X2JG40_DROME Loading...

Gamma-tubulin complex component

Component of the gamma-tubulin ring complex (gTuRC) which mediates microtubule nucleation. The gTuRC regulates the minus-end nucleation of alpha-beta tubulin heterodimers that grow into microtubule protafilaments, a critical step in centrosome duplication and spindle formation. Plays a role in neuronal migration.

AlphaFold DB , UniProt , Accession X2JG40, Species DROME (Drosophila melanogaster, Fruit fly), Gene Grip84, Length 819 aa.

						>X2JG40_DROME|X2JG40|Grip84
MYALLVFVERYSECKPVSESSSSTSLSAMGLPHGNKTSDVNSAAGSVPTTLAIASTSTILTTSQNVSGSTRLSLTQSQDFPTSTPVNCKKATESDTTPVVFVRRGPMDRNRGAGKDERNDLSVIKERVLNAVSDQSLSGYRSVTNKTGNSPKSMPNDLVTLTDVPDEYRTHLLWEYYKVDGDKVPRAEIAAMPLLSQESMLLDELLHCLTGIRESLLVPQKPIISAVGLAKYDTDFDIHTHLDRSLTHQVREILPLASYFMGVQKIIAATDGLGQVMNSLNEALQELTHDFYLIIVQAEQELRHNRLTLQKLLYYLQPTMWVMHEVWSSLVIIQLSDSRDAEVLTYLHERIKRLEGNKDAQQLIIGLVRKAAKPYMRMLQMWIQKGVIVDRHREFLVVDNEVIHRDELPEHYSDDYWERRYTLRDEQIPSFLAKYSDKILRTGKYLNVIRQCGKRVMPTQEMNLEFDPTSERHVSVINDAYYFAARMLLDVLLTENDLMGHLQSVKRYLLLNQGDFTMQFMDACEDELTKNVDHVLPMTLENLLGLTLRISSARNDPYKDDLHCELLPYDLVTQMSKIMKKEENWQAQPRLDLSGLECFAFTYEVKWPCSLVLNHISISKYQMLFRQLFYCKHVERQLCKIWKENSIARQFEPQAASLYRAAFTLRQRMMNAIQNLEYYMMIEIIEPNWHIFIEKMKTVENVDNVLRLHQDFLDSCLKNCMLTESSHLNRSIFKLCKICLKYCEFIQIETPLDPTDTFSERVRRFDLEFTQLLISFLKQINSMAKKNTADCFMNLVHRINFNAFYTDQMDKMCVEDAIG
					

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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	29.9	Very low	38.1	Very low	154 Å²	154	87.5 Å²	87.5	76%	0.759	42%	0.419	S	S	*	.				0	-68.4	0	-164.4	-179.7	-76.1	0	0	111.7	A3 L4 L5	M1-A3 PolarHBondContact O-N 3.1Å; M1-L4 WeakPolarHBondContact O-CB 3.46Å; M1-L4 PolarHBondContact O-N 3.21Å; M1-L5 PolarHBondContact O-N 3.1Å
2	Y	28.2	Very low	37.9	Very low	192 Å²	192	84.5 Å²	84.5	75%	0.753	41%	0.414	S	S	*	.	H	α-helix	trans	-56.7	-43.9	-176	-152.5	-101.7	0	0	0	113.5	L4 L5 V6	Y2-L4 VanDerWaalsContact C-N 3.31Å; Y2-L4 PolarHBondContact O-N 2.95Å; Y2-L5 WeakPolarHBondContact O-CB 3.43Å; Y2-L5 PolarHBondContact O-N 2.72Å; Y2-V6 HydrophobicContact CD1-CG2 4.4Å; Y2-V6 WeakPolarHBondContact O-CG2 3.45Å; Y2-V6 PolarHBondContact O-N 2.9Å
3	A	32.7	Very low	37.4	Very low	45 Å²	45	87.7 Å²	87.7	37%	0.372	43%	0.428	S	S	.	.	H	α-helix	trans	-76.2	-11.5	179.1	0	0	0	0	0	115.2	M1 F7	M1-A3 PolarHBondContact O-N 3.1Å; A3-F7 PolarHBondContact O-N 3.27Å; A3-F7 VanDerWaalsContact O-N 3.13Å
4	L	38.6	Very low	36.8	Very low	27 Å²	27	89.4 Å²	89.4	14%	0.141	45%	0.451	C	S	.	.	H	α-helix	trans	-78.1	-35.8	166.2	-84.4	163.5	0	0	0	111.2	M1 Y2 F7 V8 I294 Y315	M1-L4 WeakPolarHBondContact O-CB 3.46Å; M1-L4 PolarHBondContact O-N 3.21Å; Y2-L4 VanDerWaalsContact C-N 3.31Å; Y2-L4 PolarHBondContact O-N 2.95Å; L4-F7 PolarHBondContact O-N 3.19Å; L4-V8 PolarHBondContact O-N 3.46Å; L4-I294 HydrophobicContact CD2-CD1 4.38Å; L4-I294 HydrophobicContact CD2-CG1 4.08Å; L4-I294 HydrophobicContact CD2-CG2 4.08Å; L4-Y315 HydrophobicContact CD1-CD1 4.07Å; L4-Y315 HydrophobicContact CD1-CD2 3.68Å; L4-Y315 HydrophobicContact CD1-CE1 4.3Å; L4-Y315 HydrophobicContact CD1-CE2 3.91Å; L4-Y315 HydrophobicContact CD1-CG 3.77Å
5	L	36.4	Very low	36.4	Very low	90 Å²	90	93.8 Å²	93.8	47%	0.471	47%	0.466	S	S	.	.	H	α-helix	trans	-60.7	-47	165.6	-86.4	162.1	0	0	0	110.1	M1 Y2 F7 V8 E9	M1-L5 PolarHBondContact O-N 3.1Å; Y2-L5 WeakPolarHBondContact O-CB 3.43Å; Y2-L5 PolarHBondContact O-N 2.72Å; L5-F7 VanDerWaalsContact C-N 3.32Å; L5-F7 PolarHBondContact O-N 3.05Å; L5-V8 CarbonylContact O-C 3.51Å; L5-V8 PolarHBondContact O-N 3.12Å; L5-E9 WeakPolarHBondContact O-CB 3.31Å; L5-E9 VanDerWaalsContact O-CG 3.28Å; L5-E9 WeakPolarHBondContact O-CG 3.35Å; L5-E9 PolarHBondContact O-N 3.23Å
6	V	40.6	Very low	35.8	Very low	57 Å²	57	95.6 Å²	95.6	35%	0.345	49%	0.487	S	S	.	.	H	α-helix	trans	-57.7	-38	177.2	174.9	0	0	0	0	113.3	Y2 R10	Y2-V6 HydrophobicContact CD1-CG2 4.4Å; Y2-V6 WeakPolarHBondContact O-CG2 3.45Å; Y2-V6 PolarHBondContact O-N 2.9Å; V6-R10 HydrophobicContact CG1-CG 4.21Å; V6-R10 WeakPolarHBondContact O-CB 3.38Å; V6-R10 WeakPolarHBondContact O-CG 3.15Å; V6-R10 PolarHBondContact O-N 3.28Å
7	F	41.7	Very low	35.2	Very low	35 Å²	35	98.2 Å²	98.2	15%	0.154	51%	0.508	C	S	.	.	H	α-helix	trans	-64.1	-40.4	175.6	-174	-82.2	0	0	0	111.9	A3 L4 L5 D290 I294 T319	A3-F7 PolarHBondContact O-N 3.27Å; A3-F7 VanDerWaalsContact O-N 3.13Å; L4-F7 PolarHBondContact O-N 3.19Å; L5-F7 VanDerWaalsContact C-N 3.32Å; L5-F7 PolarHBondContact O-N 3.05Å; F7-D290 HydrophobicContact CD2-CB 4.04Å; F7-D290 HydrophobicContact CE2-CB 3.82Å; F7-I294 HydrophobicContact CB-CD1 4.46Å; F7-I294 HydrophobicContact CD1-CD1 4.03Å; F7-I294 HydrophobicContact CD2-CD1 3.63Å; F7-I294 HydrophobicContact CD2-CG1 4.21Å; F7-I294 HydrophobicContact CE1-CD1 4.15Å; F7-I294 HydrophobicContact CE2-CD1 3.73Å; F7-I294 HydrophobicContact CG-CD1 3.78Å; F7-I294 HydrophobicContact CG-CG1 4.49Å; F7-I294 HydrophobicContact CZ-CD1 4.01Å; F7-T319 HydrophobicContact CE1-CG2 3.88Å; F7-T319 HydrophobicContact CZ-CG2 4.37Å
8	V	37.8	Very low	34.7	Very low	68 Å²	68	98.2 Å²	98.2	41%	0.412	52%	0.517	S	S	.	.	H	α-helix	trans	-71.9	-48.4	175.9	175.2	0	0	0	0	111	L4 L5 R10 Y11 S12	L4-V8 PolarHBondContact O-N 3.46Å; L5-V8 CarbonylContact O-C 3.51Å; L5-V8 PolarHBondContact O-N 3.12Å; V8-R10 PolarHBondContact O-N 2.96Å; V8-Y11 CarbonylContact O-C 3.6Å; V8-Y11 PolarHBondContact O-N 2.71Å; V8-Y11 VanDerWaalsContact O-N 3.16Å; V8-S12 WeakPolarHBondContact CG1-OG 3.35Å; V8-S12 VanDerWaalsContact O-CB 3.26Å; V8-S12 WeakPolarHBondContact O-CB 3.43Å; V8-S12 PolarHBondContact O-N 3.39Å; V8-S12 PolarHBondContact O-OG 3.19Å
9	E	40.2	Very low	34.4	Very low	93 Å²	93	103.2 Å²	103.2	44%	0.435	54%	0.538	S	S	.	.	H	α-helix	trans	-62	-41.6	-178.2	-71.1	168.8	157.6	0	0	112	L5 Y11 S12 E13	L5-E9 WeakPolarHBondContact O-CB 3.31Å; L5-E9 VanDerWaalsContact O-CG 3.28Å; L5-E9 WeakPolarHBondContact O-CG 3.35Å; L5-E9 PolarHBondContact O-N 3.23Å; E9-Y11 PolarHBondContact O-N 3.24Å; E9-Y11 VanDerWaalsContact O-N 3.07Å; E9-S12 PolarHBondContact O-N 3.14Å; E9-S12 VanDerWaalsContact O-N 3.1Å; E9-E13 PolarHBondContact O-N 3.2Å
10	R	46.8	Very low	33.9	Very low	150 Å²	150	103.1 Å²	103.1	57%	0.566	55%	0.546	S	S	*	.	H	α-helix	trans	-51.4	-31.5	174	-93.3	-173.9	169.2	-177.5	-0.8	113.5	V6 V8 D290	V6-R10 HydrophobicContact CG1-CG 4.21Å; V6-R10 WeakPolarHBondContact O-CB 3.38Å; V6-R10 WeakPolarHBondContact O-CG 3.15Å; V6-R10 PolarHBondContact O-N 3.28Å; V8-R10 PolarHBondContact O-N 2.96Å; R10-D290 IonicContact CZ-OD2 2.62Å; R10-D290 IonicContact NH1-OD1 3.07Å; R10-D290 PolarHBondContact NH1-OD1 3.42Å; R10-D290 IonicContact NH1-OD2 3.92Å; R10-D290 PolarHBondContact NH1-OD2 3Å
11	Y	46.2	Very low	33.5	Very low	51 Å²	51	103.6 Å²	103.6	20%	0.2	56%	0.558	C	S	.	*	H	α-helix	trans	-114.3	2.1	-177.7	-68.9	-81.9	0	0	0	113.7	V8 E9 Q362 L363	V8-Y11 CarbonylContact O-C 3.6Å; V8-Y11 PolarHBondContact O-N 2.71Å; V8-Y11 VanDerWaalsContact O-N 3.16Å; E9-Y11 PolarHBondContact O-N 3.24Å; E9-Y11 VanDerWaalsContact O-N 3.07Å; Y11-Q362 PolarHBondContact O-NE2 2.81Å; Y11-Q362 VanDerWaalsContact O-NE2 3.17Å; Y11-L363 HydrophobicContact CD1-CB 4.06Å; Y11-L363 HydrophobicContact CD1-CD1 3.85Å; Y11-L363 HydrophobicContact CD1-CG 4.08Å; Y11-L363 HydrophobicContact CD2-CD1 4.46Å; Y11-L363 HydrophobicContact CE1-CB 4.31Å; Y11-L363 HydrophobicContact CE1-CD1 3.73Å; Y11-L363 HydrophobicContact CE1-CG 3.88Å; Y11-L363 HydrophobicContact CE2-CD1 4.36Å; Y11-L363 HydrophobicContact CG-CD1 4.22Å
12	S	35.1	Very low	33.3	Very low	52 Å²	52	102 Å²	102	36%	0.364	56%	0.562	S	S	.	*	H	α-helix	trans	-104.7	-33.4	176.2	-59.1	0	0	0	0	113.4	V8 E9	V8-S12 WeakPolarHBondContact CG1-OG 3.35Å; V8-S12 VanDerWaalsContact O-CB 3.26Å; V8-S12 WeakPolarHBondContact O-CB 3.43Å; V8-S12 PolarHBondContact O-N 3.39Å; V8-S12 PolarHBondContact O-OG 3.19Å; E9-S12 PolarHBondContact O-N 3.14Å; E9-S12 VanDerWaalsContact O-N 3.1Å
13	E	32.3	Very low	33	Very low	126 Å²	126	97.9 Å²	97.9	59%	0.589	56%	0.561	S	S	*	*			trans	-108.8	78.2	-170.3	-72.7	-114.1	112.7	0	0	113.1	E9 K15	E9-E13 PolarHBondContact O-N 3.2Å; E13-K15 IonicContact OE1-NZ 2.76Å; E13-K15 PolarHBondContact OE1-NZ 3.27Å
14	C	28	Very low	32.6	Very low	111 Å²	111	101.8 Å²	101.8	75%	0.75	58%	0.581	S	S	*	*			trans	-116.4	57.9	160	-119.8	0	0	0	0	111.6
15	K	31.1	Very low	31.8	Very low	156 Å²	156	105.4 Å²	105.4	68%	0.678	61%	0.609	S	S	*	*			trans	-73.2	144.4	163.5	-71.4	173.2	-169.7	130	0	109.4	E13 V17	E13-K15 IonicContact OE1-NZ 2.76Å; E13-K15 PolarHBondContact OE1-NZ 3.27Å; K15-V17 PolarHBondContact O-N 3.1Å
16	P	26.8	Very low	31.2	Very low	123 Å²	123	108.6 Å²	108.6	80%	0.799	63%	0.625	S	S	*	*			trans	-66.7	130.9	178.1	27.8	-34.1	0	0	0	110.6	S18	P16-S18 PolarHBondContact O-N 3.17Å
17	V	26.4	Very low	30.5	Very low	139 Å²	139	111.6 Å²	111.6	84%	0.842	65%	0.648	S	S	*	*			trans	-71.1	100	170.6	178.4	0	0	0	0	108.4	K15	K15-V17 PolarHBondContact O-N 3.1Å
18	S	25.4	Very low	29.7	Very low	98 Å²	98	114.6 Å²	114.6	69%	0.685	68%	0.68	S	S	*	*			trans	-73.4	122	163.3	56	0	0	0	0	109.1	P16 S20	P16-S18 PolarHBondContact O-N 3.17Å; S18-S20 PolarHBondContact O-N 3.25Å
19	E	29.4	Very low	29.1	Very low	194 Å²	194	121 Å²	121	91%	0.907	71%	0.708	S	S	*	*			trans	-60.3	128.4	175	-60.6	179.7	125.2	0	0	111.2
20	S	24.3	Very low	28.3	Very low	101 Å²	101	120.5 Å²	120.5	71%	0.706	73%	0.727	S	S	*	*			trans	-146	88.8	166.4	52.6	0	0	0	0	111.9	S18	S18-S20 PolarHBondContact O-N 3.25Å
21	S	25.1	Very low	27.2	Very low	114 Å²	114	121.4 Å²	121.4	80%	0.797	74%	0.742	S	S	*	*			trans	26.1	112.6	146	59.9	0	0	0	0	118.5	S23	S21-S23 PolarHBondContact O-N 2.95Å
22	S	25.6	Very low	26.9	Very low	121 Å²	121	123.1 Å²	123.1	85%	0.846	76%	0.76	S	S	*	*			trans	-59.5	127.7	163.2	55.1	0	0	0	0	112.5
23	S	23.2	Very low	26.5	Very low	104 Å²	104	129.8 Å²	129.8	73%	0.727	79%	0.785	S	S	*	*			trans	-74.2	165.1	148.5	64.3	0	0	0	0	109	S21	S21-S23 PolarHBondContact O-N 2.95Å
24	T	23.8	Very low	26.2	Very low	128 Å²	128	126.9 Å²	126.9	79%	0.785	79%	0.788	S	S	*	*			cis	-153.6	146.5	14.5	-42.8	0	0	0	0	109.7
25	S	21.9	Very low	26.1	Very low	103 Å²	103	129.1 Å²	129.1	72%	0.72	79%	0.793	S	S	*	*			trans	-155.8	142.6	140.4	71.6	0	0	0	0	113.5
26	L	24.4	Very low	25.9	Very low	156 Å²	156	130.3 Å²	130.3	82%	0.817	80%	0.798	S	S	*	*			trans	66.5	110.4	155.5	-71.3	160.7	0	0	0	122
27	S	25.5	Very low	25.9	Very low	120 Å²	120	130.5 Å²	130.5	84%	0.839	80%	0.797	S	S	*	*			trans	67.1	123.7	138.6	58.6	0	0	0	0	120.7
28	A	23.8	Very low	25.9	Very low	98 Å²	98	128.5 Å²	128.5	81%	0.81	79%	0.789	S	S	*	*			trans	-117.2	139.8	165.8	0	0	0	0	0	111
29	M	25.7	Very low	25.8	Very low	203 Å²	203	130.6 Å²	130.6	100%	1	79%	0.793	S	S	*	*			trans	-167	137.4	156.8	-109.7	-173.8	-179.3	0	0	109.3
30	G	23.7	Very low	25.7	Very low	82 Å²	82	126.3 Å²	126.3	85%	0.845	78%	0.78	S	S	*	*			trans	115.9	101	165.1	0	0	0	0	0	117.5
31	L	24.4	Very low	25.9	Very low	169 Å²	169	128.5 Å²	128.5	89%	0.885	78%	0.784	S	S	*	*			trans	-63.9	177.8	161.5	-74	160.7	0	0	0	113
32	P	39.9	Very low	25.9	Very low	87 Å²	87	128.1 Å²	128.1	57%	0.565	78%	0.781	S	S	*	*			cis	-141.5	-176.8	-27.8	33.6	-12.7	0	0	0	115.8
33	H	26.3	Very low	25.9	Very low	193 Å²	193	126.9 Å²	126.9	89%	0.894	78%	0.778	S	S	*	*			trans	70.3	151.5	158.2	-56.4	-43.3	0	0	0	119.1
34	G	25.2	Very low	26	Very low	64 Å²	64	127.2 Å²	127.2	66%	0.66	79%	0.787	S	S	*	*			cis	170.2	155.7	-9.1	0	0	0	0	0	114.5
35	N	27	Very low	26	Very low	158 Å²	158	124.1 Å²	124.1	85%	0.845	78%	0.781	S	S	*	*			trans	65.9	140.8	-179.5	-61.2	-25.3	0	0	0	116.1
36	K	26.1	Very low	26.2	Very low	182 Å²	182	125 Å²	125	79%	0.791	79%	0.787	S	S	*	*			cis	106.9	147.7	20.3	-85.6	-163.5	170.9	-172.6	0	113.9
37	T	26.9	Very low	26.3	Very low	126 Å²	126	124.2 Å²	124.2	77%	0.773	79%	0.788	S	S	*	*			trans	66.8	132.9	176.7	57.1	0	0	0	0	115
38	S	25.9	Very low	26.9	Very low	97 Å²	97	123.3 Å²	123.3	68%	0.678	78%	0.78	S	S	*	*			cis	72.7	142.1	27.9	94.3	0	0	0	0	113.3
39	D	24.7	Very low	27	Very low	142 Å²	142	124.6 Å²	124.6	76%	0.759	78%	0.777	S	S	*	*			cis	-163.3	171.5	-1.4	-134.7	-31.6	0	0	0	111.4
40	V	27.2	Very low	26.9	Very low	104 Å²	104	120.9 Å²	120.9	63%	0.63	77%	0.767	S	S	*	*			trans	59.3	115.4	145.1	168	0	0	0	0	121.9
41	N	26.7	Very low	26.9	Very low	147 Å²	147	124 Å²	124	79%	0.786	76%	0.763	S	S	*	*			trans	61.8	154.6	136.6	-65.3	-4.7	0	0	0	121.3
42	S	25.5	Very low	26.9	Very low	106 Å²	106	120.5 Å²	120.5	74%	0.741	76%	0.758	S	S	*	*			cis	-169.8	161.9	8.5	29.8	0	0	0	0	114.1
43	A	25.6	Very low	26.2	Very low	95 Å²	95	123.4 Å²	123.4	79%	0.785	77%	0.768	S	S	*	*			trans	75.3	144.4	142.1	0	0	0	0	0	122.7
44	A	24.8	Very low	26.1	Very low	111 Å²	111	118.7 Å²	118.7	92%	0.917	76%	0.762	S	S	*	*			trans	62.4	146.6	169.4	0	0	0	0	0	117.6
45	G	23.8	Very low	26	Very low	63 Å²	63	120.5 Å²	120.5	65%	0.649	76%	0.764	S	S	*	*			cis	175.5	-175.7	-4.1	0	0	0	0	0	112.2
46	S	26.6	Very low	25.9	Very low	122 Å²	122	119.3 Å²	119.3	85%	0.853	76%	0.763	S	S	*	*			trans	59.3	104.8	168.5	48.3	0	0	0	0	120.3
47	V	25.9	Very low	25.8	Very low	139 Å²	139	115.4 Å²	115.4	84%	0.842	76%	0.759	S	S	*	*			trans	-44.1	169.2	134	-98.1	0	0	0	0	113.2
48	P	39.8	Very low	25.8	Very low	102 Å²	102	115.8 Å²	115.8	66%	0.662	76%	0.761	S	S	*	*			cis	-144.3	175.1	18.3	37.3	-15.8	0	0	0	118.8
49	T	24.4	Very low	25.7	Very low	124 Å²	124	118.5 Å²	118.5	76%	0.761	77%	0.766	S	S	*	*			trans	63.2	159.1	147.9	45.2	0	0	0	0	119.5
50	T	25.4	Very low	25.7	Very low	126 Å²	126	119.5 Å²	119.5	77%	0.773	77%	0.771	S	S	*	*			cis	-148.3	170.7	15.2	-23.4	0	0	0	0	112.9
51	L	23.6	Very low	25.5	Very low	148 Å²	148	120.3 Å²	120.3	78%	0.775	78%	0.776	S	S	*	*			trans	-68.6	149.5	179.3	-57.1	105.1	0	0	0	116.4	I53	L51-I53 HydrophobicContact CD2-CD1 4.42Å
52	A	23.8	Very low	25.4	Very low	95 Å²	95	120.4 Å²	120.4	79%	0.785	78%	0.782	S	S	*	*			trans	172.5	127.5	133.1	0	0	0	0	0	108.1
53	I	24.6	Very low	25.3	Very low	148 Å²	148	120.5 Å²	120.5	76%	0.759	78%	0.783	S	S	*	*			cis	76.1	86.3	39.1	-50.6	175.9	0	0	0	114.3	L51	L51-I53 HydrophobicContact CD2-CD1 4.42Å
54	A	23.9	Very low	25.3	Very low	94 Å²	94	125.1 Å²	125.1	78%	0.777	79%	0.788	S	S	*	*			trans	-174.4	139.1	142.6	0	0	0	0	0	107.8
55	S	24	Very low	25.2	Very low	101 Å²	101	127.4 Å²	127.4	71%	0.706	79%	0.785	S	S	*	*			cis	111.6	142.4	17.3	-71.4	0	0	0	0	112.5
56	T	24.4	Very low	25.3	Very low	133 Å²	133	131.5 Å²	131.5	82%	0.816	80%	0.797	S	S	*	*			trans	65.4	143.1	178.8	69.3	0	0	0	0	118.1
57	S	25.1	Very low	25.1	Very low	101 Å²	101	131.4 Å²	131.4	71%	0.706	80%	0.797	S	S	*	*			cis	117.2	101.3	-8.3	80.2	0	0	0	0	118
58	T	25.6	Very low	24.9	Very low	133 Å²	133	128.5 Å²	128.5	82%	0.816	79%	0.794	S	S	*	*			trans	-167.9	134.3	152	22.4	0	0	0	0	106.2
59	I	25	Very low	24.1	Very low	155 Å²	155	129 Å²	129	80%	0.795	80%	0.801	S	S	*	*			cis	66.6	107.2	48.4	-54.8	175.4	0	0	0	113.3
60	L	24.3	Very low	24	Very low	163 Å²	163	129.3 Å²	129.3	85%	0.853	80%	0.802	S	S	*	*				-163.5	159.5	128.3	-111	168.2	0	0	0	112
61	T	23.2	Very low	23.9	Very low	121 Å²	121	133.4 Å²	133.4	74%	0.742	80%	0.804	S	S	*	*			trans	-115.2	160	-177.7	49	0	0	0	0	111.1
62	T	24.5	Very low	23.9	Very low	148 Å²	148	132.9 Å²	132.9	91%	0.908	80%	0.801	S	S	*	*			trans	-160.7	157.3	144.4	4.7	0	0	0	0	110.6
63	S	23.1	Very low	23.8	Very low	108 Å²	108	133.4 Å²	133.4	76%	0.755	80%	0.798	S	S	*	*			trans	-136.1	156.6	-179.8	57.1	0	0	0	0	109.9
64	Q	25.8	Very low	23.7	Very low	193 Å²	193	133.9 Å²	133.9	90%	0.902	80%	0.802	S	S	*	*			trans	-166.3	147.4	144.9	-111.5	165.4	28.4	0	0	112.5
65	N	23.3	Very low	23.8	Very low	158 Å²	158	134.9 Å²	134.9	85%	0.845	80%	0.798	S	S	*	*			trans	-99.3	163.9	170.1	-67.2	-37.1	0	0	0	109.8
66	V	24.8	Very low	23.9	Very low	149 Å²	149	138.3 Å²	138.3	90%	0.903	80%	0.803	S	S	*	*			trans	-163.7	159.8	131.5	132.9	0	0	0	0	110.1
67	S	22.8	Very low	23.8	Very low	121 Å²	121	136.4 Å²	136.4	85%	0.846	80%	0.796	S	S	*	*			trans	-114.6	165.2	-163.4	51.1	0	0	0	0	114.6
68	G	21.8	Very low	23.9	Very low	77 Å²	77	140.4 Å²	140.4	79%	0.794	80%	0.803	S	S	*	*			trans	-177.7	118.5	170.3	0	0	0	0	0	115.7
69	S	22.1	Very low	23.8	Very low	114 Å²	114	141.3 Å²	141.3	80%	0.797	80%	0.803	S	S	*	*			trans	-75.8	166.7	175	-42.7	0	0	0	0	112.1
70	T	23.5	Very low	23.8	Very low	129 Å²	129	143.1 Å²	143.1	79%	0.791	81%	0.805	S	S	*	*			cis	-163.8	-156.2	7.7	-4.3	0	0	0	0	108.6
71	R	23.2	Very low	24.2	Very low	213 Å²	213	141 Å²	141	80%	0.804	80%	0.801	S	S	*	*			cis	-166.9	159.2	9.3	-133.6	179.4	-173.8	177.9	2.2	112.3
72	L	22.7	Very low	24.2	Very low	137 Å²	137	141.1 Å²	141.1	72%	0.717	80%	0.802	S	S	*	*			trans	79.9	157.4	145.4	-82.2	168.9	0	0	0	124.5
73	S	22.5	Very low	24.3	Very low	105 Å²	105	139.5 Å²	139.5	73%	0.734	80%	0.797	S	S	*	*			trans	64.3	117.1	-168.7	50.3	0	0	0	0	115.4
74	L	22.7	Very low	24.4	Very low	159 Å²	159	140.2 Å²	140.2	83%	0.832	80%	0.797	S	S	*	*			cis	72.3	127.9	46.7	-61.2	168.4	0	0	0	112.2
75	T	24.8	Very low	24.5	Very low	114 Å²	114	137.1 Å²	137.1	70%	0.699	79%	0.794	S	S	*	*			cis	-145.1	148.8	31.7	49.4	0	0	0	0	116.3
76	Q	26.6	Very low	24.6	Very low	173 Å²	173	135.5 Å²	135.5	81%	0.808	79%	0.789	S	S	*	*			trans	50.9	110.2	141.7	-77	170.8	-23.5	0	0	120.4
77	S	23.4	Very low	24.5	Very low	94 Å²	94	135.7 Å²	135.7	66%	0.657	79%	0.785	S	S	*	*				84.6	142.1	81	76.1	0	0	0	0	113.8
78	Q	26.9	Very low	24.5	Very low	184 Å²	184	134.9 Å²	134.9	86%	0.86	78%	0.778	S	S	*	*			cis	-134	177.3	33.3	-62.6	-179.8	-43.8	0	0	114.5
79	D	23.5	Very low	24.7	Very low	153 Å²	153	140.2 Å²	140.2	82%	0.818	78%	0.779	S	S	*	*			trans	-104.8	169.2	-163.1	-60.3	-85.6	0	0	0	116.8
80	F	24.6	Very low	24.8	Very low	193 Å²	193	144.7 Å²	144.7	85%	0.846	78%	0.784	S	S	*	*			trans	-55.3	174.7	156.3	-71.8	-83	0	0	0	112.3
81	P	32.9	Very low	24.9	Very low	117 Å²	117	142.9 Å²	142.9	76%	0.76	78%	0.783	S	S	*	*			cis	-153.5	171.9	31.7	44.5	-22.4	0	0	0	121.9
82	T	23.3	Very low	24.9	Very low	125 Å²	125	138.9 Å²	138.9	77%	0.767	78%	0.782	S	S	*	*			trans	-25.3	140.3	147.4	-34.2	0	0	0	0	117.7
83	S	25.8	Very low	24.8	Very low	114 Å²	114	140.9 Å²	140.9	80%	0.797	79%	0.788	S	S	*	*				-172.7	149.6	129	45.1	0	0	0	0	113.6
84	T	25.5	Very low	24.8	Very low	123 Å²	123	141 Å²	141	76%	0.755	79%	0.789	S	S	*	*			trans	-79.1	168.2	170.1	13.6	0	0	0	0	112.1
85	P	29	Very low	24.8	Very low	128 Å²	128	140.9 Å²	140.9	83%	0.831	79%	0.789	S	S	*	*				-135.9	167.4	114.6	38.4	-30	0	0	0	114.5
86	V	25	Very low	24.7	Very low	124 Å²	124	141.9 Å²	141.9	75%	0.752	80%	0.795	S	S	*	*			trans	-125.1	136.8	178.5	168.7	0	0	0	0	108.9
87	N	22.9	Very low	24.5	Very low	153 Å²	153	139.5 Å²	139.5	82%	0.818	79%	0.792	S	S	*	*			trans	-164	156.7	141.7	-130.8	-28.9	0	0	0	114.6
88	C	22.7	Very low	24.9	Very low	104 Å²	104	140.5 Å²	140.5	70%	0.703	80%	0.797	S	S	*	*			trans	-129.3	151.9	173.1	-57.6	0	0	0	0	109.4
89	K	25.8	Very low	24.7	Very low	188 Å²	188	137.3 Å²	137.3	82%	0.817	79%	0.79	S	S	*	*				169.9	134.1	130	-95.5	158.8	-177.5	172.1	0	115.8
90	K	24.5	Very low	24.7	Very low	208 Å²	208	135.9 Å²	135.9	90%	0.904	79%	0.786	S	S	*	*			trans	64.8	163.4	140.8	-70.9	-168.1	169.7	-165.6	0	120.1
91	A	23.6	Very low	24.6	Very low	92 Å²	92	135.3 Å²	135.3	76%	0.76	78%	0.784	S	S	*	*			trans	-137.6	163.8	-176.2	0	0	0	0	0	110.4
92	T	23.3	Very low	24.1	Very low	128 Å²	128	134.6 Å²	134.6	79%	0.785	78%	0.777	S	S	*	*			trans	-165.1	123.8	155.1	26.7	0	0	0	0	111
93	E	22.4	Very low	24.1	Very low	179 Å²	179	138.8 Å²	138.8	84%	0.836	78%	0.779	S	S	*	*			trans	40.6	151.4	133.1	-58.1	-176.9	139.9	0	0	125.1
94	S	22.4	Very low	23.9	Very low	109 Å²	109	144.2 Å²	144.2	76%	0.762	78%	0.782	S	S	*	*			trans	89.3	97.9	145.6	69.6	0	0	0	0	121.9
95	D	21.2	Very low	23.8	Very low	156 Å²	156	141.6 Å²	141.6	83%	0.834	78%	0.78	S	S	*	*				75.7	158.7	114	-99	-31	0	0	0	125.9
96	T	23.4	Very low	24.4	Very low	134 Å²	134	141 Å²	141	82%	0.822	78%	0.776	S	S	*	*			trans	72.9	131.5	168.2	58	0	0	0	0	122.7
97	T	22.4	Very low	24.3	Very low	123 Å²	123	142.6 Å²	142.6	76%	0.755	78%	0.777	S	S	*	*			trans	-100	168.6	165.5	66.7	0	0	0	0	109.1
98	P	31.3	Very low	24.4	Very low	116 Å²	116	140.5 Å²	140.5	75%	0.753	77%	0.766	S	S	*	*				-137.5	150.2	69.2	16.8	8.8	0	0	0	114.8
99	V	23.5	Very low	24.6	Very low	117 Å²	117	145.1 Å²	145.1	71%	0.709	77%	0.768	S	S	*	*				57.2	125.3	83.1	-164.2	0	0	0	0	115.9
100	V	23.6	Very low	24.7	Very low	122 Å²	122	142.6 Å²	142.6	74%	0.739	76%	0.763	S	S	*	*			trans	156.4	111.8	130.2	164.9	0	0	0	0	114
101	F	21.2	Very low	24.8	Very low	182 Å²	182	143.9 Å²	143.9	80%	0.798	76%	0.763	S	S	*	*			trans	45.3	159.1	139.5	-74.5	-118.6	0	0	0	124.2
102	V	23.2	Very low	24.9	Very low	102 Å²	102	143.2 Å²	143.2	62%	0.618	77%	0.765	S	S	*	*			cis	-173.6	148.4	-34.7	91.8	0	0	0	0	112.1
103	R	23	Very low	25	Very low	213 Å²	213	142.4 Å²	142.4	80%	0.804	77%	0.771	S	S	*	*			trans	61.4	168.5	163	-73.8	169.8	175.2	165.4	-2.1	116.9
104	R	21.9	Very low	25.2	Very low	227 Å²	227	137.4 Å²	137.4	86%	0.857	77%	0.768	S	S	*	*			cis	-148.1	142.1	6.4	-122.5	154.2	-178.6	174.4	-1.3	105.2
105	G	23.1	Very low	25.5	Very low	69 Å²	69	142.2 Å²	142.2	71%	0.711	78%	0.775	S	S	*	*				77.9	161.8	66.7	0	0	0	0	0	113
106	P	41.4	Very low	26	Very low	115 Å²	115	141.9 Å²	141.9	75%	0.747	77%	0.773	S	S	*	*			cis	-143.5	-151.6	-27.8	36.9	-13.4	0	0	0	113
107	M	23.5	Very low	26.4	Very low	157 Å²	157	145 Å²	145	77%	0.773	78%	0.778	S	S	*	*			trans	85.2	142.7	166	-56.8	-52.2	-163.6	0	0	118.4
108	D	25.1	Very low	26.8	Very low	110 Å²	110	150.6 Å²	150.6	59%	0.588	79%	0.786	S	S	*	*			cis	-154.7	157.9	-13.3	-141	-2.8	0	0	0	115.2
109	R	26.9	Very low	27.2	Very low	201 Å²	201	152.5 Å²	152.5	76%	0.758	79%	0.789	S	S	*	*			trans	18.6	158.6	140.3	-82.5	170.3	-180	160.5	-5	124
110	N	27.9	Very low	27.8	Very low	134 Å²	134	152.5 Å²	152.5	72%	0.717	79%	0.786	S	S	*	*			cis	-165	179	7	-141.1	-19.1	0	0	0	115.7
111	R	26.8	Very low	28.7	Very low	236 Å²	236	153 Å²	153	89%	0.891	78%	0.783	S	S	*	*			trans	74.9	124.7	168	-62.1	177.7	177.3	-174.6	-1.9	115.5
112	G	25.7	Very low	29.9	Very low	78 Å²	78	147.3 Å²	147.3	80%	0.804	77%	0.766	S	S	*	*			cis	90.8	140.2	2.3	0	0	0	0	0	113.7
113	A	26.1	Very low	31.2	Very low	111 Å²	111	145.6 Å²	145.6	92%	0.917	76%	0.756	S	S	*	*			cis	-161.3	177.1	4.3	0	0	0	0	0	108.8
114	G	26.6	Very low	32.5	Very low	74 Å²	74	140.5 Å²	140.5	76%	0.763	74%	0.743	S	S	*	*			cis	130.8	130.6	2.3	0	0	0	0	0	112.4
115	K	28.3	Very low	33.6	Very low	209 Å²	209	136.8 Å²	136.8	91%	0.909	73%	0.733	S	S	*	*			trans	-159	142.2	172.1	-129.9	-170.8	-177.2	-163.2	0	113.4
116	D	32.2	Very low	34.5	Very low	150 Å²	150	139.5 Å²	139.5	80%	0.802	73%	0.728	S	S	*	*			trans	-98.7	168	-175.6	-45.6	-97.7	0	0	0	114.1
117	E	30.4	Very low	34.7	Very low	200 Å²	200	142.9 Å²	142.9	94%	0.935	73%	0.725	S	S	*	*				-160.7	176.5	116.5	-112	167.6	-150	0	0	112.6
118	R	31.5	Very low	35.7	Very low	240 Å²	240	139.7 Å²	139.7	91%	0.906	71%	0.714	S	S	*	*			trans	-103.6	158.5	-156.2	-81.3	177.1	167.1	164.7	-4.9	116
119	N	39.7	Very low	36.5	Very low	155 Å²	155	139.6 Å²	139.6	83%	0.829	71%	0.713	S	S	*	*			trans	-53.9	143.6	166.8	-59.2	-22.3	0	0	0	112.6
120	D	34.8	Very low	37.1	Very low	118 Å²	118	135.3 Å²	135.3	63%	0.631	71%	0.705	S	S	*	*			trans	-117	124.5	167.1	-159.9	0.9	0	0	0	110.5	S122	D120-S122 VanDerWaalsContact C-N 3.31Å; D120-S122 PolarHBondContact O-N 2.91Å; D120-S122 PolarHBondContact OD1-OG 3.01Å; D120-S122 PolarHBondContact OD2-OG 3.33Å; D120-S122 VanDerWaalsContact OD2-OG 3.05Å
121	L	44.1	Very low	37.8	Very low	132 Å²	132	133 Å²	133	69%	0.691	71%	0.706	S	S	*	*	S	Bend	trans	-83.1	-9.1	-171.1	-116.2	70.4	0	0	0	113.4
122	S	46	Very low	38.3	Very low	62 Å²	62	127.2 Å²	127.2	43%	0.434	70%	0.696	S	S	.	*	H	α-helix	trans	-58.2	-53.5	177.6	51	0	0	0	0	112.5	D120 I124 K125 E126	D120-S122 VanDerWaalsContact C-N 3.31Å; D120-S122 PolarHBondContact O-N 2.91Å; D120-S122 PolarHBondContact OD1-OG 3.01Å; D120-S122 PolarHBondContact OD2-OG 3.33Å; D120-S122 VanDerWaalsContact OD2-OG 3.05Å; S122-I124 VanDerWaalsContact C-N 3.29Å; S122-I124 PolarHBondContact O-N 3.06Å; S122-K125 WeakPolarHBondContact O-CB 3.44Å; S122-K125 PolarHBondContact O-N 3.06Å; S122-K125 VanDerWaalsContact O-N 3.15Å; S122-E126 PolarHBondContact O-N 3.03Å
123	V	49.3	Very low	38.7	Very low	66 Å²	66	128 Å²	128	40%	0.4	69%	0.689	S	S	.	*	H	α-helix	trans	-64.2	-30	-173.5	-176.7	0	0	0	0	112.9	R127	V123-R127 WeakPolarHBondContact O-CG 3.14Å; V123-R127 PolarHBondContact O-N 3.41Å
124	I	52	Low	38.8	Very low	107 Å²	107	130.1 Å²	130.1	55%	0.549	69%	0.685	S	S	.	*	H	α-helix	trans	-72.2	-40.7	178.1	-58.9	177.2	0	0	0	110.3	S122 E126 R127 V128	S122-I124 VanDerWaalsContact C-N 3.29Å; S122-I124 PolarHBondContact O-N 3.06Å; I124-E126 VanDerWaalsContact C-N 3.34Å; I124-E126 PolarHBondContact O-N 2.65Å; I124-R127 PolarHBondContact O-N 2.74Å; I124-V128 WeakPolarHBondContact O-CG2 3.35Å; I124-V128 PolarHBondContact O-N 2.75Å; I124-V128 VanDerWaalsContact O-N 3.13Å
125	K	43.7	Very low	39.2	Very low	149 Å²	149	135.8 Å²	135.8	65%	0.648	69%	0.692	S	S	*	*	H	α-helix	trans	-63.1	-39.9	179	-172.5	-178.1	178.2	-174.8	0	112	S122 V128 L129	S122-K125 WeakPolarHBondContact O-CB 3.44Å; S122-K125 PolarHBondContact O-N 3.06Å; S122-K125 VanDerWaalsContact O-N 3.15Å; K125-V128 PolarHBondContact O-N 3.4Å; K125-L129 HydrophobicContact CG-CD1 4.22Å; K125-L129 WeakPolarHBondContact O-CG 3.31Å; K125-L129 PolarHBondContact O-N 2.82Å; K125-L129 VanDerWaalsContact O-N 3.08Å
126	E	43.2	Very low	39	Very low	126 Å²	126	131 Å²	131	59%	0.589	68%	0.684	S	S	*	*	H	α-helix	trans	-66.5	-42.9	179.1	-168.7	169.2	-138.8	0	0	112.2	S122 I124 V128 L129 N130	S122-E126 PolarHBondContact O-N 3.03Å; I124-E126 VanDerWaalsContact C-N 3.34Å; I124-E126 PolarHBondContact O-N 2.65Å; E126-V128 PolarHBondContact O-N 3.3Å; E126-L129 PolarHBondContact O-N 3.38Å; E126-N130 PolarHBondContact O-N 2.92Å; E126-N130 VanDerWaalsContact O-N 3.12Å
