I178 K184 Q208 E209 L212	N176-L180 WeakPolarHBondContact O-CG 3.34Å; N176-L180 PolarHBondContact O-N 3.04Å; L177-L180 PolarHBondContact O-N 3.28Å; I178-L180 VanDerWaalsContact C-N 3.35Å; I178-L180 PolarHBondContact O-N 3.25Å; L180-K184 WeakPolarHBondContact O-CD 3.31Å; L180-K184 VanDerWaalsContact O-CG 3.23Å; L180-K184 WeakPolarHBondContact O-CG 3.47Å; L180-K184 PolarHBondContact O-N 2.91Å; L180-Q208 HydrophobicContact CD2-CB 4.47Å; L180-E209 HydrophobicContact CD1-CB 4.21Å; L180-E209 HydrophobicContact CD1-CG 4.1Å; L180-E209 HydrophobicContact CD2-CB 4Å; L180-L212 HydrophobicContact CD1-CD1 3.83Å; L180-L212 HydrophobicContact CD2-CD1 3.82Å; L180-L212 HydrophobicContact CG-CD1 3.57Å
181	Q	87.5	Confident	87.2	Confident	30 Å²	30	24.1 Å²	24.1	14%	0.14	13%	0.128	C	C	.	.	H	α-helix	trans	-75.1	-39.9	173.3	-60.5	-47.7	-37	0	0	112.2	L177 I178 F179 L183 K184 V185 L415	L177-Q181 WeakPolarHBondContact O-CG 3.38Å; L177-Q181 PolarHBondContact O-N 3.35Å; L177-Q181 VanDerWaalsContact O-N 3.14Å; I178-Q181 PolarHBondContact O-N 3.46Å; F179-Q181 VanDerWaalsContact C-N 3.28Å; F179-Q181 PolarHBondContact O-N 2.83Å; Q181-L183 VanDerWaalsContact C-N 3.28Å; Q181-L183 PolarHBondContact O-N 3.46Å; Q181-K184 WeakPolarHBondContact O-CB 3.24Å; Q181-K184 PolarHBondContact O-N 3.34Å; Q181-V185 WeakPolarHBondContact O-CG2 3.46Å; Q181-V185 PolarHBondContact O-N 2.96Å; Q181-L415 HydrophobicContact CG-CD2 3.51Å
182	M	90	Very high	86	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-56.7	-44.3	175.8	-66.3	165.2	57.2	0	0	111.5	I178 F179 V185 I186 V287 T290 L291 L424	I178-M182 HydrophobicContact CG2-CG 4.34Å; I178-M182 HydrophobicContact CG2-SD 3.74Å; I178-M182 WeakPolarHBondContact O-CG 3.45Å; I178-M182 PolarHBondContact O-N 2.78Å; F179-M182 PolarHBondContact O-N 2.95Å; M182-V185 PolarHBondContact O-N 2.92Å; M182-I186 WeakPolarHBondContact O-CG1 3.12Å; M182-I186 PolarHBondContact O-N 2.94Å; M182-I186 VanDerWaalsContact O-N 3.17Å; M182-V287 HydrophobicContact CE-CB 4.34Å; M182-V287 HydrophobicContact CE-CG1 4.14Å; M182-V287 HydrophobicContact CE-CG2 4.49Å; M182-V287 VanDerWaalsContact CE-O 3.3Å; M182-V287 WeakPolarHBondContact CE-O 3.42Å; M182-T290 HydrophobicContact CE-CG2 3.65Å; M182-T290 HydrophobicContact CG-CG2 4.33Å; M182-T290 HydrophobicContact SD-CG2 3.84Å; M182-L291 HydrophobicContact CE-CD2 4.36Å; M182-L291 HydrophobicContact CE-CG 3.89Å; M182-L291 HydrophobicContact SD-CD2 4.14Å; M182-L291 HydrophobicContact SD-CG 4.32Å; M182-L424 HydrophobicContact CB-CD1 3.9Å; M182-L424 HydrophobicContact CE-CD2 4.22Å; M182-L424 HydrophobicContact CG-CD1 4.15Å; M182-L424 HydrophobicContact CG-CG 4.39Å
183	L	89.3	Confident	84.7	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.016	18%	0.18	C	C	.	.	H	α-helix	trans	-65.9	-37.7	174.8	-59.6	-170.7	0	0	0	112.6	F179 Q181 F187 L205 Q208 L264 V287	F179-L183 HydrophobicContact CD2-CG 4.39Å; F179-L183 HydrophobicContact CE1-CD1 4.17Å; F179-L183 HydrophobicContact CE2-CD1 4.09Å; F179-L183 HydrophobicContact CE2-CD2 3.99Å; F179-L183 HydrophobicContact CE2-CG 4.06Å; F179-L183 HydrophobicContact CZ-CD1 3.82Å; F179-L183 HydrophobicContact CZ-CD2 4.45Å; F179-L183 HydrophobicContact CZ-CG 4.32Å; F179-L183 WeakPolarHBondContact O-CG 3.47Å; F179-L183 PolarHBondContact O-N 3.09Å; F179-L183 VanDerWaalsContact O-N 3.12Å; Q181-L183 VanDerWaalsContact C-N 3.28Å; Q181-L183 PolarHBondContact O-N 3.46Å; L183-F187 HydrophobicContact CB-CD2 4.15Å; L183-F187 HydrophobicContact CB-CE2 4.01Å; L183-F187 WeakPolarHBondContact O-CB 3.23Å; L183-F187 WeakPolarHBondContact O-CD2 3.05Å; L183-F187 WeakPolarHBondContact O-CG 3.24Å; L183-F187 PolarHBondContact O-N 3.37Å; L183-L205 HydrophobicContact CB-CD2 3.59Å; L183-Q208 HydrophobicContact CD1-CB 4.13Å; L183-Q208 HydrophobicContact CD1-CG 3.94Å; L183-L264 HydrophobicContact CD1-CD2 3.76Å; L183-L264 HydrophobicContact CD2-CD2 3.63Å; L183-L264 HydrophobicContact CG-CD2 4.35Å; L183-V287 HydrophobicContact CD2-CG2 4.4Å
184	K	87.3	Confident	83.3	Confident	59 Å²	59	40.1 Å²	40.1	26%	0.257	21%	0.21	S	C	.	.	H	α-helix	trans	-64.7	-39.3	176.6	-77	167.1	-175.1	175.8	0	112.4	L180 Q181 S188 L205	L180-K184 WeakPolarHBondContact O-CD 3.31Å; L180-K184 VanDerWaalsContact O-CG 3.23Å; L180-K184 WeakPolarHBondContact O-CG 3.47Å; L180-K184 PolarHBondContact O-N 2.91Å; Q181-K184 WeakPolarHBondContact O-CB 3.24Å; Q181-K184 PolarHBondContact O-N 3.34Å; K184-S188 WeakPolarHBondContact O-CB 3.49Å; K184-S188 PolarHBondContact O-N 2.8Å; K184-S188 PolarHBondContact O-OG 3.41Å; K184-L205 HydrophobicContact CG-CD1 3.88Å; K184-L205 HydrophobicContact CG-CD2 3.83Å
185	V	85.8	Confident	81.9	Confident	20 Å²	20	45.2 Å²	45.2	12%	0.121	23%	0.232	C	C	.	.	H	α-helix	trans	-60.4	-57.2	174.7	168.2	0	0	0	0	110.2	Q181 M182 F187 S188 S189 L424 Q427	Q181-V185 WeakPolarHBondContact O-CG2 3.46Å; Q181-V185 PolarHBondContact O-N 2.96Å; M182-V185 PolarHBondContact O-N 2.92Å; V185-F187 PolarHBondContact O-N 2.88Å; V185-S188 PolarHBondContact O-N 3.18Å; V185-S188 VanDerWaalsContact O-N 3.15Å; V185-S189 PolarHBondContact O-N 3.03Å; V185-S189 PolarHBondContact O-OG 3Å; V185-L424 HydrophobicContact CB-CD1 3.9Å; V185-L424 HydrophobicContact CG1-CD1 3.83Å; V185-Q427 VanDerWaalsContact CG2-OE1 3.28Å
186	I	85.3	Confident	80.4	Confident	15 Å²	15	52.4 Å²	52.4	8%	0.077	27%	0.27	C	S	.	.	H	α-helix	trans	-57.7	-53.1	-178.2	-70.8	165.6	0	0	0	110.3	M182 S188 S189 R190 D283 V287 L424	M182-I186 WeakPolarHBondContact O-CG1 3.12Å; M182-I186 PolarHBondContact O-N 2.94Å; M182-I186 VanDerWaalsContact O-N 3.17Å; I186-S188 PolarHBondContact O-N 3.5Å; I186-S189 PolarHBondContact O-N 2.97Å; I186-S189 PolarHBondContact O-OG 3.32Å; I186-R190 HydrophobicContact CG2-CG 4.2Å; I186-R190 WeakPolarHBondContact O-CB 3.29Å; I186-R190 VanDerWaalsContact O-CG 3.24Å; I186-R190 WeakPolarHBondContact O-CG 3.34Å; I186-R190 PolarHBondContact O-N 3.46Å; I186-D283 HydrophobicContact CG2-CB 4.31Å; I186-D283 VanDerWaalsContact CG2-OD2 3.3Å; I186-D283 WeakPolarHBondContact CG2-OD2 3.34Å; I186-V287 HydrophobicContact CD1-CG2 3.24Å; I186-L424 HydrophobicContact CD1-CD1 4.28Å; I186-L424 HydrophobicContact CD1-CD2 4.01Å; I186-L424 HydrophobicContact CG1-CD1 4.17Å
187	F	84.2	Confident	79.3	Confident	7 Å²	7	54 Å²	54	3%	0.031	28%	0.279	C	S	.	.	H	α-helix	trans	-66.1	-26.3	-178.7	-64.9	-42.5	0	0	0	113.5	L183 V185 F191 A201 T204 L205 L268	L183-F187 HydrophobicContact CB-CD2 4.15Å; L183-F187 HydrophobicContact CB-CE2 4.01Å; L183-F187 WeakPolarHBondContact O-CB 3.23Å; L183-F187 WeakPolarHBondContact O-CD2 3.05Å; L183-F187 WeakPolarHBondContact O-CG 3.24Å; L183-F187 PolarHBondContact O-N 3.37Å; V185-F187 PolarHBondContact O-N 2.88Å; F187-F191 HydrophobicContact CB-CD2 4.41Å; F187-F191 AromaticContact CD1-CD2 3.8Å; F187-F191 HydrophobicContact CD1-CD2 3.8Å; F187-F191 AromaticContact CD1-CE2 3.81Å; F187-F191 HydrophobicContact CD1-CE2 3.81Å; F187-F191 HydrophobicContact CE1-CE2 4.29Å; F187-F191 WeakPolarHBondContact O-CA 3.38Å; F187-F191 WeakPolarHBondContact O-CB 3.43Å; F187-F191 PolarHBondContact O-N 3.44Å; F187-A201 HydrophobicContact CB-CB 3.93Å; F187-A201 HydrophobicContact CG-CB 4.23Å; F187-T204 HydrophobicContact CE2-CG2 3.98Å; F187-T204 HydrophobicContact CZ-CG2 3.75Å; F187-L205 HydrophobicContact CD2-CD1 4.07Å; F187-L205 HydrophobicContact CD2-CD2 3.8Å; F187-L205 HydrophobicContact CD2-CG 3.63Å; F187-L205 HydrophobicContact CE2-CD2 4.13Å; F187-L205 HydrophobicContact CE2-CG 4.07Å; F187-L268 HydrophobicContact CE1-CD2 3.98Å; F187-L268 HydrophobicContact CZ-CD2 4.38Å
188	S	80.9	Confident	78.6	Confident	68 Å²	68	53.1 Å²	53.1	48%	0.476	28%	0.278	S	S	.	.	H	α-helix	trans	-75.5	-34.8	174.5	-59.7	0	0	0	0	113.4	K184 V185 I186	K184-S188 WeakPolarHBondContact O-CB 3.49Å; K184-S188 PolarHBondContact O-N 2.8Å; K184-S188 PolarHBondContact O-OG 3.41Å; V185-S188 PolarHBondContact O-N 3.18Å; V185-S188 VanDerWaalsContact O-N 3.15Å; I186-S188 PolarHBondContact O-N 3.5Å
189	S	79.5	Confident	78.1	Confident	83 Å²	83	57.2 Å²	57.2	58%	0.58	30%	0.3	S	S	*	.	H	α-helix	trans	-77.1	-34.2	176.7	65.9	0	0	0	0	112.3	V185 I186	V185-S189 PolarHBondContact O-N 3.03Å; V185-S189 PolarHBondContact O-OG 3Å; I186-S189 PolarHBondContact O-N 2.97Å; I186-S189 PolarHBondContact O-OG 3.32Å
190	R	76.8	Confident	77.6	Confident	68 Å²	68	59.8 Å²	59.8	26%	0.257	31%	0.311	S	S	.	.	H	α-helix	trans	-90.9	-33	-176	-57.2	-45.3	-153.1	135.9	5.8	114.2	I186 P192 F275 E279 D283	I186-R190 HydrophobicContact CG2-CG 4.2Å; I186-R190 WeakPolarHBondContact O-CB 3.29Å; I186-R190 VanDerWaalsContact O-CG 3.24Å; I186-R190 WeakPolarHBondContact O-CG 3.34Å; I186-R190 PolarHBondContact O-N 3.46Å; R190-P192 WeakPolarHBondContact O-CD 3.28Å; R190-F275 HydrophobicContact CB-CD2 4.33Å; R190-F275 HydrophobicContact CB-CE2 3.54Å; R190-F275 HydrophobicContact CB-CZ 4.1Å; R190-F275 HydrophobicContact CG-CE2 3.44Å; R190-F275 VanDerWaalsContact CG-CE2 3.44Å; R190-F275 HydrophobicContact CG-CZ 3.54Å; R190-F275 VanDerWaalsContact CZ-CZ 3.43Å; R190-E279 IonicContact CZ-OE1 3.31Å; R190-E279 IonicContact NH1-OE1 3.93Å; R190-E279 PolarHBondContact NH1-OE1 3.03Å; R190-D283 WeakPolarHBondContact CG-OD2 3.29Å; R190-D283 IonicContact CZ-OD1 3.81Å; R190-D283 IonicContact CZ-OD2 2.89Å; R190-D283 IonicContact NE-OD1 3.46Å; R190-D283 PolarHBondContact NE-OD1 2.94Å; R190-D283 IonicContact NE-OD2 2.74Å; R190-D283 PolarHBondContact NE-OD2 3Å; R190-D283 IonicContact NH2-OD1 2.67Å; R190-D283 PolarHBondContact NH2-OD1 3.18Å; R190-D283 IonicContact NH2-OD2 3.55Å
191	F	75.6	Confident	77.3	Confident	14 Å²	14	60 Å²	60	6%	0.061	31%	0.313	C	S	.	.	S	Bend	trans	-122.6	76.6	-178.2	-54.4	-64.1	0	0	0	111.6	F187 D197 A201 R271 F275	F187-F191 HydrophobicContact CB-CD2 4.41Å; F187-F191 AromaticContact CD1-CD2 3.8Å; F187-F191 HydrophobicContact CD1-CD2 3.8Å; F187-F191 AromaticContact CD1-CE2 3.81Å; F187-F191 HydrophobicContact CD1-CE2 3.81Å; F187-F191 HydrophobicContact CE1-CE2 4.29Å; F187-F191 WeakPolarHBondContact O-CA 3.38Å; F187-F191 WeakPolarHBondContact O-CB 3.43Å; F187-F191 PolarHBondContact O-N 3.44Å; F191-D197 HydrophobicContact CD1-CB 3.65Å; F191-D197 HydrophobicContact CE1-CB 4.3Å; F191-D197 HydrophobicContact CG-CB 4.42Å; F191-A201 HydrophobicContact CB-CB 4.03Å; F191-A201 HydrophobicContact CD2-CB 4.09Å; F191-A201 HydrophobicContact CG-CB 4.34Å; F191-R271 VanDerWaalsContact CE1-NH1 3.27Å; F191-F275 HydrophobicContact CE1-CD2 4.29Å; F191-F275 HydrophobicContact CZ-CB 4.47Å; F191-F275 AromaticContact CZ-CD2 3.94Å; F191-F275 HydrophobicContact CZ-CD2 3.94Å; F191-F275 HydrophobicContact CZ-CG 4.22Å
192	P	68	Low	77.2	Confident	55 Å²	55	64.5 Å²	64.5	36%	0.357	33%	0.332	S	S	.	.			trans	-60.2	151.5	174.6	26.4	-35	0	0	0	111.6	R190 D194	R190-P192 WeakPolarHBondContact O-CD 3.28Å; P192-D194 PolarHBondContact O-N 2.74Å
193	K	64.5	Low	77.1	Confident	192 Å²	192	68.9 Å²	68.9	84%	0.835	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-13.8	-162.7	-63.3	178.6	-178.4	174.5	0	115.9	K195	K193-K195 VanDerWaalsContact C-N 3.34Å; K193-K195 PolarHBondContact O-N 2.97Å
194	D	58.8	Low	77.1	Confident	156 Å²	156	69 Å²	69	83%	0.834	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	19	-169.6	-45.6	-53	0	0	0	113.5	P192	P192-D194 PolarHBondContact O-N 2.74Å
195	K	60.9	Low	77.2	Confident	121 Å²	121	67.5 Å²	67.5	53%	0.526	35%	0.351	S	S	.	.	S	Bend	trans	-132.1	151.2	-177	-64.7	-178.1	179.3	179.4	0	112	K193 D197 A198	K193-K195 VanDerWaalsContact C-N 3.34Å; K193-K195 PolarHBondContact O-N 2.97Å; K195-D197 HydrophobicContact CB-CB 4.38Å; K195-D197 PolarHBondContact O-N 3.41Å; K195-A198 VanDerWaalsContact O-CB 3.24Å; K195-A198 WeakPolarHBondContact O-CB 3.29Å; K195-A198 PolarHBondContact O-N 3.39Å
196	N	61.3	Low	77.5	Confident	154 Å²	154	71.8 Å²	71.8	82%	0.824	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-26.7	171	-65.4	-10.5	0	0	0	113.2	A198 D199	N196-A198 PolarHBondContact O-N 2.93Å; N196-D199 PolarHBondContact O-N 3Å
197	D	67.7	Low	77.8	Confident	37 Å²	37	75 Å²	75	20%	0.198	39%	0.389	C	S	.	.	H	α-helix	trans	-66.5	-15.3	177.3	-60.8	-64.2	0	0	0	114.1	F191 K195 F200 A201 R271	F191-D197 HydrophobicContact CD1-CB 3.65Å; F191-D197 HydrophobicContact CE1-CB 4.3Å; F191-D197 HydrophobicContact CG-CB 4.42Å; K195-D197 HydrophobicContact CB-CB 4.38Å; K195-D197 PolarHBondContact O-N 3.41Å; D197-F200 PolarHBondContact O-N 3.03Å; D197-A201 PolarHBondContact O-N 3.39Å; D197-R271 VanDerWaalsContact CB-NH2 3.27Å; D197-R271 VanDerWaalsContact CG-NH2 3.33Å; D197-R271 IonicContact OD1-CZ 2.68Å; D197-R271 IonicContact OD1-NH2 2.75Å; D197-R271 PolarHBondContact OD1-NH2 3.44Å
198	A	73.4	Confident	78.3	Confident	23 Å²	23	74.7 Å²	74.7	19%	0.19	39%	0.387	C	S	.	.	H	α-helix	trans	-70.3	-31.1	178.5	0	0	0	0	0	113	K195 N196 A201 K202	K195-A198 VanDerWaalsContact O-CB 3.24Å; K195-A198 WeakPolarHBondContact O-CB 3.29Å; K195-A198 PolarHBondContact O-N 3.39Å; N196-A198 PolarHBondContact O-N 2.93Å; A198-A201 PolarHBondContact O-N 3.01Å; A198-K202 WeakPolarHBondContact O-CB 3.41Å; A198-K202 PolarHBondContact O-N 3.33Å
199	D	80.4	Confident	78.8	Confident	90 Å²	90	75.1 Å²	75.1	48%	0.481	38%	0.382	S	S	.	.	H	α-helix	trans	-69.5	-38.7	174.6	-78.4	-47.2	0	0	0	111.1	N196 A201 K202 D203	N196-D199 PolarHBondContact O-N 3Å; D199-A201 VanDerWaalsContact C-N 3.32Å; D199-A201 PolarHBondContact O-N 3.37Å; D199-K202 PolarHBondContact O-N 3.39Å; D199-K202 IonicContact OD1-NZ 2.73Å; D199-K202 PolarHBondContact OD1-NZ 3.03Å; D199-D203 WeakPolarHBondContact O-CB 3.42Å; D199-D203 PolarHBondContact O-N 3.33Å
200	F	82.7	Confident	79.4	Confident	56 Å²	56	76.9 Å²	76.9	25%	0.246	38%	0.379	C	S	.	.	H	α-helix	trans	-57.5	-44.5	171.2	172.8	-80.1	0	0	0	112	D197 T204 L267 R271	D197-F200 PolarHBondContact O-N 3.03Å; F200-T204 WeakPolarHBondContact CE1-OG1 3.46Å; F200-T204 WeakPolarHBondContact O-CB 3.37Å; F200-T204 PolarHBondContact O-N 3.26Å; F200-T204 PolarHBondContact O-OG1 2.66Å; F200-L267 HydrophobicContact CE2-CD1 4.26Å; F200-L267 HydrophobicContact CE2-CG 4.42Å; F200-L267 HydrophobicContact CZ-CD1 4.36Å; F200-L267 HydrophobicContact CZ-CD2 4.11Å; F200-L267 HydrophobicContact CZ-CG 4.04Å; F200-R271 VanDerWaalsContact CE1-NH1 3.27Å
201	A	83.3	Confident	80.1	Confident	8 Å²	8	76.3 Å²	76.3	7%	0.066	38%	0.378	C	S	.	.	H	α-helix	trans	-61	-46.3	179.6	0	0	0	0	0	111.5	F187 F191 D197 A198 D199 L205	F187-A201 HydrophobicContact CB-CB 3.93Å; F187-A201 HydrophobicContact CG-CB 4.23Å; F191-A201 HydrophobicContact CB-CB 4.03Å; F191-A201 HydrophobicContact CD2-CB 4.09Å; F191-A201 HydrophobicContact CG-CB 4.34Å; D197-A201 PolarHBondContact O-N 3.39Å; A198-A201 PolarHBondContact O-N 3.01Å; D199-A201 VanDerWaalsContact C-N 3.32Å; D199-A201 PolarHBondContact O-N 3.37Å; A201-L205 WeakPolarHBondContact O-CB 3.44Å; A201-L205 VanDerWaalsContact O-CG 3.31Å; A201-L205 WeakPolarHBondContact O-CG 3.13Å; A201-L205 PolarHBondContact O-N 2.93Å
202	K	85.7	Confident	80.8	Confident	124 Å²	124	75.6 Å²	75.6	54%	0.539	38%	0.375	S	S	.	.	H	α-helix	trans	-64.6	-46.6	177.5	174.5	-174.4	162.4	-153.2	0	112.6	A198 D199 L205 L206	A198-K202 WeakPolarHBondContact O-CB 3.41Å; A198-K202 PolarHBondContact O-N 3.33Å; D199-K202 PolarHBondContact O-N 3.39Å; D199-K202 IonicContact OD1-NZ 2.73Å; D199-K202 PolarHBondContact OD1-NZ 3.03Å; K202-L205 PolarHBondContact O-N 2.79Å; K202-L206 WeakPolarHBondContact O-CB 3.33Å; K202-L206 PolarHBondContact O-N 3.37Å
203	D	88.2	Confident	81.7	Confident	94 Å²	94	76 Å²	76	50%	0.503	37%	0.374	S	S	.	.	H	α-helix	trans	-68.6	-37.3	179.2	-73.3	-9.1	0	0	0	111.7	D199 L206 M207	D199-D203 WeakPolarHBondContact O-CB 3.42Å; D199-D203 PolarHBondContact O-N 3.33Å; D203-L206 PolarHBondContact O-N 3.16Å; D203-M207 VanDerWaalsContact O-CB 3.3Å; D203-M207 WeakPolarHBondContact O-CB 3.39Å; D203-M207 PolarHBondContact O-N 3.46Å
204	T	88.6	Confident	82.8	Confident	4 Å²	4	70.8 Å²	70.8	3%	0.025	35%	0.353	C	S	.	.	H	α-helix	trans	-65.5	-44.2	174	-58.9	0	0	0	0	111	F187 F200 L206 M207 Q208 L264 L267	F187-T204 HydrophobicContact CE2-CG2 3.98Å; F187-T204 HydrophobicContact CZ-CG2 3.75Å; F200-T204 WeakPolarHBondContact CE1-OG1 3.46Å; F200-T204 WeakPolarHBondContact O-CB 3.37Å; F200-T204 PolarHBondContact O-N 3.26Å; F200-T204 PolarHBondContact O-OG1 2.66Å; T204-L206 PolarHBondContact O-N 2.93Å; T204-M207 PolarHBondContact O-N 3.24Å; T204-Q208 HydrophobicContact CG2-CG 4.44Å; T204-Q208 WeakPolarHBondContact O-CB 3.47Å; T204-Q208 WeakPolarHBondContact O-CG 3.34Å; T204-Q208 PolarHBondContact O-N 2.96Å; T204-L264 HydrophobicContact CG2-CD1 3.91Å; T204-L267 HydrophobicContact CG2-CD2 3.96Å
205	L	89.9	Confident	83.9	Confident	29 Å²	29	64.9 Å²	64.9	15%	0.152	32%	0.321	C	S	.	.	H	α-helix	trans	-59.3	-46.1	173.2	-78.2	169.4	0	0	0	112.1	L183 K184 F187 A201 K202 M207 Q208 E209	L183-L205 HydrophobicContact CB-CD2 3.59Å; K184-L205 HydrophobicContact CG-CD1 3.88Å; K184-L205 HydrophobicContact CG-CD2 3.83Å; F187-L205 HydrophobicContact CD2-CD1 4.07Å; F187-L205 HydrophobicContact CD2-CD2 3.8Å; F187-L205 HydrophobicContact CD2-CG 3.63Å; F187-L205 HydrophobicContact CE2-CD2 4.13Å; F187-L205 HydrophobicContact CE2-CG 4.07Å; A201-L205 WeakPolarHBondContact O-CB 3.44Å; A201-L205 VanDerWaalsContact O-CG 3.31Å; A201-L205 WeakPolarHBondContact O-CG 3.13Å; A201-L205 PolarHBondContact O-N 2.93Å; K202-L205 PolarHBondContact O-N 2.79Å; L205-M207 PolarHBondContact O-N 3.29Å; L205-Q208 PolarHBondContact O-N 2.98Å; L205-E209 WeakPolarHBondContact O-CB 3.33Å; L205-E209 PolarHBondContact O-N 2.67Å
206	L	91.6	Very high	84.6	Confident	109 Å²	109	61.6 Å²	61.6	57%	0.571	31%	0.305	S	S	*	.	H	α-helix	trans	-65.6	-38	179.7	-170.2	152	0	0	0	111.7	K202 D203 T204 K210	K202-L206 WeakPolarHBondContact O-CB 3.33Å; K202-L206 PolarHBondContact O-N 3.37Å; D203-L206 PolarHBondContact O-N 3.16Å; T204-L206 PolarHBondContact O-N 2.93Å; L206-K210 VanDerWaalsContact O-CB 3.28Å; L206-K210 WeakPolarHBondContact O-CB 3.39Å; L206-K210 PolarHBondContact O-N 3.26Å
207	M	92.4	Very high	85	Confident	83 Å²	83	60.1 Å²	60.1	41%	0.409	29%	0.292	S	S	.	.	H	α-helix	trans	-63.1	-45.3	172.8	-171.8	-154.6	-55.3	0	0	111.7	D203 T204 L205 K210 K211	D203-M207 VanDerWaalsContact O-CB 3.3Å; D203-M207 WeakPolarHBondContact O-CB 3.39Å; D203-M207 PolarHBondContact O-N 3.46Å; T204-M207 PolarHBondContact O-N 3.24Å; L205-M207 PolarHBondContact O-N 3.29Å; M207-K210 PolarHBondContact O-N 3.4Å; M207-K211 PolarHBondContact O-N 3.39Å
208	Q	93.4	Very high	84.6	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-66.3	-43.2	178.9	-68.4	-70.3	-28.6	0	0	111.1	L180 L183 T204 L205 K211 L212 Q260	L180-Q208 HydrophobicContact CD2-CB 4.47Å; L183-Q208 HydrophobicContact CD1-CB 4.13Å; L183-Q208 HydrophobicContact CD1-CG 3.94Å; T204-Q208 HydrophobicContact CG2-CG 4.44Å; T204-Q208 WeakPolarHBondContact O-CB 3.47Å; T204-Q208 WeakPolarHBondContact O-CG 3.34Å; T204-Q208 PolarHBondContact O-N 2.96Å; L205-Q208 PolarHBondContact O-N 2.98Å; Q208-K211 PolarHBondContact O-N 2.96Å; Q208-L212 WeakPolarHBondContact O-CG 3.36Å; Q208-L212 PolarHBondContact O-N 3.11Å; Q208-Q260 PolarHBondContact O-NE2 3.08Å; Q208-Q260 VanDerWaalsContact O-NE2 3.09Å
209	E	92.4	Very high	83.6	Confident	77 Å²	77	63.3 Å²	63.3	36%	0.36	31%	0.31	S	S	.	.	H	α-helix	trans	-63.3	-39.6	173.7	-178.1	158.6	-164.3	0	0	112	L180 L205 L212 N213	L180-E209 HydrophobicContact CD1-CB 4.21Å; L180-E209 HydrophobicContact CD1-CG 4.1Å; L180-E209 HydrophobicContact CD2-CB 4Å; L205-E209 WeakPolarHBondContact O-CB 3.33Å; L205-E209 PolarHBondContact O-N 2.67Å; E209-L212 PolarHBondContact O-N 3.07Å; E209-N213 WeakPolarHBondContact O-CB 3.28Å; E209-N213 PolarHBondContact O-N 2.98Å; E209-N213 PolarHBondContact O-ND2 3.08Å; E209-N213 VanDerWaalsContact O-ND2 3.09Å
210	K	92.2	Very high	82.1	Confident	120 Å²	120	61.5 Å²	61.5	52%	0.522	31%	0.307	S	S	.	.	H	α-helix	trans	-61.6	-47.7	172.5	-178.6	-177.2	169.1	-174.2	0	112	L206 M207 L212 N213 E214	L206-K210 VanDerWaalsContact O-CB 3.28Å; L206-K210 WeakPolarHBondContact O-CB 3.39Å; L206-K210 PolarHBondContact O-N 3.26Å; M207-K210 PolarHBondContact O-N 3.4Å; K210-L212 PolarHBondContact O-N 3.37Å; K210-N213 CarbonylContact O-C 3.57Å; K210-N213 WeakPolarHBondContact O-CB 3.17Å; K210-N213 PolarHBondContact O-N 2.95Å; K210-N213 VanDerWaalsContact O-N 3.15Å; K210-E214 WeakPolarHBondContact CE-OE1 3.45Å; K210-E214 IonicContact NZ-OE1 3.05Å; K210-E214 PolarHBondContact O-N 3.13Å
211	K	91.1	Very high	80.3	Confident	55 Å²	55	63.5 Å²	63.5	24%	0.239	32%	0.324	C	S	.	.	H	α-helix	trans	-58.7	-45.2	177.3	-77.5	-175.3	175.6	179.8	0	111.3	M207 Q208 N213 E214 L215 Q260 D263	M207-K211 PolarHBondContact O-N 3.39Å; Q208-K211 PolarHBondContact O-N 2.96Å; K211-N213 VanDerWaalsContact C-N 3.34Å; K211-N213 PolarHBondContact O-N 3.38Å; K211-E214 WeakPolarHBondContact O-CB 3.3Å; K211-E214 PolarHBondContact O-N 3.27Å; K211-L215 PolarHBondContact O-N 2.91Å; K211-Q260 HydrophobicContact CB-CG 4.35Å; K211-Q260 HydrophobicContact CD-CB 4.37Å; K211-Q260 HydrophobicContact CD-CG 3.91Å; K211-D263 IonicContact NZ-OD2 3.73Å; K211-D263 PolarHBondContact NZ-OD2 3.4Å
212	L	90.6	Very high	78.5	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-63.2	-39	174.9	-64.3	171.1	0	0	0	112.3	N176 F179 L180 Q208 E209 K210 E214 L215 R216 F257	N176-L212 HydrophobicContact CB-CD1 4.46Å; F179-L212 HydrophobicContact CD1-CD1 4.11Å; L180-L212 HydrophobicContact CD1-CD1 3.83Å; L180-L212 HydrophobicContact CD2-CD1 3.82Å; L180-L212 HydrophobicContact CG-CD1 3.57Å; Q208-L212 WeakPolarHBondContact O-CG 3.36Å; Q208-L212 PolarHBondContact O-N 3.11Å; E209-L212 PolarHBondContact O-N 3.07Å; K210-L212 PolarHBondContact O-N 3.37Å; L212-E214 PolarHBondContact O-N 3.3Å; L212-L215 HydrophobicContact CD2-CD1 4.43Å; L212-L215 PolarHBondContact O-N 3.36Å; L212-R216 WeakPolarHBondContact O-CG 3.46Å; L212-R216 PolarHBondContact O-N 3.42Å; L212-F257 HydrophobicContact CD2-CD2 3.91Å; L212-F257 HydrophobicContact CD2-CE2 3.87Å
213	N	87.4	Confident	76.4	Confident	63 Å²	63	63.3 Å²	63.3	34%	0.337	34%	0.338	S	S	.	.	H	α-helix	trans	-65.9	-24.5	173.6	-74.2	-32.4	0	0	0	113.1	E209 K210 K211 R216 K217	E209-N213 WeakPolarHBondContact O-CB 3.28Å; E209-N213 PolarHBondContact O-N 2.98Å; E209-N213 PolarHBondContact O-ND2 3.08Å; E209-N213 VanDerWaalsContact O-ND2 3.09Å; K210-N213 CarbonylContact O-C 3.57Å; K210-N213 WeakPolarHBondContact O-CB 3.17Å; K210-N213 PolarHBondContact O-N 2.95Å; K210-N213 VanDerWaalsContact O-N 3.15Å; K211-N213 VanDerWaalsContact C-N 3.34Å; K211-N213 PolarHBondContact O-N 3.38Å; N213-R216 WeakPolarHBondContact OD1-CD 3.2Å; N213-R216 PolarHBondContact OD1-NH1 2.97Å; N213-K217 WeakPolarHBondContact O-CG 3.37Å; N213-K217 PolarHBondContact O-N 2.83Å
214	E	86.9	Confident	73.7	Confident	82 Å²	82	63.5 Å²	63.5	38%	0.383	34%	0.343	S	S	.	.	H	α-helix	trans	-77.3	-37.8	171	-79.7	160.5	-177.6	0	0	112	K210 K211 L212 R216 K217 P218	K210-E214 WeakPolarHBondContact CE-OE1 3.45Å; K210-E214 IonicContact NZ-OE1 3.05Å; K210-E214 PolarHBondContact O-N 3.13Å; K211-E214 WeakPolarHBondContact O-CB 3.3Å; K211-E214 PolarHBondContact O-N 3.27Å; L212-E214 PolarHBondContact O-N 3.3Å; E214-R216 VanDerWaalsContact C-N 3.26Å; E214-R216 PolarHBondContact O-N 3.5Å; E214-K217 HydrophobicContact CG-CD 4.24Å; E214-K217 VanDerWaalsContact CG-NZ 3.32Å; E214-K217 PolarHBondContact O-N 2.99Å; E214-K217 IonicContact OE1-NZ 3.29Å; E214-P218 WeakPolarHBondContact O-CD 3.39Å
215	L	82.1	Confident	71.4	Confident	32 Å²	32	65.9 Å²	65.9	17%	0.168	36%	0.357	C	S	.	.	H	α-helix	trans	-63.5	-28.6	169.5	-60.2	-178.7	0	0	0	113.2	K211 L212 T253 F257	K211-L215 PolarHBondContact O-N 2.91Å; L212-L215 HydrophobicContact CD2-CD1 4.43Å; L212-L215 PolarHBondContact O-N 3.36Å; L215-T253 HydrophobicContact CB-CG2 4.34Å; L215-F257 HydrophobicContact CD1-CB 4.35Å
216	R	74.9	Confident	69.3	Low	52 Å²	52	68.7 Å²	68.7	20%	0.196	37%	0.369	C	S	.	.	H	α-helix	trans	-71.8	-31.3	174.6	-75.1	164.3	166.5	153.4	-3.3	114	E173 L212 N213 E214 L219 A220	E173-R216 WeakPolarHBondContact OE1-CG 3.31Å; E173-R216 IonicContact OE1-CZ 2.68Å; E173-R216 IonicContact OE1-NE 3.84Å; E173-R216 PolarHBondContact OE1-NE 3.2Å; E173-R216 IonicContact OE1-NH2 3.88Å; E173-R216 PolarHBondContact OE1-NH2 3.02Å; E173-R216 IonicContact OE2-CZ 2.63Å; E173-R216 IonicContact OE2-NE 3.92Å; E173-R216 PolarHBondContact OE2-NE 2.79Å; E173-R216 IonicContact OE2-NH2 3.5Å; E173-R216 PolarHBondContact OE2-NH2 3.02Å; L212-R216 WeakPolarHBondContact O-CG 3.46Å; L212-R216 PolarHBondContact O-N 3.42Å; N213-R216 WeakPolarHBondContact OD1-CD 3.2Å; N213-R216 PolarHBondContact OD1-NH1 2.97Å; E214-R216 VanDerWaalsContact C-N 3.26Å; E214-R216 PolarHBondContact O-N 3.5Å; R216-L219 PolarHBondContact O-N 2.86Å; R216-L219 VanDerWaalsContact O-N 3.08Å; R216-A220 PolarHBondContact O-N 3.31Å
217	K	69.3	Low	66.7	Low	123 Å²	123	71.8 Å²	71.8	54%	0.535	38%	0.38	S	S	.	.	H	α-helix	trans	-56.3	-47.4	-170.5	-78.6	166.6	-167.9	172.3	0	114.2	N213 E214 L219 A220 T221	N213-K217 WeakPolarHBondContact O-CG 3.37Å; N213-K217 PolarHBondContact O-N 2.83Å; E214-K217 HydrophobicContact CG-CD 4.24Å; E214-K217 VanDerWaalsContact CG-NZ 3.32Å; E214-K217 PolarHBondContact O-N 2.99Å; E214-K217 IonicContact OE1-NZ 3.29Å; K217-L219 PolarHBondContact O-N 3.13Å; K217-L219 VanDerWaalsContact O-N 3.16Å; K217-A220 PolarHBondContact O-N 2.88Å; K217-T221 PolarHBondContact O-OG1 3.05Å
218	P	59.3	Low	64.1	Low	82 Å²	82	73.1 Å²	73.1	53%	0.532	39%	0.393	S	S	.	.	H	α-helix	trans	-60.7	-25.8	178.9	-24	34.8	0	0	0	113.9	E214	E214-P218 WeakPolarHBondContact O-CD 3.39Å
219	L	53.6	Low	62.1	Low	46 Å²	46	75 Å²	75	24%	0.241	40%	0.403	C	S	.	.	H	α-helix	trans	-95.9	-18.8	-170.9	-166.4	47.3	0	0	0	113	F169 R216 K217 Q223	F169-L219 HydrophobicContact CD2-CD2 3.33Å; F169-L219 HydrophobicContact CD2-CG 3.77Å; F169-L219 HydrophobicContact CE2-CD2 3.83Å; F169-L219 HydrophobicContact CE2-CG 4.03Å; F169-L219 HydrophobicContact CG-CD2 4.21Å; F169-L219 HydrophobicContact CG-CG 4.42Å; R216-L219 PolarHBondContact O-N 2.86Å; R216-L219 VanDerWaalsContact O-N 3.08Å; K217-L219 PolarHBondContact O-N 3.13Å; K217-L219 VanDerWaalsContact O-N 3.16Å; L219-Q223 PolarHBondContact O-NE2 2.85Å; L219-Q223 VanDerWaalsContact O-NE2 3.14Å
220	A	48	Very low	59.9	Low	51 Å²	51	78 Å²	78	42%	0.421	42%	0.417	S	S	.	.	H	α-helix	trans	-73.7	-39.3	171.9	0	0	0	0	0	112.5	R216 K217 G222 Q223 T224	R216-A220 PolarHBondContact O-N 3.31Å; K217-A220 PolarHBondContact O-N 2.88Å; A220-G222 PolarHBondContact O-N 3.44Å; A220-Q223 WeakPolarHBondContact O-CA 3.43Å; A220-Q223 WeakPolarHBondContact O-CB 3.44Å; A220-Q223 PolarHBondContact O-N 3.5Å; A220-T224 PolarHBondContact O-N 3.34Å; A220-T224 VanDerWaalsContact O-N 3.1Å; A220-T224 PolarHBondContact O-OG1 3.11Å
221	T	45.8	Very low	57.9	Low	98 Å²	98	79.5 Å²	79.5	60%	0.601	43%	0.43	S	S	*	.	H	α-helix	trans	-60.7	-32.3	-177.1	-42.9	0	0	0	0	113.1	K217 Q223 T224 T225	K217-T221 PolarHBondContact O-OG1 3.05Å; T221-Q223 VanDerWaalsContact C-N 3.33Å; T221-T224 PolarHBondContact O-OG1 3.45Å; T221-T225 PolarHBondContact O-OG1 3.12Å; T221-T225 VanDerWaalsContact O-OG1 3.14Å
222	G	45	Very low	56.5	Low	54 Å²	54	79 Å²	79	56%	0.557	44%	0.437	S	S	*	.	H	α-helix	trans	-81.2	-4.7	173.5	0	0	0	0	0	115.1	A220 T225	A220-G222 PolarHBondContact O-N 3.44Å; G222-T225 WeakPolarHBondContact CA-OG1 3.32Å; G222-T225 PolarHBondContact O-OG1 3.03Å
223	Q	42	Very low	55.6	Low	74 Å²	74	82.8 Å²	82.8	35%	0.346	46%	0.463	S	S	.	.	H	α-helix	trans	-102.8	-32.9	176.4	-67.8	179	46.3	0	0	112	L219 A220 T221 T225 K226	L219-Q223 PolarHBondContact O-NE2 2.85Å; L219-Q223 VanDerWaalsContact O-NE2 3.14Å; A220-Q223 WeakPolarHBondContact O-CA 3.43Å; A220-Q223 WeakPolarHBondContact O-CB 3.44Å; A220-Q223 PolarHBondContact O-N 3.5Å; T221-Q223 VanDerWaalsContact C-N 3.33Å; Q223-T225 PolarHBondContact O-N 2.69Å; Q223-K226 WeakPolarHBondContact O-CB 3.37Å; Q223-K226 WeakPolarHBondContact O-CG 3.47Å; Q223-K226 PolarHBondContact O-N 2.95Å
224	T	31.7	Very low	55.2	Low	98 Å²	98	79.8 Å²	79.8	60%	0.601	45%	0.447	S	S	*	.	H	α-helix	trans	-59.5	-23.9	168.9	36.8	0	0	0	0	113.1	A220 T221 K226	A220-T224 PolarHBondContact O-N 3.34Å; A220-T224 VanDerWaalsContact O-N 3.1Å; A220-T224 PolarHBondContact O-OG1 3.11Å; T221-T224 PolarHBondContact O-OG1 3.45Å; T224-K226 PolarHBondContact O-N 2.88Å
225	T	39.8	Very low	55.2	Low	54 Å²	54	76.7 Å²	76.7	33%	0.331	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-69.4	-9.9	174.4	1.3	0	0	0	0	113.9	T221 G222 Q223 E227 T228 I229	T221-T225 PolarHBondContact O-OG1 3.12Å; T221-T225 VanDerWaalsContact O-OG1 3.14Å; G222-T225 WeakPolarHBondContact CA-OG1 3.32Å; G222-T225 PolarHBondContact O-OG1 3.03Å; Q223-T225 PolarHBondContact O-N 2.69Å; T225-E227 PolarHBondContact O-N 2.66Å; T225-T228 PolarHBondContact O-N 2.95Å; T225-I229 HydrophobicContact CG2-CD1 3.77Å; T225-I229 HydrophobicContact CG2-CG1 4.21Å; T225-I229 WeakPolarHBondContact O-CD1 3.32Å; T225-I229 VanDerWaalsContact O-CG1 3.28Å; T225-I229 WeakPolarHBondContact O-CG1 3.49Å; T225-I229 PolarHBondContact O-N 2.97Å
226	K	45.3	Very low	55.4	Low	89 Å²	89	76.2 Å²	76.2	39%	0.387	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-66.1	-16.1	175.7	-70.8	-163.9	175.8	-158.5	0	114	F139 Q223 T224	F139-K226 WeakPolarHBondContact CE1-O 3.38Å; Q223-K226 WeakPolarHBondContact O-CB 3.37Å; Q223-K226 WeakPolarHBondContact O-CG 3.47Å; Q223-K226 PolarHBondContact O-N 2.95Å; T224-K226 PolarHBondContact O-N 2.88Å
227	E	37.3	Very low	56	Low	173 Å²	173	77 Å²	77	81%	0.808	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-100.3	-8.9	-179.2	-60.3	-170.4	152.2	0	0	113.6	T225	T225-E227 PolarHBondContact O-N 2.66Å
228	T	38	Very low	56.8	Low	112 Å²	112	74.7 Å²	74.7	69%	0.687	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	-13.8	-178.7	21.1	0	0	0	0	115.3	T225 Q230	T225-T228 PolarHBondContact O-N 2.95Å; T228-Q230 VanDerWaalsContact C-N 3.32Å; T228-Q230 PolarHBondContact O-N 3.44Å
229	I	51.4	Low	58.2	Low	39 Å²	39	71.2 Å²	71.2	20%	0.2	41%	0.406	C	S	.	.			trans	-96.1	44.4	-175.5	-57.6	169.2	0	0	0	110.2	F139 T225 A232	F139-I229 VanDerWaalsContact CZ-O 3.25Å; F139-I229 WeakPolarHBondContact CZ-O 3.26Å; T225-I229 HydrophobicContact CG2-CD1 3.77Å; T225-I229 HydrophobicContact CG2-CG1 4.21Å; T225-I229 WeakPolarHBondContact O-CD1 3.32Å; T225-I229 VanDerWaalsContact O-CG1 3.28Å; T225-I229 WeakPolarHBondContact O-CG1 3.49Å; T225-I229 PolarHBondContact O-N 2.97Å; I229-A232 HydrophobicContact CB-CB 4.45Å; I229-A232 HydrophobicContact CG2-CB 3.73Å
230	Q	46.5	Very low	59.9	Low	141 Å²	141	70.7 Å²	70.7	66%	0.659	40%	0.402	S	S	*	.	S	Bend	trans	-76.1	-27	-172.3	-158.8	157.7	27.5	0	0	113.8	F139 T228	F139-Q230 HydrophobicContact CE2-CG 4.24Å; T228-Q230 VanDerWaalsContact C-N 3.32Å; T228-Q230 PolarHBondContact O-N 3.44Å
231	D	50.6	Low	61.9	Low	151 Å²	151	74.6 Å²	74.6	81%	0.807	41%	0.406	S	S	*	.	S	Bend	trans	-132.9	14.1	177.6	-64.2	-74.2	0	0	0	113	S233	D231-S233 PolarHBondContact O-N 3.44Å
232	A	60.9	Low	64	Low	45 Å²	45	71.8 Å²	71.8	37%	0.372	39%	0.393	S	S	.	.			trans	-77.8	120.5	-175.4	0	0	0	0	0	111.8	I229	I229-A232 HydrophobicContact CB-CB 4.45Å; I229-A232 HydrophobicContact CG2-CB 3.73Å
233	S	71.6	Confident	66.1	Low	79 Å²	79	69.7 Å²	69.7	55%	0.552	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66	152.2	170.1	58.2	0	0	0	0	111	F135 D231	F135-S233 WeakPolarHBondContact O-CA 3.43Å; D231-S233 PolarHBondContact O-N 3.44Å
234	C	80.1	Confident	68.5	Low	0 Å²	0	70.4 Å²	70.4	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	135	-172.9	174.9	0	0	0	0	111.6	S134 F135 R137 E238	S134-C234 CarbonylContact C-O 3.54Å; S134-C234 WeakPolarHBondContact CA-O 3.46Å; F135-C234 WeakPolarHBondContact CD1-O 3.23Å; F135-C234 PolarHBondContact N-O 3.14Å; F135-C234 PolarHBondContact O-N 3.42Å; R137-C234 HydrophobicContact CG-CB 3.84Å; R137-C234 VanDerWaalsContact CZ-SG 3.58Å; R137-C234 VanDerWaalsContact NE-CB 3.25Å; R137-C234 PolarHBondContact NE-SG 3.37Å; R137-C234 PolarHBondContact NH2-SG 3.17Å; C234-E238 WeakPolarHBondContact CA-OE2 3.39Å; C234-E238 PolarHBondContact SG-OE2 3.42Å
235	S	85.7	Confident	71.3	Confident	18 Å²	18	68.4 Å²	68.4	13%	0.126	36%	0.356	C	S	.	.			trans	-85	157	170.3	69.6	0	0	0	0	112.6	E237 E238	S235-E237 VanDerWaalsContact C-N 3.3Å; S235-E237 PolarHBondContact O-N 2.78Å; S235-E238 VanDerWaalsContact CB-OE1 3.26Å; S235-E238 WeakPolarHBondContact CB-OE1 3.23Å; S235-E238 PolarHBondContact N-OE1 3.27Å; S235-E238 PolarHBondContact O-N 3.45Å; S235-E238 VanDerWaalsContact OG-CD 3.23Å; S235-E238 WeakPolarHBondContact OG-CG 3.49Å; S235-E238 PolarHBondContact OG-N 3.04Å; S235-E238 PolarHBondContact OG-OE1 3.12Å
236	L	87.5	Confident	73.7	Confident	21 Å²	21	66.8 Å²	66.8	11%	0.11	35%	0.345	C	S	.	.	H	α-helix	trans	-64.1	-34.7	174.1	-176.9	53.4	0	0	0	112.3	I154 E238 I239 E240 L601 M604 R605	I154-L236 HydrophobicContact CD1-CD1 4.48Å; L236-E238 VanDerWaalsContact C-N 3.33Å; L236-E238 PolarHBondContact O-N 3.29Å; L236-I239 WeakPolarHBondContact O-CB 3.49Å; L236-I239 PolarHBondContact O-N 3.45Å; L236-E240 HydrophobicContact CD1-CG 4.44Å; L236-E240 HydrophobicContact CG-CG 4.42Å; L236-E240 WeakPolarHBondContact O-CG 3.47Å; L236-E240 PolarHBondContact O-N 2.9Å; L236-L601 HydrophobicContact CD1-CD2 4.08Å; L236-M604 HydrophobicContact CD1-CB 3.75Å; L236-M604 HydrophobicContact CD1-CE 3.94Å; L236-M604 HydrophobicContact CD1-SD 4.25Å; L236-M604 HydrophobicContact CD2-CB 4.32Å; L236-R605 HydrophobicContact CD2-CB 4.4Å; L236-R605 HydrophobicContact CD2-CG 3.58Å
237	E	86.3	Confident	76	Confident	69 Å²	69	63 Å²	63	32%	0.322	33%	0.329	S	S	.	.	H	α-helix	trans	-63.5	-34.7	178.6	-60.2	-175.2	139.8	0	0	113.1	N132 S235 I239 R241	N132-E237 VanDerWaalsContact CG-CD 3.45Å; N132-E237 PolarHBondContact ND2-OE1 3.46Å; N132-E237 PolarHBondContact ND2-OE2 3.38Å; N132-E237 WeakPolarHBondContact OD1-CG 3.29Å; N132-E237 PolarHBondContact OD1-OE1 3.26Å; S235-E237 VanDerWaalsContact C-N 3.3Å; S235-E237 PolarHBondContact O-N 2.78Å; E237-I239 VanDerWaalsContact C-N 3.27Å; E237-I239 PolarHBondContact O-N 2.82Å; E237-R241 WeakPolarHBondContact O-CB 3.43Å; E237-R241 PolarHBondContact O-N 2.74Å; E237-R241 PolarHBondContact O-NH1 3.26Å
238	E	87	Confident	78.6	Confident	74 Å²	74	61.3 Å²	61.3	35%	0.346	32%	0.321	S	S	.	.	H	α-helix	trans	-60.4	-38.9	170.6	-71.6	151.5	-125.6	0	0	112	R137 C234 S235 L236 A242	R137-E238 IonicContact NH2-OE2 2.61Å; C234-E238 WeakPolarHBondContact CA-OE2 3.39Å; C234-E238 PolarHBondContact SG-OE2 3.42Å; S235-E238 VanDerWaalsContact CB-OE1 3.26Å; S235-E238 WeakPolarHBondContact CB-OE1 3.23Å; S235-E238 PolarHBondContact N-OE1 3.27Å; S235-E238 PolarHBondContact O-N 3.45Å; S235-E238 VanDerWaalsContact OG-CD 3.23Å; S235-E238 WeakPolarHBondContact OG-CG 3.49Å; S235-E238 PolarHBondContact OG-N 3.04Å; S235-E238 PolarHBondContact OG-OE1 3.12Å; L236-E238 VanDerWaalsContact C-N 3.33Å; L236-E238 PolarHBondContact O-N 3.29Å; E238-A242 WeakPolarHBondContact O-CB 3.47Å; E238-A242 PolarHBondContact O-N 2.91Å
239	I	88.2	Confident	81.1	Confident	9 Å²	9	60.9 Å²	60.9	5%	0.046	31%	0.307	C	S	.	.	H	α-helix	trans	-74.5	-41.1	-176.8	-59.9	176.4	0	0	0	110.2	F135 L161 L236 E237 A242 Q243 L601 M604	F135-I239 HydrophobicContact CE1-CD1 3.8Å; F135-I239 HydrophobicContact CZ-CD1 3.53Å; L161-I239 HydrophobicContact CD2-CG2 3.52Å; L236-I239 WeakPolarHBondContact O-CB 3.49Å; L236-I239 PolarHBondContact O-N 3.45Å; E237-I239 VanDerWaalsContact C-N 3.27Å; E237-I239 PolarHBondContact O-N 2.82Å; I239-A242 PolarHBondContact O-N 3.16Å; I239-Q243 VanDerWaalsContact O-CG 3.31Å; I239-Q243 WeakPolarHBondContact O-CG 3.37Å; I239-Q243 PolarHBondContact O-N 2.86Å; I239-Q243 PolarHBondContact O-NE2 3.4Å; I239-L601 HydrophobicContact CG2-CD2 4.11Å; I239-M604 HydrophobicContact CD1-CE 3.78Å; I239-M604 HydrophobicContact CG2-CE 4.43Å
240	E	90.1	Very high	83	Confident	35 Å²	35	60.4 Å²	60.4	16%	0.164	31%	0.305	C	S	.	.	H	α-helix	trans	-60.6	-51.1	173.5	-69.7	177.6	176.2	0	0	111.2	L236 A242 Q243 K244 L601 R605	L236-E240 HydrophobicContact CD1-CG 4.44Å; L236-E240 HydrophobicContact CG-CG 4.42Å; L236-E240 WeakPolarHBondContact O-CG 3.47Å; L236-E240 PolarHBondContact O-N 2.9Å; E240-A242 PolarHBondContact O-N 2.93Å; E240-Q243 PolarHBondContact O-N 3.3Å; E240-Q243 VanDerWaalsContact O-N 3.13Å; E240-K244 PolarHBondContact O-N 3.45Å; E240-L601 HydrophobicContact CG-CD1 4Å; E240-L601 HydrophobicContact CG-CD2 3.59Å; E240-L601 HydrophobicContact CG-CG 4.26Å; E240-R605 IonicContact OE1-CZ 2.69Å; E240-R605 VanDerWaalsContact OE1-CZ 3.29Å; E240-R605 IonicContact OE1-NE 3.86Å; E240-R605 PolarHBondContact OE1-NE 3.2Å; E240-R605 IonicContact OE1-NH2 2.69Å; E240-R605 PolarHBondContact OE1-NH2 2.96Å; E240-R605 IonicContact OE2-CZ 3.41Å; E240-R605 IonicContact OE2-NE 3.2Å; E240-R605 IonicContact OE2-NH2 2.82Å; E240-R605 PolarHBondContact OE2-NH2 3.34Å
241	R	89.6	Confident	85.2	Confident	134 Å²	134	54.6 Å²	54.6	51%	0.506	28%	0.278	S	S	.	.	H	α-helix	trans	-57	-47.4	174.1	-167.3	-179.7	-58.6	104.6	3.3	111.1	E237 Q243 K244 D245	E237-R241 WeakPolarHBondContact O-CB 3.43Å; E237-R241 PolarHBondContact O-N 2.74Å; E237-R241 PolarHBondContact O-NH1 3.26Å; R241-Q243 VanDerWaalsContact C-N 3.3Å; R241-Q243 PolarHBondContact O-N 3.4Å; R241-K244 PolarHBondContact O-N 3.04Å; R241-D245 PolarHBondContact O-N 3.16Å; R241-D245 VanDerWaalsContact O-OD1 3.08Å
242	A	88.9	Confident	87.2	Confident	39 Å²	39	52 Å²	52	32%	0.322	26%	0.262	S	S	.	.	H	α-helix	trans	-63.7	-28.8	177.6	0	0	0	0	0	114.1	E238 I239 E240 L246	E238-A242 WeakPolarHBondContact O-CB 3.47Å; E238-A242 PolarHBondContact O-N 2.91Å; I239-A242 PolarHBondContact O-N 3.16Å; E240-A242 PolarHBondContact O-N 2.93Å; A242-L246 WeakPolarHBondContact O-CB 3.26Å; A242-L246 PolarHBondContact O-N 2.95Å
243	Q	90.5	Very high	88.6	Confident	10 Å²	10	51.3 Å²	51.3	5%	0.047	25%	0.252	C	S	.	.	H	α-helix	trans	-70	-42.8	170.1	-63.5	-31.9	-66.9	0	0	111.5	L161 Q165 I239 E240 R241 L246 L247 L601	L161-Q243 HydrophobicContact CD1-CG 4.43Å; L161-Q243 HydrophobicContact CD2-CG 4.18Å; Q165-Q243 VanDerWaalsContact NE2-CD 3.32Å; I239-Q243 VanDerWaalsContact O-CG 3.31Å; I239-Q243 WeakPolarHBondContact O-CG 3.37Å; I239-Q243 PolarHBondContact O-N 2.86Å; I239-Q243 PolarHBondContact O-NE2 3.4Å; E240-Q243 PolarHBondContact O-N 3.3Å; E240-Q243 VanDerWaalsContact O-N 3.13Å; R241-Q243 VanDerWaalsContact C-N 3.3Å; R241-Q243 PolarHBondContact O-N 3.4Å; Q243-L246 WeakPolarHBondContact O-CB 3.44Å; Q243-L246 PolarHBondContact O-N 3.38Å; Q243-L247 PolarHBondContact O-N 3.43Å; Q243-L601 HydrophobicContact CB-CD1 4.34Å; Q243-L601 HydrophobicContact CG-CD1 3.91Å
244	K	91.6	Very high	89.7	Confident	88 Å²	88	47.8 Å²	47.8	38%	0.383	23%	0.228	S	C	.	.	H	α-helix	trans	-65.1	-49.3	-179.3	-167.6	161.4	-161.3	147.3	0	111.6	E240 R241 L246 L247 E248 E662 E666	E240-K244 PolarHBondContact O-N 3.45Å; R241-K244 PolarHBondContact O-N 3.04Å; K244-L246 PolarHBondContact O-N 3.31Å; K244-L247 WeakPolarHBondContact O-CB 3.38Å; K244-L247 PolarHBondContact O-N 3.5Å; K244-L247 VanDerWaalsContact O-N 3.13Å; K244-E248 PolarHBondContact O-N 3.36Å; K244-E662 IonicContact NZ-OE1 3.36Å; K244-E662 PolarHBondContact NZ-OE1 3.26Å; K244-E666 WeakPolarHBondContact CE-OE1 3.44Å; K244-E666 IonicContact NZ-OE1 2.99Å
245	D	90.6	Very high	90.3	Very high	57 Å²	57	51.5 Å²	51.5	31%	0.305	24%	0.244	S	C	.	.	H	α-helix	trans	-59.2	-32	173	-51.6	-10.6	0	0	0	111.8	R241 R249	R241-D245 PolarHBondContact O-N 3.16Å; R241-D245 VanDerWaalsContact O-OD1 3.08Å; D245-R249 VanDerWaalsContact C-NH1 3.26Å; D245-R249 WeakPolarHBondContact O-CB 3.43Å; D245-R249 WeakPolarHBondContact O-CG 3.32Å; D245-R249 PolarHBondContact O-N 3.03Å; D245-R249 PolarHBondContact O-NH1 3.35Å; D245-R249 IonicContact OD2-NH2 3.9Å; D245-R249 PolarHBondContact OD2-NH2 3.09Å; D245-R249 VanDerWaalsContact OD2-NH2 3.13Å
246	L	90.4	Very high	90.7	Very high	20 Å²	20	52.4 Å²	52.4	11%	0.105	25%	0.25	C	S	.	.	H	α-helix	trans	-70.8	-39.9	177.9	178	62.5	0	0	0	111.5	Q165 A242 Q243 K244 N250	Q165-L246 HydrophobicContact CB-CD2 4.26Å; Q165-L246 HydrophobicContact CG-CD2 3.54Å; A242-L246 WeakPolarHBondContact O-CB 3.26Å; A242-L246 PolarHBondContact O-N 2.95Å; Q243-L246 WeakPolarHBondContact O-CB 3.44Å; Q243-L246 PolarHBondContact O-N 3.38Å; K244-L246 PolarHBondContact O-N 3.31Å; L246-N250 VanDerWaalsContact O-CB 3.32Å; L246-N250 WeakPolarHBondContact O-CB 3.37Å; L246-N250 PolarHBondContact O-N 2.68Å; L246-N250 PolarHBondContact O-ND2 2.83Å
247	L	93.3	Very high	91	Very high	8 Å²	8	51.4 Å²	51.4	4%	0.042	25%	0.245	C	C	.	.	H	α-helix	trans	-59.5	-50.8	171.2	177.3	66.9	0	0	0	110.6	Q243 K244 R249 N250 L251 F591 R594 E666	Q243-L247 PolarHBondContact O-N 3.43Å; K244-L247 WeakPolarHBondContact O-CB 3.38Å; K244-L247 PolarHBondContact O-N 3.5Å; K244-L247 VanDerWaalsContact O-N 3.13Å; L247-R249 PolarHBondContact O-N 3.16Å; L247-N250 WeakPolarHBondContact O-CB 3.29Å; L247-N250 PolarHBondContact O-N 3.14Å; L247-L251 HydrophobicContact CD1-CD1 4.09Å; L247-L251 HydrophobicContact CD1-CD2 4.41Å; L247-L251 HydrophobicContact CD1-CG 4.02Å; L247-L251 HydrophobicContact CD2-CD1 4.46Å; L247-L251 HydrophobicContact CG-CD1 3.95Å; L247-L251 HydrophobicContact CG-CG 4.25Å; L247-L251 WeakPolarHBondContact O-CG 3.49Å; L247-L251 PolarHBondContact O-N 2.71Å; L247-F591 HydrophobicContact CD1-CD1 4.25Å; L247-F591 HydrophobicContact CD1-CE1 4.05Å; L247-F591 HydrophobicContact CD1-CZ 4.23Å; L247-F591 HydrophobicContact CD2-CE1 3.86Å; L247-F591 HydrophobicContact CD2-CZ 4.34Å; L247-R594 HydrophobicContact CD1-CB 4.25Å; L247-R594 HydrophobicContact CD2-CG 4.05Å; L247-E666 HydrophobicContact CD2-CB 3.86Å; L247-E666 VanDerWaalsContact CD2-CD 3.47Å; L247-E666 HydrophobicContact CD2-CG 4Å; L247-E666 VanDerWaalsContact CD2-OE2 3.23Å; L247-E666 WeakPolarHBondContact CD2-OE2 3.3Å
248	E	92.3	Very high	91.4	Very high	138 Å²	138	48.3 Å²	48.3	65%	0.645	23%	0.231	S	C	*	.	H	α-helix	trans	-58	-47.2	-179.8	-170.8	-177	176.1	0	0	111.5	K244 N250 L251 Q252	K244-E248 PolarHBondContact O-N 3.36Å; E248-N250 VanDerWaalsContact C-N 3.32Å; E248-N250 PolarHBondContact O-N 3.32Å; E248-L251 PolarHBondContact O-N 2.88Å; E248-Q252 WeakPolarHBondContact O-CB 3.41Å; E248-Q252 PolarHBondContact O-N 3.41Å
249	R	89.6	Confident	91.6	Very high	104 Å²	104	47.3 Å²	47.3	39%	0.392	23%	0.232	S	C	.	.	H	α-helix	trans	-59.9	-38.4	174.2	-71.9	178.8	-139.5	109.2	-8.4	112.4	D245 L247 T253	D245-R249 VanDerWaalsContact C-NH1 3.26Å; D245-R249 WeakPolarHBondContact O-CB 3.43Å; D245-R249 WeakPolarHBondContact O-CG 3.32Å; D245-R249 PolarHBondContact O-N 3.03Å; D245-R249 PolarHBondContact O-NH1 3.35Å; D245-R249 IonicContact OD2-NH2 3.9Å; D245-R249 PolarHBondContact OD2-NH2 3.09Å; D245-R249 VanDerWaalsContact OD2-NH2 3.13Å; L247-R249 PolarHBondContact O-N 3.16Å; R249-T253 VanDerWaalsContact O-CB 3.22Å; R249-T253 WeakPolarHBondContact O-CB 3.44Å; R249-T253 PolarHBondContact O-N 2.7Å; R249-T253 PolarHBondContact O-OG1 3.09Å
250	N	91.3	Very high	91.9	Very high	28 Å²	28	47.2 Å²	47.2	15%	0.15	23%	0.232	C	C	.	.	H	α-helix	trans	-69.9	-41.8	178.1	-71.8	-19	0	0	0	112.2	L246 L247 E248 T253 S254	L246-N250 VanDerWaalsContact O-CB 3.32Å; L246-N250 WeakPolarHBondContact O-CB 3.37Å; L246-N250 PolarHBondContact O-N 2.68Å; L246-N250 PolarHBondContact O-ND2 2.83Å; L247-N250 WeakPolarHBondContact O-CB 3.29Å; L247-N250 PolarHBondContact O-N 3.14Å; E248-N250 VanDerWaalsContact C-N 3.32Å; E248-N250 PolarHBondContact O-N 3.32Å; N250-T253 PolarHBondContact O-N 2.91Å; N250-S254 WeakPolarHBondContact O-CB 3.34Å; N250-S254 PolarHBondContact O-N 3.21Å; N250-S254 PolarHBondContact O-OG 2.88Å
251	L	93.3	Very high	92.1	Very high	20 Å²	20	45.7 Å²	45.7	11%	0.105	23%	0.225	C	C	.	.	H	α-helix	trans	-65.1	-45.2	175.8	-66.4	177.3	0	0	0	111.1	L247 E248 S254 K255 M587 F591 A670 L673	L247-L251 HydrophobicContact CD1-CD1 4.09Å; L247-L251 HydrophobicContact CD1-CD2 4.41Å; L247-L251 HydrophobicContact CD1-CG 4.02Å; L247-L251 HydrophobicContact CD2-CD1 4.46Å; L247-L251 HydrophobicContact CG-CD1 3.95Å; L247-L251 HydrophobicContact CG-CG 4.25Å; L247-L251 WeakPolarHBondContact O-CG 3.49Å; L247-L251 PolarHBondContact O-N 2.71Å; E248-L251 PolarHBondContact O-N 2.88Å; L251-S254 PolarHBondContact O-N 3.16Å; L251-K255 WeakPolarHBondContact O-CB 3.45Å; L251-K255 PolarHBondContact O-N 3.18Å; L251-M587 HydrophobicContact CD2-CB 4.25Å; L251-M587 HydrophobicContact CD2-CG 3.85Å; L251-M587 HydrophobicContact CD2-SD 4.15Å; L251-F591 HydrophobicContact CD1-CE2 4.37Å; L251-F591 HydrophobicContact CD1-CZ 4.05Å; L251-F591 HydrophobicContact CD2-CE2 3.77Å; L251-F591 HydrophobicContact CD2-CZ 4.28Å; L251-A670 HydrophobicContact CD1-CB 4.44Å; L251-A670 HydrophobicContact CD2-CB 4.48Å; L251-L673 HydrophobicContact CB-CD1 4.43Å
252	Q	92.1	Very high	92.2	Very high	97 Å²	97	40 Å²	40	45%	0.453	20%	0.204	S	C	.	.	H	α-helix	trans	-65.6	-38.3	175.6	179.8	54.4	36.1	0	0	112.1	E248 K255 S256	E248-Q252 WeakPolarHBondContact O-CB 3.41Å; E248-Q252 PolarHBondContact O-N 3.41Å; Q252-K255 PolarHBondContact O-N 3.43Å; Q252-S256 PolarHBondContact NE2-OG 3.33Å; Q252-S256 WeakPolarHBondContact O-CB 3.37Å; Q252-S256 PolarHBondContact O-N 3.33Å; Q252-S256 PolarHBondContact O-OG 2.77Å
253	T	91.6	Very high	92.3	Very high	29 Å²	29	42.1 Å²	42.1	18%	0.178	21%	0.21	C	C	.	.	H	α-helix	trans	-63.5	-42.2	173.8	-61.4	0	0	0	0	111.3	L215 R249 N250 S256 F257	L215-T253 HydrophobicContact CB-CG2 4.34Å; R249-T253 VanDerWaalsContact O-CB 3.22Å; R249-T253 WeakPolarHBondContact O-CB 3.44Å; R249-T253 PolarHBondContact O-N 2.7Å; R249-T253 PolarHBondContact O-OG1 3.09Å; N250-T253 PolarHBondContact O-N 2.91Å; T253-S256 PolarHBondContact O-N 3.39Å; T253-F257 WeakPolarHBondContact O-CB 3.23Å; T253-F257 PolarHBondContact O-N 2.77Å
254	S	93.5	Very high	92.4	Very high	6 Å²	6	41.9 Å²	41.9	4%	0.042	21%	0.209	C	C	.	.	H	α-helix	trans	-64.1	-43.6	176.7	-60.4	0	0	0	0	111.9	N250 L251 F257 S258	N250-S254 WeakPolarHBondContact O-CB 3.34Å; N250-S254 PolarHBondContact O-N 3.21Å; N250-S254 PolarHBondContact O-OG 2.88Å; L251-S254 PolarHBondContact O-N 3.16Å; S254-F257 PolarHBondContact O-N 3.34Å; S254-S258 PolarHBondContact O-N 2.94Å
255	K	93.3	Very high	92.3	Very high	77 Å²	77	37.8 Å²	37.8	34%	0.335	19%	0.191	S	C	.	.	H	α-helix	trans	-57.3	-52.7	172.7	-174.8	177.8	-171	171.4	0	111.4	L251 Q252 F257 S258 S259 L673	L251-K255 WeakPolarHBondContact O-CB 3.45Å; L251-K255 PolarHBondContact O-N 3.18Å; Q252-K255 PolarHBondContact O-N 3.43Å; K255-F257 VanDerWaalsContact C-N 3.35Å; K255-F257 PolarHBondContact O-N 2.72Å; K255-S258 WeakPolarHBondContact O-CB 3.39Å; K255-S258 PolarHBondContact O-N 3.48Å; K255-S258 VanDerWaalsContact O-N 3.12Å; K255-S259 PolarHBondContact O-N 3.32Å; K255-S259 PolarHBondContact O-OG 2.98Å; K255-L673 HydrophobicContact CB-CD1 4.32Å; K255-L673 HydrophobicContact CB-CD2 4.01Å; K255-L673 HydrophobicContact CD-CD1 4.1Å; K255-L673 HydrophobicContact CD-CD2 3.73Å; K255-L673 HydrophobicContact CD-CG 3.99Å; K255-L673 HydrophobicContact CG-CD2 3.75Å
256	S	93	Very high	92.2	Very high	37 Å²	37	36.4 Å²	36.4	26%	0.259	18%	0.183	S	C	.	.	H	α-helix	trans	-66	-33.1	-179.6	-69.4	0	0	0	0	113.2	Q252 T253 S259 Q260	Q252-S256 PolarHBondContact NE2-OG 3.33Å; Q252-S256 WeakPolarHBondContact O-CB 3.37Å; Q252-S256 PolarHBondContact O-N 3.33Å; Q252-S256 PolarHBondContact O-OG 2.77Å; T253-S256 PolarHBondContact O-N 3.39Å; S256-S259 PolarHBondContact O-N 2.99Å; S256-Q260 WeakPolarHBondContact O-CB 3.44Å; S256-Q260 PolarHBondContact O-N 2.79Å
257	F	94.6	Very high	92	Very high	1 Å²	1	38.3 Å²	38.3	0%	0.004	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-41.8	170.3	-173.9	-79.6	0	0	0	111.3	F179 L212 L215 T253 S254 K255 Q260 L261 L291 H582 L586	F179-F257 HydrophobicContact CB-CZ 4.34Å; F179-F257 AromaticContact CD1-CE2 3.94Å; F179-F257 HydrophobicContact CD1-CE2 3.94Å; F179-F257 AromaticContact CD1-CZ 3.9Å; F179-F257 HydrophobicContact CD1-CZ 3.9Å; F179-F257 HydrophobicContact CE1-CE2 4.43Å; F179-F257 HydrophobicContact CE1-CZ 4.32Å; F179-F257 HydrophobicContact CG-CE2 4.41Å; F179-F257 HydrophobicContact CG-CZ 4Å; L212-F257 HydrophobicContact CD2-CD2 3.91Å; L212-F257 HydrophobicContact CD2-CE2 3.87Å; L215-F257 HydrophobicContact CD1-CB 4.35Å; T253-F257 WeakPolarHBondContact O-CB 3.23Å; T253-F257 PolarHBondContact O-N 2.77Å; S254-F257 PolarHBondContact O-N 3.34Å; K255-F257 VanDerWaalsContact C-N 3.35Å; K255-F257 PolarHBondContact O-N 2.72Å; F257-Q260 PolarHBondContact O-N 2.77Å; F257-L261 WeakPolarHBondContact O-CB 3.39Å; F257-L261 PolarHBondContact O-N 3.23Å; F257-L291 HydrophobicContact CE1-CD1 4.42Å; F257-L291 HydrophobicContact CZ-CD2 4.43Å; F257-H582 AromaticContact CD1-CE1 3.78Å; F257-H582 AromaticContact CE1-CE1 3.58Å; F257-H582 AromaticContact CE1-NE2 3.9Å; F257-L586 HydrophobicContact CD1-CD1 4.35Å
258	S	93.9	Very high	91.7	Very high	4 Å²	4	39 Å²	39	3%	0.028	20%	0.196	C	C	.	.	H	α-helix	trans	-64.6	-41.7	176.3	-142.9	0	0	0	0	111.9	S254 K255 L261 E262 H677	S254-S258 PolarHBondContact O-N 2.94Å; K255-S258 WeakPolarHBondContact O-CB 3.39Å; K255-S258 PolarHBondContact O-N 3.48Å; K255-S258 VanDerWaalsContact O-N 3.12Å; S258-L261 PolarHBondContact O-N 3.14Å; S258-E262 WeakPolarHBondContact O-CB 3.4Å; S258-E262 PolarHBondContact O-N 2.77Å; S258-H677 PolarHBondContact OG-CE1 3.23Å; S258-H677 PolarHBondContact OG-NE2 3.24Å
259	S	92.9	Very high	91.3	Very high	53 Å²	53	33.3 Å²	33.3	37%	0.371	17%	0.171	S	C	.	.	H	α-helix	trans	-61.3	-42.1	171.5	-61.5	0	0	0	0	112.4	K255 S256 L261 E262 D263	K255-S259 PolarHBondContact O-N 3.32Å; K255-S259 PolarHBondContact O-OG 2.98Å; S256-S259 PolarHBondContact O-N 2.99Å; S259-L261 VanDerWaalsContact C-N 3.34Å; S259-L261 PolarHBondContact O-N 2.94Å; S259-E262 PolarHBondContact O-N 3.29Å; S259-D263 WeakPolarHBondContact O-CB 3.08Å; S259-D263 VanDerWaalsContact O-CG 3.26Å; S259-D263 PolarHBondContact O-N 3.49Å
260	Q	93.8	Very high	90.9	Very high	6 Å²	6	37 Å²	37	3%	0.028	18%	0.184	C	C	.	.	H	α-helix	trans	-63.1	-37.3	175.9	170.7	174.3	-5	0	0	112.7	Q208 K211 S256 F257 L264	Q208-Q260 PolarHBondContact O-NE2 3.08Å; Q208-Q260 VanDerWaalsContact O-NE2 3.09Å; K211-Q260 HydrophobicContact CB-CG 4.35Å; K211-Q260 HydrophobicContact CD-CB 4.37Å; K211-Q260 HydrophobicContact CD-CG 3.91Å; S256-Q260 WeakPolarHBondContact O-CB 3.44Å; S256-Q260 PolarHBondContact O-N 2.79Å; F257-Q260 PolarHBondContact O-N 2.77Å; Q260-L264 PolarHBondContact O-N 3Å
261	L	93.9	Very high	90.1	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-70	-39.6	174.8	179.7	61.4	0	0	0	111.6	F179 F257 S258 S259 L264 C265 V287 V288 L291	F179-L261 HydrophobicContact CE2-CD1 4.09Å; F179-L261 HydrophobicContact CZ-CD1 4.33Å; F257-L261 WeakPolarHBondContact O-CB 3.39Å; F257-L261 PolarHBondContact O-N 3.23Å; S258-L261 PolarHBondContact O-N 3.14Å; S259-L261 VanDerWaalsContact C-N 3.34Å; S259-L261 PolarHBondContact O-N 2.94Å; L261-L264 PolarHBondContact O-N 3.47Å; L261-C265 PolarHBondContact O-N 3.07Å; L261-C265 PolarHBondContact O-SG 2.77Å; L261-V287 HydrophobicContact CD1-CG1 4.01Å; L261-V288 HydrophobicContact CD2-CG2 4.47Å; L261-L291 HydrophobicContact CD1-CD1 3.86Å; L261-L291 HydrophobicContact CD2-CD1 3.76Å; L261-L291 HydrophobicContact CG-CD1 4.46Å
262	E	92.3	Very high	88.8	Confident	13 Å²	13	44.4 Å²	44.4	6%	0.061	21%	0.209	C	C	.	.	H	α-helix	trans	-68.6	-43.5	176.2	-178.4	56.3	-158	0	0	111.9	S258 S259 L264 C265 Q266 K579 L680 N684	S258-E262 WeakPolarHBondContact O-CB 3.4Å; S258-E262 PolarHBondContact O-N 2.77Å; S259-E262 PolarHBondContact O-N 3.29Å; E262-L264 PolarHBondContact O-N 3.47Å; E262-C265 WeakPolarHBondContact O-CB 3.16Å; E262-C265 PolarHBondContact O-N 3.3Å; E262-C265 VanDerWaalsContact O-N 3.11Å; E262-Q266 WeakPolarHBondContact O-CG 3.45Å; E262-Q266 PolarHBondContact O-N 3.29Å; E262-Q266 PolarHBondContact OE1-NE2 3.05Å; E262-K579 IonicContact OE2-NZ 3.67Å; E262-K579 PolarHBondContact OE2-NZ 3.46Å; E262-L680 HydrophobicContact CG-CD2 4.36Å; E262-N684 VanDerWaalsContact CG-ND2 3.3Å; E262-N684 WeakPolarHBondContact CG-ND2 3.33Å; E262-N684 WeakPolarHBondContact OE1-CB 3.43Å; E262-N684 PolarHBondContact OE1-ND2 3.26Å
263	D	91.6	Very high	87.3	Confident	85 Å²	85	43 Å²	43	46%	0.455	21%	0.21	S	C	.	.	H	α-helix	trans	-50.7	-45.5	170.2	-76.3	-18.3	0	0	0	111.1	K211 S259 Q266 L267	K211-D263 IonicContact NZ-OD2 3.73Å; K211-D263 PolarHBondContact NZ-OD2 3.4Å; S259-D263 WeakPolarHBondContact O-CB 3.08Å; S259-D263 VanDerWaalsContact O-CG 3.26Å; S259-D263 PolarHBondContact O-N 3.49Å; D263-Q266 PolarHBondContact O-N 2.91Å; D263-L267 WeakPolarHBondContact O-CB 3.15Å; D263-L267 PolarHBondContact O-N 3.38Å
264	L	91.5	Very high	85.9	Confident	4 Å²	4	44 Å²	44	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-66.6	-42.5	179.4	-178.4	60.1	0	0	0	111.8	F179 L183 T204 Q260 L261 E262 Q266 L267 L268	F179-L264 HydrophobicContact CE2-CD2 4.32Å; F179-L264 HydrophobicContact CZ-CD2 3.92Å; L183-L264 HydrophobicContact CD1-CD2 3.76Å; L183-L264 HydrophobicContact CD2-CD2 3.63Å; L183-L264 HydrophobicContact CG-CD2 4.35Å; T204-L264 HydrophobicContact CG2-CD1 3.91Å; Q260-L264 PolarHBondContact O-N 3Å; L261-L264 PolarHBondContact O-N 3.47Å; E262-L264 PolarHBondContact O-N 3.47Å; L264-Q266 VanDerWaalsContact C-N 3.34Å; L264-Q266 PolarHBondContact O-N 2.87Å; L264-L267 PolarHBondContact O-N 3.47Å; L264-L268 HydrophobicContact CD1-CD1 4.27Å; L264-L268 HydrophobicContact CD1-CG 4.28Å; L264-L268 HydrophobicContact CG-CD1 4.14Å; L264-L268 VanDerWaalsContact O-CG 3.3Å; L264-L268 WeakPolarHBondContact O-CG 3.46Å; L264-L268 PolarHBondContact O-N 3.24Å
265	C	90.4	Very high	84.7	Confident	3 Å²	3	45 Å²	45	2%	0.02	23%	0.23	C	C	.	.	H	α-helix	trans	-59.1	-45.9	174.8	-65.3	0	0	0	0	111.3	L261 E262 L268 L269 I284 K579	L261-C265 PolarHBondContact O-N 3.07Å; L261-C265 PolarHBondContact O-SG 2.77Å; E262-C265 WeakPolarHBondContact O-CB 3.16Å; E262-C265 PolarHBondContact O-N 3.3Å; E262-C265 VanDerWaalsContact O-N 3.11Å; C265-L268 PolarHBondContact O-N 3.17Å; C265-L269 WeakPolarHBondContact O-CB 3.44Å; C265-L269 VanDerWaalsContact O-CG 3.29Å; C265-L269 WeakPolarHBondContact O-CG 3.48Å; C265-L269 PolarHBondContact O-N 2.84Å; C265-I284 HydrophobicContact CB-CD1 4.05Å; C265-I284 HydrophobicContact CB-CG1 4.47Å; C265-I284 HydrophobicContact CB-CG2 4.39Å; C265-K579 WeakPolarHBondContact SG-CE 3.3Å; C265-K579 PolarHBondContact SG-NZ 3.46Å; C265-K579 VanDerWaalsContact SG-NZ 3.36Å
266	Q	87.3	Confident	83.9	Confident	27 Å²	27	43 Å²	43	13%	0.126	23%	0.225	C	C	.	.	H	α-helix	trans	-67.3	-35.5	178.8	-64.4	-61.2	-32	0	0	112.3	E262 D263 L264 R270	E262-Q266 WeakPolarHBondContact O-CG 3.45Å; E262-Q266 PolarHBondContact O-N 3.29Å; E262-Q266 PolarHBondContact OE1-NE2 3.05Å; D263-Q266 PolarHBondContact O-N 2.91Å; L264-Q266 VanDerWaalsContact C-N 3.34Å; L264-Q266 PolarHBondContact O-N 2.87Å; Q266-R270 WeakPolarHBondContact O-CB 3.46Å; Q266-R270 WeakPolarHBondContact O-CD 3.47Å; Q266-R270 WeakPolarHBondContact O-CG 3.11Å; Q266-R270 PolarHBondContact O-N 3.17Å; Q266-R270 VanDerWaalsContact O-N 3.15Å
267	L	87.5	Confident	83.1	Confident	60 Å²	60	44.8 Å²	44.8	31%	0.314	24%	0.236	S	C	.	.	H	α-helix	trans	-64.5	-43.1	174.7	179.8	64.9	0	0	0	112.1	F200 T204 D263 L264	F200-L267 HydrophobicContact CE2-CD1 4.26Å; F200-L267 HydrophobicContact CE2-CG 4.42Å; F200-L267 HydrophobicContact CZ-CD1 4.36Å; F200-L267 HydrophobicContact CZ-CD2 4.11Å; F200-L267 HydrophobicContact CZ-CG 4.04Å; T204-L267 HydrophobicContact CG2-CD2 3.96Å; D263-L267 WeakPolarHBondContact O-CB 3.15Å; D263-L267 PolarHBondContact O-N 3.38Å; L264-L267 PolarHBondContact O-N 3.47Å