127	R	45.7	Very low	38.8	Very low	185 Å²	185	131.4 Å²	131.4	70%	0.698	69%	0.685	S	S	*	*	H	α-helix	trans	-63.3	-39.2	174.9	-69.4	177.8	-173.3	-172.4	2.4	112.9	V123 I124 A131	V123-R127 WeakPolarHBondContact O-CG 3.14Å; V123-R127 PolarHBondContact O-N 3.41Å; I124-R127 PolarHBondContact O-N 2.74Å; R127-A131 WeakPolarHBondContact O-CB 3.23Å; R127-A131 PolarHBondContact O-N 2.66Å
128	V	43.5	Very low	38.5	Very low	90 Å²	90	127 Å²	127	55%	0.545	68%	0.677	S	S	.	*	H	α-helix	trans	-69.3	-35.7	177.7	172.4	0	0	0	0	111.9	I124 K125 E126 A131 V132	I124-V128 WeakPolarHBondContact O-CG2 3.35Å; I124-V128 PolarHBondContact O-N 2.75Å; I124-V128 VanDerWaalsContact O-N 3.13Å; K125-V128 PolarHBondContact O-N 3.4Å; E126-V128 PolarHBondContact O-N 3.3Å; V128-A131 PolarHBondContact O-N 3.38Å; V128-V132 WeakPolarHBondContact O-CG2 3.43Å
129	L	41.5	Very low	38.2	Very low	108 Å²	108	118.7 Å²	118.7	57%	0.565	67%	0.666	S	S	*	*	H	α-helix	trans	-67.5	-42.7	176	-76.5	165.4	0	0	0	112.3	K125 E126 A131 V132 S133	K125-L129 HydrophobicContact CG-CD1 4.22Å; K125-L129 WeakPolarHBondContact O-CG 3.31Å; K125-L129 PolarHBondContact O-N 2.82Å; K125-L129 VanDerWaalsContact O-N 3.08Å; E126-L129 PolarHBondContact O-N 3.38Å; L129-A131 VanDerWaalsContact C-N 3.3Å; L129-A131 PolarHBondContact O-N 2.87Å; L129-V132 PolarHBondContact O-N 3.38Å; L129-S133 PolarHBondContact O-OG 3.41Å
130	N	39.8	Very low	37.6	Very low	111 Å²	111	122 Å²	122	59%	0.594	67%	0.668	S	S	*	*	H	α-helix	trans	-65.9	-33.4	178	-68.6	-6.9	0	0	0	112.1	E126 V132 S133	E126-N130 PolarHBondContact O-N 2.92Å; E126-N130 VanDerWaalsContact O-N 3.12Å; N130-V132 PolarHBondContact O-N 3.26Å; N130-S133 PolarHBondContact O-N 3.39Å
131	A	42	Very low	37.3	Very low	87 Å²	87	127.2 Å²	127.2	72%	0.719	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-6.5	177.3	0	0	0	0	0	115	R127 V128 L129	R127-A131 WeakPolarHBondContact O-CB 3.23Å; R127-A131 PolarHBondContact O-N 2.66Å; V128-A131 PolarHBondContact O-N 3.38Å; L129-A131 VanDerWaalsContact C-N 3.3Å; L129-A131 PolarHBondContact O-N 2.87Å
132	V	38.3	Very low	36.3	Very low	114 Å²	114	126.5 Å²	126.5	69%	0.691	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	-8.3	-178.1	173.4	0	0	0	0	112.5	V128 L129 N130	V128-V132 WeakPolarHBondContact O-CG2 3.43Å; L129-V132 PolarHBondContact O-N 3.38Å; N130-V132 PolarHBondContact O-N 3.26Å
133	S	33.8	Very low	35.5	Very low	93 Å²	93	128.6 Å²	128.6	65%	0.65	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-32.1	-174.6	-59.5	0	0	0	0	114.3	L129 N130 Q135	L129-S133 PolarHBondContact O-OG 3.41Å; N130-S133 PolarHBondContact O-N 3.39Å; S133-Q135 PolarHBondContact O-N 3Å
134	D	29	Very low	34.3	Very low	157 Å²	157	131.3 Å²	131.3	84%	0.84	71%	0.712	S	S	*	*			trans	-97.2	75.1	-176.2	-75.9	-39	0	0	0	112.8
135	Q	34.4	Very low	33	Very low	193 Å²	193	133.5 Å²	133.5	90%	0.902	73%	0.725	S	S	*	*			trans	-133.2	91	160.5	-104.4	-166.8	13.2	0	0	112.8	S133	S133-Q135 PolarHBondContact O-N 3Å
136	S	25	Very low	32.1	Very low	107 Å²	107	135.7 Å²	135.7	75%	0.748	74%	0.735	S	S	*	*			trans	-153.4	131.1	158.2	75	0	0	0	0	108.8
137	L	27.4	Very low	31.3	Very low	159 Å²	159	136.8 Å²	136.8	83%	0.832	75%	0.75	S	S	*	*			cis	-135.3	153.4	-2.6	-75.7	99.9	0	0	0	112.5
138	S	24.3	Very low	30.2	Very low	108 Å²	108	131.4 Å²	131.4	76%	0.755	75%	0.752	S	S	*	*			trans	23.9	131.8	140.1	-172.5	0	0	0	0	121
139	G	24.4	Very low	29.3	Very low	65 Å²	65	135.3 Å²	135.3	67%	0.67	77%	0.77	S	S	*	*			cis	157.9	-176.3	-2.5	0	0	0	0	0	116.5
140	Y	27.1	Very low	28.5	Very low	226 Å²	226	134.6 Å²	134.6	89%	0.886	77%	0.774	S	S	*	*			trans	60.4	104.8	164.4	-72.9	-80.7	0	0	0	121.1
141	R	29.4	Very low	27.9	Very low	226 Å²	226	135.4 Å²	135.4	85%	0.853	79%	0.785	S	S	*	*			trans	-60.2	157.7	140.7	-74	176.6	166.8	173.8	-5.3	110.6
142	S	22.9	Very low	27.1	Very low	118 Å²	118	140.4 Å²	140.4	83%	0.825	79%	0.79	S	S	*	*			trans	-134.9	151.5	138.5	-167.1	0	0	0	0	110
143	V	28.3	Very low	26.3	Very low	105 Å²	105	139.8 Å²	139.8	64%	0.636	79%	0.791	S	S	*	*			trans	-131.3	137.8	-177.1	170.1	0	0	0	0	108.2
144	T	24.5	Very low	25.8	Very low	124 Å²	124	143.5 Å²	143.5	76%	0.761	80%	0.8	S	S	*	*			trans	-134.9	81.1	164.5	54.8	0	0	0	0	111.9
145	N	25.2	Very low	25.7	Very low	153 Å²	153	141.3 Å²	141.3	82%	0.818	80%	0.795	S	S	*	*			trans	-63.8	131.6	148.7	-84.8	-7.5	0	0	0	108.3
146	K	25.3	Very low	25.1	Very low	195 Å²	195	139.1 Å²	139.1	85%	0.848	79%	0.789	S	S	*	*			trans	-143.3	69.9	170.8	-95.7	-161	176.9	-176	0	112.2
147	T	25.5	Very low	25.2	Very low	149 Å²	149	142.2 Å²	142.2	91%	0.914	80%	0.797	S	S	*	*			trans	-142.5	137.6	150.5	37.1	0	0	0	0	108.5
148	G	23.1	Very low	25.1	Very low	71 Å²	71	140.3 Å²	140.3	73%	0.732	79%	0.788	S	S	*	*			trans	-177.9	88.7	-174.7	0	0	0	0	0	112.3
149	N	24.4	Very low	25.2	Very low	172 Å²	172	141.1 Å²	141.1	92%	0.92	79%	0.787	S	S	*	*			trans	-160	122	149.7	-104.1	-17	0	0	0	108.6
150	S	24.9	Very low	25.2	Very low	94 Å²	94	143.7 Å²	143.7	66%	0.657	79%	0.79	S	S	*	*			trans	-87.1	166.7	175.4	62.7	0	0	0	0	111.3
151	P	27.4	Very low	25.2	Very low	127 Å²	127	140 Å²	140	83%	0.825	79%	0.785	S	S	*	*				-121.3	176.8	94.8	21.3	-8.3	0	0	0	114.3
152	K	24.6	Very low	25.1	Very low	192 Å²	192	134.6 Å²	134.6	84%	0.835	78%	0.778	S	S	*	*			trans	-83.4	169.1	-176.4	-57.1	166	-176.7	172.1	0	108.7
153	S	21.8	Very low	25.5	Very low	101 Å²	101	136.5 Å²	136.5	71%	0.706	78%	0.778	S	S	*	*			cis	-170.4	150.4	34.8	55.3	0	0	0	0	115.8
154	M	23.4	Very low	25.5	Very low	171 Å²	171	136.3 Å²	136.3	84%	0.842	78%	0.777	S	S	*	*			trans	68.1	166.9	150.2	-63.9	-64.3	-175.2	0	0	116.8
155	P	26.3	Very low	25.8	Very low	111 Å²	111	135.1 Å²	135.1	72%	0.721	77%	0.771	S	S	*	*				-133	138.7	-78.1	34.6	-16.3	0	0	0	113.9
156	N	22.8	Very low	26.2	Very low	147 Å²	147	133.1 Å²	133.1	79%	0.786	76%	0.761	S	S	*	*			trans	-106.3	124.2	171	-89.6	-12.2	0	0	0	111.6	L158	N156-L158 HydrophobicContact CB-CD1 4.49Å; N156-L158 PolarHBondContact O-N 3.41Å; N156-L158 VanDerWaalsContact O-N 3.14Å
157	D	26.8	Very low	26.7	Very low	172 Å²	172	132 Å²	132	92%	0.92	76%	0.759	S	S	*	*			trans	-65	105.5	157.5	-79.4	-46.2	0	0	0	108.9
158	L	25	Very low	27.2	Very low	120 Å²	120	134 Å²	134	63%	0.628	75%	0.751	S	S	*	*			trans	-120.7	98.8	176	-109.1	163.6	0	0	0	109.1	N156 T160	N156-L158 HydrophobicContact CB-CD1 4.49Å; N156-L158 PolarHBondContact O-N 3.41Å; N156-L158 VanDerWaalsContact O-N 3.14Å; L158-T160 PolarHBondContact O-N 3.23Å; L158-T160 VanDerWaalsContact O-N 3.16Å
159	V	25.8	Very low	28.2	Very low	124 Å²	124	137.9 Å²	137.9	75%	0.752	74%	0.743	S	S	*	*			trans	-59.9	115.7	174.8	176.4	0	0	0	0	109.2	L161	V159-L161 HydrophobicContact CG1-CD1 4.33Å; V159-L161 PolarHBondContact O-N 2.76Å
160	T	24.7	Very low	29.1	Very low	119 Å²	119	133.7 Å²	133.7	73%	0.73	72%	0.724	S	S	*	*			trans	-74	95.4	178.2	46.3	0	0	0	0	111.1	L158	L158-T160 PolarHBondContact O-N 3.23Å; L158-T160 VanDerWaalsContact O-N 3.16Å
161	L	27.1	Very low	29.8	Very low	150 Å²	150	136.3 Å²	136.3	79%	0.785	73%	0.726	S	S	*	*			trans	-109.2	122.5	157.3	-77.1	152.5	0	0	0	106.3	V159	V159-L161 HydrophobicContact CG1-CD1 4.33Å; V159-L161 PolarHBondContact O-N 2.76Å
162	T	26.8	Very low	30.7	Very low	112 Å²	112	134.7 Å²	134.7	69%	0.687	71%	0.71	S	S	*	*			cis	-138.2	129.4	12.5	52.2	0	0	0	0	112.7	V164	T162-V164 PolarHBondContact O-N 2.91Å
163	D	31.2	Very low	32	Very low	157 Å²	157	131.1 Å²	131.1	84%	0.84	70%	0.699	S	S	*	*			trans	-77	116.8	162.5	-80.3	-41.5	0	0	0	110.1
164	V	29.8	Very low	33.7	Very low	102 Å²	102	129.9 Å²	129.9	62%	0.618	68%	0.679	S	S	*	*			trans	-138.9	130.5	167.1	-176.9	0	0	0	0	107.6	T162	T162-V164 PolarHBondContact O-N 2.91Å
165	P	29.4	Very low	35.3	Very low	98 Å²	98	127.2 Å²	127.2	64%	0.636	66%	0.664	S	S	*	*			trans	-62.6	145.1	-177.5	-24.6	35	0	0	0	114.3	E167	P165-E167 PolarHBondContact O-N 3.07Å; P165-E167 VanDerWaalsContact O-N 3.09Å
166	D	35.2	Very low	36.9	Very low	111 Å²	111	122.8 Å²	122.8	59%	0.594	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-65	-12	-173.4	-90.1	-47.4	0	0	0	115.9	Y168 R169	D166-Y168 PolarHBondContact O-N 3.49Å; D166-R169 PolarHBondContact O-N 3.47Å; D166-R169 WeakPolarHBondContact OD1-CD 3.47Å; D166-R169 IonicContact OD1-CZ 3.85Å; D166-R169 IonicContact OD1-NE 2.76Å; D166-R169 IonicContact OD1-NH1 3.51Å; D166-R169 PolarHBondContact OD1-NH1 3.2Å
167	E	34.1	Very low	38.3	Very low	172 Å²	172	123 Å²	123	80%	0.804	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-66.4	-11.9	-170.3	-62.2	-172.2	142.5	0	0	114.7	P165	P165-E167 PolarHBondContact O-N 3.07Å; P165-E167 VanDerWaalsContact O-N 3.09Å
168	Y	36.2	Very low	39.4	Very low	192 Å²	192	119.7 Å²	119.7	75%	0.753	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-99.3	1.5	178.7	-70.8	-79.1	0	0	0	115	D166 T170	D166-Y168 PolarHBondContact O-N 3.49Å; Y168-T170 VanDerWaalsContact C-N 3.28Å; Y168-T170 PolarHBondContact O-N 3.29Å
169	R	44.4	Very low	40.4	Very low	151 Å²	151	118 Å²	118	57%	0.57	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-77.2	1	-175.1	-76.1	-166.5	154.1	126.2	-5.1	116	D166 H171 L172	D166-R169 PolarHBondContact O-N 3.47Å; D166-R169 WeakPolarHBondContact OD1-CD 3.47Å; D166-R169 IonicContact OD1-CZ 3.85Å; D166-R169 IonicContact OD1-NE 2.76Å; D166-R169 IonicContact OD1-NH1 3.51Å; D166-R169 PolarHBondContact OD1-NH1 3.2Å; R169-H171 PolarHBondContact O-N 3.37Å; R169-H171 VanDerWaalsContact O-N 3.14Å; R169-L172 HydrophobicContact CB-CD1 4.4Å; R169-L172 HydrophobicContact CG-CD1 4.06Å; R169-L172 PolarHBondContact O-N 2.81Å
170	T	43.1	Very low	41.3	Very low	85 Å²	85	118.5 Å²	118.5	52%	0.521	59%	0.594	S	S	.	*	G	3₁₀ helix	trans	-59	-26.7	180	47.4	0	0	0	0	114	Y168 L172 L173	Y168-T170 VanDerWaalsContact C-N 3.28Å; Y168-T170 PolarHBondContact O-N 3.29Å; T170-L172 VanDerWaalsContact C-N 3.33Å; T170-L173 PolarHBondContact O-N 3Å
171	H	40.8	Very low	42.2	Very low	149 Å²	149	115.4 Å²	115.4	69%	0.69	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-79.3	-7.9	177.1	-63.1	-73.6	0	0	0	114.9	R169	R169-H171 PolarHBondContact O-N 3.37Å; R169-H171 VanDerWaalsContact O-N 3.14Å
172	L	45.2	Very low	42.6	Very low	93 Å²	93	115 Å²	115	49%	0.487	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-89.3	-12.3	173.3	-75	156	0	0	0	112.6	R169 T170 W174 A268	R169-L172 HydrophobicContact CB-CD1 4.4Å; R169-L172 HydrophobicContact CG-CD1 4.06Å; R169-L172 PolarHBondContact O-N 2.81Å; T170-L172 VanDerWaalsContact C-N 3.33Å; L172-W174 PolarHBondContact O-N 3.34Å; L172-A268 HydrophobicContact CD2-CB 4.45Å
173	L	53.1	Low	43.3	Very low	116 Å²	116	118.8 Å²	118.8	61%	0.607	59%	0.592	S	S	*	*			trans	-84.1	96.7	170.9	-68.9	169	0	0	0	108.7	T170 E175	T170-L173 PolarHBondContact O-N 3Å; L173-E175 HydrophobicContact CB-CG 4.5Å; L173-E175 PolarHBondContact O-N 2.94Å
174	W	57.4	Low	43.8	Very low	75 Å²	75	116.4 Å²	116.4	28%	0.284	58%	0.583	S	S	.	*			trans	-69.7	59.8	169.6	-67.8	103.5	0	0	0	111.3	L172 M261 Q264 K265	L172-W174 PolarHBondContact O-N 3.34Å; W174-M261 HydrophobicContact CB-CE 4.01Å; W174-M261 HydrophobicContact CE3-CE 4.24Å; W174-M261 HydrophobicContact CE3-SD 4.23Å; W174-M261 WeakPolarHBondContact O-CE 3.47Å; W174-Q264 HydrophobicContact CB-CB 4.4Å; W174-Q264 HydrophobicContact CD2-CB 3.81Å; W174-Q264 HydrophobicContact CD2-CG 4.37Å; W174-Q264 HydrophobicContact CE3-CB 4.36Å; W174-Q264 HydrophobicContact CG-CB 3.8Å; W174-Q264 HydrophobicContact CZ2-CG 4.49Å; W174-K265 HydrophobicContact CB-CG 3.87Å; W174-K265 WeakPolarHBondContact O-CE 3.31Å
175	E	56	Low	44.4	Very low	115 Å²	115	116.8 Å²	116.8	54%	0.537	59%	0.587	S	S	.	*	S	Bend	trans	-118.4	76.2	179.2	-65.5	-162	155.1	0	0	110	L173 Y177	L173-E175 HydrophobicContact CB-CG 4.5Å; L173-E175 PolarHBondContact O-N 2.94Å; E175-Y177 PolarHBondContact O-N 2.96Å
176	Y	58.9	Low	45.3	Very low	18 Å²	18	123.2 Å²	123.2	7%	0.071	60%	0.599	C	S	.	*			trans	29.8	75.5	165.3	-80.4	-77.3	0	0	0	115.1	K178 C208 G211 R213 P219 F236 A257 M261	Y176-K178 PolarHBondContact O-N 3.32Å; Y176-C208 WeakPolarHBondContact CE1-O 3.48Å; Y176-G211 WeakPolarHBondContact CA-O 3.44Å; Y176-R213 VanDerWaalsContact O-CB 3.31Å; Y176-R213 WeakPolarHBondContact O-CB 3.23Å; Y176-P219 HydrophobicContact CD1-CG 4.18Å; Y176-P219 HydrophobicContact CD2-CB 3.83Å; Y176-P219 HydrophobicContact CD2-CG 3.9Å; Y176-P219 HydrophobicContact CE2-CB 4.29Å; Y176-P219 HydrophobicContact CG-CB 4.07Å; Y176-P219 HydrophobicContact CG-CG 3.62Å; Y176-F236 HydrophobicContact CE1-CE1 4.08Å; Y176-F236 HydrophobicContact CE2-CE1 4.07Å; Y176-F236 HydrophobicContact CE2-CZ 4.19Å; Y176-F236 AromaticContact CZ-CE1 3.66Å; Y176-F236 AromaticContact CZ-CZ 3.8Å; Y176-F236 VanDerWaalsContact OH-CZ 3.32Å; Y176-F236 WeakPolarHBondContact OH-CZ 3.48Å; Y176-A257 WeakPolarHBondContact OH-CB 3.2Å; Y176-A257 PolarHBondContact OH-O 3.43Å; Y176-M261 HydrophobicContact CD2-CE 4.25Å; Y176-M261 HydrophobicContact CE2-CB 4.32Å; Y176-M261 HydrophobicContact CE2-CE 4.2Å; Y176-M261 HydrophobicContact CE2-CG 3.87Å; Y176-M261 HydrophobicContact CG-CE 4.5Å; Y176-M261 WeakPolarHBondContact OH-CG 3.47Å
177	Y	54.2	Low	45.8	Very low	151 Å²	151	120.7 Å²	120.7	59%	0.592	59%	0.593	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-66.1	127.5	-168.2	-171	-92.2	0	0	0	111.2	E175 V179 G211 R213	E175-Y177 PolarHBondContact O-N 2.96Å; Y177-V179 HydrophobicContact CD1-CG2 4.36Å; Y177-V179 PolarHBondContact O-N 2.95Å; Y177-G211 PolarHBondContact N-O 3.23Å; Y177-R213 PolarHBondContact O-N 3.35Å
178	K	48.1	Very low	46.8	Very low	104 Å²	104	120 Å²	120	45%	0.452	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.7	106.6	176.6	179.1	165.7	173.4	-85.1	0	109.7	Y176 D180	Y176-K178 PolarHBondContact O-N 3.32Å; K178-D180 IonicContact NZ-OD1 2.66Å; K178-D180 PolarHBondContact NZ-OD1 3.26Å; K178-D180 IonicContact NZ-OD2 2.65Å; K178-D180 PolarHBondContact NZ-OD2 3.48Å; K178-D180 PolarHBondContact O-N 2.98Å
179	V	48	Very low	47.7	Very low	83 Å²	83	112 Å²	112	50%	0.503	56%	0.56	S	S	.	*			trans	-71	96.2	169.2	178	0	0	0	0	108.1	Y177 G181 I212	Y177-V179 HydrophobicContact CD1-CG2 4.36Å; Y177-V179 PolarHBondContact O-N 2.95Å; V179-G181 PolarHBondContact O-N 3.48Å; V179-I212 HydrophobicContact CG2-CG2 4Å
180	D	43.8	Very low	48.2	Very low	135 Å²	135	108.3 Å²	108.3	72%	0.722	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	64	166.2	-94.4	-57.1	0	0	0	109.8	K178	K178-D180 IonicContact NZ-OD1 2.66Å; K178-D180 PolarHBondContact NZ-OD1 3.26Å; K178-D180 IonicContact NZ-OD2 2.65Å; K178-D180 PolarHBondContact NZ-OD2 3.48Å; K178-D180 PolarHBondContact O-N 2.98Å
181	G	43.3	Very low	48.9	Very low	54 Å²	54	108 Å²	108	56%	0.557	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.2	-7.2	-164.5	0	0	0	0	0	115.8	V179	V179-G181 PolarHBondContact O-N 3.48Å
182	D	35.2	Very low	50	Low	143 Å²	143	103.4 Å²	103.4	77%	0.765	55%	0.547	S	S	*	.			trans	-151.5	141.9	153.6	-134.9	-28.5	0	0	0	114.2
183	K	41	Very low	51.4	Low	190 Å²	190	103.1 Å²	103.1	83%	0.826	55%	0.551	S	S	*	*			trans	-107	65.7	173.5	-78.1	-176.3	-179.4	171.7	0	109.2	P185	K183-P185 WeakPolarHBondContact O-CD 3.41Å; K183-P185 VanDerWaalsContact O-N 3.09Å
184	V	41.7	Very low	52.2	Low	107 Å²	107	102.6 Å²	102.6	65%	0.648	55%	0.548	S	S	*	.			trans	-54	118.3	164.4	-174.4	0	0	0	0	107
185	P	43.4	Very low	53	Low	110 Å²	110	105.5 Å²	105.5	71%	0.714	57%	0.569	S	S	*	*			trans	-62.1	143.2	176.9	27	-33.6	0	0	0	108.1	K183 A187	K183-P185 WeakPolarHBondContact O-CD 3.41Å; K183-P185 VanDerWaalsContact O-N 3.09Å; P185-A187 VanDerWaalsContact C-N 3.31Å; P185-A187 PolarHBondContact O-N 3.36Å
186	R	48.5	Very low	53.8	Low	234 Å²	234	102.8 Å²	102.8	88%	0.883	56%	0.562	S	S	*	*			trans	-58.1	92.1	-179.9	-73.1	179.2	174.6	170.1	-3.9	110.5
187	A	46.3	Very low	54.6	Low	57 Å²	57	102.6 Å²	102.6	47%	0.471	56%	0.562	S	S	.	*			trans	-59.6	140.5	165.2	0	0	0	0	0	107.9	P185 I189	P185-A187 VanDerWaalsContact C-N 3.31Å; P185-A187 PolarHBondContact O-N 3.36Å; A187-I189 VanDerWaalsContact C-N 3.28Å; A187-I189 PolarHBondContact O-N 2.71Å
188	E	53.8	Low	55.7	Low	158 Å²	158	97.1 Å²	97.1	74%	0.738	54%	0.542	S	S	*	.			trans	-71.7	90.3	175.8	-65.2	-176.4	159.3	0	0	108	A190 A191	E188-A190 PolarHBondContact O-N 2.84Å; E188-A190 VanDerWaalsContact O-N 3.1Å; E188-A191 HydrophobicContact CB-CB 4.16Å; E188-A191 WeakPolarHBondContact O-CA 3.37Å; E188-A191 WeakPolarHBondContact O-CB 3.34Å; E188-A191 PolarHBondContact O-N 3.49Å
189	I	56.5	Low	57.1	Low	25 Å²	25	94.7 Å²	94.7	13%	0.128	54%	0.538	C	S	.	.	G	3₁₀ helix	trans	-52.4	-37.7	-174.1	-63.6	139.1	0	0	0	111.2	A187 A191 M192 Q197 L216 L242	A187-I189 VanDerWaalsContact C-N 3.28Å; A187-I189 PolarHBondContact O-N 2.71Å; I189-A191 PolarHBondContact O-N 2.76Å; I189-M192 HydrophobicContact CB-CE 4.46Å; I189-M192 HydrophobicContact CG1-CE 4.31Å; I189-M192 HydrophobicContact CG2-CE 4.37Å; I189-M192 PolarHBondContact O-N 2.8Å; I189-M192 VanDerWaalsContact O-N 3.09Å; I189-Q197 HydrophobicContact CG2-CG 4.42Å; I189-Q197 PolarHBondContact O-NE2 2.81Å; I189-L216 HydrophobicContact CD1-CD2 3.44Å; I189-L216 VanDerWaalsContact CD1-CD2 3.44Å; I189-L216 HydrophobicContact CG1-CD2 4.14Å; I189-L242 HydrophobicContact CG2-CD2 3.6Å; I189-L242 HydrophobicContact CG2-CG 4.46Å
190	A	54.2	Low	58.4	Low	73 Å²	73	93.7 Å²	93.7	60%	0.603	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-63	-15.4	175.7	0	0	0	0	0	115.1	E188	E188-A190 PolarHBondContact O-N 2.84Å; E188-A190 VanDerWaalsContact O-N 3.1Å
191	A	57.2	Low	59.9	Low	78 Å²	78	87.4 Å²	87.4	65%	0.645	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-98.6	-5.9	175.8	0	0	0	0	0	113.4	E188 I189	E188-A191 HydrophobicContact CB-CB 4.16Å; E188-A191 WeakPolarHBondContact O-CA 3.37Å; E188-A191 WeakPolarHBondContact O-CB 3.34Å; E188-A191 PolarHBondContact O-N 3.49Å; I189-A191 PolarHBondContact O-N 2.76Å
192	M	64.6	Low	61.6	Low	52 Å²	52	84.9 Å²	84.9	26%	0.256	47%	0.469	S	S	.	.	S	Bend	trans	-82.8	146.6	178.5	-62	-157.8	-67.7	0	0	112.3	I189 Q197 M200	I189-M192 HydrophobicContact CB-CE 4.46Å; I189-M192 HydrophobicContact CG1-CE 4.31Å; I189-M192 HydrophobicContact CG2-CE 4.37Å; I189-M192 PolarHBondContact O-N 2.8Å; I189-M192 VanDerWaalsContact O-N 3.09Å; M192-Q197 HydrophobicContact CB-CG 4.06Å; M192-Q197 PolarHBondContact O-NE2 2.86Å; M192-M200 HydrophobicContact CE-SD 3.97Å
193	P	74.1	Confident	63.6	Low	87 Å²	87	81.6 Å²	81.6	57%	0.565	45%	0.451	S	S	*	.			trans	-59.3	146.8	170.9	-22.6	33.8	0	0	0	112.3	L195 S196 Q197	P193-L195 PolarHBondContact O-N 3.15Å; P193-L195 VanDerWaalsContact O-N 3.14Å; P193-S196 WeakPolarHBondContact O-CA 3.45Å; P193-S196 WeakPolarHBondContact O-CB 3.36Å; P193-S196 PolarHBondContact O-N 2.65Å; P193-Q197 PolarHBondContact O-N 2.83Å
194	L	71.3	Confident	65.4	Low	106 Å²	106	73 Å²	73	56%	0.555	41%	0.414	S	S	*	.	H	α-helix	trans	-52.6	-38.3	-179.2	-71.6	166.8	0	0	0	113.5	S196 Q197 E198 D243	L194-S196 VanDerWaalsContact C-N 3.33Å; L194-S196 PolarHBondContact O-N 3.43Å; L194-Q197 PolarHBondContact O-N 3Å; L194-E198 WeakPolarHBondContact O-CB 3.43Å; L194-E198 PolarHBondContact O-N 2.94Å; L194-D243 HydrophobicContact CD2-CB 3.95Å
195	L	72.6	Confident	67.1	Low	136 Å²	136	67.9 Å²	67.9	71%	0.712	38%	0.383	S	S	*	.	H	α-helix	trans	-67.5	-31	177.1	-63.7	172.1	0	0	0	113	P193 S199	P193-L195 PolarHBondContact O-N 3.15Å; P193-L195 VanDerWaalsContact O-N 3.14Å; L195-S199 WeakPolarHBondContact O-CB 3.49Å; L195-S199 PolarHBondContact O-N 2.96Å
196	S	74.4	Confident	68.9	Low	58 Å²	58	62.9 Å²	62.9	41%	0.406	35%	0.35	S	S	.	.	H	α-helix	trans	-76.8	-36.1	174.4	-55.3	0	0	0	0	111.3	P193 L194 M200	P193-S196 WeakPolarHBondContact O-CA 3.45Å; P193-S196 WeakPolarHBondContact O-CB 3.36Å; P193-S196 PolarHBondContact O-N 2.65Å; L194-S196 VanDerWaalsContact C-N 3.33Å; L194-S196 PolarHBondContact O-N 3.43Å; S196-M200 WeakPolarHBondContact O-CB 3.37Å; S196-M200 PolarHBondContact O-N 3.22Å; S196-M200 VanDerWaalsContact O-N 3.1Å
197	Q	73.9	Confident	70.3	Confident	14 Å²	14	54.5 Å²	54.5	7%	0.065	32%	0.321	C	S	.	.	H	α-helix	trans	-63.4	-45.1	170.3	-64.3	179.6	-5.4	0	0	111.4	I189 M192 P193 L194 L201 L246	I189-Q197 HydrophobicContact CG2-CG 4.42Å; I189-Q197 PolarHBondContact O-NE2 2.81Å; M192-Q197 HydrophobicContact CB-CG 4.06Å; M192-Q197 PolarHBondContact O-NE2 2.86Å; P193-Q197 PolarHBondContact O-N 2.83Å; L194-Q197 PolarHBondContact O-N 3Å; Q197-L201 VanDerWaalsContact O-CB 3.31Å; Q197-L201 WeakPolarHBondContact O-CB 3.36Å; Q197-L201 WeakPolarHBondContact O-CG 3.37Å; Q197-L201 PolarHBondContact O-N 3.17Å; Q197-L246 HydrophobicContact CB-CD1 4.24Å
198	E	78.7	Confident	71.8	Confident	36 Å²	36	52 Å²	52	17%	0.168	30%	0.3	C	S	.	.	H	α-helix	trans	-62.9	-45	177.7	-173.8	-179.9	179.6	0	0	111.7	L194 L201 L202 L246 T308 L309	L194-E198 WeakPolarHBondContact O-CB 3.43Å; L194-E198 PolarHBondContact O-N 2.94Å; E198-L201 PolarHBondContact O-N 2.99Å; E198-L202 HydrophobicContact CG-CD1 4.1Å; E198-L202 HydrophobicContact CG-CG 4.5Å; E198-L202 WeakPolarHBondContact O-CB 3.44Å; E198-L202 WeakPolarHBondContact O-CG 3.39Å; E198-L202 PolarHBondContact O-N 3.03Å; E198-L246 HydrophobicContact CB-CD1 4.46Å; E198-L246 HydrophobicContact CB-CD2 4.3Å; E198-L246 HydrophobicContact CG-CD2 4.24Å; E198-T308 VanDerWaalsContact OE1-CA 3.27Å; E198-T308 WeakPolarHBondContact OE1-CA 3.29Å; E198-T308 VanDerWaalsContact OE1-CB 3.3Å; E198-T308 WeakPolarHBondContact OE1-CB 3.48Å; E198-L309 HydrophobicContact CG-CB 4.28Å; E198-L309 PolarHBondContact OE1-N 3.1Å
199	S	77.3	Confident	72.9	Confident	52 Å²	52	44.5 Å²	44.5	36%	0.364	27%	0.265	S	S	.	.	H	α-helix	trans	-62.5	-45.5	178.3	-168	0	0	0	0	112.4	L195 L202 D203	L195-S199 WeakPolarHBondContact O-CB 3.49Å; L195-S199 PolarHBondContact O-N 2.96Å; S199-L202 PolarHBondContact O-N 3.02Å; S199-D203 PolarHBondContact O-N 3.24Å; S199-D203 VanDerWaalsContact O-N 3.15Å
200	M	74.3	Confident	73.7	Confident	63 Å²	63	45 Å²	45	31%	0.31	27%	0.269	S	S	.	.	H	α-helix	trans	-65.8	-38.8	176.4	-172.8	178.7	179.8	0	0	112.2	M192 S196 D203 E204 L216	M192-M200 HydrophobicContact CE-SD 3.97Å; S196-M200 WeakPolarHBondContact O-CB 3.37Å; S196-M200 PolarHBondContact O-N 3.22Å; S196-M200 VanDerWaalsContact O-N 3.1Å; M200-D203 PolarHBondContact O-N 3.35Å; M200-E204 PolarHBondContact O-N 3.08Å; M200-L216 HydrophobicContact CE-CD1 3.98Å; M200-L216 HydrophobicContact CE-CG 4.34Å; M200-L216 HydrophobicContact CG-CD1 4.03Å; M200-L216 HydrophobicContact SD-CD1 4.04Å
201	L	75.9	Confident	74.4	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-67	-35.1	175	-82.2	178	0	0	0	113.1	Q197 E198 D203 L205 L216 L242 L246 V250	Q197-L201 VanDerWaalsContact O-CB 3.31Å; Q197-L201 WeakPolarHBondContact O-CB 3.36Å; Q197-L201 WeakPolarHBondContact O-CG 3.37Å; Q197-L201 PolarHBondContact O-N 3.17Å; E198-L201 PolarHBondContact O-N 2.99Å; L201-D203 VanDerWaalsContact C-N 3.34Å; L201-L205 WeakPolarHBondContact O-CB 3.49Å; L201-L205 PolarHBondContact O-N 2.94Å; L201-L216 HydrophobicContact CD2-CB 4.42Å; L201-L216 HydrophobicContact CD2-CD1 3.94Å; L201-L242 HydrophobicContact CD1-CD1 4.27Å; L201-L242 HydrophobicContact CD1-CD2 3.97Å; L201-L242 HydrophobicContact CD2-CD1 3.8Å; L201-L242 HydrophobicContact CD2-CD2 4.27Å; L201-L242 HydrophobicContact CG-CD1 4.5Å; L201-L242 HydrophobicContact CG-CD2 4.19Å; L201-L246 HydrophobicContact CD1-CB 4.04Å; L201-L246 HydrophobicContact CD1-CD1 4.26Å; L201-V250 HydrophobicContact CD1-CG2 4.44Å
202	L	78.5	Confident	75.1	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-65.8	-39.6	175.7	-79.8	169.1	0	0	0	111.4	E198 S199 L206 L302 L307 L309 L312	E198-L202 HydrophobicContact CG-CD1 4.1Å; E198-L202 HydrophobicContact CG-CG 4.5Å; E198-L202 WeakPolarHBondContact O-CB 3.44Å; E198-L202 WeakPolarHBondContact O-CG 3.39Å; E198-L202 PolarHBondContact O-N 3.03Å; S199-L202 PolarHBondContact O-N 3.02Å; L202-L206 VanDerWaalsContact O-CG 3.3Å; L202-L206 WeakPolarHBondContact O-CG 3.46Å; L202-L206 PolarHBondContact O-N 3.32Å; L202-L302 HydrophobicContact CB-CD1 3.83Å; L202-L302 HydrophobicContact CB-CD2 4.12Å; L202-L302 HydrophobicContact CD1-CD1 4Å; L202-L307 HydrophobicContact CD1-CB 4.48Å; L202-L307 HydrophobicContact CD1-CD2 4.46Å; L202-L307 HydrophobicContact CD1-CG 4.31Å; L202-L307 HydrophobicContact CD2-CD2 3.95Å; L202-L307 HydrophobicContact CD2-CG 4.24Å; L202-L309 HydrophobicContact CD2-CB 4.35Å; L202-L309 HydrophobicContact CD2-CD1 3.99Å; L202-L312 HydrophobicContact CD2-CB 4.3Å; L202-L312 HydrophobicContact CD2-CD2 3.7Å
203	D	78.4	Confident	74.9	Confident	73 Å²	73	42.9 Å²	42.9	39%	0.39	23%	0.232	S	C	.	.	H	α-helix	trans	-65.9	-53.3	176.5	-147.2	11.3	0	0	0	110.7	S199 M200 L201 L205 L206 H207 L302	S199-D203 PolarHBondContact O-N 3.24Å; S199-D203 VanDerWaalsContact O-N 3.15Å; M200-D203 PolarHBondContact O-N 3.35Å; L201-D203 VanDerWaalsContact C-N 3.34Å; D203-L205 VanDerWaalsContact C-N 3.26Å; D203-L205 PolarHBondContact O-N 3.21Å; D203-L206 PolarHBondContact O-N 3.49Å; D203-L206 VanDerWaalsContact O-N 3.17Å; D203-H207 PolarHBondContact O-N 3Å; D203-H207 PolarHBondContact O-ND1 3.28Å; D203-H207 IonicContact OD1-CE1 3.52Å; D203-H207 PolarHBondContact OD1-CE1 2.65Å; D203-H207 IonicContact OD1-ND1 3.65Å; D203-L302 HydrophobicContact CB-CD2 4.24Å
204	E	77.9	Confident	74.2	Confident	9 Å²	9	41.8 Å²	41.8	4%	0.042	22%	0.219	C	C	.	.	H	α-helix	trans	-60.5	-33.2	177.2	-71.4	-132.8	-176.1	0	0	112.9	M200 C208 E214 S215 L216 L217	M200-E204 PolarHBondContact O-N 3.08Å; E204-C208 VanDerWaalsContact O-CB 3.25Å; E204-C208 WeakPolarHBondContact O-CB 3.36Å; E204-C208 PolarHBondContact O-N 3.33Å; E204-E214 WeakPolarHBondContact CA-OE2 3.28Å; E204-E214 HydrophobicContact CB-CB 4.44Å; E204-E214 VanDerWaalsContact CD-CB 3.48Å; E204-E214 HydrophobicContact CG-CB 4.09Å; E204-E214 WeakPolarHBondContact CG-OE2 3.13Å; E204-E214 VanDerWaalsContact OE2-CB 3.28Å; E204-E214 WeakPolarHBondContact OE2-CB 3.32Å; E204-S215 WeakPolarHBondContact OE1-CB 3.4Å; E204-S215 PolarHBondContact OE1-N 3.13Å; E204-S215 VanDerWaalsContact OE1-N 3.1Å; E204-S215 PolarHBondContact OE1-OG 3.05Å; E204-S215 PolarHBondContact OE2-N 2.9Å; E204-L216 HydrophobicContact CG-CD1 4.22Å; E204-L216 HydrophobicContact CG-CG 4.48Å; E204-L216 PolarHBondContact OE1-N 3.2Å; E204-L216 WeakPolarHBondContact OE2-CA 3.34Å; E204-L216 VanDerWaalsContact OE2-CB 3.31Å; E204-L216 WeakPolarHBondContact OE2-CB 3.48Å; E204-L216 PolarHBondContact OE2-N 2.88Å; E204-L217 PolarHBondContact OE2-N 2.91Å
205	L	78.4	Confident	73.6	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-72.2	-36.7	177.9	-178.4	60.7	0	0	0	112.3	L201 D203 C208 L209 L217 I253 L254 L309 L312	L201-L205 WeakPolarHBondContact O-CB 3.49Å; L201-L205 PolarHBondContact O-N 2.94Å; D203-L205 VanDerWaalsContact C-N 3.26Å; D203-L205 PolarHBondContact O-N 3.21Å; L205-C208 PolarHBondContact O-N 3.28Å; L205-L209 HydrophobicContact CG-CD1 4.23Å; L205-L209 WeakPolarHBondContact O-CB 3.26Å; L205-L209 WeakPolarHBondContact O-CD1 3.43Å; L205-L209 VanDerWaalsContact O-CG 3.25Å; L205-L209 WeakPolarHBondContact O-CG 3.4Å; L205-L209 PolarHBondContact O-N 3.36Å; L205-L217 HydrophobicContact CB-CD1 4.28Å; L205-L217 HydrophobicContact CD1-CD1 4.17Å; L205-I253 HydrophobicContact CD1-CG2 4.1Å; L205-I253 HydrophobicContact CD2-CB 4.36Å; L205-I253 HydrophobicContact CD2-CD1 3.82Å; L205-I253 HydrophobicContact CD2-CG2 4.13Å; L205-I253 HydrophobicContact CG-CG2 4.4Å; L205-L254 HydrophobicContact CD1-CD2 4.33Å; L205-L309 HydrophobicContact CD2-CD1 3.8Å; L205-L312 HydrophobicContact CD2-CD2 3.94Å
206	L	80.6	Confident	72.8	Confident	6 Å²	6	33.2 Å²	33.2	3%	0.031	18%	0.18	C	C	.	.	H	α-helix	trans	-67.9	-41.7	173.5	-70.2	172.6	0	0	0	111	L202 D203 L209 T210 I295 A298 E299 L302	L202-L206 VanDerWaalsContact O-CG 3.3Å; L202-L206 WeakPolarHBondContact O-CG 3.46Å; L202-L206 PolarHBondContact O-N 3.32Å; D203-L206 PolarHBondContact O-N 3.49Å; D203-L206 VanDerWaalsContact O-N 3.17Å; L206-L209 PolarHBondContact O-N 3.17Å; L206-T210 PolarHBondContact O-N 3.17Å; L206-I295 HydrophobicContact CD2-CG2 4.2Å; L206-A298 HydrophobicContact CD2-CB 3.79Å; L206-E299 HydrophobicContact CD1-CB 4.15Å; L206-E299 HydrophobicContact CD1-CG 4.39Å; L206-L302 HydrophobicContact CD1-CB 4.48Å; L206-L302 HydrophobicContact CD1-CD2 3.78Å
207	H	78.2	Confident	72.1	Confident	57 Å²	57	30.6 Å²	30.6	26%	0.264	16%	0.161	S	C	.	.	H	α-helix	trans	-61.1	-44.7	173	-70.5	91.4	0	0	0	111.4	D203 L209 T210 G211 I212 E214	D203-H207 PolarHBondContact O-N 3Å; D203-H207 PolarHBondContact O-ND1 3.28Å; D203-H207 IonicContact OD1-CE1 3.52Å; D203-H207 PolarHBondContact OD1-CE1 2.65Å; D203-H207 IonicContact OD1-ND1 3.65Å; H207-L209 PolarHBondContact O-N 3.14Å; H207-T210 PolarHBondContact O-N 3.15Å; H207-T210 PolarHBondContact O-OG1 3.24Å; H207-G211 PolarHBondContact O-N 3.12Å; H207-I212 HydrophobicContact CB-CB 4.17Å; H207-I212 HydrophobicContact CB-CG2 4.31Å; H207-I212 WeakPolarHBondContact O-CB 3.09Å; H207-I212 PolarHBondContact O-N 3.37Å; H207-E214 VanDerWaalsContact CB-CD 3.43Å; H207-E214 HydrophobicContact CB-CG 3.76Å; H207-E214 IonicContact CD2-OE1 3.64Å; H207-E214 IonicContact CG-OE1 3.47Å; H207-E214 IonicContact CG-OE2 2.79Å; H207-E214 IonicContact ND1-OE1 3.96Å; H207-E214 IonicContact ND1-OE2 3.67Å
208	C	77.6	Confident	71.6	Confident	4 Å²	4	31.6 Å²	31.6	3%	0.027	17%	0.168	C	C	.	.	H	α-helix	trans	-56.9	-46.2	172.8	-173.8	0	0	0	0	112.4	Y176 E204 L205 T210 G211 L217 F236	Y176-C208 WeakPolarHBondContact CE1-O 3.48Å; E204-C208 VanDerWaalsContact O-CB 3.25Å; E204-C208 WeakPolarHBondContact O-CB 3.36Å; E204-C208 PolarHBondContact O-N 3.33Å; L205-C208 PolarHBondContact O-N 3.28Å; C208-T210 PolarHBondContact O-N 2.97Å; C208-T210 VanDerWaalsContact O-N 3.13Å; C208-G211 PolarHBondContact O-N 3.43Å; C208-L217 HydrophobicContact CB-CD1 4.09Å; C208-F236 VanDerWaalsContact SG-CE1 3.56Å
209	L	75.8	Confident	70.7	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.01	17%	0.165	C	C	.	.	H	α-helix	trans	-63.4	-17.1	177	-73.3	163.1	0	0	0	113.9	L205 L206 H207 I253 L256 A257 F291 I295 L316	L205-L209 HydrophobicContact CG-CD1 4.23Å; L205-L209 WeakPolarHBondContact O-CB 3.26Å; L205-L209 WeakPolarHBondContact O-CD1 3.43Å; L205-L209 VanDerWaalsContact O-CG 3.25Å; L205-L209 WeakPolarHBondContact O-CG 3.4Å; L205-L209 PolarHBondContact O-N 3.36Å; L206-L209 PolarHBondContact O-N 3.17Å; H207-L209 PolarHBondContact O-N 3.14Å; L209-I253 HydrophobicContact CD1-CG2 4.25Å; L209-I253 HydrophobicContact CD2-CG2 4.36Å; L209-L256 HydrophobicContact CD2-CB 4.39Å; L209-L256 HydrophobicContact CD2-CD2 4.37Å; L209-L256 HydrophobicContact CD2-CG 4.32Å; L209-A257 HydrophobicContact CD2-CB 3.98Å; L209-F291 HydrophobicContact CD2-CZ 4.26Å; L209-I295 HydrophobicContact CB-CD1 3.84Å; L209-L316 HydrophobicContact CD1-CD1 4.09Å
210	T	73.4	Confident	70	Confident	34 Å²	34	32 Å²	32	21%	0.209	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-5.3	171.9	64.2	0	0	0	0	114.9	L206 H207 C208 Y292 I295	L206-T210 PolarHBondContact O-N 3.17Å; H207-T210 PolarHBondContact O-N 3.15Å; H207-T210 PolarHBondContact O-OG1 3.24Å; C208-T210 PolarHBondContact O-N 2.97Å; C208-T210 VanDerWaalsContact O-N 3.13Å; T210-Y292 HydrophobicContact CG2-CD1 4.36Å; T210-Y292 HydrophobicContact CG2-CE1 4.18Å; T210-I295 HydrophobicContact CG2-CD1 3.85Å; T210-I295 HydrophobicContact CG2-CG2 3.83Å
211	G	69.4	Low	69	Low	8 Å²	8	38 Å²	38	8%	0.082	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	16.3	-175.5	0	0	0	0	0	114.8	Y176 Y177 H207 C208	Y176-G211 WeakPolarHBondContact CA-O 3.44Å; Y177-G211 PolarHBondContact N-O 3.23Å; H207-G211 PolarHBondContact O-N 3.12Å; C208-G211 PolarHBondContact O-N 3.43Å
212	I	71.1	Confident	68	Low	55 Å²	55	41 Å²	41	28%	0.282	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	142.1	173.1	-63	170.7	0	0	0	109	V179 H207 E214	V179-I212 HydrophobicContact CG2-CG2 4Å; H207-I212 HydrophobicContact CB-CB 4.17Å; H207-I212 HydrophobicContact CB-CG2 4.31Å; H207-I212 WeakPolarHBondContact O-CB 3.09Å; H207-I212 PolarHBondContact O-N 3.37Å; I212-E214 HydrophobicContact CG2-CG 4.15Å
213	R	61.4	Low	66.6	Low	96 Å²	96	46 Å²	46	36%	0.362	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	121.4	177.9	-179.5	-179.9	172.6	175.4	3	112.2	Y176 Y177	Y176-R213 VanDerWaalsContact O-CB 3.31Å; Y176-R213 WeakPolarHBondContact O-CB 3.23Å; Y177-R213 PolarHBondContact O-N 3.35Å
214	E	59.8	Low	65.2	Low	64 Å²	64	51.1 Å²	51.1	30%	0.299	26%	0.26	S	S	.	.			trans	-115.5	-155.6	-177.7	-54.1	-136.7	132.4	0	0	112.6	E204 H207 I212	E204-E214 WeakPolarHBondContact CA-OE2 3.28Å; E204-E214 HydrophobicContact CB-CB 4.44Å; E204-E214 VanDerWaalsContact CD-CB 3.48Å; E204-E214 HydrophobicContact CG-CB 4.09Å; E204-E214 WeakPolarHBondContact CG-OE2 3.13Å; E204-E214 VanDerWaalsContact OE2-CB 3.28Å; E204-E214 WeakPolarHBondContact OE2-CB 3.32Å; H207-E214 VanDerWaalsContact CB-CD 3.43Å; H207-E214 HydrophobicContact CB-CG 3.76Å; H207-E214 IonicContact CD2-OE1 3.64Å; H207-E214 IonicContact CG-OE1 3.47Å; H207-E214 IonicContact CG-OE2 2.79Å; H207-E214 IonicContact ND1-OE1 3.96Å; H207-E214 IonicContact ND1-OE2 3.67Å; I212-E214 HydrophobicContact CG2-CG 4.15Å
215	S	57.1	Low	63.5	Low	61 Å²	61	55.8 Å²	55.8	43%	0.427	29%	0.294	S	S	.	.	S	Bend	trans	-106.4	-22.9	-158.2	85.9	0	0	0	0	115.9	E204 H239	E204-S215 WeakPolarHBondContact OE1-CB 3.4Å; E204-S215 PolarHBondContact OE1-N 3.13Å; E204-S215 VanDerWaalsContact OE1-N 3.1Å; E204-S215 PolarHBondContact OE1-OG 3.05Å; E204-S215 PolarHBondContact OE2-N 2.9Å; S215-H239 PolarHBondContact O-NE2 3.36Å
216	L	56.2	Low	61.8	Low	2 Å²	2	57 Å²	57	1%	0.01	30%	0.304	C	S	.	.	S	Bend	trans	-105.1	-24.5	-179.8	-58.8	174.6	0	0	0	112.8	I189 M200 L201 E204 H239	I189-L216 HydrophobicContact CD1-CD2 3.44Å; I189-L216 VanDerWaalsContact CD1-CD2 3.44Å; I189-L216 HydrophobicContact CG1-CD2 4.14Å; M200-L216 HydrophobicContact CE-CD1 3.98Å; M200-L216 HydrophobicContact CE-CG 4.34Å; M200-L216 HydrophobicContact CG-CD1 4.03Å; M200-L216 HydrophobicContact SD-CD1 4.04Å; L201-L216 HydrophobicContact CD2-CB 4.42Å; L201-L216 HydrophobicContact CD2-CD1 3.94Å; E204-L216 HydrophobicContact CG-CD1 4.22Å; E204-L216 HydrophobicContact CG-CG 4.48Å; E204-L216 PolarHBondContact OE1-N 3.2Å; E204-L216 WeakPolarHBondContact OE2-CA 3.34Å; E204-L216 VanDerWaalsContact OE2-CB 3.31Å; E204-L216 WeakPolarHBondContact OE2-CB 3.48Å; E204-L216 PolarHBondContact OE2-N 2.88Å; L216-H239 HydrophobicContact CD2-CB 4.37Å; L216-H239 PolarHBondContact O-CD2 3.23Å; L216-H239 PolarHBondContact O-N 2.78Å
217	L	60.2	Low	60	Low	3 Å²	3	63.4 Å²	63.4	2%	0.016	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	105.4	179.3	-61.1	178.3	0	0	0	110.2	E204 L205 C208 I238 V250 L254	E204-L217 PolarHBondContact OE2-N 2.91Å; L205-L217 HydrophobicContact CB-CD1 4.28Å; L205-L217 HydrophobicContact CD1-CD1 4.17Å; C208-L217 HydrophobicContact CB-CD1 4.09Å; L217-I238 HydrophobicContact CD2-CG1 4.01Å; L217-I238 HydrophobicContact CD2-CG2 4.48Å; L217-V250 HydrophobicContact CD2-CG1 3.97Å; L217-L254 HydrophobicContact CD1-CD2 4.42Å
218	V	63.7	Low	59	Low	34 Å²	34	61.7 Å²	61.7	21%	0.206	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	114.6	-177.9	177.2	0	0	0	0	110.2	Q220 F236 D237	V218-Q220 PolarHBondContact O-N 2.66Å; V218-F236 CarbonylContact O-C 3.56Å; V218-F236 WeakPolarHBondContact O-CA 3.47Å; V218-D237 HydrophobicContact CB-CB 4.42Å; V218-D237 PolarHBondContact N-O 2.82Å; V218-D237 PolarHBondContact O-N 3.01Å
219	P	60.4	Low	57.8	Low	17 Å²	17	64.9 Å²	64.9	11%	0.11	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	133.6	172.2	27.4	-32.7	0	0	0	110	Y176 F236	Y176-P219 HydrophobicContact CD1-CG 4.18Å; Y176-P219 HydrophobicContact CD2-CB 3.83Å; Y176-P219 HydrophobicContact CD2-CG 3.9Å; Y176-P219 HydrophobicContact CE2-CB 4.29Å; Y176-P219 HydrophobicContact CG-CB 4.07Å; Y176-P219 HydrophobicContact CG-CG 3.62Å; P219-F236 HydrophobicContact CB-CD1 3.93Å; P219-F236 HydrophobicContact CB-CE1 4Å
220	Q	61	Low	56.6	Low	79 Å²	79	67.5 Å²	67.5	37%	0.369	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-68.7	152.7	172.6	-65.2	-167.6	4.8	0	0	110.2	V218 D235 D237	V218-Q220 PolarHBondContact O-N 2.66Å; Q220-D235 HydrophobicContact CB-CB 4.24Å; Q220-D235 HydrophobicContact CG-CB 4.19Å; Q220-D235 PolarHBondContact N-O 3.1Å; Q220-D237 PolarHBondContact NE2-OD1 3.07Å
221	K	54.8	Low	55.7	Low	190 Å²	190	71.4 Å²	71.4	83%	0.826	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-72.2	138.5	175.5	-68.5	-171.8	176.9	-172.3	0	109.7	I223	K221-I223 PolarHBondContact O-N 3.35Å
222	P	54.8	Low	55.1	Low	64 Å²	64	72.4 Å²	72.4	42%	0.416	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-57.9	133.5	-179.8	23.9	-33.8	0	0	0	111	I224	P222-I224 PolarHBondContact O-N 3.03Å; P222-I224 VanDerWaalsContact O-N 3.11Å
223	I	49.1	Very low	54.6	Low	107 Å²	107	72.6 Å²	72.6	55%	0.549	40%	0.397	S	S	.	.			trans	-73.4	107.9	-174.3	-60.2	175.7	0	0	0	109	K221 S225 A226	K221-I223 PolarHBondContact O-N 3.35Å; I223-S225 PolarHBondContact O-N 3.3Å; I223-A226 HydrophobicContact CB-CB 4.22Å; I223-A226 HydrophobicContact CG2-CB 4.43Å; I223-A226 WeakPolarHBondContact O-CB 3.46Å; I223-A226 PolarHBondContact O-N 3.27Å
224	I	48.4	Very low	54.7	Low	181 Å²	181	68.5 Å²	68.5	93%	0.928	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-17.5	-175.8	-58.7	170.3	0	0	0	113	P222	P222-I224 PolarHBondContact O-N 3.03Å; P222-I224 VanDerWaalsContact O-N 3.11Å
225	S	42.1	Very low	54.8	Low	108 Å²	108	70 Å²	70	76%	0.755	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	2.8	178.8	-170.2	0	0	0	0	115	I223	I223-S225 PolarHBondContact O-N 3.3Å
226	A	42.9	Very low	55.4	Low	25 Å²	25	68.5 Å²	68.5	21%	0.207	38%	0.378	C	S	.	.			trans	-78.7	138.7	-174.6	0	0	0	0	0	113.2	I223 A230	I223-A226 HydrophobicContact CB-CB 4.22Å; I223-A226 HydrophobicContact CG2-CB 4.43Å; I223-A226 WeakPolarHBondContact O-CB 3.46Å; I223-A226 PolarHBondContact O-N 3.27Å; A226-A230 HydrophobicContact CB-CB 3.99Å; A226-A230 VanDerWaalsContact CB-O 3.32Å; A226-A230 WeakPolarHBondContact CB-O 3.33Å
227	V	43.7	Very low	55.7	Low	140 Å²	140	72.3 Å²	72.3	85%	0.848	40%	0.399	S	S	*	.			trans	-118.2	135.7	177.8	-178.6	0	0	0	0	109.2
228	G	55.8	Low	56.1	Low	21 Å²	21	73.4 Å²	73.4	22%	0.216	40%	0.404	C	S	.	.	S	Bend	trans	82.2	-145.6	-177.4	0	0	0	0	0	113.3	A230 K231	G228-A230 VanDerWaalsContact C-N 3.27Å; G228-A230 PolarHBondContact O-N 2.86Å; G228-K231 WeakPolarHBondContact O-CB 3.35Å; G228-K231 PolarHBondContact O-N 2.68Å; G228-K231 VanDerWaalsContact O-N 3.15Å
229	L	53.1	Low	56	Low	71 Å²	71	75.3 Å²	75.3	37%	0.372	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-54.2	-39.3	-173.8	-94.1	64.8	0	0	0	113.5	K231 Y232 D233 W327 V331 L335	L229-K231 PolarHBondContact O-N 3.36Å; L229-Y232 PolarHBondContact O-N 3.43Å; L229-D233 PolarHBondContact O-N 3.42Å; L229-W327 HydrophobicContact CB-CH2 4.29Å; L229-W327 HydrophobicContact CD2-CH2 4.08Å; L229-W327 HydrophobicContact CD2-CZ3 3.86Å; L229-W327 HydrophobicContact CG-CH2 4.14Å; L229-W327 HydrophobicContact CG-CZ3 4.32Å; L229-V331 HydrophobicContact CB-CG1 4.5Å; L229-V331 HydrophobicContact CD1-CG1 3.77Å; L229-V331 HydrophobicContact CG-CG1 3.85Å; L229-L335 HydrophobicContact CD1-CD1 4.38Å
230	A	50	Low	55.9	Low	58 Å²	58	80.7 Å²	80.7	48%	0.479	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-64.6	-1.2	-178.5	0	0	0	0	0	115.1	A226 G228	A226-A230 HydrophobicContact CB-CB 3.99Å; A226-A230 VanDerWaalsContact CB-O 3.32Å; A226-A230 WeakPolarHBondContact CB-O 3.33Å; G228-A230 VanDerWaalsContact C-N 3.27Å; G228-A230 PolarHBondContact O-N 2.86Å
231	K	54.8	Low	55.8	Low	115 Å²	115	82.4 Å²	82.4	50%	0.5	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-79.5	-28.4	167.3	-174.5	-171.3	170.1	-154.4	0	112.6	G228 L229	G228-K231 WeakPolarHBondContact O-CB 3.35Å; G228-K231 PolarHBondContact O-N 2.68Å; G228-K231 VanDerWaalsContact O-N 3.15Å; L229-K231 PolarHBondContact O-N 3.36Å
232	Y	55.8	Low	56.3	Low	29 Å²	29	74.3 Å²	74.3	11%	0.114	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-11.1	-173.7	-60.5	-75.3	0	0	0	113.7	L229 V331 Q334 L335	L229-Y232 PolarHBondContact O-N 3.43Å; Y232-V331 HydrophobicContact CD2-CB 4.44Å; Y232-V331 HydrophobicContact CD2-CG1 3.68Å; Y232-V331 HydrophobicContact CD2-CG2 4.1Å; Y232-V331 HydrophobicContact CE2-CG1 4.27Å; Y232-V331 HydrophobicContact CG-CG2 4.15Å; Y232-Q334 HydrophobicContact CE1-CG 4.45Å; Y232-L335 HydrophobicContact CE2-CD2 4.35Å; Y232-L335 HydrophobicContact CE2-CG 4.41Å
233	D	60.7	Low	57	Low	60 Å²	60	74.2 Å²	74.2	32%	0.321	41%	0.413	S	S	.	.			trans	-72.7	151	172.4	-144.6	-23.7	0	0	0	111.3	L229 S258 W327	L229-D233 PolarHBondContact O-N 3.42Å; D233-S258 WeakPolarHBondContact OD1-CB 3.27Å; D233-S258 PolarHBondContact OD1-OG 2.74Å; D233-W327 HydrophobicContact CB-CZ2 4.32Å
234	T	63.8	Low	58.1	Low	10 Å²	10	79.6 Å²	79.6	6%	0.061	43%	0.426	C	S	.	.			trans	-130.5	102.5	173.4	62	0	0	0	0	110.4	F236 S258	T234-F236 VanDerWaalsContact O-CD2 3.24Å; T234-F236 WeakPolarHBondContact O-CD2 3.42Å; T234-F236 WeakPolarHBondContact O-CE2 3.39Å; T234-S258 PolarHBondContact N-OG 3.38Å
235	D	63.3	Low	59.4	Low	96 Å²	96	74 Å²	74	51%	0.513	40%	0.403	S	S	.	.			trans	-65.7	155.7	168.9	-76.1	-59.9	0	0	0	111.8	Q220	Q220-D235 HydrophobicContact CB-CB 4.24Å; Q220-D235 HydrophobicContact CG-CB 4.19Å; Q220-D235 PolarHBondContact N-O 3.1Å
236	F	68.6	Low	60.8	Low	29 Å²	29	69.5 Å²	69.5	13%	0.127	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	130.8	179.8	-57	-96.3	0	0	0	112.4	Y176 C208 V218 P219 T234 L254 A257	Y176-F236 HydrophobicContact CE1-CE1 4.08Å; Y176-F236 HydrophobicContact CE2-CE1 4.07Å; Y176-F236 HydrophobicContact CE2-CZ 4.19Å; Y176-F236 AromaticContact CZ-CE1 3.66Å; Y176-F236 AromaticContact CZ-CZ 3.8Å; Y176-F236 VanDerWaalsContact OH-CZ 3.32Å; Y176-F236 WeakPolarHBondContact OH-CZ 3.48Å; C208-F236 VanDerWaalsContact SG-CE1 3.56Å; V218-F236 CarbonylContact O-C 3.56Å; V218-F236 WeakPolarHBondContact O-CA 3.47Å; P219-F236 HydrophobicContact CB-CD1 3.93Å; P219-F236 HydrophobicContact CB-CE1 4Å; T234-F236 VanDerWaalsContact O-CD2 3.24Å; T234-F236 WeakPolarHBondContact O-CD2 3.42Å; T234-F236 WeakPolarHBondContact O-CE2 3.39Å; F236-L254 HydrophobicContact CB-CD1 4.02Å; F236-L254 HydrophobicContact CB-CD2 4.21Å; F236-L254 HydrophobicContact CD1-CD2 4.09Å; F236-L254 HydrophobicContact CD2-CB 3.91Å; F236-L254 HydrophobicContact CD2-CD1 4.42Å; F236-L254 HydrophobicContact CD2-CD2 3.85Å; F236-L254 HydrophobicContact CD2-CG 4.27Å; F236-L254 HydrophobicContact CE1-CD2 4.38Å; F236-L254 HydrophobicContact CE2-CB 4.2Å; F236-L254 HydrophobicContact CE2-CD2 4.15Å; F236-L254 WeakPolarHBondContact CE2-O 3.37Å; F236-L254 HydrophobicContact CG-CD1 4.41Å; F236-L254 HydrophobicContact CG-CD2 3.81Å; F236-L254 HydrophobicContact CG-CG 4.5Å; F236-L254 HydrophobicContact CZ-CD2 4.41Å; F236-A257 HydrophobicContact CE2-CB 4.37Å; F236-A257 HydrophobicContact CZ-CB 3.85Å
237	D	63.5	Low	62.4	Low	82 Å²	82	69.4 Å²	69.4	44%	0.439	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	123	167.7	-68.7	-38.4	0	0	0	110.3	V218 Q220	V218-D237 HydrophobicContact CB-CB 4.42Å; V218-D237 PolarHBondContact N-O 2.82Å; V218-D237 PolarHBondContact O-N 3.01Å; Q220-D237 PolarHBondContact NE2-OD1 3.07Å
238	I	67.6	Low	64	Low	26 Å²	26	68.5 Å²	68.5	13%	0.133	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	135.7	174.6	-56.7	174.2	0	0	0	109	L217 T240 L242 T247 V250 R251 L254	L217-I238 HydrophobicContact CD2-CG1 4.01Å; L217-I238 HydrophobicContact CD2-CG2 4.48Å; I238-T240 PolarHBondContact O-N 2.83Å; I238-L242 HydrophobicContact CG2-CD1 3.7Å; I238-T247 HydrophobicContact CD1-CG2 4.17Å; I238-T247 HydrophobicContact CG2-CG2 4.25Å; I238-V250 HydrophobicContact CD1-CB 4.46Å; I238-V250 HydrophobicContact CD1-CG1 3.99Å; I238-R251 HydrophobicContact CD1-CG 3.52Å; I238-L254 HydrophobicContact CD1-CD1 3.73Å; I238-L254 HydrophobicContact CG1-CD1 3.98Å
239	H	62.6	Low	65	Low	74 Å²	74	68.9 Å²	68.9	34%	0.343	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-60	133.4	-177.5	-87.6	-143	0	0	0	114.8	S215 L216 H241 L242	S215-H239 PolarHBondContact O-NE2 3.36Å; L216-H239 HydrophobicContact CD2-CB 4.37Å; L216-H239 PolarHBondContact O-CD2 3.23Å; L216-H239 PolarHBondContact O-N 2.78Å; H239-H241 PolarHBondContact O-N 3.12Å; H239-L242 HydrophobicContact CB-CD1 4.34Å; H239-L242 PolarHBondContact O-N 3.41Å
240	T	57.7	Low	66.2	Low	129 Å²	129	65.6 Å²	65.6	79%	0.791	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	4.8	-169.3	52.6	0	0	0	0	116.4	I238	I238-T240 PolarHBondContact O-N 2.83Å
241	H	58.7	Low	67.7	Low	116 Å²	116	70.6 Å²	70.6	54%	0.537	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	7.7	-173.9	-66.5	-78.4	0	0	0	113.9	H239	H239-H241 PolarHBondContact O-N 3.12Å
242	L	64.8	Low	68.8	Low	19 Å²	19	69 Å²	69	10%	0.099	33%	0.333	C	S	.	.	S	Bend	trans	-87.6	155.3	176.4	-65	164.5	0	0	0	111.1	I189 L201 I238 H239	I189-L242 HydrophobicContact CG2-CD2 3.6Å; I189-L242 HydrophobicContact CG2-CG 4.46Å; L201-L242 HydrophobicContact CD1-CD1 4.27Å; L201-L242 HydrophobicContact CD1-CD2 3.97Å; L201-L242 HydrophobicContact CD2-CD1 3.8Å; L201-L242 HydrophobicContact CD2-CD2 4.27Å; L201-L242 HydrophobicContact CG-CD1 4.5Å; L201-L242 HydrophobicContact CG-CD2 4.19Å; I238-L242 HydrophobicContact CG2-CD1 3.7Å; H239-L242 HydrophobicContact CB-CD1 4.34Å; H239-L242 PolarHBondContact O-N 3.41Å
243	D	70.8	Confident	70	Confident	62 Å²	62	67.6 Å²	67.6	33%	0.332	33%	0.328	S	S	.	.			trans	-64.9	147.1	174.7	-179.9	50.8	0	0	0	112	L194 S245 L246 T247	L194-D243 HydrophobicContact CD2-CB 3.95Å; D243-S245 VanDerWaalsContact C-N 3.29Å; D243-S245 PolarHBondContact O-N 3Å; D243-S245 VanDerWaalsContact OD2-CB 3.24Å; D243-S245 WeakPolarHBondContact OD2-CB 3.27Å; D243-S245 PolarHBondContact OD2-N 2.97Å; D243-S245 PolarHBondContact OD2-OG 3.28Å; D243-L246 PolarHBondContact O-N 3.5Å; D243-T247 WeakPolarHBondContact O-CB 3.4Å; D243-T247 PolarHBondContact O-N 3.38Å; D243-T247 PolarHBondContact O-OG1 3.24Å
244	R	70.9	Confident	70.9	Confident	220 Å²	220	65.1 Å²	65.1	83%	0.83	32%	0.315	S	S	*	.	H	α-helix	trans	-65.1	-29.6	-177.5	-65.6	-177.2	177.5	-174.4	-0.8	112.8	H248	R244-H248 PolarHBondContact O-N 3.23Å; R244-H248 VanDerWaalsContact O-N 3.14Å
245	S	75.6	Confident	71.7	Confident	65 Å²	65	66.9 Å²	66.9	46%	0.455	33%	0.326	S	S	.	.	H	α-helix	trans	-71.7	-47.1	179.1	70.1	0	0	0	0	112.1	D243 H248 Q249	D243-S245 VanDerWaalsContact C-N 3.29Å; D243-S245 PolarHBondContact O-N 3Å; D243-S245 VanDerWaalsContact OD2-CB 3.24Å; D243-S245 WeakPolarHBondContact OD2-CB 3.27Å; D243-S245 PolarHBondContact OD2-N 2.97Å; D243-S245 PolarHBondContact OD2-OG 3.28Å; S245-H248 PolarHBondContact O-N 3.39Å; S245-Q249 PolarHBondContact O-N 3.22Å
246	L	72.4	Confident	72.6	Confident	12 Å²	12	62.3 Å²	62.3	6%	0.063	30%	0.302	C	S	.	.	H	α-helix	trans	-63.1	-43.7	174	-62.4	176.1	0	0	0	110.7	Q197 E198 L201 D243 H248 Q249 V250 L309	Q197-L246 HydrophobicContact CB-CD1 4.24Å; E198-L246 HydrophobicContact CB-CD1 4.46Å; E198-L246 HydrophobicContact CB-CD2 4.3Å; E198-L246 HydrophobicContact CG-CD2 4.24Å; L201-L246 HydrophobicContact CD1-CB 4.04Å; L201-L246 HydrophobicContact CD1-CD1 4.26Å; D243-L246 PolarHBondContact O-N 3.5Å; L246-H248 VanDerWaalsContact C-N 3.25Å; L246-H248 PolarHBondContact O-N 3.44Å; L246-Q249 PolarHBondContact O-N 3.42Å; L246-V250 WeakPolarHBondContact O-CG2 3.41Å; L246-V250 PolarHBondContact O-N 2.97Å; L246-L309 HydrophobicContact CB-CD2 4.42Å; L246-L309 HydrophobicContact CD2-CD2 3.93Å
247	T	75.5	Confident	73	Confident	23 Å²	23	60.9 Å²	60.9	14%	0.141	30%	0.296	C	S	.	.	H	α-helix	trans	-57.2	-35.9	176.5	-57.5	0	0	0	0	112.5	I238 D243 R251	I238-T247 HydrophobicContact CD1-CG2 4.17Å; I238-T247 HydrophobicContact CG2-CG2 4.25Å; D243-T247 WeakPolarHBondContact O-CB 3.4Å; D243-T247 PolarHBondContact O-N 3.38Å; D243-T247 PolarHBondContact O-OG1 3.24Å; T247-R251 VanDerWaalsContact O-CG 3.29Å; T247-R251 WeakPolarHBondContact O-CG 3.38Å; T247-R251 PolarHBondContact O-N 2.87Å
248	H	78.8	Confident	73.8	Confident	121 Å²	121	57 Å²	57	56%	0.56	28%	0.275	S	S	*	.	H	α-helix	trans	-68.5	-47.7	176.9	-160.3	-72.8	0	0	0	111.9	R244 S245 L246 V250 R251 E252	R244-H248 PolarHBondContact O-N 3.23Å; R244-H248 VanDerWaalsContact O-N 3.14Å; S245-H248 PolarHBondContact O-N 3.39Å; L246-H248 VanDerWaalsContact C-N 3.25Å; L246-H248 PolarHBondContact O-N 3.44Å; H248-V250 VanDerWaalsContact C-N 3.35Å; H248-V250 PolarHBondContact O-N 2.99Å; H248-R251 WeakPolarHBondContact O-CB 3.42Å; H248-R251 PolarHBondContact O-N 3.23Å; H248-E252 IonicContact CE1-OE1 3.02Å; H248-E252 PolarHBondContact CE1-OE1 2.6Å; H248-E252 IonicContact ND1-OE1 2.76Å; H248-E252 PolarHBondContact ND1-OE1 3.29Å; H248-E252 PolarHBondContact O-N 3.2Å
249	Q	76.6	Confident	74.4	Confident	30 Å²	30	57.8 Å²	57.8	14%	0.14	28%	0.277	C	S	.	.	H	α-helix	trans	-65.9	-36	-179.5	-66.4	172.7	29.3	0	0	112	S245 L246 E252 I253 L309	S245-Q249 PolarHBondContact O-N 3.22Å; L246-Q249 PolarHBondContact O-N 3.42Å; Q249-E252 PolarHBondContact O-N 3Å; Q249-I253 PolarHBondContact O-N 2.66Å; Q249-L309 HydrophobicContact CB-CD2 3.58Å; Q249-L309 HydrophobicContact CB-CG 3.83Å
250	V	77.9	Confident	75.2	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.012	26%	0.26	C	S	.	.	H	α-helix	trans	-63.8	-42.3	172.2	173.2	0	0	0	0	111.2	L201 L217 I238 L246 H248 E252 I253 L254 L309	L201-V250 HydrophobicContact CD1-CG2 4.44Å; L217-V250 HydrophobicContact CD2-CG1 3.97Å; I238-V250 HydrophobicContact CD1-CB 4.46Å; I238-V250 HydrophobicContact CD1-CG1 3.99Å; L246-V250 WeakPolarHBondContact O-CG2 3.41Å; L246-V250 PolarHBondContact O-N 2.97Å; H248-V250 VanDerWaalsContact C-N 3.35Å; H248-V250 PolarHBondContact O-N 2.99Å; V250-E252 PolarHBondContact O-N 3.27Å; V250-I253 PolarHBondContact O-N 3.32Å; V250-L254 HydrophobicContact CG1-CD1 3.72Å; V250-L254 HydrophobicContact CG1-CG 3.93Å; V250-L254 WeakPolarHBondContact O-CG 3.24Å; V250-L254 PolarHBondContact O-N 3.34Å; V250-L309 HydrophobicContact CG2-CD1 4.34Å; V250-L309 HydrophobicContact CG2-CD2 3.95Å
251	R	80.4	Confident	76.1	Confident	162 Å²	162	48.2 Å²	48.2	61%	0.611	22%	0.223	S	C	*	.	H	α-helix	trans	-62.5	-27.3	177.3	-77.4	176	177.7	-174.6	-2.2	114.2	I238 T247 H248 P255	I238-R251 HydrophobicContact CD1-CG 3.52Å; T247-R251 VanDerWaalsContact O-CG 3.29Å; T247-R251 WeakPolarHBondContact O-CG 3.38Å; T247-R251 PolarHBondContact O-N 2.87Å; H248-R251 WeakPolarHBondContact O-CB 3.42Å; H248-R251 PolarHBondContact O-N 3.23Å; R251-P255 VanDerWaalsContact O-CD 3.28Å; R251-P255 WeakPolarHBondContact O-CD 3.25Å
252	E	79	Confident	76.9	Confident	81 Å²	81	42.7 Å²	42.7	38%	0.379	20%	0.198	S	C	.	.	H	α-helix	trans	-73.4	-27.9	174.2	-71.4	169.4	-158.3	0	0	112.4	H248 Q249 V250 L313	H248-E252 IonicContact CE1-OE1 3.02Å; H248-E252 PolarHBondContact CE1-OE1 2.6Å; H248-E252 IonicContact ND1-OE1 2.76Å; H248-E252 PolarHBondContact ND1-OE1 3.29Å; H248-E252 PolarHBondContact O-N 3.2Å; Q249-E252 PolarHBondContact O-N 3Å; V250-E252 PolarHBondContact O-N 3.27Å; E252-L313 HydrophobicContact CB-CD1 3.9Å; E252-L313 WeakPolarHBondContact OE2-CD2 3.17Å