268	L	85.9	Confident	82.4	Confident	22 Å²	22	52 Å²	52	12%	0.115	27%	0.27	C	S	.	.	H	α-helix	trans	-67.9	-49.3	178.3	-69.6	171.5	0	0	0	111.5	F187 L264 C265 R270 R271 I284	F187-L268 HydrophobicContact CE1-CD2 3.98Å; F187-L268 HydrophobicContact CZ-CD2 4.38Å; L264-L268 HydrophobicContact CD1-CD1 4.27Å; L264-L268 HydrophobicContact CD1-CG 4.28Å; L264-L268 HydrophobicContact CG-CD1 4.14Å; L264-L268 VanDerWaalsContact O-CG 3.3Å; L264-L268 WeakPolarHBondContact O-CG 3.46Å; L264-L268 PolarHBondContact O-N 3.24Å; C265-L268 PolarHBondContact O-N 3.17Å; L268-R270 VanDerWaalsContact C-N 3.29Å; L268-R270 PolarHBondContact O-N 2.95Å; L268-R271 PolarHBondContact O-N 2.91Å; L268-R271 VanDerWaalsContact O-N 3.14Å; L268-I284 HydrophobicContact CB-CD1 4.03Å; L268-I284 HydrophobicContact CB-CG1 4.39Å; L268-I284 HydrophobicContact CD1-CD1 4.4Å; L268-I284 HydrophobicContact CD1-CG1 3.86Å
269	L	83.4	Confident	81.9	Confident	20 Å²	20	55.1 Å²	55.1	11%	0.105	28%	0.284	C	S	.	.	H	α-helix	trans	-62.3	-31.7	-179.8	-71.8	171.4	0	0	0	113.7	C265 R271 A280 I284	C265-L269 WeakPolarHBondContact O-CB 3.44Å; C265-L269 VanDerWaalsContact O-CG 3.29Å; C265-L269 WeakPolarHBondContact O-CG 3.48Å; C265-L269 PolarHBondContact O-N 2.84Å; L269-R271 VanDerWaalsContact C-N 3.33Å; L269-A280 HydrophobicContact CD2-CB 4.41Å; L269-I284 HydrophobicContact CD1-CD1 4.21Å; L269-I284 HydrophobicContact CD2-CD1 3.98Å; L269-I284 HydrophobicContact CG-CD1 3.65Å
270	R	81.4	Confident	81.5	Confident	181 Å²	181	52.7 Å²	52.7	68%	0.683	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-13.2	178.1	-73	173.7	-178.6	-166.4	-1	114	Q266 L268	Q266-R270 WeakPolarHBondContact O-CB 3.46Å; Q266-R270 WeakPolarHBondContact O-CD 3.47Å; Q266-R270 WeakPolarHBondContact O-CG 3.11Å; Q266-R270 PolarHBondContact O-N 3.17Å; Q266-R270 VanDerWaalsContact O-N 3.15Å; L268-R270 VanDerWaalsContact C-N 3.29Å; L268-R270 PolarHBondContact O-N 2.95Å
271	R	75.1	Confident	81.2	Confident	24 Å²	24	53.9 Å²	53.9	9%	0.091	27%	0.272	C	S	.	.			trans	-85.1	117.1	-175.8	-173.4	178.3	178.4	-165.1	2.2	110.8	F191 D197 F200 L268 L269 S273	F191-R271 VanDerWaalsContact CE1-NH1 3.27Å; D197-R271 VanDerWaalsContact CB-NH2 3.27Å; D197-R271 VanDerWaalsContact CG-NH2 3.33Å; D197-R271 IonicContact OD1-CZ 2.68Å; D197-R271 IonicContact OD1-NH2 2.75Å; D197-R271 PolarHBondContact OD1-NH2 3.44Å; F200-R271 VanDerWaalsContact CE1-NH1 3.27Å; L268-R271 PolarHBondContact O-N 2.91Å; L268-R271 VanDerWaalsContact O-N 3.14Å; L269-R271 VanDerWaalsContact C-N 3.33Å; R271-S273 PolarHBondContact NE-O 3.11Å; R271-S273 PolarHBondContact NE-OG 2.86Å
272	R	66.4	Low	80.9	Confident	179 Å²	179	58.4 Å²	58.4	68%	0.675	30%	0.297	S	S	*	.			trans	-98.3	-1.5	173.9	-58.3	-172.4	-173.3	150.5	10.7	114.5	E695	R272-E695 IonicContact CZ-OE1 3.92Å; R272-E695 IonicContact CZ-OE2 2.72Å; R272-E695 IonicContact NH2-OE1 2.78Å; R272-E695 PolarHBondContact NH2-OE1 2.88Å; R272-E695 IonicContact NH2-OE2 2.63Å; R272-E695 PolarHBondContact NH2-OE2 3.32Å
273	S	59.9	Low	80.8	Confident	67 Å²	67	58.8 Å²	58.8	47%	0.469	30%	0.299	S	S	.	.	S	Bend	trans	-99.5	127.1	-179.7	53.8	0	0	0	0	111.6	R271 F275	R271-S273 PolarHBondContact NE-O 3.11Å; R271-S273 PolarHBondContact NE-OG 2.86Å; S273-F275 PolarHBondContact O-N 2.64Å
274	G	62.3	Low	80.8	Confident	50 Å²	50	54.9 Å²	54.9	52%	0.515	28%	0.278	S	S	.	.	S	Bend	trans	74.3	2.2	175.4	0	0	0	0	0	115.8
275	F	68.1	Low	80.8	Confident	29 Å²	29	56.9 Å²	56.9	13%	0.127	29%	0.288	C	S	.	.	S	Bend	trans	-153.7	145.6	-171.8	-135.1	-123.1	0	0	0	112.9	R190 F191 S273 E279 A280 D283	R190-F275 HydrophobicContact CB-CD2 4.33Å; R190-F275 HydrophobicContact CB-CE2 3.54Å; R190-F275 HydrophobicContact CB-CZ 4.1Å; R190-F275 HydrophobicContact CG-CE2 3.44Å; R190-F275 VanDerWaalsContact CG-CE2 3.44Å; R190-F275 HydrophobicContact CG-CZ 3.54Å; R190-F275 VanDerWaalsContact CZ-CZ 3.43Å; F191-F275 HydrophobicContact CE1-CD2 4.29Å; F191-F275 HydrophobicContact CZ-CB 4.47Å; F191-F275 AromaticContact CZ-CD2 3.94Å; F191-F275 HydrophobicContact CZ-CD2 3.94Å; F191-F275 HydrophobicContact CZ-CG 4.22Å; S273-F275 PolarHBondContact O-N 2.64Å; F275-E279 HydrophobicContact CD1-CB 3.98Å; F275-E279 VanDerWaalsContact CE1-C 3.43Å; F275-E279 HydrophobicContact CE1-CB 3.57Å; F275-E279 HydrophobicContact CE2-CB 4.23Å; F275-E279 HydrophobicContact CZ-CB 3.69Å; F275-A280 HydrophobicContact CD1-CB 4.01Å; F275-A280 HydrophobicContact CE1-CB 4.3Å; F275-D283 VanDerWaalsContact CZ-OD2 3.28Å; F275-D283 WeakPolarHBondContact CZ-OD2 3.18Å
276	S	76.4	Confident	80.9	Confident	34 Å²	34	58.6 Å²	58.6	24%	0.238	30%	0.3	C	S	.	.			trans	-83.2	150.1	171	141	0	0	0	0	112.1	E278 E279 A280	S276-E278 PolarHBondContact O-N 3.27Å; S276-E278 PolarHBondContact OG-N 3.06Å; S276-E279 WeakPolarHBondContact CB-OE2 3.24Å; S276-E279 PolarHBondContact N-OE2 2.91Å; S276-E279 PolarHBondContact O-N 3.38Å; S276-E279 PolarHBondContact OG-N 3.46Å; S276-A280 WeakPolarHBondContact O-CB 3.36Å; S276-A280 PolarHBondContact O-N 3.33Å
277	P	76.1	Confident	81.2	Confident	75 Å²	75	57.7 Å²	57.7	49%	0.487	30%	0.297	S	S	.	.	H	α-helix	trans	-61.8	-28.2	172.6	-22	34	0	0	0	114	H281	P277-H281 PolarHBondContact O-N 2.9Å; P277-H281 VanDerWaalsContact O-N 3.13Å
278	E	80.4	Confident	81.5	Confident	152 Å²	152	54.8 Å²	54.8	71%	0.71	28%	0.282	S	S	*	.	H	α-helix	trans	-74.7	-45.7	177.1	-59.8	175.3	154.5	0	0	109.9	S276 A280 H281 D282	S276-E278 PolarHBondContact O-N 3.27Å; S276-E278 PolarHBondContact OG-N 3.06Å; E278-A280 VanDerWaalsContact C-N 3.27Å; E278-A280 PolarHBondContact O-N 3.47Å; E278-H281 WeakPolarHBondContact O-CA 3.47Å; E278-H281 WeakPolarHBondContact O-CB 3.32Å; E278-H281 PolarHBondContact O-N 3.47Å; E278-D282 PolarHBondContact O-N 2.88Å
279	E	83.6	Confident	81.9	Confident	69 Å²	69	56.8 Å²	56.8	32%	0.322	29%	0.29	S	S	.	.	H	α-helix	trans	-59.6	-38.6	173	-62.1	-177.7	109.2	0	0	111.9	R190 F275 S276 H281 D282 D283	R190-E279 IonicContact CZ-OE1 3.31Å; R190-E279 IonicContact NH1-OE1 3.93Å; R190-E279 PolarHBondContact NH1-OE1 3.03Å; F275-E279 HydrophobicContact CD1-CB 3.98Å; F275-E279 VanDerWaalsContact CE1-C 3.43Å; F275-E279 HydrophobicContact CE1-CB 3.57Å; F275-E279 HydrophobicContact CE2-CB 4.23Å; F275-E279 HydrophobicContact CZ-CB 3.69Å; S276-E279 WeakPolarHBondContact CB-OE2 3.24Å; S276-E279 PolarHBondContact N-OE2 2.91Å; S276-E279 PolarHBondContact O-N 3.38Å; S276-E279 PolarHBondContact OG-N 3.46Å; E279-H281 VanDerWaalsContact C-N 3.32Å; E279-H281 PolarHBondContact O-N 2.94Å; E279-D282 PolarHBondContact O-N 3.38Å; E279-D283 WeakPolarHBondContact O-CB 3.21Å; E279-D283 PolarHBondContact O-N 3.11Å
280	A	84.8	Confident	82.4	Confident	2 Å²	2	56 Å²	56	2%	0.017	29%	0.286	C	S	.	.	H	α-helix	trans	-62.5	-38.8	173.9	0	0	0	0	0	111.9	L269 F275 S276 E278 I284	L269-A280 HydrophobicContact CD2-CB 4.41Å; F275-A280 HydrophobicContact CD1-CB 4.01Å; F275-A280 HydrophobicContact CE1-CB 4.3Å; S276-A280 WeakPolarHBondContact O-CB 3.36Å; S276-A280 PolarHBondContact O-N 3.33Å; E278-A280 VanDerWaalsContact C-N 3.27Å; E278-A280 PolarHBondContact O-N 3.47Å; A280-I284 WeakPolarHBondContact O-CB 3.5Å; A280-I284 VanDerWaalsContact O-CD1 3.23Å; A280-I284 WeakPolarHBondContact O-CD1 3.23Å; A280-I284 WeakPolarHBondContact O-CG1 3.34Å; A280-I284 PolarHBondContact O-N 2.68Å; A280-I284 VanDerWaalsContact O-N 3.11Å
281	H	86.8	Confident	83.1	Confident	32 Å²	32	47.5 Å²	47.5	15%	0.148	25%	0.254	C	S	.	.	H	α-helix	trans	-68.4	-44	177.5	-167.7	76.2	0	0	0	111.9	P277 E278 E279 I284 L285	P277-H281 PolarHBondContact O-N 2.9Å; P277-H281 VanDerWaalsContact O-N 3.13Å; E278-H281 WeakPolarHBondContact O-CA 3.47Å; E278-H281 WeakPolarHBondContact O-CB 3.32Å; E278-H281 PolarHBondContact O-N 3.47Å; E279-H281 VanDerWaalsContact C-N 3.32Å; E279-H281 PolarHBondContact O-N 2.94Å; H281-I284 PolarHBondContact O-N 2.99Å; H281-L285 WeakPolarHBondContact O-CB 3.36Å; H281-L285 PolarHBondContact O-N 3.16Å
282	D	88.4	Confident	84.1	Confident	99 Å²	99	46.6 Å²	46.6	53%	0.529	25%	0.251	S	S	.	.	H	α-helix	trans	-64.4	-46.3	178.4	-75.8	-18.7	0	0	0	112.2	E278 E279 I284 L285 S286	E278-D282 PolarHBondContact O-N 2.88Å; E279-D282 PolarHBondContact O-N 3.38Å; D282-I284 VanDerWaalsContact C-N 3.34Å; D282-I284 PolarHBondContact O-N 3.23Å; D282-L285 PolarHBondContact O-N 3Å; D282-S286 WeakPolarHBondContact O-CB 3.46Å; D282-S286 PolarHBondContact O-N 3.33Å
283	D	88.8	Confident	85.3	Confident	21 Å²	21	39.6 Å²	39.6	11%	0.112	23%	0.23	C	C	.	.	H	α-helix	trans	-63.5	-39.6	177.1	-78.8	8.2	0	0	0	111.1	I186 R190 F275 E279 S286 V287	I186-D283 HydrophobicContact CG2-CB 4.31Å; I186-D283 VanDerWaalsContact CG2-OD2 3.3Å; I186-D283 WeakPolarHBondContact CG2-OD2 3.34Å; R190-D283 WeakPolarHBondContact CG-OD2 3.29Å; R190-D283 IonicContact CZ-OD1 3.81Å; R190-D283 IonicContact CZ-OD2 2.89Å; R190-D283 IonicContact NE-OD1 3.46Å; R190-D283 PolarHBondContact NE-OD1 2.94Å; R190-D283 IonicContact NE-OD2 2.74Å; R190-D283 PolarHBondContact NE-OD2 3Å; R190-D283 IonicContact NH2-OD1 2.67Å; R190-D283 PolarHBondContact NH2-OD1 3.18Å; R190-D283 IonicContact NH2-OD2 3.55Å; F275-D283 VanDerWaalsContact CZ-OD2 3.28Å; F275-D283 WeakPolarHBondContact CZ-OD2 3.18Å; E279-D283 WeakPolarHBondContact O-CB 3.21Å; E279-D283 PolarHBondContact O-N 3.11Å; D283-S286 PolarHBondContact O-N 3.01Å; D283-V287 WeakPolarHBondContact O-CG2 3.22Å; D283-V287 PolarHBondContact O-N 2.81Å
284	I	91.9	Very high	87	Confident	3 Å²	3	36.6 Å²	36.6	2%	0.015	21%	0.209	C	C	.	.	H	α-helix	trans	-62.4	-46.3	172.9	-74.2	165.7	0	0	0	111.3	C265 L268 L269 A280 H281 D282 S286 V287 V288 L575	C265-I284 HydrophobicContact CB-CD1 4.05Å; C265-I284 HydrophobicContact CB-CG1 4.47Å; C265-I284 HydrophobicContact CB-CG2 4.39Å; L268-I284 HydrophobicContact CB-CD1 4.03Å; L268-I284 HydrophobicContact CB-CG1 4.39Å; L268-I284 HydrophobicContact CD1-CD1 4.4Å; L268-I284 HydrophobicContact CD1-CG1 3.86Å; L269-I284 HydrophobicContact CD1-CD1 4.21Å; L269-I284 HydrophobicContact CD2-CD1 3.98Å; L269-I284 HydrophobicContact CG-CD1 3.65Å; A280-I284 WeakPolarHBondContact O-CB 3.5Å; A280-I284 VanDerWaalsContact O-CD1 3.23Å; A280-I284 WeakPolarHBondContact O-CD1 3.23Å; A280-I284 WeakPolarHBondContact O-CG1 3.34Å; A280-I284 PolarHBondContact O-N 2.68Å; A280-I284 VanDerWaalsContact O-N 3.11Å; H281-I284 PolarHBondContact O-N 2.99Å; D282-I284 VanDerWaalsContact C-N 3.34Å; D282-I284 PolarHBondContact O-N 3.23Å; I284-S286 VanDerWaalsContact C-N 3.3Å; I284-S286 PolarHBondContact O-N 3.04Å; I284-V287 PolarHBondContact O-N 2.99Å; I284-V288 HydrophobicContact CG2-CG2 4.49Å; I284-V288 WeakPolarHBondContact O-CG2 3.06Å; I284-V288 PolarHBondContact O-N 3.2Å; I284-L575 HydrophobicContact CG2-CD1 3.86Å; I284-L575 HydrophobicContact CG2-CD2 3.76Å; I284-L575 HydrophobicContact CG2-CG 4.44Å
285	L	92.2	Very high	88.5	Confident	45 Å²	45	34.2 Å²	34.2	24%	0.236	19%	0.185	C	C	.	.	H	α-helix	trans	-64.8	-37.2	-179.5	-175.3	146.4	0	0	0	111.2	H281 D282 Q289	H281-L285 WeakPolarHBondContact O-CB 3.36Å; H281-L285 PolarHBondContact O-N 3.16Å; D282-L285 PolarHBondContact O-N 3Å; L285-Q289 WeakPolarHBondContact O-CB 3.44Å; L285-Q289 PolarHBondContact O-N 2.98Å
286	S	91.6	Very high	89.8	Confident	39 Å²	39	36.6 Å²	36.6	27%	0.273	20%	0.196	S	C	.	.	H	α-helix	trans	-64.9	-44.6	173.4	-171.8	0	0	0	0	112.3	D282 D283 I284 Q289 T290 L424	D282-S286 WeakPolarHBondContact O-CB 3.46Å; D282-S286 PolarHBondContact O-N 3.33Å; D283-S286 PolarHBondContact O-N 3.01Å; I284-S286 VanDerWaalsContact C-N 3.3Å; I284-S286 PolarHBondContact O-N 3.04Å; S286-Q289 PolarHBondContact O-N 3.02Å; S286-T290 VanDerWaalsContact O-CB 3.24Å; S286-T290 WeakPolarHBondContact O-CB 3.42Å; S286-T290 PolarHBondContact O-N 3.42Å; S286-T290 PolarHBondContact O-OG1 2.74Å; S286-L424 WeakPolarHBondContact OG-CD2 3.47Å
287	V	93.3	Very high	90.6	Very high	8 Å²	8	36.9 Å²	36.9	5%	0.048	19%	0.194	C	C	.	.	H	α-helix	trans	-58.8	-50.8	173	167.4	0	0	0	0	111.2	F179 M182 L183 I186 L261 D283 I284 T290 L291	F179-V287 HydrophobicContact CE2-CG1 4.22Å; M182-V287 HydrophobicContact CE-CB 4.34Å; M182-V287 HydrophobicContact CE-CG1 4.14Å; M182-V287 HydrophobicContact CE-CG2 4.49Å; M182-V287 VanDerWaalsContact CE-O 3.3Å; M182-V287 WeakPolarHBondContact CE-O 3.42Å; L183-V287 HydrophobicContact CD2-CG2 4.4Å; I186-V287 HydrophobicContact CD1-CG2 3.24Å; L261-V287 HydrophobicContact CD1-CG1 4.01Å; D283-V287 WeakPolarHBondContact O-CG2 3.22Å; D283-V287 PolarHBondContact O-N 2.81Å; I284-V287 PolarHBondContact O-N 2.99Å; V287-T290 PolarHBondContact O-N 2.8Å; V287-L291 HydrophobicContact CG1-CD1 3.9Å; V287-L291 HydrophobicContact CG1-CG 4.38Å; V287-L291 WeakPolarHBondContact O-CB 3.37Å; V287-L291 WeakPolarHBondContact O-CG 3.4Å; V287-L291 PolarHBondContact O-N 3.34Å
288	V	95.2	Very high	91.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-67.9	-38.9	-177	-179.3	0	0	0	0	111.1	L261 I284 L291 L292 L575 K578 K579	L261-V288 HydrophobicContact CD2-CG2 4.47Å; I284-V288 HydrophobicContact CG2-CG2 4.49Å; I284-V288 WeakPolarHBondContact O-CG2 3.06Å; I284-V288 PolarHBondContact O-N 3.2Å; V288-L291 PolarHBondContact O-N 3Å; V288-L292 WeakPolarHBondContact O-CB 3.49Å; V288-L292 WeakPolarHBondContact O-CG 3.24Å; V288-L292 PolarHBondContact O-N 2.91Å; V288-L575 HydrophobicContact CB-CD1 4.28Å; V288-L575 HydrophobicContact CG2-CD1 4.02Å; V288-K578 HydrophobicContact CG1-CB 3.71Å; V288-K579 HydrophobicContact CG1-CG 4.11Å; V288-K579 HydrophobicContact CG2-CG 4.07Å
289	Q	94.4	Very high	92	Very high	64 Å²	64	27.2 Å²	27.2	30%	0.299	14%	0.143	S	C	.	.	H	α-helix	trans	-64	-40.6	175.4	-176.6	60.1	51	0	0	112.5	L285 S286 L292 S293 K578	L285-Q289 WeakPolarHBondContact O-CB 3.44Å; L285-Q289 PolarHBondContact O-N 2.98Å; S286-Q289 PolarHBondContact O-N 3.02Å; Q289-L292 PolarHBondContact O-N 2.97Å; Q289-S293 PolarHBondContact O-N 3.37Å; Q289-S293 PolarHBondContact O-OG 3.12Å; Q289-K578 VanDerWaalsContact OE1-CE 3.27Å
290	T	93.8	Very high	92.5	Very high	3 Å²	3	27.5 Å²	27.5	2%	0.018	15%	0.15	C	C	.	.	H	α-helix	trans	-74.5	-36	-179.9	-58.2	0	0	0	0	111.1	M182 S286 V287 S293 A294 L424 T428	M182-T290 HydrophobicContact CE-CG2 3.65Å; M182-T290 HydrophobicContact CG-CG2 4.33Å; M182-T290 HydrophobicContact SD-CG2 3.84Å; S286-T290 VanDerWaalsContact O-CB 3.24Å; S286-T290 WeakPolarHBondContact O-CB 3.42Å; S286-T290 PolarHBondContact O-N 3.42Å; S286-T290 PolarHBondContact O-OG1 2.74Å; V287-T290 PolarHBondContact O-N 2.8Å; T290-S293 PolarHBondContact O-N 3.35Å; T290-A294 WeakPolarHBondContact O-CB 3.36Å; T290-A294 PolarHBondContact O-N 2.97Å; T290-L424 HydrophobicContact CG2-CG 4.39Å; T290-T428 HydrophobicContact CG2-CG2 3.77Å; T290-T428 VanDerWaalsContact CG2-OG1 3.29Å; T290-T428 WeakPolarHBondContact CG2-OG1 3.37Å
291	L	95.6	Very high	92.9	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-64	-39.8	170.7	-80.4	176.5	0	0	0	112.6	F179 M182 F257 L261 V287 V288 A294 E295	F179-L291 HydrophobicContact CB-CD2 4.15Å; F179-L291 HydrophobicContact CD2-CD1 4Å; F179-L291 HydrophobicContact CD2-CD2 4.01Å; F179-L291 HydrophobicContact CD2-CG 4.37Å; F179-L291 HydrophobicContact CE2-CD1 4.16Å; F179-L291 HydrophobicContact CG-CD2 4.39Å; M182-L291 HydrophobicContact CE-CD2 4.36Å; M182-L291 HydrophobicContact CE-CG 3.89Å; M182-L291 HydrophobicContact SD-CD2 4.14Å; M182-L291 HydrophobicContact SD-CG 4.32Å; F257-L291 HydrophobicContact CE1-CD1 4.42Å; F257-L291 HydrophobicContact CZ-CD2 4.43Å; L261-L291 HydrophobicContact CD1-CD1 3.86Å; L261-L291 HydrophobicContact CD2-CD1 3.76Å; L261-L291 HydrophobicContact CG-CD1 4.46Å; V287-L291 HydrophobicContact CG1-CD1 3.9Å; V287-L291 HydrophobicContact CG1-CG 4.38Å; V287-L291 WeakPolarHBondContact O-CB 3.37Å; V287-L291 WeakPolarHBondContact O-CG 3.4Å; V287-L291 PolarHBondContact O-N 3.34Å; V288-L291 PolarHBondContact O-N 3Å; L291-A294 PolarHBondContact O-N 3.42Å; L291-E295 WeakPolarHBondContact O-CB 3.43Å; L291-E295 PolarHBondContact O-N 2.91Å
292	L	95.1	Very high	93.3	Very high	5 Å²	5	27.2 Å²	27.2	3%	0.026	15%	0.149	C	C	.	.	H	α-helix	trans	-59	-52.3	172	-82.4	170.6	0	0	0	111.2	V288 Q289 A294 E295 E296 K578 K581 H582 L585	V288-L292 WeakPolarHBondContact O-CB 3.49Å; V288-L292 WeakPolarHBondContact O-CG 3.24Å; V288-L292 PolarHBondContact O-N 2.91Å; Q289-L292 PolarHBondContact O-N 2.97Å; L292-A294 PolarHBondContact O-N 3.41Å; L292-E295 PolarHBondContact O-N 3.11Å; L292-E295 VanDerWaalsContact O-N 3.08Å; L292-E296 WeakPolarHBondContact O-CG 3.49Å; L292-E296 PolarHBondContact O-N 2.76Å; L292-K578 HydrophobicContact CD1-CB 3.75Å; L292-K578 HydrophobicContact CD1-CD 4.33Å; L292-K578 HydrophobicContact CD1-CG 3.85Å; L292-K581 HydrophobicContact CD2-CB 3.98Å; L292-K581 HydrophobicContact CD2-CD 3.96Å; L292-K581 HydrophobicContact CD2-CG 3.96Å; L292-H582 HydrophobicContact CD2-CB 3.71Å; L292-H582 HydrophobicContact CG-CB 4.15Å; L292-L585 HydrophobicContact CD2-CD1 3.83Å
293	S	93.6	Very high	93.5	Very high	33 Å²	33	25.6 Å²	25.6	23%	0.231	14%	0.138	C	C	.	.	H	α-helix	trans	-60.1	-35.2	179.9	-49.1	0	0	0	0	111.8	Q289 T290 H297	Q289-S293 PolarHBondContact O-N 3.37Å; Q289-S293 PolarHBondContact O-OG 3.12Å; T290-S293 PolarHBondContact O-N 3.35Å; S293-H297 PolarHBondContact O-N 3.37Å
294	A	94.2	Very high	93.6	Very high	3 Å²	3	27 Å²	27	3%	0.025	15%	0.152	C	C	.	.	H	α-helix	trans	-71.5	-39.8	173.8	0	0	0	0	0	113.2	I178 T290 L291 L292 H297 L298 Q432	I178-A294 HydrophobicContact CG2-CB 4.38Å; T290-A294 WeakPolarHBondContact O-CB 3.36Å; T290-A294 PolarHBondContact O-N 2.97Å; L291-A294 PolarHBondContact O-N 3.42Å; L292-A294 PolarHBondContact O-N 3.41Å; A294-H297 PolarHBondContact O-N 3.33Å; A294-L298 WeakPolarHBondContact O-CB 3.35Å; A294-L298 WeakPolarHBondContact O-CD1 3.45Å; A294-L298 WeakPolarHBondContact O-CG 3.36Å; A294-L298 PolarHBondContact O-N 2.87Å; A294-Q432 VanDerWaalsContact CA-NE2 3.29Å; A294-Q432 VanDerWaalsContact CB-NE2 3.31Å
295	E	95.2	Very high	93.7	Very high	1 Å²	1	27 Å²	27	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-66.8	-44.2	177.9	-166.9	60.7	-151.5	0	0	111.5	K175 L291 L292 H297 L298 T299 L585 R589	K175-E295 WeakPolarHBondContact CD-OE2 3.29Å; K175-E295 WeakPolarHBondContact CE-OE2 3.36Å; K175-E295 IonicContact NZ-OE2 2.74Å; K175-E295 PolarHBondContact NZ-OE2 2.69Å; L291-E295 WeakPolarHBondContact O-CB 3.43Å; L291-E295 PolarHBondContact O-N 2.91Å; L292-E295 PolarHBondContact O-N 3.11Å; L292-E295 VanDerWaalsContact O-N 3.08Å; E295-H297 VanDerWaalsContact C-N 3.29Å; E295-H297 PolarHBondContact O-N 3.29Å; E295-L298 PolarHBondContact O-N 2.84Å; E295-L298 VanDerWaalsContact O-N 3.13Å; E295-T299 PolarHBondContact O-N 2.73Å; E295-T299 PolarHBondContact O-OG1 2.76Å; E295-L585 HydrophobicContact CB-CB 4.45Å; E295-L585 HydrophobicContact CB-CD1 4.45Å; E295-L585 HydrophobicContact CG-CB 3.61Å; E295-L585 HydrophobicContact CG-CD1 4.46Å; E295-R589 VanDerWaalsContact OE1-CD 3.28Å; E295-R589 WeakPolarHBondContact OE1-CD 3.5Å; E295-R589 IonicContact OE1-CZ 2.69Å; E295-R589 IonicContact OE1-NE 3.71Å; E295-R589 PolarHBondContact OE1-NE 3.26Å; E295-R589 IonicContact OE1-NH1 3.34Å; E295-R589 PolarHBondContact OE1-NH1 3.03Å; E295-R589 IonicContact OE2-NH1 3.54Å; E295-R589 PolarHBondContact OE2-NH1 2.88Å
296	E	93.9	Very high	93.8	Very high	78 Å²	78	25.2 Å²	25.2	36%	0.364	14%	0.143	S	C	.	.	H	α-helix	trans	-56.4	-43.4	173.6	-69.9	172	-178	0	0	111.2	L292 T299 T300 K581 L585	L292-E296 WeakPolarHBondContact O-CG 3.49Å; L292-E296 PolarHBondContact O-N 2.76Å; E296-T299 PolarHBondContact O-N 3.02Å; E296-T300 PolarHBondContact O-N 3.25Å; E296-K581 IonicContact OE1-NZ 3.57Å; E296-K581 PolarHBondContact OE1-NZ 3.36Å; E296-L585 HydrophobicContact CG-CD1 3.76Å
297	H	93	Very high	93.9	Very high	41 Å²	41	27.9 Å²	27.9	19%	0.19	15%	0.15	C	C	.	.	H	α-helix	trans	-63.5	-46.5	173.9	-174.9	49.5	0	0	0	112.7	S293 A294 E295 T299 T300 L301	S293-H297 PolarHBondContact O-N 3.37Å; A294-H297 PolarHBondContact O-N 3.33Å; E295-H297 VanDerWaalsContact C-N 3.29Å; E295-H297 PolarHBondContact O-N 3.29Å; H297-T299 VanDerWaalsContact C-N 3.29Å; H297-T299 PolarHBondContact O-N 2.84Å; H297-T300 PolarHBondContact O-N 3.38Å; H297-T300 PolarHBondContact O-OG1 3.05Å; H297-L301 PolarHBondContact O-N 3.11Å
298	L	94.1	Very high	93.9	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.021	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-32.6	-179.6	-70	165.6	0	0	0	112.6	L171 K175 A294 E295 L301 Q302	L171-L298 HydrophobicContact CB-CD2 4.4Å; L171-L298 HydrophobicContact CD2-CB 4.18Å; L171-L298 HydrophobicContact CD2-CD2 3.46Å; L171-L298 VanDerWaalsContact CD2-CD2 3.46Å; L171-L298 HydrophobicContact CD2-CG 4.43Å; K175-L298 HydrophobicContact CB-CD1 3.74Å; K175-L298 HydrophobicContact CG-CD1 4.33Å; A294-L298 WeakPolarHBondContact O-CB 3.35Å; A294-L298 WeakPolarHBondContact O-CD1 3.45Å; A294-L298 WeakPolarHBondContact O-CG 3.36Å; A294-L298 PolarHBondContact O-N 2.87Å; E295-L298 PolarHBondContact O-N 2.84Å; E295-L298 VanDerWaalsContact O-N 3.13Å; L298-L301 PolarHBondContact O-N 3.3Å; L298-Q302 PolarHBondContact O-N 2.93Å
299	T	93.4	Very high	93.9	Very high	19 Å²	19	30.7 Å²	30.7	12%	0.117	16%	0.16	C	C	.	.	H	α-helix	trans	-64	-50.5	171.6	-62.5	0	0	0	0	111.3	E295 E296 H297 L301 Q302 E303	E295-T299 PolarHBondContact O-N 2.73Å; E295-T299 PolarHBondContact O-OG1 2.76Å; E296-T299 PolarHBondContact O-N 3.02Å; H297-T299 VanDerWaalsContact C-N 3.29Å; H297-T299 PolarHBondContact O-N 2.84Å; T299-L301 VanDerWaalsContact C-N 3.26Å; T299-L301 PolarHBondContact O-N 3.32Å; T299-Q302 WeakPolarHBondContact O-CA 3.44Å; T299-Q302 WeakPolarHBondContact O-CB 3.33Å; T299-Q302 PolarHBondContact O-N 2.79Å; T299-E303 WeakPolarHBondContact O-CG 3.47Å; T299-E303 PolarHBondContact O-N 3.01Å
300	T	93	Very high	93.9	Very high	75 Å²	75	27.7 Å²	27.7	46%	0.46	15%	0.146	S	C	.	.	H	α-helix	trans	-60.8	-33.7	177.1	64.6	0	0	0	0	113.3	E296 H297 A304	E296-T300 PolarHBondContact O-N 3.25Å; H297-T300 PolarHBondContact O-N 3.38Å; H297-T300 PolarHBondContact O-OG1 3.05Å; T300-A304 PolarHBondContact O-N 3.48Å
301	L	93.3	Very high	93.8	Very high	24 Å²	24	30.4 Å²	30.4	13%	0.126	16%	0.158	C	C	.	.	H	α-helix	trans	-67.8	-35.7	172.4	-71.7	-179.3	0	0	0	112.5	L171 H297 L298 T299 D305	L171-L301 HydrophobicContact CD2-CB 3.94Å; L171-L301 HydrophobicContact CD2-CD1 4.37Å; H297-L301 PolarHBondContact O-N 3.11Å; L298-L301 PolarHBondContact O-N 3.3Å; T299-L301 VanDerWaalsContact C-N 3.26Å; T299-L301 PolarHBondContact O-N 3.32Å; L301-D305 VanDerWaalsContact O-CB 3.31Å; L301-D305 WeakPolarHBondContact O-CB 3.4Å; L301-D305 PolarHBondContact O-N 3.25Å; L301-D305 VanDerWaalsContact O-N 3.08Å
302	Q	94.5	Very high	93.8	Very high	5 Å²	5	31.2 Å²	31.2	2%	0.023	16%	0.161	C	C	.	.	H	α-helix	trans	-67.6	-44.9	177.5	-162.3	-170.7	61.1	0	0	111.4	L171 L298 T299 A304 D305 L306 R589 V593	L171-Q302 HydrophobicContact CD1-CB 3.58Å; L171-Q302 HydrophobicContact CD1-CG 3.67Å; L298-Q302 PolarHBondContact O-N 2.93Å; T299-Q302 WeakPolarHBondContact O-CA 3.44Å; T299-Q302 WeakPolarHBondContact O-CB 3.33Å; T299-Q302 PolarHBondContact O-N 2.79Å; Q302-A304 PolarHBondContact O-N 2.88Å; Q302-D305 CarbonylContact O-C 3.58Å; Q302-D305 WeakPolarHBondContact O-CA 3.45Å; Q302-D305 WeakPolarHBondContact O-CB 3.47Å; Q302-D305 PolarHBondContact O-N 3.03Å; Q302-L306 WeakPolarHBondContact O-CG 3.35Å; Q302-L306 PolarHBondContact O-N 2.9Å; Q302-R589 HydrophobicContact CB-CG 4.47Å; Q302-R589 PolarHBondContact NE2-O 3.08Å; Q302-R589 PolarHBondContact OE1-O 3.19Å; Q302-V593 VanDerWaalsContact CD-CG2 3.48Å; Q302-V593 HydrophobicContact CG-CG2 4.19Å
303	E	92.8	Very high	93.8	Very high	64 Å²	64	31 Å²	31	30%	0.299	16%	0.16	S	C	.	.	H	α-helix	trans	-59.6	-45.4	177.9	-64.9	170.5	168.7	0	0	111.8	T299 D305 L306 K307 Q543	T299-E303 WeakPolarHBondContact O-CG 3.47Å; T299-E303 PolarHBondContact O-N 3.01Å; E303-D305 VanDerWaalsContact C-N 3.26Å; E303-D305 PolarHBondContact O-N 3.43Å; E303-L306 PolarHBondContact O-N 3.37Å; E303-K307 WeakPolarHBondContact O-CB 3.36Å; E303-K307 PolarHBondContact O-N 3.24Å; E303-Q543 PolarHBondContact OE1-NE2 2.73Å
304	A	92.5	Very high	93.7	Very high	50 Å²	50	30.1 Å²	30.1	41%	0.413	15%	0.153	S	C	.	.	H	α-helix	trans	-64.4	-30.7	174.8	0	0	0	0	0	112.9	T300 Q302 R308	T300-A304 PolarHBondContact O-N 3.48Å; Q302-A304 PolarHBondContact O-N 2.88Å; A304-R308 WeakPolarHBondContact O-CB 3.46Å; A304-R308 PolarHBondContact O-N 3.41Å; A304-R308 VanDerWaalsContact O-N 3.15Å
305	D	93.2	Very high	93.7	Very high	4 Å²	4	31 Å²	31	2%	0.021	16%	0.155	C	C	.	.	H	α-helix	trans	-76.6	-41	176	-92.2	20.4	0	0	0	112.3	R167 L301 Q302 E303 R308 T309 R439	R167-D305 WeakPolarHBondContact CD-OD2 3.49Å; R167-D305 IonicContact CZ-OD2 3.45Å; R167-D305 IonicContact NH1-OD1 2.99Å; R167-D305 PolarHBondContact NH1-OD1 3.17Å; R167-D305 IonicContact NH1-OD2 3.4Å; R167-D305 PolarHBondContact NH1-OD2 2.97Å; L301-D305 VanDerWaalsContact O-CB 3.31Å; L301-D305 WeakPolarHBondContact O-CB 3.4Å; L301-D305 PolarHBondContact O-N 3.25Å; L301-D305 VanDerWaalsContact O-N 3.08Å; Q302-D305 CarbonylContact O-C 3.58Å; Q302-D305 WeakPolarHBondContact O-CA 3.45Å; Q302-D305 WeakPolarHBondContact O-CB 3.47Å; Q302-D305 PolarHBondContact O-N 3.03Å; E303-D305 VanDerWaalsContact C-N 3.26Å; E303-D305 PolarHBondContact O-N 3.43Å; D305-R308 PolarHBondContact O-N 3.49Å; D305-R308 IonicContact OD1-CZ 2.77Å; D305-R308 IonicContact OD1-NH1 3.1Å; D305-R308 PolarHBondContact OD1-NH1 2.77Å; D305-R308 IonicContact OD1-NH2 2.7Å; D305-R308 PolarHBondContact OD1-NH2 3.39Å; D305-T309 PolarHBondContact O-N 3.08Å; D305-T309 PolarHBondContact O-OG1 3.06Å; D305-T309 VanDerWaalsContact O-OG1 3.08Å; D305-R439 IonicContact OD2-CZ 3.44Å; D305-R439 IonicContact OD2-NH1 3.39Å; D305-R439 PolarHBondContact OD2-NH1 2.67Å
306	L	94.8	Very high	93.6	Very high	7 Å²	7	31 Å²	31	4%	0.037	16%	0.155	C	C	.	.	H	α-helix	trans	-59.7	-49.3	172	-69.6	179.7	0	0	0	111.1	V164 Q302 E303 R308 T309 L310 T592 V593 F596	V164-L306 HydrophobicContact CB-CD2 4.2Å; V164-L306 HydrophobicContact CG1-CD2 3.46Å; V164-L306 VanDerWaalsContact CG1-CD2 3.46Å; V164-L306 HydrophobicContact CG2-CD2 3.64Å; Q302-L306 WeakPolarHBondContact O-CG 3.35Å; Q302-L306 PolarHBondContact O-N 2.9Å; E303-L306 PolarHBondContact O-N 3.37Å; L306-R308 VanDerWaalsContact C-N 3.35Å; L306-R308 PolarHBondContact O-N 2.91Å; L306-T309 PolarHBondContact O-N 3.18Å; L306-T309 VanDerWaalsContact O-N 3.12Å; L306-L310 PolarHBondContact O-N 3.08Å; L306-T592 HydrophobicContact CD1-CG2 3.79Å; L306-V593 HydrophobicContact CD2-CG2 4.4Å; L306-F596 HydrophobicContact CB-CD2 4.23Å; L306-F596 HydrophobicContact CB-CE2 4.23Å; L306-F596 HydrophobicContact CD1-CB 4.19Å; L306-F596 HydrophobicContact CD1-CD2 4.49Å; L306-F596 HydrophobicContact CD1-CG 4.37Å; L306-F596 HydrophobicContact CD2-CB 4.19Å; L306-F596 HydrophobicContact CD2-CD1 3.76Å; L306-F596 HydrophobicContact CD2-CD2 4.33Å; L306-F596 HydrophobicContact CD2-CE1 4.13Å; L306-F596 HydrophobicContact CD2-CG 3.85Å; L306-F596 HydrophobicContact CG-CG 4.5Å
307	K	93.3	Very high	93.5	Very high	95 Å²	95	27.9 Å²	27.9	41%	0.413	14%	0.141	S	C	.	.	H	α-helix	trans	-58.5	-44.5	177	177.3	167.5	176.1	165	0	112	E303 T309 L310 E311	E303-K307 WeakPolarHBondContact O-CB 3.36Å; E303-K307 PolarHBondContact O-N 3.24Å; K307-T309 VanDerWaalsContact C-N 3.31Å; K307-T309 PolarHBondContact O-N 2.89Å; K307-L310 PolarHBondContact O-N 3.37Å; K307-E311 WeakPolarHBondContact CE-OE1 3.34Å; K307-E311 HydrophobicContact CG-CG 4.47Å; K307-E311 WeakPolarHBondContact O-CG 3.41Å; K307-E311 PolarHBondContact O-N 3Å
308	R	92.8	Very high	93.3	Very high	67 Å²	67	27 Å²	27	25%	0.253	14%	0.137	S	C	.	.	H	α-helix	trans	-65.2	-35	176.8	-161.8	-174.6	-45.5	98.4	8.8	112	A304 D305 L306 R312	A304-R308 WeakPolarHBondContact O-CB 3.46Å; A304-R308 PolarHBondContact O-N 3.41Å; A304-R308 VanDerWaalsContact O-N 3.15Å; D305-R308 PolarHBondContact O-N 3.49Å; D305-R308 IonicContact OD1-CZ 2.77Å; D305-R308 IonicContact OD1-NH1 3.1Å; D305-R308 PolarHBondContact OD1-NH1 2.77Å; D305-R308 IonicContact OD1-NH2 2.7Å; D305-R308 PolarHBondContact OD1-NH2 3.39Å; L306-R308 VanDerWaalsContact C-N 3.35Å; L306-R308 PolarHBondContact O-N 2.91Å; R308-R312 WeakPolarHBondContact O-CB 3.43Å; R308-R312 PolarHBondContact O-N 3.47Å
309	T	94.5	Very high	93.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-68.1	-37.2	175	-62.1	0	0	0	0	111.7	A160 E163 V164 D305 L306 K307 L313	A160-T309 HydrophobicContact CB-CG2 3.9Å; E163-T309 HydrophobicContact CB-CG2 4.4Å; E163-T309 HydrophobicContact CG-CG2 4.5Å; V164-T309 HydrophobicContact CG2-CG2 3.94Å; D305-T309 PolarHBondContact O-N 3.08Å; D305-T309 PolarHBondContact O-OG1 3.06Å; D305-T309 VanDerWaalsContact O-OG1 3.08Å; L306-T309 PolarHBondContact O-N 3.18Å; L306-T309 VanDerWaalsContact O-N 3.12Å; K307-T309 VanDerWaalsContact C-N 3.31Å; K307-T309 PolarHBondContact O-N 2.89Å; T309-L313 VanDerWaalsContact O-CB 3.23Å; T309-L313 WeakPolarHBondContact O-CB 3.46Å; T309-L313 PolarHBondContact O-N 2.87Å
310	L	94.8	Very high	92.8	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-65.2	-48.6	171.1	177.8	62.5	0	0	0	112.6	L306 K307 R312 L313 L314 Q532 W535 M539 F596	L306-L310 PolarHBondContact O-N 3.08Å; K307-L310 PolarHBondContact O-N 3.37Å; L310-R312 PolarHBondContact O-N 3.41Å; L310-L313 HydrophobicContact CD1-CD2 4.23Å; L310-L313 WeakPolarHBondContact O-CB 3.37Å; L310-L313 PolarHBondContact O-N 3.34Å; L310-L314 HydrophobicContact CD1-CD1 3.83Å; L310-L314 HydrophobicContact CD1-CG 4.06Å; L310-L314 HydrophobicContact CG-CD1 4.05Å; L310-L314 WeakPolarHBondContact O-CG 3.45Å; L310-L314 PolarHBondContact O-N 3.16Å; L310-L314 VanDerWaalsContact O-N 3.07Å; L310-Q532 HydrophobicContact CD2-CG 4.39Å; L310-W535 HydrophobicContact CD1-CB 4.43Å; L310-W535 HydrophobicContact CD1-CD2 3.79Å; L310-W535 HydrophobicContact CD1-CE3 3.66Å; L310-W535 HydrophobicContact CD1-CG 4.2Å; L310-W535 HydrophobicContact CD1-CZ3 4.13Å; L310-W535 HydrophobicContact CD2-CB 3.68Å; L310-W535 HydrophobicContact CD2-CD2 4.39Å; L310-W535 HydrophobicContact CD2-CE3 4.12Å; L310-W535 HydrophobicContact CD2-CG 4.3Å; L310-W535 HydrophobicContact CG-CE3 4.45Å; L310-M539 HydrophobicContact CD2-CE 3.86Å; L310-F596 HydrophobicContact CB-CE2 4.17Å; L310-F596 HydrophobicContact CB-CZ 4.14Å
311	E	93.2	Very high	92.4	Very high	61 Å²	61	24.4 Å²	24.4	29%	0.285	12%	0.123	S	C	.	.	H	α-helix	trans	-56.5	-41	175.7	-74	168.8	175.2	0	0	111.6	K307 W315	K307-E311 WeakPolarHBondContact CE-OE1 3.34Å; K307-E311 HydrophobicContact CG-CG 4.47Å; K307-E311 WeakPolarHBondContact O-CG 3.41Å; K307-E311 PolarHBondContact O-N 3Å; E311-W315 WeakPolarHBondContact O-CB 3.39Å; E311-W315 PolarHBondContact O-N 3.43Å
312	R	94.2	Very high	92	Very high	18 Å²	18	25.8 Å²	25.8	7%	0.068	13%	0.13	C	C	.	.	H	α-helix	trans	-71.6	-41.5	178.2	-172.5	172.7	-175	-125.6	-14.4	112.6	Y141 E163 R308 L310 W316 K396 D450	Y141-R312 HydrophobicContact CE1-CG 4.38Å; E163-R312 IonicContact OE1-NH1 2.72Å; E163-R312 PolarHBondContact OE1-NH1 3.03Å; E163-R312 IonicContact OE2-CZ 2.64Å; E163-R312 IonicContact OE2-NH1 3.19Å; E163-R312 PolarHBondContact OE2-NH1 3.33Å; R308-R312 WeakPolarHBondContact O-CB 3.43Å; R308-R312 PolarHBondContact O-N 3.47Å; L310-R312 PolarHBondContact O-N 3.41Å; R312-W316 PolarHBondContact O-N 3.35Å; R312-W316 VanDerWaalsContact O-N 3.15Å; R312-K396 VanDerWaalsContact NH2-NZ 3.1Å; R312-D450 IonicContact CZ-OD2 2.73Å; R312-D450 IonicContact NE-OD2 2.77Å; R312-D450 PolarHBondContact NE-OD2 3.21Å; R312-D450 IonicContact NH2-OD1 2.67Å; R312-D450 PolarHBondContact NH2-OD1 3.25Å; R312-D450 IonicContact NH2-OD2 3.14Å; R312-D450 PolarHBondContact NH2-OD2 2.9Å
313	L	94.8	Very high	91.5	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-55.1	-57.8	175	172.9	81	0	0	0	110.7	L156 Y157 A160 T309 L310 W315 W316 E317 M600	L156-L313 HydrophobicContact CD1-CD1 4.09Å; L156-L313 HydrophobicContact CG-CD1 3.76Å; Y157-L313 HydrophobicContact CD1-CD1 4.12Å; Y157-L313 HydrophobicContact CD1-CD2 3.94Å; Y157-L313 HydrophobicContact CE1-CD1 4.42Å; Y157-L313 HydrophobicContact CE1-CD2 3.69Å; Y157-L313 HydrophobicContact CG-CD1 4.27Å; A160-L313 HydrophobicContact CB-CB 4.35Å; A160-L313 HydrophobicContact CB-CD1 3.66Å; A160-L313 HydrophobicContact CB-CG 4.49Å; T309-L313 VanDerWaalsContact O-CB 3.23Å; T309-L313 WeakPolarHBondContact O-CB 3.46Å; T309-L313 PolarHBondContact O-N 2.87Å; L310-L313 HydrophobicContact CD1-CD2 4.23Å; L310-L313 WeakPolarHBondContact O-CB 3.37Å; L310-L313 PolarHBondContact O-N 3.34Å; L313-W315 VanDerWaalsContact C-N 3.29Å; L313-W315 PolarHBondContact O-N 2.96Å; L313-W316 PolarHBondContact O-N 3Å; L313-W316 VanDerWaalsContact O-N 3.11Å; L313-E317 PolarHBondContact O-N 2.87Å; L313-M600 HydrophobicContact CD2-CE 4.12Å
314	L	93.2	Very high	90.9	Very high	15 Å²	15	25.2 Å²	25.2	8%	0.079	13%	0.129	C	C	.	.	H	α-helix	trans	-63.8	-33.6	-175.5	-63.6	170.1	0	0	0	112.2	L310 E317 E318 L528 Q532	L310-L314 HydrophobicContact CD1-CD1 3.83Å; L310-L314 HydrophobicContact CD1-CG 4.06Å; L310-L314 HydrophobicContact CG-CD1 4.05Å; L310-L314 WeakPolarHBondContact O-CG 3.45Å; L310-L314 PolarHBondContact O-N 3.16Å; L310-L314 VanDerWaalsContact O-N 3.07Å; L314-E317 WeakPolarHBondContact O-CB 3.43Å; L314-E317 PolarHBondContact O-N 2.95Å; L314-E318 PolarHBondContact O-N 3.35Å; L314-L528 HydrophobicContact CD2-CD2 3.88Å; L314-Q532 HydrophobicContact CD1-CB 3.61Å; L314-Q532 HydrophobicContact CD1-CG 3.83Å
315	W	92.8	Very high	90.4	Very high	22 Å²	22	22.9 Å²	22.9	8%	0.083	11%	0.109	C	C	.	.	H	α-helix	trans	-69.1	-35.4	174.5	178	68.7	0	0	0	113.5	Y11 E311 L313 E317 L319 D450 A454	Y11-W315 HydrophobicContact CD1-CB 3.99Å; Y11-W315 AromaticContact CD1-CD1 3.87Å; Y11-W315 AromaticContact CD1-CD2 3.54Å; Y11-W315 HydrophobicContact CD1-CD2 3.54Å; Y11-W315 AromaticContact CD1-CE2 3.92Å; Y11-W315 HydrophobicContact CD1-CE3 4.07Å; Y11-W315 AromaticContact CD1-CG 3.49Å; Y11-W315 HydrophobicContact CD1-CG 3.49Å; Y11-W315 VanDerWaalsContact CD1-CG 3.49Å; Y11-W315 HydrophobicContact CE1-CB 4.35Å; Y11-W315 AromaticContact CE1-CD2 3.71Å; Y11-W315 HydrophobicContact CE1-CD2 3.71Å; Y11-W315 AromaticContact CE1-CE3 3.72Å; Y11-W315 HydrophobicContact CE1-CE3 3.72Å; Y11-W315 HydrophobicContact CE1-CG 4Å; Y11-W315 HydrophobicContact CE1-CZ3 4.29Å; Y11-W315 HydrophobicContact CG-CG 4.29Å; E311-W315 WeakPolarHBondContact O-CB 3.39Å; E311-W315 PolarHBondContact O-N 3.43Å; L313-W315 VanDerWaalsContact C-N 3.29Å; L313-W315 PolarHBondContact O-N 2.96Å; W315-E317 VanDerWaalsContact C-N 3.31Å; W315-L319 WeakPolarHBondContact O-CB 3.42Å; W315-L319 PolarHBondContact O-N 2.97Å; W315-D450 HydrophobicContact CH2-CB 4.26Å; W315-D450 HydrophobicContact CZ3-CB 3.94Å; W315-A454 HydrophobicContact CH2-CB 3.62Å; W315-A454 HydrophobicContact CZ2-CB 3.68Å
316	W	94	Very high	90	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-72.3	-25.8	170.5	-78.3	106.1	0	0	0	112.1	Y141 P142 L145 L156 R312 L313 L319 S320 D450 I453	Y141-W316 HydrophobicContact CD1-CB 4.02Å; Y141-W316 AromaticContact CD1-CD1 3.24Å; Y141-W316 HydrophobicContact CD1-CD2 4.45Å; Y141-W316 AromaticContact CD1-CG 3.66Å; Y141-W316 HydrophobicContact CD1-CG 3.66Å; Y141-W316 AromaticContact CD1-NE1 3.87Å; Y141-W316 AromaticContact CE1-CD1 4Å; Y141-W316 AromaticContact CG-CD1 3.66Å; Y141-W316 HydrophobicContact CG-CD2 4.48Å; Y141-W316 HydrophobicContact CG-CG 4.12Å; Y141-W316 AromaticContact CG-NE1 3.79Å; P142-W316 HydrophobicContact CB-CH2 4.03Å; P142-W316 HydrophobicContact CB-CZ3 4.12Å; P142-W316 HydrophobicContact CG-CH2 3.57Å; P142-W316 HydrophobicContact CG-CZ2 4.03Å; P142-W316 HydrophobicContact CG-CZ3 4.11Å; L145-W316 HydrophobicContact CD1-CE3 3.99Å; L145-W316 HydrophobicContact CD1-CZ3 3.68Å; L145-W316 HydrophobicContact CG-CE3 4.45Å; L156-W316 HydrophobicContact CD1-CB 3.74Å; L156-W316 HydrophobicContact CD2-CB 4.29Å; R312-W316 PolarHBondContact O-N 3.35Å; R312-W316 VanDerWaalsContact O-N 3.15Å; L313-W316 PolarHBondContact O-N 3Å; L313-W316 VanDerWaalsContact O-N 3.11Å; W316-L319 HydrophobicContact CE3-CD2 3.76Å; W316-L319 HydrophobicContact CH2-CD2 4.27Å; W316-L319 HydrophobicContact CZ3-CD2 3.55Å; W316-S320 WeakPolarHBondContact O-CB 3.18Å; W316-S320 PolarHBondContact O-N 2.91Å; W316-D450 HydrophobicContact CZ2-CB 3.94Å; W316-D450 PolarHBondContact NE1-OD2 3.27Å; W316-I453 HydrophobicContact CH2-CB 4.39Å; W316-I453 HydrophobicContact CH2-CG2 3.99Å
317	E	90.6	Very high	89.4	Confident	13 Å²	13	25 Å²	25	6%	0.061	12%	0.121	C	C	.	.	H	α-helix	trans	-70.2	-47.5	171.8	-163.6	172.1	157	0	0	111.6	R153 L156 Y157 L313 L314 W315 L319 S320 G321 L528	R153-E317 IonicContact CZ-OE1 3.07Å; R153-E317 IonicContact NH1-OE1 3.44Å; R153-E317 PolarHBondContact NH1-OE1 3.43Å; R153-E317 IonicContact NH2-OE1 3.04Å; R153-E317 PolarHBondContact NH2-OE1 2.93Å; R153-E317 IonicContact NH2-OE2 3.63Å; L156-E317 HydrophobicContact CD2-CB 3.88Å; L156-E317 HydrophobicContact CD2-CG 4.43Å; Y157-E317 PolarHBondContact OH-OE2 2.89Å; L313-E317 PolarHBondContact O-N 2.87Å; L314-E317 WeakPolarHBondContact O-CB 3.43Å; L314-E317 PolarHBondContact O-N 2.95Å; W315-E317 VanDerWaalsContact C-N 3.31Å; E317-L319 VanDerWaalsContact C-N 3.32Å; E317-L319 PolarHBondContact O-N 3.5Å; E317-S320 WeakPolarHBondContact O-CA 3.48Å; E317-S320 WeakPolarHBondContact O-CB 3.5Å; E317-S320 PolarHBondContact O-N 3.37Å; E317-S320 PolarHBondContact O-OG 3.03Å; E317-G321 PolarHBondContact O-N 2.89Å; E317-G321 VanDerWaalsContact O-N 3.11Å; E317-L528 HydrophobicContact CB-CD1 4.36Å; E317-L528 HydrophobicContact CB-CD2 4.41Å; E317-L528 HydrophobicContact CG-CD1 4.47Å; E317-L528 HydrophobicContact CG-CD2 4.1Å; E317-L528 WeakPolarHBondContact OE1-CD2 3.32Å
318	E	89.1	Confident	88.9	Confident	23 Å²	23	20.9 Å²	20.9	11%	0.107	10%	0.104	C	C	.	.	H	α-helix	trans	-52.5	-48.9	170.7	-178.9	-170.7	-160.9	0	0	110.9	A13 L314 S320 G321 L322 R525 L528	A13-E318 WeakPolarHBondContact CB-OE1 3.15Å; L314-E318 PolarHBondContact O-N 3.35Å; E318-S320 VanDerWaalsContact C-N 3.25Å; E318-S320 PolarHBondContact O-N 3.44Å; E318-G321 PolarHBondContact O-N 3.27Å; E318-G321 VanDerWaalsContact O-N 3.16Å; E318-L322 PolarHBondContact O-N 3.11Å; E318-R525 IonicContact OE1-CZ 3.08Å; E318-R525 IonicContact OE1-NE 3.54Å; E318-R525 PolarHBondContact OE1-NE 3.39Å; E318-R525 IonicContact OE1-NH2 3.59Å; E318-R525 PolarHBondContact OE1-NH2 3.42Å; E318-L528 HydrophobicContact CB-CD1 4.11Å
319	L	90	Very high	88.5	Confident	9 Å²	9	18.1 Å²	18.1	5%	0.047	9%	0.094	C	C	.	.	H	α-helix	trans	-65.3	-27.9	178	-175.2	57.5	0	0	0	112.8	L145 W315 W316 E317 L322 V323 A454	L145-L319 HydrophobicContact CD1-CD2 4.11Å; L145-L319 HydrophobicContact CD1-CG 4.16Å; W315-L319 WeakPolarHBondContact O-CB 3.42Å; W315-L319 PolarHBondContact O-N 2.97Å; W316-L319 HydrophobicContact CE3-CD2 3.76Å; W316-L319 HydrophobicContact CH2-CD2 4.27Å; W316-L319 HydrophobicContact CZ3-CD2 3.55Å; E317-L319 VanDerWaalsContact C-N 3.32Å; E317-L319 PolarHBondContact O-N 3.5Å; L319-L322 HydrophobicContact CD1-CB 4.48Å; L319-L322 HydrophobicContact CD1-CD2 4.07Å; L319-L322 PolarHBondContact O-N 2.94Å; L319-V323 WeakPolarHBondContact O-CB 3.49Å; L319-V323 WeakPolarHBondContact O-CG2 3.33Å; L319-V323 PolarHBondContact O-N 3.18Å; L319-A454 HydrophobicContact CD2-CB 3.64Å
320	S	87.8	Confident	88.2	Confident	27 Å²	27	18.3 Å²	18.3	19%	0.189	10%	0.095	C	C	.	.	H	α-helix	trans	-69.8	-35.9	173.5	86.3	0	0	0	0	112.5	L145 W316 E317 E318 Q324	L145-S320 VanDerWaalsContact CD2-CA 3.44Å; W316-S320 WeakPolarHBondContact O-CB 3.18Å; W316-S320 PolarHBondContact O-N 2.91Å; E317-S320 WeakPolarHBondContact O-CA 3.48Å; E317-S320 WeakPolarHBondContact O-CB 3.5Å; E317-S320 PolarHBondContact O-N 3.37Å; E317-S320 PolarHBondContact O-OG 3.03Å; E318-S320 VanDerWaalsContact C-N 3.25Å; E318-S320 PolarHBondContact O-N 3.44Å; S320-Q324 WeakPolarHBondContact O-CB 3.2Å; S320-Q324 VanDerWaalsContact O-CG 3.29Å; S320-Q324 WeakPolarHBondContact O-CG 3.42Å; S320-Q324 PolarHBondContact O-N 3.25Å; S320-Q324 PolarHBondContact O-NE2 2.87Å
321	G	83.9	Confident	87.9	Confident	8 Å²	8	22.6 Å²	22.6	8%	0.082	11%	0.111	C	C	.	.	H	α-helix	trans	-64	-47.9	170.2	0	0	0	0	0	111.2	E317 E318 V323 Q324 S325 F617	E317-G321 PolarHBondContact O-N 2.89Å; E317-G321 VanDerWaalsContact O-N 3.11Å; E318-G321 PolarHBondContact O-N 3.27Å; E318-G321 VanDerWaalsContact O-N 3.16Å; G321-V323 VanDerWaalsContact C-N 3.32Å; G321-V323 PolarHBondContact O-N 3.15Å; G321-Q324 PolarHBondContact O-N 3.33Å; G321-Q324 VanDerWaalsContact O-N 3.16Å; G321-S325 PolarHBondContact O-N 2.96Å; G321-F617 WeakPolarHBondContact O-CE2 3.3Å
322	L	85.3	Confident	87.6	Confident	52 Å²	52	21.5 Å²	21.5	27%	0.272	11%	0.105	S	C	.	.	H	α-helix	trans	-58.4	-42.2	176.9	179.9	61.5	0	0	0	112.1	E318 L319 S325 L521	E318-L322 PolarHBondContact O-N 3.11Å; L319-L322 HydrophobicContact CD1-CB 4.48Å; L319-L322 HydrophobicContact CD1-CD2 4.07Å; L319-L322 PolarHBondContact O-N 2.94Å; L322-S325 PolarHBondContact O-OG 2.72Å; L322-L521 HydrophobicContact CB-CD2 4.29Å; L322-L521 HydrophobicContact CD1-CD1 3.81Å
323	V	83.9	Confident	87.4	Confident	10 Å²	10	20.6 Å²	20.6	6%	0.061	10%	0.101	C	C	.	.	H	α-helix	trans	-67.1	-41.7	175.8	166.7	0	0	0	0	111.9	L145 L319 G321 S325 Q326 P327 W461	L145-V323 HydrophobicContact CD1-CG2 4.34Å; L145-V323 HydrophobicContact CD2-CG2 4.38Å; L319-V323 WeakPolarHBondContact O-CB 3.49Å; L319-V323 WeakPolarHBondContact O-CG2 3.33Å; L319-V323 PolarHBondContact O-N 3.18Å; G321-V323 VanDerWaalsContact C-N 3.32Å; G321-V323 PolarHBondContact O-N 3.15Å; V323-S325 VanDerWaalsContact C-N 3.32Å; V323-S325 PolarHBondContact O-N 2.99Å; V323-Q326 PolarHBondContact O-N 3.03Å; V323-P327 WeakPolarHBondContact O-CD 3.48Å; V323-W461 HydrophobicContact CG1-CZ2 3.92Å
324	Q	80.7	Confident	87.1	Confident	48 Å²	48	21.2 Å²	21.2	22%	0.224	11%	0.105	C	C	.	.	H	α-helix	trans	-70.2	-24.8	-179.6	-74.6	172.4	100.2	0	0	113.6	G149 S320 G321 Q326	G149-Q324 VanDerWaalsContact N-OE1 3.17Å; S320-Q324 WeakPolarHBondContact O-CB 3.2Å; S320-Q324 VanDerWaalsContact O-CG 3.29Å; S320-Q324 WeakPolarHBondContact O-CG 3.42Å; S320-Q324 PolarHBondContact O-N 3.25Å; S320-Q324 PolarHBondContact O-NE2 2.87Å; G321-Q324 PolarHBondContact O-N 3.33Å; G321-Q324 VanDerWaalsContact O-N 3.16Å; Q324-Q326 VanDerWaalsContact C-N 3.29Å; Q324-Q326 PolarHBondContact O-N 3.01Å
325	S	80.8	Confident	87	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.007	12%	0.118	C	C	.	.	H	α-helix	trans	-60.4	-34.7	172.3	77	0	0	0	0	113.3	G321 L322 V323 A328 L329	G321-S325 PolarHBondContact O-N 2.96Å; L322-S325 PolarHBondContact O-OG 2.72Å; V323-S325 VanDerWaalsContact C-N 3.32Å; V323-S325 PolarHBondContact O-N 2.99Å; S325-A328 WeakPolarHBondContact O-CB 3.22Å; S325-A328 PolarHBondContact O-N 3.07Å; S325-A328 VanDerWaalsContact O-N 3.16Å; S325-L329 WeakPolarHBondContact O-CG 3.13Å; S325-L329 PolarHBondContact O-N 3.01Å
326	Q	84.9	Confident	86.8	Confident	34 Å²	34	22.6 Å²	22.6	16%	0.159	12%	0.116	C	C	.	.	H	α-helix	trans	-72.6	-43.9	-168.3	-56.4	-66.2	-73.8	0	0	112.9	V323 Q324 A328 L330 W461	V323-Q326 PolarHBondContact O-N 3.03Å; Q324-Q326 VanDerWaalsContact C-N 3.29Å; Q324-Q326 PolarHBondContact O-N 3.01Å; Q326-A328 VanDerWaalsContact C-N 3.31Å; Q326-A328 PolarHBondContact O-N 2.98Å; Q326-L330 PolarHBondContact O-N 2.89Å; Q326-W461 HydrophobicContact CB-CD2 4.2Å; Q326-W461 HydrophobicContact CB-CE3 3.59Å; Q326-W461 HydrophobicContact CB-CZ3 4.08Å; Q326-W461 HydrophobicContact CG-CB 4.25Å; Q326-W461 HydrophobicContact CG-CE3 4.35Å
327	P	83.4	Confident	86.6	Confident	22 Å²	22	22.7 Å²	22.7	14%	0.143	12%	0.117	C	C	.	.	H	α-helix	trans	-62.8	-33.1	166.2	-24.7	35.1	0	0	0	113.6	V323 L330 R331 W461	V323-P327 WeakPolarHBondContact O-CD 3.48Å; P327-L330 WeakPolarHBondContact O-CB 3.47Å; P327-L330 PolarHBondContact O-N 3.48Å; P327-R331 WeakPolarHBondContact O-CG 3.37Å; P327-R331 PolarHBondContact O-N 3.14Å; P327-R331 VanDerWaalsContact O-N 3.14Å; P327-W461 HydrophobicContact CG-CH2 3.62Å; P327-W461 HydrophobicContact CG-CZ3 3.77Å
328	A	83	Confident	86.6	Confident	7 Å²	7	23.4 Å²	23.4	6%	0.058	12%	0.12	C	C	.	.	H	α-helix	trans	-67.1	-46.7	-178.8	0	0	0	0	0	111.9	S325 Q326 L330 R331 W332 F617	S325-A328 WeakPolarHBondContact O-CB 3.22Å; S325-A328 PolarHBondContact O-N 3.07Å; S325-A328 VanDerWaalsContact O-N 3.16Å; Q326-A328 VanDerWaalsContact C-N 3.31Å; Q326-A328 PolarHBondContact O-N 2.98Å; A328-L330 VanDerWaalsContact C-N 3.27Å; A328-L330 PolarHBondContact O-N 3.44Å; A328-R331 PolarHBondContact O-N 3.02Å; A328-W332 PolarHBondContact O-N 3.09Å; A328-F617 HydrophobicContact CB-CB 3.37Å; A328-F617 HydrophobicContact CB-CG 4.17Å
329	L	84.7	Confident	86.6	Confident	10 Å²	10	23.7 Å²	23.7	5%	0.052	13%	0.129	C	C	.	.	H	α-helix	trans	-59.7	-35.3	173.2	-70.2	167.5	0	0	0	112.4	S325 W332 E333 R465 A513 E514 A517	S325-L329 WeakPolarHBondContact O-CG 3.13Å; S325-L329 PolarHBondContact O-N 3.01Å; L329-W332 PolarHBondContact O-N 3.25Å; L329-E333 WeakPolarHBondContact O-CB 3.35Å; L329-E333 PolarHBondContact O-N 2.8Å; L329-R465 PolarHBondContact O-NH2 3.39Å; L329-A513 HydrophobicContact CD2-CB 4.38Å; L329-E514 HydrophobicContact CD1-CG 4.46Å; L329-A517 HydrophobicContact CD1-CB 4.38Å; L329-A517 HydrophobicContact CD2-CB 4.09Å; L329-A517 HydrophobicContact CG-CB 4.49Å
330	L	87.9	Confident	86.6	Confident	3 Å²	3	24.3 Å²	24.3	2%	0.016	13%	0.132	C	C	.	.	H	α-helix	trans	-62.9	-38.4	171.8	-88.7	162.8	0	0	0	113.1	Q326 P327 A328 V334 L374 R465 W468 L472	Q326-L330 PolarHBondContact O-N 2.89Å; P327-L330 WeakPolarHBondContact O-CB 3.47Å; P327-L330 PolarHBondContact O-N 3.48Å; A328-L330 VanDerWaalsContact C-N 3.27Å; A328-L330 PolarHBondContact O-N 3.44Å; L330-V334 WeakPolarHBondContact O-CG2 3.4Å; L330-V334 PolarHBondContact O-N 3.31Å; L330-L374 HydrophobicContact CB-CD1 4.02Å; L330-R465 VanDerWaalsContact CD2-NH1 3.28Å; L330-W468 HydrophobicContact CD1-CB 4.44Å; L330-W468 HydrophobicContact CD2-CB 3.84Å; L330-L472 HydrophobicContact CD2-CD1 3.94Å
331	R	88.1	Confident	86.7	Confident	92 Å²	92	23 Å²	23	35%	0.347	12%	0.123	S	C	.	.	H	α-helix	trans	-70.3	-42.6	175.8	-38	-157.9	-171.5	82.5	6	111	P327 A328 E333 V334 T335 L374	P327-R331 WeakPolarHBondContact O-CG 3.37Å; P327-R331 PolarHBondContact O-N 3.14Å; P327-R331 VanDerWaalsContact O-N 3.14Å; A328-R331 PolarHBondContact O-N 3.02Å; R331-E333 PolarHBondContact O-N 2.93Å; R331-V334 WeakPolarHBondContact O-CB 3.36Å; R331-V334 PolarHBondContact O-N 3.27Å; R331-V334 VanDerWaalsContact O-N 3.13Å; R331-T335 PolarHBondContact O-N 3.3Å; R331-T335 PolarHBondContact O-OG1 2.96Å; R331-L374 HydrophobicContact CB-CD2 4.04Å; R331-L374 HydrophobicContact CG-CD1 4.28Å; R331-L374 HydrophobicContact CG-CD2 4.02Å
332	W	85.9	Confident	87	Confident	37 Å²	37	23.7 Å²	23.7	14%	0.14	13%	0.128	C	C	.	.	H	α-helix	trans	-62.4	-43	-178.6	-162.9	81.5	0	0	0	111.8	A328 L329 V334 T335 L336 E509 L510 A513 L620 L621	A328-W332 PolarHBondContact O-N 3.09Å; L329-W332 PolarHBondContact O-N 3.25Å; W332-V334 VanDerWaalsContact C-N 3.31Å; W332-V334 PolarHBondContact O-N 3.41Å; W332-T335 PolarHBondContact O-N 2.89Å; W332-L336 HydrophobicContact CD2-CD1 4.36Å; W332-L336 HydrophobicContact CD2-CG 4.16Å; W332-L336 HydrophobicContact CE3-CD1 3.64Å; W332-L336 HydrophobicContact CE3-CG 3.89Å; W332-L336 HydrophobicContact CH2-CD1 3.38Å; W332-L336 HydrophobicContact CH2-CD2 4.09Å; W332-L336 HydrophobicContact CH2-CG 3.97Å; W332-L336 HydrophobicContact CZ2-CD1 4.11Å; W332-L336 HydrophobicContact CZ2-CD2 4Å; W332-L336 HydrophobicContact CZ2-CG 4.21Å; W332-L336 HydrophobicContact CZ3-CD1 3.09Å; W332-L336 HydrophobicContact CZ3-CD2 4.42Å; W332-L336 HydrophobicContact CZ3-CG 3.79Å; W332-L336 PolarHBondContact O-N 3.21Å; W332-E509 HydrophobicContact CH2-CB 4.29Å; W332-E509 VanDerWaalsContact CH2-O 3.29Å; W332-E509 WeakPolarHBondContact CH2-O 3.46Å; W332-E509 VanDerWaalsContact CZ3-O 3.31Å; W332-E509 WeakPolarHBondContact CZ3-O 3.46Å; W332-L510 HydrophobicContact CE3-CD2 4.2Å; W332-L510 HydrophobicContact CZ3-CD2 4.3Å; W332-A513 HydrophobicContact CD2-CB 3.76Å; W332-A513 HydrophobicContact CE3-CB 3.37Å; W332-A513 HydrophobicContact CH2-CB 3.32Å; W332-A513 HydrophobicContact CZ2-CB 3.73Å; W332-A513 HydrophobicContact CZ3-CB 3.13Å; W332-L620 PolarHBondContact NE1-O 3.47Å; W332-L621 HydrophobicContact CB-CD2 4.33Å
333	E	90	Very high	87.1	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-56.1	-42.2	171.1	-178.1	-177	153.8	0	0	113	L329 R331 R337 R465 S469 L510	L329-E333 WeakPolarHBondContact O-CB 3.35Å; L329-E333 PolarHBondContact O-N 2.8Å; R331-E333 PolarHBondContact O-N 2.93Å; E333-R337 VanDerWaalsContact O-CB 3.29Å; E333-R337 WeakPolarHBondContact O-CB 3.29Å; E333-R337 PolarHBondContact O-N 3.38Å; E333-R337 IonicContact OE1-CZ 3.88Å; E333-R337 IonicContact OE1-NH1 3.41Å; E333-R337 PolarHBondContact OE1-NH1 2.92Å; E333-R337 IonicContact OE1-NH2 3.42Å; E333-R337 PolarHBondContact OE1-NH2 3.13Å; E333-R465 IonicContact OE2-CZ 2.69Å; E333-R465 IonicContact OE2-NH1 3.74Å; E333-R465 PolarHBondContact OE2-NH1 2.94Å; E333-R465 IonicContact OE2-NH2 3.29Å; E333-R465 PolarHBondContact OE2-NH2 3.2Å; E333-S469 VanDerWaalsContact CD-OG 3.27Å; E333-S469 WeakPolarHBondContact OE1-CA 3.4Å; E333-S469 WeakPolarHBondContact OE1-CB 3.4Å; E333-S469 PolarHBondContact OE1-OG 3.43Å; E333-S469 WeakPolarHBondContact OE2-CB 3.18Å; E333-S469 PolarHBondContact OE2-OG 3.17Å; E333-L510 HydrophobicContact CB-CD2 3.82Å; E333-L510 HydrophobicContact CG-CD1 4.17Å; E333-L510 HydrophobicContact CG-CD2 4.01Å
334	V	90.3	Very high	87.2	Confident	12 Å²	12	25.5 Å²	25.5	7%	0.073	14%	0.138	C	C	.	.	H	α-helix	trans	-66.6	-42.8	176.6	166.1	0	0	0	0	111.2	L330 R331 W332 M338 L370 L472	L330-V334 WeakPolarHBondContact O-CG2 3.4Å; L330-V334 PolarHBondContact O-N 3.31Å; R331-V334 WeakPolarHBondContact O-CB 3.36Å; R331-V334 PolarHBondContact O-N 3.27Å; R331-V334 VanDerWaalsContact O-N 3.13Å; W332-V334 VanDerWaalsContact C-N 3.31Å; W332-V334 PolarHBondContact O-N 3.41Å; V334-M338 WeakPolarHBondContact O-CB 3.39Å; V334-M338 WeakPolarHBondContact O-CG 3.16Å; V334-M338 PolarHBondContact O-N 3.12Å; V334-L370 HydrophobicContact CG1-CB 3.86Å; V334-L370 HydrophobicContact CG1-CD1 4.21Å; V334-L472 HydrophobicContact CG2-CD1 3.86Å; V334-L472 HydrophobicContact CG2-CD2 4.31Å
335	T	89.5	Confident	87.4	Confident	58 Å²	58	23.2 Å²	23.2	36%	0.356	13%	0.127	S	C	.	.	H	α-helix	trans	-60.4	-47.7	175.6	-64.9	0	0	0	0	111.6	R331 W332 M338 G339	R331-T335 PolarHBondContact O-N 3.3Å; R331-T335 PolarHBondContact O-OG1 2.96Å; W332-T335 PolarHBondContact O-N 2.89Å; T335-M338 PolarHBondContact O-N 3.23Å; T335-G339 PolarHBondContact O-N 2.82Å
336	L	88.2	Confident	87.5	Confident	9 Å²	9	28.8 Å²	28.8	5%	0.047	15%	0.153	C	C	.	.	H	α-helix	trans	-62.5	-50.7	176.7	-72.8	-163.4	0	0	0	112.7	W332 M338 G339 L340 L506 E509	W332-L336 HydrophobicContact CD2-CD1 4.36Å; W332-L336 HydrophobicContact CD2-CG 4.16Å; W332-L336 HydrophobicContact CE3-CD1 3.64Å; W332-L336 HydrophobicContact CE3-CG 3.89Å; W332-L336 HydrophobicContact CH2-CD1 3.38Å; W332-L336 HydrophobicContact CH2-CD2 4.09Å; W332-L336 HydrophobicContact CH2-CG 3.97Å; W332-L336 HydrophobicContact CZ2-CD1 4.11Å; W332-L336 HydrophobicContact CZ2-CD2 4Å; W332-L336 HydrophobicContact CZ2-CG 4.21Å; W332-L336 HydrophobicContact CZ3-CD1 3.09Å; W332-L336 HydrophobicContact CZ3-CD2 4.42Å; W332-L336 HydrophobicContact CZ3-CG 3.79Å; W332-L336 PolarHBondContact O-N 3.21Å; L336-M338 PolarHBondContact O-N 2.61Å; L336-G339 PolarHBondContact O-N 3.3Å; L336-L340 WeakPolarHBondContact O-CG 3.25Å; L336-L340 PolarHBondContact O-N 3.1Å; L336-L506 HydrophobicContact CB-CD1 3.45Å; L336-L506 VanDerWaalsContact CB-CD1 3.45Å; L336-L506 HydrophobicContact CD1-CD1 3.8Å; L336-L506 HydrophobicContact CG-CD1 4.33Å; L336-E509 HydrophobicContact CD1-CB 3.45Å; L336-E509 VanDerWaalsContact CD1-CB 3.45Å; L336-E509 HydrophobicContact CD1-CG 4.44Å; L336-E509 VanDerWaalsContact CD1-OE2 3.32Å; L336-E509 WeakPolarHBondContact CD1-OE2 3.29Å; L336-E509 WeakPolarHBondContact CD2-OE2 3.39Å
337	R	91.4	Very high	87.4	Confident	2 Å²	2	32.3 Å²	32.3	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-57.4	-37.5	-179.3	-171.5	176.6	-81.9	113.4	-3.9	110.5	E333 I341 E503 L506	E333-R337 VanDerWaalsContact O-CB 3.29Å; E333-R337 WeakPolarHBondContact O-CB 3.29Å; E333-R337 PolarHBondContact O-N 3.38Å; E333-R337 IonicContact OE1-CZ 3.88Å; E333-R337 IonicContact OE1-NH1 3.41Å; E333-R337 PolarHBondContact OE1-NH1 2.92Å; E333-R337 IonicContact OE1-NH2 3.42Å; E333-R337 PolarHBondContact OE1-NH2 3.13Å; R337-I341 HydrophobicContact CG-CD1 3.92Å; R337-I341 WeakPolarHBondContact O-CB 3.4Å; R337-I341 VanDerWaalsContact O-CD1 3.31Å; R337-I341 WeakPolarHBondContact O-CD1 3.45Å; R337-I341 WeakPolarHBondContact O-CG1 2.91Å; R337-I341 PolarHBondContact O-N 2.95Å; R337-I341 VanDerWaalsContact O-N 3.11Å; R337-E503 IonicContact CZ-OE1 3.87Å; R337-E503 VanDerWaalsContact CZ-OE1 3.26Å; R337-E503 IonicContact NE-OE1 2.71Å; R337-E503 PolarHBondContact NE-OE1 2.62Å; R337-E503 IonicContact NH2-OE1 3.34Å; R337-E503 PolarHBondContact NH2-OE1 2.93Å; R337-E503 IonicContact NH2-OE2 2.62Å; R337-E503 PolarHBondContact NH2-OE2 2.91Å; R337-E503 VanDerWaalsContact NH2-OE2 3.08Å; R337-L506 HydrophobicContact CB-CD1 4.47Å; R337-L506 HydrophobicContact CB-CD2 3.93Å; R337-L506 HydrophobicContact CG-CD2 4.12Å; R337-L506 VanDerWaalsContact NH2-CD2 3.27Å
338	M	89.9	Confident	87	Confident	27 Å²	27	34 Å²	34	13%	0.133	18%	0.177	C	C	.	.	H	α-helix	trans	-65.1	-46.6	170.9	-76.8	-57.8	-47.8	0	0	113.5	V334 T335 L336 I341 A342 L363 I366 Q367 L370	V334-M338 WeakPolarHBondContact O-CB 3.39Å; V334-M338 WeakPolarHBondContact O-CG 3.16Å; V334-M338 PolarHBondContact O-N 3.12Å; T335-M338 PolarHBondContact O-N 3.23Å; L336-M338 PolarHBondContact O-N 2.61Å; M338-I341 PolarHBondContact O-N 3.37Å; M338-A342 WeakPolarHBondContact O-CB 3.3Å; M338-A342 PolarHBondContact O-N 2.93Å; M338-L363 HydrophobicContact CE-CB 4.37Å; M338-L363 HydrophobicContact CE-CD2 3.63Å; M338-I366 HydrophobicContact SD-CB 4.12Å; M338-I366 HydrophobicContact SD-CG2 3.61Å; M338-Q367 HydrophobicContact CE-CB 3.83Å; M338-Q367 HydrophobicContact SD-CB 4.11Å; M338-L370 HydrophobicContact CG-CD1 4.02Å; M338-L370 HydrophobicContact SD-CD1 3.86Å
339	G	89.1	Confident	86.6	Confident	29 Å²	29	34.3 Å²	34.3	30%	0.299	18%	0.178	S	C	.	.	H	α-helix	trans	-63.5	-41.8	-179.9	0	0	0	0	0	113.7	T335 L336 A342 T343	T335-G339 PolarHBondContact O-N 2.82Å; L336-G339 PolarHBondContact O-N 3.3Å; G339-A342 PolarHBondContact O-N 3Å; G339-T343 WeakPolarHBondContact O-CB 3.47Å; G339-T343 PolarHBondContact O-N 3.17Å; G339-T343 PolarHBondContact O-OG1 3.28Å
340	L	90.8	Very high	85.5	Confident	22 Å²	22	40.4 Å²	40.4	12%	0.115	21%	0.211	C	C	.	.	H	α-helix	trans	-65.8	-46.8	174.8	-66.8	170.6	0	0	0	111.1	L336 A342 T343 R344 V502 E505 L506	L336-L340 WeakPolarHBondContact O-CG 3.25Å; L336-L340 PolarHBondContact O-N 3.1Å; L340-A342 VanDerWaalsContact C-N 3.33Å; L340-A342 PolarHBondContact O-N 3.46Å; L340-T343 PolarHBondContact O-N 3.36Å; L340-R344 WeakPolarHBondContact O-CG 3.23Å; L340-R344 PolarHBondContact O-N 3.36Å; L340-V502 HydrophobicContact CB-CG1 4.05Å; L340-E505 HydrophobicContact CD1-CB 4.28Å; L340-E505 HydrophobicContact CD2-CB 4.25Å; L340-L506 HydrophobicContact CD1-CB 3.75Å; L340-L506 HydrophobicContact CD1-CD1 4.21Å
341	I	89.6	Confident	83.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60	-42.7	175.5	-69.9	168.3	0	0	0	111.1	R337 M338 R344 L345 L363 I366 A476 F480 W499 V502	R337-I341 HydrophobicContact CG-CD1 3.92Å; R337-I341 WeakPolarHBondContact O-CB 3.4Å; R337-I341 VanDerWaalsContact O-CD1 3.31Å; R337-I341 WeakPolarHBondContact O-CD1 3.45Å; R337-I341 WeakPolarHBondContact O-CG1 2.91Å; R337-I341 PolarHBondContact O-N 2.95Å; R337-I341 VanDerWaalsContact O-N 3.11Å; M338-I341 PolarHBondContact O-N 3.37Å; I341-R344 PolarHBondContact O-N 2.96Å; I341-L345 HydrophobicContact CG2-CD1 3.77Å; I341-L345 HydrophobicContact CG2-CG 4.33Å; I341-L345 WeakPolarHBondContact O-CB 3.46Å; I341-L345 VanDerWaalsContact O-CG 3.31Å; I341-L345 WeakPolarHBondContact O-CG 3.22Å; I341-L345 PolarHBondContact O-N 2.88Å; I341-L363 HydrophobicContact CG2-CD2 3.97Å; I341-I366 HydrophobicContact CD1-CD1 4.5Å; I341-I366 HydrophobicContact CD1-CG2 4.45Å; I341-I366 HydrophobicContact CG2-CD1 4.07Å; I341-A476 HydrophobicContact CD1-CB 4.39Å; I341-F480 HydrophobicContact CG2-CD2 4.06Å; I341-F480 HydrophobicContact CG2-CE2 4.21Å; I341-W499 HydrophobicContact CD1-CH2 4.22Å; I341-W499 HydrophobicContact CD1-CZ3 3.8Å; I341-W499 HydrophobicContact CG1-CZ3 4.35Å; I341-V502 HydrophobicContact CG1-CG1 4.16Å
342	A	88.9	Confident	82.3	Confident	22 Å²	22	46 Å²	46	18%	0.182	26%	0.259	C	S	.	.	H	α-helix	trans	-60.4	-49.6	175.8	0	0	0	0	0	111.6	M338 G339 L340 R344 L345 E346 L363	M338-A342 WeakPolarHBondContact O-CB 3.3Å; M338-A342 PolarHBondContact O-N 2.93Å; G339-A342 PolarHBondContact O-N 3Å; L340-A342 VanDerWaalsContact C-N 3.33Å; L340-A342 PolarHBondContact O-N 3.46Å; A342-R344 VanDerWaalsContact C-N 3.28Å; A342-R344 PolarHBondContact O-N 2.88Å; A342-L345 PolarHBondContact O-N 3.37Å; A342-L345 VanDerWaalsContact O-N 3.11Å; A342-E346 WeakPolarHBondContact O-CG 3.41Å; A342-E346 PolarHBondContact O-N 2.87Å; A342-L363 HydrophobicContact CB-CD1 3.92Å; A342-L363 HydrophobicContact CB-CD2 3.8Å
343	T	87.8	Confident	80.5	Confident	66 Å²	66	50.1 Å²	50.1	41%	0.405	29%	0.294	S	S	.	.	H	α-helix	trans	-56.4	-40.7	177.7	-58.4	0	0	0	0	112	G339 L340 Q347	G339-T343 WeakPolarHBondContact O-CB 3.47Å; G339-T343 PolarHBondContact O-N 3.17Å; G339-T343 PolarHBondContact O-OG1 3.28Å; L340-T343 PolarHBondContact O-N 3.36Å; T343-Q347 WeakPolarHBondContact O-CG 3.43Å; T343-Q347 PolarHBondContact O-N 2.81Å; T343-Q347 VanDerWaalsContact O-N 3.12Å
344	R	86.6	Confident	78.6	Confident	34 Å²	34	55 Å²	55	13%	0.128	33%	0.328	C	S	.	.	H	α-helix	trans	-71.3	-39.6	175.7	-63.6	-50.2	-179.7	176.8	3.5	113.1	L340 I341 A342 Q347 L348 V502 E505	L340-R344 WeakPolarHBondContact O-CG 3.23Å; L340-R344 PolarHBondContact O-N 3.36Å; I341-R344 PolarHBondContact O-N 2.96Å; A342-R344 VanDerWaalsContact C-N 3.28Å; A342-R344 PolarHBondContact O-N 2.88Å; R344-Q347 PolarHBondContact O-N 3.12Å; R344-L348 WeakPolarHBondContact O-CD1 3.36Å; R344-L348 VanDerWaalsContact O-CG 3.29Å; R344-L348 WeakPolarHBondContact O-CG 3.42Å; R344-L348 PolarHBondContact O-N 3.21Å; R344-L348 VanDerWaalsContact O-N 3.14Å; R344-V502 HydrophobicContact CG-CG2 3.63Å; R344-E505 IonicContact CZ-OE1 2.87Å; R344-E505 IonicContact CZ-OE2 3.82Å; R344-E505 IonicContact NE-OE2 2.74Å; R344-E505 IonicContact NH2-OE1 3.78Å; R344-E505 PolarHBondContact NH2-OE1 3.01Å; R344-E505 IonicContact NH2-OE2 3.38Å; R344-E505 PolarHBondContact NH2-OE2 3.5Å
345	L	84.3	Confident	76.7	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-67.7	-36.6	177	-69.9	172.1	0	0	0	112.1	I341 A342 L348 T349 A359 I362 L363 F480 V484 L488	I341-L345 HydrophobicContact CG2-CD1 3.77Å; I341-L345 HydrophobicContact CG2-CG 4.33Å; I341-L345 WeakPolarHBondContact O-CB 3.46Å; I341-L345 VanDerWaalsContact O-CG 3.31Å; I341-L345 WeakPolarHBondContact O-CG 3.22Å; I341-L345 PolarHBondContact O-N 2.88Å; A342-L345 PolarHBondContact O-N 3.37Å; A342-L345 VanDerWaalsContact O-N 3.11Å; L345-L348 HydrophobicContact CD2-CD1 4.5Å; L345-L348 PolarHBondContact O-N 2.92Å; L345-T349 VanDerWaalsContact O-CB 3.23Å; L345-T349 WeakPolarHBondContact O-CB 3.28Å; L345-T349 PolarHBondContact O-N 3.3Å; L345-T349 VanDerWaalsContact O-N 3.12Å; L345-T349 PolarHBondContact O-OG1 3.07Å; L345-A359 HydrophobicContact CB-CB 4.03Å; L345-I362 HydrophobicContact CD1-CB 4.32Å; L345-I362 HydrophobicContact CD1-CG2 3.97Å; L345-L363 HydrophobicContact CD1-CD1 4.42Å; L345-L363 HydrophobicContact CD1-CD2 3.95Å; L345-L363 HydrophobicContact CD1-CG 3.81Å; L345-F480 HydrophobicContact CD2-CE2 4.33Å; L345-V484 HydrophobicContact CD2-CG2 3.85Å; L345-L488 HydrophobicContact CD2-CD1 3.78Å
346	E	84	Confident	75	Confident	118 Å²	118	68.3 Å²	68.3	55%	0.551	39%	0.387	S	S	*	.	H	α-helix	trans	-62.8	-48.1	171.5	-73.4	-178	-177.4	0	0	111.8	A342 L348 T349 N350	A342-E346 WeakPolarHBondContact O-CG 3.41Å; A342-E346 PolarHBondContact O-N 2.87Å; E346-L348 PolarHBondContact O-N 3.2Å; E346-T349 PolarHBondContact O-N 3.16Å; E346-N350 PolarHBondContact O-N 3.44Å; E346-N350 PolarHBondContact O-ND2 2.94Å
347	Q	81.6	Confident	74.1	Confident	108 Å²	108	70.2 Å²	70.2	51%	0.505	40%	0.397	S	S	.	.	H	α-helix	trans	-54.2	-37.1	175.8	-75.3	169.5	14.3	0	0	112.6	T343 R344	T343-Q347 WeakPolarHBondContact O-CG 3.43Å; T343-Q347 PolarHBondContact O-N 2.81Å; T343-Q347 VanDerWaalsContact O-N 3.12Å; R344-Q347 PolarHBondContact O-N 3.12Å
348	L	76.1	Confident	73.3	Confident	57 Å²	57	72 Å²	72	30%	0.298	41%	0.408	S	S	.	.	H	α-helix	trans	-76.8	-21.5	176.4	-67.4	165.7	0	0	0	114	R344 L345 E346 L490 L498	R344-L348 WeakPolarHBondContact O-CD1 3.36Å; R344-L348 VanDerWaalsContact O-CG 3.29Å; R344-L348 WeakPolarHBondContact O-CG 3.42Å; R344-L348 PolarHBondContact O-N 3.21Å; R344-L348 VanDerWaalsContact O-N 3.14Å; L345-L348 HydrophobicContact CD2-CD1 4.5Å; L345-L348 PolarHBondContact O-N 2.92Å; E346-L348 PolarHBondContact O-N 3.2Å; L348-L490 HydrophobicContact CD1-CD1 3.93Å; L348-L490 HydrophobicContact CD2-CD1 4.12Å; L348-L490 HydrophobicContact CD2-CD2 4.47Å; L348-L498 HydrophobicContact CD1-CD1 4.01Å; L348-L498 HydrophobicContact CD2-CD1 4.33Å
349	T	73.7	Confident	72.8	Confident	15 Å²	15	70.9 Å²	70.9	9%	0.092	40%	0.404	C	S	.	.	H	α-helix	trans	-103.1	-19.7	-168.7	-57.4	0	0	0	0	113.3	L345 E346 G351 K352 N357	L345-T349 VanDerWaalsContact O-CB 3.23Å; L345-T349 WeakPolarHBondContact O-CB 3.28Å; L345-T349 PolarHBondContact O-N 3.3Å; L345-T349 VanDerWaalsContact O-N 3.12Å; L345-T349 PolarHBondContact O-OG1 3.07Å; E346-T349 PolarHBondContact O-N 3.16Å; T349-G351 PolarHBondContact O-N 3.43Å; T349-K352 PolarHBondContact O-N 2.86Å; T349-N357 WeakPolarHBondContact CG2-OD1 3.47Å
350	N	62.3	Low	72.5	Confident	138 Å²	138	74.7 Å²	74.7	74%	0.738	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	6.9	179.9	-80.9	-30.4	0	0	0	117.2	E346	E346-N350 PolarHBondContact O-N 3.44Å; E346-N350 PolarHBondContact O-ND2 2.94Å
351	G	54.1	Low	72.2	Confident	76 Å²	76	76.5 Å²	76.5	78%	0.784	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	1.7	173.1	0	0	0	0	0	116.1	T349	T349-G351 PolarHBondContact O-N 3.43Å
352	K	54	Low	72	Confident	135 Å²	135	76.5 Å²	76.5	59%	0.587	43%	0.426	S	S	*	.			trans	-127.6	95.2	-173.4	-70.3	179.1	-179	172.3	0	112.8	T349	T349-K352 PolarHBondContact O-N 2.86Å
353	S	49.3	Very low	71.9	Confident	124 Å²	124	76.8 Å²	76.8	87%	0.867	42%	0.424	S	S	*	.			trans	-88.9	112.2	176.4	59.4	0	0	0	0	113.1
354	S	48.6	Very low	72	Confident	103 Å²	103	77.1 Å²	77.1	72%	0.72	43%	0.429	S	S	*	.	S	Bend	trans	147.9	131	140.6	-171.1	0	0	0	0	113.8
355	K	50.8	Low	72.2	Confident	189 Å²	189	79.1 Å²	79.1	82%	0.822	44%	0.44	S	S	*	.	S	Bend	trans	67.7	130.5	174.9	-60.9	177.1	-179.1	179.5	0	116.7
356	L	54.6	Low	72.5	Confident	160 Å²	160	79.1 Å²	79.1	84%	0.838	44%	0.44	S	S	*	.	S	Bend	trans	28	91.8	168.8	-90.2	163.6	0	0	0	114.5	P358	L356-P358 WeakPolarHBondContact O-CD 3.42Å
357	N	68.8	Low	72.9	Confident	50 Å²	50	78.8 Å²	78.8	27%	0.267	44%	0.438	S	S	.	.			trans	-67	119.6	-167.1	-145.7	4.3	0	0	0	110.5	T349 A359 E360 T361	T349-N357 WeakPolarHBondContact CG2-OD1 3.47Å; N357-A359 PolarHBondContact O-N 2.61Å; N357-E360 HydrophobicContact CB-CB 4.22Å; N357-E360 HydrophobicContact CB-CG 3.86Å; N357-E360 WeakPolarHBondContact CB-OE1 3.18Å; N357-E360 PolarHBondContact ND2-OE1 3.28Å; N357-E360 WeakPolarHBondContact O-CB 3.47Å; N357-E360 PolarHBondContact O-N 2.98Å; N357-T361 PolarHBondContact O-N 2.87Å
358	P	73.8	Confident	73.4	Confident	38 Å²	38	76.6 Å²	76.6	25%	0.247	44%	0.439	C	S	.	.	H	α-helix	trans	-60.6	-33	-179	21	-30.8	0	0	0	111.8	L356 E360 T361 I362 Q487 L488	L356-P358 WeakPolarHBondContact O-CD 3.42Å; P358-E360 VanDerWaalsContact C-N 3.32Å; P358-E360 PolarHBondContact O-N 3.26Å; P358-T361 WeakPolarHBondContact O-CB 3.35Å; P358-T361 PolarHBondContact O-N 3.48Å; P358-T361 VanDerWaalsContact O-N 3.12Å; P358-I362 WeakPolarHBondContact O-CG1 3.34Å; P358-I362 PolarHBondContact O-N 3.09Å; P358-Q487 HydrophobicContact CB-CB 3.88Å; P358-Q487 PolarHBondContact O-OE1 3.09Å; P358-L488 HydrophobicContact CG-CD2 4Å
359	A	79.7	Confident	74.2	Confident	5 Å²	5	74.9 Å²	74.9	4%	0.041	43%	0.433	C	S	.	.	H	α-helix	trans	-54.6	-42.1	172.3	0	0	0	0	0	113.4	L345 N357 T361 I362 L363	L345-A359 HydrophobicContact CB-CB 4.03Å; N357-A359 PolarHBondContact O-N 2.61Å; A359-T361 VanDerWaalsContact C-N 3.33Å; A359-T361 PolarHBondContact O-N 2.82Å; A359-I362 PolarHBondContact O-N 2.82Å; A359-L363 WeakPolarHBondContact O-CB 3.44Å; A359-L363 VanDerWaalsContact O-CG 3.24Å; A359-L363 WeakPolarHBondContact O-CG 3.19Å; A359-L363 PolarHBondContact O-N 3.05Å
360	E	82.7	Confident	75.1	Confident	109 Å²	109	74.2 Å²	74.2	51%	0.509	43%	0.429	S	S	.	.	H	α-helix	trans	-67.5	-34.2	178.4	-71	155	-148.1	0	0	111.8	N357 P358 S364	N357-E360 HydrophobicContact CB-CB 4.22Å; N357-E360 HydrophobicContact CB-CG 3.86Å; N357-E360 WeakPolarHBondContact CB-OE1 3.18Å; N357-E360 PolarHBondContact ND2-OE1 3.28Å; N357-E360 WeakPolarHBondContact O-CB 3.47Å; N357-E360 PolarHBondContact O-N 2.98Å; P358-E360 VanDerWaalsContact C-N 3.32Å; P358-E360 PolarHBondContact O-N 3.26Å; E360-S364 WeakPolarHBondContact O-CB 3.23Å; E360-S364 PolarHBondContact O-N 2.84Å; E360-S364 PolarHBondContact O-OG 2.94Å
361	T	84.4	Confident	76.5	Confident	59 Å²	59	71.4 Å²	71.4	36%	0.362	42%	0.417	S	S	.	.	H	α-helix	trans	-67.6	-48.8	175.9	-52.2	0	0	0	0	110.5	N357 P358 A359 L363 S364 E365	N357-T361 PolarHBondContact O-N 2.87Å; P358-T361 WeakPolarHBondContact O-CB 3.35Å; P358-T361 PolarHBondContact O-N 3.48Å; P358-T361 VanDerWaalsContact O-N 3.12Å; A359-T361 VanDerWaalsContact C-N 3.33Å; A359-T361 PolarHBondContact O-N 2.82Å; T361-L363 VanDerWaalsContact C-N 3.35Å; T361-L363 PolarHBondContact O-N 3.37Å; T361-S364 WeakPolarHBondContact O-CB 3.1Å; T361-S364 PolarHBondContact O-N 3.09Å; T361-E365 WeakPolarHBondContact O-CG 3.04Å; T361-E365 PolarHBondContact O-N 3.48Å
362	I	85.2	Confident	78.4	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-60.2	-44.3	177.3	-62.6	171.5	0	0	0	111	L345 P358 A359 S364 E365 I366 V484 Q487 L488	L345-I362 HydrophobicContact CD1-CB 4.32Å; L345-I362 HydrophobicContact CD1-CG2 3.97Å; P358-I362 WeakPolarHBondContact O-CG1 3.34Å; P358-I362 PolarHBondContact O-N 3.09Å; A359-I362 PolarHBondContact O-N 2.82Å; I362-S364 VanDerWaalsContact C-N 3.33Å; I362-S364 PolarHBondContact O-N 3.25Å; I362-E365 PolarHBondContact O-N 2.83Å; I362-I366 HydrophobicContact CG2-CD1 3.78Å; I362-I366 HydrophobicContact CG2-CG1 4.45Å; I362-I366 WeakPolarHBondContact O-CG1 3.33Å; I362-I366 PolarHBondContact O-N 3.22Å; I362-V484 HydrophobicContact CD1-CG2 3.99Å; I362-V484 HydrophobicContact CG2-CG2 4.25Å; I362-Q487 HydrophobicContact CD1-CB 4.25Å; I362-L488 HydrophobicContact CD1-CD1 4.49Å
363	L	88.6	Confident	80.2	Confident	29 Å²	29	66.2 Å²	66.2	15%	0.152	37%	0.374	C	S	.	.	H	α-helix	trans	-62.9	-39.9	176.9	-74.6	167.7	0	0	0	111.9	M338 I341 A342 L345 A359 T361 Q367	M338-L363 HydrophobicContact CE-CB 4.37Å; M338-L363 HydrophobicContact CE-CD2 3.63Å; I341-L363 HydrophobicContact CG2-CD2 3.97Å; A342-L363 HydrophobicContact CB-CD1 3.92Å; A342-L363 HydrophobicContact CB-CD2 3.8Å; L345-L363 HydrophobicContact CD1-CD1 4.42Å; L345-L363 HydrophobicContact CD1-CD2 3.95Å; L345-L363 HydrophobicContact CD1-CG 3.81Å; A359-L363 WeakPolarHBondContact O-CB 3.44Å; A359-L363 VanDerWaalsContact O-CG 3.24Å; A359-L363 WeakPolarHBondContact O-CG 3.19Å; A359-L363 PolarHBondContact O-N 3.05Å; T361-L363 VanDerWaalsContact C-N 3.35Å; T361-L363 PolarHBondContact O-N 3.37Å; L363-Q367 WeakPolarHBondContact O-CB 3.5Å; L363-Q367 PolarHBondContact O-N 3.1Å
364	S	88.6	Confident	82.2	Confident	72 Å²	72	61.5 Å²	61.5	50%	0.503	34%	0.339	S	S	.	.	H	α-helix	trans	-64.4	-41.4	176	-58.9	0	0	0	0	112.3	E360 T361 I362 A368	E360-S364 WeakPolarHBondContact O-CB 3.23Å; E360-S364 PolarHBondContact O-N 2.84Å; E360-S364 PolarHBondContact O-OG 2.94Å; T361-S364 WeakPolarHBondContact O-CB 3.1Å; T361-S364 PolarHBondContact O-N 3.09Å; I362-S364 VanDerWaalsContact C-N 3.33Å; I362-S364 PolarHBondContact O-N 3.25Å; S364-A368 VanDerWaalsContact O-CB 3.32Å; S364-A368 WeakPolarHBondContact O-CB 3.33Å; S364-A368 PolarHBondContact O-N 3.15Å
365	E	90.7	Very high	84.2	Confident	77 Å²	77	62.2 Å²	62.2	36%	0.36	33%	0.331	S	S	.	.	H	α-helix	trans	-61	-51.1	175.3	-72.8	171.9	-179.2	0	0	111.6	T361 I362 A368 A369 I479 S483	T361-E365 WeakPolarHBondContact O-CG 3.04Å; T361-E365 PolarHBondContact O-N 3.48Å; I362-E365 PolarHBondContact O-N 2.83Å; E365-A368 PolarHBondContact O-N 3.05Å; E365-A369 WeakPolarHBondContact O-CB 3.44Å; E365-A369 PolarHBondContact O-N 3.41Å; E365-A369 VanDerWaalsContact O-N 3.11Å; E365-I479 HydrophobicContact CB-CG2 4.11Å; E365-S483 PolarHBondContact OE2-OG 3.27Å
366	I	91	Very high	86.1	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.5	-43.3	-179.7	-60.6	170.5	0	0	0	110.7	M338 I341 I362 A368 A369 L370 A476 I479 F480	M338-I366 HydrophobicContact SD-CB 4.12Å; M338-I366 HydrophobicContact SD-CG2 3.61Å; I341-I366 HydrophobicContact CD1-CD1 4.5Å; I341-I366 HydrophobicContact CD1-CG2 4.45Å; I341-I366 HydrophobicContact CG2-CD1 4.07Å; I362-I366 HydrophobicContact CG2-CD1 3.78Å; I362-I366 HydrophobicContact CG2-CG1 4.45Å; I362-I366 WeakPolarHBondContact O-CG1 3.33Å; I362-I366 PolarHBondContact O-N 3.22Å; I366-A368 PolarHBondContact O-N 2.69Å; I366-A369 PolarHBondContact O-N 3.49Å; I366-L370 HydrophobicContact CG2-CD1 3.76Å; I366-L370 HydrophobicContact CG2-CG 4.11Å; I366-L370 WeakPolarHBondContact O-CB 3.28Å; I366-L370 WeakPolarHBondContact O-CG 3.37Å; I366-L370 PolarHBondContact O-N 2.69Å; I366-A476 HydrophobicContact CG2-CB 4.01Å; I366-I479 HydrophobicContact CD1-CG2 4.34Å; I366-I479 HydrophobicContact CG1-CB 3.97Å; I366-I479 HydrophobicContact CG1-CG2 3.49Å; I366-I479 VanDerWaalsContact CG1-CG2 3.49Å; I366-F480 HydrophobicContact CD1-CB 4.26Å; I366-F480 HydrophobicContact CD1-CD2 4.46Å
367	Q	91.9	Very high	87.8	Confident	110 Å²	110	51.1 Å²	51.1	51%	0.514	27%	0.273	S	S	.	.	H	α-helix	trans	-61.6	-43	179.3	-173	178.8	9.5	0	0	111.8	M338 L363 T371	M338-Q367 HydrophobicContact CE-CB 3.83Å; M338-Q367 HydrophobicContact SD-CB 4.11Å; L363-Q367 WeakPolarHBondContact O-CB 3.5Å; L363-Q367 PolarHBondContact O-N 3.1Å; Q367-T371 VanDerWaalsContact O-CB 3.26Å; Q367-T371 WeakPolarHBondContact O-CB 3.33Å; Q367-T371 PolarHBondContact O-N 3.22Å; Q367-T371 PolarHBondContact O-OG1 3.26Å
368	A	92.4	Very high	88.7	Confident	62 Å²	62	51.2 Å²	51.2	51%	0.512	28%	0.276	S	S	.	.	H	α-helix	trans	-62.9	-48.9	176.7	0	0	0	0	0	111.4	S364 E365 I366 T371 E372	S364-A368 VanDerWaalsContact O-CB 3.32Å; S364-A368 WeakPolarHBondContact O-CB 3.33Å; S364-A368 PolarHBondContact O-N 3.15Å; E365-A368 PolarHBondContact O-N 3.05Å; I366-A368 PolarHBondContact O-N 2.69Å; A368-T371 PolarHBondContact O-N 2.82Å; A368-E372 WeakPolarHBondContact O-CB 3.4Å; A368-E372 PolarHBondContact O-N 2.72Å
369	A	93.4	Very high	89.5	Confident	22 Å²	22	54.4 Å²	54.4	18%	0.182	29%	0.287	C	S	.	.	H	α-helix	trans	-64.4	-41.6	-179.3	0	0	0	0	0	112.9	E365 I366 G373 I475 I479	E365-A369 WeakPolarHBondContact O-CB 3.44Å; E365-A369 PolarHBondContact O-N 3.41Å; E365-A369 VanDerWaalsContact O-N 3.11Å; I366-A369 PolarHBondContact O-N 3.49Å; A369-G373 PolarHBondContact O-N 2.63Å; A369-I475 HydrophobicContact CB-CG2 3.7Å; A369-I479 HydrophobicContact CB-CD1 3.43Å; A369-I479 VanDerWaalsContact CB-CD1 3.43Å
370	L	92.5	Very high	90	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-68.2	-38.3	175.4	-73.4	-179.1	0	0	0	112.4	V334 M338 I366 G373 L374 L472 A476	V334-L370 HydrophobicContact CG1-CB 3.86Å; V334-L370 HydrophobicContact CG1-CD1 4.21Å; M338-L370 HydrophobicContact CG-CD1 4.02Å; M338-L370 HydrophobicContact SD-CD1 3.86Å; I366-L370 HydrophobicContact CG2-CD1 3.76Å; I366-L370 HydrophobicContact CG2-CG 4.11Å; I366-L370 WeakPolarHBondContact O-CB 3.28Å; I366-L370 WeakPolarHBondContact O-CG 3.37Å; I366-L370 PolarHBondContact O-N 2.69Å; L370-G373 PolarHBondContact O-N 3.46Å; L370-L374 VanDerWaalsContact O-CB 3.24Å; L370-L374 WeakPolarHBondContact O-CB 3.44Å; L370-L374 PolarHBondContact O-N 3.49Å; L370-L472 HydrophobicContact CD2-CB 3.94Å; L370-L472 HydrophobicContact CD2-CD2 3.71Å; L370-L472 HydrophobicContact CD2-CG 4.44Å; L370-L472 WeakPolarHBondContact CD2-O 3.41Å; L370-A476 HydrophobicContact CD1-CB 4.23Å; L370-A476 HydrophobicContact CD2-CB 4.16Å; L370-A476 HydrophobicContact CG-CB 4.42Å
371	T	91.6	Very high	90.3	Very high	79 Å²	79	51.4 Å²	51.4	49%	0.485	27%	0.273	S	S	.	.	H	α-helix	trans	-64.6	-44	176.4	-58.7	0	0	0	0	111.1	Q367 A368 L374 Q375	Q367-T371 VanDerWaalsContact O-CB 3.26Å; Q367-T371 WeakPolarHBondContact O-CB 3.33Å; Q367-T371 PolarHBondContact O-N 3.22Å; Q367-T371 PolarHBondContact O-OG1 3.26Å; A368-T371 PolarHBondContact O-N 2.82Å; T371-L374 PolarHBondContact O-N 2.97Å; T371-Q375 PolarHBondContact O-N 3.07Å
372	E	93.4	Very high	90.5	Very high	102 Å²	102	50.7 Å²	50.7	48%	0.477	27%	0.268	S	S	.	.	H	α-helix	trans	-66	-40.7	176	-160.2	-162.6	-163.8	0	0	111.6	A368 Q375 R376	A368-E372 WeakPolarHBondContact O-CB 3.4Å; A368-E372 PolarHBondContact O-N 2.72Å; E372-Q375 PolarHBondContact O-N 3.08Å; E372-R376 WeakPolarHBondContact O-CG 3.43Å; E372-R376 PolarHBondContact O-N 3.15Å; E372-R376 IonicContact OE1-CZ 3.36Å; E372-R376 IonicContact OE1-NH1 2.79Å; E372-R376 IonicContact OE1-NH2 2.66Å; E372-R376 PolarHBondContact OE1-NH2 3.08Å; E372-R376 IonicContact OE2-CZ 3.5Å; E372-R376 IonicContact OE2-NH1 3.37Å; E372-R376 PolarHBondContact OE2-NH1 3.24Å; E372-R376 IonicContact OE2-NH2 2.74Å; E372-R376 PolarHBondContact OE2-NH2 3.22Å
373	G	92.4	Very high	90.9	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60	-42.6	171.9	0	0	0	0	0	112.9	A369 L370 R376 S377	A369-G373 PolarHBondContact O-N 2.63Å; L370-G373 PolarHBondContact O-N 3.46Å; G373-R376 PolarHBondContact O-N 3.24Å; G373-S377 WeakPolarHBondContact O-CB 3.42Å; G373-S377 PolarHBondContact O-N 2.98Å
374	L	90.5	Very high	91.1	Very high	26 Å²	26	58.4 Å²	58.4	14%	0.136	30%	0.301	C	S	.	.	H	α-helix	trans	-66.6	-39.3	178.2	-175.5	64.8	0	0	0	112	L330 R331 L370 T371 S377 T378	L330-L374 HydrophobicContact CB-CD1 4.02Å; R331-L374 HydrophobicContact CB-CD2 4.04Å; R331-L374 HydrophobicContact CG-CD1 4.28Å; R331-L374 HydrophobicContact CG-CD2 4.02Å; L370-L374 VanDerWaalsContact O-CB 3.24Å; L370-L374 WeakPolarHBondContact O-CB 3.44Å; L370-L374 PolarHBondContact O-N 3.49Å; T371-L374 PolarHBondContact O-N 2.97Å; L374-S377 PolarHBondContact O-N 3.39Å; L374-S377 PolarHBondContact O-OG 3.38Å; L374-T378 PolarHBondContact O-N 2.81Å; L374-T378 VanDerWaalsContact O-N 3.09Å; L374-T378 PolarHBondContact O-OG1 3.39Å
375	Q	90.6	Very high	91.2	Very high	118 Å²	118	55 Å²	55	55%	0.551	28%	0.277	S	S	*	.	H	α-helix	trans	-61.3	-53.5	172	178.3	174.1	-16.5	0	0	111	T371 E372 S377 T378 E379	T371-Q375 PolarHBondContact O-N 3.07Å; E372-Q375 PolarHBondContact O-N 3.08Å; Q375-S377 PolarHBondContact O-N 2.95Å; Q375-T378 WeakPolarHBondContact O-CB 3.31Å; Q375-T378 PolarHBondContact O-N 3.42Å; Q375-E379 VanDerWaalsContact CG-OE1 3.28Å; Q375-E379 WeakPolarHBondContact CG-OE1 3.48Å; Q375-E379 PolarHBondContact NE2-OE1 3.23Å; Q375-E379 PolarHBondContact O-N 2.91Å
376	R	91.4	Very high	91.3	Very high	114 Å²	114	57.6 Å²	57.6	43%	0.43	28%	0.283	S	S	.	.	H	α-helix	trans	-53.9	-38.9	175.6	-70.2	177.6	-175.9	116.7	-5.4	112.1	E372 G373 E379 E380 W468	E372-R376 WeakPolarHBondContact O-CG 3.43Å; E372-R376 PolarHBondContact O-N 3.15Å; E372-R376 IonicContact OE1-CZ 3.36Å; E372-R376 IonicContact OE1-NH1 2.79Å; E372-R376 IonicContact OE1-NH2 2.66Å; E372-R376 PolarHBondContact OE1-NH2 3.08Å; E372-R376 IonicContact OE2-CZ 3.5Å; E372-R376 IonicContact OE2-NH1 3.37Å; E372-R376 PolarHBondContact OE2-NH1 3.24Å; E372-R376 IonicContact OE2-NH2 2.74Å; E372-R376 PolarHBondContact OE2-NH2 3.22Å; G373-R376 PolarHBondContact O-N 3.24Å; R376-E379 PolarHBondContact O-N 3.46Å; R376-E380 WeakPolarHBondContact O-CB 3.46Å; R376-E380 PolarHBondContact O-N 2.91Å; R376-W468 HydrophobicContact CB-CH2 3.84Å; R376-W468 HydrophobicContact CB-CZ3 4.44Å
377	S	90.5	Very high	91.4	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.007	31%	0.307	C	S	.	.	H	α-helix	trans	-63	-42.4	176.9	84.1	0	0	0	0	112.1	G373 L374 Q375 E380 C381	G373-S377 WeakPolarHBondContact O-CB 3.42Å; G373-S377 PolarHBondContact O-N 2.98Å; L374-S377 PolarHBondContact O-N 3.39Å; L374-S377 PolarHBondContact O-OG 3.38Å; Q375-S377 PolarHBondContact O-N 2.95Å; S377-E380 PolarHBondContact O-N 3.12Å; S377-C381 VanDerWaalsContact O-CB 3.24Å; S377-C381 WeakPolarHBondContact O-CB 3.44Å; S377-C381 PolarHBondContact O-N 3.47Å; S377-C381 PolarHBondContact O-SG 2.75Å
378	T	87.5	Confident	91.6	Very high	52 Å²	52	59.5 Å²	59.5	32%	0.319	29%	0.293	S	S	.	.	H	α-helix	trans	-66.4	-42.2	180	-56.3	0	0	0	0	110.9	L374 Q375 T382	L374-T378 PolarHBondContact O-N 2.81Å; L374-T378 VanDerWaalsContact O-N 3.09Å; L374-T378 PolarHBondContact O-OG1 3.39Å; Q375-T378 WeakPolarHBondContact O-CB 3.31Å; Q375-T378 PolarHBondContact O-N 3.42Å; T378-T382 WeakPolarHBondContact O-CB 3.48Å; T378-T382 WeakPolarHBondContact O-CG2 3.36Å; T378-T382 PolarHBondContact O-N 2.93Å; T378-T382 PolarHBondContact O-OG1 2.63Å
379	E	90.2	Very high	91.6	Very high	105 Å²	105	56.6 Å²	56.6	49%	0.491	27%	0.269	S	S	.	.	H	α-helix	trans	-66.1	-46	176.3	-67.4	172.5	-169.8	0	0	112.2	Q375 R376 T382 K383	Q375-E379 VanDerWaalsContact CG-OE1 3.28Å; Q375-E379 WeakPolarHBondContact CG-OE1 3.48Å; Q375-E379 PolarHBondContact NE2-OE1 3.23Å; Q375-E379 PolarHBondContact O-N 2.91Å; R376-E379 PolarHBondContact O-N 3.46Å; E379-T382 PolarHBondContact O-OG1 3.4Å; E379-T382 VanDerWaalsContact O-OG1 3.14Å; E379-K383 WeakPolarHBondContact O-CB 3.49Å; E379-K383 PolarHBondContact O-N 3.17Å
380	E	91	Very high	91.5	Very high	51 Å²	51	57.2 Å²	57.2	24%	0.238	27%	0.274	C	S	.	.	H	α-helix	trans	-66.2	-39.4	178.5	-157.2	-163.6	104.7	0	0	111.7	R376 S377 K384 W468 R471	R376-E380 WeakPolarHBondContact O-CB 3.46Å; R376-E380 PolarHBondContact O-N 2.91Å; S377-E380 PolarHBondContact O-N 3.12Å; E380-K384 HydrophobicContact CG-CD 4.25Å; E380-K384 WeakPolarHBondContact O-CB 3.45Å; E380-K384 WeakPolarHBondContact O-CG 3.43Å; E380-K384 PolarHBondContact O-N 3.12Å; E380-K384 WeakPolarHBondContact OE1-CE 3.48Å; E380-K384 IonicContact OE1-NZ 3.18Å; E380-K384 PolarHBondContact OE1-NZ 3.42Å; E380-W468 HydrophobicContact CB-CZ2 4.07Å; E380-W468 WeakPolarHBondContact OE2-CZ2 3.43Å; E380-R471 IonicContact OE2-NH1 2.72Å; E380-R471 PolarHBondContact OE2-NH1 3.03Å
381	C	89.3	Confident	91.6	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.007	29%	0.288	C	S	.	.	H	α-helix	trans	-70.6	-44.4	179.9	-65.7	0	0	0	0	112.6	S377 K384 T385 W461 L464	S377-C381 VanDerWaalsContact O-CB 3.24Å; S377-C381 WeakPolarHBondContact O-CB 3.44Å; S377-C381 PolarHBondContact O-N 3.47Å; S377-C381 PolarHBondContact O-SG 2.75Å; C381-K384 PolarHBondContact O-N 2.99Å; C381-T385 VanDerWaalsContact O-CB 3.25Å; C381-T385 WeakPolarHBondContact O-CB 3.33Å; C381-T385 PolarHBondContact O-N 2.78Å; C381-T385 PolarHBondContact O-OG1 3.48Å; C381-W461 HydrophobicContact CB-CE3 4.49Å; C381-W461 HydrophobicContact CB-CH2 3.47Å; C381-W461 VanDerWaalsContact CB-CH2 3.47Å; C381-W461 HydrophobicContact CB-CZ2 4.22Å; C381-W461 HydrophobicContact CB-CZ3 3.62Å; C381-L464 HydrophobicContact CB-CD1 4.1Å
382	T	88.5	Confident	91.7	Very high	44 Å²	44	59.5 Å²	59.5	27%	0.27	28%	0.279	S	S	.	.	H	α-helix	trans	-64.2	-41.7	175.8	50.9	0	0	0	0	111.5	T378 E379 T385 R386	T378-T382 WeakPolarHBondContact O-CB 3.48Å; T378-T382 WeakPolarHBondContact O-CG2 3.36Å; T378-T382 PolarHBondContact O-N 2.93Å; T378-T382 PolarHBondContact O-OG1 2.63Å; E379-T382 PolarHBondContact O-OG1 3.4Å; E379-T382 VanDerWaalsContact O-OG1 3.14Å; T382-T385 PolarHBondContact O-N 2.61Å; T382-R386 WeakPolarHBondContact O-CB 3.28Å; T382-R386 PolarHBondContact O-N 3.15Å
383	K	91.9	Very high	91.7	Very high	119 Å²	119	54.9 Å²	54.9	52%	0.517	26%	0.257	S	S	.	.	H	α-helix	trans	-57.8	-55.3	173.3	177.7	175	174.8	176.6	0	112.3	E379 T385 R386 E387	E379-K383 WeakPolarHBondContact O-CB 3.49Å; E379-K383 PolarHBondContact O-N 3.17Å; K383-T385 VanDerWaalsContact C-N 3.29Å; K383-T385 PolarHBondContact O-N 3.17Å; K383-R386 PolarHBondContact O-N 3.41Å; K383-E387 WeakPolarHBondContact CE-OE1 3.45Å; K383-E387 WeakPolarHBondContact CG-OE1 3.45Å; K383-E387 WeakPolarHBondContact O-CG 3.02Å; K383-E387 PolarHBondContact O-N 3.05Å
384	K	93.1	Very high	91.7	Very high	72 Å²	72	62.3 Å²	62.3	31%	0.313	29%	0.285	S	S	.	.	H	α-helix	trans	-63.7	-33.5	-179.4	-75.6	176.2	172.5	175	0	112.7	E380 C381 L388 L460 L464	E380-K384 HydrophobicContact CG-CD 4.25Å; E380-K384 WeakPolarHBondContact O-CB 3.45Å; E380-K384 WeakPolarHBondContact O-CG 3.43Å; E380-K384 PolarHBondContact O-N 3.12Å; E380-K384 WeakPolarHBondContact OE1-CE 3.48Å; E380-K384 IonicContact OE1-NZ 3.18Å; E380-K384 PolarHBondContact OE1-NZ 3.42Å; C381-K384 PolarHBondContact O-N 2.99Å; K384-L388 WeakPolarHBondContact O-CB 3.44Å; K384-L388 PolarHBondContact O-N 3.45Å; K384-L460 HydrophobicContact CB-CD1 4.39Å; K384-L460 HydrophobicContact CB-CD2 4.13Å; K384-L464 HydrophobicContact CB-CD1 4.43Å; K384-L464 HydrophobicContact CD-CD1 4.49Å; K384-L464 HydrophobicContact CD-CD2 3.85Å
385	T	91.9	Very high	91.8	Very high	1 Å²	1	66.3 Å²	66.3	1%	0.006	30%	0.302	C	S	.	.	H	α-helix	trans	-62.2	-49.4	173.1	-62.3	0	0	0	0	110.6	T146 C381 T382 K383 L388 A389 L457 W461	T146-T385 HydrophobicContact CG2-CG2 4.11Å; C381-T385 VanDerWaalsContact O-CB 3.25Å; C381-T385 WeakPolarHBondContact O-CB 3.33Å; C381-T385 PolarHBondContact O-N 2.78Å; C381-T385 PolarHBondContact O-OG1 3.48Å; T382-T385 PolarHBondContact O-N 2.61Å; K383-T385 VanDerWaalsContact C-N 3.29Å; K383-T385 PolarHBondContact O-N 3.17Å; T385-L388 PolarHBondContact O-N 2.93Å; T385-A389 VanDerWaalsContact O-CB 3.29Å; T385-A389 WeakPolarHBondContact O-CB 3.5Å; T385-A389 PolarHBondContact O-N 2.97Å; T385-L457 HydrophobicContact CG2-CD2 4.08Å; T385-W461 PolarHBondContact OG1-NE1 3.35Å
386	R	91.8	Very high	91.9	Very high	131 Å²	131	61.8 Å²	61.8	49%	0.494	28%	0.28	S	S	.	.	H	α-helix	trans	-62	-44	177.8	-168.3	-177.5	-63.2	128.7	1.3	112.7	T146 T382 K383 A389 A390	T146-R386 HydrophobicContact CG2-CB 3.76Å; T146-R386 HydrophobicContact CG2-CG 4.16Å; T382-R386 WeakPolarHBondContact O-CB 3.28Å; T382-R386 PolarHBondContact O-N 3.15Å; K383-R386 PolarHBondContact O-N 3.41Å; R386-A389 PolarHBondContact O-N 3.44Å; R386-A390 WeakPolarHBondContact O-CB 3.35Å; R386-A390 PolarHBondContact O-N 3.3Å
387	E	94.1	Very high	91.9	Very high	106 Å²	106	59.1 Å²	59.1	50%	0.495	27%	0.273	S	S	.	.	H	α-helix	trans	-60.9	-45.1	176.7	-72.6	170.9	178	0	0	112.1	K383 E391	K383-E387 WeakPolarHBondContact CE-OE1 3.45Å; K383-E387 WeakPolarHBondContact CG-OE1 3.45Å; K383-E387 WeakPolarHBondContact O-CG 3.02Å; K383-E387 PolarHBondContact O-N 3.05Å; E387-E391 WeakPolarHBondContact O-CB 3.39Å; E387-E391 PolarHBondContact O-N 3.47Å; E387-E391 VanDerWaalsContact O-N 3.15Å
388	L	94.8	Very high	92	Very high	44 Å²	44	61.8 Å²	61.8	23%	0.23	29%	0.291	C	S	.	.	H	α-helix	trans	-70	-41.1	178.9	-178.6	57.7	0	0	0	112.4	K384 T385 K392 A456 L457 L460	K384-L388 WeakPolarHBondContact O-CB 3.44Å; K384-L388 PolarHBondContact O-N 3.45Å; T385-L388 PolarHBondContact O-N 2.93Å; L388-K392 HydrophobicContact CD1-CG 3.99Å; L388-K392 HydrophobicContact CG-CG 4.49Å; L388-K392 WeakPolarHBondContact O-CB 3.33Å; L388-K392 WeakPolarHBondContact O-CG 3.4Å; L388-K392 PolarHBondContact O-N 3.03Å; L388-K392 VanDerWaalsContact O-N 3.09Å; L388-A456 HydrophobicContact CD2-CB 4.23Å; L388-L457 HydrophobicContact CD2-CD2 4.17Å; L388-L457 HydrophobicContact CG-CD2 4.36Å; L388-L460 HydrophobicContact CB-CD2 4.21Å; L388-L460 HydrophobicContact CD2-CB 3.9Å; L388-L460 HydrophobicContact CD2-CD2 3.71Å; L388-L460 HydrophobicContact CD2-CG 4.35Å
389	A	92.7	Very high	92.4	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-58.3	-59.1	174.9	0	0	0	0	0	110.6	P142 T385 R386 E391 K392 C393	P142-A389 HydrophobicContact CB-CB 4.01Å; T385-A389 VanDerWaalsContact O-CB 3.29Å; T385-A389 WeakPolarHBondContact O-CB 3.5Å; T385-A389 PolarHBondContact O-N 2.97Å; R386-A389 PolarHBondContact O-N 3.44Å; A389-E391 VanDerWaalsContact C-N 3.32Å; A389-E391 PolarHBondContact O-N 3.19Å; A389-K392 PolarHBondContact O-N 2.97Å; A389-K392 VanDerWaalsContact O-N 3.1Å; A389-C393 WeakPolarHBondContact O-CB 3.34Å; A389-C393 PolarHBondContact O-N 3.44Å; A389-C393 PolarHBondContact O-SG 2.96Å
390	A	92.1	Very high	92.5	Very high	35 Å²	35	60.1 Å²	60.1	29%	0.289	28%	0.278	S	S	.	.	H	α-helix	trans	-55.7	-43.8	-178.7	0	0	0	0	0	112.7	R386 K392 C393 R394	R386-A390 WeakPolarHBondContact O-CB 3.35Å; R386-A390 PolarHBondContact O-N 3.3Å; A390-K392 PolarHBondContact O-N 3.28Å; A390-C393 PolarHBondContact O-N 2.74Å; A390-R394 WeakPolarHBondContact O-CG 2.87Å; A390-R394 PolarHBondContact O-N 2.95Å
391	E	94.7	Very high	92.7	Very high	64 Å²	64	63.6 Å²	63.6	30%	0.299	29%	0.292	S	S	.	.	H	α-helix	trans	-66.6	-37.5	179.4	175.9	53.5	-164.6	0	0	113.2	E387 A389 R394 K395	E387-E391 WeakPolarHBondContact O-CB 3.39Å; E387-E391 PolarHBondContact O-N 3.47Å; E387-E391 VanDerWaalsContact O-N 3.15Å; A389-E391 VanDerWaalsContact C-N 3.32Å; A389-E391 PolarHBondContact O-N 3.19Å; E391-R394 IonicContact OE2-CZ 3.33Å; E391-R394 IonicContact OE2-NE 2.77Å; E391-R394 PolarHBondContact OE2-NE 2.97Å; E391-R394 VanDerWaalsContact OE2-NE 3.11Å; E391-R394 IonicContact OE2-NH2 2.91Å; E391-R394 PolarHBondContact OE2-NH2 3.14Å; E391-K395 PolarHBondContact O-N 2.92Å; E391-K395 WeakPolarHBondContact OE1-CE 3.41Å; E391-K395 IonicContact OE1-NZ 3.84Å; E391-K395 PolarHBondContact OE1-NZ 3.27Å
392	K	93.5	Very high	92.9	Very high	64 Å²	64	71.1 Å²	71.1	28%	0.278	32%	0.324	S	S	.	.	H	α-helix	trans	-73.5	-36.6	175.2	-64.7	-94	-169.9	155.1	0	111.8	L388 A389 A390 K395 K396 K452 I453	L388-K392 HydrophobicContact CD1-CG 3.99Å; L388-K392 HydrophobicContact CG-CG 4.49Å; L388-K392 WeakPolarHBondContact O-CB 3.33Å; L388-K392 WeakPolarHBondContact O-CG 3.4Å; L388-K392 PolarHBondContact O-N 3.03Å; L388-K392 VanDerWaalsContact O-N 3.09Å; A389-K392 PolarHBondContact O-N 2.97Å; A389-K392 VanDerWaalsContact O-N 3.1Å; A390-K392 PolarHBondContact O-N 3.28Å; K392-K395 CarbonylContact O-C 3.46Å; K392-K395 WeakPolarHBondContact O-CB 3.47Å; K392-K395 PolarHBondContact O-N 3.13Å; K392-K396 PolarHBondContact O-N 2.88Å; K392-K452 PolarHBondContact NZ-O 3.39Å; K392-I453 HydrophobicContact CB-CD1 4.22Å; K392-I453 HydrophobicContact CB-CG1 3.62Å; K392-I453 HydrophobicContact CD-CG1 4.38Å; K392-I453 HydrophobicContact CG-CG1 4.28Å
393	C	92.5	Very high	93.3	Very high	4 Å²	4	70.8 Å²	70.8	3%	0.027	32%	0.321	C	S	.	.	H	α-helix	trans	-61.1	-48.7	174.3	-72.8	0	0	0	0	111.7	H140 A389 A390 K395 K396 E397	H140-C393 HydrophobicContact CB-CB 4.43Å; H140-C393 VanDerWaalsContact CB-SG 3.56Å; H140-C393 WeakPolarHBondContact CD2-CB 3.49Å; A389-C393 WeakPolarHBondContact O-CB 3.34Å; A389-C393 PolarHBondContact O-N 3.44Å; A389-C393 PolarHBondContact O-SG 2.96Å; A390-C393 PolarHBondContact O-N 2.74Å; C393-K395 VanDerWaalsContact C-N 3.27Å; C393-K395 PolarHBondContact O-N 3.37Å; C393-K396 WeakPolarHBondContact O-CB 3.28Å; C393-K396 PolarHBondContact O-N 3.14Å; C393-K396 VanDerWaalsContact O-N 3.09Å; C393-E397 PolarHBondContact O-N 3.25Å
394	R	92.4	Very high	93.3	Very high	157 Å²	157	68.4 Å²	68.4	59%	0.592	31%	0.312	S	S	*	.	H	α-helix	trans	-53.1	-44.6	171.3	-73.4	-172.1	-65	-116.6	6.6	111.9	A390 E391 E397 S398	A390-R394 WeakPolarHBondContact O-CG 2.87Å; A390-R394 PolarHBondContact O-N 2.95Å; E391-R394 IonicContact OE2-CZ 3.33Å; E391-R394 IonicContact OE2-NE 2.77Å; E391-R394 PolarHBondContact OE2-NE 2.97Å; E391-R394 VanDerWaalsContact OE2-NE 3.11Å; E391-R394 IonicContact OE2-NH2 2.91Å; E391-R394 PolarHBondContact OE2-NH2 3.14Å; R394-E397 PolarHBondContact O-N 3.21Å; R394-S398 WeakPolarHBondContact O-CB 3.26Å; R394-S398 PolarHBondContact O-N 3.46Å
395	K	93.4	Very high	93.3	Very high	110 Å²	110	71.8 Å²	71.8	48%	0.478	33%	0.326	S	S	.	.	H	α-helix	trans	-65.2	-40.4	176.5	-81.6	164.6	167.1	153.2	0	112.9	E391 K392 C393 S398 K399	E391-K395 PolarHBondContact O-N 2.92Å; E391-K395 WeakPolarHBondContact OE1-CE 3.41Å; E391-K395 IonicContact OE1-NZ 3.84Å; E391-K395 PolarHBondContact OE1-NZ 3.27Å; K392-K395 CarbonylContact O-C 3.46Å; K392-K395 WeakPolarHBondContact O-CB 3.47Å; K392-K395 PolarHBondContact O-N 3.13Å; C393-K395 VanDerWaalsContact C-N 3.27Å; C393-K395 PolarHBondContact O-N 3.37Å; K395-S398 PolarHBondContact O-OG 2.9Å; K395-K399 WeakPolarHBondContact O-CG 3.39Å; K395-K399 PolarHBondContact O-N 2.96Å
396	K	92.3	Very high	93.3	Very high	23 Å²	23	75.4 Å²	75.4	10%	0.1	35%	0.352	C	S	.	.	H	α-helix	trans	-60.5	-51.3	173.8	175.3	176.8	179.5	176.4	0	111	R312 K392 C393 S398 K399 K400 Q449 D450	R312-K396 VanDerWaalsContact NH2-NZ 3.1Å; K392-K396 PolarHBondContact O-N 2.88Å; C393-K396 WeakPolarHBondContact O-CB 3.28Å; C393-K396 PolarHBondContact O-N 3.14Å; C393-K396 VanDerWaalsContact O-N 3.09Å; K396-S398 VanDerWaalsContact C-N 3.35Å; K396-S398 PolarHBondContact O-N 3.43Å; K396-K399 WeakPolarHBondContact O-CB 3.37Å; K396-K399 PolarHBondContact O-N 3.28Å; K396-K399 VanDerWaalsContact O-N 3.07Å; K396-K400 PolarHBondContact O-N 3.43Å; K396-Q449 HydrophobicContact CB-CB 4.04Å; K396-Q449 HydrophobicContact CB-CG 4.02Å; K396-Q449 HydrophobicContact CD-CB 3.81Å; K396-Q449 HydrophobicContact CD-CG 4.45Å; K396-Q449 HydrophobicContact CG-CB 3.76Å; K396-Q449 HydrophobicContact CG-CG 3.85Å; K396-D450 IonicContact NZ-OD1 3.05Å; K396-D450 PolarHBondContact NZ-OD1 3.41Å; K396-D450 IonicContact NZ-OD2 3.13Å
397	E	91.9	Very high	93.4	Very high	58 Å²	58	69.5 Å²	69.5	27%	0.271	33%	0.33	S	S	.	.	H	α-helix	trans	-64.8	-38.4	-177.5	-171.7	54.5	-152.7	0	0	112	C393 R394 K399 K400 K401	C393-E397 PolarHBondContact O-N 3.25Å; R394-E397 PolarHBondContact O-N 3.21Å; E397-K399 PolarHBondContact O-N 2.88Å; E397-K400 PolarHBondContact O-N 2.89Å; E397-K400 VanDerWaalsContact O-N 3.15Å; E397-K401 HydrophobicContact CG-CD 4.38Å; E397-K401 HydrophobicContact CG-CG 4.48Å; E397-K401 PolarHBondContact O-N 3.41Å; E397-K401 WeakPolarHBondContact OE1-CE 3.45Å; E397-K401 WeakPolarHBondContact OE1-CG 3.47Å
398	S	93.3	Very high	93.1	Very high	56 Å²	56	70.1 Å²	70.1	39%	0.392	33%	0.334	S	S	.	.	H	α-helix	trans	-59.8	-29.2	173.9	81	0	0	0	0	113.7	R394 K395 K396 K402	R394-S398 WeakPolarHBondContact O-CB 3.26Å; R394-S398 PolarHBondContact O-N 3.46Å; K395-S398 PolarHBondContact O-OG 2.9Å; K396-S398 VanDerWaalsContact C-N 3.35Å; K396-S398 PolarHBondContact O-N 3.43Å; S398-K402 WeakPolarHBondContact O-CD 3.3Å; S398-K402 VanDerWaalsContact O-CG 3.26Å; S398-K402 WeakPolarHBondContact O-CG 3.33Å; S398-K402 PolarHBondContact O-N 3.31Å
399	K	95.1	Very high	92.8	Very high	89 Å²	89	71.8 Å²	71.8	39%	0.387	34%	0.343	S	S	.	.	H	α-helix	trans	-80.9	-41.6	174.7	-66.3	173.3	-175.6	-179	0	111.2	K395 K396 E397 K402 L403 L445	K395-K399 WeakPolarHBondContact O-CG 3.39Å; K395-K399 PolarHBondContact O-N 2.96Å; K396-K399 WeakPolarHBondContact O-CB 3.37Å; K396-K399 PolarHBondContact O-N 3.28Å; K396-K399 VanDerWaalsContact O-N 3.07Å; E397-K399 PolarHBondContact O-N 2.88Å; K399-K402 PolarHBondContact O-N 2.64Å; K399-L403 PolarHBondContact O-N 3.47Å; K399-L445 HydrophobicContact CB-CD1 4.18Å; K399-L445 HydrophobicContact CB-CD2 4.16Å; K399-L445 HydrophobicContact CD-CD1 4.27Å
400	K	93.1	Very high	92.7	Very high	33 Å²	33	74.8 Å²	74.8	14%	0.143	36%	0.357	C	S	.	.	H	α-helix	trans	-58.1	-49.6	177	-171.2	169.8	178.8	171.1	0	111.2	K396 E397 K402 L403 Q404 E446	K396-K400 PolarHBondContact O-N 3.43Å; E397-K400 PolarHBondContact O-N 2.89Å; E397-K400 VanDerWaalsContact O-N 3.15Å; K400-K402 VanDerWaalsContact C-N 3.33Å; K400-K402 PolarHBondContact O-N 2.77Å; K400-L403 PolarHBondContact O-N 3.4Å; K400-Q404 WeakPolarHBondContact O-CB 3.39Å; K400-Q404 WeakPolarHBondContact O-CG 3.45Å; K400-Q404 PolarHBondContact O-N 3.35Å; K400-Q404 PolarHBondContact O-OE1 3.4Å; K400-E446 WeakPolarHBondContact CE-OE1 3.34Å; K400-E446 IonicContact NZ-OE1 2.72Å; K400-E446 PolarHBondContact NZ-OE1 3Å
401	K	93.5	Very high	92.4	Very high	124 Å²	124	76 Å²	76	54%	0.539	35%	0.354	S	S	.	.	H	α-helix	trans	-60.6	-37.2	175.7	-66.4	-173.6	179.6	-172.5	0	113	E397 K405	E397-K401 HydrophobicContact CG-CD 4.38Å; E397-K401 HydrophobicContact CG-CG 4.48Å; E397-K401 PolarHBondContact O-N 3.41Å; E397-K401 WeakPolarHBondContact OE1-CE 3.45Å; E397-K401 WeakPolarHBondContact OE1-CG 3.47Å; K401-K405 PolarHBondContact O-N 2.95Å; K401-K405 VanDerWaalsContact O-N 3.1Å
402	K	95.4	Very high	91.9	Very high	159 Å²	159	75.4 Å²	75.4	69%	0.691	36%	0.357	S	S	*	.	H	α-helix	trans	-66.7	-44.6	174.4	-76.7	174.1	-178.3	-178.8	0	112.5	S398 K399 K400 K405 S406	S398-K402 WeakPolarHBondContact O-CD 3.3Å; S398-K402 VanDerWaalsContact O-CG 3.26Å; S398-K402 WeakPolarHBondContact O-CG 3.33Å; S398-K402 PolarHBondContact O-N 3.31Å; K399-K402 PolarHBondContact O-N 2.64Å; K400-K402 VanDerWaalsContact C-N 3.33Å; K400-K402 PolarHBondContact O-N 2.77Å; K402-K405 PolarHBondContact O-N 2.98Å; K402-S406 PolarHBondContact O-N 2.84Å
403	L	95.3	Very high	91.5	Very high	38 Å²	38	78.7 Å²	78.7	20%	0.199	37%	0.372	C	S	.	.	H	α-helix	trans	-62.2	-49.3	176.3	177.8	61	0	0	0	111	K399 K400 K405 S406 Q407 Q441 I442 L445	K399-L403 PolarHBondContact O-N 3.47Å; K400-L403 PolarHBondContact O-N 3.4Å; L403-K405 VanDerWaalsContact C-N 3.33Å; L403-K405 PolarHBondContact O-N 3.39Å; L403-S406 WeakPolarHBondContact O-CA 3.13Å; L403-S406 WeakPolarHBondContact O-CB 3.34Å; L403-S406 PolarHBondContact O-N 3.04Å; L403-Q407 HydrophobicContact CD1-CG 4.13Å; L403-Q407 HydrophobicContact CG-CG 4.33Å; L403-Q407 WeakPolarHBondContact O-CG 3.43Å; L403-Q407 PolarHBondContact O-N 2.86Å; L403-Q441 HydrophobicContact CD1-CB 4.44Å; L403-Q441 HydrophobicContact CD2-CB 4.15Å; L403-I442 HydrophobicContact CD2-CG1 3.91Å; L403-L445 HydrophobicContact CB-CD2 4.31Å; L403-L445 HydrophobicContact CD2-CB 4.44Å; L403-L445 HydrophobicContact CD2-CD2 3.81Å
404	Q	91.9	Very high	90.9	Very high	69 Å²	69	79.9 Å²	79.9	32%	0.322	38%	0.382	S	S	.	.	H	α-helix	trans	-57.6	-41.6	178.2	-72.7	170.2	-40.9	0	0	112.5	K400 S406 Q407 M408	K400-Q404 WeakPolarHBondContact O-CB 3.39Å; K400-Q404 WeakPolarHBondContact O-CG 3.45Å; K400-Q404 PolarHBondContact O-N 3.35Å; K400-Q404 PolarHBondContact O-OE1 3.4Å; Q404-S406 VanDerWaalsContact C-N 3.32Å; Q404-S406 PolarHBondContact O-N 3.42Å; Q404-Q407 PolarHBondContact O-N 3.37Å; Q404-M408 WeakPolarHBondContact O-CB 3.29Å; Q404-M408 PolarHBondContact O-N 2.68Å
405	K	93.1	Very high	90.1	Very high	142 Å²	142	74.4 Å²	74.4	62%	0.617	36%	0.364	S	S	*	.	H	α-helix	trans	-62.9	-37.4	174.4	-174	170.7	-178.7	173.3	0	112.4	K401 K402 L403 N409	K401-K405 PolarHBondContact O-N 2.95Å; K401-K405 VanDerWaalsContact O-N 3.1Å; K402-K405 PolarHBondContact O-N 2.98Å; L403-K405 VanDerWaalsContact C-N 3.33Å; L403-K405 PolarHBondContact O-N 3.39Å; K405-N409 VanDerWaalsContact O-CG 3.32Å; K405-N409 PolarHBondContact O-N 3.12Å; K405-N409 PolarHBondContact O-OD1 3.5Å
406	S	93	Very high	89.1	Confident	77 Å²	77	75.6 Å²	75.6	54%	0.538	37%	0.372	S	S	.	.	H	α-helix	trans	-66.8	-43.3	174	-164.7	0	0	0	0	111.8	K402 L403 Q404 M408 N409 E410	K402-S406 PolarHBondContact O-N 2.84Å; L403-S406 WeakPolarHBondContact O-CA 3.13Å; L403-S406 WeakPolarHBondContact O-CB 3.34Å; L403-S406 PolarHBondContact O-N 3.04Å; Q404-S406 VanDerWaalsContact C-N 3.32Å; Q404-S406 PolarHBondContact O-N 3.42Å; S406-M408 PolarHBondContact O-N 2.93Å; S406-N409 PolarHBondContact O-N 2.88Å; S406-E410 PolarHBondContact O-N 2.99Å
407	Q	92.9	Very high	88	Confident	7 Å²	7	80.4 Å²	80.4	3%	0.033	40%	0.398	C	S	.	.	H	α-helix	trans	-67	-34.1	179.7	-71	179	-20.7	0	0	112.6	L403 Q404 E410 R411 Q438	L403-Q407 HydrophobicContact CD1-CG 4.13Å; L403-Q407 HydrophobicContact CG-CG 4.33Å; L403-Q407 WeakPolarHBondContact O-CG 3.43Å; L403-Q407 PolarHBondContact O-N 2.86Å; Q404-Q407 PolarHBondContact O-N 3.37Å; Q407-E410 PolarHBondContact O-N 2.83Å; Q407-R411 WeakPolarHBondContact O-CB 3.37Å; Q407-R411 VanDerWaalsContact O-CG 3.32Å; Q407-R411 WeakPolarHBondContact O-CG 2.79Å; Q407-R411 PolarHBondContact O-N 3.47Å; Q407-Q438 HydrophobicContact CB-CG 4.22Å; Q407-Q438 HydrophobicContact CG-CB 4.21Å; Q407-Q438 HydrophobicContact CG-CG 3.8Å; Q407-Q438 PolarHBondContact NE2-O 3.03Å; Q407-Q438 PolarHBondContact O-NE2 3.5Å; Q407-Q438 VanDerWaalsContact O-NE2 3.12Å
408	M	89	Confident	86.7	Confident	119 Å²	119	79.1 Å²	79.1	59%	0.586	40%	0.4	S	S	*	.	H	α-helix	trans	-63.4	-42.6	172.1	-172.7	176.2	71.6	0	0	111.9	Q404 S406 E410 R411 S412	Q404-M408 WeakPolarHBondContact O-CB 3.29Å; Q404-M408 PolarHBondContact O-N 2.68Å; S406-M408 PolarHBondContact O-N 2.93Å; M408-E410 VanDerWaalsContact C-N 3.33Å; M408-R411 PolarHBondContact O-N 2.85Å; M408-S412 PolarHBondContact O-N 3.28Å
409	N	88.4	Confident	85.2	Confident	80 Å²	80	80.8 Å²	80.8	43%	0.428	40%	0.404	S	S	.	.	H	α-helix	trans	-71	-26.1	175.5	-65.7	-3.2	0	0	0	113.1	K405 S406 S412 K413	K405-N409 VanDerWaalsContact O-CG 3.32Å; K405-N409 PolarHBondContact O-N 3.12Å; K405-N409 PolarHBondContact O-OD1 3.5Å; S406-N409 PolarHBondContact O-N 2.88Å; N409-S412 PolarHBondContact O-OG 3.29Å; N409-K413 WeakPolarHBondContact O-CG 3.41Å
410	E	90.2	Very high	83.6	Confident	63 Å²	63	82.4 Å²	82.4	29%	0.294	42%	0.421	S	S	.	.	H	α-helix	trans	-73.6	-43.7	171.2	-173.2	-175.7	-161.7	0	0	110.4	S406 Q407 M408 K413 A414 L434 R437 Q438	S406-E410 PolarHBondContact O-N 2.99Å; Q407-E410 PolarHBondContact O-N 2.83Å; M408-E410 VanDerWaalsContact C-N 3.33Å; E410-K413 PolarHBondContact O-N 2.86Å; E410-A414 WeakPolarHBondContact O-CB 3.28Å; E410-A414 PolarHBondContact O-N 3.37Å; E410-L434 VanDerWaalsContact CD-CD1 3.47Å; E410-L434 HydrophobicContact CG-CD1 3.93Å; E410-L434 WeakPolarHBondContact OE1-CD1 3.23Å; E410-R437 IonicContact OE1-NH1 3.46Å; E410-Q438 PolarHBondContact OE2-NE2 3.26Å
411	R	86.5	Confident	82	Confident	59 Å²	59	86.3 Å²	86.3	22%	0.223	44%	0.435	C	S	.	.	H	α-helix	trans	-56.3	-51.3	174.2	-74.9	175.3	-167.6	-149.3	-6.4	110.8	E174 Q407 M408 K413 A414 L415 Q438	E174-R411 IonicContact OE1-CZ 3.49Å; E174-R411 IonicContact OE1-NH1 3.19Å; E174-R411 IonicContact OE1-NH2 2.94Å; E174-R411 PolarHBondContact OE1-NH2 2.88Å; Q407-R411 WeakPolarHBondContact O-CB 3.37Å; Q407-R411 VanDerWaalsContact O-CG 3.32Å; Q407-R411 WeakPolarHBondContact O-CG 2.79Å; Q407-R411 PolarHBondContact O-N 3.47Å; M408-R411 PolarHBondContact O-N 2.85Å; R411-K413 PolarHBondContact O-N 3.49Å; R411-A414 PolarHBondContact O-N 2.99Å; R411-A414 VanDerWaalsContact O-N 3.17Å; R411-L415 VanDerWaalsContact O-CG 3.3Å; R411-L415 WeakPolarHBondContact O-CG 3.43Å; R411-L415 PolarHBondContact O-N 3.35Å; R411-Q438 VanDerWaalsContact NH2-OE1 3.09Å
412	S	83.3	Confident	80.6	Confident	52 Å²	52	86.4 Å²	86.4	36%	0.364	45%	0.45	S	S	.	.	H	α-helix	trans	-57.9	-44.9	-177.8	67.3	0	0	0	0	112.8	M408 N409 A414 L415 E416	M408-S412 PolarHBondContact O-N 3.28Å; N409-S412 PolarHBondContact O-OG 3.29Å; S412-A414 PolarHBondContact O-N 2.82Å; S412-L415 WeakPolarHBondContact O-CB 3.4Å; S412-L415 PolarHBondContact O-N 3.28Å; S412-E416 WeakPolarHBondContact O-CG 3.28Å; S412-E416 PolarHBondContact O-N 3.31Å; S412-E416 VanDerWaalsContact O-N 3.09Å
413	K	84.2	Confident	80	Confident	133 Å²	133	82.2 Å²	82.2	58%	0.578	44%	0.435	S	S	*	.	H	α-helix	trans	-64.7	-39	176.5	-68.4	176.8	179.4	-171.7	0	113.2	N409 E410 R411 L415 E416 L417	N409-K413 WeakPolarHBondContact O-CG 3.41Å; E410-K413 PolarHBondContact O-N 2.86Å; R411-K413 PolarHBondContact O-N 3.49Å; K413-L415 VanDerWaalsContact C-N 3.28Å; K413-L415 PolarHBondContact O-N 3.02Å; K413-E416 PolarHBondContact O-N 3.15Å; K413-L417 WeakPolarHBondContact O-CG 3.43Å; K413-L417 PolarHBondContact O-N 2.81Å
414	A	81.1	Confident	79.4	Confident	30 Å²	30	80.7 Å²	80.7	25%	0.248	43%	0.427	C	S	.	.	H	α-helix	trans	-64.8	-34.3	176.3	0	0	0	0	0	111.9	E410 R411 S412 G418 L434	E410-A414 WeakPolarHBondContact O-CB 3.28Å; E410-A414 PolarHBondContact O-N 3.37Å; R411-A414 PolarHBondContact O-N 2.99Å; R411-A414 VanDerWaalsContact O-N 3.17Å; S412-A414 PolarHBondContact O-N 2.82Å; A414-G418 PolarHBondContact O-N 2.89Å; A414-L434 HydrophobicContact CB-CD2 3.48Å; A414-L434 VanDerWaalsContact CB-CD2 3.48Å
415	L	75.2	Confident	79.2	Confident	42 Å²	42	82.3 Å²	82.3	22%	0.22	44%	0.435	C	S	.	.	H	α-helix	trans	-70.4	-37.8	175	-63.5	-179.1	0	0	0	112.6	L177 Q181 R411 S412 K413 Y431	L177-L415 HydrophobicContact CD1-CD1 4.49Å; Q181-L415 HydrophobicContact CG-CD2 3.51Å; R411-L415 VanDerWaalsContact O-CG 3.3Å; R411-L415 WeakPolarHBondContact O-CG 3.43Å; R411-L415 PolarHBondContact O-N 3.35Å; S412-L415 WeakPolarHBondContact O-CB 3.4Å; S412-L415 PolarHBondContact O-N 3.28Å; K413-L415 VanDerWaalsContact C-N 3.28Å; K413-L415 PolarHBondContact O-N 3.02Å; L415-Y431 HydrophobicContact CD2-CD2 4.05Å; L415-Y431 HydrophobicContact CD2-CE2 3.41Å; L415-Y431 VanDerWaalsContact CD2-CE2 3.41Å; L415-Y431 HydrophobicContact CG-CE2 4.14Å
416	E	72.8	Confident	78.8	Confident	135 Å²	135	79.9 Å²	79.9	63%	0.631	43%	0.426	S	S	*	.	H	α-helix	trans	-64.2	-44	174.1	-70.8	161.6	-173.4	0	0	111.8	S412 K413	S412-E416 WeakPolarHBondContact O-CG 3.28Å; S412-E416 PolarHBondContact O-N 3.31Å; S412-E416 VanDerWaalsContact O-N 3.09Å; K413-E416 PolarHBondContact O-N 3.15Å
417	L	69.8	Low	78.3	Confident	123 Å²	123	77.3 Å²	77.3	64%	0.644	41%	0.405	S	S	*	.	H	α-helix	trans	-70.1	-36.5	178	-72.2	165.4	0	0	0	113	K413 L419 T420	K413-L417 WeakPolarHBondContact O-CG 3.43Å; K413-L417 PolarHBondContact O-N 2.81Å; L417-L419 PolarHBondContact O-N 3.05Å; L417-T420 PolarHBondContact O-N 3.44Å; L417-T420 PolarHBondContact O-OG1 2.98Å
418	G	63.7	Low	78.1	Confident	31 Å²	31	77.6 Å²	77.6	32%	0.32	41%	0.407	S	S	.	.	H	α-helix	trans	-58.5	-30.9	-173	0	0	0	0	0	114.5	A414 T420 R421 Q427	A414-G418 PolarHBondContact O-N 2.89Å; G418-T420 PolarHBondContact O-N 3.1Å; G418-R421 PolarHBondContact O-N 3.37Å; G418-Q427 PolarHBondContact O-NE2 3.03Å
419	L	62.5	Low	78	Confident	91 Å²	91	75 Å²	75	48%	0.476	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-4.3	-178.3	-65.6	170.6	0	0	0	115.1	L417	L417-L419 PolarHBondContact O-N 3.05Å
420	T	61.8	Low	77.9	Confident	123 Å²	123	75 Å²	75	76%	0.755	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-6.7	-178.5	58.2	0	0	0	0	114.8	L417 G418	L417-T420 PolarHBondContact O-N 3.44Å; L417-T420 PolarHBondContact O-OG1 2.98Å; G418-T420 PolarHBondContact O-N 3.1Å
421	R	58.8	Low	77.8	Confident	116 Å²	116	73 Å²	73	44%	0.438	39%	0.39	S	S	.	.			trans	-103.4	151.8	-178.4	-164.2	171.3	-173	137.4	-1.5	110.4	G418 E426 Q427 I430	G418-R421 PolarHBondContact O-N 3.37Å; R421-E426 IonicContact CZ-OE2 2.67Å; R421-E426 IonicContact NE-OE2 3.86Å; R421-E426 PolarHBondContact NE-OE2 3.39Å; R421-E426 IonicContact NH2-OE1 2.7Å; R421-E426 PolarHBondContact NH2-OE1 3.26Å; R421-E426 IonicContact NH2-OE2 2.63Å; R421-E426 PolarHBondContact NH2-OE2 3.16Å; R421-Q427 HydrophobicContact CB-CG 3.86Å; R421-Q427 HydrophobicContact CG-CG 4.17Å; R421-Q427 PolarHBondContact O-NE2 3.2Å; R421-I430 VanDerWaalsContact NH1-CD1 3.31Å
422	C	64.6	Low	77.9	Confident	126 Å²	126	71.3 Å²	71.3	85%	0.851	39%	0.385	S	S	*	.			trans	-101.8	-26.1	-170.1	-60.4	0	0	0	0	115.3
423	D	81.1	Confident	78.3	Confident	70 Å²	70	73.5 Å²	73.5	37%	0.374	39%	0.389	S	S	.	.			trans	-92	129.2	179.1	-179.6	58	0	0	0	113.3	Q425 E426 Q427	D423-Q425 WeakPolarHBondContact OD2-CA 3.49Å; D423-Q425 WeakPolarHBondContact OD2-CB 3.44Å; D423-Q425 PolarHBondContact OD2-N 3.47Å; D423-E426 HydrophobicContact CB-CB 4.21Å; D423-E426 HydrophobicContact CB-CG 4.19Å; D423-E426 WeakPolarHBondContact OD2-CG 3.47Å; D423-E426 PolarHBondContact OD2-N 2.99Å; D423-Q427 WeakPolarHBondContact O-CB 3.49Å; D423-Q427 VanDerWaalsContact O-CG 3.27Å; D423-Q427 WeakPolarHBondContact O-CG 3.37Å; D423-Q427 PolarHBondContact O-N 3.48Å; D423-Q427 VanDerWaalsContact O-N 3.12Å; D423-Q427 PolarHBondContact O-OE1 2.91Å
424	L	84.7	Confident	78.6	Confident	7 Å²	7	67.7 Å²	67.7	4%	0.037	36%	0.364	C	S	.	.	H	α-helix	trans	-68.6	-37.4	-175.8	-166.1	71.8	0	0	0	112.6	M182 V185 I186 S286 T290 T428	M182-L424 HydrophobicContact CB-CD1 3.9Å; M182-L424 HydrophobicContact CE-CD2 4.22Å; M182-L424 HydrophobicContact CG-CD1 4.15Å; M182-L424 HydrophobicContact CG-CG 4.39Å; V185-L424 HydrophobicContact CB-CD1 3.9Å; V185-L424 HydrophobicContact CG1-CD1 3.83Å; I186-L424 HydrophobicContact CD1-CD1 4.28Å; I186-L424 HydrophobicContact CD1-CD2 4.01Å; I186-L424 HydrophobicContact CG1-CD1 4.17Å; S286-L424 WeakPolarHBondContact OG-CD2 3.47Å; T290-L424 HydrophobicContact CG2-CG 4.39Å; L424-T428 VanDerWaalsContact O-CB 3.29Å; L424-T428 WeakPolarHBondContact O-CB 3.49Å; L424-T428 PolarHBondContact O-N 3.31Å; L424-T428 PolarHBondContact O-OG1 2.69Å
425	Q	85.8	Confident	79	Confident	102 Å²	102	66.5 Å²	66.5	48%	0.477	35%	0.354	S	S	.	.	H	α-helix	trans	-77.9	-42.7	-175.3	-172.7	173.3	-16.1	0	0	110.7	D423 T428 S429	D423-Q425 WeakPolarHBondContact OD2-CA 3.49Å; D423-Q425 WeakPolarHBondContact OD2-CB 3.44Å; D423-Q425 PolarHBondContact OD2-N 3.47Å; Q425-T428 PolarHBondContact O-N 2.91Å; Q425-S429 WeakPolarHBondContact O-CB 3.27Å; Q425-S429 PolarHBondContact O-N 3.29Å
426	E	84.9	Confident	79.8	Confident	92 Å²	92	68.7 Å²	68.7	43%	0.43	36%	0.364	S	S	.	.	H	α-helix	trans	-58.1	-49.7	170.4	-73.3	-169.7	152.1	0	0	111.8	R421 D423 T428 S429 I430	R421-E426 IonicContact CZ-OE2 2.67Å; R421-E426 IonicContact NE-OE2 3.86Å; R421-E426 PolarHBondContact NE-OE2 3.39Å; R421-E426 IonicContact NH2-OE1 2.7Å; R421-E426 PolarHBondContact NH2-OE1 3.26Å; R421-E426 IonicContact NH2-OE2 2.63Å; R421-E426 PolarHBondContact NH2-OE2 3.16Å; D423-E426 HydrophobicContact CB-CB 4.21Å; D423-E426 HydrophobicContact CB-CG 4.19Å; D423-E426 WeakPolarHBondContact OD2-CG 3.47Å; D423-E426 PolarHBondContact OD2-N 2.99Å; E426-T428 VanDerWaalsContact C-N 3.32Å; E426-T428 PolarHBondContact O-N 3.32Å; E426-S429 PolarHBondContact O-N 2.99Å; E426-I430 WeakPolarHBondContact O-CD1 3.46Å; E426-I430 VanDerWaalsContact O-CG1 3.25Å; E426-I430 WeakPolarHBondContact O-CG1 3.4Å; E426-I430 PolarHBondContact O-N 3.15Å
427	Q	84.1	Confident	80.7	Confident	23 Å²	23	67 Å²	67	11%	0.107	35%	0.352	C	S	.	.	H	α-helix	trans	-58.7	-44.5	177.5	-78.6	167	-46	0	0	111.9	V185 G418 R421 D423 I430 Y431	V185-Q427 VanDerWaalsContact CG2-OE1 3.28Å; G418-Q427 PolarHBondContact O-NE2 3.03Å; R421-Q427 HydrophobicContact CB-CG 3.86Å; R421-Q427 HydrophobicContact CG-CG 4.17Å; R421-Q427 PolarHBondContact O-NE2 3.2Å; D423-Q427 WeakPolarHBondContact O-CB 3.49Å; D423-Q427 VanDerWaalsContact O-CG 3.27Å; D423-Q427 WeakPolarHBondContact O-CG 3.37Å; D423-Q427 PolarHBondContact O-N 3.48Å; D423-Q427 VanDerWaalsContact O-N 3.12Å; D423-Q427 PolarHBondContact O-OE1 2.91Å; Q427-I430 PolarHBondContact O-N 2.91Å; Q427-Y431 PolarHBondContact O-N 3.22Å
428	T	87.7	Confident	81.8	Confident	12 Å²	12	61.1 Å²	61.1	7%	0.074	32%	0.321	C	S	.	.	H	α-helix	trans	-64.3	-42	178.2	-61.5	0	0	0	0	111.1	I178 T290 L424 Q425 E426 Y431 Q432	I178-T428 HydrophobicContact CG2-CG2 3.78Å; T290-T428 HydrophobicContact CG2-CG2 3.77Å; T290-T428 VanDerWaalsContact CG2-OG1 3.29Å; T290-T428 WeakPolarHBondContact CG2-OG1 3.37Å; L424-T428 VanDerWaalsContact O-CB 3.29Å; L424-T428 WeakPolarHBondContact O-CB 3.49Å; L424-T428 PolarHBondContact O-N 3.31Å; L424-T428 PolarHBondContact O-OG1 2.69Å; Q425-T428 PolarHBondContact O-N 2.91Å; E426-T428 VanDerWaalsContact C-N 3.32Å; E426-T428 PolarHBondContact O-N 3.32Å; T428-Y431 PolarHBondContact O-N 3.38Å; T428-Q432 HydrophobicContact CG2-CG 4.47Å; T428-Q432 WeakPolarHBondContact O-CB 3.44Å; T428-Q432 VanDerWaalsContact O-CG 3.24Å; T428-Q432 WeakPolarHBondContact O-CG 3.45Å; T428-Q432 PolarHBondContact O-N 3.07Å
429	S	87.5	Confident	83	Confident	66 Å²	66	60.7 Å²	60.7	46%	0.462	31%	0.31	S	S	.	.	H	α-helix	trans	-62.5	-44	176.2	-174	0	0	0	0	112.6	Q425 E426 Y431 Q432 E433	Q425-S429 WeakPolarHBondContact O-CB 3.27Å; Q425-S429 PolarHBondContact O-N 3.29Å; E426-S429 PolarHBondContact O-N 2.99Å; S429-Y431 VanDerWaalsContact C-N 3.31Å; S429-Y431 PolarHBondContact O-N 3.06Å; S429-Q432 PolarHBondContact O-N 3.46Å; S429-E433 PolarHBondContact O-N 3Å
430	I	86.6	Confident	84.5	Confident	79 Å²	79	62.7 Å²	62.7	41%	0.405	32%	0.315	S	S	.	.	H	α-helix	trans	-63.1	-39.3	176.1	-66.6	159.3	0	0	0	111	R421 E426 Q427 E433 L434	R421-I430 VanDerWaalsContact NH1-CD1 3.31Å; E426-I430 WeakPolarHBondContact O-CD1 3.46Å; E426-I430 VanDerWaalsContact O-CG1 3.25Å; E426-I430 WeakPolarHBondContact O-CG1 3.4Å; E426-I430 PolarHBondContact O-N 3.15Å; Q427-I430 PolarHBondContact O-N 2.91Å; I430-E433 PolarHBondContact O-N 2.82Å; I430-L434 PolarHBondContact O-N 2.88Å; I430-L434 VanDerWaalsContact O-N 3.09Å
431	Y	86.9	Confident	86	Confident	20 Å²	20	60.2 Å²	60.2	8%	0.078	30%	0.295	C	S	.	.	H	α-helix	trans	-68.7	-39.8	176.7	-159.7	-105.9	0	0	0	112	L177 I178 L415 Q427 T428 S429 L434 L435	L177-Y431 HydrophobicContact CD2-CE1 4.2Å; L177-Y431 WeakPolarHBondContact CD2-OH 3.45Å; L177-Y431 HydrophobicContact CG-CE1 4.15Å; I178-Y431 HydrophobicContact CG1-CD1 3.94Å; I178-Y431 HydrophobicContact CG1-CE1 4.48Å; L415-Y431 HydrophobicContact CD2-CD2 4.05Å; L415-Y431 HydrophobicContact CD2-CE2 3.41Å; L415-Y431 VanDerWaalsContact CD2-CE2 3.41Å; L415-Y431 HydrophobicContact CG-CE2 4.14Å; Q427-Y431 PolarHBondContact O-N 3.22Å; T428-Y431 PolarHBondContact O-N 3.38Å; S429-Y431 VanDerWaalsContact C-N 3.31Å; S429-Y431 PolarHBondContact O-N 3.06Å; Y431-L434 HydrophobicContact CD2-CD2 4.29Å; Y431-L434 HydrophobicContact CE2-CD2 4.14Å; Y431-L434 WeakPolarHBondContact O-CB 3.46Å; Y431-L434 PolarHBondContact O-N 3.3Å; Y431-L435 HydrophobicContact CD1-CD1 3.78Å; Y431-L435 HydrophobicContact CD1-CG 4.15Å; Y431-L435 HydrophobicContact CE1-CD1 3.76Å; Y431-L435 HydrophobicContact CE1-CD2 4.09Å; Y431-L435 HydrophobicContact CE1-CG 4.03Å; Y431-L435 VanDerWaalsContact O-CG 3.3Å; Y431-L435 WeakPolarHBondContact O-CG 3.46Å; Y431-L435 PolarHBondContact O-N 3.2Å