253	I	80.7	Confident	77.8	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-89.5	-36.2	-178.3	-61.2	169.5	0	0	0	112.2	L205 L209 Q249 V250 L256 L309 L312 L313 L316	L205-I253 HydrophobicContact CD1-CG2 4.1Å; L205-I253 HydrophobicContact CD2-CB 4.36Å; L205-I253 HydrophobicContact CD2-CD1 3.82Å; L205-I253 HydrophobicContact CD2-CG2 4.13Å; L205-I253 HydrophobicContact CG-CG2 4.4Å; L209-I253 HydrophobicContact CD1-CG2 4.25Å; L209-I253 HydrophobicContact CD2-CG2 4.36Å; Q249-I253 PolarHBondContact O-N 2.66Å; V250-I253 PolarHBondContact O-N 3.32Å; I253-L256 VanDerWaalsContact O-CB 3.25Å; I253-L256 WeakPolarHBondContact O-CB 3.46Å; I253-L256 PolarHBondContact O-N 3.34Å; I253-L309 HydrophobicContact CD1-CD1 3.9Å; I253-L312 HydrophobicContact CD1-CD2 4.39Å; I253-L312 HydrophobicContact CD1-CG 4.4Å; I253-L313 HydrophobicContact CD1-CB 4.16Å; I253-L313 HydrophobicContact CD1-CD1 4.35Å; I253-L313 HydrophobicContact CG1-CB 4.48Å; I253-L313 HydrophobicContact CG1-CD1 3.77Å; I253-L316 HydrophobicContact CG2-CD1 3.63Å
254	L	78.8	Confident	78.2	Confident	8 Å²	8	39.6 Å²	39.6	4%	0.042	18%	0.181	C	C	.	.	H	α-helix	trans	-52.7	-36.2	-174.5	-77	167.4	0	0	0	116.2	L205 L217 F236 I238 V250 L256 A257 S258	L205-L254 HydrophobicContact CD1-CD2 4.33Å; L217-L254 HydrophobicContact CD1-CD2 4.42Å; F236-L254 HydrophobicContact CB-CD1 4.02Å; F236-L254 HydrophobicContact CB-CD2 4.21Å; F236-L254 HydrophobicContact CD1-CD2 4.09Å; F236-L254 HydrophobicContact CD2-CB 3.91Å; F236-L254 HydrophobicContact CD2-CD1 4.42Å; F236-L254 HydrophobicContact CD2-CD2 3.85Å; F236-L254 HydrophobicContact CD2-CG 4.27Å; F236-L254 HydrophobicContact CE1-CD2 4.38Å; F236-L254 HydrophobicContact CE2-CB 4.2Å; F236-L254 HydrophobicContact CE2-CD2 4.15Å; F236-L254 WeakPolarHBondContact CE2-O 3.37Å; F236-L254 HydrophobicContact CG-CD1 4.41Å; F236-L254 HydrophobicContact CG-CD2 3.81Å; F236-L254 HydrophobicContact CG-CG 4.5Å; F236-L254 HydrophobicContact CZ-CD2 4.41Å; I238-L254 HydrophobicContact CD1-CD1 3.73Å; I238-L254 HydrophobicContact CG1-CD1 3.98Å; V250-L254 HydrophobicContact CG1-CD1 3.72Å; V250-L254 HydrophobicContact CG1-CG 3.93Å; V250-L254 WeakPolarHBondContact O-CG 3.24Å; V250-L254 PolarHBondContact O-N 3.34Å; L254-L256 PolarHBondContact O-N 3.26Å; L254-L256 VanDerWaalsContact O-N 3.17Å; L254-A257 WeakPolarHBondContact O-CB 3.35Å; L254-A257 PolarHBondContact O-N 3Å; L254-S258 PolarHBondContact O-N 2.68Å
255	P	82	Confident	78.5	Confident	47 Å²	47	31.3 Å²	31.3	31%	0.305	15%	0.151	S	C	.	.	H	α-helix	trans	-57.1	-29.9	175.3	-27.5	36.4	0	0	0	113.8	R251 A257 S258 Y259	R251-P255 VanDerWaalsContact O-CD 3.28Å; R251-P255 WeakPolarHBondContact O-CD 3.25Å; P255-A257 VanDerWaalsContact C-N 3.31Å; P255-A257 PolarHBondContact O-N 3.19Å; P255-S258 WeakPolarHBondContact O-CB 3.22Å; P255-S258 PolarHBondContact O-N 2.78Å; P255-Y259 HydrophobicContact CB-CE2 3.95Å; P255-Y259 VanDerWaalsContact O-CD2 3.24Å; P255-Y259 WeakPolarHBondContact O-CD2 3.47Å; P255-Y259 PolarHBondContact O-N 3.14Å
256	L	81.6	Confident	78.6	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-63.2	-37.7	175.8	-175.4	57.4	0	0	0	112.2	L209 I253 L254 Y259 F260 F291 L316 M320 M323	L209-L256 HydrophobicContact CD2-CB 4.39Å; L209-L256 HydrophobicContact CD2-CD2 4.37Å; L209-L256 HydrophobicContact CD2-CG 4.32Å; I253-L256 VanDerWaalsContact O-CB 3.25Å; I253-L256 WeakPolarHBondContact O-CB 3.46Å; I253-L256 PolarHBondContact O-N 3.34Å; L254-L256 PolarHBondContact O-N 3.26Å; L254-L256 VanDerWaalsContact O-N 3.17Å; L256-Y259 PolarHBondContact O-N 3.17Å; L256-F260 VanDerWaalsContact O-CB 3.26Å; L256-F260 WeakPolarHBondContact O-CB 3.09Å; L256-F260 PolarHBondContact O-N 3.1Å; L256-F291 HydrophobicContact CD1-CE2 4.45Å; L256-F291 HydrophobicContact CD2-CE2 3.91Å; L256-F291 HydrophobicContact CD2-CZ 4.18Å; L256-F291 HydrophobicContact CG-CE2 4.22Å; L256-F291 HydrophobicContact CG-CZ 4.19Å; L256-L316 HydrophobicContact CD2-CB 4.07Å; L256-L316 HydrophobicContact CD2-CD1 4.15Å; L256-L316 HydrophobicContact CD2-CD2 3.94Å; L256-L316 HydrophobicContact CD2-CG 4.27Å; L256-M320 HydrophobicContact CB-CG 4.16Å; L256-M320 HydrophobicContact CB-SD 4.47Å; L256-M320 HydrophobicContact CD1-CG 4.37Å; L256-M320 HydrophobicContact CD2-CG 4.05Å; L256-M320 HydrophobicContact CG-CG 4.44Å; L256-M323 HydrophobicContact CD1-CB 3.83Å; L256-M323 HydrophobicContact CD1-CG 3.98Å
257	A	77.7	Confident	79	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-68.3	-35.9	175.6	0	0	0	0	0	111.6	Y176 L209 F236 L254 P255 M261	Y176-A257 WeakPolarHBondContact OH-CB 3.2Å; Y176-A257 PolarHBondContact OH-O 3.43Å; L209-A257 HydrophobicContact CD2-CB 3.98Å; F236-A257 HydrophobicContact CE2-CB 4.37Å; F236-A257 HydrophobicContact CZ-CB 3.85Å; L254-A257 WeakPolarHBondContact O-CB 3.35Å; L254-A257 PolarHBondContact O-N 3Å; P255-A257 VanDerWaalsContact C-N 3.31Å; P255-A257 PolarHBondContact O-N 3.19Å; A257-M261 WeakPolarHBondContact O-CB 3.3Å; A257-M261 VanDerWaalsContact O-CG 3.26Å; A257-M261 WeakPolarHBondContact O-CG 3.42Å; A257-M261 PolarHBondContact O-N 3.31Å; A257-M261 VanDerWaalsContact O-N 3.09Å
258	S	79.6	Confident	79.1	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.007	14%	0.135	C	C	.	.	H	α-helix	trans	-62.3	-53.3	171.3	179.4	0	0	0	0	111.5	D233 T234 L254 P255 F260 M261 G262	D233-S258 WeakPolarHBondContact OD1-CB 3.27Å; D233-S258 PolarHBondContact OD1-OG 2.74Å; T234-S258 PolarHBondContact N-OG 3.38Å; L254-S258 PolarHBondContact O-N 2.68Å; P255-S258 WeakPolarHBondContact O-CB 3.22Å; P255-S258 PolarHBondContact O-N 2.78Å; S258-F260 PolarHBondContact O-N 3.44Å; S258-M261 PolarHBondContact O-N 3.46Å; S258-G262 PolarHBondContact O-N 2.88Å
259	Y	80.7	Confident	78.9	Confident	41 Å²	41	25.5 Å²	25.5	16%	0.161	13%	0.13	C	C	.	.	H	α-helix	trans	-59.8	-45.3	-179	-53.9	-31.5	0	0	0	111.9	P255 L256 G262 V263 H324 W327	P255-Y259 HydrophobicContact CB-CE2 3.95Å; P255-Y259 VanDerWaalsContact O-CD2 3.24Å; P255-Y259 WeakPolarHBondContact O-CD2 3.47Å; P255-Y259 PolarHBondContact O-N 3.14Å; L256-Y259 PolarHBondContact O-N 3.17Å; Y259-G262 PolarHBondContact O-N 3.07Å; Y259-V263 WeakPolarHBondContact O-CG2 3.38Å; Y259-V263 PolarHBondContact O-N 3.23Å; Y259-H324 HydrophobicContact CD2-CB 4.19Å; Y259-H324 HydrophobicContact CE2-CB 3.83Å; Y259-H324 AromaticContact CZ-CD2 3.7Å; Y259-W327 HydrophobicContact CD1-CB 4.44Å; Y259-W327 AromaticContact CD1-CD2 3.6Å; Y259-W327 HydrophobicContact CD1-CD2 3.6Å; Y259-W327 AromaticContact CD1-CE3 3.58Å; Y259-W327 HydrophobicContact CD1-CE3 3.58Å; Y259-W327 AromaticContact CD1-CG 4Å; Y259-W327 HydrophobicContact CD1-CG 4Å; Y259-W327 HydrophobicContact CD1-CH2 4.41Å; Y259-W327 HydrophobicContact CD1-CZ2 4.43Å; Y259-W327 HydrophobicContact CD1-CZ3 4Å; Y259-W327 HydrophobicContact CE1-CD2 4.31Å; Y259-W327 AromaticContact CE1-CE3 3.84Å; Y259-W327 HydrophobicContact CE1-CE3 3.84Å; Y259-W327 HydrophobicContact CE1-CH2 4.35Å; Y259-W327 AromaticContact CE1-CZ3 3.87Å; Y259-W327 HydrophobicContact CE1-CZ3 3.87Å; Y259-W327 HydrophobicContact CG-CB 4.36Å; Y259-W327 HydrophobicContact CG-CD2 4.37Å; Y259-W327 HydrophobicContact CG-CG 4.32Å; Y259-W327 VanDerWaalsContact O-CD1 3.24Å
260	F	78.9	Confident	78.7	Confident	1 Å²	1	24.1 Å²	24.1	0%	0.004	12%	0.124	C	C	.	.	H	α-helix	trans	-62.5	-47.8	179.8	-178	-106.8	0	0	0	112.5	L256 S258 G262 V263 Q264 T288 F291 Y292 M323	L256-F260 VanDerWaalsContact O-CB 3.26Å; L256-F260 WeakPolarHBondContact O-CB 3.09Å; L256-F260 PolarHBondContact O-N 3.1Å; S258-F260 PolarHBondContact O-N 3.44Å; F260-G262 VanDerWaalsContact C-N 3.3Å; F260-G262 PolarHBondContact O-N 2.85Å; F260-V263 PolarHBondContact O-N 3.42Å; F260-Q264 HydrophobicContact CE1-CG 4.45Å; F260-Q264 HydrophobicContact CZ-CG 4.47Å; F260-Q264 PolarHBondContact O-N 2.83Å; F260-T288 HydrophobicContact CE2-CG2 3.53Å; F260-T288 HydrophobicContact CZ-CG2 3.46Å; F260-T288 VanDerWaalsContact CZ-CG2 3.46Å; F260-F291 HydrophobicContact CB-CE1 4.38Å; F260-F291 HydrophobicContact CD1-CD1 4.32Å; F260-F291 AromaticContact CD1-CE1 3.96Å; F260-F291 HydrophobicContact CD1-CE1 3.96Å; F260-F291 AromaticContact CD2-CD1 3.48Å; F260-F291 HydrophobicContact CD2-CD1 3.48Å; F260-F291 VanDerWaalsContact CD2-CD1 3.48Å; F260-F291 AromaticContact CD2-CE1 3.7Å; F260-F291 HydrophobicContact CD2-CE1 3.7Å; F260-F291 HydrophobicContact CD2-CG 4.21Å; F260-F291 HydrophobicContact CE1-CD1 4.14Å; F260-F291 HydrophobicContact CE1-CE1 4.11Å; F260-F291 HydrophobicContact CE2-CB 4.23Å; F260-F291 AromaticContact CE2-CD1 3.25Å; F260-F291 HydrophobicContact CE2-CD1 3.25Å; F260-F291 AromaticContact CE2-CE1 3.86Å; F260-F291 HydrophobicContact CE2-CE1 3.86Å; F260-F291 HydrophobicContact CE2-CG 4.04Å; F260-F291 HydrophobicContact CG-CD1 4.01Å; F260-F291 AromaticContact CG-CE1 3.74Å; F260-F291 HydrophobicContact CG-CE1 3.74Å; F260-F291 AromaticContact CZ-CD1 3.61Å; F260-F291 HydrophobicContact CZ-CD1 3.61Å; F260-F291 HydrophobicContact CZ-CE1 4.05Å; F260-Y292 AromaticContact CE1-CE1 3.99Å; F260-Y292 HydrophobicContact CE1-CE1 3.99Å; F260-Y292 HydrophobicContact CE1-CE2 4.49Å; F260-Y292 AromaticContact CE1-CZ 3.8Å; F260-Y292 HydrophobicContact CZ-CD1 4.46Å; F260-Y292 HydrophobicContact CZ-CD2 4.37Å; F260-Y292 AromaticContact CZ-CE1 3.93Å; F260-Y292 HydrophobicContact CZ-CE1 3.93Å; F260-Y292 AromaticContact CZ-CE2 3.84Å; F260-Y292 HydrophobicContact CZ-CE2 3.84Å; F260-Y292 AromaticContact CZ-CZ 3.58Å; F260-M323 HydrophobicContact CD2-CE 4.4Å
261	M	77	Confident	78.4	Confident	2 Å²	2	28.1 Å²	28.1	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-67.5	-31.4	176.3	-68.5	-65.4	-78.9	0	0	112.1	W174 Y176 A257 S258 Q264 K265	W174-M261 HydrophobicContact CB-CE 4.01Å; W174-M261 HydrophobicContact CE3-CE 4.24Å; W174-M261 HydrophobicContact CE3-SD 4.23Å; W174-M261 WeakPolarHBondContact O-CE 3.47Å; Y176-M261 HydrophobicContact CD2-CE 4.25Å; Y176-M261 HydrophobicContact CE2-CB 4.32Å; Y176-M261 HydrophobicContact CE2-CE 4.2Å; Y176-M261 HydrophobicContact CE2-CG 3.87Å; Y176-M261 HydrophobicContact CG-CE 4.5Å; Y176-M261 WeakPolarHBondContact OH-CG 3.47Å; A257-M261 WeakPolarHBondContact O-CB 3.3Å; A257-M261 VanDerWaalsContact O-CG 3.26Å; A257-M261 WeakPolarHBondContact O-CG 3.42Å; A257-M261 PolarHBondContact O-N 3.31Å; A257-M261 VanDerWaalsContact O-N 3.09Å; S258-M261 PolarHBondContact O-N 3.46Å; M261-Q264 PolarHBondContact O-N 3.18Å; M261-K265 WeakPolarHBondContact O-CB 3.33Å; M261-K265 VanDerWaalsContact O-CG 3.23Å; M261-K265 WeakPolarHBondContact O-CG 3.42Å; M261-K265 PolarHBondContact O-N 3.11Å
262	G	76.2	Confident	77.8	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.3	-43.9	170.3	0	0	0	0	0	112.7	S258 Y259 F260 K265 I266	S258-G262 PolarHBondContact O-N 2.88Å; Y259-G262 PolarHBondContact O-N 3.07Å; F260-G262 VanDerWaalsContact C-N 3.3Å; F260-G262 PolarHBondContact O-N 2.85Å; G262-K265 PolarHBondContact O-N 2.75Å; G262-I266 VanDerWaalsContact O-CG1 3.27Å; G262-I266 WeakPolarHBondContact O-CG1 3.34Å; G262-I266 PolarHBondContact O-N 2.99Å
263	V	81.9	Confident	77.3	Confident	2 Å²	2	23.5 Å²	23.5	1%	0.012	15%	0.146	C	C	.	.	H	α-helix	trans	-62.2	-46.2	174.5	172	0	0	0	0	111	Y259 F260 K265 I266 I267 L284 M323 V326 W327 L330	Y259-V263 WeakPolarHBondContact O-CG2 3.38Å; Y259-V263 PolarHBondContact O-N 3.23Å; F260-V263 PolarHBondContact O-N 3.42Å; V263-K265 PolarHBondContact O-N 2.78Å; V263-I266 PolarHBondContact O-N 2.78Å; V263-I266 VanDerWaalsContact O-N 3.17Å; V263-I267 HydrophobicContact CG1-CD1 3.88Å; V263-I267 HydrophobicContact CG1-CG1 4.48Å; V263-I267 WeakPolarHBondContact O-CG1 3.41Å; V263-I267 PolarHBondContact O-N 3.29Å; V263-L284 HydrophobicContact CG1-CB 4.48Å; V263-M323 HydrophobicContact CG2-SD 4.3Å; V263-V326 HydrophobicContact CG2-CG1 4.48Å; V263-W327 HydrophobicContact CG2-CB 4.17Å; V263-L330 HydrophobicContact CG1-CD1 4.28Å; V263-L330 HydrophobicContact CG2-CD1 4.02Å
264	Q	80.3	Confident	77.2	Confident	14 Å²	14	23.7 Å²	23.7	7%	0.065	15%	0.148	C	C	.	.	H	α-helix	trans	-62.4	-41.4	177.3	-77.2	-60.8	-52.4	0	0	113.3	W174 F260 M261 I266 I267 A268 T288	W174-Q264 HydrophobicContact CB-CB 4.4Å; W174-Q264 HydrophobicContact CD2-CB 3.81Å; W174-Q264 HydrophobicContact CD2-CG 4.37Å; W174-Q264 HydrophobicContact CE3-CB 4.36Å; W174-Q264 HydrophobicContact CG-CB 3.8Å; W174-Q264 HydrophobicContact CZ2-CG 4.49Å; F260-Q264 HydrophobicContact CE1-CG 4.45Å; F260-Q264 HydrophobicContact CZ-CG 4.47Å; F260-Q264 PolarHBondContact O-N 2.83Å; M261-Q264 PolarHBondContact O-N 3.18Å; Q264-I266 VanDerWaalsContact C-N 3.32Å; Q264-I266 PolarHBondContact O-N 3.27Å; Q264-I267 PolarHBondContact O-N 3.01Å; Q264-A268 PolarHBondContact O-N 3.33Å; Q264-A268 VanDerWaalsContact O-N 3.17Å; Q264-T288 HydrophobicContact CG-CG2 4.46Å; Q264-T288 PolarHBondContact NE2-OG1 2.94Å
265	K	77.6	Confident	77.4	Confident	46 Å²	46	26.3 Å²	26.3	20%	0.2	16%	0.16	C	C	.	.	H	α-helix	trans	-60.6	-38.2	172.1	-74.8	171.5	-174.4	176.4	0	112.7	W174 M261 G262 V263 A269	W174-K265 HydrophobicContact CB-CG 3.87Å; W174-K265 WeakPolarHBondContact O-CE 3.31Å; M261-K265 WeakPolarHBondContact O-CB 3.33Å; M261-K265 VanDerWaalsContact O-CG 3.23Å; M261-K265 WeakPolarHBondContact O-CG 3.42Å; M261-K265 PolarHBondContact O-N 3.11Å; G262-K265 PolarHBondContact O-N 2.75Å; V263-K265 PolarHBondContact O-N 2.78Å; K265-A269 WeakPolarHBondContact O-CB 3.34Å; K265-A269 PolarHBondContact O-N 2.89Å
266	I	76.6	Confident	77.6	Confident	4 Å²	4	24.1 Å²	24.1	2%	0.021	15%	0.145	C	C	.	.	H	α-helix	trans	-70.1	-48	179.3	-69.9	165.6	0	0	0	110.1	G262 V263 Q264 A268 A269 T270 L330 V331	G262-I266 VanDerWaalsContact O-CG1 3.27Å; G262-I266 WeakPolarHBondContact O-CG1 3.34Å; G262-I266 PolarHBondContact O-N 2.99Å; V263-I266 PolarHBondContact O-N 2.78Å; V263-I266 VanDerWaalsContact O-N 3.17Å; Q264-I266 VanDerWaalsContact C-N 3.32Å; Q264-I266 PolarHBondContact O-N 3.27Å; I266-A268 VanDerWaalsContact C-N 3.35Å; I266-A268 PolarHBondContact O-N 2.87Å; I266-A269 CarbonylContact O-C 3.56Å; I266-A269 WeakPolarHBondContact O-CA 3.27Å; I266-A269 WeakPolarHBondContact O-CB 3.43Å; I266-A269 PolarHBondContact O-N 2.91Å; I266-T270 HydrophobicContact CG2-CG2 4.04Å; I266-T270 PolarHBondContact O-N 3.24Å; I266-T270 PolarHBondContact O-OG1 2.87Å; I266-L330 HydrophobicContact CD1-CB 3.89Å; I266-L330 HydrophobicContact CG2-CB 4.45Å; I266-V331 HydrophobicContact CD1-CG2 3.83Å
267	I	80.6	Confident	77.7	Confident	5 Å²	5	24.5 Å²	24.5	3%	0.026	15%	0.148	C	C	.	.	H	α-helix	trans	-51.1	-53.7	176.5	-68	162.5	0	0	0	110.7	V263 Q264 A269 T270 D271 N281 L284 Q285	V263-I267 HydrophobicContact CG1-CD1 3.88Å; V263-I267 HydrophobicContact CG1-CG1 4.48Å; V263-I267 WeakPolarHBondContact O-CG1 3.41Å; V263-I267 PolarHBondContact O-N 3.29Å; Q264-I267 PolarHBondContact O-N 3.01Å; I267-A269 PolarHBondContact O-N 2.89Å; I267-A269 VanDerWaalsContact O-N 3.11Å; I267-T270 PolarHBondContact O-N 3.38Å; I267-T270 VanDerWaalsContact O-N 3.1Å; I267-T270 PolarHBondContact O-OG1 3.03Å; I267-D271 VanDerWaalsContact O-CG 3.28Å; I267-D271 PolarHBondContact O-N 3.29Å; I267-N281 HydrophobicContact CG2-CB 4.2Å; I267-N281 PolarHBondContact O-ND2 3.34Å; I267-L284 HydrophobicContact CD1-CB 3.77Å; I267-L284 HydrophobicContact CG1-CB 4.16Å; I267-L284 HydrophobicContact CG1-CD1 4.31Å; I267-Q285 HydrophobicContact CD1-CG 4.32Å; I267-Q285 HydrophobicContact CG2-CG 4.16Å
268	A	78.3	Confident	78.1	Confident	33 Å²	33	27.2 Å²	27.2	27%	0.273	16%	0.162	S	C	.	.	H	α-helix	trans	-66	-13.9	-179.6	0	0	0	0	0	114.4	L172 Q264 I266	L172-A268 HydrophobicContact CD2-CB 4.45Å; Q264-A268 PolarHBondContact O-N 3.33Å; Q264-A268 VanDerWaalsContact O-N 3.17Å; I266-A268 VanDerWaalsContact C-N 3.35Å; I266-A268 PolarHBondContact O-N 2.87Å
269	A	75.3	Confident	78.5	Confident	57 Å²	57	28.3 Å²	28.3	47%	0.471	17%	0.17	S	C	.	.	H	α-helix	trans	-98.1	-20.2	174.9	0	0	0	0	0	113.5	K265 I266 I267	K265-A269 WeakPolarHBondContact O-CB 3.34Å; K265-A269 PolarHBondContact O-N 2.89Å; I266-A269 CarbonylContact O-C 3.56Å; I266-A269 WeakPolarHBondContact O-CA 3.27Å; I266-A269 WeakPolarHBondContact O-CB 3.43Å; I266-A269 PolarHBondContact O-N 2.91Å; I267-A269 PolarHBondContact O-N 2.89Å; I267-A269 VanDerWaalsContact O-N 3.11Å
270	T	72.1	Confident	78.8	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.006	16%	0.162	C	C	.	.	H	α-helix	trans	-99.6	-12.4	179.4	52.5	0	0	0	0	113.8	I266 I267 G272 L273 M277 N281 Q334	I266-T270 HydrophobicContact CG2-CG2 4.04Å; I266-T270 PolarHBondContact O-N 3.24Å; I266-T270 PolarHBondContact O-OG1 2.87Å; I267-T270 PolarHBondContact O-N 3.38Å; I267-T270 VanDerWaalsContact O-N 3.1Å; I267-T270 PolarHBondContact O-OG1 3.03Å; T270-G272 PolarHBondContact O-N 2.81Å; T270-G272 VanDerWaalsContact O-N 3.13Å; T270-L273 WeakPolarHBondContact O-CB 3.43Å; T270-L273 PolarHBondContact O-N 3.08Å; T270-M277 HydrophobicContact CG2-CE 3.54Å; T270-N281 VanDerWaalsContact OG1-CG 3.26Å; T270-N281 PolarHBondContact OG1-ND2 2.89Å; T270-N281 PolarHBondContact OG1-OD1 3.02Å; T270-Q334 VanDerWaalsContact CG2-OE1 3.23Å
271	D	71.8	Confident	79.2	Confident	86 Å²	86	26.5 Å²	26.5	46%	0.46	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	116.6	176.8	-78.4	-26.5	0	0	0	111.7	I267 N281	I267-D271 VanDerWaalsContact O-CG 3.28Å; I267-D271 PolarHBondContact O-N 3.29Å; D271-N281 PolarHBondContact N-ND2 3.44Å; D271-N281 PolarHBondContact OD1-ND2 2.8Å
272	G	68.3	Low	79.7	Confident	47 Å²	47	32.6 Å²	32.6	49%	0.485	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	97.8	-10.4	-177.2	0	0	0	0	0	115.6	T270 G274 N278	T270-G272 PolarHBondContact O-N 2.81Å; T270-G272 VanDerWaalsContact O-N 3.13Å; G272-G274 VanDerWaalsContact C-N 3.26Å; G272-G274 PolarHBondContact O-N 3.02Å; G272-N278 PolarHBondContact N-OD1 3.46Å
273	L	68.3	Low	80.2	Confident	99 Å²	99	32.7 Å²	32.7	52%	0.518	19%	0.192	S	C	.	.	S	Bend	trans	-82.7	54.2	-179.2	-58.4	-174.3	0	0	0	113.5	T270 M277	T270-L273 WeakPolarHBondContact O-CB 3.43Å; T270-L273 PolarHBondContact O-N 3.08Å; L273-M277 VanDerWaalsContact O-CB 3.27Å; L273-M277 WeakPolarHBondContact O-CB 3.49Å; L273-M277 VanDerWaalsContact O-CG 3.3Å; L273-M277 WeakPolarHBondContact O-CG 3.5Å
274	G	78.7	Confident	80.4	Confident	4 Å²	4	32.6 Å²	32.6	4%	0.041	19%	0.192	C	C	.	.			trans	98.7	159.2	176.1	0	0	0	0	0	114.7	G272 N278 D340	G272-G274 VanDerWaalsContact C-N 3.26Å; G272-G274 PolarHBondContact O-N 3.02Å; G274-N278 WeakPolarHBondContact O-CB 3.41Å; G274-N278 PolarHBondContact O-N 3.07Å; G274-N278 PolarHBondContact O-ND2 3Å; G274-D340 WeakPolarHBondContact CA-OD1 3.39Å
275	Q	82.6	Confident	80.7	Confident	62 Å²	62	36.4 Å²	36.4	29%	0.29	21%	0.209	S	C	.	.	H	α-helix	trans	-71.2	-37.9	-176	-65	172.4	68.7	0	0	112.3	N278 S279 P374 E394	Q275-N278 PolarHBondContact O-N 2.91Å; Q275-S279 WeakPolarHBondContact O-CB 3.46Å; Q275-S279 PolarHBondContact O-N 3.05Å; Q275-S279 PolarHBondContact O-OG 3.34Å; Q275-P374 HydrophobicContact CB-CB 3.89Å; Q275-P374 HydrophobicContact CB-CG 4.37Å; Q275-E394 WeakPolarHBondContact CB-OE1 3.4Å; Q275-E394 WeakPolarHBondContact CB-OE2 3.27Å; Q275-E394 WeakPolarHBondContact CG-OE1 3.45Å; Q275-E394 VanDerWaalsContact N-CD 3.25Å; Q275-E394 PolarHBondContact N-OE1 3.35Å; Q275-E394 PolarHBondContact N-OE2 3.05Å; Q275-E394 PolarHBondContact NE2-OE1 3.3Å
276	V	86.3	Confident	81.2	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-64.3	-44.9	176.4	175.1	0	0	0	0	110	S279 L280 D340 L344 A371 P374 Y375 E394	V276-S279 PolarHBondContact O-N 2.96Å; V276-L280 WeakPolarHBondContact O-CB 3.41Å; V276-L280 PolarHBondContact O-N 3.36Å; V276-D340 HydrophobicContact CB-CB 3.84Å; V276-D340 VanDerWaalsContact CB-OD1 3.3Å; V276-D340 WeakPolarHBondContact CB-OD1 3.27Å; V276-D340 HydrophobicContact CG2-CB 3.98Å; V276-D340 PolarHBondContact N-OD1 2.95Å; V276-L344 HydrophobicContact CG1-CD1 4.11Å; V276-L344 HydrophobicContact CG1-CD2 3.76Å; V276-L344 HydrophobicContact CG1-CG 3.75Å; V276-L344 HydrophobicContact CG2-CD1 4.22Å; V276-A371 HydrophobicContact CG1-CB 4.32Å; V276-P374 HydrophobicContact CG2-CG 4.27Å; V276-Y375 HydrophobicContact CG2-CD2 4.27Å; V276-E394 PolarHBondContact N-OE2 3.49Å
277	M	83	Confident	81.6	Confident	9 Å²	9	38.5 Å²	38.5	4%	0.044	22%	0.22	C	C	.	.	H	α-helix	trans	-64	-43.1	175.5	-69.4	-58.8	-68.3	0	0	112.6	T270 L273 S279 L280 N281 I333 D340 V343	T270-M277 HydrophobicContact CG2-CE 3.54Å; L273-M277 VanDerWaalsContact O-CB 3.27Å; L273-M277 WeakPolarHBondContact O-CB 3.49Å; L273-M277 VanDerWaalsContact O-CG 3.3Å; L273-M277 WeakPolarHBondContact O-CG 3.5Å; M277-S279 VanDerWaalsContact C-N 3.33Å; M277-S279 PolarHBondContact O-N 2.6Å; M277-L280 WeakPolarHBondContact O-CB 3.37Å; M277-L280 PolarHBondContact O-N 3.45Å; M277-L280 VanDerWaalsContact O-N 3.15Å; M277-L280 HydrophobicContact SD-CD2 4.27Å; M277-N281 WeakPolarHBondContact O-CB 3.46Å; M277-N281 PolarHBondContact O-N 3.01Å; M277-N281 PolarHBondContact O-OD1 3.38Å; M277-I333 HydrophobicContact CE-CG2 4.42Å; M277-D340 PolarHBondContact N-OD1 2.91Å; M277-V343 HydrophobicContact SD-CB 4.2Å; M277-V343 HydrophobicContact SD-CG1 3.89Å; M277-V343 HydrophobicContact SD-CG2 3.81Å
278	N	86.8	Confident	81.7	Confident	57 Å²	57	38.7 Å²	38.7	31%	0.305	22%	0.221	S	C	.	.	H	α-helix	trans	-61.4	-39.2	175.6	-71.4	-33	0	0	0	112.2	G272 G274 Q275 N281 E282	G272-N278 PolarHBondContact N-OD1 3.46Å; G274-N278 WeakPolarHBondContact O-CB 3.41Å; G274-N278 PolarHBondContact O-N 3.07Å; G274-N278 PolarHBondContact O-ND2 3Å; Q275-N278 PolarHBondContact O-N 2.91Å; N278-N281 PolarHBondContact O-N 3.41Å; N278-E282 PolarHBondContact O-N 2.92Å
279	S	86.9	Confident	82.1	Confident	24 Å²	24	42.3 Å²	42.3	17%	0.168	23%	0.232	C	C	.	.	H	α-helix	trans	-73.6	-24.7	174.6	-69.9	0	0	0	0	113.9	Q275 V276 M277 A283	Q275-S279 WeakPolarHBondContact O-CB 3.46Å; Q275-S279 PolarHBondContact O-N 3.05Å; Q275-S279 PolarHBondContact O-OG 3.34Å; V276-S279 PolarHBondContact O-N 2.96Å; M277-S279 VanDerWaalsContact C-N 3.33Å; M277-S279 PolarHBondContact O-N 2.6Å; S279-A283 WeakPolarHBondContact O-CB 3.36Å; S279-A283 PolarHBondContact O-N 3.39Å
280	L	87.6	Confident	82.6	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-71.5	-43.6	168	-178.7	60.1	0	0	0	110.6	V276 M277 E282 A283 L284 L330 V343 L347 L367 A371	V276-L280 WeakPolarHBondContact O-CB 3.41Å; V276-L280 PolarHBondContact O-N 3.36Å; M277-L280 WeakPolarHBondContact O-CB 3.37Å; M277-L280 PolarHBondContact O-N 3.45Å; M277-L280 VanDerWaalsContact O-N 3.15Å; M277-L280 HydrophobicContact SD-CD2 4.27Å; L280-E282 PolarHBondContact O-N 2.9Å; L280-A283 WeakPolarHBondContact O-CB 3.43Å; L280-A283 PolarHBondContact O-N 3.48Å; L280-L284 HydrophobicContact CD1-CD1 4.33Å; L280-L284 HydrophobicContact CD1-CG 4.37Å; L280-L284 HydrophobicContact CG-CD1 4.01Å; L280-L284 HydrophobicContact CG-CG 4.48Å; L280-L284 VanDerWaalsContact O-CG 3.27Å; L280-L284 WeakPolarHBondContact O-CG 3.35Å; L280-L284 PolarHBondContact O-N 2.97Å; L280-L330 HydrophobicContact CD2-CD2 4.07Å; L280-V343 HydrophobicContact CD2-CG1 4.13Å; L280-L347 HydrophobicContact CD1-CD1 4.45Å; L280-L347 HydrophobicContact CD2-CD1 4.21Å; L280-L367 HydrophobicContact CD1-CB 4.34Å; L280-A371 HydrophobicContact CB-CB 3.93Å; L280-A371 HydrophobicContact CD1-CB 4.18Å
281	N	87.3	Confident	83.1	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.011	21%	0.213	C	C	.	.	H	α-helix	trans	-58.9	-46.2	174.7	-79.1	14.7	0	0	0	111.5	I267 T270 D271 M277 N278 A283 L284 Q285	I267-N281 HydrophobicContact CG2-CB 4.2Å; I267-N281 PolarHBondContact O-ND2 3.34Å; T270-N281 VanDerWaalsContact OG1-CG 3.26Å; T270-N281 PolarHBondContact OG1-ND2 2.89Å; T270-N281 PolarHBondContact OG1-OD1 3.02Å; D271-N281 PolarHBondContact N-ND2 3.44Å; D271-N281 PolarHBondContact OD1-ND2 2.8Å; M277-N281 WeakPolarHBondContact O-CB 3.46Å; M277-N281 PolarHBondContact O-N 3.01Å; M277-N281 PolarHBondContact O-OD1 3.38Å; N278-N281 PolarHBondContact O-N 3.41Å; N281-A283 VanDerWaalsContact C-N 3.32Å; N281-A283 PolarHBondContact O-N 3.16Å; N281-L284 CarbonylContact O-C 3.52Å; N281-L284 PolarHBondContact O-N 2.98Å; N281-L284 VanDerWaalsContact O-N 3.16Å; N281-Q285 WeakPolarHBondContact O-CB 3.45Å; N281-Q285 VanDerWaalsContact O-CG 3.29Å; N281-Q285 WeakPolarHBondContact O-CG 3.31Å; N281-Q285 PolarHBondContact O-N 3.5Å
282	E	87.1	Confident	83.8	Confident	130 Å²	130	39.2 Å²	39.2	61%	0.607	20%	0.203	S	C	*	.	H	α-helix	trans	-55.1	-46.1	173.1	-175	-177.9	-169.8	0	0	111.5	N278 L280 L284 Q285 E286	N278-E282 PolarHBondContact O-N 2.92Å; L280-E282 PolarHBondContact O-N 2.9Å; E282-L284 VanDerWaalsContact C-N 3.34Å; E282-L284 PolarHBondContact O-N 3.32Å; E282-Q285 PolarHBondContact O-N 3.06Å; E282-E286 PolarHBondContact O-N 2.94Å
283	A	87.5	Confident	84.6	Confident	2 Å²	2	40.7 Å²	40.7	2%	0.017	20%	0.2	C	C	.	.	H	α-helix	trans	-66.2	-32.5	178.1	0	0	0	0	0	113.6	S279 L280 N281 L287 L367 K370	S279-A283 WeakPolarHBondContact O-CB 3.36Å; S279-A283 PolarHBondContact O-N 3.39Å; L280-A283 WeakPolarHBondContact O-CB 3.43Å; L280-A283 PolarHBondContact O-N 3.48Å; N281-A283 VanDerWaalsContact C-N 3.32Å; N281-A283 PolarHBondContact O-N 3.16Å; A283-L287 PolarHBondContact O-N 3.31Å; A283-L367 HydrophobicContact CB-CD2 3.82Å; A283-K370 HydrophobicContact CB-CB 3.8Å; A283-K370 HydrophobicContact CB-CD 3.59Å; A283-K370 HydrophobicContact CB-CG 4.34Å