432	Q	89.8	Confident	87.6	Confident	24 Å²	24	56.1 Å²	56.1	11%	0.112	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-41.7	172.7	-72.4	164.1	-10.8	0	0	112.2	I178 A294 T428 S429 L434 L435 M436	I178-Q432 HydrophobicContact CD1-CG 3.97Å; A294-Q432 VanDerWaalsContact CA-NE2 3.29Å; A294-Q432 VanDerWaalsContact CB-NE2 3.31Å; T428-Q432 HydrophobicContact CG2-CG 4.47Å; T428-Q432 WeakPolarHBondContact O-CB 3.44Å; T428-Q432 VanDerWaalsContact O-CG 3.24Å; T428-Q432 WeakPolarHBondContact O-CG 3.45Å; T428-Q432 PolarHBondContact O-N 3.07Å; S429-Q432 PolarHBondContact O-N 3.46Å; Q432-L434 VanDerWaalsContact C-N 3.33Å; Q432-L434 PolarHBondContact O-N 2.82Å; Q432-L435 PolarHBondContact O-N 3.42Å; Q432-M436 WeakPolarHBondContact O-CB 3.29Å; Q432-M436 PolarHBondContact O-N 2.86Å
433	E	89.9	Confident	88.9	Confident	99 Å²	99	50.7 Å²	50.7	46%	0.463	24%	0.244	S	C	.	.	H	α-helix	trans	-62.9	-39.9	176.5	-159.5	-128	121	0	0	111.6	S429 I430 M436 R437	S429-E433 PolarHBondContact O-N 3Å; I430-E433 PolarHBondContact O-N 2.82Å; E433-M436 PolarHBondContact O-N 2.98Å; E433-R437 VanDerWaalsContact CD-NH2 3.33Å; E433-R437 VanDerWaalsContact O-CB 3.27Å; E433-R437 WeakPolarHBondContact O-CB 3.48Å; E433-R437 PolarHBondContact O-N 3.41Å; E433-R437 IonicContact OE1-CZ 2.69Å; E433-R437 IonicContact OE1-NE 3.02Å; E433-R437 IonicContact OE1-NH2 2.76Å; E433-R437 PolarHBondContact OE1-NH2 2.72Å; E433-R437 IonicContact OE2-NH2 3.87Å
434	L	90.9	Very high	89.5	Confident	10 Å²	10	51.2 Å²	51.2	5%	0.052	25%	0.247	C	C	.	.	H	α-helix	trans	-60	-48.5	171.3	172.2	62.9	0	0	0	111.8	E410 A414 I430 Y431 Q432 R437 Q438	E410-L434 VanDerWaalsContact CD-CD1 3.47Å; E410-L434 HydrophobicContact CG-CD1 3.93Å; E410-L434 WeakPolarHBondContact OE1-CD1 3.23Å; A414-L434 HydrophobicContact CB-CD2 3.48Å; A414-L434 VanDerWaalsContact CB-CD2 3.48Å; I430-L434 PolarHBondContact O-N 2.88Å; I430-L434 VanDerWaalsContact O-N 3.09Å; Y431-L434 HydrophobicContact CD2-CD2 4.29Å; Y431-L434 HydrophobicContact CE2-CD2 4.14Å; Y431-L434 WeakPolarHBondContact O-CB 3.46Å; Y431-L434 PolarHBondContact O-N 3.3Å; Q432-L434 VanDerWaalsContact C-N 3.33Å; Q432-L434 PolarHBondContact O-N 2.82Å; L434-R437 WeakPolarHBondContact O-CB 3.04Å; L434-R437 PolarHBondContact O-N 3.09Å; L434-Q438 HydrophobicContact CD1-CG 4.25Å; L434-Q438 VanDerWaalsContact O-CG 3.31Å; L434-Q438 WeakPolarHBondContact O-CG 3.42Å; L434-Q438 PolarHBondContact O-N 3.11Å
435	L	90.4	Very high	90	Very high	6 Å²	6	52.5 Å²	52.5	3%	0.031	25%	0.254	C	S	.	.	H	α-helix	trans	-63.2	-42.3	178.7	-64.9	173.7	0	0	0	111.8	E174 I178 Y431 Q432 Q438 R439	E174-L435 HydrophobicContact CB-CD1 3.96Å; E174-L435 HydrophobicContact CG-CD1 3.94Å; E174-L435 HydrophobicContact CG-CD2 4.07Å; I178-L435 HydrophobicContact CD1-CD1 4.18Å; I178-L435 HydrophobicContact CG1-CD1 4.44Å; Y431-L435 HydrophobicContact CD1-CD1 3.78Å; Y431-L435 HydrophobicContact CD1-CG 4.15Å; Y431-L435 HydrophobicContact CE1-CD1 3.76Å; Y431-L435 HydrophobicContact CE1-CD2 4.09Å; Y431-L435 HydrophobicContact CE1-CG 4.03Å; Y431-L435 VanDerWaalsContact O-CG 3.3Å; Y431-L435 WeakPolarHBondContact O-CG 3.46Å; Y431-L435 PolarHBondContact O-N 3.2Å; Q432-L435 PolarHBondContact O-N 3.42Å; L435-Q438 PolarHBondContact O-N 2.79Å; L435-R439 WeakPolarHBondContact O-CB 3.46Å; L435-R439 PolarHBondContact O-N 2.92Å
436	M	90.9	Very high	90.3	Very high	87 Å²	87	48.4 Å²	48.4	43%	0.429	24%	0.235	S	C	.	.	H	α-helix	trans	-59.6	-46.9	174.5	-174.1	-156	-64.5	0	0	111.3	Q432 E433 Q438 R439 K440	Q432-M436 WeakPolarHBondContact O-CB 3.29Å; Q432-M436 PolarHBondContact O-N 2.86Å; E433-M436 PolarHBondContact O-N 2.98Å; M436-Q438 VanDerWaalsContact C-N 3.3Å; M436-Q438 PolarHBondContact O-N 3.36Å; M436-R439 PolarHBondContact O-N 3.49Å; M436-K440 WeakPolarHBondContact O-CB 3.46Å; M436-K440 PolarHBondContact O-N 2.91Å
437	R	92.4	Very high	90.6	Very high	99 Å²	99	46 Å²	46	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-58.3	-42.3	176.5	-167.3	-169.4	-52.7	138.5	1.9	111.4	E410 E433 L434 K440 Q441	E410-R437 IonicContact OE1-NH1 3.46Å; E433-R437 VanDerWaalsContact CD-NH2 3.33Å; E433-R437 VanDerWaalsContact O-CB 3.27Å; E433-R437 WeakPolarHBondContact O-CB 3.48Å; E433-R437 PolarHBondContact O-N 3.41Å; E433-R437 IonicContact OE1-CZ 2.69Å; E433-R437 IonicContact OE1-NE 3.02Å; E433-R437 IonicContact OE1-NH2 2.76Å; E433-R437 PolarHBondContact OE1-NH2 2.72Å; E433-R437 IonicContact OE2-NH2 3.87Å; L434-R437 WeakPolarHBondContact O-CB 3.04Å; L434-R437 PolarHBondContact O-N 3.09Å; R437-K440 PolarHBondContact O-N 3.29Å; R437-Q441 WeakPolarHBondContact O-CG 3.27Å; R437-Q441 PolarHBondContact O-N 2.93Å
438	Q	92.1	Very high	91.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-69.8	-41.7	177.6	-71.2	-175.4	-11.8	0	0	113	Q407 E410 R411 L434 L435 M436 K440 Q441 I442	Q407-Q438 HydrophobicContact CB-CG 4.22Å; Q407-Q438 HydrophobicContact CG-CB 4.21Å; Q407-Q438 HydrophobicContact CG-CG 3.8Å; Q407-Q438 PolarHBondContact NE2-O 3.03Å; Q407-Q438 PolarHBondContact O-NE2 3.5Å; Q407-Q438 VanDerWaalsContact O-NE2 3.12Å; E410-Q438 PolarHBondContact OE2-NE2 3.26Å; R411-Q438 VanDerWaalsContact NH2-OE1 3.09Å; L434-Q438 HydrophobicContact CD1-CG 4.25Å; L434-Q438 VanDerWaalsContact O-CG 3.31Å; L434-Q438 WeakPolarHBondContact O-CG 3.42Å; L434-Q438 PolarHBondContact O-N 3.11Å; L435-Q438 PolarHBondContact O-N 2.79Å; M436-Q438 VanDerWaalsContact C-N 3.3Å; M436-Q438 PolarHBondContact O-N 3.36Å; Q438-K440 VanDerWaalsContact C-N 3.31Å; Q438-K440 PolarHBondContact O-N 3.21Å; Q438-Q441 PolarHBondContact O-N 3.5Å; Q438-I442 WeakPolarHBondContact O-CG1 3.34Å; Q438-I442 PolarHBondContact O-N 2.85Å
439	R	90.5	Very high	91.4	Very high	22 Å²	22	50.4 Å²	50.4	8%	0.083	25%	0.245	C	C	.	.	H	α-helix	trans	-62.4	-38.1	173.9	-172.8	180	-63	-134.8	5.5	111.6	E174 D305 L435 M436 I442 S443	E174-R439 IonicContact OE2-CZ 3.82Å; E174-R439 IonicContact OE2-NE 3.59Å; E174-R439 IonicContact OE2-NH2 3.64Å; E174-R439 PolarHBondContact OE2-NH2 2.74Å; D305-R439 IonicContact OD2-CZ 3.44Å; D305-R439 IonicContact OD2-NH1 3.39Å; D305-R439 PolarHBondContact OD2-NH1 2.67Å; L435-R439 WeakPolarHBondContact O-CB 3.46Å; L435-R439 PolarHBondContact O-N 2.92Å; M436-R439 PolarHBondContact O-N 3.49Å; R439-I442 PolarHBondContact O-N 3.25Å; R439-S443 WeakPolarHBondContact O-CB 3.42Å; R439-S443 PolarHBondContact O-N 3.49Å; R439-S443 PolarHBondContact O-OG 2.95Å
440	K	92.3	Very high	91.7	Very high	134 Å²	134	47.3 Å²	47.3	58%	0.583	22%	0.223	S	C	*	.	H	α-helix	trans	-63.3	-49.2	172.9	-177.6	172	179.9	177.5	0	111.8	M436 R437 Q438 I442 S443 D444	M436-K440 WeakPolarHBondContact O-CB 3.46Å; M436-K440 PolarHBondContact O-N 2.91Å; R437-K440 PolarHBondContact O-N 3.29Å; Q438-K440 VanDerWaalsContact C-N 3.31Å; Q438-K440 PolarHBondContact O-N 3.21Å; K440-I442 VanDerWaalsContact C-N 3.26Å; K440-I442 PolarHBondContact O-N 3.46Å; K440-S443 PolarHBondContact O-N 3.03Å; K440-D444 WeakPolarHBondContact CE-OD2 3.45Å; K440-D444 WeakPolarHBondContact CG-OD2 3.45Å; K440-D444 WeakPolarHBondContact O-CB 3.38Å; K440-D444 VanDerWaalsContact O-CG 3.28Å; K440-D444 PolarHBondContact O-N 2.99Å
441	Q	94.5	Very high	92	Very high	71 Å²	71	45.1 Å²	45.1	33%	0.332	21%	0.212	S	C	.	.	H	α-helix	trans	-55.6	-39.1	175.6	-71.5	167.3	0.4	0	0	113	L403 R437 Q438 L445	L403-Q441 HydrophobicContact CD1-CB 4.44Å; L403-Q441 HydrophobicContact CD2-CB 4.15Å; R437-Q441 WeakPolarHBondContact O-CG 3.27Å; R437-Q441 PolarHBondContact O-N 2.93Å; Q438-Q441 PolarHBondContact O-N 3.5Å; Q441-L445 VanDerWaalsContact O-CB 3.28Å; Q441-L445 WeakPolarHBondContact O-CB 3.45Å; Q441-L445 PolarHBondContact O-N 3.28Å; Q441-L445 VanDerWaalsContact O-N 3.09Å
442	I	92.1	Very high	92.4	Very high	29 Å²	29	48.2 Å²	48.2	15%	0.149	23%	0.226	C	C	.	.	H	α-helix	trans	-65.3	-48.5	174.5	-67.5	167.9	0	0	0	110.2	L403 Q438 R439 K440 L445 E446	L403-I442 HydrophobicContact CD2-CG1 3.91Å; Q438-I442 WeakPolarHBondContact O-CG1 3.34Å; Q438-I442 PolarHBondContact O-N 2.85Å; R439-I442 PolarHBondContact O-N 3.25Å; K440-I442 VanDerWaalsContact C-N 3.26Å; K440-I442 PolarHBondContact O-N 3.46Å; I442-L445 WeakPolarHBondContact O-CB 3.42Å; I442-L445 PolarHBondContact O-N 2.89Å; I442-E446 HydrophobicContact CG2-CG 4.31Å; I442-E446 WeakPolarHBondContact O-CB 3.37Å; I442-E446 WeakPolarHBondContact O-CG 3.33Å; I442-E446 PolarHBondContact O-N 3.49Å
443	S	91.4	Very high	92.6	Very high	12 Å²	12	47.3 Å²	47.3	8%	0.084	22%	0.221	C	C	.	.	H	α-helix	trans	-63.1	-44.1	-178.1	-54.8	0	0	0	0	112.2	R439 K440 L445 E446 L447	R439-S443 WeakPolarHBondContact O-CB 3.42Å; R439-S443 PolarHBondContact O-N 3.49Å; R439-S443 PolarHBondContact O-OG 2.95Å; K440-S443 PolarHBondContact O-N 3.03Å; S443-L445 VanDerWaalsContact C-N 3.34Å; S443-L445 PolarHBondContact O-N 3.25Å; S443-E446 PolarHBondContact O-N 2.88Å; S443-L447 VanDerWaalsContact O-CB 3.3Å; S443-L447 WeakPolarHBondContact O-CB 3.3Å; S443-L447 PolarHBondContact O-N 3.26Å
444	D	94.2	Very high	92.8	Very high	81 Å²	81	42.8 Å²	42.8	43%	0.433	20%	0.201	S	C	.	.	H	α-helix	trans	-62.8	-39.8	176.1	-67	-15.9	0	0	0	111	K440 H448	K440-D444 WeakPolarHBondContact CE-OD2 3.45Å; K440-D444 WeakPolarHBondContact CG-OD2 3.45Å; K440-D444 WeakPolarHBondContact O-CB 3.38Å; K440-D444 VanDerWaalsContact O-CG 3.28Å; K440-D444 PolarHBondContact O-N 2.99Å; D444-H448 WeakPolarHBondContact O-CB 3.43Å; D444-H448 PolarHBondContact O-N 3.37Å
445	L	94.7	Very high	92.9	Very high	35 Å²	35	47 Å²	47	18%	0.183	22%	0.22	C	C	.	.	H	α-helix	trans	-65.6	-44.3	174.2	173.2	63.8	0	0	0	111.9	K399 L403 Q441 I442 S443 H448 Q449	K399-L445 HydrophobicContact CB-CD1 4.18Å; K399-L445 HydrophobicContact CB-CD2 4.16Å; K399-L445 HydrophobicContact CD-CD1 4.27Å; L403-L445 HydrophobicContact CB-CD2 4.31Å; L403-L445 HydrophobicContact CD2-CB 4.44Å; L403-L445 HydrophobicContact CD2-CD2 3.81Å; Q441-L445 VanDerWaalsContact O-CB 3.28Å; Q441-L445 WeakPolarHBondContact O-CB 3.45Å; Q441-L445 PolarHBondContact O-N 3.28Å; Q441-L445 VanDerWaalsContact O-N 3.09Å; I442-L445 WeakPolarHBondContact O-CB 3.42Å; I442-L445 PolarHBondContact O-N 2.89Å; S443-L445 VanDerWaalsContact C-N 3.34Å; S443-L445 PolarHBondContact O-N 3.25Å; L445-H448 PolarHBondContact O-N 3.19Å; L445-Q449 HydrophobicContact CD1-CG 4.11Å; L445-Q449 WeakPolarHBondContact O-CG 3.46Å; L445-Q449 PolarHBondContact O-N 3.3Å
446	E	92.1	Very high	93.1	Very high	16 Å²	16	47.3 Å²	47.3	8%	0.075	22%	0.224	C	C	.	.	H	α-helix	trans	-64.3	-48.7	-179.2	-74.1	-178.5	143.5	0	0	111.4	R167 K400 I442 S443 H448 Q449 D450	R167-E446 IonicContact NH2-OE2 2.65Å; K400-E446 WeakPolarHBondContact CE-OE1 3.34Å; K400-E446 IonicContact NZ-OE1 2.72Å; K400-E446 PolarHBondContact NZ-OE1 3Å; I442-E446 HydrophobicContact CG2-CG 4.31Å; I442-E446 WeakPolarHBondContact O-CB 3.37Å; I442-E446 WeakPolarHBondContact O-CG 3.33Å; I442-E446 PolarHBondContact O-N 3.49Å; S443-E446 PolarHBondContact O-N 2.88Å; E446-H448 PolarHBondContact O-N 2.9Å; E446-Q449 PolarHBondContact O-N 3.02Å; E446-Q449 VanDerWaalsContact O-N 3.16Å; E446-D450 WeakPolarHBondContact O-CB 3.45Å; E446-D450 PolarHBondContact O-N 2.92Å
447	L	92.4	Very high	93.2	Very high	41 Å²	41	43.2 Å²	43.2	22%	0.215	20%	0.204	C	C	.	.	H	α-helix	trans	-56.2	-47.1	172.8	178.4	57.9	0	0	0	111.8	V10 Y11 S443 Q449 D450 N451	V10-L447 HydrophobicContact CG1-CD1 4.24Å; V10-L447 HydrophobicContact CG1-CD2 3.83Å; V10-L447 HydrophobicContact CG1-CG 4.26Å; Y11-L447 HydrophobicContact CD1-CD1 4.43Å; Y11-L447 HydrophobicContact CE1-CD1 3.69Å; Y11-L447 HydrophobicContact CE2-CD1 4.04Å; Y11-L447 VanDerWaalsContact CZ-CD1 3.48Å; S443-L447 VanDerWaalsContact O-CB 3.3Å; S443-L447 WeakPolarHBondContact O-CB 3.3Å; S443-L447 PolarHBondContact O-N 3.26Å; L447-Q449 VanDerWaalsContact C-N 3.28Å; L447-Q449 PolarHBondContact O-N 3.04Å; L447-D450 PolarHBondContact O-N 3.49Å; L447-N451 PolarHBondContact O-N 3.44Å; L447-N451 PolarHBondContact O-OD1 2.99Å
448	H	93.9	Very high	93.1	Very high	113 Å²	113	39.3 Å²	39.3	52%	0.523	19%	0.192	S	C	.	.	H	α-helix	trans	-68.9	-22.9	178.9	-172.5	59.3	0	0	0	113.8	D444 L445 E446 K452	D444-H448 WeakPolarHBondContact O-CB 3.43Å; D444-H448 PolarHBondContact O-N 3.37Å; L445-H448 PolarHBondContact O-N 3.19Å; E446-H448 PolarHBondContact O-N 2.9Å; H448-K452 WeakPolarHBondContact NE2-CE 3.34Å; H448-K452 PolarHBondContact NE2-NZ 2.95Å; H448-K452 WeakPolarHBondContact O-CB 3.35Å; H448-K452 WeakPolarHBondContact O-CG 3.41Å
449	Q	94.2	Very high	93.1	Very high	15 Å²	15	41.9 Å²	41.9	7%	0.07	21%	0.209	C	C	.	.	H	α-helix	trans	-83.9	-40	172.1	-67	-30.2	-96.8	0	0	111.6	K396 L445 E446 L447 K452 I453	K396-Q449 HydrophobicContact CB-CB 4.04Å; K396-Q449 HydrophobicContact CB-CG 4.02Å; K396-Q449 HydrophobicContact CD-CB 3.81Å; K396-Q449 HydrophobicContact CD-CG 4.45Å; K396-Q449 HydrophobicContact CG-CB 3.76Å; K396-Q449 HydrophobicContact CG-CG 3.85Å; L445-Q449 HydrophobicContact CD1-CG 4.11Å; L445-Q449 WeakPolarHBondContact O-CG 3.46Å; L445-Q449 PolarHBondContact O-N 3.3Å; E446-Q449 PolarHBondContact O-N 3.02Å; E446-Q449 VanDerWaalsContact O-N 3.16Å; L447-Q449 VanDerWaalsContact C-N 3.28Å; L447-Q449 PolarHBondContact O-N 3.04Å; Q449-K452 CarbonylContact O-C 3.38Å; Q449-K452 PolarHBondContact O-N 3.23Å; Q449-I453 WeakPolarHBondContact O-CD1 3.47Å; Q449-I453 VanDerWaalsContact O-CG1 3.22Å; Q449-I453 WeakPolarHBondContact O-CG1 3.3Å; Q449-I453 PolarHBondContact O-N 2.82Å
450	D	93.3	Very high	93.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.8	-47.4	178.5	-80	17.4	0	0	0	111.2	R312 W315 W316 K396 E446 L447 K452 I453 A454	R312-D450 IonicContact CZ-OD2 2.73Å; R312-D450 IonicContact NE-OD2 2.77Å; R312-D450 PolarHBondContact NE-OD2 3.21Å; R312-D450 IonicContact NH2-OD1 2.67Å; R312-D450 PolarHBondContact NH2-OD1 3.25Å; R312-D450 IonicContact NH2-OD2 3.14Å; R312-D450 PolarHBondContact NH2-OD2 2.9Å; W315-D450 HydrophobicContact CH2-CB 4.26Å; W315-D450 HydrophobicContact CZ3-CB 3.94Å; W316-D450 HydrophobicContact CZ2-CB 3.94Å; W316-D450 PolarHBondContact NE1-OD2 3.27Å; K396-D450 IonicContact NZ-OD1 3.05Å; K396-D450 PolarHBondContact NZ-OD1 3.41Å; K396-D450 IonicContact NZ-OD2 3.13Å; E446-D450 WeakPolarHBondContact O-CB 3.45Å; E446-D450 PolarHBondContact O-N 2.92Å; L447-D450 PolarHBondContact O-N 3.49Å; D450-K452 VanDerWaalsContact C-N 3.32Å; D450-K452 PolarHBondContact O-N 3.5Å; D450-I453 WeakPolarHBondContact O-CA 3.49Å; D450-I453 WeakPolarHBondContact O-CB 3.31Å; D450-I453 PolarHBondContact O-N 2.97Å; D450-A454 PolarHBondContact O-N 3.31Å
451	N	93.1	Very high	93.1	Very high	34 Å²	34	36.5 Å²	36.5	18%	0.182	19%	0.187	C	C	.	.	H	α-helix	trans	-59.6	-42	175	-68.6	12.4	0	0	0	111.5	L447 I453 A454 E455	L447-N451 PolarHBondContact O-N 3.44Å; L447-N451 PolarHBondContact O-OD1 2.99Å; N451-I453 PolarHBondContact O-N 2.88Å; N451-A454 PolarHBondContact O-N 2.92Å; N451-E455 WeakPolarHBondContact O-CB 3.36Å; N451-E455 VanDerWaalsContact O-CG 3.23Å; N451-E455 WeakPolarHBondContact O-CG 3.32Å; N451-E455 PolarHBondContact O-N 2.81Å
452	K	94.8	Very high	92.9	Very high	85 Å²	85	37.6 Å²	37.6	37%	0.37	19%	0.191	S	C	.	.	H	α-helix	trans	-71.9	-7.4	175.9	-78.8	-178.8	167.2	173.7	0	115	K392 H448 Q449 D450	K392-K452 PolarHBondContact NZ-O 3.39Å; H448-K452 WeakPolarHBondContact NE2-CE 3.34Å; H448-K452 PolarHBondContact NE2-NZ 2.95Å; H448-K452 WeakPolarHBondContact O-CB 3.35Å; H448-K452 WeakPolarHBondContact O-CG 3.41Å; Q449-K452 CarbonylContact O-C 3.38Å; Q449-K452 PolarHBondContact O-N 3.23Å; D450-K452 VanDerWaalsContact C-N 3.32Å; D450-K452 PolarHBondContact O-N 3.5Å
453	I	94.4	Very high	93	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-91.4	-52.1	168.8	-68.5	157.7	0	0	0	108.7	P142 W316 K392 Q449 D450 N451 E455 A456 L457	P142-I453 HydrophobicContact CB-CG2 3.75Å; P142-I453 HydrophobicContact CG-CD1 3.99Å; P142-I453 HydrophobicContact CG-CG2 3.68Å; W316-I453 HydrophobicContact CH2-CB 4.39Å; W316-I453 HydrophobicContact CH2-CG2 3.99Å; K392-I453 HydrophobicContact CB-CD1 4.22Å; K392-I453 HydrophobicContact CB-CG1 3.62Å; K392-I453 HydrophobicContact CD-CG1 4.38Å; K392-I453 HydrophobicContact CG-CG1 4.28Å; Q449-I453 WeakPolarHBondContact O-CD1 3.47Å; Q449-I453 VanDerWaalsContact O-CG1 3.22Å; Q449-I453 WeakPolarHBondContact O-CG1 3.3Å; Q449-I453 PolarHBondContact O-N 2.82Å; D450-I453 WeakPolarHBondContact O-CA 3.49Å; D450-I453 WeakPolarHBondContact O-CB 3.31Å; D450-I453 PolarHBondContact O-N 2.97Å; N451-I453 PolarHBondContact O-N 2.88Å; I453-E455 PolarHBondContact O-N 3.37Å; I453-A456 WeakPolarHBondContact O-CB 3.33Å; I453-A456 PolarHBondContact O-N 3.49Å; I453-L457 HydrophobicContact CG2-CD1 3.64Å; I453-L457 HydrophobicContact CG2-CG 4.17Å; I453-L457 WeakPolarHBondContact O-CG 3.45Å; I453-L457 PolarHBondContact O-N 3.25Å
454	A	93.3	Very high	93	Very high	4 Å²	4	43 Å²	43	3%	0.033	21%	0.212	C	C	.	.	H	α-helix	trans	-55.1	-51.8	176.5	0	0	0	0	0	112.4	W315 L319 D450 N451 A456 L457 C458	W315-A454 HydrophobicContact CH2-CB 3.62Å; W315-A454 HydrophobicContact CZ2-CB 3.68Å; L319-A454 HydrophobicContact CD2-CB 3.64Å; D450-A454 PolarHBondContact O-N 3.31Å; N451-A454 PolarHBondContact O-N 2.92Å; A454-A456 PolarHBondContact O-N 3.09Å; A454-L457 PolarHBondContact O-N 3.31Å; A454-C458 WeakPolarHBondContact O-CB 3.45Å; A454-C458 PolarHBondContact O-N 3.24Å; A454-C458 PolarHBondContact O-SG 2.67Å
455	E	93.9	Very high	92.7	Very high	99 Å²	99	40.2 Å²	40.2	46%	0.463	20%	0.196	S	C	.	.	H	α-helix	trans	-49.4	-43.8	173.5	-75	165.6	-170.6	0	0	112.2	L16 N451 I453 S459	L16-E455 HydrophobicContact CD2-CG 4.5Å; N451-E455 WeakPolarHBondContact O-CB 3.36Å; N451-E455 VanDerWaalsContact O-CG 3.23Å; N451-E455 WeakPolarHBondContact O-CG 3.32Å; N451-E455 PolarHBondContact O-N 2.81Å; I453-E455 PolarHBondContact O-N 3.37Å; E455-S459 VanDerWaalsContact O-CB 3.32Å; E455-S459 WeakPolarHBondContact O-CB 3.39Å; E455-S459 PolarHBondContact O-N 3.38Å
456	A	95	Very high	92.6	Very high	13 Å²	13	41 Å²	41	11%	0.107	21%	0.208	C	C	.	.	H	α-helix	trans	-74.2	-40.9	-176.8	0	0	0	0	0	112.2	L388 I453 A454 S459 L460	L388-A456 HydrophobicContact CD2-CB 4.23Å; I453-A456 WeakPolarHBondContact O-CB 3.33Å; I453-A456 PolarHBondContact O-N 3.49Å; A454-A456 PolarHBondContact O-N 3.09Å; A456-S459 PolarHBondContact O-N 3.18Å; A456-S459 PolarHBondContact O-OG 3.04Å; A456-L460 WeakPolarHBondContact O-CB 3.31Å; A456-L460 PolarHBondContact O-N 2.84Å
457	L	92.4	Very high	92.7	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-64.1	-46.6	174.7	-68.9	171	0	0	0	110.9	L145 T385 L388 I453 A454 S459 L460 W461	L145-L457 HydrophobicContact CD1-CD1 3.69Å; T385-L457 HydrophobicContact CG2-CD2 4.08Å; L388-L457 HydrophobicContact CD2-CD2 4.17Å; L388-L457 HydrophobicContact CG-CD2 4.36Å; I453-L457 HydrophobicContact CG2-CD1 3.64Å; I453-L457 HydrophobicContact CG2-CG 4.17Å; I453-L457 WeakPolarHBondContact O-CG 3.45Å; I453-L457 PolarHBondContact O-N 3.25Å; A454-L457 PolarHBondContact O-N 3.31Å; L457-S459 VanDerWaalsContact C-N 3.3Å; L457-S459 PolarHBondContact O-N 3.48Å; L457-L460 WeakPolarHBondContact O-CB 3.47Å; L457-L460 PolarHBondContact O-N 2.98Å; L457-L460 VanDerWaalsContact O-N 3.11Å; L457-W461 VanDerWaalsContact O-CD1 3.32Å; L457-W461 PolarHBondContact O-N 3.01Å
458	C	90.4	Very high	92.8	Very high	17 Å²	17	42.3 Å²	42.3	12%	0.115	21%	0.214	C	C	.	.	H	α-helix	trans	-59.5	-40.3	172.8	-63.7	0	0	0	0	111.6	A454 L460 K462	A454-C458 WeakPolarHBondContact O-CB 3.45Å; A454-C458 PolarHBondContact O-N 3.24Å; A454-C458 PolarHBondContact O-SG 2.67Å; C458-L460 VanDerWaalsContact C-N 3.31Å; C458-L460 PolarHBondContact O-N 3.33Å; C458-K462 WeakPolarHBondContact O-CB 3.33Å; C458-K462 VanDerWaalsContact O-CG 3.28Å; C458-K462 WeakPolarHBondContact O-CG 3.33Å; C458-K462 PolarHBondContact O-N 2.93Å
459	S	92.6	Very high	92.7	Very high	53 Å²	53	38.1 Å²	38.1	37%	0.371	20%	0.197	S	C	.	.	H	α-helix	trans	-68.5	-27.6	176	83.6	0	0	0	0	113.8	E455 A456 L457 K463	E455-S459 VanDerWaalsContact O-CB 3.32Å; E455-S459 WeakPolarHBondContact O-CB 3.39Å; E455-S459 PolarHBondContact O-N 3.38Å; A456-S459 PolarHBondContact O-N 3.18Å; A456-S459 PolarHBondContact O-OG 3.04Å; L457-S459 VanDerWaalsContact C-N 3.3Å; L457-S459 PolarHBondContact O-N 3.48Å; S459-K463 WeakPolarHBondContact O-CD 3.47Å; S459-K463 VanDerWaalsContact O-CG 3.29Å; S459-K463 WeakPolarHBondContact O-CG 3.17Å
460	L	93.3	Very high	92.7	Very high	31 Å²	31	42.1 Å²	42.1	16%	0.162	22%	0.219	C	C	.	.	H	α-helix	trans	-73.6	-51.3	174.3	174.8	65.2	0	0	0	109.9	K384 L388 A456 L457 C458 K462 K463 L464	K384-L460 HydrophobicContact CB-CD1 4.39Å; K384-L460 HydrophobicContact CB-CD2 4.13Å; L388-L460 HydrophobicContact CB-CD2 4.21Å; L388-L460 HydrophobicContact CD2-CB 3.9Å; L388-L460 HydrophobicContact CD2-CD2 3.71Å; L388-L460 HydrophobicContact CD2-CG 4.35Å; A456-L460 WeakPolarHBondContact O-CB 3.31Å; A456-L460 PolarHBondContact O-N 2.84Å; L457-L460 WeakPolarHBondContact O-CB 3.47Å; L457-L460 PolarHBondContact O-N 2.98Å; L457-L460 VanDerWaalsContact O-N 3.11Å; C458-L460 VanDerWaalsContact C-N 3.31Å; C458-L460 PolarHBondContact O-N 3.33Å; L460-K462 PolarHBondContact O-N 2.82Å; L460-K463 PolarHBondContact O-N 2.91Å; L460-K463 VanDerWaalsContact O-N 3.12Å; L460-L464 HydrophobicContact CD1-CD1 3.76Å; L460-L464 HydrophobicContact CD1-CG 4.08Å; L460-L464 HydrophobicContact CD2-CD1 4.31Å; L460-L464 HydrophobicContact CG-CD1 3.68Å; L460-L464 HydrophobicContact CG-CG 4.36Å; L460-L464 WeakPolarHBondContact O-CG 3.27Å; L460-L464 PolarHBondContact O-N 2.99Å
461	W	90.1	Very high	92.7	Very high	12 Å²	12	46.8 Å²	46.8	5%	0.045	24%	0.237	C	C	.	.	H	α-helix	trans	-60.5	-43.3	180	-82.8	105.9	0	0	0	112.9	V323 Q326 P327 C381 T385 L457 K463 L464 R465	V323-W461 HydrophobicContact CG1-CZ2 3.92Å; Q326-W461 HydrophobicContact CB-CD2 4.2Å; Q326-W461 HydrophobicContact CB-CE3 3.59Å; Q326-W461 HydrophobicContact CB-CZ3 4.08Å; Q326-W461 HydrophobicContact CG-CB 4.25Å; Q326-W461 HydrophobicContact CG-CE3 4.35Å; P327-W461 HydrophobicContact CG-CH2 3.62Å; P327-W461 HydrophobicContact CG-CZ3 3.77Å; C381-W461 HydrophobicContact CB-CE3 4.49Å; C381-W461 HydrophobicContact CB-CH2 3.47Å; C381-W461 VanDerWaalsContact CB-CH2 3.47Å; C381-W461 HydrophobicContact CB-CZ2 4.22Å; C381-W461 HydrophobicContact CB-CZ3 3.62Å; T385-W461 PolarHBondContact OG1-NE1 3.35Å; L457-W461 VanDerWaalsContact O-CD1 3.32Å; L457-W461 PolarHBondContact O-N 3.01Å; W461-K463 VanDerWaalsContact C-N 3.28Å; W461-K463 PolarHBondContact O-N 2.89Å; W461-L464 PolarHBondContact O-N 3.43Å; W461-L464 VanDerWaalsContact O-N 3.16Å; W461-R465 WeakPolarHBondContact O-CB 3.47Å; W461-R465 PolarHBondContact O-N 3.2Å
462	K	89.9	Confident	92.7	Very high	94 Å²	94	45.2 Å²	45.2	41%	0.409	23%	0.228	S	C	.	.	H	α-helix	trans	-55.7	-41.2	173.5	-72.3	175	-174.4	-172.2	0	112.6	L17 C458 L460 A466	L17-K462 VanDerWaalsContact CG-NZ 3.29Å; C458-K462 WeakPolarHBondContact O-CB 3.33Å; C458-K462 VanDerWaalsContact O-CG 3.28Å; C458-K462 WeakPolarHBondContact O-CG 3.33Å; C458-K462 PolarHBondContact O-N 2.93Å; L460-K462 PolarHBondContact O-N 2.82Å; K462-A466 PolarHBondContact O-N 2.89Å
463	K	92.9	Very high	92.6	Very high	150 Å²	150	42 Å²	42	65%	0.652	22%	0.217	S	C	*	.	H	α-helix	trans	-71.6	-38.1	177.9	-70.5	171.7	-176	178.2	0	112.5	S459 L460 W461 L467	S459-K463 WeakPolarHBondContact O-CD 3.47Å; S459-K463 VanDerWaalsContact O-CG 3.29Å; S459-K463 WeakPolarHBondContact O-CG 3.17Å; L460-K463 PolarHBondContact O-N 2.91Å; L460-K463 VanDerWaalsContact O-N 3.12Å; W461-K463 VanDerWaalsContact C-N 3.28Å; W461-K463 PolarHBondContact O-N 2.89Å; K463-L467 VanDerWaalsContact O-CB 3.23Å; K463-L467 WeakPolarHBondContact O-CB 3.43Å; K463-L467 PolarHBondContact O-N 3.05Å
464	L	91.6	Very high	92.6	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.026	24%	0.236	C	C	.	.	H	α-helix	trans	-71.9	-40.3	178.7	-68.5	171.2	0	0	0	112	C381 K384 L460 W461 A466 L467 W468	C381-L464 HydrophobicContact CB-CD1 4.1Å; K384-L464 HydrophobicContact CB-CD1 4.43Å; K384-L464 HydrophobicContact CD-CD1 4.49Å; K384-L464 HydrophobicContact CD-CD2 3.85Å; L460-L464 HydrophobicContact CD1-CD1 3.76Å; L460-L464 HydrophobicContact CD1-CG 4.08Å; L460-L464 HydrophobicContact CD2-CD1 4.31Å; L460-L464 HydrophobicContact CG-CD1 3.68Å; L460-L464 HydrophobicContact CG-CG 4.36Å; L460-L464 WeakPolarHBondContact O-CG 3.27Å; L460-L464 PolarHBondContact O-N 2.99Å; W461-L464 PolarHBondContact O-N 3.43Å; W461-L464 VanDerWaalsContact O-N 3.16Å; L464-A466 PolarHBondContact O-N 2.97Å; L464-L467 PolarHBondContact O-N 2.73Å; L464-W468 WeakPolarHBondContact O-CB 3.45Å; L464-W468 PolarHBondContact O-N 3Å
465	R	89.3	Confident	92.6	Very high	23 Å²	23	48.4 Å²	48.4	9%	0.087	25%	0.247	C	C	.	.	H	α-helix	trans	-54.8	-49.9	174.6	-179.2	73	-168.8	91.5	-3	111.1	L329 L330 E333 W461 S469	L329-R465 PolarHBondContact O-NH2 3.39Å; L330-R465 VanDerWaalsContact CD2-NH1 3.28Å; E333-R465 IonicContact OE2-CZ 2.69Å; E333-R465 IonicContact OE2-NH1 3.74Å; E333-R465 PolarHBondContact OE2-NH1 2.94Å; E333-R465 IonicContact OE2-NH2 3.29Å; E333-R465 PolarHBondContact OE2-NH2 3.2Å; W461-R465 WeakPolarHBondContact O-CB 3.47Å; W461-R465 PolarHBondContact O-N 3.2Å; R465-S469 VanDerWaalsContact O-CB 3.3Å; R465-S469 WeakPolarHBondContact O-CB 3.36Å; R465-S469 PolarHBondContact O-N 3.1Å
466	A	91.7	Very high	92.5	Very high	52 Å²	52	43.7 Å²	43.7	43%	0.43	23%	0.225	S	C	.	.	H	α-helix	trans	-68.2	-46.3	177.7	0	0	0	0	0	112.8	K462 L464 W468 S469 N470	K462-A466 PolarHBondContact O-N 2.89Å; L464-A466 PolarHBondContact O-N 2.97Å; A466-W468 VanDerWaalsContact C-N 3.29Å; A466-W468 PolarHBondContact O-N 3.45Å; A466-S469 PolarHBondContact O-N 2.96Å; A466-N470 PolarHBondContact O-N 3.48Å; A466-N470 PolarHBondContact O-OD1 3.33Å
467	L	94.8	Very high	92.4	Very high	73 Å²	73	46.8 Å²	46.8	38%	0.382	23%	0.234	S	C	.	.	H	α-helix	trans	-60.7	-37.7	179.4	178.4	147.1	0	0	0	112.5	K463 L464 R471	K463-L467 VanDerWaalsContact O-CB 3.23Å; K463-L467 WeakPolarHBondContact O-CB 3.43Å; K463-L467 PolarHBondContact O-N 3.05Å; L464-L467 PolarHBondContact O-N 2.73Å; L467-R471 WeakPolarHBondContact O-CG 3.49Å; L467-R471 PolarHBondContact O-N 2.72Å
468	W	93.8	Very high	92.5	Very high	11 Å²	11	51.1 Å²	51.1	4%	0.042	26%	0.257	C	S	.	.	H	α-helix	trans	-82.4	-34.6	178.8	-78.7	109.2	0	0	0	113.6	L330 R376 E380 L464 A466 R471 L472	L330-W468 HydrophobicContact CD1-CB 4.44Å; L330-W468 HydrophobicContact CD2-CB 3.84Å; R376-W468 HydrophobicContact CB-CH2 3.84Å; R376-W468 HydrophobicContact CB-CZ3 4.44Å; E380-W468 HydrophobicContact CB-CZ2 4.07Å; E380-W468 WeakPolarHBondContact OE2-CZ2 3.43Å; L464-W468 WeakPolarHBondContact O-CB 3.45Å; L464-W468 PolarHBondContact O-N 3Å; A466-W468 VanDerWaalsContact C-N 3.29Å; A466-W468 PolarHBondContact O-N 3.45Å; W468-R471 HydrophobicContact CE3-CB 4.12Å; W468-R471 VanDerWaalsContact CH2-NH1 3.34Å; W468-R471 PolarHBondContact O-N 3.37Å; W468-L472 WeakPolarHBondContact O-CB 3.32Å; W468-L472 WeakPolarHBondContact O-CD1 3.17Å; W468-L472 WeakPolarHBondContact O-CG 3.26Å; W468-L472 PolarHBondContact O-N 2.73Å
469	S	92.8	Very high	92.5	Very high	25 Å²	25	52.1 Å²	52.1	18%	0.175	26%	0.261	C	S	.	.	H	α-helix	trans	-56.8	-51.3	169.8	178	0	0	0	0	111.1	E333 R465 A466 R471 L472 S473	E333-S469 VanDerWaalsContact CD-OG 3.27Å; E333-S469 WeakPolarHBondContact OE1-CA 3.4Å; E333-S469 WeakPolarHBondContact OE1-CB 3.4Å; E333-S469 PolarHBondContact OE1-OG 3.43Å; E333-S469 WeakPolarHBondContact OE2-CB 3.18Å; E333-S469 PolarHBondContact OE2-OG 3.17Å; R465-S469 VanDerWaalsContact O-CB 3.3Å; R465-S469 WeakPolarHBondContact O-CB 3.36Å; R465-S469 PolarHBondContact O-N 3.1Å; A466-S469 PolarHBondContact O-N 2.96Å; S469-R471 PolarHBondContact O-N 3.06Å; S469-L472 PolarHBondContact O-N 2.95Å; S469-L472 VanDerWaalsContact O-N 3.16Å; S469-S473 PolarHBondContact O-N 2.94Å
470	N	93.1	Very high	92.3	Very high	99 Å²	99	49.7 Å²	49.7	53%	0.529	24%	0.244	S	C	.	.	H	α-helix	trans	-57.3	-48.7	177	-70.3	22.3	0	0	0	112	A466 L472 S473 E474	A466-N470 PolarHBondContact O-N 3.48Å; A466-N470 PolarHBondContact O-OD1 3.33Å; N470-L472 VanDerWaalsContact C-N 3.31Å; N470-L472 PolarHBondContact O-N 3.34Å; N470-S473 WeakPolarHBondContact O-CB 3.49Å; N470-S473 PolarHBondContact O-N 3.09Å; N470-E474 VanDerWaalsContact O-CG 3.31Å; N470-E474 WeakPolarHBondContact O-CG 3.16Å; N470-E474 PolarHBondContact O-N 2.96Å
471	R	93.9	Very high	92.1	Very high	98 Å²	98	50.2 Å²	50.2	37%	0.37	25%	0.246	S	C	.	.	H	α-helix	trans	-59.8	-38	177.3	-85.5	179.1	164.7	175.5	-4.1	113.3	E380 L467 W468 S469 I475	E380-R471 IonicContact OE2-NH1 2.72Å; E380-R471 PolarHBondContact OE2-NH1 3.03Å; L467-R471 WeakPolarHBondContact O-CG 3.49Å; L467-R471 PolarHBondContact O-N 2.72Å; W468-R471 HydrophobicContact CE3-CB 4.12Å; W468-R471 VanDerWaalsContact CH2-NH1 3.34Å; W468-R471 PolarHBondContact O-N 3.37Å; S469-R471 PolarHBondContact O-N 3.06Å; R471-I475 WeakPolarHBondContact O-CB 3.28Å; R471-I475 WeakPolarHBondContact O-CD1 3.46Å; R471-I475 WeakPolarHBondContact O-CG1 3.46Å; R471-I475 PolarHBondContact O-N 3.19Å
472	L	93	Very high	92	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-73.6	-37	-179.9	-69.3	163.8	0	0	0	110.9	L330 V334 L370 W468 S469 N470 A476	L330-L472 HydrophobicContact CD2-CD1 3.94Å; V334-L472 HydrophobicContact CG2-CD1 3.86Å; V334-L472 HydrophobicContact CG2-CD2 4.31Å; L370-L472 HydrophobicContact CD2-CB 3.94Å; L370-L472 HydrophobicContact CD2-CD2 3.71Å; L370-L472 HydrophobicContact CD2-CG 4.44Å; L370-L472 WeakPolarHBondContact CD2-O 3.41Å; W468-L472 WeakPolarHBondContact O-CB 3.32Å; W468-L472 WeakPolarHBondContact O-CD1 3.17Å; W468-L472 WeakPolarHBondContact O-CG 3.26Å; W468-L472 PolarHBondContact O-N 2.73Å; S469-L472 PolarHBondContact O-N 2.95Å; S469-L472 VanDerWaalsContact O-N 3.16Å; N470-L472 VanDerWaalsContact C-N 3.31Å; N470-L472 PolarHBondContact O-N 3.34Å; L472-A476 WeakPolarHBondContact O-CB 3.31Å; L472-A476 PolarHBondContact O-N 3.38Å; L472-A476 VanDerWaalsContact O-N 3.09Å
473	S	92.6	Very high	91.8	Very high	19 Å²	19	48.6 Å²	48.6	13%	0.133	25%	0.252	C	S	.	.	H	α-helix	trans	-60.5	-49	168.4	-175	0	0	0	0	111.3	S469 N470 I475 A476 R477 E503	S469-S473 PolarHBondContact O-N 2.94Å; N470-S473 WeakPolarHBondContact O-CB 3.49Å; N470-S473 PolarHBondContact O-N 3.09Å; S473-I475 PolarHBondContact O-N 2.95Å; S473-A476 PolarHBondContact O-N 3.38Å; S473-R477 VanDerWaalsContact O-CB 3.29Å; S473-R477 WeakPolarHBondContact O-CB 3.5Å; S473-R477 PolarHBondContact O-N 2.97Å; S473-E503 WeakPolarHBondContact CB-OE1 3.48Å; S473-E503 PolarHBondContact OG-OE1 3.23Å
474	E	94.1	Very high	91.4	Very high	89 Å²	89	41.4 Å²	41.4	42%	0.416	22%	0.221	S	C	.	.	H	α-helix	trans	-57.2	-49.8	177.6	-73.1	168.5	165.4	0	0	112	N470 A476 R477 D478	N470-E474 VanDerWaalsContact O-CG 3.31Å; N470-E474 WeakPolarHBondContact O-CG 3.16Å; N470-E474 PolarHBondContact O-N 2.96Å; E474-A476 PolarHBondContact O-N 2.85Å; E474-R477 PolarHBondContact O-N 2.84Å; E474-D478 WeakPolarHBondContact O-CB 3.48Å; E474-D478 PolarHBondContact O-N 2.71Å
475	I	92.8	Very high	91	Very high	53 Å²	53	42.3 Å²	42.3	27%	0.272	23%	0.227	S	C	.	.	H	α-helix	trans	-58.9	-45.7	178.2	-72.2	164.1	0	0	0	111.6	A369 R471 S473 I479	A369-I475 HydrophobicContact CB-CG2 3.7Å; R471-I475 WeakPolarHBondContact O-CB 3.28Å; R471-I475 WeakPolarHBondContact O-CD1 3.46Å; R471-I475 WeakPolarHBondContact O-CG1 3.46Å; R471-I475 PolarHBondContact O-N 3.19Å; S473-I475 PolarHBondContact O-N 2.95Å; I475-I479 HydrophobicContact CG2-CD1 4.15Å; I475-I479 WeakPolarHBondContact O-CD1 3.38Å; I475-I479 WeakPolarHBondContact O-CG1 3.35Å; I475-I479 PolarHBondContact O-N 3.27Å
476	A	92.9	Very high	90.5	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-69	-42.5	179.9	0	0	0	0	0	112.3	I341 I366 L370 L472 S473 E474 F480 W499	I341-A476 HydrophobicContact CD1-CB 4.39Å; I366-A476 HydrophobicContact CG2-CB 4.01Å; L370-A476 HydrophobicContact CD1-CB 4.23Å; L370-A476 HydrophobicContact CD2-CB 4.16Å; L370-A476 HydrophobicContact CG-CB 4.42Å; L472-A476 WeakPolarHBondContact O-CB 3.31Å; L472-A476 PolarHBondContact O-N 3.38Å; L472-A476 VanDerWaalsContact O-N 3.09Å; S473-A476 PolarHBondContact O-N 3.38Å; E474-A476 PolarHBondContact O-N 2.85Å; A476-F480 WeakPolarHBondContact O-CB 3.38Å; A476-F480 PolarHBondContact O-N 2.88Å; A476-W499 HydrophobicContact CB-CH2 3.71Å; A476-W499 HydrophobicContact CB-CZ3 4.38Å
477	R	93.3	Very high	89.8	Confident	78 Å²	78	47.4 Å²	47.4	29%	0.294	25%	0.251	S	S	.	.	H	α-helix	trans	-61.1	-48.2	177.8	-174	-167.1	61.9	-140.6	-12.1	111.3	S473 E474 I479 F480 L481 W499	S473-R477 VanDerWaalsContact O-CB 3.29Å; S473-R477 WeakPolarHBondContact O-CB 3.5Å; S473-R477 PolarHBondContact O-N 2.97Å; E474-R477 PolarHBondContact O-N 2.84Å; R477-I479 VanDerWaalsContact C-N 3.31Å; R477-I479 PolarHBondContact O-N 3.03Å; R477-F480 PolarHBondContact O-N 3.03Å; R477-L481 HydrophobicContact CG-CD1 3.69Å; R477-L481 HydrophobicContact CG-CG 4.1Å; R477-L481 WeakPolarHBondContact O-CB 3.47Å; R477-L481 WeakPolarHBondContact O-CG 3.3Å; R477-L481 PolarHBondContact O-N 3.39Å; R477-W499 HydrophobicContact CB-CD2 4.04Å; R477-W499 HydrophobicContact CB-CE3 4.4Å; R477-W499 HydrophobicContact CB-CH2 3.95Å; R477-W499 HydrophobicContact CB-CZ2 3.53Å; R477-W499 HydrophobicContact CB-CZ3 4.35Å; R477-W499 HydrophobicContact CG-CD2 3.86Å; R477-W499 HydrophobicContact CG-CE3 4.47Å; R477-W499 HydrophobicContact CG-CG 4.09Å; R477-W499 HydrophobicContact CG-CZ2 4.21Å
478	D	92.9	Very high	89	Confident	91 Å²	91	44.4 Å²	44.4	49%	0.487	24%	0.235	S	C	.	.	H	α-helix	trans	-68.4	-33.5	-172.5	-66.8	1.3	0	0	0	111.1	E474 A482	E474-D478 WeakPolarHBondContact O-CB 3.48Å; E474-D478 PolarHBondContact O-N 2.71Å; D478-A482 VanDerWaalsContact O-CB 3.29Å; D478-A482 WeakPolarHBondContact O-CB 3.24Å; D478-A482 PolarHBondContact O-N 2.76Å
479	I	90.5	Very high	88.2	Confident	39 Å²	39	48.6 Å²	48.6	20%	0.2	27%	0.266	C	S	.	.	H	α-helix	trans	-71.4	-45.5	170.2	-62.3	167.7	0	0	0	111	E365 I366 A369 I475 R477 L481 A482 S483	E365-I479 HydrophobicContact CB-CG2 4.11Å; I366-I479 HydrophobicContact CD1-CG2 4.34Å; I366-I479 HydrophobicContact CG1-CB 3.97Å; I366-I479 HydrophobicContact CG1-CG2 3.49Å; I366-I479 VanDerWaalsContact CG1-CG2 3.49Å; A369-I479 HydrophobicContact CB-CD1 3.43Å; A369-I479 VanDerWaalsContact CB-CD1 3.43Å; I475-I479 HydrophobicContact CG2-CD1 4.15Å; I475-I479 WeakPolarHBondContact O-CD1 3.38Å; I475-I479 WeakPolarHBondContact O-CG1 3.35Å; I475-I479 PolarHBondContact O-N 3.27Å; R477-I479 VanDerWaalsContact C-N 3.31Å; R477-I479 PolarHBondContact O-N 3.03Å; I479-L481 PolarHBondContact O-N 3.01Å; I479-A482 PolarHBondContact O-N 3.17Å; I479-S483 PolarHBondContact O-N 3.42Å
480	F	89.8	Confident	87.5	Confident	1 Å²	1	49.8 Å²	49.8	0%	0.004	27%	0.27	C	S	.	.	H	α-helix	trans	-59	-49.7	179.5	-178	-92.1	0	0	0	111.8	I341 L345 I366 A476 R477 A482 V484 L498 W499	I341-F480 HydrophobicContact CG2-CD2 4.06Å; I341-F480 HydrophobicContact CG2-CE2 4.21Å; L345-F480 HydrophobicContact CD2-CE2 4.33Å; I366-F480 HydrophobicContact CD1-CB 4.26Å; I366-F480 HydrophobicContact CD1-CD2 4.46Å; A476-F480 WeakPolarHBondContact O-CB 3.38Å; A476-F480 PolarHBondContact O-N 2.88Å; R477-F480 PolarHBondContact O-N 3.03Å; F480-A482 VanDerWaalsContact C-N 3.29Å; F480-A482 PolarHBondContact O-N 3.47Å; F480-V484 HydrophobicContact CD1-CG2 4.37Å; F480-V484 HydrophobicContact CD2-CG2 3.67Å; F480-V484 HydrophobicContact CE1-CG2 4.46Å; F480-V484 HydrophobicContact CE2-CG2 3.77Å; F480-V484 HydrophobicContact CG-CG2 3.99Å; F480-V484 HydrophobicContact CZ-CG2 4.17Å; F480-V484 WeakPolarHBondContact O-CB 3.47Å; F480-V484 VanDerWaalsContact O-CG2 3.23Å; F480-V484 WeakPolarHBondContact O-CG2 3.49Å; F480-V484 PolarHBondContact O-N 3.44Å; F480-L498 HydrophobicContact CZ-CB 4.42Å; F480-W499 HydrophobicContact CB-CE3 4.13Å; F480-W499 HydrophobicContact CB-CZ3 4.05Å; F480-W499 AromaticContact CD1-CE3 3.78Å; F480-W499 HydrophobicContact CD1-CE3 3.78Å; F480-W499 HydrophobicContact CD1-CZ3 4.48Å; F480-W499 HydrophobicContact CE1-CB 4.49Å; F480-W499 HydrophobicContact CE1-CE3 4.29Å; F480-W499 AromaticContact CG-CE3 3.92Å; F480-W499 HydrophobicContact CG-CE3 3.92Å; F480-W499 HydrophobicContact CG-CZ3 4.17Å
481	L	89.5	Confident	87.1	Confident	42 Å²	42	49.4 Å²	49.4	22%	0.22	27%	0.271	C	S	.	.	H	α-helix	trans	-69.9	-21.4	179.2	-65.1	-179.9	0	0	0	113.4	R477 I479 P485 C495 E496	R477-L481 HydrophobicContact CG-CD1 3.69Å; R477-L481 HydrophobicContact CG-CG 4.1Å; R477-L481 WeakPolarHBondContact O-CB 3.47Å; R477-L481 WeakPolarHBondContact O-CG 3.3Å; R477-L481 PolarHBondContact O-N 3.39Å; I479-L481 PolarHBondContact O-N 3.01Å; L481-P485 WeakPolarHBondContact O-CD 3.42Å; L481-P485 VanDerWaalsContact O-CG 3.26Å; L481-P485 WeakPolarHBondContact O-CG 3.25Å; L481-C495 HydrophobicContact CD2-CB 3.84Å; L481-E496 HydrophobicContact CD2-CG 4.43Å
482	A	88	Confident	86.5	Confident	56 Å²	56	49.4 Å²	49.4	46%	0.463	28%	0.282	S	S	.	.	H	α-helix	trans	-81.5	-50.1	172.8	0	0	0	0	0	112.7	D478 I479 F480 T486	D478-A482 VanDerWaalsContact O-CB 3.29Å; D478-A482 WeakPolarHBondContact O-CB 3.24Å; D478-A482 PolarHBondContact O-N 2.76Å; I479-A482 PolarHBondContact O-N 3.17Å; F480-A482 VanDerWaalsContact C-N 3.29Å; F480-A482 PolarHBondContact O-N 3.47Å; A482-T486 WeakPolarHBondContact O-CG2 3.34Å; A482-T486 PolarHBondContact O-OG1 2.88Å
483	S	85.2	Confident	86.1	Confident	16 Å²	16	57.1 Å²	57.1	11%	0.112	32%	0.318	C	S	.	.	H	α-helix	trans	-86.9	-28.3	-171	-61.6	0	0	0	0	113.8	E365 I479 T486 Q487	E365-S483 PolarHBondContact OE2-OG 3.27Å; I479-S483 PolarHBondContact O-N 3.42Å; S483-T486 PolarHBondContact O-OG1 3.33Å; S483-T486 VanDerWaalsContact O-OG1 3.12Å; S483-Q487 VanDerWaalsContact O-CB 3.32Å; S483-Q487 WeakPolarHBondContact O-CB 3.29Å; S483-Q487 VanDerWaalsContact O-CG 3.27Å; S483-Q487 WeakPolarHBondContact O-CG 3.43Å; S483-Q487 PolarHBondContact O-N 2.93Å; S483-Q487 VanDerWaalsContact O-N 3.1Å
484	V	83.8	Confident	85.6	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-71.1	-50.5	-178.5	174.7	0	0	0	0	113.4	L345 I362 F480 T486 L488 L490	L345-V484 HydrophobicContact CD2-CG2 3.85Å; I362-V484 HydrophobicContact CD1-CG2 3.99Å; I362-V484 HydrophobicContact CG2-CG2 4.25Å; F480-V484 HydrophobicContact CD1-CG2 4.37Å; F480-V484 HydrophobicContact CD2-CG2 3.67Å; F480-V484 HydrophobicContact CE1-CG2 4.46Å; F480-V484 HydrophobicContact CE2-CG2 3.77Å; F480-V484 HydrophobicContact CG-CG2 3.99Å; F480-V484 HydrophobicContact CZ-CG2 4.17Å; F480-V484 WeakPolarHBondContact O-CB 3.47Å; F480-V484 VanDerWaalsContact O-CG2 3.23Å; F480-V484 WeakPolarHBondContact O-CG2 3.49Å; F480-V484 PolarHBondContact O-N 3.44Å; V484-T486 VanDerWaalsContact C-N 3.27Å; V484-T486 PolarHBondContact O-N 3.25Å; V484-L488 HydrophobicContact CG1-CD1 4.2Å; V484-L488 WeakPolarHBondContact O-CB 3.46Å; V484-L488 PolarHBondContact O-N 2.89Å; V484-L490 HydrophobicContact CG1-CD1 3.78Å
485	P	82.7	Confident	85.2	Confident	23 Å²	23	56.9 Å²	56.9	15%	0.149	31%	0.311	C	S	.	.	H	α-helix	trans	-61.9	-37.9	-179.9	-21.6	33.1	0	0	0	112.3	L481 S489 C495	L481-P485 WeakPolarHBondContact O-CD 3.42Å; L481-P485 VanDerWaalsContact O-CG 3.26Å; L481-P485 WeakPolarHBondContact O-CG 3.25Å; P485-S489 WeakPolarHBondContact O-CA 3.38Å; P485-S489 PolarHBondContact O-N 3.43Å; P485-S489 VanDerWaalsContact O-N 3.14Å; P485-C495 HydrophobicContact CG-CB 4.41Å
486	T	79.5	Confident	84.9	Confident	111 Å²	111	58.7 Å²	58.7	68%	0.681	32%	0.318	S	S	*	.	H	α-helix	trans	-74.2	-39.8	-175.5	52	0	0	0	0	113	A482 S483 V484	A482-T486 WeakPolarHBondContact O-CG2 3.34Å; A482-T486 PolarHBondContact O-OG1 2.88Å; S483-T486 PolarHBondContact O-OG1 3.33Å; S483-T486 VanDerWaalsContact O-OG1 3.12Å; V484-T486 VanDerWaalsContact C-N 3.27Å; V484-T486 PolarHBondContact O-N 3.25Å
487	Q	78	Confident	84.7	Confident	72 Å²	72	60.4 Å²	60.4	34%	0.336	33%	0.33	S	S	.	.	H	α-helix	trans	-92.3	-29.5	-177.6	-58	-176.3	32.6	0	0	113.9	P358 I362 S483	P358-Q487 HydrophobicContact CB-CB 3.88Å; P358-Q487 PolarHBondContact O-OE1 3.09Å; I362-Q487 HydrophobicContact CD1-CB 4.25Å; S483-Q487 VanDerWaalsContact O-CB 3.32Å; S483-Q487 WeakPolarHBondContact O-CB 3.29Å; S483-Q487 VanDerWaalsContact O-CG 3.27Å; S483-Q487 WeakPolarHBondContact O-CG 3.43Å; S483-Q487 PolarHBondContact O-N 2.93Å; S483-Q487 VanDerWaalsContact O-N 3.1Å
488	L	77.1	Confident	84.4	Confident	10 Å²	10	57 Å²	57	5%	0.052	32%	0.318	C	S	.	.	H	α-helix	trans	-105.7	0.8	-177.9	-70.2	167.3	0	0	0	114.4	L345 P358 I362 V484 L490	L345-L488 HydrophobicContact CD2-CD1 3.78Å; P358-L488 HydrophobicContact CG-CD2 4Å; I362-L488 HydrophobicContact CD1-CD1 4.49Å; V484-L488 HydrophobicContact CG1-CD1 4.2Å; V484-L488 WeakPolarHBondContact O-CB 3.46Å; V484-L488 PolarHBondContact O-N 2.89Å; L488-L490 HydrophobicContact CB-CD1 4.02Å; L488-L490 HydrophobicContact CB-CG 4.36Å
489	S	76.8	Confident	84.3	Confident	99 Å²	99	53.3 Å²	53.3	69%	0.692	30%	0.297	S	S	*	.			trans	57	45.1	177.6	68.7	0	0	0	0	114	P485	P485-S489 WeakPolarHBondContact O-CA 3.38Å; P485-S489 PolarHBondContact O-N 3.43Å; P485-S489 VanDerWaalsContact O-N 3.14Å
490	L	79.1	Confident	84.4	Confident	50 Å²	50	57.2 Å²	57.2	26%	0.262	32%	0.318	S	S	.	.			trans	-101.1	155.4	-179.5	-71.6	163.7	0	0	0	111.5	L348 V484 L488	L348-L490 HydrophobicContact CD1-CD1 3.93Å; L348-L490 HydrophobicContact CD2-CD1 4.12Å; L348-L490 HydrophobicContact CD2-CD2 4.47Å; V484-L490 HydrophobicContact CG1-CD1 3.78Å; L488-L490 HydrophobicContact CB-CD1 4.02Å; L488-L490 HydrophobicContact CB-CG 4.36Å
491	T	83.4	Confident	84.3	Confident	90 Å²	90	60.2 Å²	60.2	55%	0.552	33%	0.332	S	S	*	.			trans	-74.7	145.1	171.8	55.3	0	0	0	0	110.6	E493 R494 C495	T491-E493 VanDerWaalsContact C-N 3.29Å; T491-E493 PolarHBondContact O-N 2.98Å; T491-R494 PolarHBondContact O-N 3.01Å; T491-C495 PolarHBondContact O-N 3.45Å; T491-C495 VanDerWaalsContact O-N 3.1Å
492	T	81.8	Confident	84.3	Confident	98 Å²	98	58.2 Å²	58.2	60%	0.601	32%	0.321	S	S	*	.	H	α-helix	trans	-55.7	-44.1	177.5	44.4	0	0	0	0	111.9	R494 C495 E496	T492-R494 VanDerWaalsContact C-N 3.28Å; T492-R494 PolarHBondContact O-N 3.28Å; T492-C495 PolarHBondContact O-N 3.44Å; T492-C495 VanDerWaalsContact O-N 3.09Å; T492-E496 WeakPolarHBondContact O-CG 3.26Å; T492-E496 PolarHBondContact O-N 3.2Å
493	E	83.6	Confident	84.5	Confident	162 Å²	162	57.8 Å²	57.8	76%	0.757	31%	0.31	S	S	*	.	H	α-helix	trans	-56.3	-37.9	175.5	-63.1	177.8	165.6	0	0	113	T491 S497	T491-E493 VanDerWaalsContact C-N 3.29Å; T491-E493 PolarHBondContact O-N 2.98Å; E493-S497 PolarHBondContact O-N 3.34Å; E493-S497 VanDerWaalsContact O-N 3.09Å; E493-S497 PolarHBondContact O-OG 3.1Å
494	R	83.8	Confident	84.8	Confident	103 Å²	103	63.6 Å²	63.6	39%	0.389	34%	0.335	S	S	.	.	H	α-helix	trans	-73	-38.9	176.6	-171.6	65.5	-170.3	128.4	0.7	111.1	T491 T492 S497 L498 E501	T491-R494 PolarHBondContact O-N 3.01Å; T492-R494 VanDerWaalsContact C-N 3.28Å; T492-R494 PolarHBondContact O-N 3.28Å; R494-S497 WeakPolarHBondContact CA-OG 3.42Å; R494-S497 PolarHBondContact NH1-OG 3.47Å; R494-S497 PolarHBondContact O-N 3.21Å; R494-S497 PolarHBondContact O-OG 2.93Å; R494-L498 HydrophobicContact CG-CD1 4.1Å; R494-L498 WeakPolarHBondContact O-CD1 3.44Å; R494-L498 VanDerWaalsContact O-CG 3.31Å; R494-L498 WeakPolarHBondContact O-CG 3.34Å; R494-L498 PolarHBondContact O-N 2.89Å; R494-E501 IonicContact CZ-OE1 3.65Å; R494-E501 IonicContact NH1-OE1 3.56Å; R494-E501 PolarHBondContact NH1-OE1 2.74Å; R494-E501 IonicContact NH2-OE1 3.9Å; R494-E501 PolarHBondContact NH2-OE1 3.27Å; R494-E501 IonicContact NH2-OE2 2.71Å
495	C	83.9	Confident	85.1	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-63	-40.9	175.2	-64.4	0	0	0	0	112.5	L481 P485 T491 T492 L498 W499	L481-C495 HydrophobicContact CD2-CB 3.84Å; P485-C495 HydrophobicContact CG-CB 4.41Å; T491-C495 PolarHBondContact O-N 3.45Å; T491-C495 VanDerWaalsContact O-N 3.1Å; T492-C495 PolarHBondContact O-N 3.44Å; T492-C495 VanDerWaalsContact O-N 3.09Å; C495-L498 PolarHBondContact O-N 2.87Å; C495-W499 PolarHBondContact O-N 2.76Å
496	E	88.1	Confident	85.5	Confident	92 Å²	92	66.1 Å²	66.1	43%	0.43	35%	0.345	S	S	.	.	H	α-helix	trans	-62	-44.2	172.8	-68.4	-75.6	-168.6	0	0	111.6	L481 T492 L498 W499 L500	L481-E496 HydrophobicContact CD2-CG 4.43Å; T492-E496 WeakPolarHBondContact O-CG 3.26Å; T492-E496 PolarHBondContact O-N 3.2Å; E496-L498 VanDerWaalsContact C-N 3.34Å; E496-L498 PolarHBondContact O-N 3.12Å; E496-W499 PolarHBondContact O-N 2.9Å; E496-L500 WeakPolarHBondContact O-CG 3.3Å; E496-L500 PolarHBondContact O-N 3.37Å
497	S	87.9	Confident	86	Confident	36 Å²	36	63.4 Å²	63.4	25%	0.252	33%	0.334	S	S	.	.	H	α-helix	trans	-63.2	-38.1	176.1	66	0	0	0	0	113	E493 R494 L500 E501	E493-S497 PolarHBondContact O-N 3.34Å; E493-S497 VanDerWaalsContact O-N 3.09Å; E493-S497 PolarHBondContact O-OG 3.1Å; R494-S497 WeakPolarHBondContact CA-OG 3.42Å; R494-S497 PolarHBondContact NH1-OG 3.47Å; R494-S497 PolarHBondContact O-N 3.21Å; R494-S497 PolarHBondContact O-OG 2.93Å; S497-L500 PolarHBondContact O-N 3.36Å; S497-E501 VanDerWaalsContact O-CG 3.32Å; S497-E501 WeakPolarHBondContact O-CG 3.44Å; S497-E501 PolarHBondContact O-N 3.5Å
498	L	86.9	Confident	86.6	Confident	6 Å²	6	65.2 Å²	65.2	3%	0.031	35%	0.346	C	S	.	.	H	α-helix	trans	-68.3	-33.6	175.3	-72.5	162.4	0	0	0	112.2	L348 F480 R494 C495 E496 E501 V502	L348-L498 HydrophobicContact CD1-CD1 4.01Å; L348-L498 HydrophobicContact CD2-CD1 4.33Å; F480-L498 HydrophobicContact CZ-CB 4.42Å; R494-L498 HydrophobicContact CG-CD1 4.1Å; R494-L498 WeakPolarHBondContact O-CD1 3.44Å; R494-L498 VanDerWaalsContact O-CG 3.31Å; R494-L498 WeakPolarHBondContact O-CG 3.34Å; R494-L498 PolarHBondContact O-N 2.89Å; C495-L498 PolarHBondContact O-N 2.87Å; E496-L498 VanDerWaalsContact C-N 3.34Å; E496-L498 PolarHBondContact O-N 3.12Å; L498-E501 PolarHBondContact O-N 3.13Å; L498-V502 WeakPolarHBondContact O-CG2 3.38Å; L498-V502 PolarHBondContact O-N 3.42Å
499	W	91.4	Very high	87.1	Confident	14 Å²	14	67.8 Å²	67.8	5%	0.053	36%	0.357	C	S	.	.	H	α-helix	trans	-67.4	-40.1	174.2	-173.7	-96.2	0	0	0	111.9	I341 A476 R477 F480 C495 E496 V502 E503	I341-W499 HydrophobicContact CD1-CH2 4.22Å; I341-W499 HydrophobicContact CD1-CZ3 3.8Å; I341-W499 HydrophobicContact CG1-CZ3 4.35Å; A476-W499 HydrophobicContact CB-CH2 3.71Å; A476-W499 HydrophobicContact CB-CZ3 4.38Å; R477-W499 HydrophobicContact CB-CD2 4.04Å; R477-W499 HydrophobicContact CB-CE3 4.4Å; R477-W499 HydrophobicContact CB-CH2 3.95Å; R477-W499 HydrophobicContact CB-CZ2 3.53Å; R477-W499 HydrophobicContact CB-CZ3 4.35Å; R477-W499 HydrophobicContact CG-CD2 3.86Å; R477-W499 HydrophobicContact CG-CE3 4.47Å; R477-W499 HydrophobicContact CG-CG 4.09Å; R477-W499 HydrophobicContact CG-CZ2 4.21Å; F480-W499 HydrophobicContact CB-CE3 4.13Å; F480-W499 HydrophobicContact CB-CZ3 4.05Å; F480-W499 AromaticContact CD1-CE3 3.78Å; F480-W499 HydrophobicContact CD1-CE3 3.78Å; F480-W499 HydrophobicContact CD1-CZ3 4.48Å; F480-W499 HydrophobicContact CE1-CB 4.49Å; F480-W499 HydrophobicContact CE1-CE3 4.29Å; F480-W499 AromaticContact CG-CE3 3.92Å; F480-W499 HydrophobicContact CG-CE3 3.92Å; F480-W499 HydrophobicContact CG-CZ3 4.17Å; C495-W499 PolarHBondContact O-N 2.76Å; E496-W499 PolarHBondContact O-N 2.9Å; W499-V502 PolarHBondContact O-N 3.38Å; W499-E503 HydrophobicContact CZ2-CG 3.9Å; W499-E503 VanDerWaalsContact CZ2-OE1 3.24Å; W499-E503 WeakPolarHBondContact CZ2-OE1 3.32Å; W499-E503 PolarHBondContact O-N 3.23Å
500	L	91.1	Very high	87.6	Confident	121 Å²	121	64.6 Å²	64.6	63%	0.634	33%	0.332	S	S	*	.	H	α-helix	trans	-65.9	-39.5	173.7	-69.1	169.2	0	0	0	112.3	E496 S497 V502 Q504	E496-L500 WeakPolarHBondContact O-CG 3.3Å; E496-L500 PolarHBondContact O-N 3.37Å; S497-L500 PolarHBondContact O-N 3.36Å; L500-V502 VanDerWaalsContact C-N 3.33Å; L500-V502 PolarHBondContact O-N 2.93Å; L500-Q504 WeakPolarHBondContact O-CB 3.24Å; L500-Q504 PolarHBondContact O-N 3.08Å; L500-Q504 VanDerWaalsContact O-N 3.09Å
501	E	89.1	Confident	88	Confident	64 Å²	64	69.2 Å²	69.2	30%	0.299	35%	0.352	S	S	.	.	H	α-helix	trans	-57	-45.6	171.3	-72	166.6	-144.3	0	0	110.6	R494 S497 L498 E505	R494-E501 IonicContact CZ-OE1 3.65Å; R494-E501 IonicContact NH1-OE1 3.56Å; R494-E501 PolarHBondContact NH1-OE1 2.74Å; R494-E501 IonicContact NH2-OE1 3.9Å; R494-E501 PolarHBondContact NH2-OE1 3.27Å; R494-E501 IonicContact NH2-OE2 2.71Å; S497-E501 VanDerWaalsContact O-CG 3.32Å; S497-E501 WeakPolarHBondContact O-CG 3.44Å; S497-E501 PolarHBondContact O-N 3.5Å; L498-E501 PolarHBondContact O-N 3.13Å; E501-E505 PolarHBondContact O-N 2.88Å
502	V	89.9	Confident	88.1	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-67.9	-48.8	179.4	167.4	0	0	0	0	113.6	L340 I341 R344 L498 W499 L500 Q504 E505 L506	L340-V502 HydrophobicContact CB-CG1 4.05Å; I341-V502 HydrophobicContact CG1-CG1 4.16Å; R344-V502 HydrophobicContact CG-CG2 3.63Å; L498-V502 WeakPolarHBondContact O-CG2 3.38Å; L498-V502 PolarHBondContact O-N 3.42Å; W499-V502 PolarHBondContact O-N 3.38Å; L500-V502 VanDerWaalsContact C-N 3.33Å; L500-V502 PolarHBondContact O-N 2.93Å; V502-Q504 VanDerWaalsContact C-N 3.26Å; V502-Q504 PolarHBondContact O-N 3.34Å; V502-E505 PolarHBondContact O-N 3.3Å; V502-L506 VanDerWaalsContact O-CB 3.23Å; V502-L506 WeakPolarHBondContact O-CB 3.31Å; V502-L506 PolarHBondContact O-N 3.01Å
503	E	90.3	Very high	88.1	Confident	47 Å²	47	66.6 Å²	66.6	22%	0.22	33%	0.327	C	S	.	.	H	α-helix	trans	-69.3	-24.2	-179.6	-75.2	-76	163.9	0	0	112.2	R337 S473 W499 A507	R337-E503 IonicContact CZ-OE1 3.87Å; R337-E503 VanDerWaalsContact CZ-OE1 3.26Å; R337-E503 IonicContact NE-OE1 2.71Å; R337-E503 PolarHBondContact NE-OE1 2.62Å; R337-E503 IonicContact NH2-OE1 3.34Å; R337-E503 PolarHBondContact NH2-OE1 2.93Å; R337-E503 IonicContact NH2-OE2 2.62Å; R337-E503 PolarHBondContact NH2-OE2 2.91Å; R337-E503 VanDerWaalsContact NH2-OE2 3.08Å; S473-E503 WeakPolarHBondContact CB-OE1 3.48Å; S473-E503 PolarHBondContact OG-OE1 3.23Å; W499-E503 HydrophobicContact CZ2-CG 3.9Å; W499-E503 VanDerWaalsContact CZ2-OE1 3.24Å; W499-E503 WeakPolarHBondContact CZ2-OE1 3.32Å; W499-E503 PolarHBondContact O-N 3.23Å; E503-A507 WeakPolarHBondContact O-CB 3.42Å; E503-A507 PolarHBondContact O-N 3.05Å; E503-A507 VanDerWaalsContact O-N 3.15Å
504	Q	91.9	Very high	88.2	Confident	137 Å²	137	62.3 Å²	62.3	64%	0.64	31%	0.307	S	S	*	.	H	α-helix	trans	-73	-47.7	172.3	-175.2	169.8	-14.6	0	0	112.1	L500 V502 L506 A507 D508	L500-Q504 WeakPolarHBondContact O-CB 3.24Å; L500-Q504 PolarHBondContact O-N 3.08Å; L500-Q504 VanDerWaalsContact O-N 3.09Å; V502-Q504 VanDerWaalsContact C-N 3.26Å; V502-Q504 PolarHBondContact O-N 3.34Å; Q504-L506 VanDerWaalsContact C-N 3.3Å; Q504-L506 PolarHBondContact O-N 3.4Å; Q504-A507 WeakPolarHBondContact O-CB 2.98Å; Q504-A507 PolarHBondContact O-N 3.38Å; Q504-D508 PolarHBondContact O-N 3.26Å
505	E	90.8	Very high	88.3	Confident	77 Å²	77	60.6 Å²	60.6	36%	0.36	31%	0.311	S	S	.	.	H	α-helix	trans	-61.7	-40	175.7	-72.3	174.2	155	0	0	111.4	L340 R344 E501 V502 A507 D508 E509	L340-E505 HydrophobicContact CD1-CB 4.28Å; L340-E505 HydrophobicContact CD2-CB 4.25Å; R344-E505 IonicContact CZ-OE1 2.87Å; R344-E505 IonicContact CZ-OE2 3.82Å; R344-E505 IonicContact NE-OE2 2.74Å; R344-E505 IonicContact NH2-OE1 3.78Å; R344-E505 PolarHBondContact NH2-OE1 3.01Å; R344-E505 IonicContact NH2-OE2 3.38Å; R344-E505 PolarHBondContact NH2-OE2 3.5Å; E501-E505 PolarHBondContact O-N 2.88Å; V502-E505 PolarHBondContact O-N 3.3Å; E505-A507 VanDerWaalsContact C-N 3.3Å; E505-A507 PolarHBondContact O-N 3.28Å; E505-D508 PolarHBondContact O-N 2.86Å; E505-E509 PolarHBondContact O-N 3.08Å; E505-E509 VanDerWaalsContact O-N 3.15Å
506	L	91.1	Very high	88.3	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60.7	-36.9	174.8	-178	62.1	0	0	0	112.6	L336 R337 L340 V502 Q504 L510	L336-L506 HydrophobicContact CB-CD1 3.45Å; L336-L506 VanDerWaalsContact CB-CD1 3.45Å; L336-L506 HydrophobicContact CD1-CD1 3.8Å; L336-L506 HydrophobicContact CG-CD1 4.33Å; R337-L506 HydrophobicContact CB-CD1 4.47Å; R337-L506 HydrophobicContact CB-CD2 3.93Å; R337-L506 HydrophobicContact CG-CD2 4.12Å; R337-L506 VanDerWaalsContact NH2-CD2 3.27Å; L340-L506 HydrophobicContact CD1-CB 3.75Å; L340-L506 HydrophobicContact CD1-CD1 4.21Å; V502-L506 VanDerWaalsContact O-CB 3.23Å; V502-L506 WeakPolarHBondContact O-CB 3.31Å; V502-L506 PolarHBondContact O-N 3.01Å; Q504-L506 VanDerWaalsContact C-N 3.3Å; Q504-L506 PolarHBondContact O-N 3.4Å; L506-L510 HydrophobicContact CD1-CD1 4.21Å; L506-L510 HydrophobicContact CD1-CG 4.13Å; L506-L510 HydrophobicContact CG-CD1 3.86Å; L506-L510 HydrophobicContact CG-CG 4.25Å; L506-L510 VanDerWaalsContact O-CB 3.24Å; L506-L510 WeakPolarHBondContact O-CB 3.28Å; L506-L510 WeakPolarHBondContact O-CG 3.49Å; L506-L510 PolarHBondContact O-N 2.91Å
507	A	90.7	Very high	88	Confident	54 Å²	54	58.8 Å²	58.8	45%	0.446	31%	0.307	S	S	.	.	H	α-helix	trans	-66.3	-40.7	179.2	0	0	0	0	0	112.4	E503 Q504 E505 Q511	E503-A507 WeakPolarHBondContact O-CB 3.42Å; E503-A507 PolarHBondContact O-N 3.05Å; E503-A507 VanDerWaalsContact O-N 3.15Å; Q504-A507 WeakPolarHBondContact O-CB 2.98Å; Q504-A507 PolarHBondContact O-N 3.38Å; E505-A507 VanDerWaalsContact C-N 3.3Å; E505-A507 PolarHBondContact O-N 3.28Å; A507-Q511 PolarHBondContact O-N 3.25Å
508	D	89.3	Confident	87.8	Confident	110 Å²	110	61.7 Å²	61.7	59%	0.588	31%	0.312	S	S	*	.	H	α-helix	trans	-66.5	-45	177.3	-74	-28.8	0	0	0	111.2	Q504 E505 Q511 Q512	Q504-D508 PolarHBondContact O-N 3.26Å; E505-D508 PolarHBondContact O-N 2.86Å; D508-Q511 PolarHBondContact O-N 3.46Å; D508-Q512 PolarHBondContact O-N 2.96Å
509	E	87.4	Confident	87.8	Confident	64 Å²	64	66.8 Å²	66.8	30%	0.299	34%	0.336	S	S	.	.	H	α-helix	trans	-67.1	-37.9	176.5	-65.3	-171.3	151.2	0	0	112.5	W332 L336 E505 Q511 Q512 A513	W332-E509 HydrophobicContact CH2-CB 4.29Å; W332-E509 VanDerWaalsContact CH2-O 3.29Å; W332-E509 WeakPolarHBondContact CH2-O 3.46Å; W332-E509 VanDerWaalsContact CZ3-O 3.31Å; W332-E509 WeakPolarHBondContact CZ3-O 3.46Å; L336-E509 HydrophobicContact CD1-CB 3.45Å; L336-E509 VanDerWaalsContact CD1-CB 3.45Å; L336-E509 HydrophobicContact CD1-CG 4.44Å; L336-E509 VanDerWaalsContact CD1-OE2 3.32Å; L336-E509 WeakPolarHBondContact CD1-OE2 3.29Å; L336-E509 WeakPolarHBondContact CD2-OE2 3.39Å; E505-E509 PolarHBondContact O-N 3.08Å; E505-E509 VanDerWaalsContact O-N 3.15Å; E509-Q511 VanDerWaalsContact C-N 3.33Å; E509-Q511 PolarHBondContact O-N 3.45Å; E509-Q512 WeakPolarHBondContact O-CB 3.17Å; E509-Q512 PolarHBondContact O-N 3.46Å; E509-Q512 VanDerWaalsContact O-N 3.1Å; E509-A513 PolarHBondContact O-N 3.16Å
510	L	87.3	Confident	87.3	Confident	31 Å²	31	67.6 Å²	67.6	16%	0.162	34%	0.34	C	S	.	.	H	α-helix	trans	-60.4	-40.4	173.2	-78.9	172.1	0	0	0	112.4	W332 E333 L506 Q512 A513 E514	W332-L510 HydrophobicContact CE3-CD2 4.2Å; W332-L510 HydrophobicContact CZ3-CD2 4.3Å; E333-L510 HydrophobicContact CB-CD2 3.82Å; E333-L510 HydrophobicContact CG-CD1 4.17Å; E333-L510 HydrophobicContact CG-CD2 4.01Å; L506-L510 HydrophobicContact CD1-CD1 4.21Å; L506-L510 HydrophobicContact CD1-CG 4.13Å; L506-L510 HydrophobicContact CG-CD1 3.86Å; L506-L510 HydrophobicContact CG-CG 4.25Å; L506-L510 VanDerWaalsContact O-CB 3.24Å; L506-L510 WeakPolarHBondContact O-CB 3.28Å; L506-L510 WeakPolarHBondContact O-CG 3.49Å; L506-L510 PolarHBondContact O-N 2.91Å; L510-Q512 VanDerWaalsContact C-N 3.26Å; L510-Q512 PolarHBondContact O-N 3.46Å; L510-A513 PolarHBondContact O-N 2.82Å; L510-E514 PolarHBondContact O-N 3.32Å