284	L	86.5	Confident	85.4	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-78.9	-30.2	175.4	-66.1	167.8	0	0	0	112.4	V263 I267 L280 N281 E282 L287 T288 V326 L330 L367	V263-L284 HydrophobicContact CG1-CB 4.48Å; I267-L284 HydrophobicContact CD1-CB 3.77Å; I267-L284 HydrophobicContact CG1-CB 4.16Å; I267-L284 HydrophobicContact CG1-CD1 4.31Å; L280-L284 HydrophobicContact CD1-CD1 4.33Å; L280-L284 HydrophobicContact CD1-CG 4.37Å; L280-L284 HydrophobicContact CG-CD1 4.01Å; L280-L284 HydrophobicContact CG-CG 4.48Å; L280-L284 VanDerWaalsContact O-CG 3.27Å; L280-L284 WeakPolarHBondContact O-CG 3.35Å; L280-L284 PolarHBondContact O-N 2.97Å; N281-L284 CarbonylContact O-C 3.52Å; N281-L284 PolarHBondContact O-N 2.98Å; N281-L284 VanDerWaalsContact O-N 3.16Å; E282-L284 VanDerWaalsContact C-N 3.34Å; E282-L284 PolarHBondContact O-N 3.32Å; L284-L287 HydrophobicContact CD2-CD2 4.36Å; L284-L287 PolarHBondContact O-N 2.65Å; L284-T288 WeakPolarHBondContact O-CB 3.31Å; L284-T288 PolarHBondContact O-N 2.66Å; L284-T288 PolarHBondContact O-OG1 3.14Å; L284-V326 HydrophobicContact CD2-CG1 3.79Å; L284-L330 HydrophobicContact CD1-CD1 3.61Å; L284-L330 HydrophobicContact CD1-CD2 3.79Å; L284-L330 HydrophobicContact CD1-CG 4.36Å; L284-L330 HydrophobicContact CD2-CD1 3.85Å; L284-L330 HydrophobicContact CG-CD1 4.4Å; L284-L367 HydrophobicContact CD2-CD1 4Å; L284-L367 HydrophobicContact CD2-CD2 3.99Å; L284-L367 HydrophobicContact CG-CD2 4.45Å
285	Q	86.4	Confident	85.6	Confident	93 Å²	93	36.7 Å²	36.7	44%	0.435	18%	0.178	S	C	.	.	H	α-helix	trans	-67.1	-37.4	170.6	-73	173.6	13.4	0	0	111	I267 N281 E282 T288 H289	I267-Q285 HydrophobicContact CD1-CG 4.32Å; I267-Q285 HydrophobicContact CG2-CG 4.16Å; N281-Q285 WeakPolarHBondContact O-CB 3.45Å; N281-Q285 VanDerWaalsContact O-CG 3.29Å; N281-Q285 WeakPolarHBondContact O-CG 3.31Å; N281-Q285 PolarHBondContact O-N 3.5Å; E282-Q285 PolarHBondContact O-N 3.06Å; Q285-T288 WeakPolarHBondContact O-CB 3.26Å; Q285-T288 PolarHBondContact O-N 3.27Å; Q285-H289 PolarHBondContact O-N 3.41Å
286	E	86.6	Confident	85.7	Confident	86 Å²	86	36.8 Å²	36.8	40%	0.402	18%	0.182	S	C	.	.	H	α-helix	trans	-64.3	-44.6	171.9	-165.9	-175.5	129.8	0	0	111.8	E282 T288 H289 D290 K370	E282-E286 PolarHBondContact O-N 2.94Å; E286-T288 VanDerWaalsContact C-N 3.29Å; E286-T288 PolarHBondContact O-N 2.81Å; E286-H289 WeakPolarHBondContact O-CB 3.33Å; E286-H289 PolarHBondContact O-N 3.08Å; E286-D290 PolarHBondContact O-N 3.23Å; E286-K370 IonicContact OE1-NZ 3.38Å; E286-K370 PolarHBondContact OE1-NZ 3.34Å; E286-K370 IonicContact OE2-NZ 2.65Å; E286-K370 PolarHBondContact OE2-NZ 2.93Å
287	L	85.4	Confident	85.6	Confident	8 Å²	8	38.7 Å²	38.7	4%	0.042	19%	0.191	C	C	.	.	H	α-helix	trans	-59.3	-39.9	172.6	179.8	62.7	0	0	0	112.2	A283 L284 F291 V326 L363	A283-L287 PolarHBondContact O-N 3.31Å; L284-L287 HydrophobicContact CD2-CD2 4.36Å; L284-L287 PolarHBondContact O-N 2.65Å; L287-F291 PolarHBondContact O-N 3.1Å; L287-F291 VanDerWaalsContact O-N 3.14Å; L287-V326 HydrophobicContact CD2-CG1 4.33Å; L287-V326 HydrophobicContact CD2-CG2 4.49Å; L287-L363 HydrophobicContact CD1-CD1 3.83Å; L287-L363 HydrophobicContact CD2-CD2 4.21Å
288	T	83.9	Confident	85.6	Confident	9 Å²	9	38.7 Å²	38.7	6%	0.055	19%	0.193	C	C	.	.	H	α-helix	trans	-64.2	-42.1	176	-61.5	0	0	0	0	111	F260 Q264 L284 Q285 E286 F291 Y292	F260-T288 HydrophobicContact CE2-CG2 3.53Å; F260-T288 HydrophobicContact CZ-CG2 3.46Å; F260-T288 VanDerWaalsContact CZ-CG2 3.46Å; Q264-T288 HydrophobicContact CG-CG2 4.46Å; Q264-T288 PolarHBondContact NE2-OG1 2.94Å; L284-T288 WeakPolarHBondContact O-CB 3.31Å; L284-T288 PolarHBondContact O-N 2.66Å; L284-T288 PolarHBondContact O-OG1 3.14Å; Q285-T288 WeakPolarHBondContact O-CB 3.26Å; Q285-T288 PolarHBondContact O-N 3.27Å; E286-T288 VanDerWaalsContact C-N 3.29Å; E286-T288 PolarHBondContact O-N 2.81Å; T288-F291 WeakPolarHBondContact O-CB 3.28Å; T288-F291 PolarHBondContact O-N 3.4Å; T288-Y292 HydrophobicContact CG2-CD2 3.87Å; T288-Y292 HydrophobicContact CG2-CE2 3.5Å; T288-Y292 VanDerWaalsContact CG2-CE2 3.5Å; T288-Y292 WeakPolarHBondContact O-CD2 3.5Å; T288-Y292 PolarHBondContact O-N 3.1Å
289	H	86.3	Confident	85.6	Confident	109 Å²	109	38.5 Å²	38.5	51%	0.505	19%	0.19	S	C	.	.	H	α-helix	trans	-63.1	-47.1	177.7	-174.7	78.8	0	0	0	111.9	Q285 E286 F291 Y292 L293	Q285-H289 PolarHBondContact O-N 3.41Å; E286-H289 WeakPolarHBondContact O-CB 3.33Å; E286-H289 PolarHBondContact O-N 3.08Å; H289-F291 PolarHBondContact O-N 2.98Å; H289-Y292 PolarHBondContact O-N 3.04Å; H289-Y292 VanDerWaalsContact O-N 3.15Å; H289-L293 WeakPolarHBondContact O-CG 3.27Å; H289-L293 PolarHBondContact O-N 2.99Å
290	D	84.9	Confident	85.5	Confident	13 Å²	13	42.3 Å²	42.3	7%	0.07	21%	0.205	C	C	.	.	H	α-helix	trans	-60.9	-31.3	175.8	-88.9	10.5	0	0	0	112.1	F7 R10 E286 L293 I294	F7-D290 HydrophobicContact CD2-CB 4.04Å; F7-D290 HydrophobicContact CE2-CB 3.82Å; R10-D290 IonicContact CZ-OD2 2.62Å; R10-D290 IonicContact NH1-OD1 3.07Å; R10-D290 PolarHBondContact NH1-OD1 3.42Å; R10-D290 IonicContact NH1-OD2 3.92Å; R10-D290 PolarHBondContact NH1-OD2 3Å; E286-D290 PolarHBondContact O-N 3.23Å; D290-L293 PolarHBondContact O-N 2.97Å; D290-I294 PolarHBondContact O-N 2.97Å
291	F	83.3	Confident	85.2	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.009	22%	0.217	C	C	.	.	H	α-helix	trans	-70.5	-43.4	171.6	179.2	-106.1	0	0	0	113.2	L209 L256 F260 L287 T288 H289 L293 I294 I295 L316	L209-F291 HydrophobicContact CD2-CZ 4.26Å; L256-F291 HydrophobicContact CD1-CE2 4.45Å; L256-F291 HydrophobicContact CD2-CE2 3.91Å; L256-F291 HydrophobicContact CD2-CZ 4.18Å; L256-F291 HydrophobicContact CG-CE2 4.22Å; L256-F291 HydrophobicContact CG-CZ 4.19Å; F260-F291 HydrophobicContact CB-CE1 4.38Å; F260-F291 HydrophobicContact CD1-CD1 4.32Å; F260-F291 AromaticContact CD1-CE1 3.96Å; F260-F291 HydrophobicContact CD1-CE1 3.96Å; F260-F291 AromaticContact CD2-CD1 3.48Å; F260-F291 HydrophobicContact CD2-CD1 3.48Å; F260-F291 VanDerWaalsContact CD2-CD1 3.48Å; F260-F291 AromaticContact CD2-CE1 3.7Å; F260-F291 HydrophobicContact CD2-CE1 3.7Å; F260-F291 HydrophobicContact CD2-CG 4.21Å; F260-F291 HydrophobicContact CE1-CD1 4.14Å; F260-F291 HydrophobicContact CE1-CE1 4.11Å; F260-F291 HydrophobicContact CE2-CB 4.23Å; F260-F291 AromaticContact CE2-CD1 3.25Å; F260-F291 HydrophobicContact CE2-CD1 3.25Å; F260-F291 AromaticContact CE2-CE1 3.86Å; F260-F291 HydrophobicContact CE2-CE1 3.86Å; F260-F291 HydrophobicContact CE2-CG 4.04Å; F260-F291 HydrophobicContact CG-CD1 4.01Å; F260-F291 AromaticContact CG-CE1 3.74Å; F260-F291 HydrophobicContact CG-CE1 3.74Å; F260-F291 AromaticContact CZ-CD1 3.61Å; F260-F291 HydrophobicContact CZ-CD1 3.61Å; F260-F291 HydrophobicContact CZ-CE1 4.05Å; L287-F291 PolarHBondContact O-N 3.1Å; L287-F291 VanDerWaalsContact O-N 3.14Å; T288-F291 WeakPolarHBondContact O-CB 3.28Å; T288-F291 PolarHBondContact O-N 3.4Å; H289-F291 PolarHBondContact O-N 2.98Å; F291-L293 PolarHBondContact O-N 3.43Å; F291-I294 WeakPolarHBondContact O-CA 3.46Å; F291-I294 WeakPolarHBondContact O-CB 3.24Å; F291-I294 PolarHBondContact O-N 3.05Å; F291-I295 HydrophobicContact CD1-CD1 4.04Å; F291-I295 HydrophobicContact CE1-CD1 3.56Å; F291-I295 HydrophobicContact CE1-CG1 4.27Å; F291-I295 HydrophobicContact CZ-CD1 4.04Å; F291-I295 HydrophobicContact CZ-CG1 4.4Å; F291-I295 PolarHBondContact O-N 3.44Å; F291-I295 VanDerWaalsContact O-N 3.13Å; F291-L316 HydrophobicContact CE2-CD2 4.5Å
292	Y	85.4	Confident	85	Confident	65 Å²	65	45.6 Å²	45.6	26%	0.255	22%	0.221	S	C	.	.	H	α-helix	trans	-60.1	-33.5	172.4	-75.4	-56.3	0	0	0	112	T210 F260 T288 H289 I294 I295 V296	T210-Y292 HydrophobicContact CG2-CD1 4.36Å; T210-Y292 HydrophobicContact CG2-CE1 4.18Å; F260-Y292 AromaticContact CE1-CE1 3.99Å; F260-Y292 HydrophobicContact CE1-CE1 3.99Å; F260-Y292 HydrophobicContact CE1-CE2 4.49Å; F260-Y292 AromaticContact CE1-CZ 3.8Å; F260-Y292 HydrophobicContact CZ-CD1 4.46Å; F260-Y292 HydrophobicContact CZ-CD2 4.37Å; F260-Y292 AromaticContact CZ-CE1 3.93Å; F260-Y292 HydrophobicContact CZ-CE1 3.93Å; F260-Y292 AromaticContact CZ-CE2 3.84Å; F260-Y292 HydrophobicContact CZ-CE2 3.84Å; F260-Y292 AromaticContact CZ-CZ 3.58Å; T288-Y292 HydrophobicContact CG2-CD2 3.87Å; T288-Y292 HydrophobicContact CG2-CE2 3.5Å; T288-Y292 VanDerWaalsContact CG2-CE2 3.5Å; T288-Y292 WeakPolarHBondContact O-CD2 3.5Å; T288-Y292 PolarHBondContact O-N 3.1Å; H289-Y292 PolarHBondContact O-N 3.04Å; H289-Y292 VanDerWaalsContact O-N 3.15Å; Y292-I294 VanDerWaalsContact C-N 3.28Å; Y292-I294 PolarHBondContact O-N 3.13Å; Y292-I295 HydrophobicContact CD1-CD1 4.26Å; Y292-I295 PolarHBondContact O-N 3.33Å; Y292-V296 WeakPolarHBondContact O-CG2 3.4Å; Y292-V296 PolarHBondContact O-N 3.31Å
293	L	86.6	Confident	84.8	Confident	77 Å²	77	48.3 Å²	48.3	40%	0.403	23%	0.225	S	C	.	.	H	α-helix	trans	-65.5	-26.3	172.5	-68.2	176.6	0	0	0	113.3	H289 D290 F291 Q297	H289-L293 WeakPolarHBondContact O-CG 3.27Å; H289-L293 PolarHBondContact O-N 2.99Å; D290-L293 PolarHBondContact O-N 2.97Å; F291-L293 PolarHBondContact O-N 3.43Å; L293-Q297 WeakPolarHBondContact O-CG 3.15Å; L293-Q297 PolarHBondContact O-N 2.68Å; L293-Q297 PolarHBondContact O-NE2 3.06Å
294	I	83.8	Confident	84.7	Confident	7 Å²	7	54 Å²	54	4%	0.036	25%	0.252	C	S	.	.	H	α-helix	trans	-70.7	-46.8	168.8	-67.7	171.6	0	0	0	110.3	L4 F7 D290 F291 Y292 V296 Q297 A298 L316 T319	L4-I294 HydrophobicContact CD2-CD1 4.38Å; L4-I294 HydrophobicContact CD2-CG1 4.08Å; L4-I294 HydrophobicContact CD2-CG2 4.08Å; F7-I294 HydrophobicContact CB-CD1 4.46Å; F7-I294 HydrophobicContact CD1-CD1 4.03Å; F7-I294 HydrophobicContact CD2-CD1 3.63Å; F7-I294 HydrophobicContact CD2-CG1 4.21Å; F7-I294 HydrophobicContact CE1-CD1 4.15Å; F7-I294 HydrophobicContact CE2-CD1 3.73Å; F7-I294 HydrophobicContact CG-CD1 3.78Å; F7-I294 HydrophobicContact CG-CG1 4.49Å; F7-I294 HydrophobicContact CZ-CD1 4.01Å; D290-I294 PolarHBondContact O-N 2.97Å; F291-I294 WeakPolarHBondContact O-CA 3.46Å; F291-I294 WeakPolarHBondContact O-CB 3.24Å; F291-I294 PolarHBondContact O-N 3.05Å; Y292-I294 VanDerWaalsContact C-N 3.28Å; Y292-I294 PolarHBondContact O-N 3.13Å; I294-V296 PolarHBondContact O-N 3.16Å; I294-Q297 WeakPolarHBondContact O-CB 3.46Å; I294-Q297 PolarHBondContact O-N 2.9Å; I294-Q297 VanDerWaalsContact O-N 3.13Å; I294-A298 PolarHBondContact O-N 2.87Å; I294-L316 HydrophobicContact CG2-CD2 4.26Å; I294-T319 HydrophobicContact CD1-CG2 4.13Å
295	I	83.9	Confident	84.3	Confident	12 Å²	12	60.8 Å²	60.8	6%	0.062	29%	0.288	C	S	.	.	H	α-helix	trans	-58.7	-48.1	179.8	-65.2	178	0	0	0	110.7	L206 L209 T210 F291 Y292 Q297 A298 E299	L206-I295 HydrophobicContact CD2-CG2 4.2Å; L209-I295 HydrophobicContact CB-CD1 3.84Å; T210-I295 HydrophobicContact CG2-CD1 3.85Å; T210-I295 HydrophobicContact CG2-CG2 3.83Å; F291-I295 HydrophobicContact CD1-CD1 4.04Å; F291-I295 HydrophobicContact CE1-CD1 3.56Å; F291-I295 HydrophobicContact CE1-CG1 4.27Å; F291-I295 HydrophobicContact CZ-CD1 4.04Å; F291-I295 HydrophobicContact CZ-CG1 4.4Å; F291-I295 PolarHBondContact O-N 3.44Å; F291-I295 VanDerWaalsContact O-N 3.13Å; Y292-I295 HydrophobicContact CD1-CD1 4.26Å; Y292-I295 PolarHBondContact O-N 3.33Å; I295-Q297 PolarHBondContact O-N 3.26Å; I295-A298 WeakPolarHBondContact O-CB 3.48Å; I295-A298 PolarHBondContact O-N 3.31Å; I295-E299 WeakPolarHBondContact O-CB 3.06Å; I295-E299 PolarHBondContact O-N 2.9Å
296	V	85	Confident	84	Confident	64 Å²	64	63.9 Å²	63.9	39%	0.388	30%	0.296	S	S	.	.	H	α-helix	trans	-59.8	-33.5	178.1	171	0	0	0	0	112.1	Y292 I294 Q300	Y292-V296 WeakPolarHBondContact O-CG2 3.4Å; Y292-V296 PolarHBondContact O-N 3.31Å; I294-V296 PolarHBondContact O-N 3.16Å; V296-Q300 WeakPolarHBondContact O-CB 3.38Å; V296-Q300 WeakPolarHBondContact O-CG 3.47Å; V296-Q300 PolarHBondContact O-N 3.03Å
297	Q	83.8	Confident	83.8	Confident	41 Å²	41	60.5 Å²	60.5	19%	0.192	28%	0.28	C	S	.	.	H	α-helix	trans	-73.5	-37.2	173.7	-74.5	173	72.1	0	0	113	L293 I294 I295 Q300 E301	L293-Q297 WeakPolarHBondContact O-CG 3.15Å; L293-Q297 PolarHBondContact O-N 2.68Å; L293-Q297 PolarHBondContact O-NE2 3.06Å; I294-Q297 WeakPolarHBondContact O-CB 3.46Å; I294-Q297 PolarHBondContact O-N 2.9Å; I294-Q297 VanDerWaalsContact O-N 3.13Å; I295-Q297 PolarHBondContact O-N 3.26Å; Q297-Q300 PolarHBondContact O-N 3.13Å; Q297-E301 PolarHBondContact O-N 2.89Å
298	A	83.5	Confident	83.7	Confident	9 Å²	9	63 Å²	63	7%	0.074	30%	0.296	C	S	.	.	H	α-helix	trans	-65.4	-43.3	174.6	0	0	0	0	0	110.9	L206 I294 I295 Q300 E301 L302 L307 L312	L206-A298 HydrophobicContact CD2-CB 3.79Å; I294-A298 PolarHBondContact O-N 2.87Å; I295-A298 WeakPolarHBondContact O-CB 3.48Å; I295-A298 PolarHBondContact O-N 3.31Å; A298-Q300 VanDerWaalsContact C-N 3.34Å; A298-Q300 PolarHBondContact O-N 3.28Å; A298-E301 PolarHBondContact O-N 3.04Å; A298-E301 VanDerWaalsContact O-N 3.17Å; A298-L302 WeakPolarHBondContact O-CB 3.15Å; A298-L302 PolarHBondContact O-N 2.99Å; A298-L307 HydrophobicContact CB-CD2 4.39Å; A298-L312 HydrophobicContact CB-CD1 4Å
299	E	84.9	Confident	83.5	Confident	53 Å²	53	62.6 Å²	62.6	25%	0.248	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-40.9	174.4	-158.5	-147.3	149.4	0	0	111.8	L206 I295 L302 R303	L206-E299 HydrophobicContact CD1-CB 4.15Å; L206-E299 HydrophobicContact CD1-CG 4.39Å; I295-E299 WeakPolarHBondContact O-CB 3.06Å; I295-E299 PolarHBondContact O-N 2.9Å; E299-L302 WeakPolarHBondContact O-CB 3.47Å; E299-L302 PolarHBondContact O-N 2.73Å; E299-R303 WeakPolarHBondContact O-CB 3.37Å; E299-R303 VanDerWaalsContact O-CG 3.31Å; E299-R303 WeakPolarHBondContact O-CG 3.45Å; E299-R303 PolarHBondContact O-N 2.9Å; E299-R303 IonicContact OE1-CZ 3.25Å; E299-R303 IonicContact OE1-NE 2.71Å; E299-R303 PolarHBondContact OE1-NE 2.8Å; E299-R303 IonicContact OE1-NH2 3.38Å; E299-R303 PolarHBondContact OE1-NH2 3.38Å
300	Q	84.8	Confident	83.3	Confident	104 Å²	104	63.6 Å²	63.6	49%	0.486	30%	0.298	S	S	.	.	H	α-helix	trans	-62.2	-42.9	172.2	-75.6	171	22.3	0	0	112.3	V296 Q297 A298 L302 R303 H304	V296-Q300 WeakPolarHBondContact O-CB 3.38Å; V296-Q300 WeakPolarHBondContact O-CG 3.47Å; V296-Q300 PolarHBondContact O-N 3.03Å; Q297-Q300 PolarHBondContact O-N 3.13Å; A298-Q300 VanDerWaalsContact C-N 3.34Å; A298-Q300 PolarHBondContact O-N 3.28Å; Q300-L302 VanDerWaalsContact C-N 3.33Å; Q300-R303 PolarHBondContact O-N 2.84Å; Q300-H304 PolarHBondContact O-N 3.5Å; Q300-H304 PolarHBondContact O-ND1 3.49Å
301	E	82	Confident	83.3	Confident	53 Å²	53	65.3 Å²	65.3	25%	0.248	31%	0.305	C	S	.	.	H	α-helix	trans	-68	-31.2	175.4	-73.9	-84.5	138.1	0	0	112.4	Q297 A298 H304 N305 R306 L307 K311	Q297-E301 PolarHBondContact O-N 2.89Å; A298-E301 PolarHBondContact O-N 3.04Å; A298-E301 VanDerWaalsContact O-N 3.17Å; E301-H304 PolarHBondContact O-N 2.68Å; E301-N305 PolarHBondContact O-N 3.26Å; E301-R306 PolarHBondContact O-N 3.1Å; E301-R306 WeakPolarHBondContact OE2-CB 3.35Å; E301-L307 HydrophobicContact CB-CB 4.38Å; E301-L307 PolarHBondContact O-N 3.25Å; E301-K311 IonicContact OE2-NZ 2.67Å; E301-K311 PolarHBondContact OE2-NZ 3.36Å
302	L	83.1	Confident	83.2	Confident	19 Å²	19	65.3 Å²	65.3	10%	0.099	31%	0.305	C	S	.	.	H	α-helix	trans	-66.4	-50.4	172.7	-178	61.4	0	0	0	111	L202 D203 L206 A298 E299 Q300 H304 N305 L307	L202-L302 HydrophobicContact CB-CD1 3.83Å; L202-L302 HydrophobicContact CB-CD2 4.12Å; L202-L302 HydrophobicContact CD1-CD1 4Å; D203-L302 HydrophobicContact CB-CD2 4.24Å; L206-L302 HydrophobicContact CD1-CB 4.48Å; L206-L302 HydrophobicContact CD1-CD2 3.78Å; A298-L302 WeakPolarHBondContact O-CB 3.15Å; A298-L302 PolarHBondContact O-N 2.99Å; E299-L302 WeakPolarHBondContact O-CB 3.47Å; E299-L302 PolarHBondContact O-N 2.73Å; Q300-L302 VanDerWaalsContact C-N 3.33Å; L302-H304 PolarHBondContact O-N 2.68Å; L302-H304 VanDerWaalsContact O-N 3.09Å; L302-N305 WeakPolarHBondContact O-CA 3.45Å; L302-N305 PolarHBondContact O-N 2.99Å; L302-L307 HydrophobicContact CB-CB 4.2Å; L302-L307 HydrophobicContact CB-CD2 4.05Å; L302-L307 HydrophobicContact CD1-CB 4.37Å
303	R	82.9	Confident	83.1	Confident	187 Å²	187	63.6 Å²	63.6	71%	0.706	30%	0.3	S	S	*	.	H	α-helix	trans	-57.8	-23.1	175.1	-70.8	172.1	178.8	-136.9	7.6	113.6	E299 Q300	E299-R303 WeakPolarHBondContact O-CB 3.37Å; E299-R303 VanDerWaalsContact O-CG 3.31Å; E299-R303 WeakPolarHBondContact O-CG 3.45Å; E299-R303 PolarHBondContact O-N 2.9Å; E299-R303 IonicContact OE1-CZ 3.25Å; E299-R303 IonicContact OE1-NE 2.71Å; E299-R303 PolarHBondContact OE1-NE 2.8Å; E299-R303 IonicContact OE1-NH2 3.38Å; E299-R303 PolarHBondContact OE1-NH2 3.38Å; Q300-R303 PolarHBondContact O-N 2.84Å
304	H	84.9	Confident	83	Confident	123 Å²	123	67.4 Å²	67.4	57%	0.569	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	4.3	173.6	-74.2	90.2	0	0	0	114.2	Q300 E301 L302 R306	Q300-H304 PolarHBondContact O-N 3.5Å; Q300-H304 PolarHBondContact O-ND1 3.49Å; E301-H304 PolarHBondContact O-N 2.68Å; L302-H304 PolarHBondContact O-N 2.68Å; L302-H304 VanDerWaalsContact O-N 3.09Å; H304-R306 VanDerWaalsContact C-N 3.26Å; H304-R306 HydrophobicContact CB-CG 4.22Å; H304-R306 PolarHBondContact O-N 2.95Å
305	N	79.3	Confident	82.9	Confident	142 Å²	142	69.6 Å²	69.6	76%	0.759	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	38.5	-172.4	-62.8	-37.9	0	0	0	113.3	E301 L302	E301-N305 PolarHBondContact O-N 3.26Å; L302-N305 WeakPolarHBondContact O-CA 3.45Å; L302-N305 PolarHBondContact O-N 2.99Å
306	R	80.4	Confident	82.9	Confident	159 Å²	159	69.1 Å²	69.1	60%	0.6	32%	0.316	S	S	*	.			trans	-115.2	-8.4	-179.5	-68.9	176.7	-176.4	-178.5	0.6	113.8	E301 H304 K311	E301-R306 PolarHBondContact O-N 3.1Å; E301-R306 WeakPolarHBondContact OE2-CB 3.35Å; H304-R306 VanDerWaalsContact C-N 3.26Å; H304-R306 HydrophobicContact CB-CG 4.22Å; H304-R306 PolarHBondContact O-N 2.95Å; R306-K311 WeakPolarHBondContact O-CD 3.33Å; R306-K311 PolarHBondContact O-NZ 3.49Å
307	L	80.8	Confident	82.7	Confident	14 Å²	14	70.9 Å²	70.9	7%	0.073	32%	0.32	C	S	.	.			trans	-85.9	141.4	175	-165	64.8	0	0	0	110.5	L202 A298 E301 L302 K311 L312	L202-L307 HydrophobicContact CD1-CB 4.48Å; L202-L307 HydrophobicContact CD1-CD2 4.46Å; L202-L307 HydrophobicContact CD1-CG 4.31Å; L202-L307 HydrophobicContact CD2-CD2 3.95Å; L202-L307 HydrophobicContact CD2-CG 4.24Å; A298-L307 HydrophobicContact CB-CD2 4.39Å; E301-L307 HydrophobicContact CB-CB 4.38Å; E301-L307 PolarHBondContact O-N 3.25Å; L302-L307 HydrophobicContact CB-CB 4.2Å; L302-L307 HydrophobicContact CB-CD2 4.05Å; L302-L307 HydrophobicContact CD1-CB 4.37Å; L307-K311 HydrophobicContact CD1-CD 4.49Å; L307-K311 HydrophobicContact CD1-CG 4.32Å; L307-L312 HydrophobicContact CD1-CB 4.07Å; L307-L312 HydrophobicContact CD2-CB 4.47Å; L307-L312 HydrophobicContact CD2-CD1 4.47Å; L307-L312 HydrophobicContact CG-CB 4.39Å
308	T	83.9	Confident	82.6	Confident	62 Å²	62	72.2 Å²	72.2	38%	0.38	33%	0.332	S	S	.	.			trans	-130.5	158.6	165.2	60	0	0	0	0	107.8	E198 Q310 K311 L312	E198-T308 VanDerWaalsContact OE1-CA 3.27Å; E198-T308 WeakPolarHBondContact OE1-CA 3.29Å; E198-T308 VanDerWaalsContact OE1-CB 3.3Å; E198-T308 WeakPolarHBondContact OE1-CB 3.48Å; T308-Q310 VanDerWaalsContact C-N 3.27Å; T308-Q310 PolarHBondContact O-N 2.65Å; T308-K311 WeakPolarHBondContact O-CB 3.36Å; T308-K311 PolarHBondContact O-N 2.71Å; T308-K311 WeakPolarHBondContact OG1-CB 3.42Å; T308-K311 PolarHBondContact OG1-N 2.94Å; T308-L312 PolarHBondContact O-N 2.92Å
309	L	80.1	Confident	82.4	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-61.4	-37	-176.5	-171.6	60	0	0	0	112.1	E198 L202 L205 L246 Q249 V250 I253 L312 L313	E198-L309 HydrophobicContact CG-CB 4.28Å; E198-L309 PolarHBondContact OE1-N 3.1Å; L202-L309 HydrophobicContact CD2-CB 4.35Å; L202-L309 HydrophobicContact CD2-CD1 3.99Å; L205-L309 HydrophobicContact CD2-CD1 3.8Å; L246-L309 HydrophobicContact CB-CD2 4.42Å; L246-L309 HydrophobicContact CD2-CD2 3.93Å; Q249-L309 HydrophobicContact CB-CD2 3.58Å; Q249-L309 HydrophobicContact CB-CG 3.83Å; V250-L309 HydrophobicContact CG2-CD1 4.34Å; V250-L309 HydrophobicContact CG2-CD2 3.95Å; I253-L309 HydrophobicContact CD1-CD1 3.9Å; L309-L312 PolarHBondContact O-N 3.17Å; L309-L313 WeakPolarHBondContact O-CB 3.45Å; L309-L313 PolarHBondContact O-N 3.19Å
310	Q	82.3	Confident	82.3	Confident	130 Å²	130	71.3 Å²	71.3	61%	0.607	33%	0.328	S	S	*	.	H	α-helix	trans	-65.7	-37.3	172.7	-64.4	-177.5	-16.6	0	0	113.1	T308 Y314	T308-Q310 VanDerWaalsContact C-N 3.27Å; T308-Q310 PolarHBondContact O-N 2.65Å; Q310-Y314 WeakPolarHBondContact O-CB 3.38Å; Q310-Y314 PolarHBondContact O-N 2.74Å
311	K	83.6	Confident	82.1	Confident	48 Å²	48	74.3 Å²	74.3	21%	0.209	34%	0.335	C	S	.	.	H	α-helix	trans	-71.1	-37.2	177	176.5	177.5	164.3	-175.5	0	111.4	E301 R306 L307 T308 Y315	E301-K311 IonicContact OE2-NZ 2.67Å; E301-K311 PolarHBondContact OE2-NZ 3.36Å; R306-K311 WeakPolarHBondContact O-CD 3.33Å; R306-K311 PolarHBondContact O-NZ 3.49Å; L307-K311 HydrophobicContact CD1-CD 4.49Å; L307-K311 HydrophobicContact CD1-CG 4.32Å; T308-K311 WeakPolarHBondContact O-CB 3.36Å; T308-K311 PolarHBondContact O-N 2.71Å; T308-K311 WeakPolarHBondContact OG1-CB 3.42Å; T308-K311 PolarHBondContact OG1-N 2.94Å; K311-Y315 HydrophobicContact CD-CE2 4.27Å; K311-Y315 VanDerWaalsContact CE-OH 3.27Å; K311-Y315 WeakPolarHBondContact CE-OH 3.25Å; K311-Y315 HydrophobicContact CG-CD2 4.28Å; K311-Y315 HydrophobicContact CG-CE2 3.67Å; K311-Y315 WeakPolarHBondContact O-CD2 3.3Å; K311-Y315 PolarHBondContact O-N 2.83Å
312	L	82.9	Confident	82.1	Confident	3 Å²	3	73 Å²	73	2%	0.016	33%	0.33	C	S	.	.	H	α-helix	trans	-64.9	-49.5	172.4	-176.9	61.1	0	0	0	111.1	L202 L205 I253 A298 L307 T308 L309 Y314 Y315 L316	L202-L312 HydrophobicContact CD2-CB 4.3Å; L202-L312 HydrophobicContact CD2-CD2 3.7Å; L205-L312 HydrophobicContact CD2-CD2 3.94Å; I253-L312 HydrophobicContact CD1-CD2 4.39Å; I253-L312 HydrophobicContact CD1-CG 4.4Å; A298-L312 HydrophobicContact CB-CD1 4Å; L307-L312 HydrophobicContact CD1-CB 4.07Å; L307-L312 HydrophobicContact CD2-CB 4.47Å; L307-L312 HydrophobicContact CD2-CD1 4.47Å; L307-L312 HydrophobicContact CG-CB 4.39Å; T308-L312 PolarHBondContact O-N 2.92Å; L309-L312 PolarHBondContact O-N 3.17Å; L312-Y314 VanDerWaalsContact C-N 3.31Å; L312-Y314 PolarHBondContact O-N 3.31Å; L312-Y315 PolarHBondContact O-N 2.77Å; L312-Y315 VanDerWaalsContact O-N 3.09Å; L312-L316 HydrophobicContact CD1-CD1 3.88Å; L312-L316 HydrophobicContact CD1-CG 4.1Å; L312-L316 HydrophobicContact CD2-CD1 4.48Å; L312-L316 HydrophobicContact CG-CD1 3.85Å; L312-L316 HydrophobicContact CG-CG 4.39Å; L312-L316 WeakPolarHBondContact O-CG 3.36Å; L312-L316 PolarHBondContact O-N 2.73Å
313	L	82.9	Confident	82.1	Confident	28 Å²	28	72.7 Å²	72.7	15%	0.147	33%	0.328	C	S	.	.	H	α-helix	trans	-53	-47.7	175.9	178.2	65.4	0	0	0	111.6	E252 I253 L309 Y315 L316 Q317 M320	E252-L313 HydrophobicContact CB-CD1 3.9Å; E252-L313 WeakPolarHBondContact OE2-CD2 3.17Å; I253-L313 HydrophobicContact CD1-CB 4.16Å; I253-L313 HydrophobicContact CD1-CD1 4.35Å; I253-L313 HydrophobicContact CG1-CB 4.48Å; I253-L313 HydrophobicContact CG1-CD1 3.77Å; L309-L313 WeakPolarHBondContact O-CB 3.45Å; L309-L313 PolarHBondContact O-N 3.19Å; L313-Y315 VanDerWaalsContact C-N 3.35Å; L313-Y315 PolarHBondContact O-N 2.75Å; L313-L316 PolarHBondContact O-N 2.68Å; L313-Q317 WeakPolarHBondContact O-CB 3.46Å; L313-Q317 PolarHBondContact O-N 3.21Å; L313-M320 HydrophobicContact CD1-CE 4.09Å
314	Y	84.1	Confident	82.2	Confident	158 Å²	158	66.7 Å²	66.7	62%	0.62	31%	0.308	S	S	*	.	H	α-helix	trans	-60.5	-39	177.3	175.6	-106	0	0	0	113.3	Q310 L312	Q310-Y314 WeakPolarHBondContact O-CB 3.38Å; Q310-Y314 PolarHBondContact O-N 2.74Å; L312-Y314 VanDerWaalsContact C-N 3.31Å; L312-Y314 PolarHBondContact O-N 3.31Å
315	Y	81.8	Confident	82.1	Confident	53 Å²	53	62.6 Å²	62.6	21%	0.208	29%	0.289	C	S	.	.	H	α-helix	trans	-73.3	-32.2	176.5	-64.9	-26.1	0	0	0	113.4	L4 K311 L312 L313	L4-Y315 HydrophobicContact CD1-CD1 4.07Å; L4-Y315 HydrophobicContact CD1-CD2 3.68Å; L4-Y315 HydrophobicContact CD1-CE1 4.3Å; L4-Y315 HydrophobicContact CD1-CE2 3.91Å; L4-Y315 HydrophobicContact CD1-CG 3.77Å; K311-Y315 HydrophobicContact CD-CE2 4.27Å; K311-Y315 VanDerWaalsContact CE-OH 3.27Å; K311-Y315 WeakPolarHBondContact CE-OH 3.25Å; K311-Y315 HydrophobicContact CG-CD2 4.28Å; K311-Y315 HydrophobicContact CG-CE2 3.67Å; K311-Y315 WeakPolarHBondContact O-CD2 3.3Å; K311-Y315 PolarHBondContact O-N 2.83Å; L312-Y315 PolarHBondContact O-N 2.77Å; L312-Y315 VanDerWaalsContact O-N 3.09Å; L313-Y315 VanDerWaalsContact C-N 3.35Å; L313-Y315 PolarHBondContact O-N 2.75Å
316	L	83.1	Confident	82.3	Confident	2 Å²	2	56 Å²	56	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-82.7	-25	178.6	-63.9	178.3	0	0	0	112.7	L209 I253 L256 F291 I294 L312 L313 P318 T319 M320	L209-L316 HydrophobicContact CD1-CD1 4.09Å; I253-L316 HydrophobicContact CG2-CD1 3.63Å; L256-L316 HydrophobicContact CD2-CB 4.07Å; L256-L316 HydrophobicContact CD2-CD1 4.15Å; L256-L316 HydrophobicContact CD2-CD2 3.94Å; L256-L316 HydrophobicContact CD2-CG 4.27Å; F291-L316 HydrophobicContact CE2-CD2 4.5Å; I294-L316 HydrophobicContact CG2-CD2 4.26Å; L312-L316 HydrophobicContact CD1-CD1 3.88Å; L312-L316 HydrophobicContact CD1-CG 4.1Å; L312-L316 HydrophobicContact CD2-CD1 4.48Å; L312-L316 HydrophobicContact CG-CD1 3.85Å; L312-L316 HydrophobicContact CG-CG 4.39Å; L312-L316 WeakPolarHBondContact O-CG 3.36Å; L312-L316 PolarHBondContact O-N 2.73Å; L313-L316 PolarHBondContact O-N 2.68Å; L316-P318 VanDerWaalsContact C-CD 3.49Å; L316-T319 WeakPolarHBondContact O-CA 3.43Å; L316-T319 WeakPolarHBondContact O-CB 3.45Å; L316-T319 PolarHBondContact O-N 3.14Å; L316-T319 PolarHBondContact O-OG1 3.32Å; L316-M320 WeakPolarHBondContact O-CG 3.23Å; L316-M320 PolarHBondContact O-N 2.89Å; L316-M320 VanDerWaalsContact O-N 3.13Å
317	Q	82.1	Confident	82.4	Confident	100 Å²	100	48.6 Å²	48.6	47%	0.467	23%	0.226	S	C	.	.	H	α-helix	trans	-49.1	-43.4	-175.5	-173.6	179.8	7.8	0	0	115	L313 M320 W321	L313-Q317 WeakPolarHBondContact O-CB 3.46Å; L313-Q317 PolarHBondContact O-N 3.21Å; Q317-M320 HydrophobicContact CB-CE 4.46Å; Q317-W321 PolarHBondContact O-NE1 3.4Å