511	Q	88.2	Confident	87	Confident	147 Å²	147	63 Å²	63	69%	0.687	32%	0.316	S	S	*	.	H	α-helix	trans	-62.4	-36.4	174.5	-173.2	173.3	-57	0	0	111.4	A507 D508 E509 S515	A507-Q511 PolarHBondContact O-N 3.25Å; D508-Q511 PolarHBondContact O-N 3.46Å; E509-Q511 VanDerWaalsContact C-N 3.33Å; E509-Q511 PolarHBondContact O-N 3.45Å; Q511-S515 PolarHBondContact O-N 2.95Å; Q511-S515 VanDerWaalsContact O-N 3.17Å
512	Q	86	Confident	86.9	Confident	132 Å²	132	61.6 Å²	61.6	62%	0.617	31%	0.311	S	S	*	.	H	α-helix	trans	-64.8	-51.2	175.6	-172.7	174	-18.6	0	0	112.1	D508 E509 L510 E514 S515 T516	D508-Q512 PolarHBondContact O-N 2.96Å; E509-Q512 WeakPolarHBondContact O-CB 3.17Å; E509-Q512 PolarHBondContact O-N 3.46Å; E509-Q512 VanDerWaalsContact O-N 3.1Å; L510-Q512 VanDerWaalsContact C-N 3.26Å; L510-Q512 PolarHBondContact O-N 3.46Å; Q512-E514 PolarHBondContact O-N 3.41Å; Q512-S515 WeakPolarHBondContact O-CB 3.49Å; Q512-S515 PolarHBondContact O-N 3.38Å; Q512-S515 VanDerWaalsContact O-N 3.09Å; Q512-S515 PolarHBondContact O-OG 3.2Å; Q512-T516 PolarHBondContact O-N 2.94Å; Q512-T516 PolarHBondContact O-OG1 2.59Å
513	A	82.1	Confident	86.6	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.008	33%	0.33	C	S	.	.	H	α-helix	trans	-68.8	-29.4	178.7	0	0	0	0	0	113.9	L329 W332 E509 L510 S515 T516 A517 L620	L329-A513 HydrophobicContact CD2-CB 4.38Å; W332-A513 HydrophobicContact CD2-CB 3.76Å; W332-A513 HydrophobicContact CE3-CB 3.37Å; W332-A513 HydrophobicContact CH2-CB 3.32Å; W332-A513 HydrophobicContact CZ2-CB 3.73Å; W332-A513 HydrophobicContact CZ3-CB 3.13Å; E509-A513 PolarHBondContact O-N 3.16Å; L510-A513 PolarHBondContact O-N 2.82Å; A513-S515 VanDerWaalsContact C-N 3.27Å; A513-S515 PolarHBondContact O-N 2.82Å; A513-T516 PolarHBondContact O-N 3.06Å; A513-A517 VanDerWaalsContact O-CB 3.28Å; A513-A517 WeakPolarHBondContact O-CB 3.49Å; A513-A517 PolarHBondContact O-N 3.11Å; A513-L620 HydrophobicContact CB-CD2 4.27Å
514	E	85.7	Confident	86.3	Confident	73 Å²	73	65 Å²	65	34%	0.341	33%	0.33	S	S	.	.	H	α-helix	trans	-62	-37.8	169.6	-79.3	-152	-178.2	0	0	111.5	L329 L510 Q512 R518	L329-E514 HydrophobicContact CD1-CG 4.46Å; L510-E514 PolarHBondContact O-N 3.32Å; Q512-E514 PolarHBondContact O-N 3.41Å; E514-R518 VanDerWaalsContact O-CG 3.23Å; E514-R518 WeakPolarHBondContact O-CG 3.43Å; E514-R518 PolarHBondContact O-N 3.36Å; E514-R518 PolarHBondContact O-NE 3Å; E514-R518 IonicContact OE2-CZ 2.74Å; E514-R518 IonicContact OE2-NH2 3.63Å; E514-R518 PolarHBondContact OE2-NH2 3.47Å
515	S	86.1	Confident	86.1	Confident	66 Å²	66	60.2 Å²	60.2	46%	0.462	31%	0.306	S	S	.	.	H	α-helix	trans	-66.2	-43.4	174.3	79	0	0	0	0	112.1	Q511 Q512 A513 A517 R518 Q519	Q511-S515 PolarHBondContact O-N 2.95Å; Q511-S515 VanDerWaalsContact O-N 3.17Å; Q512-S515 WeakPolarHBondContact O-CB 3.49Å; Q512-S515 PolarHBondContact O-N 3.38Å; Q512-S515 VanDerWaalsContact O-N 3.09Å; Q512-S515 PolarHBondContact O-OG 3.2Å; A513-S515 VanDerWaalsContact C-N 3.27Å; A513-S515 PolarHBondContact O-N 2.82Å; S515-A517 PolarHBondContact O-N 3.09Å; S515-R518 PolarHBondContact O-N 2.71Å; S515-Q519 PolarHBondContact O-N 2.94Å
516	T	82.9	Confident	86	Confident	51 Å²	51	59.2 Å²	59.2	31%	0.313	31%	0.305	S	S	.	.	H	α-helix	trans	-62.7	-41.4	176	-52.1	0	0	0	0	112	Q512 A513 R518 Q519 Q520 L620	Q512-T516 PolarHBondContact O-N 2.94Å; Q512-T516 PolarHBondContact O-OG1 2.59Å; A513-T516 PolarHBondContact O-N 3.06Å; T516-R518 VanDerWaalsContact C-N 3.34Å; T516-R518 PolarHBondContact O-N 3.41Å; T516-Q519 PolarHBondContact O-N 3.24Å; T516-Q520 WeakPolarHBondContact O-CG 3.4Å; T516-Q520 PolarHBondContact O-N 3.27Å; T516-L620 HydrophobicContact CG2-CD1 4.38Å; T516-L620 HydrophobicContact CG2-CD2 3.94Å; T516-L620 HydrophobicContact CG2-CG 4.34Å
517	A	81.4	Confident	85.8	Confident	4 Å²	4	62.1 Å²	62.1	3%	0.033	32%	0.319	C	S	.	.	H	α-helix	trans	-68.6	-31.7	177.9	0	0	0	0	0	112.5	L329 A513 S515 L521 F617	L329-A517 HydrophobicContact CD1-CB 4.38Å; L329-A517 HydrophobicContact CD2-CB 4.09Å; L329-A517 HydrophobicContact CG-CB 4.49Å; A513-A517 VanDerWaalsContact O-CB 3.28Å; A513-A517 WeakPolarHBondContact O-CB 3.49Å; A513-A517 PolarHBondContact O-N 3.11Å; S515-A517 PolarHBondContact O-N 3.09Å; A517-L521 VanDerWaalsContact O-CG 3.32Å; A517-L521 WeakPolarHBondContact O-CG 3.46Å; A517-L521 PolarHBondContact O-N 3.29Å; A517-L521 VanDerWaalsContact O-N 3.13Å; A517-F617 HydrophobicContact CB-CD1 4.31Å; A517-F617 HydrophobicContact CB-CE1 4.18Å
518	R	84.9	Confident	85.8	Confident	97 Å²	97	60 Å²	60	37%	0.366	30%	0.3	S	S	.	.	H	α-helix	trans	-69.8	-41.3	172.1	-71	175.7	-137.7	165.1	4.7	111.7	E18 E514 S515 T516 L521 D522	E18-R518 WeakPolarHBondContact OE1-CD 3.25Å; E18-R518 IonicContact OE1-CZ 3.94Å; E18-R518 IonicContact OE1-NE 2.69Å; E18-R518 IonicContact OE1-NH1 3.55Å; E18-R518 PolarHBondContact OE1-NH1 3.08Å; E18-R518 WeakPolarHBondContact OE2-CD 3.42Å; E514-R518 VanDerWaalsContact O-CG 3.23Å; E514-R518 WeakPolarHBondContact O-CG 3.43Å; E514-R518 PolarHBondContact O-N 3.36Å; E514-R518 PolarHBondContact O-NE 3Å; E514-R518 IonicContact OE2-CZ 2.74Å; E514-R518 IonicContact OE2-NH2 3.63Å; E514-R518 PolarHBondContact OE2-NH2 3.47Å; S515-R518 PolarHBondContact O-N 2.71Å; T516-R518 VanDerWaalsContact C-N 3.34Å; T516-R518 PolarHBondContact O-N 3.41Å; R518-L521 PolarHBondContact O-N 3.35Å; R518-D522 PolarHBondContact O-N 3.04Å; R518-D522 VanDerWaalsContact O-N 3.08Å
519	Q	85.8	Confident	85.8	Confident	112 Å²	112	60 Å²	60	52%	0.523	30%	0.296	S	S	.	.	H	α-helix	trans	-58.4	-48.9	172	-176.9	60.1	50.3	0	0	111.3	S515 T516 L521 D522 D523	S515-Q519 PolarHBondContact O-N 2.94Å; T516-Q519 PolarHBondContact O-N 3.24Å; Q519-L521 VanDerWaalsContact C-N 3.28Å; Q519-L521 PolarHBondContact O-N 2.74Å; Q519-D522 PolarHBondContact O-N 3.07Å; Q519-D522 VanDerWaalsContact O-N 3.07Å; Q519-D523 PolarHBondContact NE2-OD1 3.05Å; Q519-D523 VanDerWaalsContact O-CG 3.22Å; Q519-D523 PolarHBondContact O-N 2.93Å
520	Q	81.1	Confident	86	Confident	31 Å²	31	62 Å²	62	15%	0.145	30%	0.304	C	S	.	.	H	α-helix	trans	-58.2	-36.5	177.2	-74.3	173.1	-11.3	0	0	113.1	T516 I524 F617	T516-Q520 WeakPolarHBondContact O-CG 3.4Å; T516-Q520 PolarHBondContact O-N 3.27Å; Q520-I524 WeakPolarHBondContact O-CB 3.27Å; Q520-I524 WeakPolarHBondContact O-CD1 3.32Å; Q520-I524 VanDerWaalsContact O-CG1 3.23Å; Q520-I524 WeakPolarHBondContact O-CG1 3.4Å; Q520-I524 PolarHBondContact O-N 3.44Å; Q520-F617 HydrophobicContact CB-CE1 4.11Å; Q520-F617 VanDerWaalsContact OE1-CD1 3.25Å
521	L	84.5	Confident	86	Confident	24 Å²	24	62.1 Å²	62.1	13%	0.126	31%	0.305	C	S	.	.	H	α-helix	trans	-69.1	-36.7	175.5	-75.5	166.9	0	0	0	112.9	L322 A517 R518 Q519 R525 F617	L322-L521 HydrophobicContact CB-CD2 4.29Å; L322-L521 HydrophobicContact CD1-CD1 3.81Å; A517-L521 VanDerWaalsContact O-CG 3.32Å; A517-L521 WeakPolarHBondContact O-CG 3.46Å; A517-L521 PolarHBondContact O-N 3.29Å; A517-L521 VanDerWaalsContact O-N 3.13Å; R518-L521 PolarHBondContact O-N 3.35Å; Q519-L521 VanDerWaalsContact C-N 3.28Å; Q519-L521 PolarHBondContact O-N 2.74Å; L521-R525 PolarHBondContact O-N 2.73Å; L521-R525 VanDerWaalsContact O-N 3.08Å; L521-F617 HydrophobicContact CD2-CZ 3.78Å; L521-F617 HydrophobicContact CG-CE1 4.32Å; L521-F617 HydrophobicContact CG-CZ 3.93Å
522	D	87.2	Confident	86.2	Confident	36 Å²	36	56.9 Å²	56.9	19%	0.193	28%	0.28	C	S	.	.	H	α-helix	trans	-73.3	-36.9	174.5	-91.1	16	0	0	0	111.8	R14 R518 Q519 R525 T526	R14-D522 IonicContact CZ-OD2 3.55Å; R14-D522 IonicContact NE-OD1 3.18Å; R14-D522 IonicContact NE-OD2 2.64Å; R14-D522 PolarHBondContact NE-OD2 3.43Å; R14-D522 IonicContact NH2-OD2 2.76Å; R14-D522 PolarHBondContact NH2-OD2 2.81Å; R518-D522 PolarHBondContact O-N 3.04Å; R518-D522 VanDerWaalsContact O-N 3.08Å; Q519-D522 PolarHBondContact O-N 3.07Å; Q519-D522 VanDerWaalsContact O-N 3.07Å; D522-R525 WeakPolarHBondContact O-CB 3.28Å; D522-R525 PolarHBondContact O-N 3.44Å; D522-R525 VanDerWaalsContact O-N 3.11Å; D522-R525 IonicContact OD1-CZ 2.91Å; D522-R525 IonicContact OD1-NH1 3.26Å; D522-R525 PolarHBondContact OD1-NH1 3.35Å; D522-R525 IonicContact OD1-NH2 3.76Å; D522-R525 PolarHBondContact OD1-NH2 3.45Å; D522-R525 IonicContact OD2-NH1 2.81Å; D522-T526 WeakPolarHBondContact O-CG2 3.34Å; D522-T526 PolarHBondContact O-N 3.13Å
523	D	84.6	Confident	86.5	Confident	75 Å²	75	55.1 Å²	55.1	40%	0.401	27%	0.272	S	S	.	.	H	α-helix	trans	-57.8	-48.9	172	-65.6	-29.8	0	0	0	110.9	Q519 R525 T526 E527	Q519-D523 PolarHBondContact NE2-OD1 3.05Å; Q519-D523 VanDerWaalsContact O-CG 3.22Å; Q519-D523 PolarHBondContact O-N 2.93Å; D523-R525 VanDerWaalsContact C-N 3.3Å; D523-R525 PolarHBondContact O-N 3.4Å; D523-T526 WeakPolarHBondContact O-CA 3.29Å; D523-T526 PolarHBondContact O-N 3.29Å; D523-T526 PolarHBondContact O-OG1 2.93Å; D523-E527 PolarHBondContact O-N 2.95Å
524	I	83.1	Confident	86.8	Confident	42 Å²	42	59 Å²	59	22%	0.215	30%	0.296	C	S	.	.	H	α-helix	trans	-56.8	-41.7	173.1	-71.7	164.5	0	0	0	110.9	Q520 T526 E527 L528	Q520-I524 WeakPolarHBondContact O-CB 3.27Å; Q520-I524 WeakPolarHBondContact O-CD1 3.32Å; Q520-I524 VanDerWaalsContact O-CG1 3.23Å; Q520-I524 WeakPolarHBondContact O-CG1 3.4Å; Q520-I524 PolarHBondContact O-N 3.44Å; I524-T526 VanDerWaalsContact C-N 3.32Å; I524-T526 PolarHBondContact O-N 2.83Å; I524-E527 WeakPolarHBondContact O-CB 3.31Å; I524-E527 PolarHBondContact O-N 3.33Å; I524-L528 HydrophobicContact CG2-CD1 3.94Å; I524-L528 HydrophobicContact CG2-CG 4.34Å; I524-L528 WeakPolarHBondContact O-CG 3.24Å; I524-L528 PolarHBondContact O-N 3.1Å
525	R	87.5	Confident	87.1	Confident	37 Å²	37	55.8 Å²	55.8	14%	0.14	28%	0.28	C	S	.	.	H	α-helix	trans	-61.2	-41.8	174.2	-167.1	-173.7	-57.9	102.7	16	111.2	E318 L521 D522 D523 E527 L528 E529	E318-R525 IonicContact OE1-CZ 3.08Å; E318-R525 IonicContact OE1-NE 3.54Å; E318-R525 PolarHBondContact OE1-NE 3.39Å; E318-R525 IonicContact OE1-NH2 3.59Å; E318-R525 PolarHBondContact OE1-NH2 3.42Å; L521-R525 PolarHBondContact O-N 2.73Å; L521-R525 VanDerWaalsContact O-N 3.08Å; D522-R525 WeakPolarHBondContact O-CB 3.28Å; D522-R525 PolarHBondContact O-N 3.44Å; D522-R525 VanDerWaalsContact O-N 3.11Å; D522-R525 IonicContact OD1-CZ 2.91Å; D522-R525 IonicContact OD1-NH1 3.26Å; D522-R525 PolarHBondContact OD1-NH1 3.35Å; D522-R525 IonicContact OD1-NH2 3.76Å; D522-R525 PolarHBondContact OD1-NH2 3.45Å; D522-R525 IonicContact OD2-NH1 2.81Å; D523-R525 VanDerWaalsContact C-N 3.3Å; D523-R525 PolarHBondContact O-N 3.4Å; R525-E527 VanDerWaalsContact C-N 3.29Å; R525-E527 PolarHBondContact O-N 2.96Å; R525-L528 PolarHBondContact O-N 3.01Å; R525-E529 WeakPolarHBondContact CD-OE1 3.23Å; R525-E529 HydrophobicContact CG-CG 4.35Å; R525-E529 WeakPolarHBondContact O-CB 3.37Å; R525-E529 WeakPolarHBondContact O-CG 3.34Å; R525-E529 PolarHBondContact O-N 3.46Å
526	T	89.7	Confident	87.3	Confident	57 Å²	57	55 Å²	55	35%	0.35	27%	0.27	S	S	.	.	H	α-helix	trans	-66.9	-29.2	176.7	81.8	0	0	0	0	113.1	D522 D523 I524 K530	D522-T526 WeakPolarHBondContact O-CG2 3.34Å; D522-T526 PolarHBondContact O-N 3.13Å; D523-T526 WeakPolarHBondContact O-CA 3.29Å; D523-T526 PolarHBondContact O-N 3.29Å; D523-T526 PolarHBondContact O-OG1 2.93Å; I524-T526 VanDerWaalsContact C-N 3.32Å; I524-T526 PolarHBondContact O-N 2.83Å; T526-K530 WeakPolarHBondContact O-CD 3.33Å; T526-K530 VanDerWaalsContact O-CE 3.29Å; T526-K530 WeakPolarHBondContact O-CE 3.48Å; T526-K530 WeakPolarHBondContact O-CG 3.48Å; T526-K530 PolarHBondContact O-N 3.35Å; T526-K530 PolarHBondContact O-NZ 2.96Å; T526-K530 PolarHBondContact OG1-NZ 3.07Å
527	E	87.2	Confident	87.7	Confident	61 Å²	61	57.8 Å²	57.8	29%	0.285	28%	0.28	S	S	.	.	H	α-helix	trans	-66.1	-51.2	171.3	-170.2	-176.6	-159.2	0	0	110.2	D523 I524 R525 E529 K530 D531 Q614	D523-E527 PolarHBondContact O-N 2.95Å; I524-E527 WeakPolarHBondContact O-CB 3.31Å; I524-E527 PolarHBondContact O-N 3.33Å; R525-E527 VanDerWaalsContact C-N 3.29Å; R525-E527 PolarHBondContact O-N 2.96Å; E527-E529 VanDerWaalsContact C-N 3.31Å; E527-E529 PolarHBondContact O-N 2.94Å; E527-K530 WeakPolarHBondContact O-CB 3.44Å; E527-K530 PolarHBondContact O-N 3.36Å; E527-K530 VanDerWaalsContact O-N 3.09Å; E527-D531 PolarHBondContact O-N 3.27Å; E527-Q614 PolarHBondContact OE2-NE2 3.1Å
528	L	89.4	Confident	88	Confident	9 Å²	9	58.9 Å²	58.9	5%	0.047	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-32.2	179.2	-64.2	173	0	0	0	113.1	L314 E317 E318 I524 R525 Q532	L314-L528 HydrophobicContact CD2-CD2 3.88Å; E317-L528 HydrophobicContact CB-CD1 4.36Å; E317-L528 HydrophobicContact CB-CD2 4.41Å; E317-L528 HydrophobicContact CG-CD1 4.47Å; E317-L528 HydrophobicContact CG-CD2 4.1Å; E317-L528 WeakPolarHBondContact OE1-CD2 3.32Å; E318-L528 HydrophobicContact CB-CD1 4.11Å; I524-L528 HydrophobicContact CG2-CD1 3.94Å; I524-L528 HydrophobicContact CG2-CG 4.34Å; I524-L528 WeakPolarHBondContact O-CG 3.24Å; I524-L528 PolarHBondContact O-N 3.1Å; R525-L528 PolarHBondContact O-N 3.01Å; L528-Q532 WeakPolarHBondContact O-CB 3.43Å; L528-Q532 PolarHBondContact O-N 2.98Å
529	E	90.4	Very high	88.2	Confident	109 Å²	109	55.8 Å²	55.8	51%	0.509	28%	0.281	S	S	.	.	H	α-helix	trans	-70.7	-34.4	172.9	-75.7	-178.5	-166.9	0	0	112.6	R525 E527 Q533	R525-E529 WeakPolarHBondContact CD-OE1 3.23Å; R525-E529 HydrophobicContact CG-CG 4.35Å; R525-E529 WeakPolarHBondContact O-CB 3.37Å; R525-E529 WeakPolarHBondContact O-CG 3.34Å; R525-E529 PolarHBondContact O-N 3.46Å; E527-E529 VanDerWaalsContact C-N 3.31Å; E527-E529 PolarHBondContact O-N 2.94Å; E529-Q533 PolarHBondContact O-N 3.4Å; E529-Q533 VanDerWaalsContact O-N 3.16Å
530	K	90.3	Very high	88.5	Confident	108 Å²	108	52.4 Å²	52.4	47%	0.47	27%	0.273	S	S	.	.	H	α-helix	trans	-69.7	-46.7	172.7	-68.1	155.9	-164.5	149.3	0	110.8	T526 E527 Q532 Q533 V534	T526-K530 WeakPolarHBondContact O-CD 3.33Å; T526-K530 VanDerWaalsContact O-CE 3.29Å; T526-K530 WeakPolarHBondContact O-CE 3.48Å; T526-K530 WeakPolarHBondContact O-CG 3.48Å; T526-K530 PolarHBondContact O-N 3.35Å; T526-K530 PolarHBondContact O-NZ 2.96Å; T526-K530 PolarHBondContact OG1-NZ 3.07Å; E527-K530 WeakPolarHBondContact O-CB 3.44Å; E527-K530 PolarHBondContact O-N 3.36Å; E527-K530 VanDerWaalsContact O-N 3.09Å; K530-Q532 VanDerWaalsContact C-N 3.3Å; K530-Q532 PolarHBondContact O-N 3.48Å; K530-Q533 PolarHBondContact O-N 2.98Å; K530-Q533 VanDerWaalsContact O-N 3.12Å; K530-V534 WeakPolarHBondContact O-CG2 3.44Å; K530-V534 PolarHBondContact O-N 2.82Å
531	D	88.1	Confident	88.9	Confident	33 Å²	33	56.4 Å²	56.4	18%	0.176	30%	0.295	C	S	.	.	H	α-helix	trans	-58.3	-42.2	173.6	-94	6.1	0	0	0	110.6	E527 Q533 V534 W535 K610	E527-D531 PolarHBondContact O-N 3.27Å; D531-Q533 VanDerWaalsContact C-N 3.31Å; D531-Q533 PolarHBondContact O-N 2.77Å; D531-V534 PolarHBondContact O-N 2.75Å; D531-W535 WeakPolarHBondContact O-CB 3.45Å; D531-W535 PolarHBondContact O-N 3.11Å; D531-K610 IonicContact OD1-NZ 3.77Å; D531-K610 IonicContact OD2-NZ 3.73Å; D531-K610 PolarHBondContact OD2-NZ 3.49Å
532	Q	91.7	Very high	89.1	Confident	36 Å²	36	55.4 Å²	55.4	17%	0.168	29%	0.29	C	S	.	.	H	α-helix	trans	-56.7	-44.2	174.5	-168.2	-180	54	0	0	112.2	L310 L314 L528 K530 W535 I536	L310-Q532 HydrophobicContact CD2-CG 4.39Å; L314-Q532 HydrophobicContact CD1-CB 3.61Å; L314-Q532 HydrophobicContact CD1-CG 3.83Å; L528-Q532 WeakPolarHBondContact O-CB 3.43Å; L528-Q532 PolarHBondContact O-N 2.98Å; K530-Q532 VanDerWaalsContact C-N 3.3Å; K530-Q532 PolarHBondContact O-N 3.48Å; Q532-W535 PolarHBondContact O-N 3.32Å; Q532-I536 HydrophobicContact CG-CD1 3.96Å; Q532-I536 VanDerWaalsContact O-CG1 3.3Å; Q532-I536 WeakPolarHBondContact O-CG1 3.44Å; Q532-I536 PolarHBondContact O-N 3.4Å
533	Q	91.9	Very high	89.3	Confident	96 Å²	96	56.9 Å²	56.9	45%	0.449	30%	0.296	S	S	.	.	H	α-helix	trans	-66.6	-45.9	-179.5	-177.5	59.6	26.8	0	0	111.4	E529 K530 D531 W535 I536 E537	E529-Q533 PolarHBondContact O-N 3.4Å; E529-Q533 VanDerWaalsContact O-N 3.16Å; K530-Q533 PolarHBondContact O-N 2.98Å; K530-Q533 VanDerWaalsContact O-N 3.12Å; D531-Q533 VanDerWaalsContact C-N 3.31Å; D531-Q533 PolarHBondContact O-N 2.77Å; Q533-W535 VanDerWaalsContact C-N 3.29Å; Q533-W535 PolarHBondContact O-N 2.72Å; Q533-I536 PolarHBondContact O-N 3.48Å; Q533-I536 VanDerWaalsContact O-N 3.11Å; Q533-E537 WeakPolarHBondContact CG-OE1 3.29Å; Q533-E537 PolarHBondContact NE2-OE1 3.11Å; Q533-E537 WeakPolarHBondContact O-CG 3.43Å; Q533-E537 PolarHBondContact O-N 3.34Å
534	V	89.9	Confident	89.5	Confident	82 Å²	82	57.3 Å²	57.3	50%	0.497	30%	0.304	S	S	.	.	H	α-helix	trans	-59.4	-40.1	175.2	173	0	0	0	0	111.4	K530 D531 E537 G538	K530-V534 WeakPolarHBondContact O-CG2 3.44Å; K530-V534 PolarHBondContact O-N 2.82Å; D531-V534 PolarHBondContact O-N 2.75Å; V534-E537 PolarHBondContact O-N 3.01Å; V534-G538 PolarHBondContact O-N 3.47Å
535	W	91.4	Very high	89.9	Confident	6 Å²	6	58.4 Å²	58.4	2%	0.023	32%	0.315	C	S	.	.	H	α-helix	trans	-65.3	-39.1	174.4	-87.4	66.4	0	0	0	113.1	Y157 L310 D531 Q532 Q533 M539 F596 Q599 M600 E603	Y157-W535 HydrophobicContact CE1-CZ2 4.26Å; L310-W535 HydrophobicContact CD1-CB 4.43Å; L310-W535 HydrophobicContact CD1-CD2 3.79Å; L310-W535 HydrophobicContact CD1-CE3 3.66Å; L310-W535 HydrophobicContact CD1-CG 4.2Å; L310-W535 HydrophobicContact CD1-CZ3 4.13Å; L310-W535 HydrophobicContact CD2-CB 3.68Å; L310-W535 HydrophobicContact CD2-CD2 4.39Å; L310-W535 HydrophobicContact CD2-CE3 4.12Å; L310-W535 HydrophobicContact CD2-CG 4.3Å; L310-W535 HydrophobicContact CG-CE3 4.45Å; D531-W535 WeakPolarHBondContact O-CB 3.45Å; D531-W535 PolarHBondContact O-N 3.11Å; Q532-W535 PolarHBondContact O-N 3.32Å; Q533-W535 VanDerWaalsContact C-N 3.29Å; Q533-W535 PolarHBondContact O-N 2.72Å; W535-M539 WeakPolarHBondContact O-CG 3.35Å; W535-M539 PolarHBondContact O-N 3.08Å; W535-F596 HydrophobicContact CE3-CD2 4.3Å; W535-F596 AromaticContact CE3-CE2 3.93Å; W535-F596 HydrophobicContact CE3-CE2 3.93Å; W535-F596 HydrophobicContact CE3-CZ 4.48Å; W535-F596 HydrophobicContact CZ3-CD2 4.03Å; W535-F596 HydrophobicContact CZ3-CE1 4.37Å; W535-F596 AromaticContact CZ3-CE2 3.7Å; W535-F596 HydrophobicContact CZ3-CE2 3.7Å; W535-F596 AromaticContact CZ3-CZ 3.89Å; W535-F596 HydrophobicContact CZ3-CZ 3.89Å; W535-Q599 HydrophobicContact CD2-CG 3.61Å; W535-Q599 VanDerWaalsContact CE2-CG 3.46Å; W535-Q599 HydrophobicContact CE3-CB 4.46Å; W535-Q599 HydrophobicContact CE3-CG 3.79Å; W535-Q599 HydrophobicContact CG-CG 4.29Å; W535-Q599 HydrophobicContact CH2-CB 4.16Å; W535-Q599 HydrophobicContact CH2-CG 3.76Å; W535-Q599 HydrophobicContact CZ2-CB 4.4Å; W535-Q599 HydrophobicContact CZ2-CG 3.57Å; W535-Q599 HydrophobicContact CZ3-CB 4.18Å; W535-Q599 HydrophobicContact CZ3-CG 3.86Å; W535-M600 HydrophobicContact CH2-CB 4.35Å; W535-M600 HydrophobicContact CH2-CG 3.57Å; W535-M600 HydrophobicContact CZ3-CG 4.13Å; W535-E603 HydrophobicContact CZ2-CG 3.73Å
536	I	90.6	Very high	90.2	Very high	49 Å²	49	57 Å²	57	25%	0.251	31%	0.309	S	S	.	.	H	α-helix	trans	-67.1	-41.9	176.4	-72.3	167.3	0	0	0	110.9	Q532 Q533 M539 A540	Q532-I536 HydrophobicContact CG-CD1 3.96Å; Q532-I536 VanDerWaalsContact O-CG1 3.3Å; Q532-I536 WeakPolarHBondContact O-CG1 3.44Å; Q532-I536 PolarHBondContact O-N 3.4Å; Q533-I536 PolarHBondContact O-N 3.48Å; Q533-I536 VanDerWaalsContact O-N 3.11Å; I536-M539 HydrophobicContact CB-CE 4.49Å; I536-M539 HydrophobicContact CG1-CE 3.97Å; I536-M539 PolarHBondContact O-N 3.24Å; I536-A540 WeakPolarHBondContact O-CB 3.43Å; I536-A540 PolarHBondContact O-N 2.64Å
537	E	90.7	Very high	90.3	Very high	110 Å²	110	60.3 Å²	60.3	51%	0.514	32%	0.319	S	S	.	.	H	α-helix	trans	-64.3	-42.9	175.1	-72.1	171.2	-168.9	0	0	111.7	Q533 V534 A540 L541	Q533-E537 WeakPolarHBondContact CG-OE1 3.29Å; Q533-E537 PolarHBondContact NE2-OE1 3.11Å; Q533-E537 WeakPolarHBondContact O-CG 3.43Å; Q533-E537 PolarHBondContact O-N 3.34Å; V534-E537 PolarHBondContact O-N 3.01Å; E537-A540 PolarHBondContact O-N 3.32Å; E537-L541 WeakPolarHBondContact O-CB 3.33Å; E537-L541 PolarHBondContact O-N 3.36Å
538	G	88.8	Confident	90.4	Very high	26 Å²	26	62.2 Å²	62.2	27%	0.268	33%	0.328	S	S	.	.	H	α-helix	trans	-61.4	-43.7	173.5	0	0	0	0	0	113.2	V534 L541 G542 H595	V534-G538 PolarHBondContact O-N 3.47Å; G538-L541 PolarHBondContact O-N 2.81Å; G538-G542 PolarHBondContact O-N 2.84Å; G538-H595 PolarHBondContact O-CE1 3.41Å
539	M	89.1	Confident	90.4	Very high	32 Å²	32	63.6 Å²	63.6	16%	0.158	34%	0.335	C	S	.	.	H	α-helix	trans	-61	-45.7	173.6	-76.2	-173.9	-67.4	0	0	111.7	L310 W535 I536 L541 G542 Q543 F596	L310-M539 HydrophobicContact CD2-CE 3.86Å; W535-M539 WeakPolarHBondContact O-CG 3.35Å; W535-M539 PolarHBondContact O-N 3.08Å; I536-M539 HydrophobicContact CB-CE 4.49Å; I536-M539 HydrophobicContact CG1-CE 3.97Å; I536-M539 PolarHBondContact O-N 3.24Å; M539-L541 PolarHBondContact O-N 2.79Å; M539-G542 PolarHBondContact O-N 2.76Å; M539-Q543 WeakPolarHBondContact O-CG 3.37Å; M539-Q543 PolarHBondContact O-N 2.83Å; M539-Q543 PolarHBondContact O-OE1 2.95Å; M539-F596 HydrophobicContact CG-CD2 4.22Å; M539-F596 HydrophobicContact SD-CD2 3.6Å; M539-F596 VanDerWaalsContact SD-CD2 3.6Å; M539-F596 HydrophobicContact SD-CE2 3.81Å
540	A	90.7	Very high	90.5	Very high	42 Å²	42	58.7 Å²	58.7	35%	0.347	31%	0.314	S	S	.	.	H	α-helix	trans	-63.5	-40	178.9	0	0	0	0	0	112.5	I536 E537 Q543 C544	I536-A540 WeakPolarHBondContact O-CB 3.43Å; I536-A540 PolarHBondContact O-N 2.64Å; E537-A540 PolarHBondContact O-N 3.32Å; A540-Q543 PolarHBondContact O-N 3.32Å; A540-C544 PolarHBondContact O-N 3.17Å; A540-C544 PolarHBondContact O-SG 3.35Å
541	L	89.9	Confident	90.5	Very high	115 Å²	115	57.6 Å²	57.6	60%	0.602	31%	0.311	S	S	*	.	H	α-helix	trans	-62.6	-47.1	173.7	-179.2	61	0	0	0	111.5	E537 G538 M539 Q543 C544 C545	E537-L541 WeakPolarHBondContact O-CB 3.33Å; E537-L541 PolarHBondContact O-N 3.36Å; G538-L541 PolarHBondContact O-N 2.81Å; M539-L541 PolarHBondContact O-N 2.79Å; L541-Q543 PolarHBondContact O-N 2.82Å; L541-C544 PolarHBondContact O-N 2.99Å; L541-C544 VanDerWaalsContact O-N 3.15Å; L541-C545 PolarHBondContact O-N 3.43Å; L541-C545 PolarHBondContact O-SG 3.36Å; L541-C545 VanDerWaalsContact O-SG 3.37Å
542	G	89.3	Confident	90.6	Very high	3 Å²	3	59.7 Å²	59.7	3%	0.031	32%	0.319	C	S	.	.	H	α-helix	trans	-57.5	-45.1	175.4	0	0	0	0	0	112.5	G538 M539 C544 C545 L546	G538-G542 PolarHBondContact O-N 2.84Å; M539-G542 PolarHBondContact O-N 2.76Å; G542-C544 PolarHBondContact O-N 3.5Å; G542-C545 PolarHBondContact O-N 3.41Å; G542-L546 WeakPolarHBondContact O-CG 3.46Å; G542-L546 PolarHBondContact O-N 2.7Å
543	Q	90.4	Very high	90.6	Very high	66 Å²	66	58.4 Å²	58.4	31%	0.308	31%	0.313	S	S	.	.	H	α-helix	trans	-60.6	-41.7	174	-72.7	170.4	-52.9	0	0	112.5	E303 M539 A540 L541 L546 K547	E303-Q543 PolarHBondContact OE1-NE2 2.73Å; M539-Q543 WeakPolarHBondContact O-CG 3.37Å; M539-Q543 PolarHBondContact O-N 2.83Å; M539-Q543 PolarHBondContact O-OE1 2.95Å; A540-Q543 PolarHBondContact O-N 3.32Å; L541-Q543 PolarHBondContact O-N 2.82Å; Q543-L546 PolarHBondContact O-N 2.73Å; Q543-K547 VanDerWaalsContact O-CB 3.31Å; Q543-K547 WeakPolarHBondContact O-CB 3.41Å; Q543-K547 PolarHBondContact O-N 3.23Å
544	C	90.4	Very high	90.7	Very high	84 Å²	84	55.5 Å²	55.5	57%	0.568	30%	0.3	S	S	*	.	H	α-helix	trans	-64.4	-41.2	177.1	-69.5	0	0	0	0	111.9	A540 L541 G542 H548	A540-C544 PolarHBondContact O-N 3.17Å; A540-C544 PolarHBondContact O-SG 3.35Å; L541-C544 PolarHBondContact O-N 2.99Å; L541-C544 VanDerWaalsContact O-N 3.15Å; G542-C544 PolarHBondContact O-N 3.5Å; C544-H548 WeakPolarHBondContact O-CB 3.16Å; C544-H548 PolarHBondContact O-N 3.02Å
545	C	90.5	Very high	90.7	Very high	66 Å²	66	57.3 Å²	57.3	45%	0.446	30%	0.303	S	S	.	.	H	α-helix	trans	-62.9	-45.3	174.7	-68.6	0	0	0	0	112.1	L541 G542 H548 L549	L541-C545 PolarHBondContact O-N 3.43Å; L541-C545 PolarHBondContact O-SG 3.36Å; L541-C545 VanDerWaalsContact O-SG 3.37Å; G542-C545 PolarHBondContact O-N 3.41Å; C545-H548 PolarHBondContact O-N 3.43Å; C545-L549 WeakPolarHBondContact O-CB 3.18Å; C545-L549 PolarHBondContact O-N 2.76Å
546	L	93.3	Very high	90.6	Very high	6 Å²	6	60.4 Å²	60.4	3%	0.031	32%	0.319	C	S	.	.	H	α-helix	trans	-65	-44	178	-69.7	173.9	0	0	0	112.2	G542 Q543 H548 L549 G550 E588 F591 T592 F663 L667	G542-L546 WeakPolarHBondContact O-CG 3.46Å; G542-L546 PolarHBondContact O-N 2.7Å; Q543-L546 PolarHBondContact O-N 2.73Å; L546-H548 PolarHBondContact O-N 2.86Å; L546-L549 WeakPolarHBondContact O-CB 3.17Å; L546-L549 PolarHBondContact O-N 2.96Å; L546-G550 PolarHBondContact O-N 3.32Å; L546-E588 HydrophobicContact CB-CG 4.41Å; L546-F591 HydrophobicContact CD1-CB 3.86Å; L546-F591 HydrophobicContact CD2-CB 3.55Å; L546-F591 HydrophobicContact CD2-CG 4.18Å; L546-F591 HydrophobicContact CG-CB 4.37Å; L546-T592 WeakPolarHBondContact CD1-OG1 3.49Å; L546-F663 HydrophobicContact CD2-CZ 4.31Å; L546-L667 HydrophobicContact CD2-CD2 3.62Å
547	K	92	Very high	90.7	Very high	127 Å²	127	58 Å²	58	55%	0.552	31%	0.307	S	S	*	.	H	α-helix	trans	-62.3	-43.3	175.9	-177.8	173.9	180	-79.4	0	111.8	Q543 L549 G550 E551	Q543-K547 VanDerWaalsContact O-CB 3.31Å; Q543-K547 WeakPolarHBondContact O-CB 3.41Å; Q543-K547 PolarHBondContact O-N 3.23Å; K547-L549 VanDerWaalsContact C-N 3.3Å; K547-L549 PolarHBondContact O-N 3.26Å; K547-G550 PolarHBondContact O-N 3.31Å; K547-E551 IonicContact NZ-OE1 2.73Å; K547-E551 PolarHBondContact NZ-OE1 3.5Å; K547-E551 WeakPolarHBondContact O-CG 3.3Å; K547-E551 PolarHBondContact O-N 3.04Å
548	H	89.6	Confident	90.6	Very high	101 Å²	101	57 Å²	57	47%	0.468	30%	0.303	S	S	.	.	H	α-helix	trans	-63.9	-36.7	176.5	-174.7	46.6	0	0	0	112	C544 C545 L546 E551 Q552	C544-H548 WeakPolarHBondContact O-CB 3.16Å; C544-H548 PolarHBondContact O-N 3.02Å; C545-H548 PolarHBondContact O-N 3.43Å; L546-H548 PolarHBondContact O-N 2.86Å; H548-E551 IonicContact ND1-OE2 2.75Å; H548-E551 PolarHBondContact O-N 2.75Å; H548-Q552 PolarHBondContact NE2-NE2 2.85Å; H548-Q552 WeakPolarHBondContact O-CG 3.38Å; H548-Q552 PolarHBondContact O-N 3.12Å
549	L	90.1	Very high	90.5	Very high	38 Å²	38	56.5 Å²	56.5	20%	0.199	30%	0.296	C	S	.	.	H	α-helix	trans	-65.2	-44.5	173.9	-172.5	62.5	0	0	0	111.7	C545 L546 K547 E551 Q552 Q553 L667 T671	C545-L549 WeakPolarHBondContact O-CB 3.18Å; C545-L549 PolarHBondContact O-N 2.76Å; L546-L549 WeakPolarHBondContact O-CB 3.17Å; L546-L549 PolarHBondContact O-N 2.96Å; K547-L549 VanDerWaalsContact C-N 3.3Å; K547-L549 PolarHBondContact O-N 3.26Å; L549-E551 VanDerWaalsContact C-N 3.33Å; L549-E551 PolarHBondContact O-N 3.05Å; L549-Q552 PolarHBondContact O-N 3.42Å; L549-Q553 WeakPolarHBondContact O-CG 3.44Å; L549-Q553 PolarHBondContact O-N 3.05Å; L549-L667 HydrophobicContact CD2-CD2 3.95Å; L549-T671 HydrophobicContact CD1-CG2 3.76Å; L549-T671 HydrophobicContact CD2-CG2 3.93Å; L549-T671 HydrophobicContact CG-CG2 4.22Å
550	G	91.1	Very high	90.4	Very high	7 Å²	7	56.6 Å²	56.6	7%	0.072	30%	0.296	C	S	.	.	H	α-helix	trans	-59.6	-41.1	173.9	0	0	0	0	0	112.7	L546 K547 Q553 M554	L546-G550 PolarHBondContact O-N 3.32Å; K547-G550 PolarHBondContact O-N 3.31Å; G550-Q553 PolarHBondContact O-N 3.38Å; G550-M554 WeakPolarHBondContact O-CB 3.47Å; G550-M554 WeakPolarHBondContact O-CG 3.48Å; G550-M554 PolarHBondContact O-N 3.04Å
551	E	91.8	Very high	90.4	Very high	85 Å²	85	55.1 Å²	55.1	40%	0.397	28%	0.283	S	S	.	.	H	α-helix	trans	-59.2	-48.1	172.8	-73	166.2	174.6	0	0	111.7	K547 H548 L549 Q553 M554 E555	K547-E551 IonicContact NZ-OE1 2.73Å; K547-E551 PolarHBondContact NZ-OE1 3.5Å; K547-E551 WeakPolarHBondContact O-CG 3.3Å; K547-E551 PolarHBondContact O-N 3.04Å; H548-E551 IonicContact ND1-OE2 2.75Å; H548-E551 PolarHBondContact O-N 2.75Å; L549-E551 VanDerWaalsContact C-N 3.33Å; L549-E551 PolarHBondContact O-N 3.05Å; E551-Q553 PolarHBondContact O-N 3.01Å; E551-M554 PolarHBondContact O-N 3.39Å; E551-E555 PolarHBondContact O-N 2.92Å
552	Q	89.9	Confident	90.1	Very high	77 Å²	77	51.4 Å²	51.4	36%	0.36	27%	0.269	S	S	.	.	H	α-helix	trans	-61.6	-42.1	176	-70.8	-178.4	11.3	0	0	113	H548 L549 M554 E555 I556	H548-Q552 PolarHBondContact NE2-NE2 2.85Å; H548-Q552 WeakPolarHBondContact O-CG 3.38Å; H548-Q552 PolarHBondContact O-N 3.12Å; L549-Q552 PolarHBondContact O-N 3.42Å; Q552-M554 VanDerWaalsContact C-N 3.29Å; Q552-M554 PolarHBondContact O-N 2.86Å; Q552-E555 PolarHBondContact O-N 3.48Å; Q552-I556 VanDerWaalsContact O-CG1 3.32Å; Q552-I556 WeakPolarHBondContact O-CG1 3.29Å; Q552-I556 PolarHBondContact O-N 2.89Å; Q552-I556 VanDerWaalsContact O-N 3.08Å
553	Q	91.9	Very high	89.8	Confident	9 Å²	9	56 Å²	56	4%	0.042	29%	0.285	C	S	.	.	H	α-helix	trans	-66.8	-33.6	177.3	-63.7	-59.7	-48.2	0	0	111.5	L549 G550 E551 I556 I557 L674	L549-Q553 WeakPolarHBondContact O-CG 3.44Å; L549-Q553 PolarHBondContact O-N 3.05Å; G550-Q553 PolarHBondContact O-N 3.38Å; E551-Q553 PolarHBondContact O-N 3.01Å; Q553-I556 PolarHBondContact O-N 2.9Å; Q553-I557 PolarHBondContact O-N 3.28Å; Q553-L674 HydrophobicContact CG-CD1 3.96Å
554	M	93.8	Very high	89.5	Confident	34 Å²	34	54.8 Å²	54.8	17%	0.167	28%	0.279	C	S	.	.	H	α-helix	trans	-66.4	-41.5	173	-74.2	-53.3	-48.4	0	0	112.9	G550 E551 Q552 I556 I557 Q558 E577 K581	G550-M554 WeakPolarHBondContact O-CB 3.47Å; G550-M554 WeakPolarHBondContact O-CG 3.48Å; G550-M554 PolarHBondContact O-N 3.04Å; E551-M554 PolarHBondContact O-N 3.39Å; Q552-M554 VanDerWaalsContact C-N 3.29Å; Q552-M554 PolarHBondContact O-N 2.86Å; M554-I556 VanDerWaalsContact C-N 3.32Å; M554-I556 PolarHBondContact O-N 3.48Å; M554-I557 HydrophobicContact CE-CG2 3.8Å; M554-I557 WeakPolarHBondContact O-CG2 3.32Å; M554-I557 PolarHBondContact O-N 3.36Å; M554-I557 HydrophobicContact SD-CG2 4.08Å; M554-Q558 WeakPolarHBondContact O-CB 3.49Å; M554-Q558 VanDerWaalsContact O-CG 3.3Å; M554-Q558 WeakPolarHBondContact O-CG 3.29Å; M554-Q558 PolarHBondContact O-N 3.39Å; M554-E577 HydrophobicContact CE-CB 4.01Å; M554-E577 HydrophobicContact CE-CG 4.36Å; M554-K581 HydrophobicContact SD-CB 3.75Å; M554-K581 HydrophobicContact SD-CG 4.28Å
555	E	89.8	Confident	88.8	Confident	120 Å²	120	52.4 Å²	52.4	56%	0.561	26%	0.264	S	S	*	.	H	α-helix	trans	-58.8	-43.6	171.7	-70.4	178.4	173.9	0	0	111.4	E551 Q552 Q558 A559	E551-E555 PolarHBondContact O-N 2.92Å; Q552-E555 PolarHBondContact O-N 3.48Å; E555-Q558 PolarHBondContact O-N 3.39Å; E555-A559 WeakPolarHBondContact O-CB 3.24Å; E555-A559 PolarHBondContact O-N 2.93Å
556	I	88.6	Confident	87.9	Confident	71 Å²	71	54.5 Å²	54.5	36%	0.364	26%	0.263	S	S	.	.	H	α-helix	trans	-62.8	-49	179.4	-68.7	165.3	0	0	0	111.7	Q552 Q553 M554 Q558 A559 M560	Q552-I556 VanDerWaalsContact O-CG1 3.32Å; Q552-I556 WeakPolarHBondContact O-CG1 3.29Å; Q552-I556 PolarHBondContact O-N 2.89Å; Q552-I556 VanDerWaalsContact O-N 3.08Å; Q553-I556 PolarHBondContact O-N 2.9Å; M554-I556 VanDerWaalsContact C-N 3.32Å; M554-I556 PolarHBondContact O-N 3.48Å; I556-Q558 VanDerWaalsContact C-N 3.35Å; I556-Q558 PolarHBondContact O-N 2.94Å; I556-A559 PolarHBondContact O-N 2.88Å; I556-M560 HydrophobicContact CG2-SD 4Å; I556-M560 WeakPolarHBondContact O-CB 3.27Å; I556-M560 WeakPolarHBondContact O-CG 3.43Å; I556-M560 PolarHBondContact O-N 3.42Å
557	I	92.1	Very high	87.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.8	-36.6	178.8	-171.8	66.5	0	0	0	111.6	Q553 M554 M560 V561 I576 E577 H580 A678	Q553-I557 PolarHBondContact O-N 3.28Å; M554-I557 HydrophobicContact CE-CG2 3.8Å; M554-I557 WeakPolarHBondContact O-CG2 3.32Å; M554-I557 PolarHBondContact O-N 3.36Å; M554-I557 HydrophobicContact SD-CG2 4.08Å; I557-M560 HydrophobicContact CD1-CB 4.48Å; I557-M560 WeakPolarHBondContact O-CB 3.22Å; I557-M560 PolarHBondContact O-N 3.48Å; I557-V561 HydrophobicContact CD1-CG2 4.39Å; I557-V561 HydrophobicContact CG1-CG2 4.28Å; I557-V561 WeakPolarHBondContact O-CB 3.48Å; I557-V561 WeakPolarHBondContact O-CG2 3.2Å; I557-V561 PolarHBondContact O-N 2.94Å; I557-I576 HydrophobicContact CD1-CG2 3.76Å; I557-I576 HydrophobicContact CG1-CG2 4.02Å; I557-E577 HydrophobicContact CG2-CG 4.5Å; I557-H580 HydrophobicContact CG1-CB 4.14Å; I557-H580 HydrophobicContact CG2-CB 4.29Å; I557-A678 HydrophobicContact CD1-CB 3.73Å
558	Q	89.9	Confident	86.9	Confident	88 Å²	88	49.9 Å²	49.9	41%	0.411	25%	0.246	S	C	.	.	H	α-helix	trans	-63.2	-44.1	175.4	-77.9	177.1	-16.1	0	0	111.8	M554 E555 I556 M560 V561 A562 E577	M554-Q558 WeakPolarHBondContact O-CB 3.49Å; M554-Q558 VanDerWaalsContact O-CG 3.3Å; M554-Q558 WeakPolarHBondContact O-CG 3.29Å; M554-Q558 PolarHBondContact O-N 3.39Å; E555-Q558 PolarHBondContact O-N 3.39Å; I556-Q558 VanDerWaalsContact C-N 3.35Å; I556-Q558 PolarHBondContact O-N 2.94Å; Q558-M560 VanDerWaalsContact C-N 3.34Å; Q558-M560 PolarHBondContact O-N 3.41Å; Q558-V561 PolarHBondContact O-N 2.9Å; Q558-A562 VanDerWaalsContact O-CB 3.26Å; Q558-A562 WeakPolarHBondContact O-CB 3.44Å; Q558-A562 PolarHBondContact O-N 2.86Å; Q558-E577 HydrophobicContact CG-CG 3.98Å; Q558-E577 WeakPolarHBondContact CG-OE2 3.45Å; Q558-E577 PolarHBondContact NE2-OE2 3.4Å
559	A	85.6	Confident	86.6	Confident	16 Å²	16	48.4 Å²	48.4	13%	0.132	25%	0.246	C	C	.	.	H	α-helix	trans	-62.4	-38.5	172.7	0	0	0	0	0	112.4	E555 I556 R563	E555-A559 WeakPolarHBondContact O-CB 3.24Å; E555-A559 PolarHBondContact O-N 2.93Å; I556-A559 PolarHBondContact O-N 2.88Å; A559-R563 WeakPolarHBondContact O-CB 3.35Å; A559-R563 VanDerWaalsContact O-CD 3.3Å; A559-R563 WeakPolarHBondContact O-CD 3.26Å; A559-R563 WeakPolarHBondContact O-CG 3.46Å; A559-R563 PolarHBondContact O-N 3.15Å; A559-R563 VanDerWaalsContact O-N 3.09Å
560	M	88.6	Confident	86.3	Confident	33 Å²	33	50.3 Å²	50.3	16%	0.163	26%	0.263	C	S	.	.	H	α-helix	trans	-66.2	-39.8	175.3	-75.2	175.5	58.6	0	0	113.2	I556 I557 Q558 A678 Q679 L682	I556-M560 HydrophobicContact CG2-SD 4Å; I556-M560 WeakPolarHBondContact O-CB 3.27Å; I556-M560 WeakPolarHBondContact O-CG 3.43Å; I556-M560 PolarHBondContact O-N 3.42Å; I557-M560 HydrophobicContact CD1-CB 4.48Å; I557-M560 WeakPolarHBondContact O-CB 3.22Å; I557-M560 PolarHBondContact O-N 3.48Å; Q558-M560 VanDerWaalsContact C-N 3.34Å; Q558-M560 PolarHBondContact O-N 3.41Å; M560-A678 HydrophobicContact CE-CB 4Å; M560-A678 HydrophobicContact SD-CB 4.24Å; M560-Q679 HydrophobicContact CE-CG 4.13Å; M560-L682 HydrophobicContact CB-CD2 4.24Å; M560-L682 HydrophobicContact CE-CD2 3.92Å
561	V	89.3	Confident	86	Confident	12 Å²	12	53.3 Å²	53.3	7%	0.073	28%	0.277	C	S	.	.	H	α-helix	trans	-71.2	-44.2	176	168	0	0	0	0	110.9	I557 Q558 R563 Q564 S565 G573 I576 L682	I557-V561 HydrophobicContact CD1-CG2 4.39Å; I557-V561 HydrophobicContact CG1-CG2 4.28Å; I557-V561 WeakPolarHBondContact O-CB 3.48Å; I557-V561 WeakPolarHBondContact O-CG2 3.2Å; I557-V561 PolarHBondContact O-N 2.94Å; Q558-V561 PolarHBondContact O-N 2.9Å; V561-R563 VanDerWaalsContact C-N 3.3Å; V561-R563 PolarHBondContact O-N 3.05Å; V561-Q564 CarbonylContact O-C 3.59Å; V561-Q564 WeakPolarHBondContact O-CA 3.34Å; V561-Q564 PolarHBondContact O-N 2.67Å; V561-S565 PolarHBondContact O-N 2.65Å; V561-G573 VanDerWaalsContact CG1-CA 3.45Å; V561-I576 HydrophobicContact CG2-CB 4.15Å; V561-I576 HydrophobicContact CG2-CD1 4.34Å; V561-I576 HydrophobicContact CG2-CG2 3.87Å; V561-L682 HydrophobicContact CG2-CD1 4.27Å
562	A	84.5	Confident	85.8	Confident	36 Å²	36	50.3 Å²	50.3	30%	0.298	26%	0.264	S	S	.	.	H	α-helix	trans	-57.1	-43.5	176.7	0	0	0	0	0	111.8	Q558 Q564 S565	Q558-A562 VanDerWaalsContact O-CB 3.26Å; Q558-A562 WeakPolarHBondContact O-CB 3.44Å; Q558-A562 PolarHBondContact O-N 2.86Å; A562-Q564 PolarHBondContact O-N 3.09Å; A562-S565 WeakPolarHBondContact O-CB 3.45Å; A562-S565 PolarHBondContact O-N 3.22Å; A562-S565 PolarHBondContact O-OG 3.06Å
563	R	83	Confident	85.8	Confident	99 Å²	99	46.8 Å²	46.8	37%	0.374	25%	0.248	S	C	.	.	H	α-helix	trans	-54.5	-31.1	172.2	-78.6	164.1	-177.5	176.7	5.5	113.6	A559 V561 Y566 Y812	A559-R563 WeakPolarHBondContact O-CB 3.35Å; A559-R563 VanDerWaalsContact O-CD 3.3Å; A559-R563 WeakPolarHBondContact O-CD 3.26Å; A559-R563 WeakPolarHBondContact O-CG 3.46Å; A559-R563 PolarHBondContact O-N 3.15Å; A559-R563 VanDerWaalsContact O-N 3.09Å; V561-R563 VanDerWaalsContact C-N 3.3Å; V561-R563 PolarHBondContact O-N 3.05Å; R563-Y566 VanDerWaalsContact O-CD1 3.23Å; R563-Y566 WeakPolarHBondContact O-CD1 3.4Å; R563-Y566 WeakPolarHBondContact O-CE1 3.28Å; R563-Y812 HydrophobicContact CG-CD1 4.12Å; R563-Y812 HydrophobicContact CG-CD2 4.02Å; R563-Y812 HydrophobicContact CG-CE1 3.67Å; R563-Y812 HydrophobicContact CG-CE2 3.52Å; R563-Y812 HydrophobicContact CG-CG 4.33Å; R563-Y812 PolarHBondContact NE-OH 3Å
564	Q	84.8	Confident	85.8	Confident	41 Å²	41	50.6 Å²	50.6	19%	0.192	26%	0.264	C	S	.	.	H	α-helix	trans	-103.4	5	-176.9	-64.6	-58.6	-29.4	0	0	114.2	V561 A562 Y566 T567 L568 L682 L686	V561-Q564 CarbonylContact O-C 3.59Å; V561-Q564 WeakPolarHBondContact O-CA 3.34Å; V561-Q564 PolarHBondContact O-N 2.67Å; A562-Q564 PolarHBondContact O-N 3.09Å; Q564-Y566 PolarHBondContact O-N 3.23Å; Q564-Y566 PolarHBondContact OE1-OH 3.26Å; Q564-T567 PolarHBondContact O-N 3.44Å; Q564-L568 HydrophobicContact CB-CD1 3.84Å; Q564-L568 HydrophobicContact CB-CG 4.29Å; Q564-L568 PolarHBondContact O-N 3.14Å; Q564-L682 HydrophobicContact CB-CD1 4.18Å; Q564-L682 HydrophobicContact CG-CD1 4.05Å; Q564-L682 HydrophobicContact CG-CD2 4.01Å; Q564-L682 HydrophobicContact CG-CG 4.26Å; Q564-L686 HydrophobicContact CB-CD2 4.26Å; Q564-L686 HydrophobicContact CG-CD1 4.13Å; Q564-L686 HydrophobicContact CG-CD2 4.41Å
565	S	74	Confident	85.7	Confident	34 Å²	34	49 Å²	49	24%	0.238	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	1.1	179.4	66	0	0	0	0	115.3	V561 A562 R816	V561-S565 PolarHBondContact O-N 2.65Å; A562-S565 WeakPolarHBondContact O-CB 3.45Å; A562-S565 PolarHBondContact O-N 3.22Å; A562-S565 PolarHBondContact O-OG 3.06Å; S565-R816 PolarHBondContact OG-NE 2.79Å; S565-R816 PolarHBondContact OG-NH2 2.97Å
566	Y	73.2	Confident	85.9	Confident	110 Å²	110	43.5 Å²	43.5	43%	0.431	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-6.7	169.2	70.4	-101.8	0	0	0	113.3	R563 Q564 K819	R563-Y566 VanDerWaalsContact O-CD1 3.23Å; R563-Y566 WeakPolarHBondContact O-CD1 3.4Å; R563-Y566 WeakPolarHBondContact O-CE1 3.28Å; Q564-Y566 PolarHBondContact O-N 3.23Å; Q564-Y566 PolarHBondContact OE1-OH 3.26Å; Y566-K819 HydrophobicContact CD2-CD 4.02Å; Y566-K819 HydrophobicContact CG-CD 4.32Å; Y566-K819 PolarHBondContact O-NZ 2.99Å
567	T	79	Confident	86.2	Confident	24 Å²	24	42.2 Å²	42.2	15%	0.147	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.2	-38.8	178.6	-61.2	0	0	0	0	112	Q564 L686 A689	Q564-T567 PolarHBondContact O-N 3.44Å; T567-L686 HydrophobicContact CG2-CD2 3.71Å; T567-A689 HydrophobicContact CG2-CB 4.02Å
568	L	84.1	Confident	86.4	Confident	13 Å²	13	44.6 Å²	44.6	7%	0.068	23%	0.233	C	C	.	.	S	Bend	trans	-88.4	145.4	179.3	-57	175.8	0	0	0	111.9	Q564 M572 I576 L682 A685 L686 A689	Q564-L568 HydrophobicContact CB-CD1 3.84Å; Q564-L568 HydrophobicContact CB-CG 4.29Å; Q564-L568 PolarHBondContact O-N 3.14Å; L568-M572 HydrophobicContact CD2-CG 4.23Å; L568-I576 HydrophobicContact CD1-CD1 3.79Å; L568-L682 HydrophobicContact CD1-CD1 3.76Å; L568-A685 HydrophobicContact CD2-CB 3.9Å; L568-L686 HydrophobicContact CD1-CD2 4.48Å; L568-L686 HydrophobicContact CD2-CD2 4.02Å; L568-L686 HydrophobicContact CD2-CG 4.33Å; L568-L686 HydrophobicContact CG-CD2 4.05Å; L568-A689 HydrophobicContact CD2-CB 4.1Å
569	S	83.3	Confident	86.6	Confident	69 Å²	69	41 Å²	41	48%	0.483	22%	0.217	S	C	.	.			trans	-72.8	161.2	168	63.5	0	0	0	0	111.4	D571 M572 G573	S569-D571 VanDerWaalsContact C-N 3.26Å; S569-D571 PolarHBondContact O-N 2.87Å; S569-M572 PolarHBondContact O-N 2.94Å; S569-M572 WeakPolarHBondContact OG-CB 3.37Å; S569-M572 PolarHBondContact OG-N 2.81Å; S569-G573 PolarHBondContact O-N 3.39Å
570	S	84	Confident	87	Confident	79 Å²	79	40.4 Å²	40.4	55%	0.552	21%	0.211	S	C	*	.	H	α-helix	trans	-56.6	-42.1	177.1	-174.4	0	0	0	0	111.7	G573 K574	S570-G573 WeakPolarHBondContact O-CA 3.47Å; S570-G573 PolarHBondContact O-N 3.26Å; S570-K574 WeakPolarHBondContact O-CG 3.46Å; S570-K574 PolarHBondContact O-N 3.5Å; S570-K574 VanDerWaalsContact OG-CE 3.27Å; S570-K574 WeakPolarHBondContact OG-CE 3.37Å; S570-K574 PolarHBondContact OG-NZ 3.03Å
571	D	85.3	Confident	87.4	Confident	70 Å²	70	42.5 Å²	42.5	37%	0.374	22%	0.219	S	C	.	.	H	α-helix	trans	-78.3	-31.7	-173.8	-51.4	-71.7	0	0	0	112.6	S569 G573 K574 L575	S569-D571 VanDerWaalsContact C-N 3.26Å; S569-D571 PolarHBondContact O-N 2.87Å; D571-G573 VanDerWaalsContact C-N 3.3Å; D571-G573 PolarHBondContact O-N 3.25Å; D571-K574 PolarHBondContact O-N 3.05Å; D571-K574 IonicContact OD1-NZ 2.92Å; D571-K574 PolarHBondContact OD1-NZ 3.36Å; D571-L575 WeakPolarHBondContact O-CB 3.41Å; D571-L575 PolarHBondContact O-N 3.2Å
572	M	87.2	Confident	87.7	Confident	22 Å²	22	41.9 Å²	41.9	11%	0.108	22%	0.215	C	C	.	.	H	α-helix	trans	-63.7	-37.5	165.4	-172.2	59.8	67	0	0	111.4	L568 S569 L575 I576 A685	L568-M572 HydrophobicContact CD2-CG 4.23Å; S569-M572 PolarHBondContact O-N 2.94Å; S569-M572 WeakPolarHBondContact OG-CB 3.37Å; S569-M572 PolarHBondContact OG-N 2.81Å; M572-L575 PolarHBondContact O-N 3.26Å; M572-L575 HydrophobicContact SD-CD2 4.17Å; M572-I576 HydrophobicContact CG-CD1 4.47Å; M572-I576 VanDerWaalsContact O-CG1 3.29Å; M572-I576 WeakPolarHBondContact O-CG1 3.35Å; M572-I576 PolarHBondContact O-N 3.36Å; M572-A685 HydrophobicContact CG-CB 4.02Å; M572-A685 HydrophobicContact SD-CB 4.13Å
573	G	89.8	Confident	88.2	Confident	2 Å²	2	40.2 Å²	40.2	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-59.2	-53.6	171.7	0	0	0	0	0	112.5	V561 S569 S570 D571 L575 I576 E577	V561-G573 VanDerWaalsContact CG1-CA 3.45Å; S569-G573 PolarHBondContact O-N 3.39Å; S570-G573 WeakPolarHBondContact O-CA 3.47Å; S570-G573 PolarHBondContact O-N 3.26Å; D571-G573 VanDerWaalsContact C-N 3.3Å; D571-G573 PolarHBondContact O-N 3.25Å; G573-L575 PolarHBondContact O-N 3.34Å; G573-I576 WeakPolarHBondContact O-CB 3.48Å; G573-I576 PolarHBondContact O-N 3.4Å; G573-I576 VanDerWaalsContact O-N 3.09Å; G573-E577 PolarHBondContact O-N 2.97Å
574	K	91.5	Very high	88.8	Confident	90 Å²	90	35.7 Å²	35.7	39%	0.391	19%	0.185	S	C	.	.	H	α-helix	trans	-55.8	-37.5	174.6	-64.2	166.8	-158.5	160.6	0	112	S570 D571 E577 K578	S570-K574 WeakPolarHBondContact O-CG 3.46Å; S570-K574 PolarHBondContact O-N 3.5Å; S570-K574 VanDerWaalsContact OG-CE 3.27Å; S570-K574 WeakPolarHBondContact OG-CE 3.37Å; S570-K574 PolarHBondContact OG-NZ 3.03Å; D571-K574 PolarHBondContact O-N 3.05Å; D571-K574 IonicContact OD1-NZ 2.92Å; D571-K574 PolarHBondContact OD1-NZ 3.36Å; K574-E577 PolarHBondContact O-N 3.35Å; K574-K578 WeakPolarHBondContact O-CB 3.37Å; K574-K578 VanDerWaalsContact O-CG 3.28Å; K574-K578 WeakPolarHBondContact O-CG 3.28Å; K574-K578 PolarHBondContact O-N 3.49Å
575	L	92.3	Very high	89.3	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67.5	-40.3	177.9	180	59.8	0	0	0	112.1	I284 V288 D571 M572 G573 K578 K579	I284-L575 HydrophobicContact CG2-CD1 3.86Å; I284-L575 HydrophobicContact CG2-CD2 3.76Å; I284-L575 HydrophobicContact CG2-CG 4.44Å; V288-L575 HydrophobicContact CB-CD1 4.28Å; V288-L575 HydrophobicContact CG2-CD1 4.02Å; D571-L575 WeakPolarHBondContact O-CB 3.41Å; D571-L575 PolarHBondContact O-N 3.2Å; M572-L575 PolarHBondContact O-N 3.26Å; M572-L575 HydrophobicContact SD-CD2 4.17Å; G573-L575 PolarHBondContact O-N 3.34Å; L575-K578 PolarHBondContact O-N 2.99Å; L575-K579 HydrophobicContact CD1-CD 4.47Å; L575-K579 HydrophobicContact CD1-CG 4.38Å; L575-K579 HydrophobicContact CG-CD 4.35Å; L575-K579 WeakPolarHBondContact O-CB 3.35Å; L575-K579 VanDerWaalsContact O-CG 3.29Å; L575-K579 WeakPolarHBondContact O-CG 3.45Å; L575-K579 PolarHBondContact O-N 3.41Å
576	I	94	Very high	90.3	Very high	4 Å²	4	33 Å²	33	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-62.5	-47.1	173.7	-65.3	162.8	0	0	0	110.2	I557 V561 L568 M572 G573 K578 K579 H580 A681 L682 A685	I557-I576 HydrophobicContact CD1-CG2 3.76Å; I557-I576 HydrophobicContact CG1-CG2 4.02Å; V561-I576 HydrophobicContact CG2-CB 4.15Å; V561-I576 HydrophobicContact CG2-CD1 4.34Å; V561-I576 HydrophobicContact CG2-CG2 3.87Å; L568-I576 HydrophobicContact CD1-CD1 3.79Å; M572-I576 HydrophobicContact CG-CD1 4.47Å; M572-I576 VanDerWaalsContact O-CG1 3.29Å; M572-I576 WeakPolarHBondContact O-CG1 3.35Å; M572-I576 PolarHBondContact O-N 3.36Å; G573-I576 WeakPolarHBondContact O-CB 3.48Å; G573-I576 PolarHBondContact O-N 3.4Å; G573-I576 VanDerWaalsContact O-N 3.09Å; I576-K578 PolarHBondContact O-N 3.48Å; I576-K579 PolarHBondContact O-N 2.84Å; I576-H580 WeakPolarHBondContact O-CB 3.45Å; I576-H580 PolarHBondContact O-N 3.21Å; I576-A681 HydrophobicContact CG2-CB 4.3Å; I576-L682 HydrophobicContact CD1-CD1 4.17Å; I576-A685 HydrophobicContact CD1-CB 3.47Å; I576-A685 VanDerWaalsContact CD1-CB 3.47Å; I576-A685 HydrophobicContact CG1-CB 4.05Å
577	E	94.9	Very high	91.3	Very high	44 Å²	44	27.9 Å²	27.9	21%	0.206	15%	0.149	C	C	.	.	H	α-helix	trans	-57.7	-47.7	175.9	-71.9	172.9	-125.9	0	0	112	M554 I557 Q558 G573 K574 K579 H580 K581	M554-E577 HydrophobicContact CE-CB 4.01Å; M554-E577 HydrophobicContact CE-CG 4.36Å; I557-E577 HydrophobicContact CG2-CG 4.5Å; Q558-E577 HydrophobicContact CG-CG 3.98Å; Q558-E577 WeakPolarHBondContact CG-OE2 3.45Å; Q558-E577 PolarHBondContact NE2-OE2 3.4Å; G573-E577 PolarHBondContact O-N 2.97Å; K574-E577 PolarHBondContact O-N 3.35Å; E577-K579 PolarHBondContact O-N 3.49Å; E577-H580 PolarHBondContact O-N 3.32Å; E577-K581 PolarHBondContact O-N 2.99Å
578	K	95.1	Very high	92	Very high	50 Å²	50	28.5 Å²	28.5	22%	0.217	15%	0.151	C	C	.	.	H	α-helix	trans	-62.6	-42.3	177.4	-74.6	-176.3	-171.7	-165.8	0	112.7	V288 Q289 L292 K574 L575 I576 H580 H582	V288-K578 HydrophobicContact CG1-CB 3.71Å; Q289-K578 VanDerWaalsContact OE1-CE 3.27Å; L292-K578 HydrophobicContact CD1-CB 3.75Å; L292-K578 HydrophobicContact CD1-CD 4.33Å; L292-K578 HydrophobicContact CD1-CG 3.85Å; K574-K578 WeakPolarHBondContact O-CB 3.37Å; K574-K578 VanDerWaalsContact O-CG 3.28Å; K574-K578 WeakPolarHBondContact O-CG 3.28Å; K574-K578 PolarHBondContact O-N 3.49Å; L575-K578 PolarHBondContact O-N 2.99Å; I576-K578 PolarHBondContact O-N 3.48Å; K578-H580 VanDerWaalsContact C-N 3.35Å; K578-H582 WeakPolarHBondContact O-CB 3.32Å; K578-H582 PolarHBondContact O-N 3.13Å
579	K	94.4	Very high	92.4	Very high	14 Å²	14	28.2 Å²	28.2	6%	0.061	15%	0.149	C	C	.	.	H	α-helix	trans	-62.6	-40.9	174.6	-76	174.9	176.8	-175.6	0	111.7	E262 C265 V288 L575 I576 E577 L583	E262-K579 IonicContact OE2-NZ 3.67Å; E262-K579 PolarHBondContact OE2-NZ 3.46Å; C265-K579 WeakPolarHBondContact SG-CE 3.3Å; C265-K579 PolarHBondContact SG-NZ 3.46Å; C265-K579 VanDerWaalsContact SG-NZ 3.36Å; V288-K579 HydrophobicContact CG1-CG 4.11Å; V288-K579 HydrophobicContact CG2-CG 4.07Å; L575-K579 HydrophobicContact CD1-CD 4.47Å; L575-K579 HydrophobicContact CD1-CG 4.38Å; L575-K579 HydrophobicContact CG-CD 4.35Å; L575-K579 WeakPolarHBondContact O-CB 3.35Å; L575-K579 VanDerWaalsContact O-CG 3.29Å; L575-K579 WeakPolarHBondContact O-CG 3.45Å; L575-K579 PolarHBondContact O-N 3.41Å; I576-K579 PolarHBondContact O-N 2.84Å; E577-K579 PolarHBondContact O-N 3.49Å; K579-L583 PolarHBondContact O-N 2.91Å
580	H	95.7	Very high	93	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.009	13%	0.128	C	C	.	.	H	α-helix	trans	-65.9	-49.7	176.9	-171.5	92.2	0	0	0	111.5	I557 I576 E577 K578 H582 L583 S584 L674	I557-H580 HydrophobicContact CG1-CB 4.14Å; I557-H580 HydrophobicContact CG2-CB 4.29Å; I576-H580 WeakPolarHBondContact O-CB 3.45Å; I576-H580 PolarHBondContact O-N 3.21Å; E577-H580 PolarHBondContact O-N 3.32Å; K578-H580 VanDerWaalsContact C-N 3.35Å; H580-H582 PolarHBondContact O-N 2.98Å; H580-L583 PolarHBondContact O-N 3.21Å; H580-S584 PolarHBondContact O-N 2.96Å; H580-L674 PolarHBondContact CE1-O 3.13Å
581	K	96	Very high	93.5	Very high	77 Å²	77	21.7 Å²	21.7	34%	0.335	10%	0.103	S	C	.	.	H	α-helix	trans	-54.4	-40.9	175.9	-169.9	-171.3	-178.9	-161.8	0	112.1	L292 E296 M554 E577 L583 S584 L585	L292-K581 HydrophobicContact CD2-CB 3.98Å; L292-K581 HydrophobicContact CD2-CD 3.96Å; L292-K581 HydrophobicContact CD2-CG 3.96Å; E296-K581 IonicContact OE1-NZ 3.57Å; E296-K581 PolarHBondContact OE1-NZ 3.36Å; M554-K581 HydrophobicContact SD-CB 3.75Å; M554-K581 HydrophobicContact SD-CG 4.28Å; E577-K581 PolarHBondContact O-N 2.99Å; K581-L583 VanDerWaalsContact C-N 3.32Å; K581-L583 PolarHBondContact O-N 2.86Å; K581-S584 WeakPolarHBondContact O-CB 3.34Å; K581-S584 PolarHBondContact O-N 3.05Å; K581-L585 HydrophobicContact CG-CD1 4.24Å; K581-L585 HydrophobicContact CG-CG 4.44Å; K581-L585 WeakPolarHBondContact O-CG 3.4Å; K581-L585 PolarHBondContact O-N 3.4Å
582	H	95.5	Very high	94	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63	-35.1	178.5	166.8	-93.3	0	0	0	113.1	K175 F257 L292 K578 H580 L586	K175-H582 PolarHBondContact NZ-NE2 2.93Å; F257-H582 AromaticContact CD1-CE1 3.78Å; F257-H582 AromaticContact CE1-CE1 3.58Å; F257-H582 AromaticContact CE1-NE2 3.9Å; L292-H582 HydrophobicContact CD2-CB 3.71Å; L292-H582 HydrophobicContact CG-CB 4.15Å; K578-H582 WeakPolarHBondContact O-CB 3.32Å; K578-H582 PolarHBondContact O-N 3.13Å; H580-H582 PolarHBondContact O-N 2.98Å; H582-L586 PolarHBondContact O-N 3.42Å
583	L	95.7	Very high	94.4	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-75.9	-36.2	172.8	-176.9	58.9	0	0	0	112.1	K579 H580 K581 L586 M587 L673 L674 H677	K579-L583 PolarHBondContact O-N 2.91Å; H580-L583 PolarHBondContact O-N 3.21Å; K581-L583 VanDerWaalsContact C-N 3.32Å; K581-L583 PolarHBondContact O-N 2.86Å; L583-L586 HydrophobicContact CD1-CB 4.47Å; L583-L586 HydrophobicContact CD1-CD1 4.4Å; L583-L586 WeakPolarHBondContact O-CB 3.48Å; L583-L586 PolarHBondContact O-N 2.93Å; L583-M587 HydrophobicContact CD1-CE 4.03Å; L583-M587 HydrophobicContact CD2-CE 4.07Å; L583-M587 HydrophobicContact CG-CE 3.92Å; L583-M587 WeakPolarHBondContact O-CG 3.46Å; L583-M587 PolarHBondContact O-N 3.21Å; L583-M587 VanDerWaalsContact O-N 3.13Å; L583-L673 HydrophobicContact CD2-CD2 4.45Å; L583-L674 HydrophobicContact CB-CD2 4.3Å; L583-L674 HydrophobicContact CD2-CD2 4.07Å; L583-L674 HydrophobicContact CG-CD2 3.83Å; L583-H677 HydrophobicContact CD2-CB 3.66Å; L583-H677 WeakPolarHBondContact CD2-ND1 3.19Å
584	S	95.1	Very high	94.6	Very high	4 Å²	4	18.8 Å²	18.8	3%	0.028	9%	0.087	C	C	.	.	H	α-helix	trans	-57	-53.2	173.8	-164.1	0	0	0	0	110.9	H580 K581 L586 M587 E588	H580-S584 PolarHBondContact O-N 2.96Å; K581-S584 WeakPolarHBondContact O-CB 3.34Å; K581-S584 PolarHBondContact O-N 3.05Å; S584-L586 VanDerWaalsContact C-N 3.3Å; S584-L586 PolarHBondContact O-N 3.39Å; S584-M587 CarbonylContact O-C 3.57Å; S584-M587 WeakPolarHBondContact O-CA 3.46Å; S584-M587 WeakPolarHBondContact O-CB 3.5Å; S584-M587 PolarHBondContact O-N 3.18Å; S584-E588 VanDerWaalsContact CB-OE1 3.28Å; S584-E588 WeakPolarHBondContact CB-OE1 3.44Å; S584-E588 WeakPolarHBondContact O-CG 3.13Å; S584-E588 PolarHBondContact O-N 3.36Å; S584-E588 PolarHBondContact OG-OE1 2.89Å
585	L	95.1	Very high	94.7	Very high	18 Å²	18	16.8 Å²	16.8	9%	0.094	8%	0.079	C	C	.	.	H	α-helix	trans	-58	-38.6	178.6	-69.8	168.9	0	0	0	113.1	L292 E295 E296 K581 M587 E588 R589	L292-L585 HydrophobicContact CD2-CD1 3.83Å; E295-L585 HydrophobicContact CB-CB 4.45Å; E295-L585 HydrophobicContact CB-CD1 4.45Å; E295-L585 HydrophobicContact CG-CB 3.61Å; E295-L585 HydrophobicContact CG-CD1 4.46Å; E296-L585 HydrophobicContact CG-CD1 3.76Å; K581-L585 HydrophobicContact CG-CD1 4.24Å; K581-L585 HydrophobicContact CG-CG 4.44Å; K581-L585 WeakPolarHBondContact O-CG 3.4Å; K581-L585 PolarHBondContact O-N 3.4Å; L585-M587 VanDerWaalsContact C-N 3.32Å; L585-M587 PolarHBondContact O-N 2.91Å; L585-E588 PolarHBondContact N-OE1 3.17Å; L585-E588 PolarHBondContact O-N 3.18Å; L585-R589 VanDerWaalsContact O-CB 3.27Å; L585-R589 WeakPolarHBondContact O-CB 3.32Å; L585-R589 PolarHBondContact O-N 2.92Å
586	L	94.3	Very high	94.8	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-61	-38.8	174	-92.5	171.4	0	0	0	112.7	K175 F257 H582 L583 S584 S590	K175-L586 HydrophobicContact CD-CD2 4.21Å; F257-L586 HydrophobicContact CD1-CD1 4.35Å; H582-L586 PolarHBondContact O-N 3.42Å; L583-L586 HydrophobicContact CD1-CB 4.47Å; L583-L586 HydrophobicContact CD1-CD1 4.4Å; L583-L586 WeakPolarHBondContact O-CB 3.48Å; L583-L586 PolarHBondContact O-N 2.93Å; S584-L586 VanDerWaalsContact C-N 3.3Å; S584-L586 PolarHBondContact O-N 3.39Å; L586-S590 PolarHBondContact O-N 3.06Å; L586-S590 PolarHBondContact O-OG 3.01Å
587	M	94.5	Very high	94.9	Very high	4 Å²	4	16.8 Å²	16.8	2%	0.02	8%	0.079	C	C	.	.	H	α-helix	trans	-74.6	-46	175.6	-65.9	-166.1	-169	0	0	111.7	L251 L583 S584 L585 R589 S590 F591 A670 L673 L674	L251-M587 HydrophobicContact CD2-CB 4.25Å; L251-M587 HydrophobicContact CD2-CG 3.85Å; L251-M587 HydrophobicContact CD2-SD 4.15Å; L583-M587 HydrophobicContact CD1-CE 4.03Å; L583-M587 HydrophobicContact CD2-CE 4.07Å; L583-M587 HydrophobicContact CG-CE 3.92Å; L583-M587 WeakPolarHBondContact O-CG 3.46Å; L583-M587 PolarHBondContact O-N 3.21Å; L583-M587 VanDerWaalsContact O-N 3.13Å; S584-M587 CarbonylContact O-C 3.57Å; S584-M587 WeakPolarHBondContact O-CA 3.46Å; S584-M587 WeakPolarHBondContact O-CB 3.5Å; S584-M587 PolarHBondContact O-N 3.18Å; L585-M587 VanDerWaalsContact C-N 3.32Å; L585-M587 PolarHBondContact O-N 2.91Å; M587-R589 VanDerWaalsContact C-N 3.28Å; M587-R589 PolarHBondContact O-N 3.21Å; M587-S590 CarbonylContact O-C 2.99Å; M587-S590 WeakPolarHBondContact O-CA 3.32Å; M587-S590 VanDerWaalsContact O-CB 3.29Å; M587-S590 WeakPolarHBondContact O-CB 3.46Å; M587-S590 PolarHBondContact O-N 2.87Å; M587-F591 HydrophobicContact CB-CD2 4.36Å; M587-F591 HydrophobicContact CB-CE2 4.45Å; M587-F591 VanDerWaalsContact O-CD2 3.24Å; M587-F591 WeakPolarHBondContact O-CD2 3.22Å; M587-F591 PolarHBondContact O-N 2.96Å; M587-A670 HydrophobicContact SD-CB 3.9Å; M587-L673 HydrophobicContact CE-CB 3.98Å; M587-L673 HydrophobicContact CE-CD1 3.76Å; M587-L673 HydrophobicContact CE-CD2 3.61Å; M587-L673 HydrophobicContact CE-CG 3.95Å; M587-L674 HydrophobicContact CE-CD2 3.76Å; M587-L674 HydrophobicContact CE-CG 3.92Å; M587-L674 HydrophobicContact SD-CD1 4.06Å; M587-L674 HydrophobicContact SD-CD2 3.82Å; M587-L674 HydrophobicContact SD-CG 3.65Å
588	E	93.7	Very high	94.8	Very high	37 Å²	37	15.1 Å²	15.1	17%	0.173	7%	0.071	C	C	.	.	H	α-helix	trans	-52.1	-48	174.6	-68.3	160.4	-129.6	0	0	110.3	L546 S584 L585 S590 F591 T592	L546-E588 HydrophobicContact CB-CG 4.41Å; S584-E588 VanDerWaalsContact CB-OE1 3.28Å; S584-E588 WeakPolarHBondContact CB-OE1 3.44Å; S584-E588 WeakPolarHBondContact O-CG 3.13Å; S584-E588 PolarHBondContact O-N 3.36Å; S584-E588 PolarHBondContact OG-OE1 2.89Å; L585-E588 PolarHBondContact N-OE1 3.17Å; L585-E588 PolarHBondContact O-N 3.18Å; E588-S590 PolarHBondContact O-N 2.61Å; E588-F591 PolarHBondContact O-N 2.99Å; E588-F591 VanDerWaalsContact O-N 3.16Å; E588-T592 PolarHBondContact O-N 3.44Å; E588-T592 PolarHBondContact O-OG1 2.65Å
589	R	93.6	Very high	94.7	Very high	7 Å²	7	14.8 Å²	14.8	3%	0.026	7%	0.071	C	C	.	.	H	α-helix	trans	-64.2	-23.8	174.8	-158.7	-170	75.9	-163.6	2.2	113.8	E295 Q302 L585 M587	E295-R589 VanDerWaalsContact OE1-CD 3.28Å; E295-R589 WeakPolarHBondContact OE1-CD 3.5Å; E295-R589 IonicContact OE1-CZ 2.69Å; E295-R589 IonicContact OE1-NE 3.71Å; E295-R589 PolarHBondContact OE1-NE 3.26Å; E295-R589 IonicContact OE1-NH1 3.34Å; E295-R589 PolarHBondContact OE1-NH1 3.03Å; E295-R589 IonicContact OE2-NH1 3.54Å; E295-R589 PolarHBondContact OE2-NH1 2.88Å; Q302-R589 HydrophobicContact CB-CG 4.47Å; Q302-R589 PolarHBondContact NE2-O 3.08Å; Q302-R589 PolarHBondContact OE1-O 3.19Å; L585-R589 VanDerWaalsContact O-CB 3.27Å; L585-R589 WeakPolarHBondContact O-CB 3.32Å; L585-R589 PolarHBondContact O-N 2.92Å; M587-R589 VanDerWaalsContact C-N 3.28Å; M587-R589 PolarHBondContact O-N 3.21Å
590	S	94.6	Very high	94.6	Very high	8 Å²	8	14.1 Å²	14.1	6%	0.056	7%	0.068	C	C	.	.	H	α-helix	trans	-80.2	-40.2	172.8	-59.9	0	0	0	0	111.6	L586 M587 E588 V593 R594	L586-S590 PolarHBondContact O-N 3.06Å; L586-S590 PolarHBondContact O-OG 3.01Å; M587-S590 CarbonylContact O-C 2.99Å; M587-S590 WeakPolarHBondContact O-CA 3.32Å; M587-S590 VanDerWaalsContact O-CB 3.29Å; M587-S590 WeakPolarHBondContact O-CB 3.46Å; M587-S590 PolarHBondContact O-N 2.87Å; E588-S590 PolarHBondContact O-N 2.61Å; S590-V593 PolarHBondContact O-N 3.1Å; S590-R594 PolarHBondContact O-N 3.35Å; S590-R594 VanDerWaalsContact O-N 3.09Å
591	F	95.9	Very high	94.4	Very high	3 Å²	3	14.2 Å²	14.2	1%	0.013	7%	0.068	C	C	.	.	H	α-helix	trans	-74.9	-31.1	178	-78.7	-74.2	0	0	0	113.8	L247 L251 L546 M587 E588 V593 R594 H595 F663 E666 L667 A670	L247-F591 HydrophobicContact CD1-CD1 4.25Å; L247-F591 HydrophobicContact CD1-CE1 4.05Å; L247-F591 HydrophobicContact CD1-CZ 4.23Å; L247-F591 HydrophobicContact CD2-CE1 3.86Å; L247-F591 HydrophobicContact CD2-CZ 4.34Å; L251-F591 HydrophobicContact CD1-CE2 4.37Å; L251-F591 HydrophobicContact CD1-CZ 4.05Å; L251-F591 HydrophobicContact CD2-CE2 3.77Å; L251-F591 HydrophobicContact CD2-CZ 4.28Å; L546-F591 HydrophobicContact CD1-CB 3.86Å; L546-F591 HydrophobicContact CD2-CB 3.55Å; L546-F591 HydrophobicContact CD2-CG 4.18Å; L546-F591 HydrophobicContact CG-CB 4.37Å; M587-F591 HydrophobicContact CB-CD2 4.36Å; M587-F591 HydrophobicContact CB-CE2 4.45Å; M587-F591 VanDerWaalsContact O-CD2 3.24Å; M587-F591 WeakPolarHBondContact O-CD2 3.22Å; M587-F591 PolarHBondContact O-N 2.96Å; E588-F591 PolarHBondContact O-N 2.99Å; E588-F591 VanDerWaalsContact O-N 3.16Å; F591-V593 VanDerWaalsContact C-N 3.26Å; F591-V593 PolarHBondContact O-N 3.27Å; F591-R594 HydrophobicContact CD1-CB 4.43Å; F591-R594 PolarHBondContact O-N 3.4Å; F591-R594 VanDerWaalsContact O-N 3.09Å; F591-H595 WeakPolarHBondContact O-CB 3.38Å; F591-H595 PolarHBondContact O-N 3.49Å; F591-F663 HydrophobicContact CB-CE2 4.17Å; F591-F663 HydrophobicContact CB-CZ 4.36Å; F591-F663 HydrophobicContact CD1-CD2 4.3Å; F591-F663 AromaticContact CD1-CE2 3.76Å; F591-F663 HydrophobicContact CD1-CE2 3.76Å; F591-F663 HydrophobicContact CD1-CZ 4.43Å; F591-F663 HydrophobicContact CG-CE2 4.43Å; F591-E666 HydrophobicContact CE1-CB 3.9Å; F591-E666 HydrophobicContact CZ-CB 4.48Å; F591-E666 WeakPolarHBondContact CZ-O 3.45Å; F591-L667 HydrophobicContact CB-CD2 4.34Å; F591-L667 HydrophobicContact CD1-CD2 3.65Å; F591-L667 HydrophobicContact CD1-CG 4.13Å; F591-L667 HydrophobicContact CD2-CD2 3.72Å; F591-L667 HydrophobicContact CE1-CD2 3.79Å; F591-L667 HydrophobicContact CE1-CG 4.05Å; F591-L667 HydrophobicContact CE2-CD2 3.89Å; F591-L667 HydrophobicContact CG-CD2 3.63Å; F591-L667 HydrophobicContact CZ-CD2 3.92Å; F591-L667 HydrophobicContact CZ-CG 4.45Å; F591-A670 HydrophobicContact CE2-CB 3.39Å; F591-A670 HydrophobicContact CZ-CB 3.56Å
592	T	94.9	Very high	94.2	Very high	18 Å²	18	11 Å²	11	11%	0.11	5%	0.054	C	C	.	.	H	α-helix	trans	-58.2	-40.9	171.8	-60.6	0	0	0	0	110.8	L306 L546 E588 F596	L306-T592 HydrophobicContact CD1-CG2 3.79Å; L546-T592 WeakPolarHBondContact CD1-OG1 3.49Å; E588-T592 PolarHBondContact O-N 3.44Å; E588-T592 PolarHBondContact O-OG1 2.65Å; T592-F596 PolarHBondContact O-N 3.1Å
593	V	95.1	Very high	93.9	Very high	6 Å²	6	11.3 Å²	11.3	4%	0.036	6%	0.056	C	C	.	.	H	α-helix	trans	-67.3	-46.1	169.9	165.2	0	0	0	0	111.9	V164 Q302 L306 S590 F591 H595 F596 S597	V164-V593 HydrophobicContact CG1-CB 4.46Å; V164-V593 HydrophobicContact CG1-CG1 3.79Å; V164-V593 HydrophobicContact CG1-CG2 4.01Å; Q302-V593 VanDerWaalsContact CD-CG2 3.48Å; Q302-V593 HydrophobicContact CG-CG2 4.19Å; L306-V593 HydrophobicContact CD2-CG2 4.4Å; S590-V593 PolarHBondContact O-N 3.1Å; F591-V593 VanDerWaalsContact C-N 3.26Å; F591-V593 PolarHBondContact O-N 3.27Å; V593-H595 VanDerWaalsContact C-N 3.33Å; V593-H595 PolarHBondContact O-N 2.71Å; V593-F596 PolarHBondContact O-N 3.46Å; V593-S597 WeakPolarHBondContact O-CB 3.38Å; V593-S597 PolarHBondContact O-N 3.07Å; V593-S597 PolarHBondContact O-OG 2.78Å
594	R	94.8	Very high	93.7	Very high	8 Å²	8	11.4 Å²	11.4	3%	0.03	6%	0.056	C	C	.	.	H	α-helix	trans	-58.3	-43.3	179.7	179.4	60.2	165.8	138.3	-3.6	112.4	L247 S590 F591 S597 L598 E662 F663 E666	L247-R594 HydrophobicContact CD1-CB 4.25Å; L247-R594 HydrophobicContact CD2-CG 4.05Å; S590-R594 PolarHBondContact O-N 3.35Å; S590-R594 VanDerWaalsContact O-N 3.09Å; F591-R594 HydrophobicContact CD1-CB 4.43Å; F591-R594 PolarHBondContact O-N 3.4Å; F591-R594 VanDerWaalsContact O-N 3.09Å; R594-S597 PolarHBondContact O-N 2.72Å; R594-L598 HydrophobicContact CG-CD1 4.02Å; R594-L598 HydrophobicContact CG-CG 4.4Å; R594-L598 VanDerWaalsContact O-CG 3.32Å; R594-L598 WeakPolarHBondContact O-CG 3.26Å; R594-L598 PolarHBondContact O-N 3.33Å; R594-E662 IonicContact CZ-OE2 2.74Å; R594-E662 IonicContact NH2-OE1 3.53Å; R594-E662 PolarHBondContact NH2-OE1 2.94Å; R594-E662 VanDerWaalsContact NH2-OE1 3.07Å; R594-E662 IonicContact NH2-OE2 2.68Å; R594-E662 PolarHBondContact NH2-OE2 3.49Å; R594-F663 HydrophobicContact CG-CD2 4.26Å; R594-E666 IonicContact CZ-OE1 3.85Å; R594-E666 IonicContact CZ-OE2 3.76Å; R594-E666 IonicContact NE-OE1 3.62Å; R594-E666 PolarHBondContact NE-OE1 2.9Å; R594-E666 IonicContact NE-OE2 2.76Å; R594-E666 PolarHBondContact NE-OE2 3.4Å; R594-E666 IonicContact NH2-OE1 3.89Å; R594-E666 PolarHBondContact NH2-OE1 2.96Å; R594-E666 IonicContact NH2-OE2 3.54Å; R594-E666 PolarHBondContact NH2-OE2 2.76Å
595	H	94.6	Very high	93.3	Very high	49 Å²	49	14.8 Å²	14.8	23%	0.227	7%	0.069	C	C	.	.	H	α-helix	trans	-60.8	-45.8	178	-169.9	-87.8	0	0	0	111.5	G538 F591 V593 L598 Q599 F663	G538-H595 PolarHBondContact O-CE1 3.41Å; F591-H595 WeakPolarHBondContact O-CB 3.38Å; F591-H595 PolarHBondContact O-N 3.49Å; V593-H595 VanDerWaalsContact C-N 3.33Å; V593-H595 PolarHBondContact O-N 2.71Å; H595-L598 PolarHBondContact O-N 2.95Å; H595-Q599 PolarHBondContact O-N 3.04Å; H595-Q599 VanDerWaalsContact O-N 3.14Å; H595-F663 HydrophobicContact CB-CE2 3.82Å; H595-F663 HydrophobicContact CB-CZ 3.97Å; H595-F663 AromaticContact CD2-CE1 3.75Å; H595-F663 AromaticContact CD2-CZ 3.75Å
596	F	94.4	Very high	92.9	Very high	2 Å²	2	14 Å²	14	1%	0.009	6%	0.064	C	C	.	.	H	α-helix	trans	-64	-41.4	174.4	-171.4	-91.3	0	0	0	112.3	V164 L306 L310 W535 M539 T592 V593 Q599 M600	V164-F596 HydrophobicContact CG2-CD1 3.91Å; V164-F596 HydrophobicContact CG2-CE1 3.6Å; L306-F596 HydrophobicContact CB-CD2 4.23Å; L306-F596 HydrophobicContact CB-CE2 4.23Å; L306-F596 HydrophobicContact CD1-CB 4.19Å; L306-F596 HydrophobicContact CD1-CD2 4.49Å; L306-F596 HydrophobicContact CD1-CG 4.37Å; L306-F596 HydrophobicContact CD2-CB 4.19Å; L306-F596 HydrophobicContact CD2-CD1 3.76Å; L306-F596 HydrophobicContact CD2-CD2 4.33Å; L306-F596 HydrophobicContact CD2-CE1 4.13Å; L306-F596 HydrophobicContact CD2-CG 3.85Å; L306-F596 HydrophobicContact CG-CG 4.5Å; L310-F596 HydrophobicContact CB-CE2 4.17Å; L310-F596 HydrophobicContact CB-CZ 4.14Å; W535-F596 HydrophobicContact CE3-CD2 4.3Å; W535-F596 AromaticContact CE3-CE2 3.93Å; W535-F596 HydrophobicContact CE3-CE2 3.93Å; W535-F596 HydrophobicContact CE3-CZ 4.48Å; W535-F596 HydrophobicContact CZ3-CD2 4.03Å; W535-F596 HydrophobicContact CZ3-CE1 4.37Å; W535-F596 AromaticContact CZ3-CE2 3.7Å; W535-F596 HydrophobicContact CZ3-CE2 3.7Å; W535-F596 AromaticContact CZ3-CZ 3.89Å; W535-F596 HydrophobicContact CZ3-CZ 3.89Å; M539-F596 HydrophobicContact CG-CD2 4.22Å; M539-F596 HydrophobicContact SD-CD2 3.6Å; M539-F596 VanDerWaalsContact SD-CD2 3.6Å; M539-F596 HydrophobicContact SD-CE2 3.81Å; T592-F596 PolarHBondContact O-N 3.1Å; V593-F596 PolarHBondContact O-N 3.46Å; F596-Q599 PolarHBondContact O-N 3.3Å; F596-M600 HydrophobicContact CD1-CE 4.31Å; F596-M600 HydrophobicContact CD1-CG 4.43Å; F596-M600 HydrophobicContact CD1-SD 4.12Å; F596-M600 HydrophobicContact CE1-CE 3.35Å; F596-M600 HydrophobicContact CE1-CG 4.25Å; F596-M600 HydrophobicContact CE1-SD 3.71Å; F596-M600 HydrophobicContact CZ-CE 3.84Å; F596-M600 PolarHBondContact O-N 3.47Å
597	S	94.4	Very high	92.5	Very high	2 Å²	2	14 Å²	14	1%	0.014	6%	0.064	C	C	.	.	H	α-helix	trans	-63.3	-39.2	174.5	-67.4	0	0	0	0	112.5	L161 V593 R594 M600 L601	L161-S597 VanDerWaalsContact CD1-OG 3.27Å; L161-S597 WeakPolarHBondContact CD1-OG 3.19Å; V593-S597 WeakPolarHBondContact O-CB 3.38Å; V593-S597 PolarHBondContact O-N 3.07Å; V593-S597 PolarHBondContact O-OG 2.78Å; R594-S597 PolarHBondContact O-N 2.72Å; S597-M600 WeakPolarHBondContact O-CB 3.36Å; S597-M600 PolarHBondContact O-N 3.46Å; S597-L601 VanDerWaalsContact O-CG 3.26Å; S597-L601 WeakPolarHBondContact O-CG 3.49Å; S597-L601 PolarHBondContact O-N 2.75Å
598	L	93.4	Very high	91.8	Very high	8 Å²	8	14.5 Å²	14.5	4%	0.042	7%	0.066	C	C	.	.	H	α-helix	trans	-62.1	-42.4	175.3	-76.3	163.8	0	0	0	111.3	R594 H595 L601 K602 L659 E662 F663	R594-L598 HydrophobicContact CG-CD1 4.02Å; R594-L598 HydrophobicContact CG-CG 4.4Å; R594-L598 VanDerWaalsContact O-CG 3.32Å; R594-L598 WeakPolarHBondContact O-CG 3.26Å; R594-L598 PolarHBondContact O-N 3.33Å; H595-L598 PolarHBondContact O-N 2.95Å; L598-L601 PolarHBondContact O-N 3.17Å; L598-K602 PolarHBondContact O-N 2.79Å; L598-L659 HydrophobicContact CD2-CB 4.22Å; L598-L659 HydrophobicContact CD2-CD2 3.5Å; L598-L659 HydrophobicContact CD2-CG 4.43Å; L598-E662 WeakPolarHBondContact CD2-OE2 3.33Å; L598-F663 HydrophobicContact CD1-CB 3.74Å; L598-F663 HydrophobicContact CD1-CD2 3.71Å; L598-F663 HydrophobicContact CD1-CG 4.09Å
599	Q	92.4	Very high	91.1	Very high	44 Å²	44	13.3 Å²	13.3	21%	0.206	6%	0.061	C	C	.	.	H	α-helix	trans	-67.2	-35.1	175.2	-173.8	68.3	-3.3	0	0	112.2	W535 H595 F596 K602 E603	W535-Q599 HydrophobicContact CD2-CG 3.61Å; W535-Q599 VanDerWaalsContact CE2-CG 3.46Å; W535-Q599 HydrophobicContact CE3-CB 4.46Å; W535-Q599 HydrophobicContact CE3-CG 3.79Å; W535-Q599 HydrophobicContact CG-CG 4.29Å; W535-Q599 HydrophobicContact CH2-CB 4.16Å; W535-Q599 HydrophobicContact CH2-CG 3.76Å; W535-Q599 HydrophobicContact CZ2-CB 4.4Å; W535-Q599 HydrophobicContact CZ2-CG 3.57Å; W535-Q599 HydrophobicContact CZ3-CB 4.18Å; W535-Q599 HydrophobicContact CZ3-CG 3.86Å; H595-Q599 PolarHBondContact O-N 3.04Å; H595-Q599 VanDerWaalsContact O-N 3.14Å; F596-Q599 PolarHBondContact O-N 3.3Å; Q599-K602 WeakPolarHBondContact O-CB 3.48Å; Q599-K602 PolarHBondContact O-N 3.09Å; Q599-E603 PolarHBondContact O-N 3.02Å
600	M	93.1	Very high	90.5	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-61.9	-43.9	168.1	-78.8	-172.4	158.5	0	0	112.3	Y157 A160 L161 L313 W535 F596 S597 K602 E603 M604	Y157-M600 HydrophobicContact CD1-CG 4.46Å; A160-M600 HydrophobicContact CB-CE 3.4Å; A160-M600 HydrophobicContact CB-SD 4.34Å; L161-M600 HydrophobicContact CB-SD 3.83Å; L161-M600 HydrophobicContact CD1-CB 4.37Å; L161-M600 HydrophobicContact CD1-SD 3.97Å; L161-M600 HydrophobicContact CG-SD 4.49Å; L313-M600 HydrophobicContact CD2-CE 4.12Å; W535-M600 HydrophobicContact CH2-CB 4.35Å; W535-M600 HydrophobicContact CH2-CG 3.57Å; W535-M600 HydrophobicContact CZ3-CG 4.13Å; F596-M600 HydrophobicContact CD1-CE 4.31Å; F596-M600 HydrophobicContact CD1-CG 4.43Å; F596-M600 HydrophobicContact CD1-SD 4.12Å; F596-M600 HydrophobicContact CE1-CE 3.35Å; F596-M600 HydrophobicContact CE1-CG 4.25Å; F596-M600 HydrophobicContact CE1-SD 3.71Å; F596-M600 HydrophobicContact CZ-CE 3.84Å; F596-M600 PolarHBondContact O-N 3.47Å; S597-M600 WeakPolarHBondContact O-CB 3.36Å; S597-M600 PolarHBondContact O-N 3.46Å; M600-K602 VanDerWaalsContact C-N 3.33Å; M600-K602 PolarHBondContact O-N 3.24Å; M600-E603 PolarHBondContact O-N 3.14Å; M600-M604 VanDerWaalsContact O-CG 3.29Å; M600-M604 WeakPolarHBondContact O-CG 3.45Å; M600-M604 PolarHBondContact O-N 3.34Å
601	L	91.9	Very high	89.6	Confident	3 Å²	3	14.3 Å²	14.3	2%	0.016	7%	0.067	C	C	.	.	H	α-helix	trans	-64.8	-36.1	178.2	-69.1	169.2	0	0	0	112.1	L161 L236 I239 E240 Q243 S597 L598 M604 R605	L161-L601 HydrophobicContact CD2-CD2 4.42Å; L236-L601 HydrophobicContact CD1-CD2 4.08Å; I239-L601 HydrophobicContact CG2-CD2 4.11Å; E240-L601 HydrophobicContact CG-CD1 4Å; E240-L601 HydrophobicContact CG-CD2 3.59Å; E240-L601 HydrophobicContact CG-CG 4.26Å; Q243-L601 HydrophobicContact CB-CD1 4.34Å; Q243-L601 HydrophobicContact CG-CD1 3.91Å; S597-L601 VanDerWaalsContact O-CG 3.26Å; S597-L601 WeakPolarHBondContact O-CG 3.49Å; S597-L601 PolarHBondContact O-N 2.75Å; L598-L601 PolarHBondContact O-N 3.17Å; L601-M604 HydrophobicContact CD2-SD 4.26Å; L601-M604 PolarHBondContact O-N 2.83Å; L601-R605 PolarHBondContact O-N 3.29Å
602	K	90.5	Very high	88.4	Confident	10 Å²	10	19.4 Å²	19.4	4%	0.043	9%	0.089	C	C	.	.	H	α-helix	trans	-55.2	-52.7	170.4	-167.5	-170.5	-176.3	-173.6	0	111	L598 Q599 M600 M604 R605 L606 S652 L655 E656 L659	L598-K602 PolarHBondContact O-N 2.79Å; Q599-K602 WeakPolarHBondContact O-CB 3.48Å; Q599-K602 PolarHBondContact O-N 3.09Å; M600-K602 VanDerWaalsContact C-N 3.33Å; M600-K602 PolarHBondContact O-N 3.24Å; K602-M604 PolarHBondContact O-N 3.36Å; K602-R605 PolarHBondContact O-N 3.24Å; K602-L606 HydrophobicContact CG-CD1 4.1Å; K602-L606 WeakPolarHBondContact O-CG 3.36Å; K602-L606 PolarHBondContact O-N 2.97Å; K602-S652 WeakPolarHBondContact CE-O 3.08Å; K602-S652 VanDerWaalsContact CE-OG 3.23Å; K602-S652 WeakPolarHBondContact CE-OG 3.47Å; K602-S652 PolarHBondContact NZ-OG 2.88Å; K602-L655 HydrophobicContact CG-CB 4.35Å; K602-E656 IonicContact NZ-OE2 2.72Å; K602-E656 PolarHBondContact NZ-OE2 2.88Å; K602-L659 HydrophobicContact CB-CD1 3.69Å; K602-L659 HydrophobicContact CG-CD1 4.09Å
603	E	90.6	Very high	86.9	Confident	7 Å²	7	19.7 Å²	19.7	3%	0.033	9%	0.091	C	C	.	.	H	α-helix	trans	-66.9	-32.7	178	-70.7	-57.5	145.1	0	0	113.2	R153 Y157 W535 Q599 M600 L606 S607 K610	R153-E603 IonicContact NH2-OE2 2.74Å; Y157-E603 HydrophobicContact CD1-CB 3.91Å; Y157-E603 HydrophobicContact CE1-CB 3.33Å; Y157-E603 HydrophobicContact CE1-CG 3.79Å; Y157-E603 HydrophobicContact CE2-CB 4.22Å; W535-E603 HydrophobicContact CZ2-CG 3.73Å; Q599-E603 PolarHBondContact O-N 3.02Å; M600-E603 PolarHBondContact O-N 3.14Å; E603-L606 CarbonylContact O-C 3.57Å; E603-L606 PolarHBondContact O-N 3.34Å; E603-S607 WeakPolarHBondContact O-CA 3.41Å; E603-S607 WeakPolarHBondContact O-CB 3.38Å; E603-S607 PolarHBondContact O-N 3.45Å; E603-S607 PolarHBondContact O-OG 2.9Å; E603-K610 IonicContact OE1-NZ 2.79Å; E603-K610 PolarHBondContact OE1-NZ 2.97Å; E603-K610 WeakPolarHBondContact OE2-CD 3.45Å; E603-K610 WeakPolarHBondContact OE2-CE 3.46Å; E603-K610 IonicContact OE2-NZ 2.93Å; E603-K610 PolarHBondContact OE2-NZ 3.37Å
604	M	90.3	Very high	85.4	Confident	1 Å²	1	21.6 Å²	21.6	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-65.7	-38.2	174.2	-70.8	176.5	82.1	0	0	112.3	F135 I154 Y157 C158 L161 L236 I239 M600 L601 K602 S607	F135-M604 HydrophobicContact CZ-CE 4.22Å; I154-M604 HydrophobicContact CD1-CB 4.42Å; I154-M604 HydrophobicContact CD1-CE 4.21Å; I154-M604 HydrophobicContact CG1-CB 4.2Å; I154-M604 HydrophobicContact CG1-CE 3.56Å; I154-M604 HydrophobicContact CG1-CG 4.19Å; Y157-M604 VanDerWaalsContact CB-CG 3.44Å; Y157-M604 HydrophobicContact CG-CG 4.11Å; C158-M604 HydrophobicContact CB-CE 3.89Å; L161-M604 HydrophobicContact CD2-SD 4.27Å; L236-M604 HydrophobicContact CD1-CB 3.75Å; L236-M604 HydrophobicContact CD1-CE 3.94Å; L236-M604 HydrophobicContact CD1-SD 4.25Å; L236-M604 HydrophobicContact CD2-CB 4.32Å; I239-M604 HydrophobicContact CD1-CE 3.78Å; I239-M604 HydrophobicContact CG2-CE 4.43Å; M600-M604 VanDerWaalsContact O-CG 3.29Å; M600-M604 WeakPolarHBondContact O-CG 3.45Å; M600-M604 PolarHBondContact O-N 3.34Å; L601-M604 HydrophobicContact CD2-SD 4.26Å; L601-M604 PolarHBondContact O-N 2.83Å; K602-M604 PolarHBondContact O-N 3.36Å; M604-S607 WeakPolarHBondContact O-CB 3.44Å
605	R	87.8	Confident	83.4	Confident	76 Å²	76	26.7 Å²	26.7	29%	0.287	13%	0.132	S	C	.	.	H	α-helix	trans	-66.1	-50.2	170.9	-71.5	-175.7	176	-157.5	-2.6	111.4	L236 E240 L601 K602 S607 L655	L236-R605 HydrophobicContact CD2-CB 4.4Å; L236-R605 HydrophobicContact CD2-CG 3.58Å; E240-R605 IonicContact OE1-CZ 2.69Å; E240-R605 VanDerWaalsContact OE1-CZ 3.29Å; E240-R605 IonicContact OE1-NE 3.86Å; E240-R605 PolarHBondContact OE1-NE 3.2Å; E240-R605 IonicContact OE1-NH2 2.69Å; E240-R605 PolarHBondContact OE1-NH2 2.96Å; E240-R605 IonicContact OE2-CZ 3.41Å; E240-R605 IonicContact OE2-NE 3.2Å; E240-R605 IonicContact OE2-NH2 2.82Å; E240-R605 PolarHBondContact OE2-NH2 3.34Å; L601-R605 PolarHBondContact O-N 3.29Å; K602-R605 PolarHBondContact O-N 3.24Å; R605-S607 PolarHBondContact O-N 2.84Å; R605-L655 HydrophobicContact CB-CD1 3.77Å
606	L	86	Confident	81.4	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-69.2	-12.6	-179.9	-64.2	177	0	0	0	113.8	K602 E603 K608 L609 K610 L648 E651 L655	K602-L606 HydrophobicContact CG-CD1 4.1Å; K602-L606 WeakPolarHBondContact O-CG 3.36Å; K602-L606 PolarHBondContact O-N 2.97Å; E603-L606 CarbonylContact O-C 3.57Å; E603-L606 PolarHBondContact O-N 3.34Å; L606-K608 PolarHBondContact O-N 3.49Å; L606-K608 VanDerWaalsContact O-N 3.12Å; L606-L609 HydrophobicContact CD2-CD1 4.28Å; L606-L609 WeakPolarHBondContact O-CA 3.26Å; L606-L609 PolarHBondContact O-N 3.45Å; L606-K610 PolarHBondContact O-N 3.3Å; L606-L648 HydrophobicContact CB-CD1 4.39Å; L606-L648 HydrophobicContact CD2-CD1 4.15Å; L606-E651 HydrophobicContact CD2-CB 4.43Å; L606-E651 HydrophobicContact CD2-CG 4.31Å; L606-L655 HydrophobicContact CD2-CD1 3.83Å; L606-L655 HydrophobicContact CG-CD1 4.03Å
607	S	85.8	Confident	79.5	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-56.7	-31.8	-173.8	-79.1	0	0	0	0	114.3	R153 E603 M604 R605 V611	R153-S607 WeakPolarHBondContact CD-OG 3.13Å; R153-S607 WeakPolarHBondContact CG-OG 3.23Å; E603-S607 WeakPolarHBondContact O-CA 3.41Å; E603-S607 WeakPolarHBondContact O-CB 3.38Å; E603-S607 PolarHBondContact O-N 3.45Å; E603-S607 PolarHBondContact O-OG 2.9Å; M604-S607 WeakPolarHBondContact O-CB 3.44Å; R605-S607 PolarHBondContact O-N 2.84Å; S607-V611 WeakPolarHBondContact O-CB 3.49Å; S607-V611 WeakPolarHBondContact O-CG2 3.41Å; S607-V611 PolarHBondContact O-N 2.91Å
608	K	80.9	Confident	77.3	Confident	14 Å²	14	33.5 Å²	33.5	6%	0.061	16%	0.159	C	C	.	.	H	α-helix	trans	-69.6	-47.8	172.4	-68.6	-175.7	-176.3	169.1	0	111.4	S129 L130 F150 L606 V611 F612	S129-K608 PolarHBondContact O-NZ 3.49Å; L130-K608 HydrophobicContact CD2-CB 4.25Å; L130-K608 HydrophobicContact CD2-CD 3.64Å; L130-K608 PolarHBondContact O-NZ 2.94Å; F150-K608 HydrophobicContact CB-CG 4.28Å; F150-K608 HydrophobicContact CD1-CG 4.2Å; F150-K608 HydrophobicContact CD2-CB 4.32Å; F150-K608 HydrophobicContact CD2-CD 4.35Å; F150-K608 HydrophobicContact CD2-CG 3.29Å; F150-K608 VanDerWaalsContact CE1-CE 3.45Å; F150-K608 HydrophobicContact CE1-CG 4.41Å; F150-K608 HydrophobicContact CE2-CD 4.3Å; F150-K608 HydrophobicContact CE2-CG 3.54Å; F150-K608 HydrophobicContact CG-CG 3.65Å; F150-K608 HydrophobicContact CZ-CD 4.42Å; F150-K608 VanDerWaalsContact CZ-CE 3.45Å; F150-K608 HydrophobicContact CZ-CG 4.11Å; L606-K608 PolarHBondContact O-N 3.49Å; L606-K608 VanDerWaalsContact O-N 3.12Å; K608-V611 PolarHBondContact O-N 3.38Å; K608-F612 HydrophobicContact CB-CE2 4.37Å; K608-F612 WeakPolarHBondContact O-CD2 3.32Å; K608-F612 WeakPolarHBondContact O-CG 3.34Å; K608-F612 PolarHBondContact O-N 2.94Å
609	L	78.1	Confident	75.2	Confident	12 Å²	12	35.2 Å²	35.2	6%	0.063	17%	0.174	C	C	.	.	H	α-helix	trans	-64.5	-47.9	-178.6	-71.8	166.5	0	0	0	111.2	L606 V611 F612 S613 A644 L648 E651	L606-L609 HydrophobicContact CD2-CD1 4.28Å; L606-L609 WeakPolarHBondContact O-CA 3.26Å; L606-L609 PolarHBondContact O-N 3.45Å; L609-V611 VanDerWaalsContact C-N 3.33Å; L609-V611 PolarHBondContact O-N 3.31Å; L609-F612 CarbonylContact O-C 3.48Å; L609-F612 PolarHBondContact O-N 2.78Å; L609-S613 WeakPolarHBondContact O-CB 3.38Å; L609-S613 PolarHBondContact O-N 2.97Å; L609-S613 PolarHBondContact O-OG 2.67Å; L609-S613 VanDerWaalsContact O-OG 3.11Å; L609-A644 HydrophobicContact CD2-CB 4.18Å; L609-L648 HydrophobicContact CB-CD1 3.74Å; L609-E651 HydrophobicContact CD1-CB 4.28Å; L609-E651 VanDerWaalsContact CD1-CD 3.45Å; L609-E651 HydrophobicContact CD1-CG 4.31Å; L609-E651 WeakPolarHBondContact CD1-OE2 3.47Å
610	K	81.3	Confident	73	Confident	13 Å²	13	34.5 Å²	34.5	6%	0.057	17%	0.172	C	C	.	.	H	α-helix	trans	-56	-45	174.1	-79.7	-167.9	170	173.1	0	111.8	D531 E603 L606 F612 S613 Q614 L648	D531-K610 IonicContact OD1-NZ 3.77Å; D531-K610 IonicContact OD2-NZ 3.73Å; D531-K610 PolarHBondContact OD2-NZ 3.49Å; E603-K610 IonicContact OE1-NZ 2.79Å; E603-K610 PolarHBondContact OE1-NZ 2.97Å; E603-K610 WeakPolarHBondContact OE2-CD 3.45Å; E603-K610 WeakPolarHBondContact OE2-CE 3.46Å; E603-K610 IonicContact OE2-NZ 2.93Å; E603-K610 PolarHBondContact OE2-NZ 3.37Å; L606-K610 PolarHBondContact O-N 3.3Å; K610-F612 VanDerWaalsContact C-N 3.26Å; K610-F612 PolarHBondContact O-N 2.93Å; K610-S613 PolarHBondContact O-N 2.95Å; K610-S613 PolarHBondContact O-OG 3.25Å; K610-Q614 VanDerWaalsContact O-CB 3.22Å; K610-Q614 WeakPolarHBondContact O-CB 3.34Å; K610-Q614 WeakPolarHBondContact O-CG 3.34Å; K610-Q614 PolarHBondContact O-N 2.7Å; K610-L648 HydrophobicContact CG-CD1 3.83Å; K610-L648 HydrophobicContact CG-CD2 4.28Å
611	V	76.5	Confident	70.7	Confident	24 Å²	24	37.7 Å²	37.7	15%	0.145	19%	0.189	C	C	.	.	H	α-helix	trans	-67.6	-20.9	177.1	168.7	0	0	0	0	113.6	R153 S607 K608 L609	R153-V611 HydrophobicContact CB-CG2 4.36Å; S607-V611 WeakPolarHBondContact O-CB 3.49Å; S607-V611 WeakPolarHBondContact O-CG2 3.41Å; S607-V611 PolarHBondContact O-N 2.91Å; K608-V611 PolarHBondContact O-N 3.38Å; L609-V611 VanDerWaalsContact C-N 3.33Å; L609-V611 PolarHBondContact O-N 3.31Å
612	F	69.7	Low	68.3	Low	110 Å²	110	40.5 Å²	40.5	48%	0.482	21%	0.212	S	C	.	.	H	α-helix	trans	-94.4	-24.2	174	-69.8	-51	0	0	0	114.1	L130 K608 L609 K610 A641 A644	L130-F612 HydrophobicContact CD2-CE2 4.4Å; K608-F612 HydrophobicContact CB-CE2 4.37Å; K608-F612 WeakPolarHBondContact O-CD2 3.32Å; K608-F612 WeakPolarHBondContact O-CG 3.34Å; K608-F612 PolarHBondContact O-N 2.94Å; L609-F612 CarbonylContact O-C 3.48Å; L609-F612 PolarHBondContact O-N 2.78Å; K610-F612 VanDerWaalsContact C-N 3.26Å; K610-F612 PolarHBondContact O-N 2.93Å; F612-A641 WeakPolarHBondContact O-CA 3.43Å; F612-A644 HydrophobicContact CB-CB 3.62Å
613	S	63.2	Low	65.8	Low	23 Å²	23	48.2 Å²	48.2	16%	0.161	25%	0.249	C	C	.	.	H	α-helix	trans	-92.9	-30	178.9	66.5	0	0	0	0	113.3	L609 K610 T615	L609-S613 WeakPolarHBondContact O-CB 3.38Å; L609-S613 PolarHBondContact O-N 2.97Å; L609-S613 PolarHBondContact O-OG 2.67Å; L609-S613 VanDerWaalsContact O-OG 3.11Å; K610-S613 PolarHBondContact O-N 2.95Å; K610-S613 PolarHBondContact O-OG 3.25Å; S613-T615 PolarHBondContact O-N 3.49Å
614	Q	64.1	Low	63.1	Low	46 Å²	46	54 Å²	54	22%	0.215	28%	0.276	C	S	.	.	S	Bend	trans	-58.8	129	169.9	-77.4	175.9	-41.3	0	0	108.6	E527 K610 D616	E527-Q614 PolarHBondContact OE2-NE2 3.1Å; K610-Q614 VanDerWaalsContact O-CB 3.22Å; K610-Q614 WeakPolarHBondContact O-CB 3.34Å; K610-Q614 WeakPolarHBondContact O-CG 3.34Å; K610-Q614 PolarHBondContact O-N 2.7Å; Q614-D616 PolarHBondContact O-N 3.33Å
615	T	51.7	Low	60.4	Low	116 Å²	116	58.5 Å²	58.5	71%	0.712	31%	0.305	S	S	*	.			trans	-73.2	66.1	175	40	0	0	0	0	110.2	S613	S613-T615 PolarHBondContact O-N 3.49Å
616	D	53.1	Low	57.6	Low	42 Å²	42	58.2 Å²	58.2	23%	0.225	31%	0.314	C	S	.	.			trans	-47.1	161.3	175.4	-166.6	12.2	0	0	0	111.2	Q614 R618 A619	Q614-D616 PolarHBondContact O-N 3.33Å; D616-R618 PolarHBondContact O-N 3.5Å; D616-R618 IonicContact OD2-CZ 3.89Å; D616-R618 IonicContact OD2-NE 2.78Å; D616-R618 PolarHBondContact OD2-NE 3.05Å; D616-R618 IonicContact OD2-NH2 2.73Å; D616-R618 PolarHBondContact OD2-NH2 2.89Å; D616-A619 PolarHBondContact O-N 3.42Å
617	F	54.1	Low	55.3	Low	9 Å²	9	67.6 Å²	67.6	4%	0.039	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	7.4	-178.5	-55.6	-82.8	0	0	0	114.6	G321 A328 A517 Q520 L521	G321-F617 WeakPolarHBondContact O-CE2 3.3Å; A328-F617 HydrophobicContact CB-CB 3.37Å; A328-F617 HydrophobicContact CB-CG 4.17Å; A517-F617 HydrophobicContact CB-CD1 4.31Å; A517-F617 HydrophobicContact CB-CE1 4.18Å; Q520-F617 HydrophobicContact CB-CE1 4.11Å; Q520-F617 VanDerWaalsContact OE1-CD1 3.25Å; L521-F617 HydrophobicContact CD2-CZ 3.78Å; L521-F617 HydrophobicContact CG-CE1 4.32Å; L521-F617 HydrophobicContact CG-CZ 3.93Å
618	R	49.2	Very low	52.8	Low	144 Å²	144	73.8 Å²	73.8	54%	0.543	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-19.5	167.1	-56.2	179.6	-131.6	-155	2.8	113.1	D616 L620 L621 A622	D616-R618 PolarHBondContact O-N 3.5Å; D616-R618 IonicContact OD2-CZ 3.89Å; D616-R618 IonicContact OD2-NE 2.78Å; D616-R618 PolarHBondContact OD2-NE 3.05Å; D616-R618 IonicContact OD2-NH2 2.73Å; D616-R618 PolarHBondContact OD2-NH2 2.89Å; R618-L620 VanDerWaalsContact C-N 3.25Å; R618-L620 PolarHBondContact O-N 2.97Å; R618-L621 CarbonylContact O-C 3.5Å; R618-L621 WeakPolarHBondContact O-CA 3.34Å; R618-L621 WeakPolarHBondContact O-CB 3.3Å; R618-L621 PolarHBondContact O-N 3.1Å; R618-A622 PolarHBondContact O-N 3.41Å
619	A	48.3	Very low	50.2	Low	44 Å²	44	81.2 Å²	81.2	36%	0.364	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-62.5	-36.2	173	0	0	0	0	0	111.3	D616 L621 A622	D616-A619 PolarHBondContact O-N 3.42Å; A619-L621 PolarHBondContact O-N 3.18Å; A619-L621 VanDerWaalsContact O-N 3.12Å; A619-A622 WeakPolarHBondContact O-CB 3.37Å; A619-A622 PolarHBondContact O-N 3.33Å
620	L	47.8	Very low	48	Very low	29 Å²	29	86.4 Å²	86.4	15%	0.152	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-60.3	-14.1	168.8	-85.1	159.3	0	0	0	114.2	W332 A513 T516 R618	W332-L620 PolarHBondContact NE1-O 3.47Å; A513-L620 HydrophobicContact CB-CD2 4.27Å; T516-L620 HydrophobicContact CG2-CD1 4.38Å; T516-L620 HydrophobicContact CG2-CD2 3.94Å; T516-L620 HydrophobicContact CG2-CG 4.34Å; R618-L620 VanDerWaalsContact C-N 3.25Å; R618-L620 PolarHBondContact O-N 2.97Å
621	L	44.1	Very low	45.4	Very low	68 Å²	68	89.8 Å²	89.8	36%	0.356	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-105.2	7.5	175	-60.7	167.4	0	0	0	112.4	W332 R618 A619	W332-L621 HydrophobicContact CB-CD2 4.33Å; R618-L621 CarbonylContact O-C 3.5Å; R618-L621 WeakPolarHBondContact O-CA 3.34Å; R618-L621 WeakPolarHBondContact O-CB 3.3Å; R618-L621 PolarHBondContact O-N 3.1Å; A619-L621 PolarHBondContact O-N 3.18Å; A619-L621 VanDerWaalsContact O-N 3.12Å
622	A	42	Very low	43.4	Very low	62 Å²	62	94 Å²	94	51%	0.512	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-25.5	177.6	0	0	0	0	0	112.7	R618 A619 E624	R618-A622 PolarHBondContact O-N 3.41Å; A619-A622 WeakPolarHBondContact O-CB 3.37Å; A619-A622 PolarHBondContact O-N 3.33Å; A622-E624 PolarHBondContact O-N 2.89Å
623	E	38.1	Very low	41.7	Very low	172 Å²	172	94 Å²	94	80%	0.804	52%	0.517	S	S	*	.			trans	-89.5	87.8	168.4	-64.5	-162.8	147.4	0	0	110	P625	E623-P625 WeakPolarHBondContact O-CD 3.45Å
624	E	32.9	Very low	40.4	Very low	128 Å²	128	96.5 Å²	96.5	60%	0.598	54%	0.535	S	S	*	.			trans	-58.1	121.7	157.5	-85.7	-82.1	156.3	0	0	108.9	A622 S626	A622-E624 PolarHBondContact O-N 2.89Å; E624-S626 PolarHBondContact O-N 3.24Å; E624-S626 VanDerWaalsContact OE2-CB 3.24Å; E624-S626 WeakPolarHBondContact OE2-CB 3.41Å; E624-S626 PolarHBondContact OE2-OG 2.94Å
625	P	33.2	Very low	39.2	Very low	95 Å²	95	97.3 Å²	97.3	62%	0.617	55%	0.55	S	S	*	.	S	Bend	trans	-66.8	-15.2	171.4	27.7	-32.9	0	0	0	112	E623 K627	E623-P625 WeakPolarHBondContact O-CD 3.45Å; P625-K627 PolarHBondContact O-N 3.24Å
626	S	29.6	Very low	38.6	Very low	70 Å²	70	96.7 Å²	96.7	49%	0.49	54%	0.542	S	S	.	.			trans	-72.1	82.2	-178.4	-37.2	0	0	0	0	113.7	E624 T628	E624-S626 PolarHBondContact O-N 3.24Å; E624-S626 VanDerWaalsContact OE2-CB 3.24Å; E624-S626 WeakPolarHBondContact OE2-CB 3.41Å; E624-S626 PolarHBondContact OE2-OG 2.94Å; S626-T628 PolarHBondContact O-N 3.18Å
627	K	38.2	Very low	38.1	Very low	198 Å²	198	102.3 Å²	102.3	86%	0.861	56%	0.564	S	S	*	*			trans	-66.6	95.5	167.9	-75.2	-179.3	-178.6	168.9	0	111.5	P625	P625-K627 PolarHBondContact O-N 3.24Å
628	T	33.1	Very low	37.7	Very low	131 Å²	131	106.6 Å²	106.6	80%	0.804	59%	0.587	S	S	*	*				162.4	91.8	116.7	46.7	0	0	0	0	113.2	S626	S626-T628 PolarHBondContact O-N 3.18Å
629	Q	27.3	Very low	38	Very low	170 Å²	170	102.8 Å²	102.8	79%	0.794	58%	0.583	S	S	*	*			trans	-169.9	129.9	137.7	-157.9	72.1	-33.4	0	0	110.3	C631	Q629-C631 PolarHBondContact O-N 3.32Å
630	P	30.5	Very low	38.4	Very low	121 Å²	121	109.5 Å²	109.5	79%	0.786	60%	0.599	S	S	*	*			trans	-79.5	87.6	177.7	31.5	-34	0	0	0	111.6
631	C	27.1	Very low	38.8	Very low	83 Å²	83	110.2 Å²	110.2	56%	0.561	61%	0.609	S	S	*	*			trans	-81	133.3	171.3	-167	0	0	0	0	111.7	Q629 D633 S634	Q629-C631 PolarHBondContact O-N 3.32Å; C631-D633 VanDerWaalsContact C-N 3.3Å; C631-D633 PolarHBondContact O-N 3Å; C631-S634 PolarHBondContact O-N 3.48Å; C631-S634 PolarHBondContact O-OG 2.9Å
632	V	33.5	Very low	39.7	Very low	114 Å²	114	108.9 Å²	108.9	69%	0.691	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-27.9	-166.9	-179	0	0	0	0	113.4	S634 A635	V632-S634 PolarHBondContact O-N 3.46Å; V632-A635 PolarHBondContact O-N 3.32Å
633	D	35.1	Very low	40.7	Very low	108 Å²	108	110.1 Å²	110.1	58%	0.578	60%	0.603	S	S	*	*	H	α-helix	trans	-67.3	-17.3	-176.3	-66	-38.9	0	0	0	114.5	C631 L636	C631-D633 VanDerWaalsContact C-N 3.3Å; C631-D633 PolarHBondContact O-N 3Å; D633-L636 PolarHBondContact O-N 3.09Å
634	S	36.7	Very low	42	Very low	76 Å²	76	102.1 Å²	102.1	53%	0.531	57%	0.566	S	S	.	*	H	α-helix	trans	-61.4	-43.5	174.2	57.5	0	0	0	0	112.1	C631 V632 L636 K637	C631-S634 PolarHBondContact O-N 3.48Å; C631-S634 PolarHBondContact O-OG 2.9Å; V632-S634 PolarHBondContact O-N 3.46Å; S634-L636 VanDerWaalsContact C-N 3.32Å; S634-L636 PolarHBondContact O-N 2.91Å; S634-K637 PolarHBondContact O-N 3.48Å
635	A	37.9	Very low	43.7	Very low	64 Å²	64	102.3 Å²	102.3	53%	0.529	57%	0.567	S	S	.	*	H	α-helix	trans	-65.3	-33.7	-178.3	0	0	0	0	0	112.9	V632 K637 S639	V632-A635 PolarHBondContact O-N 3.32Å; A635-K637 PolarHBondContact O-N 3.03Å; A635-S639 WeakPolarHBondContact O-CB 3.27Å; A635-S639 PolarHBondContact O-N 3.37Å
636	L	39.8	Very low	45.6	Very low	103 Å²	103	106.8 Å²	106.8	54%	0.539	57%	0.572	S	S	.	*	H	α-helix	trans	-71	-27.8	-176.8	-108.5	129.4	0	0	0	113.7	D633 S634	D633-L636 PolarHBondContact O-N 3.09Å; S634-L636 VanDerWaalsContact C-N 3.32Å; S634-L636 PolarHBondContact O-N 2.91Å
637	K	42.1	Very low	47.8	Very low	160 Å²	160	106.3 Å²	106.3	70%	0.696	56%	0.562	S	S	*	*	H	α-helix	trans	-77.2	-47.6	174.7	-70.7	172.5	-177.7	167.2	0	111.1	S634 A635 S639 R640	S634-K637 PolarHBondContact O-N 3.48Å; A635-K637 PolarHBondContact O-N 3.03Å; K637-S639 PolarHBondContact O-N 2.95Å; K637-R640 PolarHBondContact O-N 2.81Å; K637-R640 VanDerWaalsContact O-N 3.07Å
638	N	45.8	Very low	49.7	Very low	98 Å²	98	98.5 Å²	98.5	52%	0.524	53%	0.529	S	S	.	.	H	α-helix	trans	-63.3	-30.3	178.3	-66.2	-2.8	0	0	0	112.3	R640 S642	N638-R640 PolarHBondContact O-N 3.41Å; N638-S642 WeakPolarHBondContact O-CB 3.37Å; N638-S642 PolarHBondContact O-N 2.89Å; N638-S642 PolarHBondContact O-OG 2.88Å
639	S	55.8	Low	52.1	Low	65 Å²	65	94 Å²	94	46%	0.455	51%	0.509	S	S	.	.	H	α-helix	trans	-56.8	-43.7	171	-179.6	0	0	0	0	112.9	A635 K637 S642 L643	A635-S639 WeakPolarHBondContact O-CB 3.27Å; A635-S639 PolarHBondContact O-N 3.37Å; K637-S639 PolarHBondContact O-N 2.95Å; S639-S642 PolarHBondContact O-OG 2.88Å; S639-L643 WeakPolarHBondContact O-CB 3.41Å; S639-L643 PolarHBondContact O-N 3.41Å
640	R	55.1	Low	54.8	Low	184 Å²	184	89.9 Å²	89.9	69%	0.694	50%	0.497	S	S	*	.	H	α-helix	trans	-71.8	-39.8	-175.8	-71	-174.3	179	173.8	1.6	113.8	K637 N638 A644	K637-R640 PolarHBondContact O-N 2.81Å; K637-R640 VanDerWaalsContact O-N 3.07Å; N638-R640 PolarHBondContact O-N 3.41Å; R640-A644 WeakPolarHBondContact O-CB 3.49Å; R640-A644 PolarHBondContact O-N 3.14Å
641	A	57.8	Low	57.3	Low	45 Å²	45	86.5 Å²	86.5	37%	0.372	47%	0.47	S	S	.	.	H	α-helix	trans	-68.9	-49.8	178.9	0	0	0	0	0	111.6	F612 L643 A644 E645	F612-A641 WeakPolarHBondContact O-CA 3.43Å; A641-L643 VanDerWaalsContact C-N 3.26Å; A641-L643 PolarHBondContact O-N 2.68Å; A641-A644 PolarHBondContact O-N 3Å; A641-A644 VanDerWaalsContact O-N 3.14Å; A641-E645 PolarHBondContact O-N 3.29Å
642	S	62	Low	60	Low	40 Å²	40	83.9 Å²	83.9	28%	0.28	45%	0.453	S	S	.	.	H	α-helix	trans	-66	-26	177.3	60.8	0	0	0	0	113.5	N638 S639 R646	N638-S642 WeakPolarHBondContact O-CB 3.37Å; N638-S642 PolarHBondContact O-N 2.89Å; N638-S642 PolarHBondContact O-OG 2.88Å; S639-S642 PolarHBondContact O-OG 2.88Å; S642-R646 WeakPolarHBondContact O-CD 3.5Å; S642-R646 WeakPolarHBondContact O-CG 3.42Å; S642-R646 PolarHBondContact O-N 3.19Å
643	L	64.2	Low	62.6	Low	88 Å²	88	85.3 Å²	85.3	46%	0.461	45%	0.45	S	S	.	.	H	α-helix	trans	-73.3	-44.8	170.1	-173.9	144.8	0	0	0	111.3	S639 A641 E645 R646 H647	S639-L643 WeakPolarHBondContact O-CB 3.41Å; S639-L643 PolarHBondContact O-N 3.41Å; A641-L643 VanDerWaalsContact C-N 3.26Å; A641-L643 PolarHBondContact O-N 2.68Å; L643-E645 VanDerWaalsContact C-N 3.34Å; L643-E645 PolarHBondContact O-N 2.89Å; L643-R646 PolarHBondContact O-N 2.7Å; L643-H647 PolarHBondContact O-CD2 3.16Å; L643-H647 PolarHBondContact O-N 3.06Å
644	A	63.7	Low	65	Low	4 Å²	4	84.1 Å²	84.1	3%	0.033	44%	0.443	C	S	.	.	H	α-helix	trans	-58.7	-44.5	175.5	0	0	0	0	0	112.1	L609 F612 R640 A641 R646 H647 L648	L609-A644 HydrophobicContact CD2-CB 4.18Å; F612-A644 HydrophobicContact CB-CB 3.62Å; R640-A644 WeakPolarHBondContact O-CB 3.49Å; R640-A644 PolarHBondContact O-N 3.14Å; A641-A644 PolarHBondContact O-N 3Å; A641-A644 VanDerWaalsContact O-N 3.14Å; A644-R646 PolarHBondContact O-N 2.84Å; A644-H647 PolarHBondContact O-N 2.93Å; A644-L648 WeakPolarHBondContact O-CB 3.47Å; A644-L648 PolarHBondContact O-N 3.34Å
645	E	68.6	Low	67.4	Low	131 Å²	131	81 Å²	81	61%	0.612	42%	0.421	S	S	*	.	H	α-helix	trans	-56.6	-47.4	174.1	-174	-173.5	-168.4	0	0	112.1	A641 L643 H647 L648	A641-E645 PolarHBondContact O-N 3.29Å; L643-E645 VanDerWaalsContact C-N 3.34Å; L643-E645 PolarHBondContact O-N 2.89Å; E645-H647 VanDerWaalsContact C-N 3.34Å; E645-H647 PolarHBondContact O-N 3.35Å; E645-L648 PolarHBondContact O-N 3.44Å
646	R	72.9	Confident	69.8	Low	189 Å²	189	82.5 Å²	82.5	71%	0.713	42%	0.416	S	S	*	.	H	α-helix	trans	-63.9	-33.1	177.5	-74.1	168.6	-173.4	-175.8	3.3	113.7	S642 L643 A644 P650	S642-R646 WeakPolarHBondContact O-CD 3.5Å; S642-R646 WeakPolarHBondContact O-CG 3.42Å; S642-R646 PolarHBondContact O-N 3.19Å; L643-R646 PolarHBondContact O-N 2.7Å; A644-R646 PolarHBondContact O-N 2.84Å; R646-P650 WeakPolarHBondContact O-CD 3.29Å
647	H	76	Confident	72	Confident	61 Å²	61	82.3 Å²	82.3	28%	0.282	42%	0.416	S	S	.	.	H	α-helix	trans	-87.3	-26.7	179.8	-74.7	-73.4	0	0	0	113.7	L643 A644 E645 G649 P650 E651	L643-H647 PolarHBondContact O-CD2 3.16Å; L643-H647 PolarHBondContact O-N 3.06Å; A644-H647 PolarHBondContact O-N 2.93Å; E645-H647 VanDerWaalsContact C-N 3.34Å; E645-H647 PolarHBondContact O-N 3.35Å; H647-G649 VanDerWaalsContact C-N 3.34Å; H647-G649 PolarHBondContact O-N 3.21Å; H647-P650 WeakPolarHBondContact O-CD 3.44Å; H647-E651 VanDerWaalsContact O-CB 3.28Å; H647-E651 WeakPolarHBondContact O-CB 3.43Å; H647-E651 PolarHBondContact O-N 2.88Å
648	L	79.5	Confident	74.2	Confident	34 Å²	34	78 Å²	78	18%	0.178	40%	0.401	C	S	.	.	H	α-helix	trans	-55.5	-45.5	-178.8	-176.1	73.3	0	0	0	112.4	L606 L609 K610 A644 E645 S652	L606-L648 HydrophobicContact CB-CD1 4.39Å; L606-L648 HydrophobicContact CD2-CD1 4.15Å; L609-L648 HydrophobicContact CB-CD1 3.74Å; K610-L648 HydrophobicContact CG-CD1 3.83Å; K610-L648 HydrophobicContact CG-CD2 4.28Å; A644-L648 WeakPolarHBondContact O-CB 3.47Å; A644-L648 PolarHBondContact O-N 3.34Å; E645-L648 PolarHBondContact O-N 3.44Å; L648-S652 WeakPolarHBondContact O-CB 3.36Å; L648-S652 PolarHBondContact O-N 2.83Å
649	G	82.6	Confident	76.2	Confident	37 Å²	37	74.2 Å²	74.2	38%	0.381	38%	0.38	S	S	.	.	H	α-helix	trans	-63.4	-55	180	0	0	0	0	0	113.9	H647 K653	H647-G649 VanDerWaalsContact C-N 3.34Å; H647-G649 PolarHBondContact O-N 3.21Å; G649-K653 WeakPolarHBondContact O-CG 3.43Å; G649-K653 PolarHBondContact O-N 3.39Å
650	P	83.6	Confident	77.8	Confident	82 Å²	82	76.5 Å²	76.5	53%	0.532	38%	0.384	S	S	.	.	H	α-helix	trans	-59	-44.3	174.1	-27.5	35.7	0	0	0	114	R646 H647 K653 L654	R646-P650 WeakPolarHBondContact O-CD 3.29Å; H647-P650 WeakPolarHBondContact O-CD 3.44Å; P650-K653 PolarHBondContact O-N 2.9Å; P650-L654 PolarHBondContact O-N 3.13Å
651	E	82.8	Confident	79.4	Confident	50 Å²	50	74.4 Å²	74.4	23%	0.234	38%	0.382	C	S	.	.	H	α-helix	trans	-69.9	-40	-177.3	-168.7	168.8	139.4	0	0	111.9	L126 L606 L609 H647 K653 L654 L655	L126-E651 WeakPolarHBondContact CD2-OE2 3.22Å; L606-E651 HydrophobicContact CD2-CB 4.43Å; L606-E651 HydrophobicContact CD2-CG 4.31Å; L609-E651 HydrophobicContact CD1-CB 4.28Å; L609-E651 VanDerWaalsContact CD1-CD 3.45Å; L609-E651 HydrophobicContact CD1-CG 4.31Å; L609-E651 WeakPolarHBondContact CD1-OE2 3.47Å; H647-E651 VanDerWaalsContact O-CB 3.28Å; H647-E651 WeakPolarHBondContact O-CB 3.43Å; H647-E651 PolarHBondContact O-N 2.88Å; E651-K653 VanDerWaalsContact C-N 3.3Å; E651-K653 PolarHBondContact O-N 3.33Å; E651-L654 PolarHBondContact O-N 2.93Å; E651-L655 HydrophobicContact CG-CD1 4.18Å; E651-L655 HydrophobicContact CG-CG 4.35Å; E651-L655 WeakPolarHBondContact O-CB 3.41Å; E651-L655 WeakPolarHBondContact O-CG 3.37Å; E651-L655 PolarHBondContact O-N 3.42Å
652	S	85.6	Confident	81	Confident	28 Å²	28	74.7 Å²	74.7	20%	0.196	38%	0.375	C	S	.	.	H	α-helix	trans	-56.7	-43.2	173.6	-177.2	0	0	0	0	111.9	K602 L648 E656	K602-S652 WeakPolarHBondContact CE-O 3.08Å; K602-S652 VanDerWaalsContact CE-OG 3.23Å; K602-S652 WeakPolarHBondContact CE-OG 3.47Å; K602-S652 PolarHBondContact NZ-OG 2.88Å; L648-S652 WeakPolarHBondContact O-CB 3.36Å; L648-S652 PolarHBondContact O-N 2.83Å; S652-E656 VanDerWaalsContact O-CB 3.28Å; S652-E656 WeakPolarHBondContact O-CB 3.47Å; S652-E656 PolarHBondContact O-N 3.42Å
653	K	86.3	Confident	82.5	Confident	145 Å²	145	73.4 Å²	73.4	63%	0.63	37%	0.365	S	S	*	.	H	α-helix	trans	-69.5	-38.8	176.9	-70.1	176.8	-179.6	-179.4	0	113.2	G649 P650 E651 E656 N657	G649-K653 WeakPolarHBondContact O-CG 3.43Å; G649-K653 PolarHBondContact O-N 3.39Å; P650-K653 PolarHBondContact O-N 2.9Å; E651-K653 VanDerWaalsContact C-N 3.3Å; E651-K653 PolarHBondContact O-N 3.33Å; K653-E656 PolarHBondContact O-N 3.38Å; K653-N657 VanDerWaalsContact O-CG 3.32Å; K653-N657 PolarHBondContact O-N 2.95Å; K653-N657 VanDerWaalsContact O-N 3.1Å; K653-N657 PolarHBondContact O-ND2 3.25Å
654	L	86.8	Confident	83.7	Confident	83 Å²	83	73.9 Å²	73.9	44%	0.435	37%	0.368	S	S	.	.	H	α-helix	trans	-64.7	-45.3	176	179.1	60.6	0	0	0	111.2	P650 E651 N658	P650-L654 PolarHBondContact O-N 3.13Å; E651-L654 PolarHBondContact O-N 2.93Å; L654-N658 WeakPolarHBondContact O-CB 3.35Å; L654-N658 PolarHBondContact O-N 3.09Å; L654-N658 VanDerWaalsContact O-N 3.12Å; L654-N658 PolarHBondContact O-ND2 2.94Å
655	L	87.1	Confident	85	Confident	11 Å²	11	76.6 Å²	76.6	6%	0.058	39%	0.386	C	S	.	.	H	α-helix	trans	-63	-42.3	175.6	-70	176.1	0	0	0	111.7	K602 R605 L606 E651 N658 L659	K602-L655 HydrophobicContact CG-CB 4.35Å; R605-L655 HydrophobicContact CB-CD1 3.77Å; L606-L655 HydrophobicContact CD2-CD1 3.83Å; L606-L655 HydrophobicContact CG-CD1 4.03Å; E651-L655 HydrophobicContact CG-CD1 4.18Å; E651-L655 HydrophobicContact CG-CG 4.35Å; E651-L655 WeakPolarHBondContact O-CB 3.41Å; E651-L655 WeakPolarHBondContact O-CG 3.37Å; E651-L655 PolarHBondContact O-N 3.42Å; L655-N658 PolarHBondContact O-N 3.19Å; L655-L659 HydrophobicContact CB-CD1 4.45Å; L655-L659 WeakPolarHBondContact O-CB 3.26Å; L655-L659 WeakPolarHBondContact O-CD1 3.41Å; L655-L659 WeakPolarHBondContact O-CG 3.49Å; L655-L659 PolarHBondContact O-N 3.46Å
656	E	87.2	Confident	86.2	Confident	94 Å²	94	71.1 Å²	71.1	44%	0.439	36%	0.36	S	S	.	.	H	α-helix	trans	-58.7	-49.7	177.6	-167.8	169.6	148	0	0	112.3	K602 S652 K653 N658 L659 Q660	K602-E656 IonicContact NZ-OE2 2.72Å; K602-E656 PolarHBondContact NZ-OE2 2.88Å; S652-E656 VanDerWaalsContact O-CB 3.28Å; S652-E656 WeakPolarHBondContact O-CB 3.47Å; S652-E656 PolarHBondContact O-N 3.42Å; K653-E656 PolarHBondContact O-N 3.38Å; E656-N658 VanDerWaalsContact C-N 3.34Å; E656-N658 PolarHBondContact O-N 3.03Å; E656-L659 PolarHBondContact O-N 3.33Å; E656-Q660 VanDerWaalsContact O-CB 3.28Å; E656-Q660 WeakPolarHBondContact O-CB 3.42Å; E656-Q660 PolarHBondContact O-N 3.43Å
657	N	86.9	Confident	87.1	Confident	99 Å²	99	62.9 Å²	62.9	53%	0.529	33%	0.331	S	S	.	.	H	α-helix	trans	-58.4	-44.5	175.5	-69.5	-23.5	0	0	0	112.2	K653 Q660 Q661	K653-N657 VanDerWaalsContact O-CG 3.32Å; K653-N657 PolarHBondContact O-N 2.95Å; K653-N657 VanDerWaalsContact O-N 3.1Å; K653-N657 PolarHBondContact O-ND2 3.25Å; N657-Q660 PolarHBondContact O-N 3.4Å; N657-Q661 WeakPolarHBondContact O-CB 3.17Å; N657-Q661 PolarHBondContact O-N 3.29Å
658	N	87.6	Confident	87.9	Confident	70 Å²	70	66.2 Å²	66.2	37%	0.374	35%	0.346	S	S	.	.	H	α-helix	trans	-66.6	-43.8	-178.7	-68.4	-14.9	0	0	0	111.9	L654 L655 E656 Q661 E662	L654-N658 WeakPolarHBondContact O-CB 3.35Å; L654-N658 PolarHBondContact O-N 3.09Å; L654-N658 VanDerWaalsContact O-N 3.12Å; L654-N658 PolarHBondContact O-ND2 2.94Å; L655-N658 PolarHBondContact O-N 3.19Å; E656-N658 VanDerWaalsContact C-N 3.34Å; E656-N658 PolarHBondContact O-N 3.03Å; N658-Q661 PolarHBondContact O-N 2.98Å; N658-E662 PolarHBondContact O-N 2.86Å
659	L	88.4	Confident	88.4	Confident	19 Å²	19	67.1 Å²	67.1	10%	0.099	36%	0.359	C	S	.	.	H	α-helix	trans	-69.3	-34.1	178.4	-66.1	164.9	0	0	0	111.4	L598 K602 L655 E656 E662 F663	L598-L659 HydrophobicContact CD2-CB 4.22Å; L598-L659 HydrophobicContact CD2-CD2 3.5Å; L598-L659 HydrophobicContact CD2-CG 4.43Å; K602-L659 HydrophobicContact CB-CD1 3.69Å; K602-L659 HydrophobicContact CG-CD1 4.09Å; L655-L659 HydrophobicContact CB-CD1 4.45Å; L655-L659 WeakPolarHBondContact O-CB 3.26Å; L655-L659 WeakPolarHBondContact O-CD1 3.41Å; L655-L659 WeakPolarHBondContact O-CG 3.49Å; L655-L659 PolarHBondContact O-N 3.46Å; E656-L659 PolarHBondContact O-N 3.33Å; L659-E662 PolarHBondContact O-N 3.28Å; L659-F663 WeakPolarHBondContact O-CB 3.42Å; L659-F663 PolarHBondContact O-N 3.5Å
660	Q	89.1	Confident	88.9	Confident	112 Å²	112	65.6 Å²	65.6	52%	0.523	34%	0.342	S	S	.	.	H	α-helix	trans	-66.5	-41.9	172	-174.3	177.9	5.2	0	0	111.7	E656 N657 F663 L664	E656-Q660 VanDerWaalsContact O-CB 3.28Å; E656-Q660 WeakPolarHBondContact O-CB 3.42Å; E656-Q660 PolarHBondContact O-N 3.43Å; N657-Q660 PolarHBondContact O-N 3.4Å; Q660-F663 PolarHBondContact O-N 2.86Å; Q660-L664 HydrophobicContact CG-CD1 4.18Å; Q660-L664 WeakPolarHBondContact O-CB 3.39Å; Q660-L664 VanDerWaalsContact O-CG 3.28Å; Q660-L664 WeakPolarHBondContact O-CG 3.4Å; Q660-L664 PolarHBondContact O-N 3.28Å
661	Q	89.6	Confident	89.3	Confident	141 Å²	141	62.7 Å²	62.7	66%	0.659	32%	0.323	S	S	*	.	H	α-helix	trans	-65.4	-39	175	-174.1	175.2	-5.4	0	0	112	N657 N658 L664 S665	N657-Q661 WeakPolarHBondContact O-CB 3.17Å; N657-Q661 PolarHBondContact O-N 3.29Å; N658-Q661 PolarHBondContact O-N 2.98Å; Q661-L664 PolarHBondContact O-N 3.26Å; Q661-S665 PolarHBondContact O-N 3.23Å; Q661-S665 VanDerWaalsContact O-N 3.07Å; Q661-S665 PolarHBondContact O-OG 2.9Å
662	E	90.9	Very high	89.7	Confident	50 Å²	50	66.6 Å²	66.6	23%	0.234	34%	0.341	C	S	.	.	H	α-helix	trans	-59.8	-52.3	172.7	-175.7	174.5	-146.1	0	0	110.6	K244 R594 L598 N658 L659 L664 S665 E666	K244-E662 IonicContact NZ-OE1 3.36Å; K244-E662 PolarHBondContact NZ-OE1 3.26Å; R594-E662 IonicContact CZ-OE2 2.74Å; R594-E662 IonicContact NH2-OE1 3.53Å; R594-E662 PolarHBondContact NH2-OE1 2.94Å; R594-E662 VanDerWaalsContact NH2-OE1 3.07Å; R594-E662 IonicContact NH2-OE2 2.68Å; R594-E662 PolarHBondContact NH2-OE2 3.49Å; L598-E662 WeakPolarHBondContact CD2-OE2 3.33Å; N658-E662 PolarHBondContact O-N 2.86Å; L659-E662 PolarHBondContact O-N 3.28Å; E662-L664 VanDerWaalsContact C-N 3.31Å; E662-L664 PolarHBondContact O-N 2.87Å; E662-S665 PolarHBondContact O-N 3.21Å; E662-S665 VanDerWaalsContact O-N 3.11Å; E662-S665 PolarHBondContact O-OG 2.73Å; E662-E666 HydrophobicContact CG-CG 4.47Å; E662-E666 WeakPolarHBondContact O-CG 3.32Å; E662-E666 PolarHBondContact O-N 3.37Å
663	F	92.2	Very high	90	Very high	13 Å²	13	66.4 Å²	66.4	6%	0.057	34%	0.338	C	S	.	.	H	α-helix	trans	-56.4	-42.3	179.3	-173.5	-114.2	0	0	0	112.7	L546 F591 R594 H595 L598 L659 Q660 E666 L667	L546-F663 HydrophobicContact CD2-CZ 4.31Å; F591-F663 HydrophobicContact CB-CE2 4.17Å; F591-F663 HydrophobicContact CB-CZ 4.36Å; F591-F663 HydrophobicContact CD1-CD2 4.3Å; F591-F663 AromaticContact CD1-CE2 3.76Å; F591-F663 HydrophobicContact CD1-CE2 3.76Å; F591-F663 HydrophobicContact CD1-CZ 4.43Å; F591-F663 HydrophobicContact CG-CE2 4.43Å; R594-F663 HydrophobicContact CG-CD2 4.26Å; H595-F663 HydrophobicContact CB-CE2 3.82Å; H595-F663 HydrophobicContact CB-CZ 3.97Å; H595-F663 AromaticContact CD2-CE1 3.75Å; H595-F663 AromaticContact CD2-CZ 3.75Å; L598-F663 HydrophobicContact CD1-CB 3.74Å; L598-F663 HydrophobicContact CD1-CD2 3.71Å; L598-F663 HydrophobicContact CD1-CG 4.09Å; L659-F663 WeakPolarHBondContact O-CB 3.42Å; L659-F663 PolarHBondContact O-N 3.5Å; Q660-F663 PolarHBondContact O-N 2.86Å; F663-E666 PolarHBondContact O-N 3.41Å; F663-L667 HydrophobicContact CD1-CD1 3.79Å; F663-L667 HydrophobicContact CE1-CD1 3.52Å; F663-L667 HydrophobicContact CE1-CG 4.36Å; F663-L667 HydrophobicContact CG-CD1 4.48Å; F663-L667 HydrophobicContact CZ-CD1 4.01Å; F663-L667 HydrophobicContact CZ-CG 4.45Å; F663-L667 WeakPolarHBondContact O-CG 3.17Å; F663-L667 PolarHBondContact O-N 2.99Å
664	L	90.6	Very high	90.4	Very high	99 Å²	99	59.8 Å²	59.8	52%	0.518	31%	0.309	S	S	.	.	H	α-helix	trans	-65.8	-39.7	177	-71.3	169.5	0	0	0	112.5	Q660 Q661 E662 L667 E668	Q660-L664 HydrophobicContact CG-CD1 4.18Å; Q660-L664 WeakPolarHBondContact O-CB 3.39Å; Q660-L664 VanDerWaalsContact O-CG 3.28Å; Q660-L664 WeakPolarHBondContact O-CG 3.4Å; Q660-L664 PolarHBondContact O-N 3.28Å; Q661-L664 PolarHBondContact O-N 3.26Å; E662-L664 VanDerWaalsContact C-N 3.31Å; E662-L664 PolarHBondContact O-N 2.87Å; L664-L667 PolarHBondContact O-N 3.36Å; L664-E668 PolarHBondContact O-N 2.94Å
665	S	90	Very high	90.6	Very high	61 Å²	61	59.6 Å²	59.6	43%	0.427	31%	0.307	S	S	.	.	H	α-helix	trans	-69.1	-33.1	176.3	69.9	0	0	0	0	112.9	Q661 E662 E668 A669	Q661-S665 PolarHBondContact O-N 3.23Å; Q661-S665 VanDerWaalsContact O-N 3.07Å; Q661-S665 PolarHBondContact O-OG 2.9Å; E662-S665 PolarHBondContact O-N 3.21Å; E662-S665 VanDerWaalsContact O-N 3.11Å; E662-S665 PolarHBondContact O-OG 2.73Å; S665-E668 PolarHBondContact O-N 3.45Å; S665-A669 PolarHBondContact O-N 3.17Å
666	E	94.3	Very high	90.8	Very high	15 Å²	15	61.4 Å²	61.4	7%	0.07	32%	0.32	C	S	.	.	H	α-helix	trans	-70.7	-36.2	174	-68.2	178.5	161.1	0	0	111.9	K244 L247 F591 R594 E662 F663 A670	K244-E666 WeakPolarHBondContact CE-OE1 3.44Å; K244-E666 IonicContact NZ-OE1 2.99Å; L247-E666 HydrophobicContact CD2-CB 3.86Å; L247-E666 VanDerWaalsContact CD2-CD 3.47Å; L247-E666 HydrophobicContact CD2-CG 4Å; L247-E666 VanDerWaalsContact CD2-OE2 3.23Å; L247-E666 WeakPolarHBondContact CD2-OE2 3.3Å; F591-E666 HydrophobicContact CE1-CB 3.9Å; F591-E666 HydrophobicContact CZ-CB 4.48Å; F591-E666 WeakPolarHBondContact CZ-O 3.45Å; R594-E666 IonicContact CZ-OE1 3.85Å; R594-E666 IonicContact CZ-OE2 3.76Å; R594-E666 IonicContact NE-OE1 3.62Å; R594-E666 PolarHBondContact NE-OE1 2.9Å; R594-E666 IonicContact NE-OE2 2.76Å; R594-E666 PolarHBondContact NE-OE2 3.4Å; R594-E666 IonicContact NH2-OE1 3.89Å; R594-E666 PolarHBondContact NH2-OE1 2.96Å; R594-E666 IonicContact NH2-OE2 3.54Å; R594-E666 PolarHBondContact NH2-OE2 2.76Å; E662-E666 HydrophobicContact CG-CG 4.47Å; E662-E666 WeakPolarHBondContact O-CG 3.32Å; E662-E666 PolarHBondContact O-N 3.37Å; F663-E666 PolarHBondContact O-N 3.41Å; E666-A670 PolarHBondContact O-N 3.15Å
667	L	93.1	Very high	91.1	Very high	17 Å²	17	57.7 Å²	57.7	9%	0.089	30%	0.303	C	S	.	.	H	α-helix	trans	-65.2	-41.6	171.7	-75.8	172.3	0	0	0	112.1	L546 L549 F591 F663 L664 A669 A670 T671	L546-L667 HydrophobicContact CD2-CD2 3.62Å; L549-L667 HydrophobicContact CD2-CD2 3.95Å; F591-L667 HydrophobicContact CB-CD2 4.34Å; F591-L667 HydrophobicContact CD1-CD2 3.65Å; F591-L667 HydrophobicContact CD1-CG 4.13Å; F591-L667 HydrophobicContact CD2-CD2 3.72Å; F591-L667 HydrophobicContact CE1-CD2 3.79Å; F591-L667 HydrophobicContact CE1-CG 4.05Å; F591-L667 HydrophobicContact CE2-CD2 3.89Å; F591-L667 HydrophobicContact CG-CD2 3.63Å; F591-L667 HydrophobicContact CZ-CD2 3.92Å; F591-L667 HydrophobicContact CZ-CG 4.45Å; F663-L667 HydrophobicContact CD1-CD1 3.79Å; F663-L667 HydrophobicContact CE1-CD1 3.52Å; F663-L667 HydrophobicContact CE1-CG 4.36Å; F663-L667 HydrophobicContact CG-CD1 4.48Å; F663-L667 HydrophobicContact CZ-CD1 4.01Å; F663-L667 HydrophobicContact CZ-CG 4.45Å; F663-L667 WeakPolarHBondContact O-CG 3.17Å; F663-L667 PolarHBondContact O-N 2.99Å; L664-L667 PolarHBondContact O-N 3.36Å; L667-A669 PolarHBondContact O-N 3.47Å; L667-A670 CarbonylContact O-C 3.29Å; L667-A670 WeakPolarHBondContact O-CA 3.46Å; L667-A670 WeakPolarHBondContact O-CB 3.45Å; L667-A670 PolarHBondContact O-N 2.9Å; L667-A670 VanDerWaalsContact O-N 3.08Å; L667-T671 WeakPolarHBondContact O-CG2 3.26Å; L667-T671 PolarHBondContact O-N 3.21Å
668	E	91	Very high	91.3	Very high	131 Å²	131	53.1 Å²	53.1	61%	0.612	28%	0.278	S	S	*	.	H	α-helix	trans	-56.4	-51	177.5	-173.1	167	-152	0	0	111	L664 S665 A670 T671 E672	L664-E668 PolarHBondContact O-N 2.94Å; S665-E668 PolarHBondContact O-N 3.45Å; E668-A670 VanDerWaalsContact C-N 3.26Å; E668-A670 PolarHBondContact O-N 3.43Å; E668-T671 PolarHBondContact O-N 3.35Å; E668-T671 PolarHBondContact O-OG1 2.99Å; E668-E672 PolarHBondContact O-N 3.03Å; E668-E672 VanDerWaalsContact O-N 3.1Å
669	A	91.1	Very high	91.5	Very high	53 Å²	53	55.6 Å²	55.6	44%	0.438	29%	0.287	S	S	.	.	H	α-helix	trans	-59.5	-32.6	175.1	0	0	0	0	0	113.5	S665 L667 L673	S665-A669 PolarHBondContact O-N 3.17Å; L667-A669 PolarHBondContact O-N 3.47Å; A669-L673 PolarHBondContact O-N 3.26Å
670	A	92.9	Very high	91.7	Very high	4 Å²	4	58.9 Å²	58.9	3%	0.033	31%	0.305	C	S	.	.	H	α-helix	trans	-72.3	-33.6	172.9	0	0	0	0	0	113.1	L251 M587 F591 E666 L667 E668 L673 L674	L251-A670 HydrophobicContact CD1-CB 4.44Å; L251-A670 HydrophobicContact CD2-CB 4.48Å; M587-A670 HydrophobicContact SD-CB 3.9Å; F591-A670 HydrophobicContact CE2-CB 3.39Å; F591-A670 HydrophobicContact CZ-CB 3.56Å; E666-A670 PolarHBondContact O-N 3.15Å; L667-A670 CarbonylContact O-C 3.29Å; L667-A670 WeakPolarHBondContact O-CA 3.46Å; L667-A670 WeakPolarHBondContact O-CB 3.45Å; L667-A670 PolarHBondContact O-N 2.9Å; L667-A670 VanDerWaalsContact O-N 3.08Å; E668-A670 VanDerWaalsContact C-N 3.26Å; E668-A670 PolarHBondContact O-N 3.43Å; A670-L673 WeakPolarHBondContact O-CB 3.46Å; A670-L673 PolarHBondContact O-N 2.99Å; A670-L674 PolarHBondContact O-N 3.04Å
671	T	91.8	Very high	91.7	Very high	21 Å²	21	53.8 Å²	53.8	13%	0.129	28%	0.282	C	S	.	.	H	α-helix	trans	-66.8	-36.3	172.8	68.6	0	0	0	0	112.3	L549 L667 E668 L673 L674 Q675	L549-T671 HydrophobicContact CD1-CG2 3.76Å; L549-T671 HydrophobicContact CD2-CG2 3.93Å; L549-T671 HydrophobicContact CG-CG2 4.22Å; L667-T671 WeakPolarHBondContact O-CG2 3.26Å; L667-T671 PolarHBondContact O-N 3.21Å; E668-T671 PolarHBondContact O-N 3.35Å; E668-T671 PolarHBondContact O-OG1 2.99Å; T671-L673 VanDerWaalsContact C-N 3.27Å; T671-L673 PolarHBondContact O-N 2.95Å; T671-L674 PolarHBondContact O-N 3.39Å; T671-Q675 WeakPolarHBondContact O-CB 3.27Å; T671-Q675 VanDerWaalsContact O-CG 3.27Å; T671-Q675 WeakPolarHBondContact O-CG 3.44Å; T671-Q675 PolarHBondContact O-N 2.9Å
672	E	91.3	Very high	91.8	Very high	132 Å²	132	47.9 Å²	47.9	62%	0.617	26%	0.255	S	S	*	.	H	α-helix	trans	-59.7	-41	171.3	-63.1	-168.1	144.9	0	0	111.2	E668 Q675 S676	E668-E672 PolarHBondContact O-N 3.03Å; E668-E672 VanDerWaalsContact O-N 3.1Å; E672-Q675 PolarHBondContact O-N 3.44Å; E672-S676 WeakPolarHBondContact O-CB 3.41Å; E672-S676 PolarHBondContact O-N 3.12Å
673	L	92.1	Very high	91.8	Very high	24 Å²	24	47.2 Å²	47.2	13%	0.126	26%	0.261	C	S	.	.	H	α-helix	trans	-64.1	-45.9	176.5	-155.4	178.4	0	0	0	111.1	L251 K255 L583 M587 A669 A670 T671 Q675 S676 H677	L251-L673 HydrophobicContact CB-CD1 4.43Å; K255-L673 HydrophobicContact CB-CD1 4.32Å; K255-L673 HydrophobicContact CB-CD2 4.01Å; K255-L673 HydrophobicContact CD-CD1 4.1Å; K255-L673 HydrophobicContact CD-CD2 3.73Å; K255-L673 HydrophobicContact CD-CG 3.99Å; K255-L673 HydrophobicContact CG-CD2 3.75Å; L583-L673 HydrophobicContact CD2-CD2 4.45Å; M587-L673 HydrophobicContact CE-CB 3.98Å; M587-L673 HydrophobicContact CE-CD1 3.76Å; M587-L673 HydrophobicContact CE-CD2 3.61Å; M587-L673 HydrophobicContact CE-CG 3.95Å; A669-L673 PolarHBondContact O-N 3.26Å; A670-L673 WeakPolarHBondContact O-CB 3.46Å; A670-L673 PolarHBondContact O-N 2.99Å; T671-L673 VanDerWaalsContact C-N 3.27Å; T671-L673 PolarHBondContact O-N 2.95Å; L673-Q675 PolarHBondContact O-N 3.15Å; L673-S676 PolarHBondContact O-N 3.22Å; L673-S676 PolarHBondContact O-OG 2.87Å; L673-H677 PolarHBondContact O-N 3.44Å
674	L	93.8	Very high	91.6	Very high	6 Å²	6	49 Å²	49	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-61.8	-41.5	175	-70.7	173.2	0	0	0	112.3	Q553 H580 L583 M587 A670 T671 H677 A678	Q553-L674 HydrophobicContact CG-CD1 3.96Å; H580-L674 PolarHBondContact CE1-O 3.13Å; L583-L674 HydrophobicContact CB-CD2 4.3Å; L583-L674 HydrophobicContact CD2-CD2 4.07Å; L583-L674 HydrophobicContact CG-CD2 3.83Å; M587-L674 HydrophobicContact CE-CD2 3.76Å; M587-L674 HydrophobicContact CE-CG 3.92Å; M587-L674 HydrophobicContact SD-CD1 4.06Å; M587-L674 HydrophobicContact SD-CD2 3.82Å; M587-L674 HydrophobicContact SD-CG 3.65Å; A670-L674 PolarHBondContact O-N 3.04Å; T671-L674 PolarHBondContact O-N 3.39Å; L674-H677 PolarHBondContact O-N 3.11Å; L674-A678 WeakPolarHBondContact O-CB 3.49Å; L674-A678 PolarHBondContact O-N 3.36Å
675	Q	91.9	Very high	91.5	Very high	80 Å²	80	44.6 Å²	44.6	37%	0.374	25%	0.249	S	C	.	.	H	α-helix	trans	-63.4	-41.8	174.1	-71.9	175.9	48.3	0	0	111.9	T671 E672 L673 H677 A678 Q679	T671-Q675 WeakPolarHBondContact O-CB 3.27Å; T671-Q675 VanDerWaalsContact O-CG 3.27Å; T671-Q675 WeakPolarHBondContact O-CG 3.44Å; T671-Q675 PolarHBondContact O-N 2.9Å; E672-Q675 PolarHBondContact O-N 3.44Å; L673-Q675 PolarHBondContact O-N 3.15Å; Q675-H677 VanDerWaalsContact C-N 3.3Å; Q675-H677 PolarHBondContact O-N 2.77Å; Q675-A678 WeakPolarHBondContact O-CB 3.39Å; Q675-A678 PolarHBondContact O-N 2.67Å; Q675-Q679 VanDerWaalsContact O-CG 3.31Å; Q675-Q679 WeakPolarHBondContact O-CG 3.23Å; Q675-Q679 PolarHBondContact O-N 3.14Å
676	S	91.3	Very high	91.5	Very high	48 Å²	48	43.2 Å²	43.2	34%	0.336	24%	0.236	S	C	.	.	H	α-helix	trans	-62.8	-37.4	175.4	79	0	0	0	0	112	E672 L673 L680	E672-S676 WeakPolarHBondContact O-CB 3.41Å; E672-S676 PolarHBondContact O-N 3.12Å; L673-S676 PolarHBondContact O-N 3.22Å; L673-S676 PolarHBondContact O-OG 2.87Å; S676-L680 WeakPolarHBondContact O-CB 3.28Å; S676-L680 PolarHBondContact O-N 3Å