318	P	80.8	Confident	82.5	Confident	70 Å²	70	48.3 Å²	48.3	46%	0.455	23%	0.226	S	C	.	.	H	α-helix	trans	-66.6	-38	175.4	-19.9	33.8	0	0	0	112.7	L316 M320	L316-P318 VanDerWaalsContact C-CD 3.49Å; P318-M320 VanDerWaalsContact C-N 3.34Å; P318-M320 PolarHBondContact O-N 3.37Å
319	T	80.7	Confident	82.3	Confident	11 Å²	11	45.5 Å²	45.5	7%	0.067	21%	0.208	C	C	.	.	H	α-helix	trans	-68.4	-31.9	-177.1	72.7	0	0	0	0	112.6	F7 I294 L316 W321 V322 M323	F7-T319 HydrophobicContact CE1-CG2 3.88Å; F7-T319 HydrophobicContact CZ-CG2 4.37Å; I294-T319 HydrophobicContact CD1-CG2 4.13Å; L316-T319 WeakPolarHBondContact O-CA 3.43Å; L316-T319 WeakPolarHBondContact O-CB 3.45Å; L316-T319 PolarHBondContact O-N 3.14Å; L316-T319 PolarHBondContact O-OG1 3.32Å; T319-W321 PolarHBondContact O-N 3.1Å; T319-V322 PolarHBondContact O-N 3.19Å; T319-M323 VanDerWaalsContact O-CB 3.29Å; T319-M323 WeakPolarHBondContact O-CB 3.33Å; T319-M323 PolarHBondContact O-N 3.47Å
320	M	81.9	Confident	82.3	Confident	31 Å²	31	45.8 Å²	45.8	15%	0.153	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-45.7	-176.8	-66.5	-161.1	-77.6	0	0	113.2	L256 L313 L316 Q317 P318 H324	L256-M320 HydrophobicContact CB-CG 4.16Å; L256-M320 HydrophobicContact CB-SD 4.47Å; L256-M320 HydrophobicContact CD1-CG 4.37Å; L256-M320 HydrophobicContact CD2-CG 4.05Å; L256-M320 HydrophobicContact CG-CG 4.44Å; L313-M320 HydrophobicContact CD1-CE 4.09Å; L316-M320 WeakPolarHBondContact O-CG 3.23Å; L316-M320 PolarHBondContact O-N 2.89Å; L316-M320 VanDerWaalsContact O-N 3.13Å; Q317-M320 HydrophobicContact CB-CE 4.46Å; P318-M320 VanDerWaalsContact C-N 3.34Å; P318-M320 PolarHBondContact O-N 3.37Å; M320-H324 WeakPolarHBondContact O-CB 3.05Å; M320-H324 PolarHBondContact O-N 3.49Å
321	W	80.7	Confident	82.1	Confident	168 Å²	168	39.6 Å²	39.6	64%	0.636	18%	0.181	S	C	*	.	H	α-helix	trans	-67.2	-40.4	-180	-56.5	100	0	0	0	112.3	Q317 T319 E325	Q317-W321 PolarHBondContact O-NE1 3.4Å; T319-W321 PolarHBondContact O-N 3.1Å; W321-E325 PolarHBondContact O-N 2.83Å
322	V	82.5	Confident	81.8	Confident	25 Å²	25	40.2 Å²	40.2	15%	0.152	19%	0.186	C	C	.	.	H	α-helix	trans	-72.8	-40.9	-178.8	-176.3	0	0	0	0	110.8	T319 E325 V326 A360 L363	T319-V322 PolarHBondContact O-N 3.19Å; V322-E325 PolarHBondContact O-N 3.38Å; V322-V326 WeakPolarHBondContact O-CG2 3.29Å; V322-V326 PolarHBondContact O-N 3.15Å; V322-V326 VanDerWaalsContact O-N 3.08Å; V322-A360 HydrophobicContact CG2-CB 4.43Å; V322-L363 HydrophobicContact CG1-CB 4.01Å; V322-L363 HydrophobicContact CG1-CD1 3.8Å; V322-L363 HydrophobicContact CG1-CD2 3.99Å; V322-L363 HydrophobicContact CG1-CG 4.14Å
323	M	83.4	Confident	81.7	Confident	13 Å²	13	40.3 Å²	40.3	6%	0.064	19%	0.186	C	C	.	.	H	α-helix	trans	-66.5	-35.8	176.2	-166	63.4	72	0	0	112	L256 F260 V263 T319 V326 W327	L256-M323 HydrophobicContact CD1-CB 3.83Å; L256-M323 HydrophobicContact CD1-CG 3.98Å; F260-M323 HydrophobicContact CD2-CE 4.4Å; V263-M323 HydrophobicContact CG2-SD 4.3Å; T319-M323 VanDerWaalsContact O-CB 3.29Å; T319-M323 WeakPolarHBondContact O-CB 3.33Å; T319-M323 PolarHBondContact O-N 3.47Å; M323-V326 PolarHBondContact O-N 3.07Å; M323-W327 VanDerWaalsContact O-CB 3.24Å; M323-W327 WeakPolarHBondContact O-CB 3.47Å; M323-W327 PolarHBondContact O-N 3.31Å
324	H	84.4	Confident	81.3	Confident	61 Å²	61	41.5 Å²	41.5	28%	0.282	19%	0.191	S	C	.	.	H	α-helix	trans	-59.6	-45.7	171.8	173.3	-92.7	0	0	0	112.6	Y259 M320 S328	Y259-H324 HydrophobicContact CD2-CB 4.19Å; Y259-H324 HydrophobicContact CE2-CB 3.83Å; Y259-H324 AromaticContact CZ-CD2 3.7Å; M320-H324 WeakPolarHBondContact O-CB 3.05Å; M320-H324 PolarHBondContact O-N 3.49Å; H324-S328 VanDerWaalsContact O-CB 3.25Å; H324-S328 WeakPolarHBondContact O-CB 3.17Å; H324-S328 PolarHBondContact O-N 3.48Å; H324-S328 PolarHBondContact O-OG 2.89Å
325	E	81.4	Confident	80.6	Confident	36 Å²	36	37.9 Å²	37.9	17%	0.168	18%	0.182	C	C	.	.	H	α-helix	trans	-68.9	-34.3	179.3	-71.1	-51.3	116.3	0	0	112.9	W321 V322 S328 S329 R350 L354 A360 I364	W321-E325 PolarHBondContact O-N 2.83Å; V322-E325 PolarHBondContact O-N 3.38Å; E325-S328 PolarHBondContact O-OG 3.15Å; E325-S329 VanDerWaalsContact O-CB 3.26Å; E325-S329 WeakPolarHBondContact O-CB 3.47Å; E325-S329 PolarHBondContact O-N 3.37Å; E325-S329 PolarHBondContact O-OG 3.32Å; E325-R350 IonicContact OE2-CZ 2.72Å; E325-R350 IonicContact OE2-NH1 2.72Å; E325-R350 PolarHBondContact OE2-NH1 2.98Å; E325-L354 HydrophobicContact CG-CD2 4.15Å; E325-A360 HydrophobicContact CB-CB 4.44Å; E325-A360 HydrophobicContact CG-CB 4.39Å; E325-I364 HydrophobicContact CB-CD1 4.45Å
326	V	83.8	Confident	79.9	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.024	19%	0.192	C	C	.	.	H	α-helix	trans	-67.4	-53.2	172.6	172.6	0	0	0	0	110.8	V263 L284 L287 V322 M323 S328 S329 L330 L363 I364 L367	V263-V326 HydrophobicContact CG2-CG1 4.48Å; L284-V326 HydrophobicContact CD2-CG1 3.79Å; L287-V326 HydrophobicContact CD2-CG1 4.33Å; L287-V326 HydrophobicContact CD2-CG2 4.49Å; V322-V326 WeakPolarHBondContact O-CG2 3.29Å; V322-V326 PolarHBondContact O-N 3.15Å; V322-V326 VanDerWaalsContact O-N 3.08Å; M323-V326 PolarHBondContact O-N 3.07Å; V326-S328 PolarHBondContact O-N 3.36Å; V326-S329 WeakPolarHBondContact O-CB 3.42Å; V326-S329 PolarHBondContact O-N 2.93Å; V326-L330 HydrophobicContact CG1-CD1 3.71Å; V326-L330 WeakPolarHBondContact O-CG 3.32Å; V326-L330 PolarHBondContact O-N 3.32Å; V326-L363 HydrophobicContact CG2-CD2 3.5Å; V326-L363 VanDerWaalsContact CG2-CD2 3.5Å; V326-I364 HydrophobicContact CG2-CG1 4.37Å; V326-L367 HydrophobicContact CG1-CD1 4.32Å; V326-L367 HydrophobicContact CG2-CD1 4.06Å
327	W	83.3	Confident	79.2	Confident	4 Å²	4	43.9 Å²	43.9	2%	0.015	22%	0.223	C	C	.	.	H	α-helix	trans	-59.1	-49.5	179.8	171.7	86	0	0	0	112.2	L229 D233 Y259 V263 M323 S329 L330 V331	L229-W327 HydrophobicContact CB-CH2 4.29Å; L229-W327 HydrophobicContact CD2-CH2 4.08Å; L229-W327 HydrophobicContact CD2-CZ3 3.86Å; L229-W327 HydrophobicContact CG-CH2 4.14Å; L229-W327 HydrophobicContact CG-CZ3 4.32Å; D233-W327 HydrophobicContact CB-CZ2 4.32Å; Y259-W327 HydrophobicContact CD1-CB 4.44Å; Y259-W327 AromaticContact CD1-CD2 3.6Å; Y259-W327 HydrophobicContact CD1-CD2 3.6Å; Y259-W327 AromaticContact CD1-CE3 3.58Å; Y259-W327 HydrophobicContact CD1-CE3 3.58Å; Y259-W327 AromaticContact CD1-CG 4Å; Y259-W327 HydrophobicContact CD1-CG 4Å; Y259-W327 HydrophobicContact CD1-CH2 4.41Å; Y259-W327 HydrophobicContact CD1-CZ2 4.43Å; Y259-W327 HydrophobicContact CD1-CZ3 4Å; Y259-W327 HydrophobicContact CE1-CD2 4.31Å; Y259-W327 AromaticContact CE1-CE3 3.84Å; Y259-W327 HydrophobicContact CE1-CE3 3.84Å; Y259-W327 HydrophobicContact CE1-CH2 4.35Å; Y259-W327 AromaticContact CE1-CZ3 3.87Å; Y259-W327 HydrophobicContact CE1-CZ3 3.87Å; Y259-W327 HydrophobicContact CG-CB 4.36Å; Y259-W327 HydrophobicContact CG-CD2 4.37Å; Y259-W327 HydrophobicContact CG-CG 4.32Å; Y259-W327 VanDerWaalsContact O-CD1 3.24Å; V263-W327 HydrophobicContact CG2-CB 4.17Å; M323-W327 VanDerWaalsContact O-CB 3.24Å; M323-W327 WeakPolarHBondContact O-CB 3.47Å; M323-W327 PolarHBondContact O-N 3.31Å; W327-S329 VanDerWaalsContact C-N 3.26Å; W327-S329 PolarHBondContact O-N 3.16Å; W327-L330 PolarHBondContact O-N 2.88Å; W327-L330 VanDerWaalsContact O-N 3.17Å; W327-V331 HydrophobicContact CD2-CG2 4.09Å; W327-V331 HydrophobicContact CG-CG2 4.32Å; W327-V331 HydrophobicContact CZ2-CG2 4.16Å; W327-V331 WeakPolarHBondContact O-CB 3.36Å; W327-V331 WeakPolarHBondContact O-CG2 3.3Å; W327-V331 PolarHBondContact O-N 3.1Å
328	S	82.8	Confident	78.4	Confident	8 Å²	8	40.2 Å²	40.2	6%	0.056	21%	0.208	C	C	.	.	H	α-helix	trans	-65	-29.7	-179.9	64.7	0	0	0	0	112.6	H324 E325 V326 I332	H324-S328 VanDerWaalsContact O-CB 3.25Å; H324-S328 WeakPolarHBondContact O-CB 3.17Å; H324-S328 PolarHBondContact O-N 3.48Å; H324-S328 PolarHBondContact O-OG 2.89Å; E325-S328 PolarHBondContact O-OG 3.15Å; V326-S328 PolarHBondContact O-N 3.36Å; S328-I332 WeakPolarHBondContact O-CD1 3.44Å; S328-I332 VanDerWaalsContact O-CG1 3.26Å; S328-I332 WeakPolarHBondContact O-CG1 3.44Å; S328-I332 PolarHBondContact O-N 3.32Å
329	S	80.8	Confident	77.8	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.014	22%	0.215	C	C	.	.	H	α-helix	trans	-69.2	-46.2	172.2	-62.4	0	0	0	0	111.8	E325 V326 W327 I332 I333 R350	E325-S329 VanDerWaalsContact O-CB 3.26Å; E325-S329 WeakPolarHBondContact O-CB 3.47Å; E325-S329 PolarHBondContact O-N 3.37Å; E325-S329 PolarHBondContact O-OG 3.32Å; V326-S329 WeakPolarHBondContact O-CB 3.42Å; V326-S329 PolarHBondContact O-N 2.93Å; W327-S329 VanDerWaalsContact C-N 3.26Å; W327-S329 PolarHBondContact O-N 3.16Å; S329-I332 PolarHBondContact O-N 3.11Å; S329-I333 WeakPolarHBondContact O-CD1 3.5Å; S329-I333 WeakPolarHBondContact O-CG1 3.47Å; S329-I333 PolarHBondContact O-N 3.15Å; S329-I333 VanDerWaalsContact O-N 3.09Å; S329-R350 VanDerWaalsContact OG-CZ 3.23Å; S329-R350 PolarHBondContact OG-NE 3.46Å; S329-R350 PolarHBondContact OG-NH2 3.09Å
330	L	79.9	Confident	77.4	Confident	7 Å²	7	44.6 Å²	44.6	4%	0.037	22%	0.215	C	C	.	.	H	α-helix	trans	-68.3	-38.7	180	-68	167.1	0	0	0	112.7	V263 I266 L280 L284 V326 W327 I332 I333 Q334	V263-L330 HydrophobicContact CG1-CD1 4.28Å; V263-L330 HydrophobicContact CG2-CD1 4.02Å; I266-L330 HydrophobicContact CD1-CB 3.89Å; I266-L330 HydrophobicContact CG2-CB 4.45Å; L280-L330 HydrophobicContact CD2-CD2 4.07Å; L284-L330 HydrophobicContact CD1-CD1 3.61Å; L284-L330 HydrophobicContact CD1-CD2 3.79Å; L284-L330 HydrophobicContact CD1-CG 4.36Å; L284-L330 HydrophobicContact CD2-CD1 3.85Å; L284-L330 HydrophobicContact CG-CD1 4.4Å; V326-L330 HydrophobicContact CG1-CD1 3.71Å; V326-L330 WeakPolarHBondContact O-CG 3.32Å; V326-L330 PolarHBondContact O-N 3.32Å; W327-L330 PolarHBondContact O-N 2.88Å; W327-L330 VanDerWaalsContact O-N 3.17Å; L330-I332 VanDerWaalsContact C-N 3.28Å; L330-I332 PolarHBondContact O-N 3.17Å; L330-I333 HydrophobicContact CD2-CD1 4.29Å; L330-I333 PolarHBondContact O-N 3.42Å; L330-Q334 WeakPolarHBondContact O-CB 3.26Å; L330-Q334 PolarHBondContact O-N 3.13Å
331	V	77.6	Confident	77.2	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.9	-37.5	173.8	168.3	0	0	0	0	111.2	L229 Y232 I266 W327 Q334 L335	L229-V331 HydrophobicContact CB-CG1 4.5Å; L229-V331 HydrophobicContact CD1-CG1 3.77Å; L229-V331 HydrophobicContact CG-CG1 3.85Å; Y232-V331 HydrophobicContact CD2-CB 4.44Å; Y232-V331 HydrophobicContact CD2-CG1 3.68Å; Y232-V331 HydrophobicContact CD2-CG2 4.1Å; Y232-V331 HydrophobicContact CE2-CG1 4.27Å; Y232-V331 HydrophobicContact CG-CG2 4.15Å; I266-V331 HydrophobicContact CD1-CG2 3.83Å; W327-V331 HydrophobicContact CD2-CG2 4.09Å; W327-V331 HydrophobicContact CG-CG2 4.32Å; W327-V331 HydrophobicContact CZ2-CG2 4.16Å; W327-V331 WeakPolarHBondContact O-CB 3.36Å; W327-V331 WeakPolarHBondContact O-CG2 3.3Å; W327-V331 PolarHBondContact O-N 3.1Å; V331-Q334 PolarHBondContact O-N 3.05Å; V331-L335 HydrophobicContact CG1-CD1 3.8Å; V331-L335 HydrophobicContact CG1-CG 4.44Å; V331-L335 WeakPolarHBondContact O-CB 3.28Å; V331-L335 WeakPolarHBondContact O-CD1 3.5Å; V331-L335 WeakPolarHBondContact O-CG 3.41Å; V331-L335 PolarHBondContact O-N 2.85Å
332	I	77.7	Confident	77.2	Confident	61 Å²	61	38.9 Å²	38.9	31%	0.313	20%	0.195	S	C	.	.	H	α-helix	trans	-69.7	-40.4	176.2	-69.3	166.7	0	0	0	111.3	S328 S329 L330 Q334 L335 S336 Y346	S328-I332 WeakPolarHBondContact O-CD1 3.44Å; S328-I332 VanDerWaalsContact O-CG1 3.26Å; S328-I332 WeakPolarHBondContact O-CG1 3.44Å; S328-I332 PolarHBondContact O-N 3.32Å; S329-I332 PolarHBondContact O-N 3.11Å; L330-I332 VanDerWaalsContact C-N 3.28Å; L330-I332 PolarHBondContact O-N 3.17Å; I332-Q334 VanDerWaalsContact C-N 3.34Å; I332-Q334 PolarHBondContact O-N 3.14Å; I332-L335 PolarHBondContact O-N 3.26Å; I332-L335 VanDerWaalsContact O-N 3.12Å; I332-S336 PolarHBondContact O-N 3.07Å; I332-S336 VanDerWaalsContact O-N 3.15Å; I332-S336 PolarHBondContact O-OG 3.3Å; I332-Y346 HydrophobicContact CB-CE2 4.38Å; I332-Y346 WeakPolarHBondContact CB-OH 3.46Å; I332-Y346 WeakPolarHBondContact CD1-OH 3.46Å; I332-Y346 HydrophobicContact CG2-CD2 4.44Å; I332-Y346 HydrophobicContact CG2-CE2 3.52Å; I332-Y346 WeakPolarHBondContact CG2-OH 3.29Å
333	I	79.5	Confident	77.3	Confident	5 Å²	5	37.8 Å²	37.8	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-58.3	-45.2	172.4	-68.9	156.3	0	0	0	111	M277 S329 L330 L335 S336 D337 V343 Y346 L347	M277-I333 HydrophobicContact CE-CG2 4.42Å; S329-I333 WeakPolarHBondContact O-CD1 3.5Å; S329-I333 WeakPolarHBondContact O-CG1 3.47Å; S329-I333 PolarHBondContact O-N 3.15Å; S329-I333 VanDerWaalsContact O-N 3.09Å; L330-I333 HydrophobicContact CD2-CD1 4.29Å; L330-I333 PolarHBondContact O-N 3.42Å; I333-L335 PolarHBondContact O-N 3.21Å; I333-S336 PolarHBondContact O-N 3.32Å; I333-S336 PolarHBondContact O-OG 3.04Å; I333-D337 PolarHBondContact O-N 3.49Å; I333-V343 HydrophobicContact CD1-CG1 3.79Å; I333-V343 HydrophobicContact CG1-CG1 4.2Å; I333-V343 HydrophobicContact CG2-CG1 4.11Å; I333-V343 HydrophobicContact CG2-CG2 3.84Å; I333-Y346 HydrophobicContact CD1-CD1 3.89Å; I333-Y346 HydrophobicContact CD1-CE1 4.28Å; I333-Y346 HydrophobicContact CG1-CD1 3.68Å; I333-Y346 HydrophobicContact CG1-CE1 4.1Å; I333-Y346 HydrophobicContact CG1-CG 4.29Å; I333-L347 HydrophobicContact CD1-CD2 4.01Å; I333-L347 HydrophobicContact CD1-CG 4.21Å
334	Q	74.7	Confident	77.3	Confident	52 Å²	52	37.1 Å²	37.1	24%	0.243	19%	0.185	C	C	.	.	H	α-helix	trans	-70.6	-15.9	178.1	-162.5	63.3	30.8	0	0	113.5	Y232 T270 L330 V331 I332	Y232-Q334 HydrophobicContact CE1-CG 4.45Å; T270-Q334 VanDerWaalsContact CG2-OE1 3.23Å; L330-Q334 WeakPolarHBondContact O-CB 3.26Å; L330-Q334 PolarHBondContact O-N 3.13Å; V331-Q334 PolarHBondContact O-N 3.05Å; I332-Q334 VanDerWaalsContact C-N 3.34Å; I332-Q334 PolarHBondContact O-N 3.14Å
335	L	70.8	Confident	77.3	Confident	82 Å²	82	35.6 Å²	35.6	43%	0.429	18%	0.18	S	C	.	.	H	α-helix	trans	-91.2	-17.8	175.4	-75.7	166.9	0	0	0	113.1	L229 Y232 V331 I332 I333	L229-L335 HydrophobicContact CD1-CD1 4.38Å; Y232-L335 HydrophobicContact CE2-CD2 4.35Å; Y232-L335 HydrophobicContact CE2-CG 4.41Å; V331-L335 HydrophobicContact CG1-CD1 3.8Å; V331-L335 HydrophobicContact CG1-CG 4.44Å; V331-L335 WeakPolarHBondContact O-CB 3.28Å; V331-L335 WeakPolarHBondContact O-CD1 3.5Å; V331-L335 WeakPolarHBondContact O-CG 3.41Å; V331-L335 PolarHBondContact O-N 2.85Å; I332-L335 PolarHBondContact O-N 3.26Å; I332-L335 VanDerWaalsContact O-N 3.12Å; I333-L335 PolarHBondContact O-N 3.21Å
336	S	66.2	Low	77.5	Confident	61 Å²	61	35.9 Å²	35.9	43%	0.427	18%	0.18	S	C	.	.	H	α-helix	trans	-96	-8	177.5	59.7	0	0	0	0	114.7	I332 I333 S338	I332-S336 PolarHBondContact O-N 3.07Å; I332-S336 VanDerWaalsContact O-N 3.15Å; I332-S336 PolarHBondContact O-OG 3.3Å; I333-S336 PolarHBondContact O-N 3.32Å; I333-S336 PolarHBondContact O-OG 3.04Å; S336-S338 WeakPolarHBondContact CB-OG 3.44Å; S336-S338 PolarHBondContact O-N 3.22Å; S336-S338 VanDerWaalsContact OG-CB 3.27Å; S336-S338 WeakPolarHBondContact OG-CB 3.47Å; S336-S338 PolarHBondContact OG-OG 3.1Å
337	D	68.3	Low	77.6	Confident	121 Å²	121	36 Å²	36	65%	0.647	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.9	27.8	-171.1	-160.2	46.7	0	0	0	112.6	I333	I333-D337 PolarHBondContact O-N 3.49Å
338	S	65.6	Low	77.6	Confident	23 Å²	23	36.9 Å²	36.9	16%	0.161	19%	0.185	C	C	.	.			trans	-70.6	133.7	-169.8	-81	0	0	0	0	112.8	S336 E342 V343	S336-S338 WeakPolarHBondContact CB-OG 3.44Å; S336-S338 PolarHBondContact O-N 3.22Å; S336-S338 VanDerWaalsContact OG-CB 3.27Å; S336-S338 WeakPolarHBondContact OG-CB 3.47Å; S336-S338 PolarHBondContact OG-OG 3.1Å; S338-E342 WeakPolarHBondContact CA-OE2 3.46Å; S338-E342 WeakPolarHBondContact CB-OE2 3.43Å; S338-E342 PolarHBondContact OG-OE2 2.97Å; S338-V343 VanDerWaalsContact O-CG2 3.27Å; S338-V343 WeakPolarHBondContact O-CG2 3.32Å
339	R	68.1	Low	77.7	Confident	160 Å²	160	40.3 Å²	40.3	60%	0.604	20%	0.2	S	C	*	.			trans	-99	129.9	-177.2	-60.9	-179.1	-172.8	163.5	6.1	111.6	A341 E342	R339-A341 PolarHBondContact O-N 3.06Å; R339-E342 WeakPolarHBondContact O-CB 3.41Å; R339-E342 PolarHBondContact O-N 2.67Å
340	D	71.9	Confident	77.9	Confident	12 Å²	12	41.6 Å²	41.6	6%	0.064	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	28.8	-78.8	167.6	-56.6	-82	0	0	0	116.8	G274 V276 M277 E342 V343 L344 E394	G274-D340 WeakPolarHBondContact CA-OD1 3.39Å; V276-D340 HydrophobicContact CB-CB 3.84Å; V276-D340 VanDerWaalsContact CB-OD1 3.3Å; V276-D340 WeakPolarHBondContact CB-OD1 3.27Å; V276-D340 HydrophobicContact CG2-CB 3.98Å; V276-D340 PolarHBondContact N-OD1 2.95Å; M277-D340 PolarHBondContact N-OD1 2.91Å; D340-E342 PolarHBondContact O-N 3.22Å; D340-V343 WeakPolarHBondContact O-CB 3.12Å; D340-V343 PolarHBondContact O-N 3.17Å; D340-V343 VanDerWaalsContact O-N 3.11Å; D340-L344 PolarHBondContact O-N 2.97Å; D340-E394 HydrophobicContact CB-CB 4.43Å; D340-E394 HydrophobicContact CB-CG 4.08Å
341	A	77.8	Confident	78.1	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-64.3	-32.6	179.3	0	0	0	0	0	114.5	R339 V343 T345 Y375 Q427 P429	R339-A341 PolarHBondContact O-N 3.06Å; A341-V343 VanDerWaalsContact C-N 3.33Å; A341-T345 WeakPolarHBondContact O-CB 3.28Å; A341-T345 PolarHBondContact O-N 3.22Å; A341-T345 PolarHBondContact O-OG1 2.06Å; A341-Y375 HydrophobicContact CB-CE2 4.36Å; A341-Q427 HydrophobicContact CB-CB 4.22Å; A341-P429 HydrophobicContact CB-CG 4.05Å
342	E	80.8	Confident	78.4	Confident	79 Å²	79	46.8 Å²	46.8	37%	0.369	23%	0.227	S	C	.	.	H	α-helix	trans	-66.7	-37.3	171	-68.7	-176.1	-168.5	0	0	111.1	S338 R339 D340 T345 Y346	S338-E342 WeakPolarHBondContact CA-OE2 3.46Å; S338-E342 WeakPolarHBondContact CB-OE2 3.43Å; S338-E342 PolarHBondContact OG-OE2 2.97Å; R339-E342 WeakPolarHBondContact O-CB 3.41Å; R339-E342 PolarHBondContact O-N 2.67Å; D340-E342 PolarHBondContact O-N 3.22Å; E342-T345 WeakPolarHBondContact O-CB 3.44Å; E342-T345 PolarHBondContact O-N 3.34Å; E342-Y346 WeakPolarHBondContact O-CB 3.42Å; E342-Y346 PolarHBondContact O-N 2.9Å
343	V	83.9	Confident	78.8	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-68	-42.2	179.5	-176.1	0	0	0	0	110.6	M277 L280 I333 S338 D340 A341 T345 Y346 L347	M277-V343 HydrophobicContact SD-CB 4.2Å; M277-V343 HydrophobicContact SD-CG1 3.89Å; M277-V343 HydrophobicContact SD-CG2 3.81Å; L280-V343 HydrophobicContact CD2-CG1 4.13Å; I333-V343 HydrophobicContact CD1-CG1 3.79Å; I333-V343 HydrophobicContact CG1-CG1 4.2Å; I333-V343 HydrophobicContact CG2-CG1 4.11Å; I333-V343 HydrophobicContact CG2-CG2 3.84Å; S338-V343 VanDerWaalsContact O-CG2 3.27Å; S338-V343 WeakPolarHBondContact O-CG2 3.32Å; D340-V343 WeakPolarHBondContact O-CB 3.12Å; D340-V343 PolarHBondContact O-N 3.17Å; D340-V343 VanDerWaalsContact O-N 3.11Å; A341-V343 VanDerWaalsContact C-N 3.33Å; V343-T345 VanDerWaalsContact C-N 3.3Å; V343-T345 PolarHBondContact O-N 3.48Å; V343-Y346 PolarHBondContact O-N 2.95Å; V343-L347 HydrophobicContact CG1-CD1 3.95Å; V343-L347 HydrophobicContact CG1-CG 4.43Å; V343-L347 WeakPolarHBondContact O-CB 3.43Å; V343-L347 VanDerWaalsContact O-CG 3.28Å; V343-L347 WeakPolarHBondContact O-CG 3.42Å; V343-L347 PolarHBondContact O-N 3.11Å
344	L	84	Confident	78.8	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.2	-38.8	170.7	-65.4	177.5	0	0	0	112.1	V276 D340 H348 A371 A372 Y375 P429 F431	V276-L344 HydrophobicContact CG1-CD1 4.11Å; V276-L344 HydrophobicContact CG1-CD2 3.76Å; V276-L344 HydrophobicContact CG1-CG 3.75Å; V276-L344 HydrophobicContact CG2-CD1 4.22Å; D340-L344 PolarHBondContact O-N 2.97Å; L344-H348 WeakPolarHBondContact O-CB 3.41Å; L344-H348 PolarHBondContact O-N 2.97Å; L344-A371 HydrophobicContact CD2-CB 4.21Å; L344-A372 HydrophobicContact CD2-CB 4.06Å; L344-Y375 HydrophobicContact CD1-CD2 4.2Å; L344-Y375 HydrophobicContact CD1-CG 4.06Å; L344-P429 HydrophobicContact CD1-CG 4.49Å; L344-F431 HydrophobicContact CB-CE1 4.28Å
345	T	85.5	Confident	78.9	Confident	29 Å²	29	56.4 Å²	56.4	18%	0.178	26%	0.264	C	S	.	.	H	α-helix	trans	-63.8	-48.5	175.5	-67.7	0	0	0	0	111.8	A341 E342 V343 H348 E349 P429 S430	A341-T345 WeakPolarHBondContact O-CB 3.28Å; A341-T345 PolarHBondContact O-N 3.22Å; A341-T345 PolarHBondContact O-OG1 2.06Å; E342-T345 WeakPolarHBondContact O-CB 3.44Å; E342-T345 PolarHBondContact O-N 3.34Å; V343-T345 VanDerWaalsContact C-N 3.3Å; V343-T345 PolarHBondContact O-N 3.48Å; T345-H348 PolarHBondContact O-N 3.15Å; T345-E349 PolarHBondContact O-N 3.47Å; T345-P429 WeakPolarHBondContact OG1-CA 3.49Å; T345-S430 PolarHBondContact OG1-N 2.88Å
346	Y	85.1	Confident	79.2	Confident	42 Å²	42	56.5 Å²	56.5	17%	0.165	29%	0.285	C	S	.	.	H	α-helix	trans	-61.7	-47.1	179	177.9	-91.1	0	0	0	112	I332 I333 E342 V343 H348 E349 R350	I332-Y346 HydrophobicContact CB-CE2 4.38Å; I332-Y346 WeakPolarHBondContact CB-OH 3.46Å; I332-Y346 WeakPolarHBondContact CD1-OH 3.46Å; I332-Y346 HydrophobicContact CG2-CD2 4.44Å; I332-Y346 HydrophobicContact CG2-CE2 3.52Å; I332-Y346 WeakPolarHBondContact CG2-OH 3.29Å; I333-Y346 HydrophobicContact CD1-CD1 3.89Å; I333-Y346 HydrophobicContact CD1-CE1 4.28Å; I333-Y346 HydrophobicContact CG1-CD1 3.68Å; I333-Y346 HydrophobicContact CG1-CE1 4.1Å; I333-Y346 HydrophobicContact CG1-CG 4.29Å; E342-Y346 WeakPolarHBondContact O-CB 3.42Å; E342-Y346 PolarHBondContact O-N 2.9Å; V343-Y346 PolarHBondContact O-N 2.95Å; Y346-H348 VanDerWaalsContact C-N 3.34Å; Y346-H348 PolarHBondContact O-N 3.04Å; Y346-E349 PolarHBondContact O-N 3.06Å; Y346-R350 PolarHBondContact O-N 2.65Å; Y346-R350 PolarHBondContact OH-NH2 3.15Å
347	L	85.2	Confident	79.9	Confident	7 Å²	7	56.3 Å²	56.3	4%	0.037	28%	0.279	C	S	.	.	H	α-helix	trans	-66.7	-35.9	178.6	-66.3	168.9	0	0	0	111.7	L280 I333 V343 R350 I351 V368	L280-L347 HydrophobicContact CD1-CD1 4.45Å; L280-L347 HydrophobicContact CD2-CD1 4.21Å; I333-L347 HydrophobicContact CD1-CD2 4.01Å; I333-L347 HydrophobicContact CD1-CG 4.21Å; V343-L347 HydrophobicContact CG1-CD1 3.95Å; V343-L347 HydrophobicContact CG1-CG 4.43Å; V343-L347 WeakPolarHBondContact O-CB 3.43Å; V343-L347 VanDerWaalsContact O-CG 3.28Å; V343-L347 WeakPolarHBondContact O-CG 3.42Å; V343-L347 PolarHBondContact O-N 3.11Å; L347-R350 PolarHBondContact O-N 3.17Å; L347-I351 WeakPolarHBondContact O-CG1 3.15Å; L347-I351 PolarHBondContact O-N 3.31Å; L347-V368 HydrophobicContact CB-CG2 3.42Å; L347-V368 VanDerWaalsContact CB-CG2 3.42Å; L347-V368 HydrophobicContact CD1-CG2 4.02Å; L347-V368 HydrophobicContact CG-CG2 4.27Å
348	H	84.1	Confident	80.6	Confident	22 Å²	22	57.8 Å²	57.8	10%	0.102	28%	0.28	C	S	.	.	H	α-helix	trans	-65.8	-34.7	172.9	-179.1	65.1	0	0	0	112.8	L344 T345 Y346 K352 F431	L344-H348 WeakPolarHBondContact O-CB 3.41Å; L344-H348 PolarHBondContact O-N 2.97Å; T345-H348 PolarHBondContact O-N 3.15Å; Y346-H348 VanDerWaalsContact C-N 3.34Å; Y346-H348 PolarHBondContact O-N 3.04Å; H348-K352 PolarHBondContact CD2-NZ 2.8Å; H348-K352 WeakPolarHBondContact NE2-CE 3.2Å; H348-K352 PolarHBondContact NE2-NZ 3.49Å; H348-F431 HydrophobicContact CB-CD1 4.44Å
349	E	84.4	Confident	81.3	Confident	79 Å²	79	60.8 Å²	60.8	37%	0.369	29%	0.294	S	S	.	.	H	α-helix	trans	-68	-42.2	168.6	-78	-164.5	-157.3	0	0	112.7	T345 Y346 I351 K352 R353	T345-E349 PolarHBondContact O-N 3.47Å; Y346-E349 PolarHBondContact O-N 3.06Å; E349-I351 VanDerWaalsContact C-N 3.28Å; E349-I351 PolarHBondContact O-N 3.15Å; E349-K352 PolarHBondContact O-N 2.99Å; E349-K352 VanDerWaalsContact O-N 3.09Å; E349-R353 WeakPolarHBondContact O-CG 3.3Å; E349-R353 PolarHBondContact O-N 3.43Å; E349-R353 IonicContact OE2-CZ 3.33Å; E349-R353 IonicContact OE2-NE 2.75Å; E349-R353 IonicContact OE2-NH2 3.68Å; E349-R353 PolarHBondContact OE2-NH2 3.5Å
350	R	83.9	Confident	81.9	Confident	30 Å²	30	53.2 Å²	53.2	11%	0.113	27%	0.265	C	S	.	.	H	α-helix	trans	-59.3	-38.4	177.6	178.6	63.1	72	134.9	9.6	111.6	E325 S329 Y346 L347 K352 R353 L354 I364	E325-R350 IonicContact OE2-CZ 2.72Å; E325-R350 IonicContact OE2-NH1 2.72Å; E325-R350 PolarHBondContact OE2-NH1 2.98Å; S329-R350 VanDerWaalsContact OG-CZ 3.23Å; S329-R350 PolarHBondContact OG-NE 3.46Å; S329-R350 PolarHBondContact OG-NH2 3.09Å; Y346-R350 PolarHBondContact O-N 2.65Å; Y346-R350 PolarHBondContact OH-NH2 3.15Å; L347-R350 PolarHBondContact O-N 3.17Å; R350-K352 VanDerWaalsContact C-N 3.29Å; R350-K352 PolarHBondContact O-N 2.91Å; R350-R353 PolarHBondContact O-N 2.81Å; R350-L354 HydrophobicContact CG-CD1 3.81Å; R350-L354 HydrophobicContact CG-CG 4.38Å; R350-L354 WeakPolarHBondContact O-CB 3.49Å; R350-L354 WeakPolarHBondContact O-CG 3.49Å; R350-L354 PolarHBondContact O-N 2.89Å; R350-L354 VanDerWaalsContact O-N 3.08Å; R350-I364 HydrophobicContact CG-CD1 4.1Å
351	I	85	Confident	82.5	Confident	11 Å²	11	54.5 Å²	54.5	6%	0.056	27%	0.271	C	S	.	.	H	α-helix	trans	-57.4	-39.8	174.6	-71.7	166.6	0	0	0	112	L347 E349 L354 Q361 I364 I365 V368 P468	L347-I351 WeakPolarHBondContact O-CG1 3.15Å; L347-I351 PolarHBondContact O-N 3.31Å; E349-I351 VanDerWaalsContact C-N 3.28Å; E349-I351 PolarHBondContact O-N 3.15Å; I351-L354 PolarHBondContact O-N 3.01Å; I351-Q361 HydrophobicContact CG2-CG 4.2Å; I351-Q361 PolarHBondContact O-NE2 2.93Å; I351-I364 HydrophobicContact CD1-CG2 4.26Å; I351-I364 HydrophobicContact CG1-CB 4.49Å; I351-I364 HydrophobicContact CG1-CG2 3.73Å; I351-I365 HydrophobicContact CD1-CG1 3.88Å; I351-I365 HydrophobicContact CG1-CG1 4.13Å; I351-I365 HydrophobicContact CG2-CD1 4.27Å; I351-I365 HydrophobicContact CG2-CG1 4Å; I351-V368 HydrophobicContact CD1-CB 4.18Å; I351-V368 HydrophobicContact CD1-CG2 3.88Å; I351-P468 HydrophobicContact CD1-CB 4.08Å; I351-P468 HydrophobicContact CD1-CG 4.18Å