677	H	92.7	Very high	91.1	Very high	17 Å²	17	45 Å²	45	8%	0.079	25%	0.251	C	S	.	.	H	α-helix	trans	-69.5	-41.5	174.8	179.6	-115.1	0	0	0	112.2	S258 L583 L673 L674 Q675 Q679 L680 A681	S258-H677 PolarHBondContact OG-CE1 3.23Å; S258-H677 PolarHBondContact OG-NE2 3.24Å; L583-H677 HydrophobicContact CD2-CB 3.66Å; L583-H677 WeakPolarHBondContact CD2-ND1 3.19Å; L673-H677 PolarHBondContact O-N 3.44Å; L674-H677 PolarHBondContact O-N 3.11Å; Q675-H677 VanDerWaalsContact C-N 3.3Å; Q675-H677 PolarHBondContact O-N 2.77Å; H677-Q679 VanDerWaalsContact C-N 3.34Å; H677-Q679 PolarHBondContact O-N 3.27Å; H677-L680 PolarHBondContact O-N 3.42Å; H677-A681 WeakPolarHBondContact O-CB 3.3Å; H677-A681 PolarHBondContact O-N 3.36Å
678	A	92.6	Very high	90.5	Very high	2 Å²	2	46 Å²	46	2%	0.017	26%	0.255	C	S	.	.	H	α-helix	trans	-57	-46.5	173.7	0	0	0	0	0	111.9	I557 M560 L674 Q675 L682	I557-A678 HydrophobicContact CD1-CB 3.73Å; M560-A678 HydrophobicContact CE-CB 4Å; M560-A678 HydrophobicContact SD-CB 4.24Å; L674-A678 WeakPolarHBondContact O-CB 3.49Å; L674-A678 PolarHBondContact O-N 3.36Å; Q675-A678 WeakPolarHBondContact O-CB 3.39Å; Q675-A678 PolarHBondContact O-N 2.67Å; A678-L682 VanDerWaalsContact O-CB 3.26Å; A678-L682 WeakPolarHBondContact O-CB 3.46Å; A678-L682 PolarHBondContact O-N 2.92Å; A678-L682 VanDerWaalsContact O-N 3.11Å
679	Q	91.9	Very high	90.1	Very high	122 Å²	122	40.6 Å²	40.6	57%	0.57	23%	0.233	S	C	*	.	H	α-helix	trans	-64.2	-44.2	177.3	-68.3	171.1	21.8	0	0	112	M560 Q675 H677 G683	M560-Q679 HydrophobicContact CE-CG 4.13Å; Q675-Q679 VanDerWaalsContact O-CG 3.31Å; Q675-Q679 WeakPolarHBondContact O-CG 3.23Å; Q675-Q679 PolarHBondContact O-N 3.14Å; H677-Q679 VanDerWaalsContact C-N 3.34Å; H677-Q679 PolarHBondContact O-N 3.27Å; Q679-G683 PolarHBondContact O-N 3.45Å
680	L	91.1	Very high	89.7	Confident	88 Å²	88	42.4 Å²	42.4	46%	0.461	23%	0.234	S	C	.	.	H	α-helix	trans	-66.6	-46.5	179.8	-174.7	151.1	0	0	0	112.4	E262 S676 H677 L682 G683 N684	E262-L680 HydrophobicContact CG-CD2 4.36Å; S676-L680 WeakPolarHBondContact O-CB 3.28Å; S676-L680 PolarHBondContact O-N 3Å; H677-L680 PolarHBondContact O-N 3.42Å; L680-L682 VanDerWaalsContact C-N 3.33Å; L680-L682 PolarHBondContact O-N 2.93Å; L680-G683 PolarHBondContact O-N 3.31Å; L680-N684 WeakPolarHBondContact O-CB 3.47Å; L680-N684 PolarHBondContact O-N 3.37Å
681	A	90.3	Very high	88.9	Confident	5 Å²	5	47 Å²	47	4%	0.041	26%	0.255	C	S	.	.	H	α-helix	trans	-62.4	-41.1	178.4	0	0	0	0	0	111.8	I576 H677 A685	I576-A681 HydrophobicContact CG2-CB 4.3Å; H677-A681 WeakPolarHBondContact O-CB 3.3Å; H677-A681 PolarHBondContact O-N 3.36Å; A681-A685 WeakPolarHBondContact O-CB 3.48Å; A681-A685 PolarHBondContact O-N 3.28Å
682	L	91.5	Very high	88	Confident	18 Å²	18	50.8 Å²	50.8	9%	0.094	27%	0.27	C	S	.	.	H	α-helix	trans	-65.6	-43.8	174.8	-169.7	71.5	0	0	0	111.9	M560 V561 Q564 L568 I576 A678 L680 A685 L686	M560-L682 HydrophobicContact CB-CD2 4.24Å; M560-L682 HydrophobicContact CE-CD2 3.92Å; V561-L682 HydrophobicContact CG2-CD1 4.27Å; Q564-L682 HydrophobicContact CB-CD1 4.18Å; Q564-L682 HydrophobicContact CG-CD1 4.05Å; Q564-L682 HydrophobicContact CG-CD2 4.01Å; Q564-L682 HydrophobicContact CG-CG 4.26Å; L568-L682 HydrophobicContact CD1-CD1 3.76Å; I576-L682 HydrophobicContact CD1-CD1 4.17Å; A678-L682 VanDerWaalsContact O-CB 3.26Å; A678-L682 WeakPolarHBondContact O-CB 3.46Å; A678-L682 PolarHBondContact O-N 2.92Å; A678-L682 VanDerWaalsContact O-N 3.11Å; L680-L682 VanDerWaalsContact C-N 3.33Å; L680-L682 PolarHBondContact O-N 2.93Å; L682-A685 PolarHBondContact O-N 3.46Å; L682-L686 HydrophobicContact CG-CD1 4.21Å; L682-L686 WeakPolarHBondContact O-CB 3.4Å; L682-L686 VanDerWaalsContact O-CG 3.3Å; L682-L686 WeakPolarHBondContact O-CG 3.49Å; L682-L686 PolarHBondContact O-N 3.02Å
683	G	90.5	Very high	87.1	Confident	35 Å²	35	49.2 Å²	49.2	36%	0.361	26%	0.262	S	S	.	.	H	α-helix	trans	-62.6	-43.1	177.4	0	0	0	0	0	113	Q679 L680 L686 S687	Q679-G683 PolarHBondContact O-N 3.45Å; L680-G683 PolarHBondContact O-N 3.31Å; G683-L686 PolarHBondContact O-N 3.02Å; G683-S687 WeakPolarHBondContact O-CB 3.48Å; G683-S687 PolarHBondContact O-N 3.26Å
684	N	88.3	Confident	86.2	Confident	52 Å²	52	54.5 Å²	54.5	28%	0.278	29%	0.287	S	S	.	.	H	α-helix	trans	-62.1	-46.3	174.1	-80.3	6.2	0	0	0	112	E262 L680 S687 H688	E262-N684 VanDerWaalsContact CG-ND2 3.3Å; E262-N684 WeakPolarHBondContact CG-ND2 3.33Å; E262-N684 WeakPolarHBondContact OE1-CB 3.43Å; E262-N684 PolarHBondContact OE1-ND2 3.26Å; L680-N684 WeakPolarHBondContact O-CB 3.47Å; L680-N684 PolarHBondContact O-N 3.37Å; N684-S687 PolarHBondContact O-N 2.98Å; N684-H688 WeakPolarHBondContact O-CB 3.08Å; N684-H688 PolarHBondContact O-N 3.23Å
685	A	88.8	Confident	84.8	Confident	5 Å²	5	59 Å²	59	4%	0.041	31%	0.308	C	S	.	.	H	α-helix	trans	-64.7	-39.5	178.5	0	0	0	0	0	112.3	L568 M572 I576 A681 L682 H688 A689	L568-A685 HydrophobicContact CD2-CB 3.9Å; M572-A685 HydrophobicContact CG-CB 4.02Å; M572-A685 HydrophobicContact SD-CB 4.13Å; I576-A685 HydrophobicContact CD1-CB 3.47Å; I576-A685 VanDerWaalsContact CD1-CB 3.47Å; I576-A685 HydrophobicContact CG1-CB 4.05Å; A681-A685 WeakPolarHBondContact O-CB 3.48Å; A681-A685 PolarHBondContact O-N 3.28Å; L682-A685 PolarHBondContact O-N 3.46Å; A685-H688 PolarHBondContact O-N 3.08Å; A685-A689 WeakPolarHBondContact O-CB 3.12Å; A685-A689 PolarHBondContact O-N 3.37Å
686	L	88.9	Confident	83	Confident	32 Å²	32	58.1 Å²	58.1	17%	0.168	31%	0.314	C	S	.	.	H	α-helix	trans	-64.9	-44.4	173.7	-76.1	171	0	0	0	111.9	Q564 T567 L568 L682 G683 H688 A689 I690	Q564-L686 HydrophobicContact CB-CD2 4.26Å; Q564-L686 HydrophobicContact CG-CD1 4.13Å; Q564-L686 HydrophobicContact CG-CD2 4.41Å; T567-L686 HydrophobicContact CG2-CD2 3.71Å; L568-L686 HydrophobicContact CD1-CD2 4.48Å; L568-L686 HydrophobicContact CD2-CD2 4.02Å; L568-L686 HydrophobicContact CD2-CG 4.33Å; L568-L686 HydrophobicContact CG-CD2 4.05Å; L682-L686 HydrophobicContact CG-CD1 4.21Å; L682-L686 WeakPolarHBondContact O-CB 3.4Å; L682-L686 VanDerWaalsContact O-CG 3.3Å; L682-L686 WeakPolarHBondContact O-CG 3.49Å; L682-L686 PolarHBondContact O-N 3.02Å; G683-L686 PolarHBondContact O-N 3.02Å; L686-H688 PolarHBondContact O-N 3.12Å; L686-A689 PolarHBondContact O-N 2.89Å; L686-I690 WeakPolarHBondContact O-CB 3.38Å; L686-I690 VanDerWaalsContact O-CG1 3.26Å; L686-I690 WeakPolarHBondContact O-CG1 3.33Å; L686-I690 PolarHBondContact O-N 3.32Å
687	S	85.8	Confident	80.9	Confident	53 Å²	53	60.6 Å²	60.6	37%	0.371	33%	0.327	S	S	.	.	H	α-helix	trans	-58.1	-47.9	174.9	179.8	0	0	0	0	111.2	G683 N684 A689 I690 H691	G683-S687 WeakPolarHBondContact O-CB 3.48Å; G683-S687 PolarHBondContact O-N 3.26Å; N684-S687 PolarHBondContact O-N 2.98Å; S687-A689 PolarHBondContact O-N 2.91Å; S687-I690 PolarHBondContact O-N 3.47Å; S687-H691 PolarHBondContact O-CD2 2.94Å; S687-H691 VanDerWaalsContact O-CD2 3.26Å; S687-H691 PolarHBondContact O-N 3.04Å
688	H	81.4	Confident	78.6	Confident	39 Å²	39	62.7 Å²	62.7	18%	0.181	34%	0.342	C	S	.	.	H	α-helix	trans	-61	-44.1	175.5	-172.3	-75	0	0	0	112.5	N684 A685 L686 I690 H691 H692	N684-H688 WeakPolarHBondContact O-CB 3.08Å; N684-H688 PolarHBondContact O-N 3.23Å; A685-H688 PolarHBondContact O-N 3.08Å; L686-H688 PolarHBondContact O-N 3.12Å; H688-I690 VanDerWaalsContact C-N 3.33Å; H688-I690 PolarHBondContact O-N 3.44Å; H688-H691 PolarHBondContact O-N 3.3Å; H688-H692 WeakPolarHBondContact O-CB 3.34Å; H688-H692 PolarHBondContact O-N 3.26Å
689	A	83	Confident	75.8	Confident	17 Å²	17	68 Å²	68	14%	0.14	37%	0.374	C	S	.	.	H	α-helix	trans	-65.5	-34.5	178.1	0	0	0	0	0	112.7	T567 L568 A685 L686 S687 K693	T567-A689 HydrophobicContact CG2-CB 4.02Å; L568-A689 HydrophobicContact CD2-CB 4.1Å; A685-A689 WeakPolarHBondContact O-CB 3.12Å; A685-A689 PolarHBondContact O-N 3.37Å; L686-A689 PolarHBondContact O-N 2.89Å; S687-A689 PolarHBondContact O-N 2.91Å; A689-K693 WeakPolarHBondContact O-CB 3.38Å; A689-K693 VanDerWaalsContact O-CG 3.29Å; A689-K693 WeakPolarHBondContact O-CG 3.33Å; A689-K693 PolarHBondContact O-N 3.28Å
690	I	81.8	Confident	73.1	Confident	90 Å²	90	68.1 Å²	68.1	46%	0.462	38%	0.375	S	S	.	.	H	α-helix	trans	-70.5	-46.9	174	-69.4	164.6	0	0	0	110.4	L686 S687 H688 H692 K693 M694	L686-I690 WeakPolarHBondContact O-CB 3.38Å; L686-I690 VanDerWaalsContact O-CG1 3.26Å; L686-I690 WeakPolarHBondContact O-CG1 3.33Å; L686-I690 PolarHBondContact O-N 3.32Å; S687-I690 PolarHBondContact O-N 3.47Å; H688-I690 VanDerWaalsContact C-N 3.33Å; H688-I690 PolarHBondContact O-N 3.44Å; I690-H692 PolarHBondContact O-N 3.08Å; I690-K693 CarbonylContact O-C 3.55Å; I690-K693 PolarHBondContact O-N 2.94Å; I690-K693 VanDerWaalsContact O-N 3.12Å; I690-M694 HydrophobicContact CG2-CG 4.43Å; I690-M694 HydrophobicContact CG2-SD 4.07Å; I690-M694 WeakPolarHBondContact O-CG 3.33Å; I690-M694 PolarHBondContact O-N 3.06Å
691	H	76.6	Confident	70.4	Confident	102 Å²	102	68.4 Å²	68.4	47%	0.472	38%	0.384	S	S	.	.	H	α-helix	trans	-57.3	-50.5	174.9	-85	-68.8	0	0	0	111.6	S687 H688 K693 M694 E695	S687-H691 PolarHBondContact O-CD2 2.94Å; S687-H691 VanDerWaalsContact O-CD2 3.26Å; S687-H691 PolarHBondContact O-N 3.04Å; H688-H691 PolarHBondContact O-N 3.3Å; H691-K693 PolarHBondContact O-N 3.19Å; H691-M694 PolarHBondContact O-N 2.93Å; H691-E695 VanDerWaalsContact O-CG 3.3Å; H691-E695 WeakPolarHBondContact O-CG 3.46Å; H691-E695 PolarHBondContact O-N 3.11Å
692	H	72.8	Confident	67.8	Low	99 Å²	99	76.1 Å²	76.1	46%	0.458	42%	0.42	S	S	.	.	H	α-helix	trans	-60.2	-33.6	176.5	-169.5	-63.4	0	0	0	112.1	H688 I690 E695 A696	H688-H692 WeakPolarHBondContact O-CB 3.34Å; H688-H692 PolarHBondContact O-N 3.26Å; I690-H692 PolarHBondContact O-N 3.08Å; H692-E695 PolarHBondContact O-N 3.45Å; H692-A696 WeakPolarHBondContact O-CB 3.48Å; H692-A696 PolarHBondContact O-N 3.47Å
693	K	72.9	Confident	65.1	Low	100 Å²	100	78.8 Å²	78.8	44%	0.435	44%	0.44	S	S	.	.	H	α-helix	trans	-73.1	-33.7	173.3	-76.4	-176.3	-178.9	-165.4	0	113.1	A689 I690 H691 E695 V697	A689-K693 WeakPolarHBondContact O-CB 3.38Å; A689-K693 VanDerWaalsContact O-CG 3.29Å; A689-K693 WeakPolarHBondContact O-CG 3.33Å; A689-K693 PolarHBondContact O-N 3.28Å; I690-K693 CarbonylContact O-C 3.55Å; I690-K693 PolarHBondContact O-N 2.94Å; I690-K693 VanDerWaalsContact O-N 3.12Å; H691-K693 PolarHBondContact O-N 3.19Å; K693-E695 VanDerWaalsContact C-N 3.28Å; K693-E695 PolarHBondContact O-N 3.05Å; K693-V697 WeakPolarHBondContact O-CB 3.37Å; K693-V697 VanDerWaalsContact O-CG2 3.27Å; K693-V697 WeakPolarHBondContact O-CG2 3.41Å; K693-V697 PolarHBondContact O-N 3.2Å
694	M	71.8	Confident	62.5	Low	134 Å²	134	80.1 Å²	80.1	66%	0.66	44%	0.444	S	S	*	.	H	α-helix	trans	-70.5	-25	172.9	-69.9	178.4	67.5	0	0	112.9	I690 H691	I690-M694 HydrophobicContact CG2-CG 4.43Å; I690-M694 HydrophobicContact CG2-SD 4.07Å; I690-M694 WeakPolarHBondContact O-CG 3.33Å; I690-M694 PolarHBondContact O-N 3.06Å; H691-M694 PolarHBondContact O-N 2.93Å
695	E	64.5	Low	60.2	Low	102 Å²	102	79.8 Å²	79.8	48%	0.477	45%	0.446	S	S	.	.	H	α-helix	trans	-92.3	-26.8	178	-64.9	179.2	144.2	0	0	112.8	R272 H691 H692 K693	R272-E695 IonicContact CZ-OE1 3.92Å; R272-E695 IonicContact CZ-OE2 2.72Å; R272-E695 IonicContact NH2-OE1 2.78Å; R272-E695 PolarHBondContact NH2-OE1 2.88Å; R272-E695 IonicContact NH2-OE2 2.63Å; R272-E695 PolarHBondContact NH2-OE2 3.32Å; H691-E695 VanDerWaalsContact O-CG 3.3Å; H691-E695 WeakPolarHBondContact O-CG 3.46Å; H691-E695 PolarHBondContact O-N 3.11Å; H692-E695 PolarHBondContact O-N 3.45Å; K693-E695 VanDerWaalsContact C-N 3.28Å; K693-E695 PolarHBondContact O-N 3.05Å
696	A	55.3	Low	58	Low	61 Å²	61	88 Å²	88	50%	0.504	48%	0.48	S	S	.	.	H	α-helix	trans	-89.2	-16.6	172.3	0	0	0	0	0	113.6	H692 P698	H692-A696 WeakPolarHBondContact O-CB 3.48Å; H692-A696 PolarHBondContact O-N 3.47Å; A696-P698 WeakPolarHBondContact O-CD 3.43Å; A696-P698 VanDerWaalsContact O-N 3.17Å
697	V	47.1	Very low	56.2	Low	100 Å²	100	88 Å²	88	61%	0.606	48%	0.48	S	S	*	.	S	Bend	trans	-57.9	112.7	149.8	162.6	0	0	0	0	105.2	K693 T699	K693-V697 WeakPolarHBondContact O-CB 3.37Å; K693-V697 VanDerWaalsContact O-CG2 3.27Å; K693-V697 WeakPolarHBondContact O-CG2 3.41Å; K693-V697 PolarHBondContact O-N 3.2Å; V697-T699 PolarHBondContact O-N 3.03Å
698	P	42.9	Very low	54.4	Low	61 Å²	61	88.9 Å²	88.9	40%	0.396	48%	0.48	S	S	.	.			trans	-64.9	132.6	-162.5	-25.9	35.7	0	0	0	111.9	A696 Q700 S701	A696-P698 WeakPolarHBondContact O-CD 3.43Å; A696-P698 VanDerWaalsContact O-N 3.17Å; P698-Q700 HydrophobicContact CB-CB 3.46Å; P698-Q700 VanDerWaalsContact CB-CB 3.46Å; P698-Q700 HydrophobicContact CB-CG 3.8Å; P698-Q700 CarbonylContact O-C 3.51Å; P698-Q700 PolarHBondContact O-N 3.46Å; P698-Q700 VanDerWaalsContact O-N 3.1Å; P698-S701 PolarHBondContact O-N 2.97Å
699	T	35.5	Very low	53.3	Low	112 Å²	112	91.9 Å²	91.9	69%	0.687	50%	0.503	S	S	*	.	S	Bend	trans	-65	-2.1	153.8	-24.4	0	0	0	0	111.2	V697 S701 Q702	V697-T699 PolarHBondContact O-N 3.03Å; T699-S701 PolarHBondContact O-N 3.04Å; T699-S701 VanDerWaalsContact O-N 3.09Å; T699-Q702 PolarHBondContact O-N 2.99Å
700	Q	35.5	Very low	52.1	Low	126 Å²	126	94.5 Å²	94.5	59%	0.589	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-68.2	29.1	151.5	-39.6	170.2	-56.6	0	0	113.6	P698 Q702 S703 S704	P698-Q700 HydrophobicContact CB-CB 3.46Å; P698-Q700 VanDerWaalsContact CB-CB 3.46Å; P698-Q700 HydrophobicContact CB-CG 3.8Å; P698-Q700 CarbonylContact O-C 3.51Å; P698-Q700 PolarHBondContact O-N 3.46Å; P698-Q700 VanDerWaalsContact O-N 3.1Å; Q700-Q702 PolarHBondContact O-N 3.42Å; Q700-S703 VanDerWaalsContact C-N 3.29Å; Q700-S703 WeakPolarHBondContact CB-OG 3.46Å; Q700-S703 CarbonylContact O-C 3.57Å; Q700-S703 VanDerWaalsContact O-C 3.29Å; Q700-S703 WeakPolarHBondContact O-CA 3.29Å; Q700-S703 PolarHBondContact O-N 2.79Å; Q700-S704 PolarHBondContact O-N 3.15Å
701	S	34.1	Very low	51.4	Low	93 Å²	93	92.1 Å²	92.1	65%	0.65	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-62.6	1.2	138.1	51	0	0	0	0	112.4	P698 T699	P698-S701 PolarHBondContact O-N 2.97Å; T699-S701 PolarHBondContact O-N 3.04Å; T699-S701 VanDerWaalsContact O-N 3.09Å
702	Q	35.3	Very low	51	Low	167 Å²	167	91.9 Å²	91.9	78%	0.78	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-99.2	9.3	156.1	-59.3	-173	-5.7	0	0	114.2	T699 Q700	T699-Q702 PolarHBondContact O-N 2.99Å; Q700-Q702 PolarHBondContact O-N 3.42Å
703	S	35.3	Very low	50.9	Low	74 Å²	74	93.9 Å²	93.9	52%	0.517	52%	0.515	S	S	.	.			trans	-130.1	34.6	162.9	96	0	0	0	0	112.7	Q700	Q700-S703 VanDerWaalsContact C-N 3.29Å; Q700-S703 WeakPolarHBondContact CB-OG 3.46Å; Q700-S703 CarbonylContact O-C 3.57Å; Q700-S703 VanDerWaalsContact O-C 3.29Å; Q700-S703 WeakPolarHBondContact O-CA 3.29Å; Q700-S703 PolarHBondContact O-N 2.79Å
704	S	36.1	Very low	50.8	Low	64 Å²	64	93.6 Å²	93.6	45%	0.448	52%	0.515	S	S	.	.	S	Bend		-51.8	147.3	126.5	51.4	0	0	0	0	107.6	Q700 K706	Q700-S704 PolarHBondContact O-N 3.15Å; S704-K706 PolarHBondContact O-N 3.37Å
705	S	39.4	Very low	50.9	Low	45 Å²	45	87.7 Å²	87.7	32%	0.315	49%	0.486	S	S	.	.			trans	-46.5	138.5	175.1	39.9	0	0	0	0	110.1	H707 E838	S705-H707 PolarHBondContact O-N 3.21Å; S705-H707 PolarHBondContact OG-CD2 3.27Å; S705-H707 VanDerWaalsContact OG-CD2 3.26Å; S705-H707 PolarHBondContact OG-NE2 3.3Å; S705-E838 WeakPolarHBondContact CB-OE1 3.42Å; S705-E838 PolarHBondContact OG-OE1 2.78Å
706	K	42.1	Very low	51.5	Low	177 Å²	177	86.9 Å²	86.9	77%	0.77	49%	0.488	S	S	*	.			trans	-72.3	58	172.7	-79.2	-168.2	178.4	-176.9	0	110.5	S704 D708	S704-K706 PolarHBondContact O-N 3.37Å; K706-D708 PolarHBondContact O-N 3.24Å
707	H	50.8	Low	52.4	Low	33 Å²	33	89.4 Å²	89.4	15%	0.153	49%	0.489	C	S	.	.			trans	-64.9	71.5	139.9	-57.4	-38.8	0	0	0	107.3	S705 L711 K712	S705-H707 PolarHBondContact O-N 3.21Å; S705-H707 PolarHBondContact OG-CD2 3.27Å; S705-H707 VanDerWaalsContact OG-CD2 3.26Å; S705-H707 PolarHBondContact OG-NE2 3.3Å; H707-L711 HydrophobicContact CB-CD2 4.05Å; H707-L711 WeakPolarHBondContact ND1-CD2 3.46Å; H707-K712 HydrophobicContact CB-CD 4.48Å; H707-K712 HydrophobicContact CB-CG 4.06Å
708	D	48.9	Very low	53.6	Low	70 Å²	70	85.4 Å²	85.4	37%	0.374	47%	0.467	S	S	.	.			trans	-45.6	147.5	177.5	-164.8	64.6	0	0	0	109	K706 S710 L711 K712	K706-D708 PolarHBondContact O-N 3.24Å; D708-S710 CarbonylContact O-C 3.58Å; D708-S710 PolarHBondContact O-N 2.99Å; D708-S710 VanDerWaalsContact OD2-CB 3.26Å; D708-S710 WeakPolarHBondContact OD2-CB 3.46Å; D708-S710 PolarHBondContact OD2-N 2.92Å; D708-S710 PolarHBondContact OD2-OG 2.74Å; D708-L711 HydrophobicContact CB-CB 4.34Å; D708-L711 WeakPolarHBondContact O-CA 3.26Å; D708-L711 WeakPolarHBondContact O-CB 3.34Å; D708-L711 PolarHBondContact O-N 2.65Å; D708-K712 PolarHBondContact O-N 3.23Å
709	P	57.1	Low	55	Low	102 Å²	102	83.3 Å²	83.3	66%	0.662	46%	0.455	S	S	*	.	H	α-helix	trans	-54.7	-27.4	175.7	20.5	-32.4	0	0	0	111.8	H713	P709-H713 WeakPolarHBondContact O-CB 3.41Å; P709-H713 PolarHBondContact O-N 2.92Å
710	S	59.1	Low	56.8	Low	73 Å²	73	82.1 Å²	82.1	51%	0.51	46%	0.457	S	S	.	.	H	α-helix	trans	-65.2	-42.6	168.1	72.4	0	0	0	0	113.5	D708 H713 H714	D708-S710 CarbonylContact O-C 3.58Å; D708-S710 PolarHBondContact O-N 2.99Å; D708-S710 VanDerWaalsContact OD2-CB 3.26Å; D708-S710 WeakPolarHBondContact OD2-CB 3.46Å; D708-S710 PolarHBondContact OD2-N 2.92Å; D708-S710 PolarHBondContact OD2-OG 2.74Å; S710-H713 PolarHBondContact O-N 2.94Å; S710-H714 WeakPolarHBondContact O-CB 3.23Å; S710-H714 PolarHBondContact O-N 3.34Å
711	L	66	Low	58.5	Low	40 Å²	40	83.4 Å²	83.4	21%	0.209	46%	0.462	C	S	.	.	H	α-helix	trans	-67.3	-44.1	176.7	-167.1	84.7	0	0	0	111.5	H707 D708 H713 H714 L715	H707-L711 HydrophobicContact CB-CD2 4.05Å; H707-L711 WeakPolarHBondContact ND1-CD2 3.46Å; D708-L711 HydrophobicContact CB-CB 4.34Å; D708-L711 WeakPolarHBondContact O-CA 3.26Å; D708-L711 WeakPolarHBondContact O-CB 3.34Å; D708-L711 PolarHBondContact O-N 2.65Å; L711-H713 VanDerWaalsContact C-N 3.3Å; L711-H713 PolarHBondContact O-N 2.91Å; L711-H714 PolarHBondContact O-N 3.02Å; L711-L715 WeakPolarHBondContact O-CB 3.41Å; L711-L715 PolarHBondContact O-N 3.34Å
712	K	68.8	Low	60.3	Low	96 Å²	96	79.9 Å²	79.9	42%	0.417	44%	0.438	S	S	.	.	H	α-helix	trans	-64.2	-36.2	175.7	-73.7	-165.3	172.8	-173	0	111.2	H707 D708 T716 E837	H707-K712 HydrophobicContact CB-CD 4.48Å; H707-K712 HydrophobicContact CB-CG 4.06Å; D708-K712 PolarHBondContact O-N 3.23Å; K712-T716 WeakPolarHBondContact O-CG2 3.4Å; K712-T716 PolarHBondContact O-N 3.46Å; K712-T716 PolarHBondContact O-OG1 2.92Å; K712-E837 IonicContact NZ-OE1 2.67Å; K712-E837 PolarHBondContact NZ-OE1 3.33Å
713	H	70.1	Confident	61.8	Low	141 Å²	141	78.4 Å²	78.4	65%	0.653	44%	0.44	S	S	*	.	H	α-helix	trans	-66.1	-48.8	170.7	-115.7	-26.3	0	0	0	112.5	P709 S710 L711 L715 T716 E717	P709-H713 WeakPolarHBondContact O-CB 3.41Å; P709-H713 PolarHBondContact O-N 2.92Å; S710-H713 PolarHBondContact O-N 2.94Å; L711-H713 VanDerWaalsContact C-N 3.3Å; L711-H713 PolarHBondContact O-N 2.91Å; H713-L715 VanDerWaalsContact C-N 3.28Å; H713-L715 PolarHBondContact O-N 3.5Å; H713-T716 WeakPolarHBondContact CA-OG1 3.24Å; H713-T716 CarbonylContact O-C 3.57Å; H713-T716 WeakPolarHBondContact O-CA 3.31Å; H713-T716 PolarHBondContact O-N 3.4Å; H713-T716 PolarHBondContact O-OG1 3.5Å; H713-E717 WeakPolarHBondContact O-CB 3.1Å; H713-E717 PolarHBondContact O-N 3.36Å
714	H	71.2	Confident	63.3	Low	94 Å²	94	81.4 Å²	81.4	44%	0.435	44%	0.441	S	S	.	.	H	α-helix	trans	-60.6	-36.9	-179.4	-177	54.5	0	0	0	112	S710 L711 E717 A718	S710-H714 WeakPolarHBondContact O-CB 3.23Å; S710-H714 PolarHBondContact O-N 3.34Å; L711-H714 PolarHBondContact O-N 3.02Å; H714-E717 PolarHBondContact O-N 3.34Å; H714-A718 WeakPolarHBondContact O-CB 3.41Å; H714-A718 PolarHBondContact O-N 2.95Å
715	L	74.4	Confident	65.1	Low	11 Å²	11	79.8 Å²	79.8	6%	0.058	43%	0.427	C	S	.	.	H	α-helix	trans	-65.2	-41.9	171.3	-126	83.2	0	0	0	111.8	L711 H713 A719 I841 L844 A845 V850	L711-L715 WeakPolarHBondContact O-CB 3.41Å; L711-L715 PolarHBondContact O-N 3.34Å; H713-L715 VanDerWaalsContact C-N 3.28Å; H713-L715 PolarHBondContact O-N 3.5Å; L715-A719 WeakPolarHBondContact O-CB 3.35Å; L715-A719 PolarHBondContact O-N 3.49Å; L715-I841 HydrophobicContact CD2-CG2 4.22Å; L715-L844 HydrophobicContact CD2-CB 4.39Å; L715-L844 HydrophobicContact CD2-CD2 4.14Å; L715-L844 HydrophobicContact CD2-CG 4.16Å; L715-A845 HydrophobicContact CD1-CB 3.99Å; L715-A845 HydrophobicContact CD2-CB 4.22Å; L715-A845 HydrophobicContact CG-CB 4.43Å; L715-V850 HydrophobicContact CD1-CG1 4.27Å
716	T	75.8	Confident	66.9	Low	84 Å²	84	81.4 Å²	81.4	52%	0.515	44%	0.435	S	S	.	.	H	α-helix	trans	-68.4	-34	176.7	55.3	0	0	0	0	113.3	K712 H713 A720	K712-T716 WeakPolarHBondContact O-CG2 3.4Å; K712-T716 PolarHBondContact O-N 3.46Å; K712-T716 PolarHBondContact O-OG1 2.92Å; H713-T716 WeakPolarHBondContact CA-OG1 3.24Å; H713-T716 CarbonylContact O-C 3.57Å; H713-T716 WeakPolarHBondContact O-CA 3.31Å; H713-T716 PolarHBondContact O-N 3.4Å; H713-T716 PolarHBondContact O-OG1 3.5Å; T716-A720 WeakPolarHBondContact O-CB 3.39Å; T716-A720 PolarHBondContact O-N 2.85Å; T716-A720 VanDerWaalsContact O-N 3.07Å
717	E	75.1	Confident	68.5	Low	114 Å²	114	80.5 Å²	80.5	53%	0.533	43%	0.431	S	S	.	.	H	α-helix	trans	-70.9	-54.9	177.3	-172.6	170.6	-130	0	0	110.1	H713 H714 A719 A720 E721	H713-E717 WeakPolarHBondContact O-CB 3.1Å; H713-E717 PolarHBondContact O-N 3.36Å; H714-E717 PolarHBondContact O-N 3.34Å; E717-A719 VanDerWaalsContact C-N 3.29Å; E717-A719 PolarHBondContact O-N 3.28Å; E717-A720 WeakPolarHBondContact O-CA 3.49Å; E717-A720 WeakPolarHBondContact O-CB 3.34Å; E717-A720 PolarHBondContact O-N 3.38Å; E717-E721 WeakPolarHBondContact O-CG 3.4Å; E717-E721 PolarHBondContact O-N 2.98Å
718	A	71.9	Confident	69.8	Low	17 Å²	17	83.6 Å²	83.6	14%	0.14	45%	0.449	C	S	.	.	H	α-helix	trans	-63.4	-31	176.1	0	0	0	0	0	113.2	H714 S722 V850	H714-A718 WeakPolarHBondContact O-CB 3.41Å; H714-A718 PolarHBondContact O-N 2.95Å; A718-S722 WeakPolarHBondContact O-CA 3.31Å; A718-S722 WeakPolarHBondContact O-CB 3.37Å; A718-S722 PolarHBondContact O-N 3.02Å; A718-V850 HydrophobicContact CB-CG2 3.54Å
719	A	73	Confident	71.2	Confident	16 Å²	16	81.9 Å²	81.9	13%	0.132	44%	0.442	C	S	.	.	H	α-helix	trans	-70	-33.1	171.4	0	0	0	0	0	112.6	L715 E717 L725	L715-A719 WeakPolarHBondContact O-CB 3.35Å; L715-A719 PolarHBondContact O-N 3.49Å; E717-A719 VanDerWaalsContact C-N 3.29Å; E717-A719 PolarHBondContact O-N 3.28Å; A719-L725 HydrophobicContact CB-CD1 3.9Å
720	A	72.5	Confident	72.3	Confident	88 Å²	88	80.1 Å²	80.1	73%	0.727	43%	0.427	S	S	*	.	H	α-helix	trans	-75.2	-30.9	174.8	0	0	0	0	0	112.7	T716 E717	T716-A720 WeakPolarHBondContact O-CB 3.39Å; T716-A720 PolarHBondContact O-N 2.85Å; T716-A720 VanDerWaalsContact O-N 3.07Å; E717-A720 WeakPolarHBondContact O-CA 3.49Å; E717-A720 WeakPolarHBondContact O-CB 3.34Å; E717-A720 PolarHBondContact O-N 3.38Å
721	E	70.9	Confident	73.4	Confident	152 Å²	152	83.6 Å²	83.6	71%	0.71	43%	0.429	S	S	*	.	H	α-helix	trans	-87.8	-16.6	176.7	-65	-170.4	154.2	0	0	113.8	E717 V723	E717-E721 WeakPolarHBondContact O-CG 3.4Å; E717-E721 PolarHBondContact O-N 2.98Å; E721-V723 PolarHBondContact O-N 3.13Å; E721-V723 VanDerWaalsContact O-N 3.11Å
722	S	72.8	Confident	74.2	Confident	19 Å²	19	84 Å²	84	13%	0.133	44%	0.438	C	S	.	.			trans	-69.8	109.4	-176.3	178.7	0	0	0	0	112.7	A718 Y724 L725	A718-S722 WeakPolarHBondContact O-CA 3.31Å; A718-S722 WeakPolarHBondContact O-CB 3.37Å; A718-S722 PolarHBondContact O-N 3.02Å; S722-Y724 PolarHBondContact O-N 2.98Å; S722-Y724 PolarHBondContact OG-N 3.3Å; S722-L725 PolarHBondContact O-N 3.09Å; S722-L725 PolarHBondContact OG-N 3.02Å
723	V	66.8	Low	74.9	Confident	137 Å²	137	80.1 Å²	80.1	83%	0.83	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-18.4	169.4	-175	0	0	0	0	112.7	E721	E721-V723 PolarHBondContact O-N 3.13Å; E721-V723 VanDerWaalsContact O-N 3.11Å
724	Y	65.8	Low	75.6	Confident	137 Å²	137	75.8 Å²	75.8	54%	0.537	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-15.2	178.6	-57.4	-79.5	0	0	0	113.5	S722 T726 R849	S722-Y724 PolarHBondContact O-N 2.98Å; S722-Y724 PolarHBondContact OG-N 3.3Å; Y724-T726 PolarHBondContact O-N 3.47Å; Y724-R849 PolarHBondContact OH-NH1 3.04Å
725	L	75.4	Confident	76.3	Confident	30 Å²	30	77.3 Å²	77.3	16%	0.157	41%	0.412	C	S	.	.			trans	-87.4	86.8	-178.4	-166.4	133.8	0	0	0	110.6	A719 S722 L730 L844 V847	A719-L725 HydrophobicContact CB-CD1 3.9Å; S722-L725 PolarHBondContact O-N 3.09Å; S722-L725 PolarHBondContact OG-N 3.02Å; L725-L730 HydrophobicContact CD2-CB 3.95Å; L725-L730 HydrophobicContact CD2-CD1 4.37Å; L725-L730 HydrophobicContact CD2-CD2 4.05Å; L725-L730 HydrophobicContact CD2-CG 4.34Å; L725-L844 HydrophobicContact CD1-CD1 3.78Å; L725-V847 HydrophobicContact CB-CG1 4.44Å; L725-V847 HydrophobicContact CD1-CG1 4.07Å; L725-V847 HydrophobicContact CG-CG1 4.26Å
726	T	76	Confident	76.8	Confident	78 Å²	78	80.6 Å²	80.6	48%	0.479	43%	0.429	S	S	.	.			trans	-72.2	155.1	178	75.7	0	0	0	0	112.1	Y724 D728 S729 L730	Y724-T726 PolarHBondContact O-N 3.47Å; T726-D728 PolarHBondContact O-N 3.33Å; T726-S729 PolarHBondContact N-OG 3.09Å; T726-S729 PolarHBondContact O-N 2.95Å; T726-S729 PolarHBondContact O-OG 3.42Å; T726-S729 WeakPolarHBondContact OG1-CB 3.44Å; T726-S729 PolarHBondContact OG1-N 2.93Å; T726-S729 PolarHBondContact OG1-OG 2.93Å; T726-L730 PolarHBondContact O-N 3.11Å
727	K	76.5	Confident	77.3	Confident	158 Å²	158	79.1 Å²	79.1	69%	0.687	41%	0.414	S	S	*	.	H	α-helix	trans	-55.8	-34.8	174.7	-175.9	173.5	-177.1	172.8	0	112.8	R731	K727-R731 WeakPolarHBondContact O-CB 3.19Å; K727-R731 PolarHBondContact O-N 2.9Å
728	D	77.9	Confident	77.8	Confident	98 Å²	98	80.2 Å²	80.2	52%	0.524	42%	0.415	S	S	.	.	H	α-helix	trans	-85.6	-31.5	-177.3	-67.1	-58.3	0	0	0	112.9	T726 R731 A732	T726-D728 PolarHBondContact O-N 3.33Å; D728-R731 PolarHBondContact O-N 3.37Å; D728-R731 IonicContact OD1-CZ 3.73Å; D728-R731 IonicContact OD1-NH1 3.39Å; D728-R731 PolarHBondContact OD1-NH1 3.28Å; D728-A732 WeakPolarHBondContact O-CB 3.34Å; D728-A732 PolarHBondContact O-N 3.38Å
729	S	78.1	Confident	78.4	Confident	34 Å²	34	81.3 Å²	81.3	24%	0.238	42%	0.421	C	S	.	.	H	α-helix	trans	-68.4	-39.9	169	55.3	0	0	0	0	112.2	T726 A732 L733	T726-S729 PolarHBondContact N-OG 3.09Å; T726-S729 PolarHBondContact O-N 2.95Å; T726-S729 PolarHBondContact O-OG 3.42Å; T726-S729 WeakPolarHBondContact OG1-CB 3.44Å; T726-S729 PolarHBondContact OG1-N 2.93Å; T726-S729 PolarHBondContact OG1-OG 2.93Å; S729-A732 PolarHBondContact O-N 2.86Å; S729-L733 PolarHBondContact O-N 3.46Å
730	L	80.6	Confident	79	Confident	66 Å²	66	83.6 Å²	83.6	35%	0.346	43%	0.431	S	S	.	.	H	α-helix	trans	-63.9	-43.2	172.5	-179.5	63.3	0	0	0	111.5	L725 T726 A732 L733 V734 L844	L725-L730 HydrophobicContact CD2-CB 3.95Å; L725-L730 HydrophobicContact CD2-CD1 4.37Å; L725-L730 HydrophobicContact CD2-CD2 4.05Å; L725-L730 HydrophobicContact CD2-CG 4.34Å; T726-L730 PolarHBondContact O-N 3.11Å; L730-A732 VanDerWaalsContact C-N 3.29Å; L730-A732 PolarHBondContact O-N 3.2Å; L730-L733 PolarHBondContact O-N 2.84Å; L730-V734 HydrophobicContact CD1-CG2 4.28Å; L730-V734 WeakPolarHBondContact O-CB 3.23Å; L730-V734 VanDerWaalsContact O-CG2 3.31Å; L730-V734 WeakPolarHBondContact O-CG2 3.3Å; L730-V734 PolarHBondContact O-N 3.46Å; L730-L844 HydrophobicContact CD1-CD1 4.13Å
731	R	82.1	Confident	79.6	Confident	145 Å²	145	81.5 Å²	81.5	55%	0.547	41%	0.407	S	S	.	.	H	α-helix	trans	-60.5	-37.8	174.5	175	-175.1	-79.1	158	-18.1	111.9	K727 D728 H735	K727-R731 WeakPolarHBondContact O-CB 3.19Å; K727-R731 PolarHBondContact O-N 2.9Å; D728-R731 PolarHBondContact O-N 3.37Å; D728-R731 IonicContact OD1-CZ 3.73Å; D728-R731 IonicContact OD1-NH1 3.39Å; D728-R731 PolarHBondContact OD1-NH1 3.28Å; R731-H735 VanDerWaalsContact O-CB 3.26Å; R731-H735 WeakPolarHBondContact O-CB 3.45Å; R731-H735 PolarHBondContact O-N 2.91Å
732	A	83.1	Confident	80.3	Confident	48 Å²	48	81.5 Å²	81.5	40%	0.397	40%	0.401	S	S	.	.	H	α-helix	trans	-64.7	-51.5	175.6	0	0	0	0	0	111.4	D728 S729 L730 V734 H735 I736	D728-A732 WeakPolarHBondContact O-CB 3.34Å; D728-A732 PolarHBondContact O-N 3.38Å; S729-A732 PolarHBondContact O-N 2.86Å; L730-A732 VanDerWaalsContact C-N 3.29Å; L730-A732 PolarHBondContact O-N 3.2Å; A732-V734 VanDerWaalsContact C-N 3.32Å; A732-V734 PolarHBondContact O-N 3.07Å; A732-H735 PolarHBondContact O-N 2.9Å; A732-I736 WeakPolarHBondContact O-CG1 3.44Å; A732-I736 PolarHBondContact O-N 3.34Å
733	L	83.2	Confident	80.9	Confident	16 Å²	16	84.4 Å²	84.4	8%	0.084	42%	0.415	C	S	.	.	H	α-helix	trans	-54.9	-47.3	176.9	-123.3	88.1	0	0	0	112.2	S729 L730 H735 I736 Y737 F840 E843 L844 V847	S729-L733 PolarHBondContact O-N 3.46Å; L730-L733 PolarHBondContact O-N 2.84Å; L733-H735 VanDerWaalsContact C-N 3.32Å; L733-H735 PolarHBondContact O-N 3.49Å; L733-I736 PolarHBondContact O-N 2.81Å; L733-Y737 PolarHBondContact O-N 3.49Å; L733-F840 HydrophobicContact CB-CE2 4.24Å; L733-F840 HydrophobicContact CD2-CD2 4.09Å; L733-F840 HydrophobicContact CD2-CE2 4.02Å; L733-F840 HydrophobicContact CG-CE2 4.5Å; L733-E843 HydrophobicContact CD1-CB 4.17Å; L733-E843 HydrophobicContact CD2-CB 3.97Å; L733-E843 HydrophobicContact CG-CB 4.29Å; L733-L844 HydrophobicContact CD2-CB 3.73Å; L733-L844 HydrophobicContact CD2-CD1 4.29Å; L733-V847 HydrophobicContact CD1-CG2 4.23Å
734	V	83.6	Confident	81.8	Confident	50 Å²	50	79.1 Å²	79.1	30%	0.303	38%	0.382	S	S	.	.	H	α-helix	trans	-65.5	-35.2	178.5	170.4	0	0	0	0	111.4	L730 A732 Y738 F840	L730-V734 HydrophobicContact CD1-CG2 4.28Å; L730-V734 WeakPolarHBondContact O-CB 3.23Å; L730-V734 VanDerWaalsContact O-CG2 3.31Å; L730-V734 WeakPolarHBondContact O-CG2 3.3Å; L730-V734 PolarHBondContact O-N 3.46Å; A732-V734 VanDerWaalsContact C-N 3.32Å; A732-V734 PolarHBondContact O-N 3.07Å; V734-Y738 HydrophobicContact CG1-CD2 3.62Å; V734-Y738 HydrophobicContact CG1-CE2 3.69Å; V734-Y738 WeakPolarHBondContact O-CB 3.28Å; V734-Y738 WeakPolarHBondContact O-CD2 3.49Å; V734-Y738 PolarHBondContact O-N 3.36Å; V734-F840 HydrophobicContact CG2-CE2 4.16Å; V734-F840 HydrophobicContact CG2-CZ 4.29Å
735	H	86.5	Confident	82.5	Confident	125 Å²	125	75.3 Å²	75.3	58%	0.579	38%	0.375	S	S	*	.	H	α-helix	trans	-71.8	-35.3	175.2	-170.6	-59.1	0	0	0	112.6	R731 A732 L733 S739	R731-H735 VanDerWaalsContact O-CB 3.26Å; R731-H735 WeakPolarHBondContact O-CB 3.45Å; R731-H735 PolarHBondContact O-N 2.91Å; A732-H735 PolarHBondContact O-N 2.9Å; L733-H735 VanDerWaalsContact C-N 3.32Å; L733-H735 PolarHBondContact O-N 3.49Å; H735-S739 PolarHBondContact O-N 2.92Å
736	I	86.3	Confident	82.6	Confident	81 Å²	81	76.6 Å²	76.6	42%	0.415	39%	0.387	S	S	.	.	H	α-helix	trans	-62.1	-56.3	174.5	-69.6	162.5	0	0	0	108.8	A732 L733 Y738 S739 D740	A732-I736 WeakPolarHBondContact O-CG1 3.44Å; A732-I736 PolarHBondContact O-N 3.34Å; L733-I736 PolarHBondContact O-N 2.81Å; I736-Y738 VanDerWaalsContact C-N 3.34Å; I736-Y738 PolarHBondContact O-N 2.89Å; I736-S739 CarbonylContact O-C 3.5Å; I736-S739 VanDerWaalsContact O-CA 3.3Å; I736-S739 WeakPolarHBondContact O-CA 3.29Å; I736-S739 WeakPolarHBondContact O-CB 3.43Å; I736-S739 PolarHBondContact O-N 2.81Å; I736-D740 WeakPolarHBondContact CG2-OD2 3.33Å; I736-D740 VanDerWaalsContact O-CG 3.28Å; I736-D740 PolarHBondContact O-N 2.98Å
737	Y	85.5	Confident	82.7	Confident	52 Å²	52	77.2 Å²	77.2	20%	0.204	39%	0.387	C	S	.	.	H	α-helix	trans	-56.5	-40.9	177.6	-179.1	-112.2	0	0	0	113.6	L733 S739 D740 L741 A836 F840	L733-Y737 PolarHBondContact O-N 3.49Å; Y737-S739 VanDerWaalsContact C-N 3.27Å; Y737-S739 PolarHBondContact O-N 2.99Å; Y737-D740 PolarHBondContact O-N 2.79Å; Y737-L741 HydrophobicContact CD1-CD1 3.98Å; Y737-L741 HydrophobicContact CE1-CD1 3.54Å; Y737-L741 HydrophobicContact CE1-CG 4.35Å; Y737-L741 HydrophobicContact CE2-CD1 4.28Å; Y737-L741 HydrophobicContact CE2-CD2 4.42Å; Y737-L741 HydrophobicContact CE2-CG 4.24Å; Y737-L741 WeakPolarHBondContact O-CB 3.39Å; Y737-L741 VanDerWaalsContact O-CG 3.29Å; Y737-L741 WeakPolarHBondContact O-CG 3.45Å; Y737-L741 PolarHBondContact O-N 2.89Å; Y737-A836 HydrophobicContact CD2-CB 4.46Å; Y737-A836 HydrophobicContact CE2-CB 4.24Å; Y737-F840 HydrophobicContact CD2-CB 3.84Å; Y737-F840 HydrophobicContact CD2-CD2 4.42Å; Y737-F840 HydrophobicContact CD2-CG 4.2Å; Y737-F840 HydrophobicContact CE2-CB 4.31Å; Y737-F840 HydrophobicContact CG-CB 4.28Å; Y737-F840 AromaticContact CG-CD2 4Å; Y737-F840 HydrophobicContact CG-CD2 4Å; Y737-F840 HydrophobicContact CG-CG 4.16Å
738	Y	84.4	Confident	82.5	Confident	138 Å²	138	72.9 Å²	72.9	54%	0.541	37%	0.371	S	S	.	.	H	α-helix	trans	-75.3	-8.3	173.3	-81.2	-58.1	0	0	0	114.9	V734 I736 L741 R742	V734-Y738 HydrophobicContact CG1-CD2 3.62Å; V734-Y738 HydrophobicContact CG1-CE2 3.69Å; V734-Y738 WeakPolarHBondContact O-CB 3.28Å; V734-Y738 WeakPolarHBondContact O-CD2 3.49Å; V734-Y738 PolarHBondContact O-N 3.36Å; I736-Y738 VanDerWaalsContact C-N 3.34Å; I736-Y738 PolarHBondContact O-N 2.89Å; Y738-L741 HydrophobicContact CD1-CD1 4.21Å; Y738-L741 HydrophobicContact CE1-CD1 4.46Å; Y738-R742 WeakPolarHBondContact O-CB 3.32Å
739	S	86.5	Confident	82	Confident	39 Å²	39	74.5 Å²	74.5	27%	0.273	38%	0.376	S	S	.	.	H	α-helix	trans	-84.5	-49.5	164.4	-157	0	0	0	0	110	H735 I736 Y737 L741 R742 D743	H735-S739 PolarHBondContact O-N 2.92Å; I736-S739 CarbonylContact O-C 3.5Å; I736-S739 VanDerWaalsContact O-CA 3.3Å; I736-S739 WeakPolarHBondContact O-CA 3.29Å; I736-S739 WeakPolarHBondContact O-CB 3.43Å; I736-S739 PolarHBondContact O-N 2.81Å; Y737-S739 VanDerWaalsContact C-N 3.27Å; Y737-S739 PolarHBondContact O-N 2.99Å; S739-L741 VanDerWaalsContact C-N 3.34Å; S739-L741 PolarHBondContact O-N 3.45Å; S739-R742 CarbonylContact O-C 3.42Å; S739-R742 WeakPolarHBondContact O-CA 3.46Å; S739-R742 VanDerWaalsContact O-CB 3.25Å; S739-R742 WeakPolarHBondContact O-CB 3.39Å; S739-R742 PolarHBondContact O-N 2.91Å; S739-D743 PolarHBondContact O-N 2.89Å; S739-D743 PolarHBondContact OG-OD2 2.9Å
740	D	85.3	Confident	81.5	Confident	64 Å²	64	77.8 Å²	77.8	34%	0.342	39%	0.39	S	S	.	.	H	α-helix	trans	-57.8	-46.4	-179.2	-53	-37.4	0	0	0	111.2	I736 Y737 R742 D743 I744	I736-D740 WeakPolarHBondContact CG2-OD2 3.33Å; I736-D740 VanDerWaalsContact O-CG 3.28Å; I736-D740 PolarHBondContact O-N 2.98Å; Y737-D740 PolarHBondContact O-N 2.79Å; D740-R742 PolarHBondContact O-N 3.04Å; D740-D743 PolarHBondContact O-N 3.11Å; D740-I744 WeakPolarHBondContact O-CB 3.49Å; D740-I744 VanDerWaalsContact O-CG1 3.23Å; D740-I744 WeakPolarHBondContact O-CG1 3.3Å; D740-I744 PolarHBondContact O-N 3.27Å
741	L	85.4	Confident	80.8	Confident	44 Å²	44	77.3 Å²	77.3	23%	0.23	39%	0.388	C	S	.	.	H	α-helix	trans	-59.2	-31.5	172.5	-71.8	179.4	0	0	0	113.4	Y737 Y738 S739 S745 L833	Y737-L741 HydrophobicContact CD1-CD1 3.98Å; Y737-L741 HydrophobicContact CE1-CD1 3.54Å; Y737-L741 HydrophobicContact CE1-CG 4.35Å; Y737-L741 HydrophobicContact CE2-CD1 4.28Å; Y737-L741 HydrophobicContact CE2-CD2 4.42Å; Y737-L741 HydrophobicContact CE2-CG 4.24Å; Y737-L741 WeakPolarHBondContact O-CB 3.39Å; Y737-L741 VanDerWaalsContact O-CG 3.29Å; Y737-L741 WeakPolarHBondContact O-CG 3.45Å; Y737-L741 PolarHBondContact O-N 2.89Å; Y738-L741 HydrophobicContact CD1-CD1 4.21Å; Y738-L741 HydrophobicContact CE1-CD1 4.46Å; S739-L741 VanDerWaalsContact C-N 3.34Å; S739-L741 PolarHBondContact O-N 3.45Å; L741-S745 WeakPolarHBondContact O-CB 3.45Å; L741-S745 PolarHBondContact O-N 3.22Å; L741-S745 VanDerWaalsContact O-N 3.1Å; L741-L833 HydrophobicContact CD2-CD1 3.42Å; L741-L833 VanDerWaalsContact CD2-CD1 3.42Å
742	R	85.3	Confident	79.8	Confident	152 Å²	152	75.3 Å²	75.3	57%	0.574	39%	0.385	S	S	*	.	H	α-helix	trans	-78.1	-36.1	178.6	-171.5	-177.4	-52.9	172.4	10.1	111.6	Y738 S739 D740 S745 S746	Y738-R742 WeakPolarHBondContact O-CB 3.32Å; S739-R742 CarbonylContact O-C 3.42Å; S739-R742 WeakPolarHBondContact O-CA 3.46Å; S739-R742 VanDerWaalsContact O-CB 3.25Å; S739-R742 WeakPolarHBondContact O-CB 3.39Å; S739-R742 PolarHBondContact O-N 2.91Å; D740-R742 PolarHBondContact O-N 3.04Å; R742-S745 PolarHBondContact O-N 3.37Å; R742-S746 WeakPolarHBondContact O-CB 3.2Å; R742-S746 PolarHBondContact O-N 3.31Å; R742-S746 PolarHBondContact O-OG 3.42Å
743	D	84.6	Confident	78.7	Confident	80 Å²	80	76 Å²	76	43%	0.428	39%	0.387	S	S	.	.	H	α-helix	trans	-74.9	-40.7	179.4	-63.9	-32.9	0	0	0	110.2	S739 D740 S745 S746 N747	S739-D743 PolarHBondContact O-N 2.89Å; S739-D743 PolarHBondContact OG-OD2 2.9Å; D740-D743 PolarHBondContact O-N 3.11Å; D743-S745 VanDerWaalsContact C-N 3.34Å; D743-S745 PolarHBondContact O-N 2.89Å; D743-S746 PolarHBondContact O-N 3.26Å; D743-N747 VanDerWaalsContact O-CG 3.25Å; D743-N747 PolarHBondContact O-N 3.24Å; D743-N747 PolarHBondContact O-ND2 3.11Å; D743-N747 VanDerWaalsContact O-ND2 3.08Å
744	I	85.1	Confident	77.7	Confident	26 Å²	26	80.2 Å²	80.2	13%	0.133	41%	0.409	C	S	.	.	H	α-helix	trans	-55.4	-47.6	166.5	-67.1	165.4	0	0	0	110.8	D740 S746 N747 L748 I829 Q832 A836	D740-I744 WeakPolarHBondContact O-CB 3.49Å; D740-I744 VanDerWaalsContact O-CG1 3.23Å; D740-I744 WeakPolarHBondContact O-CG1 3.3Å; D740-I744 PolarHBondContact O-N 3.27Å; I744-S746 PolarHBondContact O-N 3.26Å; I744-N747 PolarHBondContact O-N 2.81Å; I744-L748 PolarHBondContact O-N 3.01Å; I744-I829 HydrophobicContact CG2-CG2 3.92Å; I744-Q832 HydrophobicContact CD1-CB 4.13Å; I744-Q832 HydrophobicContact CG1-CB 4.39Å; I744-A836 HydrophobicContact CD1-CB 4.43Å
745	S	80.2	Confident	76.5	Confident	58 Å²	58	79.7 Å²	79.7	41%	0.406	40%	0.404	S	S	.	.	H	α-helix	trans	-65.4	-35.1	178.1	-174.1	0	0	0	0	113.4	L741 R742 D743 L748 Q749	L741-S745 WeakPolarHBondContact O-CB 3.45Å; L741-S745 PolarHBondContact O-N 3.22Å; L741-S745 VanDerWaalsContact O-N 3.1Å; R742-S745 PolarHBondContact O-N 3.37Å; D743-S745 VanDerWaalsContact C-N 3.34Å; D743-S745 PolarHBondContact O-N 2.89Å; S745-L748 PolarHBondContact O-N 3.34Å; S745-Q749 PolarHBondContact O-N 3.12Å
746	S	79.3	Confident	75	Confident	57 Å²	57	78.9 Å²	78.9	40%	0.399	41%	0.405	S	S	.	.	H	α-helix	trans	-70.8	-40.4	178.2	-59.2	0	0	0	0	111.7	R742 D743 I744 L748 Q749 L750	R742-S746 WeakPolarHBondContact O-CB 3.2Å; R742-S746 PolarHBondContact O-N 3.31Å; R742-S746 PolarHBondContact O-OG 3.42Å; D743-S746 PolarHBondContact O-N 3.26Å; I744-S746 PolarHBondContact O-N 3.26Å; S746-L748 VanDerWaalsContact C-N 3.32Å; S746-L748 PolarHBondContact O-N 3.38Å; S746-Q749 PolarHBondContact O-N 3.38Å; S746-L750 PolarHBondContact O-N 2.81Å; S746-L750 VanDerWaalsContact O-N 3.14Å
747	N	76.8	Confident	73.5	Confident	91 Å²	91	82.1 Å²	82.1	49%	0.487	42%	0.417	S	S	.	.	H	α-helix	trans	-60.6	-41.1	174.3	-69.4	-34.2	0	0	0	111.6	D743 I744 Q749 L750 D751	D743-N747 VanDerWaalsContact O-CG 3.25Å; D743-N747 PolarHBondContact O-N 3.24Å; D743-N747 PolarHBondContact O-ND2 3.11Å; D743-N747 VanDerWaalsContact O-ND2 3.08Å; I744-N747 PolarHBondContact O-N 2.81Å; N747-Q749 VanDerWaalsContact C-N 3.31Å; N747-Q749 PolarHBondContact O-N 2.69Å; N747-L750 WeakPolarHBondContact O-CB 3.21Å; N747-L750 PolarHBondContact O-N 3.5Å; N747-D751 PolarHBondContact O-N 3.29Å; N747-D751 VanDerWaalsContact O-N 3.09Å
748	L	73.2	Confident	71.9	Confident	66 Å²	66	84.4 Å²	84.4	35%	0.346	43%	0.43	S	S	.	.	H	α-helix	trans	-60.3	-35.6	175.1	173.3	137.9	0	0	0	113.1	I744 S745 S746 Q752 I829	I744-L748 PolarHBondContact O-N 3.01Å; S745-L748 PolarHBondContact O-N 3.34Å; S746-L748 VanDerWaalsContact C-N 3.32Å; S746-L748 PolarHBondContact O-N 3.38Å; L748-Q752 VanDerWaalsContact O-CG 3.32Å; L748-Q752 WeakPolarHBondContact O-CG 3.31Å; L748-Q752 PolarHBondContact O-N 3.27Å; L748-I829 HydrophobicContact CB-CD1 4.05Å; L748-I829 HydrophobicContact CD1-CD1 3.88Å; L748-I829 HydrophobicContact CG-CD1 4.44Å
749	Q	67.8	Low	70.2	Confident	132 Å²	132	83.5 Å²	83.5	62%	0.617	43%	0.432	S	S	*	.	H	α-helix	trans	-71.8	-37	174.9	-67.6	-172.6	6.6	0	0	112.4	S745 S746 N747 Q752 S753	S745-Q749 PolarHBondContact O-N 3.12Å; S746-Q749 PolarHBondContact O-N 3.38Å; N747-Q749 VanDerWaalsContact C-N 3.31Å; N747-Q749 PolarHBondContact O-N 2.69Å; Q749-Q752 PolarHBondContact O-N 2.76Å; Q749-S753 PolarHBondContact O-N 2.87Å; Q749-S753 VanDerWaalsContact O-N 3.12Å
750	L	67.8	Low	68.5	Low	103 Å²	103	88.7 Å²	88.7	54%	0.539	46%	0.457	S	S	.	.	H	α-helix	trans	-62.9	-48.8	178.4	-166.4	72.3	0	0	0	111.2	S746 N747 Q752 S753 N754	S746-L750 PolarHBondContact O-N 2.81Å; S746-L750 VanDerWaalsContact O-N 3.14Å; N747-L750 WeakPolarHBondContact O-CB 3.21Å; N747-L750 PolarHBondContact O-N 3.5Å; L750-Q752 PolarHBondContact O-N 2.99Å; L750-S753 WeakPolarHBondContact O-CB 3.49Å; L750-S753 PolarHBondContact O-N 3.06Å; L750-S753 VanDerWaalsContact O-N 3.11Å; L750-S753 PolarHBondContact O-OG 3.29Å; L750-N754 PolarHBondContact O-N 3.37Å; L750-N754 PolarHBondContact O-ND2 3.3Å
751	D	64.4	Low	67	Low	56 Å²	56	92.7 Å²	92.7	30%	0.299	47%	0.471	S	S	.	.	H	α-helix	trans	-59.9	-42.6	178.2	-80.6	-6.8	0	0	0	112.5	N747 S753 N754 L755 N825	N747-D751 PolarHBondContact O-N 3.29Å; N747-D751 VanDerWaalsContact O-N 3.09Å; D751-S753 VanDerWaalsContact C-N 3.29Å; D751-S753 PolarHBondContact O-N 3.37Å; D751-N754 PolarHBondContact O-N 3.46Å; D751-L755 PolarHBondContact O-N 3.4Å; D751-N825 PolarHBondContact OD2-ND2 3.35Å
752	Q	61.6	Low	65.7	Low	104 Å²	104	97.7 Å²	97.7	49%	0.486	49%	0.487	S	S	.	.	H	α-helix	trans	-63.6	-33.5	176.2	-72.7	-180	23.8	0	0	112.4	L748 Q749 L750 N756	L748-Q752 VanDerWaalsContact O-CG 3.32Å; L748-Q752 WeakPolarHBondContact O-CG 3.31Å; L748-Q752 PolarHBondContact O-N 3.27Å; Q749-Q752 PolarHBondContact O-N 2.76Å; L750-Q752 PolarHBondContact O-N 2.99Å; Q752-N756 PolarHBondContact O-ND2 3.15Å
753	S	60.9	Low	64.3	Low	63 Å²	63	99.1 Å²	99.1	44%	0.441	50%	0.498	S	S	.	.	H	α-helix	trans	-67.9	-42.1	178.4	78.3	0	0	0	0	112.3	Q749 L750 D751 N756	Q749-S753 PolarHBondContact O-N 2.87Å; Q749-S753 VanDerWaalsContact O-N 3.12Å; L750-S753 WeakPolarHBondContact O-CB 3.49Å; L750-S753 PolarHBondContact O-N 3.06Å; L750-S753 VanDerWaalsContact O-N 3.11Å; L750-S753 PolarHBondContact O-OG 3.29Å; D751-S753 VanDerWaalsContact C-N 3.29Å; D751-S753 PolarHBondContact O-N 3.37Å; S753-N756 PolarHBondContact O-N 2.84Å
754	N	61.4	Low	63	Low	103 Å²	103	101.1 Å²	101.1	55%	0.551	51%	0.508	S	S	*	.	H	α-helix	trans	-64.3	-43.2	179.7	-71.6	-41.4	0	0	0	112	L750 D751 N756 H757	L750-N754 PolarHBondContact O-N 3.37Å; L750-N754 PolarHBondContact O-ND2 3.3Å; D751-N754 PolarHBondContact O-N 3.46Å; N754-N756 PolarHBondContact O-N 3.14Å; N754-N756 VanDerWaalsContact O-N 3.15Å; N754-H757 PolarHBondContact O-N 2.98Å
755	L	59.1	Low	61.8	Low	39 Å²	39	102.4 Å²	102.4	20%	0.204	53%	0.527	C	S	.	.	H	α-helix	trans	-59	-26.5	179.6	-86.3	164.6	0	0	0	114.3	D751 K818 L822	D751-L755 PolarHBondContact O-N 3.4Å; L755-K818 HydrophobicContact CD2-CB 4.19Å; L755-K818 HydrophobicContact CD2-CD 3.78Å; L755-K818 HydrophobicContact CD2-CG 3.71Å; L755-K818 PolarHBondContact O-NZ 3.36Å; L755-L822 HydrophobicContact CD1-CD1 4.42Å; L755-L822 HydrophobicContact CD1-CD2 3.67Å; L755-L822 HydrophobicContact CD1-CG 3.99Å
756	N	55.2	Low	60.9	Low	109 Å²	109	106.1 Å²	106.1	58%	0.583	53%	0.533	S	S	*	.	H	α-helix	trans	-84.5	-33.3	-178.7	-79.2	-64.1	0	0	0	113.4	Q752 S753 N754 E758 M759	Q752-N756 PolarHBondContact O-ND2 3.15Å; S753-N756 PolarHBondContact O-N 2.84Å; N754-N756 PolarHBondContact O-N 3.14Å; N754-N756 VanDerWaalsContact O-N 3.15Å; N756-E758 VanDerWaalsContact C-N 3.28Å; N756-E758 PolarHBondContact O-N 2.63Å; N756-M759 PolarHBondContact O-N 3.25Å
757	H	53.1	Low	60.4	Low	148 Å²	148	105.6 Å²	105.6	69%	0.685	53%	0.529	S	S	*	.	H	α-helix	trans	-67	-28.2	-169.4	-155.3	-32.1	0	0	0	113.5	N754 M759	N754-H757 PolarHBondContact O-N 2.98Å; H757-M759 VanDerWaalsContact C-N 3.29Å; H757-M759 PolarHBondContact O-N 3.12Å
758	E	52.8	Low	60.3	Low	101 Å²	101	107.3 Å²	107.3	47%	0.472	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-75.2	-13.8	-177.1	-162.4	54.4	-156.6	0	0	113.8	N756 N760 K761	N756-E758 VanDerWaalsContact C-N 3.28Å; N756-E758 PolarHBondContact O-N 2.63Å; E758-N760 VanDerWaalsContact C-N 3.29Å; E758-N760 PolarHBondContact O-N 3.05Å; E758-K761 IonicContact OE2-NZ 3.26Å
759	M	49.7	Very low	60.5	Low	118 Å²	118	106.8 Å²	106.8	58%	0.581	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-70.6	-16.9	-172.3	-68.1	-95.1	51.8	0	0	115.1	N756 H757	N756-M759 PolarHBondContact O-N 3.25Å; H757-M759 VanDerWaalsContact C-N 3.29Å; H757-M759 PolarHBondContact O-N 3.12Å
760	N	50.3	Low	61.1	Low	149 Å²	149	102.9 Å²	102.9	80%	0.797	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-94.1	-1	-167.6	-79.4	-36.5	0	0	0	115.9	E758	E758-N760 VanDerWaalsContact C-N 3.29Å; E758-N760 PolarHBondContact O-N 3.05Å
761	K	53.8	Low	61.9	Low	148 Å²	148	104.8 Å²	104.8	64%	0.643	52%	0.519	S	S	*	.	S	Bend	trans	-93.8	0.9	-166.3	-84.6	178.7	-177.9	161.7	0	117.8	E758	E758-K761 IonicContact OE2-NZ 3.26Å
762	R	56.8	Low	62.8	Low	149 Å²	149	103.1 Å²	103.1	56%	0.562	51%	0.513	S	S	*	.			trans	-139.7	95.7	-169.2	-57.4	-175.1	-166.5	164.6	5.1	114.5	E814	R762-E814 IonicContact CZ-OE1 2.72Å; R762-E814 IonicContact NH1-OE1 3.99Å; R762-E814 PolarHBondContact NH1-OE1 2.87Å; R762-E814 IonicContact NH1-OE2 2.85Å; R762-E814 PolarHBondContact NH1-OE2 3.49Å; R762-E814 IonicContact NH2-OE1 3.11Å; R762-E814 PolarHBondContact NH2-OE1 3.39Å
763	K	56.2	Low	64	Low	182 Å²	182	99.4 Å²	99.4	79%	0.791	50%	0.496	S	S	*	.			trans	-139.7	-9.9	170.5	-76.2	-173.3	176.8	170	0	116.4
764	D	57.2	Low	65.2	Low	122 Å²	122	101.5 Å²	101.5	65%	0.652	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-34.5	-159.8	-56.2	-62.9	0	0	0	116.1	S767	D764-S767 WeakPolarHBondContact O-CB 3.28Å; D764-S767 PolarHBondContact O-N 2.88Å; D764-S767 PolarHBondContact O-OG 3.47Å
765	G	59.6	Low	66.5	Low	52 Å²	52	104.1 Å²	104.1	54%	0.536	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-49.3	-175.7	0	0	0	0	0	113.5	S767 Q768	G765-S767 PolarHBondContact O-N 3.27Å; G765-S767 VanDerWaalsContact O-N 3.09Å; G765-Q768 WeakPolarHBondContact O-CB 3.3Å; G765-Q768 PolarHBondContact O-N 3.46Å
766	R	62.3	Low	67.8	Low	136 Å²	136	103.8 Å²	103.8	51%	0.513	50%	0.501	S	S	.	.	H	α-helix	trans	-57.9	-27.1	-179.7	-162.5	173.4	-171.7	-155.2	1.5	113.3	Q768 S770 S804	R766-Q768 PolarHBondContact O-N 3.49Å; R766-S770 PolarHBondContact O-N 3.26Å; R766-S804 PolarHBondContact NE-OG 2.9Å; R766-S804 PolarHBondContact NH2-OG 3.22Å; R766-S804 VanDerWaalsContact NH2-OG 3.08Å
767	S	67.7	Low	69.4	Low	46 Å²	46	101.9 Å²	101.9	32%	0.322	49%	0.491	S	S	.	.	H	α-helix	trans	-64.9	-24.6	175.8	82.6	0	0	0	0	113.6	D764 G765 R771	D764-S767 WeakPolarHBondContact O-CB 3.28Å; D764-S767 PolarHBondContact O-N 2.88Å; D764-S767 PolarHBondContact O-OG 3.47Å; G765-S767 PolarHBondContact O-N 3.27Å; G765-S767 VanDerWaalsContact O-N 3.09Å; S767-R771 WeakPolarHBondContact O-CB 3.37Å; S767-R771 VanDerWaalsContact O-CG 3.3Å; S767-R771 WeakPolarHBondContact O-CG 3.39Å; S767-R771 PolarHBondContact O-N 3.29Å; S767-R771 PolarHBondContact O-NE 2.91Å; S767-R771 PolarHBondContact OG-NH2 3.33Å
768	Q	76.7	Confident	71	Confident	127 Å²	127	101 Å²	101	59%	0.593	49%	0.489	S	S	*	.	H	α-helix	trans	-84.3	-45.6	-174.1	-57.8	-170.9	15.7	0	0	111.7	G765 R766 R771 A772	G765-Q768 WeakPolarHBondContact O-CB 3.3Å; G765-Q768 PolarHBondContact O-N 3.46Å; R766-Q768 PolarHBondContact O-N 3.49Å; Q768-R771 CarbonylContact O-C 3.48Å; Q768-R771 WeakPolarHBondContact O-CB 3.43Å; Q768-R771 PolarHBondContact O-N 2.83Å; Q768-A772 PolarHBondContact O-N 2.88Å
769	L	77.2	Confident	72.6	Confident	56 Å²	56	98.5 Å²	98.5	29%	0.293	48%	0.479	S	S	.	.	H	α-helix	trans	-64.1	-41.2	175.7	-67.9	173.4	0	0	0	111.8	R771 A772 L773 L800 Q803	L769-R771 VanDerWaalsContact C-N 3.3Å; L769-R771 PolarHBondContact O-N 3.36Å; L769-A772 WeakPolarHBondContact O-CA 3.44Å; L769-A772 WeakPolarHBondContact O-CB 3.34Å; L769-A772 PolarHBondContact O-N 2.98Å; L769-L773 PolarHBondContact O-N 3.07Å; L769-L800 HydrophobicContact CB-CD1 3.71Å; L769-Q803 HydrophobicContact CD1-CB 3.77Å; L769-Q803 HydrophobicContact CD1-CG 3.85Å
770	S	79.6	Confident	74.2	Confident	50 Å²	50	97 Å²	97	35%	0.35	47%	0.466	S	S	.	.	H	α-helix	trans	-58.2	-42.1	172.4	177.1	0	0	0	0	111.9	R766 A772 L773 L774	R766-S770 PolarHBondContact O-N 3.26Å; S770-A772 VanDerWaalsContact C-N 3.27Å; S770-A772 PolarHBondContact O-N 2.86Å; S770-L773 PolarHBondContact O-N 3.17Å; S770-L774 WeakPolarHBondContact O-CB 3.39Å; S770-L774 VanDerWaalsContact O-CG 3.29Å; S770-L774 WeakPolarHBondContact O-CG 3.29Å; S770-L774 PolarHBondContact O-N 3.47Å
771	R	84.6	Confident	75.7	Confident	143 Å²	143	92.7 Å²	92.7	54%	0.54	46%	0.457	S	S	.	.	H	α-helix	trans	-70	-15.2	172.9	-77.3	-179.2	-74.5	163	-9.1	114.2	S767 Q768 L769 R775	S767-R771 WeakPolarHBondContact O-CB 3.37Å; S767-R771 VanDerWaalsContact O-CG 3.3Å; S767-R771 WeakPolarHBondContact O-CG 3.39Å; S767-R771 PolarHBondContact O-N 3.29Å; S767-R771 PolarHBondContact O-NE 2.91Å; S767-R771 PolarHBondContact OG-NH2 3.33Å; Q768-R771 CarbonylContact O-C 3.48Å; Q768-R771 WeakPolarHBondContact O-CB 3.43Å; Q768-R771 PolarHBondContact O-N 2.83Å; L769-R771 VanDerWaalsContact C-N 3.3Å; L769-R771 PolarHBondContact O-N 3.36Å; R771-R775 WeakPolarHBondContact O-CG 3.5Å; R771-R775 PolarHBondContact O-NE 2.85Å
772	A	83.7	Confident	77.3	Confident	21 Å²	21	91.6 Å²	91.6	17%	0.174	45%	0.452	C	S	.	.	H	α-helix	trans	-82.1	-51.5	170.6	0	0	0	0	0	110.8	Q768 L769 S770 L774 R775 E776	Q768-A772 PolarHBondContact O-N 2.88Å; L769-A772 WeakPolarHBondContact O-CA 3.44Å; L769-A772 WeakPolarHBondContact O-CB 3.34Å; L769-A772 PolarHBondContact O-N 2.98Å; S770-A772 VanDerWaalsContact C-N 3.27Å; S770-A772 PolarHBondContact O-N 2.86Å; A772-L774 VanDerWaalsContact C-N 3.33Å; A772-L774 PolarHBondContact O-N 3.34Å; A772-R775 WeakPolarHBondContact O-CB 3.37Å; A772-R775 PolarHBondContact O-N 3.48Å; A772-E776 PolarHBondContact O-N 3.09Å; A772-E776 VanDerWaalsContact O-N 3.15Å
773	L	86.4	Confident	78.5	Confident	25 Å²	25	92.8 Å²	92.8	13%	0.131	46%	0.457	C	S	.	.	H	α-helix	trans	-57.7	-43.2	177.4	179	58.6	0	0	0	112.4	L769 S770 R775 E776 L777 V793 N796 K797 L800	L769-L773 PolarHBondContact O-N 3.07Å; S770-L773 PolarHBondContact O-N 3.17Å; L773-R775 VanDerWaalsContact C-N 3.26Å; L773-R775 PolarHBondContact O-N 3.14Å; L773-E776 PolarHBondContact O-N 3.36Å; L773-L777 HydrophobicContact CD1-CD1 4.16Å; L773-L777 HydrophobicContact CD1-CG 4.19Å; L773-L777 HydrophobicContact CG-CD1 3.94Å; L773-L777 HydrophobicContact CG-CG 4.45Å; L773-L777 WeakPolarHBondContact O-CB 3.24Å; L773-L777 WeakPolarHBondContact O-CG 3.36Å; L773-L777 PolarHBondContact O-N 3.33Å; L773-V793 HydrophobicContact CD1-CG1 4.27Å; L773-N796 HydrophobicContact CB-CB 4.24Å; L773-N796 HydrophobicContact CD1-CB 3.93Å; L773-K797 HydrophobicContact CD1-CB 4.15Å; L773-K797 HydrophobicContact CD2-CB 4.41Å; L773-L800 HydrophobicContact CB-CD2 4.43Å; L773-L800 HydrophobicContact CD2-CD2 3.59Å
774	L	85.8	Confident	79.4	Confident	108 Å²	108	88.2 Å²	88.2	57%	0.565	45%	0.446	S	S	*	.	H	α-helix	trans	-62.6	-29.4	176.5	-73.1	169.6	0	0	0	113.3	S770 A772 M778	S770-L774 WeakPolarHBondContact O-CB 3.39Å; S770-L774 VanDerWaalsContact O-CG 3.29Å; S770-L774 WeakPolarHBondContact O-CG 3.29Å; S770-L774 PolarHBondContact O-N 3.47Å; A772-L774 VanDerWaalsContact C-N 3.33Å; A772-L774 PolarHBondContact O-N 3.34Å; L774-M778 WeakPolarHBondContact O-CB 3.2Å; L774-M778 PolarHBondContact O-N 3.47Å; L774-M778 VanDerWaalsContact O-N 3.16Å
775	R	88.1	Confident	80.5	Confident	157 Å²	157	87.5 Å²	87.5	59%	0.592	46%	0.457	S	S	*	.	H	α-helix	trans	-73	-45.2	174.6	-79.4	179.9	-72	155.1	0.6	111.5	R771 A772 L773 M778 N779	R771-R775 WeakPolarHBondContact O-CG 3.5Å; R771-R775 PolarHBondContact O-NE 2.85Å; A772-R775 WeakPolarHBondContact O-CB 3.37Å; A772-R775 PolarHBondContact O-N 3.48Å; L773-R775 VanDerWaalsContact C-N 3.26Å; L773-R775 PolarHBondContact O-N 3.14Å; R775-M778 CarbonylContact O-C 3.53Å; R775-M778 WeakPolarHBondContact O-CB 3.3Å; R775-M778 PolarHBondContact O-N 2.97Å; R775-N779 PolarHBondContact O-N 3.44Å; R775-N779 PolarHBondContact O-ND2 2.68Å
776	E	88	Confident	81.7	Confident	32 Å²	32	86.4 Å²	86.4	15%	0.15	44%	0.441	C	S	.	.	H	α-helix	trans	-69.8	-34.8	178.1	-69.8	-51.5	101.5	0	0	112.8	A772 L773 M778 N779 W780 F789 R792 V793 N796	A772-E776 PolarHBondContact O-N 3.09Å; A772-E776 VanDerWaalsContact O-N 3.15Å; L773-E776 PolarHBondContact O-N 3.36Å; E776-M778 VanDerWaalsContact C-N 3.32Å; E776-M778 PolarHBondContact O-N 3.35Å; E776-N779 PolarHBondContact O-N 3.05Å; E776-N779 PolarHBondContact OE1-ND2 3.42Å; E776-W780 PolarHBondContact O-N 3.17Å; E776-F789 WeakPolarHBondContact OE2-CD1 3.39Å; E776-R792 HydrophobicContact CG-CB 4.31Å; E776-R792 IonicContact OE2-NE 3.45Å; E776-R792 PolarHBondContact OE2-NE 2.91Å; E776-V793 HydrophobicContact CB-CG2 3.87Å; E776-V793 WeakPolarHBondContact O-CG2 3.32Å; E776-N796 WeakPolarHBondContact CG-ND2 3.47Å
777	L	86.9	Confident	82.7	Confident	70 Å²	70	82.9 Å²	82.9	37%	0.366	44%	0.441	S	S	.	.	H	α-helix	trans	-59.6	-42	169	-78	167.5	0	0	0	111.8	L773 N779 G781 V793	L773-L777 HydrophobicContact CD1-CD1 4.16Å; L773-L777 HydrophobicContact CD1-CG 4.19Å; L773-L777 HydrophobicContact CG-CD1 3.94Å; L773-L777 HydrophobicContact CG-CG 4.45Å; L773-L777 WeakPolarHBondContact O-CB 3.24Å; L773-L777 WeakPolarHBondContact O-CG 3.36Å; L773-L777 PolarHBondContact O-N 3.33Å; L777-N779 PolarHBondContact O-N 2.95Å; L777-G781 PolarHBondContact O-N 3.47Å; L777-V793 HydrophobicContact CD2-CG1 3.68Å; L777-V793 HydrophobicContact CD2-CG2 4.28Å; L777-V793 HydrophobicContact CG-CG1 4.21Å; L777-V793 HydrophobicContact CG-CG2 4.4Å
778	M	86.8	Confident	83.6	Confident	130 Å²	130	86.1 Å²	86.1	64%	0.64	45%	0.451	S	S	*	.	H	α-helix	trans	-67.8	-23.2	174.4	-158.5	-151.4	-167.3	0	0	112.9	L774 R775 E776 K782	L774-M778 WeakPolarHBondContact O-CB 3.2Å; L774-M778 PolarHBondContact O-N 3.47Å; L774-M778 VanDerWaalsContact O-N 3.16Å; R775-M778 CarbonylContact O-C 3.53Å; R775-M778 WeakPolarHBondContact O-CB 3.3Å; R775-M778 PolarHBondContact O-N 2.97Å; E776-M778 VanDerWaalsContact C-N 3.32Å; E776-M778 PolarHBondContact O-N 3.35Å; M778-K782 VanDerWaalsContact O-CD 3.23Å; M778-K782 WeakPolarHBondContact O-CD 3.34Å; M778-K782 WeakPolarHBondContact O-CE 3.39Å; M778-K782 VanDerWaalsContact O-CG 3.29Å; M778-K782 WeakPolarHBondContact O-CG 3.37Å; M778-K782 PolarHBondContact O-NZ 3.02Å; M778-K782 PolarHBondContact SD-NZ 3.3Å
779	N	86.4	Confident	84	Confident	48 Å²	48	82 Å²	82	26%	0.257	43%	0.431	S	S	.	.	H	α-helix	trans	-83.7	-43.6	176.6	-67.8	-23.9	0	0	0	111.5	R775 E776 L777 K782 R783 F789	R775-N779 PolarHBondContact O-N 3.44Å; R775-N779 PolarHBondContact O-ND2 2.68Å; E776-N779 PolarHBondContact O-N 3.05Å; E776-N779 PolarHBondContact OE1-ND2 3.42Å; L777-N779 PolarHBondContact O-N 2.95Å; N779-K782 WeakPolarHBondContact O-CB 3.18Å; N779-K782 PolarHBondContact O-N 3.26Å; N779-K782 VanDerWaalsContact O-N 3.16Å; N779-K782 PolarHBondContact OD1-NZ 2.82Å; N779-R783 PolarHBondContact O-N 3.03Å; N779-F789 HydrophobicContact CB-CD1 3.75Å; N779-F789 HydrophobicContact CB-CE1 3.6Å; N779-F789 HydrophobicContact CB-CZ 4.37Å