352	K	84.7	Confident	82.8	Confident	105 Å²	105	57.2 Å²	57.2	46%	0.457	28%	0.284	S	S	.	.	H	α-helix	trans	-72.2	-38.5	177.2	-62.3	171.5	-171.5	168.8	0	112.1	H348 E349 R350 L354 E355	H348-K352 PolarHBondContact CD2-NZ 2.8Å; H348-K352 WeakPolarHBondContact NE2-CE 3.2Å; H348-K352 PolarHBondContact NE2-NZ 3.49Å; E349-K352 PolarHBondContact O-N 2.99Å; E349-K352 VanDerWaalsContact O-N 3.09Å; R350-K352 VanDerWaalsContact C-N 3.29Å; R350-K352 PolarHBondContact O-N 2.91Å; K352-L354 PolarHBondContact O-N 3.04Å; K352-E355 WeakPolarHBondContact O-CG 3.22Å; K352-E355 PolarHBondContact O-N 3.01Å
353	R	84.4	Confident	83	Confident	166 Å²	166	53.8 Å²	53.8	63%	0.626	27%	0.268	S	S	*	.	H	α-helix	trans	-66.2	-18.6	175.5	-61.8	175.5	-163.2	-161.5	6.8	112.8	E349 R350	E349-R353 WeakPolarHBondContact O-CG 3.3Å; E349-R353 PolarHBondContact O-N 3.43Å; E349-R353 IonicContact OE2-CZ 3.33Å; E349-R353 IonicContact OE2-NE 2.75Å; E349-R353 IonicContact OE2-NH2 3.68Å; E349-R353 PolarHBondContact OE2-NH2 3.5Å; R350-R353 PolarHBondContact O-N 2.81Å
354	L	81	Confident	83	Confident	18 Å²	18	54 Å²	54	9%	0.094	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	12.5	-177.1	-72.7	175.8	0	0	0	115.3	E325 R350 I351 K352 G356 N357 Q361 I364	E325-L354 HydrophobicContact CG-CD2 4.15Å; R350-L354 HydrophobicContact CG-CD1 3.81Å; R350-L354 HydrophobicContact CG-CG 4.38Å; R350-L354 WeakPolarHBondContact O-CB 3.49Å; R350-L354 WeakPolarHBondContact O-CG 3.49Å; R350-L354 PolarHBondContact O-N 2.89Å; R350-L354 VanDerWaalsContact O-N 3.08Å; I351-L354 PolarHBondContact O-N 3.01Å; K352-L354 PolarHBondContact O-N 3.04Å; L354-G356 PolarHBondContact O-N 3.22Å; L354-N357 PolarHBondContact O-N 3.12Å; L354-Q361 HydrophobicContact CB-CB 4.29Å; L354-Q361 HydrophobicContact CB-CG 4.47Å; L354-I364 HydrophobicContact CD1-CD1 3.55Å
355	E	75.4	Confident	83.2	Confident	136 Å²	136	54.8 Å²	54.8	64%	0.636	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-17.4	178.4	-73.3	170.2	-161.2	0	0	114.6	K352	K352-E355 WeakPolarHBondContact O-CG 3.22Å; K352-E355 PolarHBondContact O-N 3.01Å
356	G	77.3	Confident	83.2	Confident	84 Å²	84	54.4 Å²	54.4	87%	0.866	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-17.4	172.7	0	0	0	0	0	116.2	L354	L354-G356 PolarHBondContact O-N 3.22Å
357	N	81.9	Confident	83.2	Confident	56 Å²	56	53.1 Å²	53.1	30%	0.299	27%	0.271	S	S	.	.			trans	-127.3	96.6	-177.6	-177.8	-9.4	0	0	0	110.9	L354 D359 A360 Q361	L354-N357 PolarHBondContact O-N 3.12Å; N357-D359 VanDerWaalsContact C-N 3.31Å; N357-D359 PolarHBondContact O-N 3.11Å; N357-D359 PolarHBondContact OD1-N 3.33Å; N357-A360 HydrophobicContact CB-CB 4.39Å; N357-A360 PolarHBondContact OD1-N 3.05Å; N357-Q361 WeakPolarHBondContact O-CB 3.35Å; N357-Q361 PolarHBondContact O-N 3.48Å
358	K	81.6	Confident	83.3	Confident	153 Å²	153	52.8 Å²	52.8	67%	0.665	27%	0.269	S	S	*	.	H	α-helix	trans	-61.4	-34.4	-173.4	-64.9	-177.3	179.3	180	0	114	Q362	K358-Q362 WeakPolarHBondContact O-CB 3.4Å; K358-Q362 VanDerWaalsContact O-CG 3.3Å; K358-Q362 WeakPolarHBondContact O-CG 3.45Å; K358-Q362 PolarHBondContact O-N 3.15Å
359	D	80.9	Confident	83.5	Confident	85 Å²	85	56.8 Å²	56.8	46%	0.455	28%	0.283	S	S	.	.	H	α-helix	trans	-80.2	-43.8	-170.4	-51	-22.1	0	0	0	109.7	N357 Q362 L363	N357-D359 VanDerWaalsContact C-N 3.31Å; N357-D359 PolarHBondContact O-N 3.11Å; N357-D359 PolarHBondContact OD1-N 3.33Å; D359-Q362 PolarHBondContact O-N 3.45Å; D359-L363 PolarHBondContact O-N 3.41Å; D359-L363 VanDerWaalsContact O-N 3.11Å
360	A	81.2	Confident	83.6	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-64.1	-38.9	169.5	0	0	0	0	0	112.1	V322 E325 N357 L363 I364	V322-A360 HydrophobicContact CG2-CB 4.43Å; E325-A360 HydrophobicContact CB-CB 4.44Å; E325-A360 HydrophobicContact CG-CB 4.39Å; N357-A360 HydrophobicContact CB-CB 4.39Å; N357-A360 PolarHBondContact OD1-N 3.05Å; A360-L363 PolarHBondContact O-N 2.91Å; A360-I364 PolarHBondContact O-N 2.89Å
361	Q	84.4	Confident	83.8	Confident	39 Å²	39	54.9 Å²	54.9	18%	0.182	27%	0.274	C	S	.	.	H	α-helix	trans	-64.7	-45.5	177.1	-166	-174.4	46.7	0	0	111.6	I351 L354 N357 L363 I364 I365	I351-Q361 HydrophobicContact CG2-CG 4.2Å; I351-Q361 PolarHBondContact O-NE2 2.93Å; L354-Q361 HydrophobicContact CB-CB 4.29Å; L354-Q361 HydrophobicContact CB-CG 4.47Å; N357-Q361 WeakPolarHBondContact O-CB 3.35Å; N357-Q361 PolarHBondContact O-N 3.48Å; Q361-L363 PolarHBondContact O-N 3.36Å; Q361-I364 PolarHBondContact O-N 3.34Å; Q361-I365 HydrophobicContact CG-CD1 3.96Å; Q361-I365 WeakPolarHBondContact O-CB 3.46Å; Q361-I365 WeakPolarHBondContact O-CD1 3.3Å; Q361-I365 WeakPolarHBondContact O-CG1 3.33Å; Q361-I365 PolarHBondContact O-N 3.29Å
362	Q	84.9	Confident	83.9	Confident	58 Å²	58	54.3 Å²	54.3	27%	0.271	27%	0.271	S	S	.	.	H	α-helix	trans	-60.9	-41.7	176.2	-80.2	-177.2	100.2	0	0	112.2	Y11 K358 D359 I365 G366	Y11-Q362 PolarHBondContact O-NE2 2.81Å; Y11-Q362 VanDerWaalsContact O-NE2 3.17Å; K358-Q362 WeakPolarHBondContact O-CB 3.4Å; K358-Q362 VanDerWaalsContact O-CG 3.3Å; K358-Q362 WeakPolarHBondContact O-CG 3.45Å; K358-Q362 PolarHBondContact O-N 3.15Å; D359-Q362 PolarHBondContact O-N 3.45Å; Q362-I365 WeakPolarHBondContact O-CB 3.48Å; Q362-I365 PolarHBondContact O-N 3.4Å; Q362-G366 PolarHBondContact O-N 2.93Å
363	L	83.7	Confident	84.1	Confident	8 Å²	8	56.8 Å²	56.8	4%	0.042	28%	0.282	C	S	.	.	H	α-helix	trans	-66.9	-43.6	179	-169.8	137.8	0	0	0	112.3	Y11 L287 V322 V326 D359 A360 Q361 G366 L367	Y11-L363 HydrophobicContact CD1-CB 4.06Å; Y11-L363 HydrophobicContact CD1-CD1 3.85Å; Y11-L363 HydrophobicContact CD1-CG 4.08Å; Y11-L363 HydrophobicContact CD2-CD1 4.46Å; Y11-L363 HydrophobicContact CE1-CB 4.31Å; Y11-L363 HydrophobicContact CE1-CD1 3.73Å; Y11-L363 HydrophobicContact CE1-CG 3.88Å; Y11-L363 HydrophobicContact CE2-CD1 4.36Å; Y11-L363 HydrophobicContact CG-CD1 4.22Å; L287-L363 HydrophobicContact CD1-CD1 3.83Å; L287-L363 HydrophobicContact CD2-CD2 4.21Å; V322-L363 HydrophobicContact CG1-CB 4.01Å; V322-L363 HydrophobicContact CG1-CD1 3.8Å; V322-L363 HydrophobicContact CG1-CD2 3.99Å; V322-L363 HydrophobicContact CG1-CG 4.14Å; V326-L363 HydrophobicContact CG2-CD2 3.5Å; V326-L363 VanDerWaalsContact CG2-CD2 3.5Å; D359-L363 PolarHBondContact O-N 3.41Å; D359-L363 VanDerWaalsContact O-N 3.11Å; A360-L363 PolarHBondContact O-N 2.91Å; Q361-L363 PolarHBondContact O-N 3.36Å; L363-G366 WeakPolarHBondContact O-CA 3.39Å; L363-G366 PolarHBondContact O-N 3.25Å; L363-G366 VanDerWaalsContact O-N 3.12Å; L363-L367 HydrophobicContact CD2-CD1 3.83Å; L363-L367 HydrophobicContact CD2-CG 4.22Å; L363-L367 PolarHBondContact O-N 3.47Å
364	I	84.8	Confident	84.3	Confident	4 Å²	4	49.6 Å²	49.6	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-69.1	-33.9	176.3	-68.8	172.7	0	0	0	111.5	E325 V326 R350 I351 L354 A360 Q361 G366 L367 V368	E325-I364 HydrophobicContact CB-CD1 4.45Å; V326-I364 HydrophobicContact CG2-CG1 4.37Å; R350-I364 HydrophobicContact CG-CD1 4.1Å; I351-I364 HydrophobicContact CD1-CG2 4.26Å; I351-I364 HydrophobicContact CG1-CB 4.49Å; I351-I364 HydrophobicContact CG1-CG2 3.73Å; L354-I364 HydrophobicContact CD1-CD1 3.55Å; A360-I364 PolarHBondContact O-N 2.89Å; Q361-I364 PolarHBondContact O-N 3.34Å; I364-G366 VanDerWaalsContact C-N 3.28Å; I364-G366 PolarHBondContact O-N 3.47Å; I364-L367 PolarHBondContact O-N 3.3Å; I364-V368 HydrophobicContact CG2-CG2 4.29Å; I364-V368 VanDerWaalsContact O-CG2 3.32Å; I364-V368 WeakPolarHBondContact O-CG2 3.25Å; I364-V368 PolarHBondContact O-N 2.69Å
365	I	87.1	Confident	84.6	Confident	18 Å²	18	48.7 Å²	48.7	9%	0.092	25%	0.252	C	S	.	.	H	α-helix	trans	-57	-43.2	168	-75.5	167.1	0	0	0	110.9	I351 Q361 Q362 V368 R369 P468 T469	I351-I365 HydrophobicContact CD1-CG1 3.88Å; I351-I365 HydrophobicContact CG1-CG1 4.13Å; I351-I365 HydrophobicContact CG2-CD1 4.27Å; I351-I365 HydrophobicContact CG2-CG1 4Å; Q361-I365 HydrophobicContact CG-CD1 3.96Å; Q361-I365 WeakPolarHBondContact O-CB 3.46Å; Q361-I365 WeakPolarHBondContact O-CD1 3.3Å; Q361-I365 WeakPolarHBondContact O-CG1 3.33Å; Q361-I365 PolarHBondContact O-N 3.29Å; Q362-I365 WeakPolarHBondContact O-CB 3.48Å; Q362-I365 PolarHBondContact O-N 3.4Å; I365-V368 PolarHBondContact O-N 2.75Å; I365-R369 WeakPolarHBondContact O-CB 3.45Å; I365-R369 PolarHBondContact O-N 3.33Å; I365-P468 HydrophobicContact CB-CG 4.11Å; I365-P468 HydrophobicContact CG1-CG 3.78Å; I365-P468 HydrophobicContact CG2-CG 3.69Å; I365-T469 HydrophobicContact CD1-CG2 3.9Å
366	G	85.9	Confident	85.2	Confident	20 Å²	20	42.5 Å²	42.5	21%	0.206	22%	0.223	C	C	.	.	H	α-helix	trans	-62.6	-46.2	175.5	0	0	0	0	0	113.4	Q362 L363 I364 R369 K370	Q362-G366 PolarHBondContact O-N 2.93Å; L363-G366 WeakPolarHBondContact O-CA 3.39Å; L363-G366 PolarHBondContact O-N 3.25Å; L363-G366 VanDerWaalsContact O-N 3.12Å; I364-G366 VanDerWaalsContact C-N 3.28Å; I364-G366 PolarHBondContact O-N 3.47Å; G366-R369 PolarHBondContact O-N 3.1Å; G366-K370 PolarHBondContact O-N 2.95Å
367	L	85.7	Confident	85.7	Confident	16 Å²	16	47.4 Å²	47.4	8%	0.084	22%	0.215	C	C	.	.	H	α-helix	trans	-60.5	-45.6	175.3	-68.1	175.5	0	0	0	111.5	L280 A283 L284 V326 L363 I364 K370 A371	L280-L367 HydrophobicContact CD1-CB 4.34Å; A283-L367 HydrophobicContact CB-CD2 3.82Å; L284-L367 HydrophobicContact CD2-CD1 4Å; L284-L367 HydrophobicContact CD2-CD2 3.99Å; L284-L367 HydrophobicContact CG-CD2 4.45Å; V326-L367 HydrophobicContact CG1-CD1 4.32Å; V326-L367 HydrophobicContact CG2-CD1 4.06Å; L363-L367 HydrophobicContact CD2-CD1 3.83Å; L363-L367 HydrophobicContact CD2-CG 4.22Å; L363-L367 PolarHBondContact O-N 3.47Å; I364-L367 PolarHBondContact O-N 3.3Å; L367-K370 PolarHBondContact O-N 3.1Å; L367-A371 WeakPolarHBondContact O-CB 3.47Å; L367-A371 PolarHBondContact O-N 2.81Å
368	V	87.6	Confident	85.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.7	-39.4	179.3	176	0	0	0	0	112	L347 I351 I364 I365 K370 A371 A372 F466	L347-V368 HydrophobicContact CB-CG2 3.42Å; L347-V368 VanDerWaalsContact CB-CG2 3.42Å; L347-V368 HydrophobicContact CD1-CG2 4.02Å; L347-V368 HydrophobicContact CG-CG2 4.27Å; I351-V368 HydrophobicContact CD1-CB 4.18Å; I351-V368 HydrophobicContact CD1-CG2 3.88Å; I364-V368 HydrophobicContact CG2-CG2 4.29Å; I364-V368 VanDerWaalsContact O-CG2 3.32Å; I364-V368 WeakPolarHBondContact O-CG2 3.25Å; I364-V368 PolarHBondContact O-N 2.69Å; I365-V368 PolarHBondContact O-N 2.75Å; V368-K370 PolarHBondContact O-N 2.88Å; V368-A371 PolarHBondContact O-N 3.18Å; V368-A372 WeakPolarHBondContact O-CB 3.26Å; V368-A372 PolarHBondContact O-N 3.14Å; V368-F466 HydrophobicContact CG1-CD1 4Å; V368-F466 HydrophobicContact CG1-CE1 3.6Å
369	R	87.9	Confident	86.3	Confident	106 Å²	106	37.9 Å²	37.9	40%	0.4	17%	0.172	S	C	.	.	H	α-helix	trans	-59.6	-37.1	175.1	-172.2	-175.4	-69.9	129.9	-9.7	111.5	I365 G366 D467	I365-R369 WeakPolarHBondContact O-CB 3.45Å; I365-R369 PolarHBondContact O-N 3.33Å; G366-R369 PolarHBondContact O-N 3.1Å; R369-D467 IonicContact CZ-OD1 3.79Å; R369-D467 VanDerWaalsContact CZ-OD1 3.28Å; R369-D467 IonicContact NE-OD1 2.76Å; R369-D467 PolarHBondContact NE-OD1 3.22Å; R369-D467 IonicContact NH2-OD1 2.68Å; R369-D467 PolarHBondContact NH2-OD1 2.99Å
370	K	86.5	Confident	86.6	Confident	68 Å²	68	36.2 Å²	36.2	30%	0.296	16%	0.161	S	C	.	.	H	α-helix	trans	-72.6	-50.3	175.2	-69	178.9	180	-178	0	112.1	A283 E286 G366 L367 V368 A372 K373	A283-K370 HydrophobicContact CB-CB 3.8Å; A283-K370 HydrophobicContact CB-CD 3.59Å; A283-K370 HydrophobicContact CB-CG 4.34Å; E286-K370 IonicContact OE1-NZ 3.38Å; E286-K370 PolarHBondContact OE1-NZ 3.34Å; E286-K370 IonicContact OE2-NZ 2.65Å; E286-K370 PolarHBondContact OE2-NZ 2.93Å; G366-K370 PolarHBondContact O-N 2.95Å; L367-K370 PolarHBondContact O-N 3.1Å; V368-K370 PolarHBondContact O-N 2.88Å; K370-A372 VanDerWaalsContact C-N 3.34Å; K370-A372 PolarHBondContact O-N 2.94Å; K370-K373 WeakPolarHBondContact O-CB 3.49Å; K370-K373 PolarHBondContact O-N 3.17Å; K370-K373 VanDerWaalsContact O-N 3.15Å
371	A	87.3	Confident	86.8	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-62.5	-35.4	179.8	0	0	0	0	0	113.5	V276 L280 L344 L367 V368 K373 P374	V276-A371 HydrophobicContact CG1-CB 4.32Å; L280-A371 HydrophobicContact CB-CB 3.93Å; L280-A371 HydrophobicContact CD1-CB 4.18Å; L344-A371 HydrophobicContact CD2-CB 4.21Å; L367-A371 WeakPolarHBondContact O-CB 3.47Å; L367-A371 PolarHBondContact O-N 2.81Å; V368-A371 PolarHBondContact O-N 3.18Å; A371-K373 VanDerWaalsContact C-N 3.28Å; A371-K373 PolarHBondContact O-N 3.49Å; A371-P374 VanDerWaalsContact O-CD 3.31Å; A371-P374 WeakPolarHBondContact O-CD 3.45Å; A371-P374 WeakPolarHBondContact O-CG 3.37Å
372	A	87.9	Confident	87.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-72.9	-16.4	177.8	0	0	0	0	0	113.6	L344 V368 K370 Y375 M376 F466	L344-A372 HydrophobicContact CD2-CB 4.06Å; V368-A372 WeakPolarHBondContact O-CB 3.26Å; V368-A372 PolarHBondContact O-N 3.14Å; K370-A372 VanDerWaalsContact C-N 3.34Å; K370-A372 PolarHBondContact O-N 2.94Å; A372-Y375 WeakPolarHBondContact O-CB 3.5Å; A372-Y375 PolarHBondContact O-N 3.15Å; A372-Y375 VanDerWaalsContact O-N 3.13Å; A372-M376 HydrophobicContact CB-CE 4.4Å; A372-M376 WeakPolarHBondContact O-CG 3.49Å; A372-M376 PolarHBondContact O-N 3.44Å; A372-F466 HydrophobicContact CB-CB 3.97Å; A372-F466 HydrophobicContact CB-CD1 3.96Å; A372-F466 HydrophobicContact CB-CG 4.15Å
373	K	88.4	Confident	87.2	Confident	157 Å²	157	34.4 Å²	34.4	68%	0.683	15%	0.153	S	C	*	.	H	α-helix	trans	-55.7	-48.9	-175.8	-169	178.7	-179.2	-178.3	0	114.6	K370 A371 Y375 M376 R377	K370-K373 WeakPolarHBondContact O-CB 3.49Å; K370-K373 PolarHBondContact O-N 3.17Å; K370-K373 VanDerWaalsContact O-N 3.15Å; A371-K373 VanDerWaalsContact C-N 3.28Å; A371-K373 PolarHBondContact O-N 3.49Å; K373-Y375 VanDerWaalsContact C-N 3.35Å; K373-Y375 PolarHBondContact O-N 3.15Å; K373-M376 PolarHBondContact O-N 3.02Å; K373-R377 WeakPolarHBondContact O-CB 3.41Å; K373-R377 PolarHBondContact O-N 2.97Å
374	P	87.9	Confident	87.2	Confident	14 Å²	14	35.2 Å²	35.2	9%	0.091	16%	0.157	C	C	.	.	H	α-helix	trans	-59.5	-42.6	172.6	22.5	-35.5	0	0	0	112.6	Q275 V276 A371 R377 M378	Q275-P374 HydrophobicContact CB-CB 3.89Å; Q275-P374 HydrophobicContact CB-CG 4.37Å; V276-P374 HydrophobicContact CG2-CG 4.27Å; A371-P374 VanDerWaalsContact O-CD 3.31Å; A371-P374 WeakPolarHBondContact O-CD 3.45Å; A371-P374 WeakPolarHBondContact O-CG 3.37Å; P374-R377 WeakPolarHBondContact O-CB 3.28Å; P374-R377 PolarHBondContact O-N 2.73Å; P374-M378 PolarHBondContact O-N 3Å
375	Y	88	Confident	87	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.7	-45.7	179.7	-163.3	-78.9	0	0	0	112	V276 A341 L344 A372 K373 R377 M378 L379 E394 L396 Q427 P429 L432	V276-Y375 HydrophobicContact CG2-CD2 4.27Å; A341-Y375 HydrophobicContact CB-CE2 4.36Å; L344-Y375 HydrophobicContact CD1-CD2 4.2Å; L344-Y375 HydrophobicContact CD1-CG 4.06Å; A372-Y375 WeakPolarHBondContact O-CB 3.5Å; A372-Y375 PolarHBondContact O-N 3.15Å; A372-Y375 VanDerWaalsContact O-N 3.13Å; K373-Y375 VanDerWaalsContact C-N 3.35Å; K373-Y375 PolarHBondContact O-N 3.15Å; Y375-R377 VanDerWaalsContact C-N 3.29Å; Y375-R377 PolarHBondContact O-N 2.91Å; Y375-M378 HydrophobicContact CD2-CE 4.39Å; Y375-M378 PolarHBondContact O-N 2.97Å; Y375-L379 WeakPolarHBondContact O-CB 3.34Å; Y375-L379 PolarHBondContact O-N 2.89Å; Y375-E394 WeakPolarHBondContact CE2-O 3.36Å; Y375-L396 HydrophobicContact CE1-CD2 4.4Å; Y375-L396 WeakPolarHBondContact OH-CB 3.44Å; Y375-L396 WeakPolarHBondContact OH-CD2 3.38Å; Y375-Q427 PolarHBondContact OH-O 2.98Å; Y375-Q427 VanDerWaalsContact OH-O 3.11Å; Y375-P429 HydrophobicContact CE1-CG 3.93Å; Y375-P429 HydrophobicContact CE2-CG 4.12Å; Y375-P429 WeakPolarHBondContact OH-CD 3.31Å; Y375-L432 HydrophobicContact CD1-CD1 4.46Å; Y375-L432 HydrophobicContact CE1-CD1 3.72Å
376	M	87.5	Confident	86.8	Confident	5 Å²	5	38.5 Å²	38.5	3%	0.025	17%	0.171	C	C	.	.	H	α-helix	trans	-64.1	-33.2	174.8	-64.7	-52.4	131.2	0	0	112.2	A372 K373 L379 Q380 F431 L464 F466	A372-M376 HydrophobicContact CB-CE 4.4Å; A372-M376 WeakPolarHBondContact O-CG 3.49Å; A372-M376 PolarHBondContact O-N 3.44Å; K373-M376 PolarHBondContact O-N 3.02Å; M376-L379 PolarHBondContact O-N 3.15Å; M376-L379 HydrophobicContact SD-CD2 4.12Å; M376-Q380 VanDerWaalsContact O-CB 3.26Å; M376-Q380 WeakPolarHBondContact O-CB 3.44Å; M376-Q380 PolarHBondContact O-N 3.26Å; M376-F431 HydrophobicContact CE-CE2 3.65Å; M376-F431 HydrophobicContact CE-CZ 3.76Å; M376-L464 HydrophobicContact CB-CD2 4.49Å; M376-L464 HydrophobicContact CB-CG 4.35Å; M376-L464 WeakPolarHBondContact CB-O 3.45Å; M376-L464 HydrophobicContact SD-CD2 4.23Å; M376-L464 HydrophobicContact SD-CG 4.2Å; M376-F466 HydrophobicContact CE-CB 4.17Å; M376-F466 HydrophobicContact CE-CD2 4.27Å; M376-F466 HydrophobicContact CE-CG 4.36Å; M376-F466 HydrophobicContact CG-CB 3.85Å; M376-F466 HydrophobicContact SD-CB 4.23Å
377	R	87.8	Confident	86.7	Confident	187 Å²	187	39.6 Å²	39.6	71%	0.706	17%	0.174	S	C	*	.	H	α-helix	trans	-66.8	-40.8	174.1	-172.9	-178.5	-178	-176.6	1.4	112.4	K373 P374 Y375 Q380 M381	K373-R377 WeakPolarHBondContact O-CB 3.41Å; K373-R377 PolarHBondContact O-N 2.97Å; P374-R377 WeakPolarHBondContact O-CB 3.28Å; P374-R377 PolarHBondContact O-N 2.73Å; Y375-R377 VanDerWaalsContact C-N 3.29Å; Y375-R377 PolarHBondContact O-N 2.91Å; R377-Q380 PolarHBondContact O-N 3.13Å; R377-M381 WeakPolarHBondContact O-CG 3.4Å; R377-M381 PolarHBondContact O-N 3.36Å; R377-M381 VanDerWaalsContact O-N 3.08Å
378	M	87.3	Confident	86.7	Confident	9 Å²	9	40.8 Å²	40.8	4%	0.044	18%	0.18	C	C	.	.	H	α-helix	trans	-62.4	-46.5	172	-69.9	-171.7	-77.2	0	0	110.7	P374 Y375 Q380 M381 W382 E394 F395	P374-M378 PolarHBondContact O-N 3Å; Y375-M378 HydrophobicContact CD2-CE 4.39Å; Y375-M378 PolarHBondContact O-N 2.97Å; M378-Q380 PolarHBondContact O-N 3.45Å; M378-M381 PolarHBondContact O-N 3.42Å; M378-W382 PolarHBondContact O-N 3.37Å; M378-E394 HydrophobicContact CE-CB 4.09Å; M378-F395 HydrophobicContact CB-CD2 3.94Å; M378-F395 HydrophobicContact CB-CE2 4.3Å; M378-F395 HydrophobicContact SD-CB 4.42Å
379	L	88.6	Confident	86.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-40.6	177.3	-174.8	54.6	0	0	0	112.7	Y375 M376 W382 I383 F395 L396 L432 I439 L464 I477	Y375-L379 WeakPolarHBondContact O-CB 3.34Å; Y375-L379 PolarHBondContact O-N 2.89Å; M376-L379 PolarHBondContact O-N 3.15Å; M376-L379 HydrophobicContact SD-CD2 4.12Å; L379-W382 PolarHBondContact O-N 3.48Å; L379-I383 HydrophobicContact CD1-CD1 3.63Å; L379-I383 HydrophobicContact CD1-CG1 4.05Å; L379-I383 HydrophobicContact CG-CD1 3.84Å; L379-I383 VanDerWaalsContact O-CB 3.3Å; L379-I383 WeakPolarHBondContact O-CB 3.4Å; L379-I383 WeakPolarHBondContact O-CG1 3.42Å; L379-I383 PolarHBondContact O-N 2.94Å; L379-F395 HydrophobicContact CB-CE2 4.03Å; L379-F395 HydrophobicContact CD1-CE2 4.06Å; L379-F395 HydrophobicContact CD1-CZ 4.04Å; L379-L396 HydrophobicContact CD1-CD2 4.46Å; L379-L432 HydrophobicContact CD2-CD1 3.79Å; L379-L432 HydrophobicContact CD2-CD2 4.34Å; L379-I439 HydrophobicContact CD1-CD1 4.16Å; L379-I439 HydrophobicContact CD1-CG1 4.31Å; L379-I439 HydrophobicContact CD1-CG2 3.44Å; L379-I439 VanDerWaalsContact CD1-CG2 3.44Å; L379-L464 HydrophobicContact CB-CD2 4.02Å; L379-L464 HydrophobicContact CD2-CD2 3.86Å; L379-L464 HydrophobicContact CG-CD2 3.74Å; L379-I477 HydrophobicContact CD2-CD1 4.47Å
380	Q	87.8	Confident	86	Confident	50 Å²	50	41.3 Å²	41.3	23%	0.234	19%	0.193	C	C	.	.	H	α-helix	trans	-64.2	-43	175.3	-176.3	-176.7	-8.1	0	0	111.8	M376 R377 M378 W382 I383 Q384 M462 L464	M376-Q380 VanDerWaalsContact O-CB 3.26Å; M376-Q380 WeakPolarHBondContact O-CB 3.44Å; M376-Q380 PolarHBondContact O-N 3.26Å; R377-Q380 PolarHBondContact O-N 3.13Å; M378-Q380 PolarHBondContact O-N 3.45Å; Q380-W382 VanDerWaalsContact C-N 3.32Å; Q380-W382 PolarHBondContact O-N 3.24Å; Q380-I383 PolarHBondContact O-N 3.43Å; Q380-Q384 VanDerWaalsContact CG-CD 3.43Å; Q380-Q384 HydrophobicContact CG-CG 4.19Å; Q380-Q384 VanDerWaalsContact CG-OE1 3.29Å; Q380-Q384 VanDerWaalsContact O-CB 3.31Å; Q380-Q384 WeakPolarHBondContact O-CB 3.47Å; Q380-Q384 PolarHBondContact O-N 3.2Å; Q380-M462 PolarHBondContact NE2-O 3.1Å; Q380-L464 HydrophobicContact CB-CB 4.33Å; Q380-L464 HydrophobicContact CB-CD2 4.43Å
381	M	86.4	Confident	85.6	Confident	52 Å²	52	48 Å²	48	26%	0.256	22%	0.217	S	C	.	.	H	α-helix	trans	-64.6	-36.2	177.4	-74.2	-69.7	-67.2	0	0	112.3	R377 M378 K385 G386 V387 V389	R377-M381 WeakPolarHBondContact O-CG 3.4Å; R377-M381 PolarHBondContact O-N 3.36Å; R377-M381 VanDerWaalsContact O-N 3.08Å; M378-M381 PolarHBondContact O-N 3.42Å; M381-K385 HydrophobicContact CE-CD 4.14Å; M381-K385 CarbonylContact O-C 3.56Å; M381-K385 WeakPolarHBondContact O-CA 3.41Å; M381-K385 WeakPolarHBondContact O-CB 3.28Å; M381-K385 PolarHBondContact O-N 3.02Å; M381-K385 VanDerWaalsContact O-N 3.12Å; M381-K385 HydrophobicContact SD-CD 3.93Å; M381-G386 PolarHBondContact O-N 2.95Å; M381-V387 CarbonylContact C-O 3.59Å; M381-V387 HydrophobicContact CE-CB 4.32Å; M381-V387 PolarHBondContact O-N 3.39Å; M381-V389 HydrophobicContact CE-CG2 4.43Å
382	W	89.7	Confident	85	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-67.1	-51.5	171.7	179.4	-111.5	0	0	0	111.8	M378 L379 Q380 Q384 G386 V387 I388 F395 V397 Y421 I439 G443 N447	M378-W382 PolarHBondContact O-N 3.37Å; L379-W382 PolarHBondContact O-N 3.48Å; Q380-W382 VanDerWaalsContact C-N 3.32Å; Q380-W382 PolarHBondContact O-N 3.24Å; W382-Q384 PolarHBondContact O-N 2.92Å; W382-G386 WeakPolarHBondContact CZ3-O 3.42Å; W382-G386 VanDerWaalsContact O-CA 3.25Å; W382-G386 WeakPolarHBondContact O-CA 3.37Å; W382-G386 PolarHBondContact O-N 3.18Å; W382-V387 PolarHBondContact N-O 3.25Å; W382-I388 HydrophobicContact CD2-CG1 4.23Å; W382-I388 HydrophobicContact CE3-CD1 3.93Å; W382-I388 HydrophobicContact CE3-CG1 3.34Å; W382-I388 HydrophobicContact CH2-CD1 4.31Å; W382-I388 HydrophobicContact CZ3-CD1 3.72Å; W382-I388 HydrophobicContact CZ3-CG1 3.54Å; W382-F395 HydrophobicContact CB-CE1 3.95Å; W382-F395 HydrophobicContact CB-CZ 3.77Å; W382-F395 AromaticContact CD1-CZ 3.97Å; W382-F395 HydrophobicContact CD2-CE1 4.27Å; W382-F395 AromaticContact CG-CE1 3.85Å; W382-F395 HydrophobicContact CG-CE1 3.85Å; W382-F395 AromaticContact CG-CZ 3.89Å; W382-F395 HydrophobicContact CG-CZ 3.89Å; W382-V397 HydrophobicContact CH2-CG1 4.08Å; W382-V397 HydrophobicContact CZ2-CB 4.48Å; W382-V397 HydrophobicContact CZ2-CG1 3.9Å; W382-V397 HydrophobicContact CZ2-CG2 4.19Å; W382-Y421 AromaticContact CH2-CD1 3.51Å; W382-Y421 HydrophobicContact CH2-CD1 3.51Å; W382-Y421 HydrophobicContact CH2-CD2 4.43Å; W382-Y421 AromaticContact CH2-CE1 3.7Å; W382-Y421 HydrophobicContact CH2-CE1 3.7Å; W382-Y421 AromaticContact CH2-CG 3.91Å; W382-Y421 HydrophobicContact CH2-CG 3.91Å; W382-Y421 HydrophobicContact CZ2-CD1 4.48Å; W382-Y421 HydrophobicContact CZ3-CD1 4.02Å; W382-Y421 AromaticContact CZ3-CE1 3.8Å; W382-Y421 HydrophobicContact CZ3-CE1 3.8Å; W382-I439 PolarHBondContact NE1-O 3.41Å; W382-G443 VanDerWaalsContact CE2-CA 3.49Å; W382-G443 VanDerWaalsContact CZ2-CA 3.46Å; W382-N447 WeakPolarHBondContact CZ3-ND2 3.48Å
383	I	87.6	Confident	84.7	Confident	8 Å²	8	62 Å²	62	4%	0.041	27%	0.273	C	S	.	.	H	α-helix	trans	-70.2	-31.2	-175	-73.9	-179.4	0	0	0	113.9	L379 Q380 I439 T442 L446 I477 A480	L379-I383 HydrophobicContact CD1-CD1 3.63Å; L379-I383 HydrophobicContact CD1-CG1 4.05Å; L379-I383 HydrophobicContact CG-CD1 3.84Å; L379-I383 VanDerWaalsContact O-CB 3.3Å; L379-I383 WeakPolarHBondContact O-CB 3.4Å; L379-I383 WeakPolarHBondContact O-CG1 3.42Å; L379-I383 PolarHBondContact O-N 2.94Å; Q380-I383 PolarHBondContact O-N 3.43Å; I383-I439 HydrophobicContact CD1-CG1 4.34Å; I383-I439 HydrophobicContact CD1-CG2 4.5Å; I383-T442 HydrophobicContact CG2-CG2 4.33Å; I383-L446 WeakPolarHBondContact O-CD1 3.46Å; I383-I477 HydrophobicContact CD1-CG1 3.84Å; I383-I477 HydrophobicContact CD1-CG2 4.45Å; I383-A480 HydrophobicContact CG2-CB 3.26Å
384	Q	83.9	Confident	84.4	Confident	25 Å²	25	54.5 Å²	54.5	12%	0.117	24%	0.241	C	C	.	.	H	α-helix	trans	-97.5	-24.3	-179.1	-67.7	176.1	-10.5	0	0	113.9	Q380 W382 V456 M462	Q380-Q384 VanDerWaalsContact CG-CD 3.43Å; Q380-Q384 HydrophobicContact CG-CG 4.19Å; Q380-Q384 VanDerWaalsContact CG-OE1 3.29Å; Q380-Q384 VanDerWaalsContact O-CB 3.31Å; Q380-Q384 WeakPolarHBondContact O-CB 3.47Å; Q380-Q384 PolarHBondContact O-N 3.2Å; W382-Q384 PolarHBondContact O-N 2.92Å; Q384-V456 WeakPolarHBondContact O-CG1 3.17Å; Q384-M462 PolarHBondContact NE2-O 3.5Å
385	K	80.3	Confident	84.3	Confident	89 Å²	89	54 Å²	54	39%	0.387	24%	0.237	S	C	.	.	H	α-helix	trans	-135.9	-5.6	-169.2	-58.3	173.4	-173.2	163.9	0	114.3	M381 V387 R450	M381-K385 HydrophobicContact CE-CD 4.14Å; M381-K385 CarbonylContact O-C 3.56Å; M381-K385 WeakPolarHBondContact O-CA 3.41Å; M381-K385 WeakPolarHBondContact O-CB 3.28Å; M381-K385 PolarHBondContact O-N 3.02Å; M381-K385 VanDerWaalsContact O-N 3.12Å; M381-K385 HydrophobicContact SD-CD 3.93Å; K385-V387 HydrophobicContact CB-CG2 4.08Å; K385-V387 PolarHBondContact O-N 3.29Å; K385-R450 VanDerWaalsContact O-CD 3.25Å; K385-R450 WeakPolarHBondContact O-CD 3.29Å; K385-R450 PolarHBondContact O-NH1 3.08Å
386	G	83.1	Confident	84.2	Confident	3 Å²	3	54 Å²	54	3%	0.031	24%	0.237	C	C	.	.			trans	68.8	8.3	-174.2	0	0	0	0	0	114.8	M381 W382 N447	M381-G386 PolarHBondContact O-N 2.95Å; W382-G386 WeakPolarHBondContact CZ3-O 3.42Å; W382-G386 VanDerWaalsContact O-CA 3.25Å; W382-G386 WeakPolarHBondContact O-CA 3.37Å; W382-G386 PolarHBondContact O-N 3.18Å; G386-N447 WeakPolarHBondContact CA-OD1 3.39Å; G386-N447 PolarHBondContact O-ND2 3.29Å; G386-N447 PolarHBondContact O-OD1 3.09Å; G386-N447 VanDerWaalsContact O-OD1 3.06Å