780	W	83.5	Confident	84.3	Confident	86 Å²	86	84.3 Å²	84.3	33%	0.326	44%	0.441	S	S	.	.	H	α-helix	trans	-62.6	-41.3	172.7	-176.2	55.9	0	0	0	111.8	E776 K782 R783 P784 F789 V793	E776-W780 PolarHBondContact O-N 3.17Å; W780-K782 PolarHBondContact O-N 3.31Å; W780-K782 VanDerWaalsContact O-N 3.07Å; W780-R783 CarbonylContact O-C 3.17Å; W780-R783 WeakPolarHBondContact O-CA 3.42Å; W780-R783 PolarHBondContact O-N 2.95Å; W780-P784 PolarHBondContact NE1-O 2.85Å; W780-P784 WeakPolarHBondContact O-CA 3.33Å; W780-F789 HydrophobicContact CB-CB 3.99Å; W780-F789 HydrophobicContact CG-CB 4.35Å; W780-V793 HydrophobicContact CB-CG2 3.91Å; W780-V793 HydrophobicContact CG-CG2 4.49Å
781	G	82.1	Confident	84.7	Confident	59 Å²	59	88.4 Å²	88.4	61%	0.608	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-17.9	174.2	0	0	0	0	0	115	L777	L777-G781 PolarHBondContact O-N 3.47Å
782	K	86.8	Confident	84.8	Confident	124 Å²	124	85.5 Å²	85.5	54%	0.539	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-17.3	171.7	-63.2	160.2	-165.9	152	0	113	M778 N779 W780	M778-K782 VanDerWaalsContact O-CD 3.23Å; M778-K782 WeakPolarHBondContact O-CD 3.34Å; M778-K782 WeakPolarHBondContact O-CE 3.39Å; M778-K782 VanDerWaalsContact O-CG 3.29Å; M778-K782 WeakPolarHBondContact O-CG 3.37Å; M778-K782 PolarHBondContact O-NZ 3.02Å; M778-K782 PolarHBondContact SD-NZ 3.3Å; N779-K782 WeakPolarHBondContact O-CB 3.18Å; N779-K782 PolarHBondContact O-N 3.26Å; N779-K782 VanDerWaalsContact O-N 3.16Å; N779-K782 PolarHBondContact OD1-NZ 2.82Å; W780-K782 PolarHBondContact O-N 3.31Å; W780-K782 VanDerWaalsContact O-N 3.07Å
783	R	83.1	Confident	85	Confident	174 Å²	174	84.9 Å²	84.9	66%	0.657	44%	0.437	S	S	*	.			trans	-148.7	66.7	-177.7	-68.2	-169.2	174.7	-170.3	-1.8	111	N779 W780 A785 S786	N779-R783 PolarHBondContact O-N 3.03Å; W780-R783 CarbonylContact O-C 3.17Å; W780-R783 WeakPolarHBondContact O-CA 3.42Å; W780-R783 PolarHBondContact O-N 2.95Å; R783-A785 VanDerWaalsContact C-N 3.26Å; R783-A785 PolarHBondContact O-N 2.75Å; R783-S786 WeakPolarHBondContact O-CB 2.94Å; R783-S786 PolarHBondContact O-N 2.68Å
784	P	75.2	Confident	84.9	Confident	86 Å²	86	87.9 Å²	87.9	56%	0.558	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-30.4	-171.6	22.2	-33.3	0	0	0	113.5	W780 S786	W780-P784 PolarHBondContact NE1-O 2.85Å; W780-P784 WeakPolarHBondContact O-CA 3.33Å; P784-S786 PolarHBondContact O-N 3.28Å
785	A	80.1	Confident	85	Confident	107 Å²	107	88 Å²	88	88%	0.884	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	6.4	176.6	0	0	0	0	0	114.8	R783	R783-A785 VanDerWaalsContact C-N 3.26Å; R783-A785 PolarHBondContact O-N 2.75Å
786	S	85.8	Confident	84.9	Confident	30 Å²	30	82.5 Å²	82.5	21%	0.21	43%	0.434	C	S	.	.			trans	-96	105.6	-179.2	-175.3	0	0	0	0	111.9	R783 P784 E788 F789 Q790	R783-S786 WeakPolarHBondContact O-CB 2.94Å; R783-S786 PolarHBondContact O-N 2.68Å; P784-S786 PolarHBondContact O-N 3.28Å; S786-E788 PolarHBondContact O-N 2.78Å; S786-F789 PolarHBondContact O-N 3.49Å; S786-F789 VanDerWaalsContact O-N 3.08Å; S786-F789 WeakPolarHBondContact OG-CD2 3.28Å; S786-Q790 PolarHBondContact O-N 2.92Å; S786-Q790 VanDerWaalsContact O-N 3.12Å
787	A	82.2	Confident	84.7	Confident	61 Å²	61	85.2 Å²	85.2	50%	0.504	45%	0.445	S	S	.	.	H	α-helix	trans	-55.5	-35.6	177.4	0	0	0	0	0	113.2	F789 Q790 Q791	A787-F789 PolarHBondContact O-N 2.9Å; A787-Q790 WeakPolarHBondContact O-CB 3.29Å; A787-Q790 PolarHBondContact O-N 2.63Å; A787-Q791 WeakPolarHBondContact O-CB 3.4Å; A787-Q791 WeakPolarHBondContact O-CG 3.43Å; A787-Q791 PolarHBondContact O-N 3.41Å
788	E	87.4	Confident	84.6	Confident	114 Å²	114	88 Å²	88	53%	0.533	45%	0.454	S	S	.	.	H	α-helix	trans	-60.6	-44.8	174.9	-70.2	-175	-151.8	0	0	113.1	S786 Q790 Q791 R792	S786-E788 PolarHBondContact O-N 2.78Å; E788-Q790 VanDerWaalsContact C-N 3.34Å; E788-Q791 PolarHBondContact O-N 2.84Å; E788-R792 WeakPolarHBondContact O-CG 3.43Å; E788-R792 PolarHBondContact O-N 3.5Å; E788-R792 IonicContact OE2-CZ 3.29Å; E788-R792 IonicContact OE2-NH1 2.67Å; E788-R792 PolarHBondContact OE2-NH1 3.08Å; E788-R792 IonicContact OE2-NH2 3.2Å; E788-R792 PolarHBondContact OE2-NH2 3.22Å
789	F	84.8	Confident	84.5	Confident	42 Å²	42	84 Å²	84	18%	0.184	44%	0.437	C	S	.	.	H	α-helix	trans	-71	-34.9	-179.7	-80.2	-67.2	0	0	0	110.9	E776 N779 W780 S786 A787 R792 V793	E776-F789 WeakPolarHBondContact OE2-CD1 3.39Å; N779-F789 HydrophobicContact CB-CD1 3.75Å; N779-F789 HydrophobicContact CB-CE1 3.6Å; N779-F789 HydrophobicContact CB-CZ 4.37Å; W780-F789 HydrophobicContact CB-CB 3.99Å; W780-F789 HydrophobicContact CG-CB 4.35Å; S786-F789 PolarHBondContact O-N 3.49Å; S786-F789 VanDerWaalsContact O-N 3.08Å; S786-F789 WeakPolarHBondContact OG-CD2 3.28Å; A787-F789 PolarHBondContact O-N 2.9Å; F789-R792 VanDerWaalsContact CE1-NH2 3.29Å; F789-R792 VanDerWaalsContact CZ-NH2 3.34Å; F789-R792 PolarHBondContact O-N 3.38Å; F789-V793 WeakPolarHBondContact O-CB 3.45Å; F789-V793 VanDerWaalsContact O-CG2 3.31Å; F789-V793 WeakPolarHBondContact O-CG2 3.31Å; F789-V793 PolarHBondContact O-N 3.46Å
790	Q	83.7	Confident	84.4	Confident	104 Å²	104	83 Å²	83	49%	0.486	43%	0.432	S	S	.	.	H	α-helix	trans	-59.9	-47.1	170.3	-172.2	-178.9	-0	0	0	111.4	S786 A787 E788 R792 V793 E794	S786-Q790 PolarHBondContact O-N 2.92Å; S786-Q790 VanDerWaalsContact O-N 3.12Å; A787-Q790 WeakPolarHBondContact O-CB 3.29Å; A787-Q790 PolarHBondContact O-N 2.63Å; E788-Q790 VanDerWaalsContact C-N 3.34Å; Q790-R792 PolarHBondContact O-N 2.93Å; Q790-V793 PolarHBondContact O-N 3.48Å; Q790-E794 PolarHBondContact O-N 3.03Å
791	Q	86.8	Confident	84.3	Confident	136 Å²	136	84.3 Å²	84.3	64%	0.636	44%	0.444	S	S	*	.	H	α-helix	trans	-61.9	-42.2	175.4	-73.7	173.9	-3.8	0	0	112.4	A787 E788 E794 L795	A787-Q791 WeakPolarHBondContact O-CB 3.4Å; A787-Q791 WeakPolarHBondContact O-CG 3.43Å; A787-Q791 PolarHBondContact O-N 3.41Å; E788-Q791 PolarHBondContact O-N 2.84Å; Q791-E794 PolarHBondContact O-N 2.83Å; Q791-L795 WeakPolarHBondContact O-CB 3.3Å; Q791-L795 PolarHBondContact O-N 3.44Å
792	R	87.9	Confident	84.3	Confident	81 Å²	81	85.8 Å²	85.8	31%	0.306	44%	0.435	S	S	.	.	H	α-helix	trans	-65.8	-34.6	175.4	-75.2	-172.1	-73.6	-93.6	0.8	113	E776 E788 F789 Q790 N796	E776-R792 HydrophobicContact CG-CB 4.31Å; E776-R792 IonicContact OE2-NE 3.45Å; E776-R792 PolarHBondContact OE2-NE 2.91Å; E788-R792 WeakPolarHBondContact O-CG 3.43Å; E788-R792 PolarHBondContact O-N 3.5Å; E788-R792 IonicContact OE2-CZ 3.29Å; E788-R792 IonicContact OE2-NH1 2.67Å; E788-R792 PolarHBondContact OE2-NH1 3.08Å; E788-R792 IonicContact OE2-NH2 3.2Å; E788-R792 PolarHBondContact OE2-NH2 3.22Å; F789-R792 VanDerWaalsContact CE1-NH2 3.29Å; F789-R792 VanDerWaalsContact CZ-NH2 3.34Å; F789-R792 PolarHBondContact O-N 3.38Å; Q790-R792 PolarHBondContact O-N 2.93Å; R792-N796 WeakPolarHBondContact O-CB 3.26Å; R792-N796 PolarHBondContact O-N 2.87Å; R792-N796 VanDerWaalsContact O-N 3.17Å; R792-N796 PolarHBondContact O-ND2 3.41Å
793	V	87.4	Confident	84	Confident	8 Å²	8	83 Å²	83	5%	0.048	42%	0.424	C	S	.	.	H	α-helix	trans	-67	-50	173.1	165.9	0	0	0	0	110.7	L773 E776 L777 W780 F789 Q790 L795 N796 K797	L773-V793 HydrophobicContact CD1-CG1 4.27Å; E776-V793 HydrophobicContact CB-CG2 3.87Å; E776-V793 WeakPolarHBondContact O-CG2 3.32Å; L777-V793 HydrophobicContact CD2-CG1 3.68Å; L777-V793 HydrophobicContact CD2-CG2 4.28Å; L777-V793 HydrophobicContact CG-CG1 4.21Å; L777-V793 HydrophobicContact CG-CG2 4.4Å; W780-V793 HydrophobicContact CB-CG2 3.91Å; W780-V793 HydrophobicContact CG-CG2 4.49Å; F789-V793 WeakPolarHBondContact O-CB 3.45Å; F789-V793 VanDerWaalsContact O-CG2 3.31Å; F789-V793 WeakPolarHBondContact O-CG2 3.31Å; F789-V793 PolarHBondContact O-N 3.46Å; Q790-V793 PolarHBondContact O-N 3.48Å; V793-L795 PolarHBondContact O-N 3.24Å; V793-N796 PolarHBondContact O-N 2.83Å; V793-K797 VanDerWaalsContact O-CB 3.27Å; V793-K797 WeakPolarHBondContact O-CB 3.5Å; V793-K797 PolarHBondContact O-N 3.44Å
794	E	84.9	Confident	83.6	Confident	89 Å²	89	75.3 Å²	75.3	42%	0.416	40%	0.397	S	S	.	.	H	α-helix	trans	-63.8	-37.3	180	-73.5	-61.8	134.5	0	0	112.6	Q790 Q791 K797 K798	Q790-E794 PolarHBondContact O-N 3.03Å; Q791-E794 PolarHBondContact O-N 2.83Å; E794-K797 PolarHBondContact O-N 2.98Å; E794-K797 WeakPolarHBondContact OE1-CD 3.35Å; E794-K797 IonicContact OE1-NZ 2.72Å; E794-K797 PolarHBondContact OE1-NZ 3.32Å; E794-K797 WeakPolarHBondContact OE2-CD 3.18Å; E794-K797 WeakPolarHBondContact OE2-CE 3.1Å; E794-K797 IonicContact OE2-NZ 3.63Å; E794-K797 PolarHBondContact OE2-NZ 3.18Å; E794-K798 WeakPolarHBondContact O-CB 3.44Å; E794-K798 PolarHBondContact O-N 2.7Å
795	L	88.2	Confident	83.4	Confident	111 Å²	111	74.6 Å²	74.6	58%	0.581	39%	0.386	S	S	*	.	H	α-helix	trans	-65.1	-42.8	174.1	-176.3	64	0	0	0	112.7	Q791 V793 K797 T799	Q791-L795 WeakPolarHBondContact O-CB 3.3Å; Q791-L795 PolarHBondContact O-N 3.44Å; V793-L795 PolarHBondContact O-N 3.24Å; L795-K797 VanDerWaalsContact C-N 3.34Å; L795-T799 WeakPolarHBondContact O-CG2 3.4Å; L795-T799 PolarHBondContact O-N 3.47Å; L795-T799 PolarHBondContact O-OG1 3.23Å
796	N	84.8	Confident	83.3	Confident	41 Å²	41	73.8 Å²	73.8	22%	0.219	37%	0.367	C	S	.	.	H	α-helix	trans	-71.4	-28.9	176.4	-78.9	-56.3	0	0	0	112.7	L773 E776 R792 V793 T799 L800	L773-N796 HydrophobicContact CB-CB 4.24Å; L773-N796 HydrophobicContact CD1-CB 3.93Å; E776-N796 WeakPolarHBondContact CG-ND2 3.47Å; R792-N796 WeakPolarHBondContact O-CB 3.26Å; R792-N796 PolarHBondContact O-N 2.87Å; R792-N796 VanDerWaalsContact O-N 3.17Å; R792-N796 PolarHBondContact O-ND2 3.41Å; V793-N796 PolarHBondContact O-N 2.83Å; N796-T799 WeakPolarHBondContact CA-OG1 3.36Å; N796-T799 PolarHBondContact O-OG1 3.24Å; N796-L800 VanDerWaalsContact O-CB 3.24Å; N796-L800 WeakPolarHBondContact O-CB 3.35Å; N796-L800 PolarHBondContact O-N 2.72Å; N796-L800 VanDerWaalsContact O-N 3.17Å
797	K	85.1	Confident	82.7	Confident	88 Å²	88	74.5 Å²	74.5	38%	0.383	37%	0.368	S	S	.	.	H	α-helix	trans	-68.8	-48.8	172.4	169.6	-174.8	163.6	-152.6	0	110.5	L773 V793 E794 L795 L800 L801	L773-K797 HydrophobicContact CD1-CB 4.15Å; L773-K797 HydrophobicContact CD2-CB 4.41Å; V793-K797 VanDerWaalsContact O-CB 3.27Å; V793-K797 WeakPolarHBondContact O-CB 3.5Å; V793-K797 PolarHBondContact O-N 3.44Å; E794-K797 PolarHBondContact O-N 2.98Å; E794-K797 WeakPolarHBondContact OE1-CD 3.35Å; E794-K797 IonicContact OE1-NZ 2.72Å; E794-K797 PolarHBondContact OE1-NZ 3.32Å; E794-K797 WeakPolarHBondContact OE2-CD 3.18Å; E794-K797 WeakPolarHBondContact OE2-CE 3.1Å; E794-K797 IonicContact OE2-NZ 3.63Å; E794-K797 PolarHBondContact OE2-NZ 3.18Å; L795-K797 VanDerWaalsContact C-N 3.34Å; K797-L800 PolarHBondContact O-N 3.1Å; K797-L801 HydrophobicContact CG-CD1 4.15Å; K797-L801 VanDerWaalsContact O-CG 3.31Å; K797-L801 WeakPolarHBondContact O-CG 3.27Å; K797-L801 PolarHBondContact O-N 2.94Å
798	K	84.4	Confident	82.1	Confident	128 Å²	128	74.3 Å²	74.3	56%	0.557	36%	0.357	S	S	*	.	H	α-helix	trans	-57.9	-53.2	176.4	177.5	163.9	176.2	166.3	0	111.8	E794 L800 L801 E802	E794-K798 WeakPolarHBondContact O-CB 3.44Å; E794-K798 PolarHBondContact O-N 2.7Å; K798-L800 VanDerWaalsContact C-N 3.32Å; K798-L800 PolarHBondContact O-N 3.27Å; K798-L801 WeakPolarHBondContact O-CB 3.29Å; K798-L801 PolarHBondContact O-N 2.87Å; K798-E802 WeakPolarHBondContact CE-OE1 3.38Å; K798-E802 HydrophobicContact CG-CG 4.32Å; K798-E802 WeakPolarHBondContact CG-OE1 3.33Å; K798-E802 IonicContact NZ-OE1 2.65Å; K798-E802 WeakPolarHBondContact O-CG 3.35Å; K798-E802 PolarHBondContact O-N 3.21Å
799	T	85.4	Confident	81.4	Confident	46 Å²	46	73.5 Å²	73.5	28%	0.282	35%	0.353	S	S	.	.	H	α-helix	trans	-63.7	-32.2	179.7	49.2	0	0	0	0	114	L795 N796 E802 Q803	L795-T799 WeakPolarHBondContact O-CG2 3.4Å; L795-T799 PolarHBondContact O-N 3.47Å; L795-T799 PolarHBondContact O-OG1 3.23Å; N796-T799 WeakPolarHBondContact CA-OG1 3.36Å; N796-T799 PolarHBondContact O-OG1 3.24Å; T799-E802 WeakPolarHBondContact CA-OE2 3.34Å; T799-Q803 WeakPolarHBondContact O-CB 3.34Å; T799-Q803 PolarHBondContact O-N 3.36Å; T799-Q803 VanDerWaalsContact O-N 3.1Å
800	L	83.6	Confident	80.8	Confident	29 Å²	29	77.6 Å²	77.6	15%	0.152	37%	0.367	C	S	.	.	H	α-helix	trans	-70	-34	172.4	179.3	64	0	0	0	112.9	L769 L773 N796 K797 K798 S804	L769-L800 HydrophobicContact CB-CD1 3.71Å; L773-L800 HydrophobicContact CB-CD2 4.43Å; L773-L800 HydrophobicContact CD2-CD2 3.59Å; N796-L800 VanDerWaalsContact O-CB 3.24Å; N796-L800 WeakPolarHBondContact O-CB 3.35Å; N796-L800 PolarHBondContact O-N 2.72Å; N796-L800 VanDerWaalsContact O-N 3.17Å; K797-L800 PolarHBondContact O-N 3.1Å; K798-L800 VanDerWaalsContact C-N 3.32Å; K798-L800 PolarHBondContact O-N 3.27Å; L800-S804 VanDerWaalsContact O-CB 3.29Å; L800-S804 WeakPolarHBondContact O-CB 3.43Å; L800-S804 PolarHBondContact O-N 3.47Å; L800-S804 VanDerWaalsContact O-N 3.11Å; L800-S804 PolarHBondContact O-OG 3.26Å
801	L	80.3	Confident	80.4	Confident	112 Å²	112	76.9 Å²	76.9	59%	0.586	37%	0.366	S	S	*	.	H	α-helix	trans	-71.1	-48.3	175.1	-71.6	166.9	0	0	0	111	K797 K798 Q803 S804 H805	K797-L801 HydrophobicContact CG-CD1 4.15Å; K797-L801 VanDerWaalsContact O-CG 3.31Å; K797-L801 WeakPolarHBondContact O-CG 3.27Å; K797-L801 PolarHBondContact O-N 2.94Å; K798-L801 WeakPolarHBondContact O-CB 3.29Å; K798-L801 PolarHBondContact O-N 2.87Å; L801-Q803 PolarHBondContact O-N 3.45Å; L801-S804 CarbonylContact O-C 3.5Å; L801-S804 WeakPolarHBondContact O-CA 3.23Å; L801-S804 WeakPolarHBondContact O-CB 3.25Å; L801-S804 PolarHBondContact O-N 2.96Å; L801-H805 PolarHBondContact O-N 3.47Å
802	E	82.4	Confident	79.5	Confident	90 Å²	90	73.1 Å²	73.1	42%	0.421	35%	0.346	S	S	.	.	H	α-helix	trans	-54.1	-51.1	175.5	-70.7	166.9	161.4	0	0	111.4	K798 T799 S804 H805 L806	K798-E802 WeakPolarHBondContact CE-OE1 3.38Å; K798-E802 HydrophobicContact CG-CG 4.32Å; K798-E802 WeakPolarHBondContact CG-OE1 3.33Å; K798-E802 IonicContact NZ-OE1 2.65Å; K798-E802 WeakPolarHBondContact O-CG 3.35Å; K798-E802 PolarHBondContact O-N 3.21Å; T799-E802 WeakPolarHBondContact CA-OE2 3.34Å; E802-S804 VanDerWaalsContact C-N 3.29Å; E802-S804 PolarHBondContact O-N 3.09Å; E802-H805 WeakPolarHBondContact O-CB 3.48Å; E802-H805 PolarHBondContact O-N 2.85Å; E802-H805 VanDerWaalsContact O-N 3.1Å; E802-L806 PolarHBondContact O-N 2.83Å; E802-L806 VanDerWaalsContact O-N 3.1Å
803	Q	81.4	Confident	78.7	Confident	66 Å²	66	73.5 Å²	73.5	31%	0.308	35%	0.351	S	S	.	.	H	α-helix	trans	-62.2	-36.3	175.4	-174.2	63.3	56.4	0	0	112.3	L769 T799 L801 H805 D807	L769-Q803 HydrophobicContact CD1-CB 3.77Å; L769-Q803 HydrophobicContact CD1-CG 3.85Å; T799-Q803 WeakPolarHBondContact O-CB 3.34Å; T799-Q803 PolarHBondContact O-N 3.36Å; T799-Q803 VanDerWaalsContact O-N 3.1Å; L801-Q803 PolarHBondContact O-N 3.45Å; Q803-H805 VanDerWaalsContact C-N 3.25Å; Q803-H805 PolarHBondContact O-N 3.39Å; Q803-D807 PolarHBondContact NE2-OD1 3.26Å; Q803-D807 WeakPolarHBondContact O-CB 3.19Å; Q803-D807 PolarHBondContact O-N 2.92Å
804	S	74.3	Confident	78.1	Confident	12 Å²	12	76.1 Å²	76.1	8%	0.084	36%	0.363	C	S	.	.	H	α-helix	trans	-70.6	-19	176.9	-64.4	0	0	0	0	113.6	R766 L800 L801 E802 Q808	R766-S804 PolarHBondContact NE-OG 2.9Å; R766-S804 PolarHBondContact NH2-OG 3.22Å; R766-S804 VanDerWaalsContact NH2-OG 3.08Å; L800-S804 VanDerWaalsContact O-CB 3.29Å; L800-S804 WeakPolarHBondContact O-CB 3.43Å; L800-S804 PolarHBondContact O-N 3.47Å; L800-S804 VanDerWaalsContact O-N 3.11Å; L800-S804 PolarHBondContact O-OG 3.26Å; L801-S804 CarbonylContact O-C 3.5Å; L801-S804 WeakPolarHBondContact O-CA 3.23Å; L801-S804 WeakPolarHBondContact O-CB 3.25Å; L801-S804 PolarHBondContact O-N 2.96Å; E802-S804 VanDerWaalsContact C-N 3.29Å; E802-S804 PolarHBondContact O-N 3.09Å; S804-Q808 WeakPolarHBondContact O-CG 3.22Å; S804-Q808 PolarHBondContact O-N 3.36Å; S804-Q808 PolarHBondContact O-NE2 3.21Å
805	H	71.9	Confident	77.3	Confident	72 Å²	72	76.1 Å²	76.1	33%	0.333	37%	0.366	S	S	.	.	H	α-helix	trans	-80.4	-50.1	172.7	-149.7	-88	0	0	0	110.5	L801 E802 Q803 D807 Q808 E809	L801-H805 PolarHBondContact O-N 3.47Å; E802-H805 WeakPolarHBondContact O-CB 3.48Å; E802-H805 PolarHBondContact O-N 2.85Å; E802-H805 VanDerWaalsContact O-N 3.1Å; Q803-H805 VanDerWaalsContact C-N 3.25Å; Q803-H805 PolarHBondContact O-N 3.39Å; H805-D807 VanDerWaalsContact C-N 3.3Å; H805-D807 PolarHBondContact O-N 3.49Å; H805-Q808 WeakPolarHBondContact O-CA 3.35Å; H805-Q808 WeakPolarHBondContact O-CB 3.19Å; H805-Q808 PolarHBondContact O-N 2.78Å; H805-E809 IonicContact CE1-OE1 3.13Å; H805-E809 PolarHBondContact CE1-OE1 3.42Å; H805-E809 IonicContact CG-OE1 2.67Å; H805-E809 IonicContact ND1-OE1 2.78Å; H805-E809 PolarHBondContact ND1-OE1 3.19Å; H805-E809 PolarHBondContact O-N 2.86Å
806	L	76.4	Confident	76.4	Confident	90 Å²	90	75.1 Å²	75.1	47%	0.471	35%	0.354	S	S	.	.	H	α-helix	trans	-60	-36.7	175.8	-65.2	172.1	0	0	0	113	E802 Q808 R810	E802-L806 PolarHBondContact O-N 2.83Å; E802-L806 VanDerWaalsContact O-N 3.1Å; L806-Q808 VanDerWaalsContact C-N 3.34Å; L806-R810 WeakPolarHBondContact O-CB 3.32Å; L806-R810 PolarHBondContact O-N 3.1Å
807	D	73.9	Confident	75.9	Confident	45 Å²	45	78.5 Å²	78.5	24%	0.241	37%	0.367	C	S	.	.	H	α-helix	trans	-65.5	-37	172.7	-76.5	-3.5	0	0	0	111.4	Q803 H805 I811	Q803-D807 PolarHBondContact NE2-OD1 3.26Å; Q803-D807 WeakPolarHBondContact O-CB 3.19Å; Q803-D807 PolarHBondContact O-N 2.92Å; H805-D807 VanDerWaalsContact C-N 3.3Å; H805-D807 PolarHBondContact O-N 3.49Å; D807-I811 WeakPolarHBondContact O-CD1 3.45Å; D807-I811 VanDerWaalsContact O-CG1 3.26Å; D807-I811 WeakPolarHBondContact O-CG1 3.44Å; D807-I811 PolarHBondContact O-N 2.8Å
808	Q	70.3	Confident	75.3	Confident	56 Å²	56	76.5 Å²	76.5	26%	0.262	36%	0.358	S	S	.	.	H	α-helix	trans	-72.3	-46.4	178.2	-88.6	178.3	74.3	0	0	112.7	S804 H805 L806 R810 I811 Y812	S804-Q808 WeakPolarHBondContact O-CG 3.22Å; S804-Q808 PolarHBondContact O-N 3.36Å; S804-Q808 PolarHBondContact O-NE2 3.21Å; H805-Q808 WeakPolarHBondContact O-CA 3.35Å; H805-Q808 WeakPolarHBondContact O-CB 3.19Å; H805-Q808 PolarHBondContact O-N 2.78Å; L806-Q808 VanDerWaalsContact C-N 3.34Å; Q808-R810 VanDerWaalsContact C-N 3.27Å; Q808-R810 PolarHBondContact O-N 3.04Å; Q808-I811 WeakPolarHBondContact O-CB 3.45Å; Q808-I811 PolarHBondContact O-N 2.89Å; Q808-I811 VanDerWaalsContact O-N 3.1Å; Q808-Y812 HydrophobicContact CB-CD2 4.44Å; Q808-Y812 HydrophobicContact CB-CE2 3.86Å; Q808-Y812 HydrophobicContact CG-CE2 4.33Å; Q808-Y812 WeakPolarHBondContact O-CD2 3.34Å; Q808-Y812 PolarHBondContact O-N 3.27Å; Q808-Y812 PolarHBondContact OE1-OH 3.09Å
809	E	71.4	Confident	74.7	Confident	97 Å²	97	73 Å²	73	45%	0.453	34%	0.343	S	S	.	.	H	α-helix	trans	-53.9	-46.2	175.6	-73.9	166.9	-151.9	0	0	111.4	H805 I811 Y812 E813	H805-E809 IonicContact CE1-OE1 3.13Å; H805-E809 PolarHBondContact CE1-OE1 3.42Å; H805-E809 IonicContact CG-OE1 2.67Å; H805-E809 IonicContact ND1-OE1 2.78Å; H805-E809 PolarHBondContact ND1-OE1 3.19Å; H805-E809 PolarHBondContact O-N 2.86Å; E809-I811 VanDerWaalsContact C-N 3.34Å; E809-I811 PolarHBondContact O-N 2.92Å; E809-Y812 PolarHBondContact O-N 3.46Å; E809-E813 PolarHBondContact O-N 2.88Å
810	R	72.9	Confident	74.1	Confident	129 Å²	129	74.3 Å²	74.3	49%	0.487	35%	0.35	S	S	.	.	H	α-helix	trans	-59.8	-42.6	176.6	-166.9	-176.5	-51.1	-176.7	7.2	112.3	L806 Q808 E813 E814	L806-R810 WeakPolarHBondContact O-CB 3.32Å; L806-R810 PolarHBondContact O-N 3.1Å; Q808-R810 VanDerWaalsContact C-N 3.27Å; Q808-R810 PolarHBondContact O-N 3.04Å; R810-E813 PolarHBondContact O-N 3.33Å; R810-E814 WeakPolarHBondContact O-CB 3.3Å; R810-E814 WeakPolarHBondContact O-CG 3.29Å; R810-E814 PolarHBondContact O-N 3.35Å
811	I	74.3	Confident	73.8	Confident	88 Å²	88	77.2 Å²	77.2	45%	0.451	36%	0.363	S	S	.	.	H	α-helix	trans	-63.7	-42.2	176.3	-71	164.3	0	0	0	110.8	D807 Q808 E809 E814 L815	D807-I811 WeakPolarHBondContact O-CD1 3.45Å; D807-I811 VanDerWaalsContact O-CG1 3.26Å; D807-I811 WeakPolarHBondContact O-CG1 3.44Å; D807-I811 PolarHBondContact O-N 2.8Å; Q808-I811 WeakPolarHBondContact O-CB 3.45Å; Q808-I811 PolarHBondContact O-N 2.89Å; Q808-I811 VanDerWaalsContact O-N 3.1Å; E809-I811 VanDerWaalsContact C-N 3.34Å; E809-I811 PolarHBondContact O-N 2.92Å; I811-E814 PolarHBondContact O-N 3.47Å; I811-L815 HydrophobicContact CG2-CD1 3.93Å; I811-L815 WeakPolarHBondContact O-CB 3.42Å; I811-L815 VanDerWaalsContact O-CG 3.26Å; I811-L815 WeakPolarHBondContact O-CG 3.49Å; I811-L815 PolarHBondContact O-N 2.84Å
812	Y	68.2	Low	73.5	Confident	57 Å²	57	75.7 Å²	75.7	22%	0.224	36%	0.355	C	S	.	.	H	α-helix	trans	-70	-33.2	178.7	-60.2	-46.5	0	0	0	113	R563 Q808 E809 L815 R816	R563-Y812 HydrophobicContact CG-CD1 4.12Å; R563-Y812 HydrophobicContact CG-CD2 4.02Å; R563-Y812 HydrophobicContact CG-CE1 3.67Å; R563-Y812 HydrophobicContact CG-CE2 3.52Å; R563-Y812 HydrophobicContact CG-CG 4.33Å; R563-Y812 PolarHBondContact NE-OH 3Å; Q808-Y812 HydrophobicContact CB-CD2 4.44Å; Q808-Y812 HydrophobicContact CB-CE2 3.86Å; Q808-Y812 HydrophobicContact CG-CE2 4.33Å; Q808-Y812 WeakPolarHBondContact O-CD2 3.34Å; Q808-Y812 PolarHBondContact O-N 3.27Å; Q808-Y812 PolarHBondContact OE1-OH 3.09Å; E809-Y812 PolarHBondContact O-N 3.46Å; Y812-L815 HydrophobicContact CD1-CD1 4.23Å; Y812-R816 WeakPolarHBondContact O-CB 3.42Å; Y812-R816 PolarHBondContact O-N 3.25Å
813	E	71.6	Confident	72.9	Confident	89 Å²	89	74.4 Å²	74.4	42%	0.416	35%	0.351	S	S	.	.	H	α-helix	trans	-74.2	-35.2	174.1	-174.1	153	-92.4	0	0	113.1	E809 R810 R816 K817	E809-E813 PolarHBondContact O-N 2.88Å; R810-E813 PolarHBondContact O-N 3.33Å; E813-R816 PolarHBondContact O-N 3.39Å; E813-R816 IonicContact OE1-NH1 3.49Å; E813-R816 PolarHBondContact OE1-NH1 3.4Å; E813-K817 HydrophobicContact CG-CD 4.47Å; E813-K817 WeakPolarHBondContact O-CG 3.36Å; E813-K817 PolarHBondContact O-N 3.03Å; E813-K817 IonicContact OE2-NZ 3.63Å
814	E	74	Confident	72.8	Confident	64 Å²	64	76.8 Å²	76.8	30%	0.299	36%	0.362	S	S	.	.	H	α-helix	trans	-64.1	-40.8	169.9	-74.8	177.1	175.5	0	0	111.4	R762 R810 I811 K817 K818	R762-E814 IonicContact CZ-OE1 2.72Å; R762-E814 IonicContact NH1-OE1 3.99Å; R762-E814 PolarHBondContact NH1-OE1 2.87Å; R762-E814 IonicContact NH1-OE2 2.85Å; R762-E814 PolarHBondContact NH1-OE2 3.49Å; R762-E814 IonicContact NH2-OE1 3.11Å; R762-E814 PolarHBondContact NH2-OE1 3.39Å; R810-E814 WeakPolarHBondContact O-CB 3.3Å; R810-E814 WeakPolarHBondContact O-CG 3.29Å; R810-E814 PolarHBondContact O-N 3.35Å; I811-E814 PolarHBondContact O-N 3.47Å; E814-K817 PolarHBondContact O-N 2.73Å; E814-K818 WeakPolarHBondContact O-CG 3.42Å; E814-K818 PolarHBondContact O-N 3.24Å
815	L	69.8	Low	73	Confident	89 Å²	89	77.6 Å²	77.6	47%	0.466	37%	0.366	S	S	.	.	H	α-helix	trans	-65.3	-37.7	172.7	-73.6	167.9	0	0	0	112.7	I811 Y812 K819	I811-L815 HydrophobicContact CG2-CD1 3.93Å; I811-L815 WeakPolarHBondContact O-CB 3.42Å; I811-L815 VanDerWaalsContact O-CG 3.26Å; I811-L815 WeakPolarHBondContact O-CG 3.49Å; I811-L815 PolarHBondContact O-N 2.84Å; Y812-L815 HydrophobicContact CD1-CD1 4.23Å; L815-K819 PolarHBondContact O-N 3.03Å
816	R	69.3	Low	73.3	Confident	90 Å²	90	79.5 Å²	79.5	34%	0.34	38%	0.376	S	S	.	.	H	α-helix	trans	-61.6	-47.1	175.3	-171.1	-168.6	-66.1	141.8	-4	111.1	S565 Y812 E813 K819 V820	S565-R816 PolarHBondContact OG-NE 2.79Å; S565-R816 PolarHBondContact OG-NH2 2.97Å; Y812-R816 WeakPolarHBondContact O-CB 3.42Å; Y812-R816 PolarHBondContact O-N 3.25Å; E813-R816 PolarHBondContact O-N 3.39Å; E813-R816 IonicContact OE1-NH1 3.49Å; E813-R816 PolarHBondContact OE1-NH1 3.4Å; R816-K819 PolarHBondContact O-N 3.33Å; R816-V820 PolarHBondContact O-N 3.06Å; R816-V820 VanDerWaalsContact O-N 3.08Å
817	K	73	Confident	73.4	Confident	112 Å²	112	79.9 Å²	79.9	49%	0.487	38%	0.376	S	S	.	.	H	α-helix	trans	-61	-51.1	177.3	-71.8	167	-176.1	164.6	0	111.3	E813 E814 K819 V820 E821	E813-K817 HydrophobicContact CG-CD 4.47Å; E813-K817 WeakPolarHBondContact O-CG 3.36Å; E813-K817 PolarHBondContact O-N 3.03Å; E813-K817 IonicContact OE2-NZ 3.63Å; E814-K817 PolarHBondContact O-N 2.73Å; K817-K819 PolarHBondContact O-N 2.9Å; K817-V820 PolarHBondContact O-N 3.41Å; K817-E821 WeakPolarHBondContact O-CG 3.12Å; K817-E821 PolarHBondContact O-N 3.02Å
818	K	73.3	Confident	73.8	Confident	45 Å²	45	83.2 Å²	83.2	20%	0.196	39%	0.385	C	S	.	.	H	α-helix	trans	-55.7	-35.6	175	-74.5	-171.7	174.9	-165.6	0	113.5	L755 E814 L822	L755-K818 HydrophobicContact CD2-CB 4.19Å; L755-K818 HydrophobicContact CD2-CD 3.78Å; L755-K818 HydrophobicContact CD2-CG 3.71Å; L755-K818 PolarHBondContact O-NZ 3.36Å; E814-K818 WeakPolarHBondContact O-CG 3.42Å; E814-K818 PolarHBondContact O-N 3.24Å; K818-L822 WeakPolarHBondContact O-CB 3.27Å; K818-L822 VanDerWaalsContact O-CG 3.29Å; K818-L822 WeakPolarHBondContact O-CG 3.36Å; K818-L822 PolarHBondContact O-N 3.04Å
819	K	70.8	Confident	74.3	Confident	54 Å²	54	82.3 Å²	82.3	24%	0.235	38%	0.381	C	S	.	.	H	α-helix	trans	-70.4	-44.1	174.7	-167.5	-175.5	174.6	-170.7	0	112.2	Y566 L815 R816 K817 E821 L822 D823	Y566-K819 HydrophobicContact CD2-CD 4.02Å; Y566-K819 HydrophobicContact CG-CD 4.32Å; Y566-K819 PolarHBondContact O-NZ 2.99Å; L815-K819 PolarHBondContact O-N 3.03Å; R816-K819 PolarHBondContact O-N 3.33Å; K817-K819 PolarHBondContact O-N 2.9Å; K819-E821 PolarHBondContact O-N 2.61Å; K819-L822 PolarHBondContact O-N 2.93Å; K819-L822 VanDerWaalsContact O-N 3.11Å; K819-D823 VanDerWaalsContact CE-OD1 3.28Å; K819-D823 WeakPolarHBondContact CE-OD1 3.22Å; K819-D823 WeakPolarHBondContact CE-OD2 3.41Å; K819-D823 IonicContact NZ-OD2 3.86Å; K819-D823 WeakPolarHBondContact O-CB 3.2Å; K819-D823 PolarHBondContact O-N 3.29Å
820	V	73.4	Confident	74.8	Confident	74 Å²	74	82.7 Å²	82.7	45%	0.448	38%	0.382	S	S	.	.	H	α-helix	trans	-59.6	-40.3	177.3	174.1	0	0	0	0	110.8	R816 K817 Q824	R816-V820 PolarHBondContact O-N 3.06Å; R816-V820 VanDerWaalsContact O-N 3.08Å; K817-V820 PolarHBondContact O-N 3.41Å; V820-Q824 HydrophobicContact CG1-CG 4.48Å; V820-Q824 VanDerWaalsContact O-CB 3.31Å; V820-Q824 WeakPolarHBondContact O-CB 3.26Å; V820-Q824 WeakPolarHBondContact O-CG 3.45Å; V820-Q824 PolarHBondContact O-N 2.86Å
821	E	77.5	Confident	75.2	Confident	91 Å²	91	79.2 Å²	79.2	43%	0.425	38%	0.381	S	S	.	.	H	α-helix	trans	-60.9	-45.1	172.5	-68	155.9	-162.6	0	0	112.1	K817 K819 N825	K817-E821 WeakPolarHBondContact O-CG 3.12Å; K817-E821 PolarHBondContact O-N 3.02Å; K819-E821 PolarHBondContact O-N 2.61Å; E821-N825 WeakPolarHBondContact O-CB 3.44Å; E821-N825 VanDerWaalsContact O-CG 3.24Å; E821-N825 PolarHBondContact O-N 3.45Å; E821-N825 PolarHBondContact O-OD1 3Å
822	L	73.3	Confident	75.6	Confident	80 Å²	80	78.3 Å²	78.3	42%	0.419	37%	0.374	S	S	.	.	H	α-helix	trans	-66.5	-44.3	176.8	-78.2	167.3	0	0	0	113.5	L755 K818 K819 Q824 N825 M826	L755-L822 HydrophobicContact CD1-CD1 4.42Å; L755-L822 HydrophobicContact CD1-CD2 3.67Å; L755-L822 HydrophobicContact CD1-CG 3.99Å; K818-L822 WeakPolarHBondContact O-CB 3.27Å; K818-L822 VanDerWaalsContact O-CG 3.29Å; K818-L822 WeakPolarHBondContact O-CG 3.36Å; K818-L822 PolarHBondContact O-N 3.04Å; K819-L822 PolarHBondContact O-N 2.93Å; K819-L822 VanDerWaalsContact O-N 3.11Å; L822-Q824 VanDerWaalsContact C-N 3.32Å; L822-Q824 PolarHBondContact O-N 3Å; L822-N825 PolarHBondContact O-N 3.06Å; L822-M826 VanDerWaalsContact O-CB 3.31Å; L822-M826 WeakPolarHBondContact O-CB 3.4Å; L822-M826 PolarHBondContact O-N 2.68Å
823	D	71.1	Confident	76.3	Confident	62 Å²	62	79.6 Å²	79.6	33%	0.332	38%	0.384	S	S	.	.	H	α-helix	trans	-63.7	-39.9	177.6	-73.2	-8.8	0	0	0	110	K819 M826 E827	K819-D823 VanDerWaalsContact CE-OD1 3.28Å; K819-D823 WeakPolarHBondContact CE-OD1 3.22Å; K819-D823 WeakPolarHBondContact CE-OD2 3.41Å; K819-D823 IonicContact NZ-OD2 3.86Å; K819-D823 WeakPolarHBondContact O-CB 3.2Å; K819-D823 PolarHBondContact O-N 3.29Å; D823-M826 PolarHBondContact O-N 3.46Å; D823-E827 PolarHBondContact O-N 2.54Å
824	Q	78.7	Confident	76.8	Confident	116 Å²	116	78.9 Å²	78.9	54%	0.542	38%	0.382	S	S	.	.	H	α-helix	trans	-67.5	-41	173.8	-74.8	175.8	5.7	0	0	113.1	V820 L822 M826 R828	V820-Q824 HydrophobicContact CG1-CG 4.48Å; V820-Q824 VanDerWaalsContact O-CB 3.31Å; V820-Q824 WeakPolarHBondContact O-CB 3.26Å; V820-Q824 WeakPolarHBondContact O-CG 3.45Å; V820-Q824 PolarHBondContact O-N 2.86Å; L822-Q824 VanDerWaalsContact C-N 3.32Å; L822-Q824 PolarHBondContact O-N 3Å; Q824-M826 VanDerWaalsContact C-N 3.34Å; Q824-R828 WeakPolarHBondContact O-CB 3.42Å; Q824-R828 PolarHBondContact O-N 3.15Å
825	N	78.6	Confident	77.2	Confident	30 Å²	30	82.3 Å²	82.3	16%	0.16	40%	0.398	C	S	.	.	H	α-helix	trans	-67	-37.1	175.7	-74.2	10.2	0	0	0	111.1	D751 E821 L822 R828 I829	D751-N825 PolarHBondContact OD2-ND2 3.35Å; E821-N825 WeakPolarHBondContact O-CB 3.44Å; E821-N825 VanDerWaalsContact O-CG 3.24Å; E821-N825 PolarHBondContact O-N 3.45Å; E821-N825 PolarHBondContact O-OD1 3Å; L822-N825 PolarHBondContact O-N 3.06Å; N825-R828 VanDerWaalsContact CG-NH1 3.34Å; N825-R828 PolarHBondContact O-N 2.89Å; N825-R828 VanDerWaalsContact OD1-CZ 3.26Å; N825-R828 PolarHBondContact OD1-NH1 2.83Å; N825-R828 PolarHBondContact OD1-NH2 3.25Å; N825-I829 WeakPolarHBondContact O-CB 3.33Å; N825-I829 VanDerWaalsContact O-CG1 3.28Å; N825-I829 WeakPolarHBondContact O-CG1 3.47Å; N825-I829 PolarHBondContact O-N 2.94Å
826	M	77.2	Confident	77.9	Confident	112 Å²	112	78.6 Å²	78.6	55%	0.552	38%	0.381	S	S	*	.	H	α-helix	trans	-64	-45.5	175.9	-178	174.2	62.4	0	0	112	L822 D823 Q824 I829 K830	L822-M826 VanDerWaalsContact O-CB 3.31Å; L822-M826 WeakPolarHBondContact O-CB 3.4Å; L822-M826 PolarHBondContact O-N 2.68Å; D823-M826 PolarHBondContact O-N 3.46Å; Q824-M826 VanDerWaalsContact C-N 3.34Å; M826-I829 PolarHBondContact O-N 2.92Å; M826-K830 VanDerWaalsContact O-CB 3.29Å; M826-K830 WeakPolarHBondContact O-CB 3.4Å; M826-K830 PolarHBondContact O-N 3.03Å
827	E	79	Confident	78.5	Confident	97 Å²	97	77.5 Å²	77.5	45%	0.453	38%	0.379	S	S	.	.	H	α-helix	trans	-67.7	-34.5	175.1	-75.4	-63.9	157.5	0	0	112.4	D823 K830 A831	D823-E827 PolarHBondContact O-N 2.54Å; E827-K830 PolarHBondContact O-N 3.38Å; E827-K830 IonicContact OE1-NZ 2.73Å; E827-K830 PolarHBondContact OE1-NZ 3.4Å; E827-K830 IonicContact OE2-NZ 2.61Å; E827-K830 PolarHBondContact OE2-NZ 3.13Å; E827-A831 WeakPolarHBondContact O-CB 3.26Å; E827-A831 PolarHBondContact O-N 2.96Å
828	R	82	Confident	78.9	Confident	115 Å²	115	76 Å²	76	43%	0.434	37%	0.374	S	S	.	.	H	α-helix	trans	-62.9	-45.6	172.3	-166.7	-170.3	-49.3	112	14.4	112.1	Q824 N825 K830 A831 Q832	Q824-R828 WeakPolarHBondContact O-CB 3.42Å; Q824-R828 PolarHBondContact O-N 3.15Å; N825-R828 VanDerWaalsContact CG-NH1 3.34Å; N825-R828 PolarHBondContact O-N 2.89Å; N825-R828 VanDerWaalsContact OD1-CZ 3.26Å; N825-R828 PolarHBondContact OD1-NH1 2.83Å; N825-R828 PolarHBondContact OD1-NH2 3.25Å; R828-K830 VanDerWaalsContact C-N 3.34Å; R828-A831 PolarHBondContact O-N 2.97Å; R828-Q832 WeakPolarHBondContact O-CG 3.31Å; R828-Q832 PolarHBondContact O-N 3.28Å
829	I	81.5	Confident	79.4	Confident	37 Å²	37	76.5 Å²	76.5	19%	0.19	38%	0.383	C	S	.	.	H	α-helix	trans	-66.7	-37.5	178.3	-72.3	167.6	0	0	0	110.8	I744 L748 N825 M826 Q832 L833	I744-I829 HydrophobicContact CG2-CG2 3.92Å; L748-I829 HydrophobicContact CB-CD1 4.05Å; L748-I829 HydrophobicContact CD1-CD1 3.88Å; L748-I829 HydrophobicContact CG-CD1 4.44Å; N825-I829 WeakPolarHBondContact O-CB 3.33Å; N825-I829 VanDerWaalsContact O-CG1 3.28Å; N825-I829 WeakPolarHBondContact O-CG1 3.47Å; N825-I829 PolarHBondContact O-N 2.94Å; M826-I829 PolarHBondContact O-N 2.92Å; I829-Q832 PolarHBondContact O-N 2.88Å; I829-L833 WeakPolarHBondContact O-CB 3.33Å; I829-L833 PolarHBondContact O-N 2.78Å
830	K	80.5	Confident	80	Confident	106 Å²	106	76.1 Å²	76.1	46%	0.461	38%	0.381	S	S	.	.	H	α-helix	trans	-63.9	-40.3	173.1	173.3	169.6	154.1	-115.6	0	112	M826 E827 R828 L833 M834	M826-K830 VanDerWaalsContact O-CB 3.29Å; M826-K830 WeakPolarHBondContact O-CB 3.4Å; M826-K830 PolarHBondContact O-N 3.03Å; E827-K830 PolarHBondContact O-N 3.38Å; E827-K830 IonicContact OE1-NZ 2.73Å; E827-K830 PolarHBondContact OE1-NZ 3.4Å; E827-K830 IonicContact OE2-NZ 2.61Å; E827-K830 PolarHBondContact OE2-NZ 3.13Å; R828-K830 VanDerWaalsContact C-N 3.34Å; K830-L833 PolarHBondContact O-N 2.93Å; K830-M834 WeakPolarHBondContact O-CG 3.39Å; K830-M834 PolarHBondContact O-N 3.46Å; K830-M834 VanDerWaalsContact O-N 3.09Å
831	A	81.4	Confident	80.4	Confident	56 Å²	56	73.2 Å²	73.2	46%	0.463	36%	0.364	S	S	.	.	H	α-helix	trans	-63.8	-46.7	172.3	0	0	0	0	0	111.9	E827 R828 L833 M834 E835	E827-A831 WeakPolarHBondContact O-CB 3.26Å; E827-A831 PolarHBondContact O-N 2.96Å; R828-A831 PolarHBondContact O-N 2.97Å; A831-L833 VanDerWaalsContact C-N 3.29Å; A831-L833 PolarHBondContact O-N 3.03Å; A831-M834 PolarHBondContact O-N 3.38Å; A831-E835 WeakPolarHBondContact O-CB 3.43Å; A831-E835 PolarHBondContact O-N 3.42Å
832	Q	83.7	Confident	80.5	Confident	69 Å²	69	71.8 Å²	71.8	32%	0.322	36%	0.361	S	S	.	.	H	α-helix	trans	-62.2	-33.8	176.3	-72.1	174.7	-39.2	0	0	113	I744 R828 I829 A836	I744-Q832 HydrophobicContact CD1-CB 4.13Å; I744-Q832 HydrophobicContact CG1-CB 4.39Å; R828-Q832 WeakPolarHBondContact O-CG 3.31Å; R828-Q832 PolarHBondContact O-N 3.28Å; I829-Q832 PolarHBondContact O-N 2.88Å; Q832-A836 WeakPolarHBondContact O-CB 3.21Å; Q832-A836 PolarHBondContact O-N 3.49Å
833	L	82.8	Confident	80.8	Confident	83 Å²	83	72 Å²	72	44%	0.435	36%	0.36	S	S	.	.	H	α-helix	trans	-68.5	-42.2	174.9	-168.2	76.8	0	0	0	111.8	L741 I829 K830 A831 A836 E837	L741-L833 HydrophobicContact CD2-CD1 3.42Å; L741-L833 VanDerWaalsContact CD2-CD1 3.42Å; I829-L833 WeakPolarHBondContact O-CB 3.33Å; I829-L833 PolarHBondContact O-N 2.78Å; K830-L833 PolarHBondContact O-N 2.93Å; A831-L833 VanDerWaalsContact C-N 3.29Å; A831-L833 PolarHBondContact O-N 3.03Å; L833-A836 PolarHBondContact O-N 3.42Å; L833-E837 PolarHBondContact O-N 2.83Å
834	M	81.1	Confident	81.3	Confident	74 Å²	74	70.2 Å²	70.2	37%	0.365	35%	0.35	S	S	.	.	H	α-helix	trans	-64.2	-45.4	174	-70.4	-65.8	-52.9	0	0	111.2	K830 A831 A836 E837 E838	K830-M834 WeakPolarHBondContact O-CG 3.39Å; K830-M834 PolarHBondContact O-N 3.46Å; K830-M834 VanDerWaalsContact O-N 3.09Å; A831-M834 PolarHBondContact O-N 3.38Å; M834-A836 VanDerWaalsContact C-N 3.32Å; M834-A836 PolarHBondContact O-N 3.42Å; M834-E837 PolarHBondContact O-N 3.07Å; M834-E838 WeakPolarHBondContact O-CG 3.46Å; M834-E838 PolarHBondContact O-N 3.48Å
835	E	84.4	Confident	81.3	Confident	136 Å²	136	64.7 Å²	64.7	64%	0.636	32%	0.324	S	S	*	.	H	α-helix	trans	-59.2	-41	176.5	-175	175.3	-162.5	0	0	111.6	A831 S839	A831-E835 WeakPolarHBondContact O-CB 3.43Å; A831-E835 PolarHBondContact O-N 3.42Å; E835-S839 WeakPolarHBondContact O-CB 3.01Å; E835-S839 PolarHBondContact O-N 3.45Å
836	A	83.1	Confident	81.2	Confident	12 Å²	12	66.4 Å²	66.4	10%	0.099	34%	0.343	C	S	.	.	H	α-helix	trans	-67.7	-38.1	174.5	0	0	0	0	0	113.3	Y737 I744 Q832 L833 M834 F840	Y737-A836 HydrophobicContact CD2-CB 4.46Å; Y737-A836 HydrophobicContact CE2-CB 4.24Å; I744-A836 HydrophobicContact CD1-CB 4.43Å; Q832-A836 WeakPolarHBondContact O-CB 3.21Å; Q832-A836 PolarHBondContact O-N 3.49Å; L833-A836 PolarHBondContact O-N 3.42Å; M834-A836 VanDerWaalsContact C-N 3.32Å; M834-A836 PolarHBondContact O-N 3.42Å; A836-F840 WeakPolarHBondContact O-CB 3.19Å; A836-F840 PolarHBondContact O-N 3.38Å
837	E	81.8	Confident	81.2	Confident	67 Å²	67	63.2 Å²	63.2	31%	0.313	33%	0.33	S	S	.	.	H	α-helix	trans	-67.8	-43.4	174.3	-171.5	177.8	164.3	0	0	111.4	K712 L833 M834 F840 I841	K712-E837 IonicContact NZ-OE1 2.67Å; K712-E837 PolarHBondContact NZ-OE1 3.33Å; L833-E837 PolarHBondContact O-N 2.83Å; M834-E837 PolarHBondContact O-N 3.07Å; E837-F840 PolarHBondContact O-N 3.01Å; E837-I841 HydrophobicContact CG-CD1 3.87Å; E837-I841 HydrophobicContact CG-CG1 4.5Å; E837-I841 WeakPolarHBondContact O-CB 3.45Å; E837-I841 VanDerWaalsContact O-CG1 3.27Å; E837-I841 WeakPolarHBondContact O-CG1 3.19Å; E837-I841 PolarHBondContact O-N 2.87Å
838	E	81.1	Confident	81	Confident	79 Å²	79	59.1 Å²	59.1	37%	0.369	31%	0.312	S	S	.	.	H	α-helix	trans	-69.3	-37.1	179	-68.9	-172.7	164.3	0	0	112.1	S705 M834 I841 T842	S705-E838 WeakPolarHBondContact CB-OE1 3.42Å; S705-E838 PolarHBondContact OG-OE1 2.78Å; M834-E838 WeakPolarHBondContact O-CG 3.46Å; M834-E838 PolarHBondContact O-N 3.48Å; E838-I841 PolarHBondContact O-N 2.85Å; E838-T842 WeakPolarHBondContact O-CB 3.47Å; E838-T842 WeakPolarHBondContact O-CG2 3.13Å; E838-T842 PolarHBondContact O-N 3.29Å; E838-T842 PolarHBondContact O-OG1 3.33Å
839	S	83.8	Confident	80.5	Confident	56 Å²	56	61.9 Å²	61.9	39%	0.392	32%	0.322	S	S	.	.	H	α-helix	trans	-61.2	-50	170.7	-172.2	0	0	0	0	111.4	E835 I841 T842 E843	E835-S839 WeakPolarHBondContact O-CB 3.01Å; E835-S839 PolarHBondContact O-N 3.45Å; S839-I841 VanDerWaalsContact C-N 3.34Å; S839-I841 PolarHBondContact O-N 3.39Å; S839-T842 WeakPolarHBondContact CA-OG1 3.48Å; S839-T842 PolarHBondContact O-N 3Å; S839-T842 PolarHBondContact O-OG1 2.98Å; S839-T842 VanDerWaalsContact O-OG1 3.06Å; S839-E843 PolarHBondContact O-N 3.19Å
840	F	83.6	Confident	79.8	Confident	46 Å²	46	61.5 Å²	61.5	20%	0.202	32%	0.322	C	S	.	.	H	α-helix	trans	-60	-41.3	177.1	177.1	-98.6	0	0	0	112.7	L733 V734 Y737 A836 E837 L844	L733-F840 HydrophobicContact CB-CE2 4.24Å; L733-F840 HydrophobicContact CD2-CD2 4.09Å; L733-F840 HydrophobicContact CD2-CE2 4.02Å; L733-F840 HydrophobicContact CG-CE2 4.5Å; V734-F840 HydrophobicContact CG2-CE2 4.16Å; V734-F840 HydrophobicContact CG2-CZ 4.29Å; Y737-F840 HydrophobicContact CD2-CB 3.84Å; Y737-F840 HydrophobicContact CD2-CD2 4.42Å; Y737-F840 HydrophobicContact CD2-CG 4.2Å; Y737-F840 HydrophobicContact CE2-CB 4.31Å; Y737-F840 HydrophobicContact CG-CB 4.28Å; Y737-F840 AromaticContact CG-CD2 4Å; Y737-F840 HydrophobicContact CG-CD2 4Å; Y737-F840 HydrophobicContact CG-CG 4.16Å; A836-F840 WeakPolarHBondContact O-CB 3.19Å; A836-F840 PolarHBondContact O-N 3.38Å; E837-F840 PolarHBondContact O-N 3.01Å; F840-L844 HydrophobicContact CE1-CD2 4.06Å; F840-L844 HydrophobicContact CZ-CD2 4.28Å; F840-L844 WeakPolarHBondContact O-CB 3.44Å; F840-L844 PolarHBondContact O-N 3.18Å
841	I	81.6	Confident	78.8	Confident	14 Å²	14	60.4 Å²	60.4	7%	0.072	33%	0.328	C	S	.	.	H	α-helix	trans	-66.8	-41.8	177.4	-71.9	171.1	0	0	0	111.5	L715 E837 E838 S839 A845	L715-I841 HydrophobicContact CD2-CG2 4.22Å; E837-I841 HydrophobicContact CG-CD1 3.87Å; E837-I841 HydrophobicContact CG-CG1 4.5Å; E837-I841 WeakPolarHBondContact O-CB 3.45Å; E837-I841 VanDerWaalsContact O-CG1 3.27Å; E837-I841 WeakPolarHBondContact O-CG1 3.19Å; E837-I841 PolarHBondContact O-N 2.87Å; E838-I841 PolarHBondContact O-N 2.85Å; S839-I841 VanDerWaalsContact C-N 3.34Å; S839-I841 PolarHBondContact O-N 3.39Å; I841-A845 WeakPolarHBondContact O-CB 3.49Å; I841-A845 PolarHBondContact O-N 3.3Å
842	T	80.9	Confident	77.6	Confident	61 Å²	61	59.2 Å²	59.2	37%	0.374	31%	0.314	S	S	.	.	H	α-helix	trans	-71.9	-40.3	-179.5	50.1	0	0	0	0	112.8	E838 S839 A846 V852	E838-T842 WeakPolarHBondContact O-CB 3.47Å; E838-T842 WeakPolarHBondContact O-CG2 3.13Å; E838-T842 PolarHBondContact O-N 3.29Å; E838-T842 PolarHBondContact O-OG1 3.33Å; S839-T842 WeakPolarHBondContact CA-OG1 3.48Å; S839-T842 PolarHBondContact O-N 3Å; S839-T842 PolarHBondContact O-OG1 2.98Å; S839-T842 VanDerWaalsContact O-OG1 3.06Å; T842-A846 WeakPolarHBondContact O-CB 3.41Å; T842-A846 PolarHBondContact O-N 2.69Å; T842-V852 HydrophobicContact CG2-CG1 4.38Å; T842-V852 HydrophobicContact CG2-CG2 4.28Å
843	E	80	Confident	76.2	Confident	84 Å²	84	63.3 Å²	63.3	39%	0.393	33%	0.333	S	S	.	.	H	α-helix	trans	-64.7	-42.9	171.8	-71.8	-160.5	156.6	0	0	112.1	L733 S839 A845 A846 V847	L733-E843 HydrophobicContact CD1-CB 4.17Å; L733-E843 HydrophobicContact CD2-CB 3.97Å; L733-E843 HydrophobicContact CG-CB 4.29Å; S839-E843 PolarHBondContact O-N 3.19Å; E843-A845 VanDerWaalsContact C-N 3.31Å; E843-A845 PolarHBondContact O-N 2.79Å; E843-A846 PolarHBondContact O-N 3.3Å; E843-A846 VanDerWaalsContact O-N 3.15Å; E843-V847 WeakPolarHBondContact O-CG2 3.33Å; E843-V847 PolarHBondContact O-N 2.67Å
844	L	81.3	Confident	74.2	Confident	25 Å²	25	64.6 Å²	64.6	13%	0.131	35%	0.349	C	S	.	.	H	α-helix	trans	-62	-41.5	179.5	179.9	59	0	0	0	111.1	L715 L725 L730 L733 F840 A848	L715-L844 HydrophobicContact CD2-CB 4.39Å; L715-L844 HydrophobicContact CD2-CD2 4.14Å; L715-L844 HydrophobicContact CD2-CG 4.16Å; L725-L844 HydrophobicContact CD1-CD1 3.78Å; L730-L844 HydrophobicContact CD1-CD1 4.13Å; L733-L844 HydrophobicContact CD2-CB 3.73Å; L733-L844 HydrophobicContact CD2-CD1 4.29Å; F840-L844 HydrophobicContact CE1-CD2 4.06Å; F840-L844 HydrophobicContact CZ-CD2 4.28Å; F840-L844 WeakPolarHBondContact O-CB 3.44Å; F840-L844 PolarHBondContact O-N 3.18Å; L844-A848 WeakPolarHBondContact O-CB 3.49Å; L844-A848 PolarHBondContact O-N 2.82Å
845	A	78	Confident	72.2	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-64.8	-41.2	173.6	0	0	0	0	0	112.5	L715 I841 E843 A848 R849 V850 V852	L715-A845 HydrophobicContact CD1-CB 3.99Å; L715-A845 HydrophobicContact CD2-CB 4.22Å; L715-A845 HydrophobicContact CG-CB 4.43Å; I841-A845 WeakPolarHBondContact O-CB 3.49Å; I841-A845 PolarHBondContact O-N 3.3Å; E843-A845 VanDerWaalsContact C-N 3.31Å; E843-A845 PolarHBondContact O-N 2.79Å; A845-A848 CarbonylContact O-C 3.51Å; A845-A848 PolarHBondContact O-N 2.99Å; A845-R849 WeakPolarHBondContact O-CA 3.47Å; A845-R849 PolarHBondContact O-N 3.06Å; A845-V850 PolarHBondContact O-N 3.02Å; A845-V852 HydrophobicContact CB-CG2 3.18Å
846	A	77.5	Confident	70	Confident	66 Å²	66	67.3 Å²	67.3	55%	0.545	38%	0.383	S	S	.	.	H	α-helix	trans	-63.6	-41	177.2	0	0	0	0	0	112.4	T842 E843 R849	T842-A846 WeakPolarHBondContact O-CB 3.41Å; T842-A846 PolarHBondContact O-N 2.69Å; E843-A846 PolarHBondContact O-N 3.3Å; E843-A846 VanDerWaalsContact O-N 3.15Å; A846-R849 PolarHBondContact O-N 3.21Å; A846-R849 VanDerWaalsContact O-N 3.13Å
847	V	76.6	Confident	67.7	Low	45 Å²	45	76 Å²	76	27%	0.273	42%	0.422	S	S	.	.	H	α-helix	trans	-68.4	-36.4	174	176.9	0	0	0	0	111.5	L725 L733 E843 R849	L725-V847 HydrophobicContact CB-CG1 4.44Å; L725-V847 HydrophobicContact CD1-CG1 4.07Å; L725-V847 HydrophobicContact CG-CG1 4.26Å; L733-V847 HydrophobicContact CD1-CG2 4.23Å; E843-V847 WeakPolarHBondContact O-CG2 3.33Å; E843-V847 PolarHBondContact O-N 2.67Å; V847-R849 PolarHBondContact O-N 3.22Å
848	A	75	Confident	65.7	Low	10 Å²	10	82.8 Å²	82.8	8%	0.083	45%	0.45	C	S	.	.	H	α-helix	trans	-73.3	-11.5	171.1	0	0	0	0	0	113.8	L844 A845 V850	L844-A848 WeakPolarHBondContact O-CB 3.49Å; L844-A848 PolarHBondContact O-N 2.82Å; A845-A848 CarbonylContact O-C 3.51Å; A845-A848 PolarHBondContact O-N 2.99Å; A848-V850 VanDerWaalsContact C-N 3.29Å; A848-V850 HydrophobicContact CB-CG2 4.01Å; A848-V850 PolarHBondContact O-N 3.11Å
849	R	71.6	Confident	63.4	Low	173 Å²	173	84.5 Å²	84.5	65%	0.653	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	33.2	-171.4	-59	-176.8	176.1	174.6	1.2	114.6	Y724 A845 A846 V847	Y724-R849 PolarHBondContact OH-NH1 3.04Å; A845-R849 WeakPolarHBondContact O-CA 3.47Å; A845-R849 PolarHBondContact O-N 3.06Å; A846-R849 PolarHBondContact O-N 3.21Å; A846-R849 VanDerWaalsContact O-N 3.13Å; V847-R849 PolarHBondContact O-N 3.22Å
850	V	66.3	Low	60.8	Low	29 Å²	29	87.4 Å²	87.4	18%	0.176	49%	0.491	C	S	.	.			trans	-97.9	136.8	174	-177.5	0	0	0	0	109.2	L715 A718 A845 A848 V852	L715-V850 HydrophobicContact CD1-CG1 4.27Å; A718-V850 HydrophobicContact CB-CG2 3.54Å; A845-V850 PolarHBondContact O-N 3.02Å; A848-V850 VanDerWaalsContact C-N 3.29Å; A848-V850 HydrophobicContact CB-CG2 4.01Å; A848-V850 PolarHBondContact O-N 3.11Å; V850-V852 PolarHBondContact O-N 2.88Å
851	S	59.9	Low	58.2	Low	84 Å²	84	90.8 Å²	90.8	59%	0.587	52%	0.521	S	S	*	.			trans	-80.9	118	174.7	-165.2	0	0	0	0	111.1	H853	S851-H853 PolarHBondContact O-N 2.9Å; S851-H853 PolarHBondContact OG-N 3Å; S851-H853 PolarHBondContact OG-O 3.07Å
852	V	56.7	Low	56	Low	30 Å²	30	99 Å²	99	18%	0.182	56%	0.558	C	S	.	*	S	Bend	trans	-68.2	-19.3	172.2	-171.9	0	0	0	0	111.8	T842 A845 V850	T842-V852 HydrophobicContact CG2-CG1 4.38Å; T842-V852 HydrophobicContact CG2-CG2 4.28Å; A845-V852 HydrophobicContact CB-CG2 3.18Å; V850-V852 PolarHBondContact O-N 2.88Å
853	H	53.9	Low	53.7	Low	156 Å²	156	104.7 Å²	104.7	72%	0.722	58%	0.581	S	S	*	*			trans	-116	118.4	177	-58.1	-25.9	0	0	0	109.9	S851	S851-H853 PolarHBondContact O-N 2.9Å; S851-H853 PolarHBondContact OG-N 3Å; S851-H853 PolarHBondContact OG-O 3.07Å
854	S	41.1	Very low	51.3	Low	110 Å²	110	107.4 Å²	107.4	77%	0.769	60%	0.598	S	S	*	*			trans	-129.8	134.4	164.9	58.2	0	0	0	0	108.8
855	A	39.2	Very low	49	Very low	98 Å²	98	112.6 Å²	112.6	81%	0.81	63%	0.626	S	S	*	*	S	Bend	trans	56.9	70.8	-179.9	0	0	0	0	0	116.9
856	D	37.8	Very low	46.6	Very low	168 Å²	168	118.4 Å²	118.4	90%	0.898	67%	0.667	S	S	*	*				-161.5	70.9	129	-107.7	-17.8	0	0	0	113
857	Q	35.2	Very low	44.3	Very low	196 Å²	196	120.4 Å²	120.4	92%	0.916	68%	0.683	S	S	*	*			trans	-147.1	72.2	167.2	-129.4	175.2	20.5	0	0	111.3
858	K	38.3	Very low	41.9	Very low	208 Å²	208	121.9 Å²	121.9	90%	0.904	71%	0.708	S	S	*	*			trans	-114.8	87.7	167.5	-87.7	-168.6	173.4	-176	0	110.6
859	S	34.2	Very low	39.9	Very low	115 Å²	115	130.2 Å²	130.2	80%	0.804	75%	0.745	S	S	*	*			trans	-169.3	165	161	48.7	0	0	0	0	110.8
860	S	28.8	Very low	37.9	Very low	117 Å²	117	131.2 Å²	131.2	82%	0.818	76%	0.757	S	S	*	*			trans	69.5	62	169.2	-167.7	0	0	0	0	118.2
861	S	28.8	Very low	36.3	Very low	118 Å²	118	134.8 Å²	134.8	83%	0.825	78%	0.784	S	S	*	*				-166.3	114.1	115.4	31.3	0	0	0	0	112
862	E	34.1	Very low	35.2	Very low	185 Å²	185	136.7 Å²	136.7	86%	0.864	79%	0.792	S	S	*	*			trans	-71.7	160	147	-66.1	151.4	153.9	0	0	107
863	E	33.4	Very low	34.2	Very low	181 Å²	181	144.1 Å²	144.1	85%	0.846	82%	0.822	S	S	*	*			cis	-157.3	179.1	22.6	-153.4	168.1	-151.5	0	0	111.8
864	D	30.3	Very low	33.6	Very low	142 Å²	142	144.7 Å²	144.7	76%	0.759	83%	0.828	S	S	*	*			trans	100.9	158.6	155.6	-137.1	-6.1	0	0	0	119.8
865	N	31.4	Very low	33.5	Very low	133 Å²	133	146.6 Å²	146.6	71%	0.711	83%	0.829	S	S	*	*			trans	-115.6	141.6	-138.5	-68.7	-93.2	0	0	0	114.7
866	S	28.1	Very low	33.6	Very low	122 Å²	122	147.1 Å²	147.1	85%	0.853	82%	0.818	S	S	*	*				160.6	157.5	105.1	56.5	0	0	0	0	115
867	A	29.6	Very low	33.9	Very low	108 Å²	108	146.5 Å²	146.5	89%	0.893	81%	0.814	S	S	*	*			trans	-32.7	139.9	-175.4	0	0	0	0	0	120.1
868	G	26.5	Very low	34.5	Very low	77 Å²	77	144 Å²	144	79%	0.794	81%	0.806	S	S	*	*			trans	-179.4	127	162.4	0	0	0	0	0	113.2
869	E	32.3	Very low	35	Very low	185 Å²	185	138.6 Å²	138.6	86%	0.864	80%	0.8	S	S	*	*			trans	-69.2	146.7	178.9	-53.5	168.4	122.3	0	0	112.5
870	Q	31.1	Very low	35.7	Very low	194 Å²	194	140.4 Å²	140.4	91%	0.907	80%	0.8	S	S	*	*				-174.9	165.2	113.1	-101.2	173.6	40	0	0	113.9
871	S	30.8	Very low	36.6	Very low	104 Å²	104	139.6 Å²	139.6	73%	0.727	79%	0.787	S	S	*	*			trans	-92.2	166.1	-167	-163.1	0	0	0	0	114.8
872	T	37.8	Very low	37.8	Very low	124 Å²	124	139.9 Å²	139.9	76%	0.761	79%	0.786	S	S	*	*			trans	-41.5	143.9	177.7	53.7	0	0	0	0	115.6
873	K	34.8	Very low	38.8	Very low	186 Å²	186	134.7 Å²	134.7	81%	0.809	78%	0.775	S	S	*	*			trans	-124.8	99.8	160.9	-73.1	-176.4	179.1	174.8	0	111.3
874	I	41	Very low	39.7	Very low	167 Å²	167	132.3 Å²	132.3	86%	0.856	77%	0.767	S	S	*	*			trans	-78.6	134	149.9	-63.2	171.2	0	0	0	105.7
875	L	40.2	Very low	41	Very low	150 Å²	150	129.2 Å²	129.2	79%	0.785	75%	0.751	S	S	*	*			trans	-119.7	110.2	178.9	-114.1	165.8	0	0	0	109.6
876	D	41.2	Very low	42.1	Very low	110 Å²	110	128 Å²	128	59%	0.588	75%	0.75	S	S	*	*			trans	-81.1	132.9	-178.3	-170.5	-14.7	0	0	0	110.6	L878	D876-L878 WeakPolarHBondContact OD1-CG 3.45Å; D876-L878 PolarHBondContact OD1-N 3.12Å; D876-L878 VanDerWaalsContact OD1-N 3.12Å
877	L	44.8	Very low	43.5	Very low	154 Å²	154	126.2 Å²	126.2	81%	0.806	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-86.7	-2.7	-174.8	-76.9	167.2	0	0	0	113.8	A879	L877-A879 PolarHBondContact O-N 2.71Å
878	L	46.2	Very low	44.8	Very low	143 Å²	143	127.8 Å²	127.8	75%	0.749	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-71.6	-8	-179.2	-69.6	169.9	0	0	0	114.8	D876 L880	D876-L878 WeakPolarHBondContact OD1-CG 3.45Å; D876-L878 PolarHBondContact OD1-N 3.12Å; D876-L878 VanDerWaalsContact OD1-N 3.12Å; L878-L880 PolarHBondContact O-N 3.24Å
879	A	49	Very low	45.8	Very low	95 Å²	95	128 Å²	128	79%	0.785	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-82.4	0.4	-173.2	0	0	0	0	0	116.2	L877	L877-A879 PolarHBondContact O-N 2.71Å
880	L	48.5	Very low	46.9	Very low	153 Å²	153	125.2 Å²	125.2	80%	0.801	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-118.1	5.7	-166.6	-80.9	172.1	0	0	0	116.8	L878	L878-L880 PolarHBondContact O-N 3.24Å
881	N	47.8	Very low	48	Very low	100 Å²	100	120.2 Å²	120.2	54%	0.535	70%	0.702	S	S	.	*			trans	-144.5	104.5	176.3	-163.3	-14.8	0	0	0	113.9	A883	N881-A883 PolarHBondContact O-N 3.4Å; N881-A883 VanDerWaalsContact OD1-CB 3.3Å; N881-A883 WeakPolarHBondContact OD1-CB 3.3Å; N881-A883 PolarHBondContact OD1-N 3.17Å; N881-A883 VanDerWaalsContact OD1-N 3.17Å
882	P	53.7	Low	48.9	Very low	124 Å²	124	121.1 Å²	121.1	81%	0.805	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-75	1.1	-179.2	31.7	-35.8	0	0	0	114.4	L884	P882-L884 PolarHBondContact O-N 3.2Å
883	A	55.2	Low	49.4	Very low	77 Å²	77	120.8 Å²	120.8	64%	0.636	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-76.3	2	178.9	0	0	0	0	0	114.8	N881	N881-A883 PolarHBondContact O-N 3.4Å; N881-A883 VanDerWaalsContact OD1-CB 3.3Å; N881-A883 WeakPolarHBondContact OD1-CB 3.3Å; N881-A883 PolarHBondContact OD1-N 3.17Å; N881-A883 VanDerWaalsContact OD1-N 3.17Å
884	L	53.5	Low	49.7	Very low	130 Å²	130	117.4 Å²	117.4	68%	0.681	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-113.7	9	-173.6	-67	174.4	0	0	0	114.5	P882 P886	P882-L884 PolarHBondContact O-N 3.2Å; L884-P886 VanDerWaalsContact O-CD 3.24Å; L884-P886 WeakPolarHBondContact O-CD 3.24Å
885	D	56.8	Low	49.4	Very low	78 Å²	78	117.9 Å²	117.9	42%	0.417	70%	0.697	S	S	.	*			trans	-70.3	115.3	177.6	-176.2	0.2	0	0	0	112	A887 L888	D885-A887 PolarHBondContact O-N 3.27Å; D885-A887 VanDerWaalsContact OD1-CB 3.28Å; D885-A887 WeakPolarHBondContact OD1-CB 3.28Å; D885-A887 PolarHBondContact OD1-N 3.26Å; D885-L888 PolarHBondContact O-N 3.35Å
886	P	54.8	Low	49.3	Very low	106 Å²	106	120.3 Å²	120.3	69%	0.688	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-66.7	-19.3	178	-18.5	33.4	0	0	0	113.8	L884 L888	L884-P886 VanDerWaalsContact O-CD 3.24Å; L884-P886 WeakPolarHBondContact O-CD 3.24Å; P886-L888 PolarHBondContact O-N 2.88Å
887	A	58.3	Low	48.8	Very low	86 Å²	86	119.8 Å²	119.8	71%	0.711	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-71.9	-15.7	-179.1	0	0	0	0	0	113.5	D885	D885-A887 PolarHBondContact O-N 3.27Å; D885-A887 VanDerWaalsContact OD1-CB 3.28Å; D885-A887 WeakPolarHBondContact OD1-CB 3.28Å; D885-A887 PolarHBondContact OD1-N 3.26Å
888	L	55.8	Low	48.6	Very low	141 Å²	141	118.7 Å²	118.7	74%	0.738	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-113.1	2.1	-174.8	-66.3	175.1	0	0	0	114.2	D885 P886	D885-L888 PolarHBondContact O-N 3.35Å; P886-L888 PolarHBondContact O-N 2.88Å
889	N	48	Very low	48.4	Very low	82 Å²	82	117.2 Å²	117.2	44%	0.439	71%	0.712	S	S	.	*			trans	-140.7	93.3	-175.7	-139.2	-29.1	0	0	0	112.5	S891	N889-S891 PolarHBondContact O-N 3.4Å; N889-S891 PolarHBondContact OD1-OG 2.9Å
890	P	56	Low	47.5	Very low	126 Å²	126	119.4 Å²	119.4	82%	0.818	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	14.4	-172.4	31.7	-37.2	0	0	0	114.7
891	S	52.8	Low	47.1	Very low	88 Å²	88	118 Å²	118	62%	0.615	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-7	-177.6	55.9	0	0	0	0	114	N889	N889-S891 PolarHBondContact O-N 3.4Å; N889-S891 PolarHBondContact OD1-OG 2.9Å
892	L	51.6	Low	46.5	Very low	123 Å²	123	123 Å²	123	64%	0.644	73%	0.729	S	S	*	*	S	Bend	trans	-108.3	5.7	-170.7	-67.2	176.2	0	0	0	115.5	P894	L892-P894 VanDerWaalsContact O-CD 3.32Å; L892-P894 WeakPolarHBondContact O-CD 3.32Å
893	T	46.2	Very low	45.5	Very low	118 Å²	118	121.8 Å²	121.8	72%	0.724	72%	0.724	S	S	*	*			trans	-92.2	112.3	174.7	41.7	0	0	0	0	112.5
894	P	42.4	Very low	44.7	Very low	115 Å²	115	127.8 Å²	127.8	75%	0.747	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-74.4	136.1	170	30.5	-33.8	0	0	0	111.4	L892	L892-P894 VanDerWaalsContact O-CD 3.32Å; L892-P894 WeakPolarHBondContact O-CD 3.32Å
895	L	34.3	Very low	44.3	Very low	177 Å²	177	127.3 Å²	127.3	93%	0.927	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-78.3	129.5	177	-87.2	152.7	0	0	0	111.8
896	F	38.5	Very low	43.6	Very low	200 Å²	200	133 Å²	133	88%	0.877	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-78.4	134.2	167.1	-82.4	-93.6	0	0	0	111.3
897	A	30.4	Very low	42.5	Very low	99 Å²	99	136.6 Å²	136.6	82%	0.818	77%	0.766	S	S	*	*			trans	-145.1	106	164	0	0	0	0	0	110.6
898	T	40.3	Very low	41.5	Very low	131 Å²	131	140.6 Å²	140.6	80%	0.804	77%	0.767	S	S	*	*			trans	-86.1	149	174.6	53.2	0	0	0	0	111.8
899	P	41.9	Very low	40.4	Very low	113 Å²	113	140.5 Å²	140.5	73%	0.734	76%	0.763	S	S	*	*			trans	-140.6	127.8	135.8	32.3	-16	0	0	0	116.5
900	V	30.6	Very low	39.6	Very low	140 Å²	140	144.4 Å²	144.4	85%	0.848	78%	0.779	S	S	*	*			trans	72.9	131	132.3	-178.3	0	0	0	0	120.9
901	V	40.6	Very low	38.7	Very low	124 Å²	124	149.6 Å²	149.6	75%	0.752	78%	0.782	S	S	*	*			trans	-83.3	145	176.2	173.4	0	0	0	0	112.8
902	K	34.3	Very low	37.7	Very low	204 Å²	204	154.6 Å²	154.6	89%	0.887	80%	0.796	S	S	*	*			trans	-135.6	160.5	145.7	-74.9	-164.1	176.7	179.5	0	110.9
903	S	33.8	Very low	37.2	Very low	99 Å²	99	153 Å²	153	69%	0.692	80%	0.795	S	S	*	*			trans	-135.2	133	-149.8	56.8	0	0	0	0	116.2
904	K	37.9	Very low	36.5	Very low	204 Å²	204	156.1 Å²	156.1	89%	0.887	80%	0.801	S	S	*	*			trans	58.5	169.8	149.8	-81.3	-176.6	179.4	176.6	0	117.6
905	P	45.8	Very low	36.3	Very low	119 Å²	119	158.2 Å²	158.2	77%	0.773	81%	0.805	S	S	*	*			cis	-118.6	-179.5	-1.4	40.6	-27.2	0	0	0	114.9
906	K	40.6	Very low	36.7	Very low	199 Å²	199	159.2 Å²	159.2	87%	0.865	83%	0.827	S	S	*	*			trans	-73.8	161.1	164.3	-58.9	176.5	177.2	-178.4	0	110.5
907	K	33.2	Very low	36.6	Very low	181 Å²	181	157.2 Å²	157.2	79%	0.787	82%	0.824	S	S	*	*			trans	-125.8	150.2	144.6	-137.9	-173.6	-170.3	-110.8	0	110.1	E909	K907-E909 IonicContact NZ-OE2 2.71Å; K907-E909 PolarHBondContact NZ-OE2 3.03Å
908	K	36.3	Very low	36.9	Very low	169 Å²	169	160.3 Å²	160.3	74%	0.735	83%	0.825	S	S	*	*			trans	-159.3	110.9	-175	175.2	-122.3	178.8	-159.1	0	107.8
909	E	32.8	Very low	36.7	Very low	139 Å²	139	161.9 Å²	161.9	65%	0.65	83%	0.826	S	S	*	*			trans	-178.7	153.7	179.1	-95.9	139.1	-153.3	0	0	106.4	K907	K907-E909 IonicContact NZ-OE2 2.71Å; K907-E909 PolarHBondContact NZ-OE2 3.03Å
910	E	31.6	Very low	36.4	Very low	165 Å²	165	164.8 Å²	164.8	77%	0.771	83%	0.831	S	S	*	*			cis	-158	-175.9	-36.3	-155.6	134.1	-120.4	0	0	107.9
911	R	37.6	Very low	36.8	Very low	235 Å²	235	166.3 Å²	166.3	89%	0.887	83%	0.83	S	S	*	*			trans	-86.6	145.8	164.7	-73.4	174.6	167.8	171.4	-5.8	109
912	E	32	Very low	36.5	Very low	193 Å²	193	169.1 Å²	169.1	90%	0.902	84%	0.835	S	S	*	*				-162.6	175	117.8	-115.9	172.5	-165.4	0	0	113.4
913	S	39.3	Very low	36.7	Very low	90 Å²	90	166.6 Å²	166.6	63%	0.629	83%	0.832	S	S	*	*			trans	-84.5	167.9	-173.7	53.7	0	0	0	0	113.9
914	H	33.2	Very low	36.9	Very low	182 Å²	182	171.8 Å²	171.8	84%	0.843	84%	0.842	S	S	*	*				-161.1	158.3	121.4	-103.4	-66.5	0	0	0	112.3
915	L	37.9	Very low	36.8	Very low	159 Å²	159	169.2 Å²	169.2	83%	0.832	84%	0.839	S	S	*	*			trans	-87.3	151.4	169.3	-69.4	102.8	0	0	0	111.5
916	S	41.1	Very low	36	Very low	199 Å²	199	173.7 Å²	173.7	100%	1.392	85%	0.845	S	S	*	*			trans	-151	0	141.5	-69.4	0	0	0	0	109.2

Retrieved 916 of 916 residues in 1936.8 ms (Link to these results)

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