387	V	84.1	Confident	84.2	Confident	43 Å²	43	53.7 Å²	53.7	26%	0.261	24%	0.236	S	C	.	.			trans	-95.9	121.3	-173.7	-173.2	0	0	0	0	110.5	M381 W382 K385 V389	M381-V387 CarbonylContact C-O 3.59Å; M381-V387 HydrophobicContact CE-CB 4.32Å; M381-V387 PolarHBondContact O-N 3.39Å; W382-V387 PolarHBondContact N-O 3.25Å; K385-V387 HydrophobicContact CB-CG2 4.08Å; K385-V387 PolarHBondContact O-N 3.29Å; V387-V389 HydrophobicContact CG1-CG2 3.84Å
388	I	85.1	Confident	84.1	Confident	40 Å²	40	46.2 Å²	46.2	21%	0.205	21%	0.211	C	C	.	.			trans	-84.9	133.7	166.6	-54.6	-175.1	0	0	0	108.5	W382 D390 F395 V397 D399 Y421	W382-I388 HydrophobicContact CD2-CG1 4.23Å; W382-I388 HydrophobicContact CE3-CD1 3.93Å; W382-I388 HydrophobicContact CE3-CG1 3.34Å; W382-I388 HydrophobicContact CH2-CD1 4.31Å; W382-I388 HydrophobicContact CZ3-CD1 3.72Å; W382-I388 HydrophobicContact CZ3-CG1 3.54Å; I388-D390 HydrophobicContact CG2-CB 3.7Å; I388-F395 HydrophobicContact CG1-CD1 4.49Å; I388-F395 HydrophobicContact CG1-CE1 4.5Å; I388-F395 HydrophobicContact CG2-CD1 4.12Å; I388-V397 HydrophobicContact CD1-CB 3.94Å; I388-V397 HydrophobicContact CD1-CG1 3.75Å; I388-D399 HydrophobicContact CD1-CB 4.26Å; I388-Y421 HydrophobicContact CD1-CD1 4.15Å; I388-Y421 HydrophobicContact CD1-CE1 4.12Å
389	V	79.4	Confident	83.8	Confident	84 Å²	84	48 Å²	48	51%	0.509	22%	0.221	S	C	.	.			trans	-130.3	68.4	176	-170.9	0	0	0	0	108.2	M381 V387	M381-V389 HydrophobicContact CE-CG2 4.43Å; V387-V389 HydrophobicContact CG1-CG2 3.84Å
390	D	81.3	Confident	83.2	Confident	33 Å²	33	50.5 Å²	50.5	18%	0.176	23%	0.234	C	C	.	.			trans	-118.5	94.7	-171.5	-178.7	10.6	0	0	0	110.6	I388 H392 R393 E394 F395 R424	I388-D390 HydrophobicContact CG2-CB 3.7Å; D390-H392 PolarHBondContact OD1-N 2.69Å; D390-R393 WeakPolarHBondContact OD1-CA 3.36Å; D390-R393 PolarHBondContact OD1-N 2.84Å; D390-R393 VanDerWaalsContact OD2-CA 3.3Å; D390-R393 WeakPolarHBondContact OD2-CA 3.38Å; D390-E394 PolarHBondContact OD1-N 3.46Å; D390-E394 PolarHBondContact OD2-N 2.9Å; D390-F395 HydrophobicContact CB-CB 4.07Å; D390-F395 PolarHBondContact OD2-N 2.99Å; D390-F395 VanDerWaalsContact OD2-N 3.09Å; D390-R424 IonicContact OD2-CZ 2.69Å; D390-R424 IonicContact OD2-NH1 3.89Å; D390-R424 PolarHBondContact OD2-NH1 3.26Å; D390-R424 IonicContact OD2-NH2 2.75Å; D390-R424 PolarHBondContact OD2-NH2 2.85Å
391	R	78.3	Confident	82	Confident	210 Å²	210	54 Å²	54	79%	0.792	25%	0.251	S	S	*	.	S	Bend	trans	-81.2	-25.9	179.4	178.9	174.4	-179.5	168.2	0.4	113.2
392	H	75.3	Confident	80.3	Confident	94 Å²	94	57.5 Å²	57.5	44%	0.435	27%	0.274	S	S	.	.	S	Bend	trans	-109.6	-7.6	-167.6	-70	-97.1	0	0	0	113.7	D390 E394	D390-H392 PolarHBondContact OD1-N 2.69Å; H392-E394 HydrophobicContact CB-CG 3.91Å; H392-E394 WeakPolarHBondContact CB-OE1 3.3Å; H392-E394 IonicContact CD2-OE1 3.11Å; H392-E394 IonicContact CG-OE1 3.83Å
393	R	80.9	Confident	78.5	Confident	198 Å²	198	59.6 Å²	59.6	75%	0.747	29%	0.285	S	S	*	.	S	Bend	trans	73	43.3	-174.7	-55.2	-179.3	176.5	-174.9	-2.8	113.6	D390 R424	D390-R393 WeakPolarHBondContact OD1-CA 3.36Å; D390-R393 PolarHBondContact OD1-N 2.84Å; D390-R393 VanDerWaalsContact OD2-CA 3.3Å; D390-R393 WeakPolarHBondContact OD2-CA 3.38Å; R393-R424 VanDerWaalsContact CA-NH1 3.31Å; R393-R424 PolarHBondContact O-NH1 3.4Å
394	E	82.3	Confident	76.6	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.005	31%	0.307	C	S	.	.			trans	-93.4	-25.2	179.8	-63.5	171.1	-127	0	0	113.9	Q275 V276 D340 Y375 M378 D390 H392	Q275-E394 WeakPolarHBondContact CB-OE1 3.4Å; Q275-E394 WeakPolarHBondContact CB-OE2 3.27Å; Q275-E394 WeakPolarHBondContact CG-OE1 3.45Å; Q275-E394 VanDerWaalsContact N-CD 3.25Å; Q275-E394 PolarHBondContact N-OE1 3.35Å; Q275-E394 PolarHBondContact N-OE2 3.05Å; Q275-E394 PolarHBondContact NE2-OE1 3.3Å; V276-E394 PolarHBondContact N-OE2 3.49Å; D340-E394 HydrophobicContact CB-CB 4.43Å; D340-E394 HydrophobicContact CB-CG 4.08Å; Y375-E394 WeakPolarHBondContact CE2-O 3.36Å; M378-E394 HydrophobicContact CE-CB 4.09Å; D390-E394 PolarHBondContact OD1-N 3.46Å; D390-E394 PolarHBondContact OD2-N 2.9Å; H392-E394 HydrophobicContact CB-CG 3.91Å; H392-E394 WeakPolarHBondContact CB-OE1 3.3Å; H392-E394 IonicContact CD2-OE1 3.11Å; H392-E394 IonicContact CG-OE1 3.83Å
395	F	85.1	Confident	75	Confident	2 Å²	2	70.7 Å²	70.7	1%	0.009	33%	0.33	C	S	.	.	S	Bend	trans	-81.2	149.1	-170.2	-169.5	-122.7	0	0	0	113.4	M378 L379 W382 I388 D390 V397 R424	M378-F395 HydrophobicContact CB-CD2 3.94Å; M378-F395 HydrophobicContact CB-CE2 4.3Å; M378-F395 HydrophobicContact SD-CB 4.42Å; L379-F395 HydrophobicContact CB-CE2 4.03Å; L379-F395 HydrophobicContact CD1-CE2 4.06Å; L379-F395 HydrophobicContact CD1-CZ 4.04Å; W382-F395 HydrophobicContact CB-CE1 3.95Å; W382-F395 HydrophobicContact CB-CZ 3.77Å; W382-F395 AromaticContact CD1-CZ 3.97Å; W382-F395 HydrophobicContact CD2-CE1 4.27Å; W382-F395 AromaticContact CG-CE1 3.85Å; W382-F395 HydrophobicContact CG-CE1 3.85Å; W382-F395 AromaticContact CG-CZ 3.89Å; W382-F395 HydrophobicContact CG-CZ 3.89Å; I388-F395 HydrophobicContact CG1-CD1 4.49Å; I388-F395 HydrophobicContact CG1-CE1 4.5Å; I388-F395 HydrophobicContact CG2-CD1 4.12Å; D390-F395 HydrophobicContact CB-CB 4.07Å; D390-F395 PolarHBondContact OD2-N 2.99Å; D390-F395 VanDerWaalsContact OD2-N 3.09Å; F395-V397 HydrophobicContact CD1-CB 3.86Å; F395-V397 HydrophobicContact CD1-CG2 4.28Å; F395-V397 HydrophobicContact CE1-CB 3.71Å; F395-V397 HydrophobicContact CE1-CG2 3.7Å; F395-V397 HydrophobicContact CZ-CG2 4.36Å; F395-V397 PolarHBondContact O-N 2.95Å; F395-R424 PolarHBondContact O-NH1 3.38Å
396	L	86.4	Confident	73.4	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	35%	0.35	C	S	.	.	S	Bend	trans	-65.5	-19.3	-178	69.1	100.1	0	0	0	114.6	Y375 L379 L423 R424 I428 L432 I439	Y375-L396 HydrophobicContact CE1-CD2 4.4Å; Y375-L396 WeakPolarHBondContact OH-CB 3.44Å; Y375-L396 WeakPolarHBondContact OH-CD2 3.38Å; L379-L396 HydrophobicContact CD1-CD2 4.46Å; L396-L423 HydrophobicContact CD1-CD2 3.49Å; L396-L423 VanDerWaalsContact CD1-CD2 3.49Å; L396-L423 CarbonylContact O-C 3.44Å; L396-L423 VanDerWaalsContact O-CA 3.32Å; L396-L423 WeakPolarHBondContact O-CA 3.34Å; L396-R424 PolarHBondContact O-N 3.25Å; L396-I428 HydrophobicContact CB-CG1 4.22Å; L396-L432 HydrophobicContact CD2-CD1 4.29Å; L396-I439 HydrophobicContact CD1-CG2 4.13Å; L396-I439 HydrophobicContact CD2-CD1 4.42Å; L396-I439 HydrophobicContact CD2-CG2 4.32Å
397	V	87.1	Confident	71.7	Confident	0 Å²	0	80.7 Å²	80.7	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135.2	178.2	-172	0	0	0	0	110.7	W382 I388 F395 Y421 L440	W382-V397 HydrophobicContact CH2-CG1 4.08Å; W382-V397 HydrophobicContact CZ2-CB 4.48Å; W382-V397 HydrophobicContact CZ2-CG1 3.9Å; W382-V397 HydrophobicContact CZ2-CG2 4.19Å; I388-V397 HydrophobicContact CD1-CB 3.94Å; I388-V397 HydrophobicContact CD1-CG1 3.75Å; F395-V397 HydrophobicContact CD1-CB 3.86Å; F395-V397 HydrophobicContact CD1-CG2 4.28Å; F395-V397 HydrophobicContact CE1-CB 3.71Å; F395-V397 HydrophobicContact CE1-CG2 3.7Å; F395-V397 HydrophobicContact CZ-CG2 4.36Å; F395-V397 PolarHBondContact O-N 2.95Å; V397-Y421 HydrophobicContact CG1-CD1 3.95Å; V397-Y421 HydrophobicContact CG1-CG 4.46Å; V397-L440 HydrophobicContact CB-CD1 4.41Å; V397-L440 HydrophobicContact CG1-CD1 3.66Å; V397-L440 HydrophobicContact CG2-CD1 3.92Å
398	V	85.3	Confident	70	Confident	29 Å²	29	80.9 Å²	80.9	18%	0.176	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	144.2	167.1	-153.6	0	0	0	0	110	N400 Y421 T422 R424	V398-N400 VanDerWaalsContact CG1-OD1 3.24Å; V398-N400 WeakPolarHBondContact CG1-OD1 3.29Å; V398-Y421 WeakPolarHBondContact O-CA 3.43Å; V398-Y421 WeakPolarHBondContact O-CD1 3.23Å; V398-T422 PolarHBondContact N-O 3.42Å; V398-R424 HydrophobicContact CG2-CG 3.49Å; V398-R424 VanDerWaalsContact CG2-CG 3.49Å
399	D	81.5	Confident	68.4	Low	47 Å²	47	82.5 Å²	82.5	25%	0.251	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	108.9	156.3	-157.4	-23.8	0	0	0	108.6	I388 E401 R420 Y421	I388-D399 HydrophobicContact CD1-CB 4.26Å; D399-E401 HydrophobicContact CB-CG 4.15Å; D399-E401 VanDerWaalsContact CG-CG 3.5Å; D399-E401 PolarHBondContact O-N 2.95Å; D399-E401 VanDerWaalsContact O-N 3.1Å; D399-E401 VanDerWaalsContact OD1-CG 3.3Å; D399-E401 WeakPolarHBondContact OD1-CG 3.47Å; D399-R420 WeakPolarHBondContact OD1-CG 3.25Å; D399-R420 IonicContact OD1-CZ 3.99Å; D399-R420 IonicContact OD1-NE 3.67Å; D399-R420 PolarHBondContact OD1-NE 2.97Å; D399-R420 IonicContact OD1-NH2 2.68Å; D399-R420 PolarHBondContact OD1-NH2 2.77Å; D399-R420 IonicContact OD2-CZ 2.68Å; D399-R420 IonicContact OD2-NE 3.72Å; D399-R420 PolarHBondContact OD2-NE 3.5Å; D399-R420 IonicContact OD2-NH2 2.68Å; D399-R420 PolarHBondContact OD2-NH2 3.32Å; D399-Y421 HydrophobicContact CB-CD1 4.2Å; D399-Y421 HydrophobicContact CB-CE1 3.71Å; D399-Y421 WeakPolarHBondContact OD2-CE1 3.22Å; D399-Y421 PolarHBondContact OD2-OH 3.22Å
400	N	76.1	Confident	67	Low	52 Å²	52	87 Å²	87	28%	0.278	41%	0.41	S	S	.	.			trans	-85.9	58.4	179.9	-62	-43.4	0	0	0	110.1	V398 V402 I403 R419 R420 T422	V398-N400 VanDerWaalsContact CG1-OD1 3.24Å; V398-N400 WeakPolarHBondContact CG1-OD1 3.29Å; N400-V402 PolarHBondContact O-N 3.43Å; N400-I403 PolarHBondContact O-N 3.47Å; N400-I403 VanDerWaalsContact O-N 3.15Å; N400-R419 PolarHBondContact ND2-O 2.9Å; N400-R420 PolarHBondContact N-O 3.2Å; N400-T422 PolarHBondContact ND2-OG1 3.48Å
401	E	63.1	Low	65.3	Low	125 Å²	125	91.7 Å²	91.7	58%	0.584	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-10.3	-176.2	-63.8	-157.4	123	0	0	114.7	D399 I403 R420	D399-E401 HydrophobicContact CB-CG 4.15Å; D399-E401 VanDerWaalsContact CG-CG 3.5Å; D399-E401 PolarHBondContact O-N 2.95Å; D399-E401 VanDerWaalsContact O-N 3.1Å; D399-E401 VanDerWaalsContact OD1-CG 3.3Å; D399-E401 WeakPolarHBondContact OD1-CG 3.47Å; E401-I403 PolarHBondContact O-N 3.42Å; E401-R420 IonicContact OE1-CZ 2.64Å; E401-R420 IonicContact OE1-NH2 3.28Å; E401-R420 PolarHBondContact OE1-NH2 2.99Å
402	V	51.1	Low	64	Low	125 Å²	125	86.7 Å²	86.7	76%	0.758	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.3	172.3	-173.9	0	0	0	0	112	N400 H404	N400-V402 PolarHBondContact O-N 3.43Å; V402-H404 VanDerWaalsContact C-N 3.32Å; V402-H404 PolarHBondContact O-N 2.98Å
403	I	51.3	Low	63.1	Low	44 Å²	44	83.5 Å²	83.5	23%	0.226	40%	0.401	C	S	.	.	S	Bend	trans	-76.4	86.7	167.4	-52.6	177.4	0	0	0	108.3	N400 E401 L408 Y416 R419	N400-I403 PolarHBondContact O-N 3.47Å; N400-I403 VanDerWaalsContact O-N 3.15Å; E401-I403 PolarHBondContact O-N 3.42Å; I403-L408 HydrophobicContact CG2-CD1 3.57Å; I403-L408 HydrophobicContact CG2-CG 4.1Å; I403-Y416 HydrophobicContact CG2-CD2 3.87Å; I403-Y416 HydrophobicContact CG2-CE2 4.21Å; I403-Y416 WeakPolarHBondContact O-CE2 3.43Å; I403-R419 HydrophobicContact CD1-CB 3.62Å
404	H	48.1	Very low	61.9	Low	107 Å²	107	75.6 Å²	75.6	50%	0.495	37%	0.373	S	S	.	.			trans	-63.6	142.3	173.7	-70.4	-70.8	0	0	0	110.8	V402 D406 E407	V402-H404 VanDerWaalsContact C-N 3.32Å; V402-H404 PolarHBondContact O-N 2.98Å; H404-D406 PolarHBondContact O-N 3.32Å; H404-D406 VanDerWaalsContact O-N 3.1Å; H404-E407 HydrophobicContact CB-CG 4.41Å; H404-E407 PolarHBondContact O-N 2.89Å
405	R	50.5	Low	60.9	Low	158 Å²	158	77 Å²	77	60%	0.596	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-24.3	175.3	-84.3	-174.4	171.1	-167.1	-3.2	112.7
406	D	45.8	Very low	60	Low	151 Å²	151	77.9 Å²	77.9	81%	0.807	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-8.4	-173.9	-44.3	-59.2	0	0	0	113.5	H404	H404-D406 PolarHBondContact O-N 3.32Å; H404-D406 VanDerWaalsContact O-N 3.1Å
407	E	47.9	Very low	59.2	Low	151 Å²	151	78.6 Å²	78.6	71%	0.706	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-15.7	177.6	-66.9	-169.5	164.2	0	0	113.7	H404	H404-E407 HydrophobicContact CB-CG 4.41Å; H404-E407 PolarHBondContact O-N 2.89Å
408	L	47.7	Very low	58.4	Low	48 Å²	48	84.9 Å²	84.9	25%	0.251	42%	0.416	S	S	.	.	S	Bend	trans	-101	132.3	172.9	-75	175.6	0	0	0	110.4	I403 Y416	I403-L408 HydrophobicContact CG2-CD1 3.57Å; I403-L408 HydrophobicContact CG2-CG 4.1Å; L408-Y416 HydrophobicContact CD1-CD2 3.94Å; L408-Y416 HydrophobicContact CD1-CG 4.41Å
409	P	51.6	Low	57.8	Low	73 Å²	73	89.7 Å²	89.7	47%	0.474	43%	0.431	S	S	.	.			trans	-59.7	145.3	167.8	-18.2	30	0	0	0	110.6	H411 Y412	P409-H411 PolarHBondContact O-N 3.4Å; P409-Y412 HydrophobicContact CB-CD2 4.13Å; P409-Y412 HydrophobicContact CG-CD2 4.07Å; P409-Y412 HydrophobicContact CG-CE2 4.47Å; P409-Y412 PolarHBondContact O-N 2.91Å
410	E	50	Low	57.5	Low	180 Å²	180	88.7 Å²	88.7	84%	0.841	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-55.2	-26.3	-173.1	-63.1	176.7	121.1	0	0	113.5	Y412	E410-Y412 VanDerWaalsContact C-N 3.29Å; E410-Y412 PolarHBondContact O-N 3.02Å
411	H	46.1	Very low	57.9	Low	131 Å²	131	86.6 Å²	86.6	61%	0.606	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-68.8	-15.5	176.1	-47	-48.1	0	0	0	115	P409	P409-H411 PolarHBondContact O-N 3.4Å
412	Y	52	Low	58.9	Low	104 Å²	104	83 Å²	83	41%	0.408	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-98	28.3	-178.7	-74.5	-83	0	0	0	113.9	P409 E410 D414 Y416 H615	P409-Y412 HydrophobicContact CB-CD2 4.13Å; P409-Y412 HydrophobicContact CG-CD2 4.07Å; P409-Y412 HydrophobicContact CG-CE2 4.47Å; P409-Y412 PolarHBondContact O-N 2.91Å; E410-Y412 VanDerWaalsContact C-N 3.29Å; E410-Y412 PolarHBondContact O-N 3.02Å; Y412-D414 PolarHBondContact O-N 3.41Å; Y412-D414 VanDerWaalsContact O-N 3.15Å; Y412-Y416 PolarHBondContact O-N 3.37Å; Y412-H615 AromaticContact CE1-CE1 3.98Å
413	S	55.7	Low	60.6	Low	28 Å²	28	79.5 Å²	79.5	20%	0.196	38%	0.375	C	S	.	.	H	α-helix	trans	-62.7	-18.4	-179.1	59.8	0	0	0	0	115.2	S610	S413-S610 WeakPolarHBondContact OG-CB 3.41Å; S413-S610 PolarHBondContact OG-OG 3.38Å
414	D	55.5	Low	62.2	Low	32 Å²	32	79.7 Å²	79.7	17%	0.171	37%	0.374	C	S	.	.	H	α-helix	trans	-79.7	-55	179.5	-162.9	21	0	0	0	112.1	Y412 Y416 W417 E418 N614	Y412-D414 PolarHBondContact O-N 3.41Å; Y412-D414 VanDerWaalsContact O-N 3.15Å; D414-Y416 PolarHBondContact O-N 2.97Å; D414-W417 PolarHBondContact O-N 3.28Å; D414-E418 PolarHBondContact O-N 3.39Å; D414-N614 HydrophobicContact CB-CB 4.02Å; D414-N614 WeakPolarHBondContact OD2-CB 3.26Å; D414-N614 PolarHBondContact OD2-ND2 3.38Å
415	D	61	Low	63.7	Low	29 Å²	29	80.8 Å²	80.8	16%	0.155	38%	0.383	C	S	.	.	H	α-helix	trans	-45.2	-37.5	168	-76.8	55.6	0	0	0	112.7	R419 H615	D415-R419 VanDerWaalsContact O-CB 3.3Å; D415-R419 WeakPolarHBondContact O-CB 3.19Å; D415-R419 VanDerWaalsContact O-CG 3.31Å; D415-R419 WeakPolarHBondContact O-CG 2.71Å; D415-R419 PolarHBondContact O-N 3.46Å; D415-R419 IonicContact OD2-CZ 3.66Å; D415-R419 IonicContact OD2-NH1 2.75Å; D415-R419 PolarHBondContact OD2-NH1 3.38Å; D415-R419 IonicContact OD2-NH2 3.83Å; D415-R419 PolarHBondContact OD2-NH2 2.94Å; D415-H615 IonicContact OD1-CE1 3.04Å
416	Y	66.1	Low	65.1	Low	21 Å²	21	80.8 Å²	80.8	8%	0.082	39%	0.39	C	S	.	.	H	α-helix	trans	-60.7	-49.9	175.2	178.1	-101.7	0	0	0	112.3	I403 L408 Y412 D414 R420	I403-Y416 HydrophobicContact CG2-CD2 3.87Å; I403-Y416 HydrophobicContact CG2-CE2 4.21Å; I403-Y416 WeakPolarHBondContact O-CE2 3.43Å; L408-Y416 HydrophobicContact CD1-CD2 3.94Å; L408-Y416 HydrophobicContact CD1-CG 4.41Å; Y412-Y416 PolarHBondContact O-N 3.37Å; D414-Y416 PolarHBondContact O-N 2.97Å; Y416-R420 WeakPolarHBondContact O-CA 3.36Å; Y416-R420 WeakPolarHBondContact O-CB 2.81Å; Y416-R420 PolarHBondContact O-N 2.94Å; Y416-R420 PolarHBondContact OH-NH1 3.24Å
417	W	68.8	Low	66.8	Low	15 Å²	15	74.2 Å²	74.2	6%	0.057	35%	0.354	C	S	.	.	H	α-helix	trans	-75.2	-24.7	179.8	-71.1	104.6	0	0	0	113.3	D414 Y421 K444 N447 V448 Q451 W607 L611	D414-W417 PolarHBondContact O-N 3.28Å; W417-Y421 HydrophobicContact CE3-CD2 4.28Å; W417-Y421 HydrophobicContact CE3-CE2 4.13Å; W417-Y421 HydrophobicContact CZ3-CD2 4.43Å; W417-Y421 AromaticContact CZ3-CE2 3.87Å; W417-Y421 HydrophobicContact CZ3-CE2 3.87Å; W417-K444 WeakPolarHBondContact O-CE 3.4Å; W417-K444 PolarHBondContact O-NZ 2.72Å; W417-N447 HydrophobicContact CH2-CB 4.19Å; W417-N447 HydrophobicContact CZ3-CB 3.92Å; W417-V448 HydrophobicContact CD2-CG2 4.12Å; W417-V448 HydrophobicContact CE3-CG2 4.15Å; W417-V448 HydrophobicContact CH2-CB 4.43Å; W417-V448 HydrophobicContact CH2-CG2 3.75Å; W417-V448 HydrophobicContact CZ2-CG2 3.75Å; W417-V448 HydrophobicContact CZ3-CG2 3.96Å; W417-Q451 HydrophobicContact CH2-CG 4.42Å; W417-W607 AromaticContact NE1-NE1 3.96Å; W417-L611 HydrophobicContact CG-CD2 4.16Å
418	E	70.8	Confident	68.5	Low	133 Å²	133	68.3 Å²	68.3	62%	0.621	33%	0.327	S	S	*	.	H	α-helix	trans	-66.6	-54.6	167.8	-68.4	-148.3	135.4	0	0	111.4	D414 K444	D414-E418 PolarHBondContact O-N 3.39Å; E418-K444 PolarHBondContact O-NZ 2.8Å
419	R	72.3	Confident	70.3	Confident	129 Å²	129	66 Å²	66	49%	0.487	32%	0.315	S	S	.	.	H	α-helix	trans	-79.1	-26.7	-173.7	-64	179.1	-175.4	123.9	18.1	114.5	N400 I403 D415	N400-R419 PolarHBondContact ND2-O 2.9Å; I403-R419 HydrophobicContact CD1-CB 3.62Å; D415-R419 VanDerWaalsContact O-CB 3.3Å; D415-R419 WeakPolarHBondContact O-CB 3.19Å; D415-R419 VanDerWaalsContact O-CG 3.31Å; D415-R419 WeakPolarHBondContact O-CG 2.71Å; D415-R419 PolarHBondContact O-N 3.46Å; D415-R419 IonicContact OD2-CZ 3.66Å; D415-R419 IonicContact OD2-NH1 2.75Å; D415-R419 PolarHBondContact OD2-NH1 3.38Å; D415-R419 IonicContact OD2-NH2 3.83Å; D415-R419 PolarHBondContact OD2-NH2 2.94Å
420	R	76.3	Confident	71.8	Confident	27 Å²	27	64.9 Å²	64.9	10%	0.102	31%	0.309	C	S	.	.	H	α-helix	trans	-64.9	-46.5	-179.9	-180	173.7	175	155	6.2	112	D399 N400 E401 Y416	D399-R420 WeakPolarHBondContact OD1-CG 3.25Å; D399-R420 IonicContact OD1-CZ 3.99Å; D399-R420 IonicContact OD1-NE 3.67Å; D399-R420 PolarHBondContact OD1-NE 2.97Å; D399-R420 IonicContact OD1-NH2 2.68Å; D399-R420 PolarHBondContact OD1-NH2 2.77Å; D399-R420 IonicContact OD2-CZ 2.68Å; D399-R420 IonicContact OD2-NE 3.72Å; D399-R420 PolarHBondContact OD2-NE 3.5Å; D399-R420 IonicContact OD2-NH2 2.68Å; D399-R420 PolarHBondContact OD2-NH2 3.32Å; N400-R420 PolarHBondContact N-O 3.2Å; E401-R420 IonicContact OE1-CZ 2.64Å; E401-R420 IonicContact OE1-NH2 3.28Å; E401-R420 PolarHBondContact OE1-NH2 2.99Å; Y416-R420 WeakPolarHBondContact O-CA 3.36Å; Y416-R420 WeakPolarHBondContact O-CB 2.81Å; Y416-R420 PolarHBondContact O-N 2.94Å; Y416-R420 PolarHBondContact OH-NH1 3.24Å
421	Y	83.8	Confident	73.4	Confident	7 Å²	7	57.4 Å²	57.4	3%	0.027	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	105.3	177.9	-57.5	-79	0	0	0	111.4	W382 I388 V397 V398 D399 W417 K444 N447	W382-Y421 AromaticContact CH2-CD1 3.51Å; W382-Y421 HydrophobicContact CH2-CD1 3.51Å; W382-Y421 HydrophobicContact CH2-CD2 4.43Å; W382-Y421 AromaticContact CH2-CE1 3.7Å; W382-Y421 HydrophobicContact CH2-CE1 3.7Å; W382-Y421 AromaticContact CH2-CG 3.91Å; W382-Y421 HydrophobicContact CH2-CG 3.91Å; W382-Y421 HydrophobicContact CZ2-CD1 4.48Å; W382-Y421 HydrophobicContact CZ3-CD1 4.02Å; W382-Y421 AromaticContact CZ3-CE1 3.8Å; W382-Y421 HydrophobicContact CZ3-CE1 3.8Å; I388-Y421 HydrophobicContact CD1-CD1 4.15Å; I388-Y421 HydrophobicContact CD1-CE1 4.12Å; V397-Y421 HydrophobicContact CG1-CD1 3.95Å; V397-Y421 HydrophobicContact CG1-CG 4.46Å; V398-Y421 WeakPolarHBondContact O-CA 3.43Å; V398-Y421 WeakPolarHBondContact O-CD1 3.23Å; D399-Y421 HydrophobicContact CB-CD1 4.2Å; D399-Y421 HydrophobicContact CB-CE1 3.71Å; D399-Y421 WeakPolarHBondContact OD2-CE1 3.22Å; D399-Y421 PolarHBondContact OD2-OH 3.22Å; W417-Y421 HydrophobicContact CE3-CD2 4.28Å; W417-Y421 HydrophobicContact CE3-CE2 4.13Å; W417-Y421 HydrophobicContact CZ3-CD2 4.43Å; W417-Y421 AromaticContact CZ3-CE2 3.87Å; W417-Y421 HydrophobicContact CZ3-CE2 3.87Å; Y421-K444 HydrophobicContact CD2-CG 4.14Å; Y421-K444 HydrophobicContact CG-CG 4.47Å; Y421-K444 WeakPolarHBondContact O-CE 3.41Å; Y421-K444 PolarHBondContact O-NZ 3.34Å; Y421-N447 HydrophobicContact CE2-CB 4.44Å; Y421-N447 PolarHBondContact OH-ND2 2.82Å
422	T	85.1	Confident	75.2	Confident	51 Å²	51	51.2 Å²	51.2	31%	0.313	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	155.3	179.1	56.4	0	0	0	0	111	V398 N400	V398-T422 PolarHBondContact N-O 3.42Å; N400-T422 PolarHBondContact ND2-OG1 3.48Å
423	L	86.6	Confident	76.8	Confident	50 Å²	50	48.7 Å²	48.7	26%	0.262	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	151.1	171.1	-65.3	174.7	0	0	0	111	L396 I428 L440	L396-L423 HydrophobicContact CD1-CD2 3.49Å; L396-L423 VanDerWaalsContact CD1-CD2 3.49Å; L396-L423 CarbonylContact O-C 3.44Å; L396-L423 VanDerWaalsContact O-CA 3.32Å; L396-L423 WeakPolarHBondContact O-CA 3.34Å; L423-I428 HydrophobicContact CD1-CD1 4.41Å; L423-L440 HydrophobicContact CD2-CB 4.25Å; L423-L440 HydrophobicContact CD2-CD1 4.28Å; L423-L440 HydrophobicContact CG-CD2 4.24Å
424	R	84.4	Confident	78.3	Confident	49 Å²	49	55.3 Å²	55.3	19%	0.185	27%	0.271	C	S	.	.			trans	-105.7	100.3	161.9	-59.2	-177.5	-163.7	129.2	12.4	108.1	D390 R393 F395 L396 V398 E426 Q427 I428	D390-R424 IonicContact OD2-CZ 2.69Å; D390-R424 IonicContact OD2-NH1 3.89Å; D390-R424 PolarHBondContact OD2-NH1 3.26Å; D390-R424 IonicContact OD2-NH2 2.75Å; D390-R424 PolarHBondContact OD2-NH2 2.85Å; R393-R424 VanDerWaalsContact CA-NH1 3.31Å; R393-R424 PolarHBondContact O-NH1 3.4Å; F395-R424 PolarHBondContact O-NH1 3.38Å; L396-R424 PolarHBondContact O-N 3.25Å; V398-R424 HydrophobicContact CG2-CG 3.49Å; V398-R424 VanDerWaalsContact CG2-CG 3.49Å; R424-E426 PolarHBondContact O-N 3.02Å; R424-Q427 HydrophobicContact CB-CB 4.04Å; R424-Q427 HydrophobicContact CB-CG 4.37Å; R424-Q427 CarbonylContact O-C 3.52Å; R424-Q427 PolarHBondContact O-N 3.36Å; R424-I428 WeakPolarHBondContact O-CG1 3.48Å
425	D	80.6	Confident	79.9	Confident	130 Å²	130	56.1 Å²	56.1	70%	0.695	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-59.5	-34.4	-175.3	-63.4	-40	0	0	0	112.9	Q427 I428	D425-Q427 PolarHBondContact O-N 3.09Å; D425-I428 PolarHBondContact O-N 2.88Å
426	E	78.4	Confident	81.2	Confident	157 Å²	157	55.6 Å²	55.6	73%	0.734	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-60	-22.6	172.4	-61.4	174.9	174.5	0	0	113.9	R424	R424-E426 PolarHBondContact O-N 3.02Å
427	Q	81.1	Confident	82.2	Confident	13 Å²	13	58 Å²	58	6%	0.061	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-115.5	26.1	-175.2	-60.8	-61.8	-52	0	0	113.1	A341 Y375 R424 D425 P429	A341-Q427 HydrophobicContact CB-CB 4.22Å; Y375-Q427 PolarHBondContact OH-O 2.98Å; Y375-Q427 VanDerWaalsContact OH-O 3.11Å; R424-Q427 HydrophobicContact CB-CB 4.04Å; R424-Q427 HydrophobicContact CB-CG 4.37Å; R424-Q427 CarbonylContact O-C 3.52Å; R424-Q427 PolarHBondContact O-N 3.36Å; D425-Q427 PolarHBondContact O-N 3.09Å; Q427-P429 WeakPolarHBondContact O-CD 3.47Å
428	I	84.6	Confident	83.1	Confident	27 Å²	27	59.9 Å²	59.9	14%	0.138	29%	0.294	C	S	.	.			trans	-98.7	110.4	171.8	-59.3	177.4	0	0	0	109.5	L396 L423 R424 D425 S430 A433	L396-I428 HydrophobicContact CB-CG1 4.22Å; L423-I428 HydrophobicContact CD1-CD1 4.41Å; R424-I428 WeakPolarHBondContact O-CG1 3.48Å; D425-I428 PolarHBondContact O-N 2.88Å; I428-S430 PolarHBondContact O-N 2.92Å; I428-A433 HydrophobicContact CG2-CB 3.89Å
429	P	84.8	Confident	84	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.264	C	S	.	.			trans	-59.8	136.9	171.5	-23.3	33.1	0	0	0	111.3	A341 L344 T345 Y375 Q427 F431 L432 A433	A341-P429 HydrophobicContact CB-CG 4.05Å; L344-P429 HydrophobicContact CD1-CG 4.49Å; T345-P429 WeakPolarHBondContact OG1-CA 3.49Å; Y375-P429 HydrophobicContact CE1-CG 3.93Å; Y375-P429 HydrophobicContact CE2-CG 4.12Å; Y375-P429 WeakPolarHBondContact OH-CD 3.31Å; Q427-P429 WeakPolarHBondContact O-CD 3.47Å; P429-F431 HydrophobicContact CB-CD1 3.86Å; P429-F431 HydrophobicContact CB-CE1 3.41Å; P429-F431 VanDerWaalsContact CB-CE1 3.41Å; P429-F431 HydrophobicContact CB-CE2 4.43Å; P429-F431 HydrophobicContact CB-CZ 3.73Å; P429-F431 HydrophobicContact CG-CE1 4.42Å; P429-F431 HydrophobicContact CG-CZ 4.36Å; P429-F431 PolarHBondContact O-N 3.48Å; P429-L432 HydrophobicContact CG-CD1 4.33Å; P429-L432 WeakPolarHBondContact O-CA 3.27Å; P429-L432 PolarHBondContact O-N 3.03Å; P429-A433 PolarHBondContact O-N 2.9Å
430	S	83.8	Confident	84.9	Confident	50 Å²	50	48.3 Å²	48.3	35%	0.35	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-27.4	-171.8	63.5	0	0	0	0	114.9	T345 I428	T345-S430 PolarHBondContact OG1-N 2.88Å; I428-S430 PolarHBondContact O-N 2.92Å
431	F	82.9	Confident	85.4	Confident	22 Å²	22	50.7 Å²	50.7	10%	0.096	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-22.9	175.1	61.2	-91.4	0	0	0	113.9	L344 H348 M376 P429 F466	L344-F431 HydrophobicContact CB-CE1 4.28Å; H348-F431 HydrophobicContact CB-CD1 4.44Å; M376-F431 HydrophobicContact CE-CE2 3.65Å; M376-F431 HydrophobicContact CE-CZ 3.76Å; P429-F431 HydrophobicContact CB-CD1 3.86Å; P429-F431 HydrophobicContact CB-CE1 3.41Å; P429-F431 VanDerWaalsContact CB-CE1 3.41Å; P429-F431 HydrophobicContact CB-CE2 4.43Å; P429-F431 HydrophobicContact CB-CZ 3.73Å; P429-F431 HydrophobicContact CG-CE1 4.42Å; P429-F431 HydrophobicContact CG-CZ 4.36Å; P429-F431 PolarHBondContact O-N 3.48Å; F431-F466 HydrophobicContact CD1-CE2 4.22Å; F431-F466 HydrophobicContact CD1-CZ 4.16Å; F431-F466 HydrophobicContact CD2-CD2 4.04Å; F431-F466 AromaticContact CD2-CE2 3.39Å; F431-F466 HydrophobicContact CD2-CE2 3.39Å; F431-F466 HydrophobicContact CD2-CZ 4.14Å; F431-F466 HydrophobicContact CE1-CE2 4.19Å; F431-F466 HydrophobicContact CE1-CZ 4.13Å; F431-F466 AromaticContact CE2-CD2 3.59Å; F431-F466 HydrophobicContact CE2-CD2 3.59Å; F431-F466 AromaticContact CE2-CE2 3.35Å; F431-F466 HydrophobicContact CE2-CE2 3.35Å; F431-F466 HydrophobicContact CE2-CZ 4.11Å; F431-F466 AromaticContact CG-CE2 3.85Å; F431-F466 HydrophobicContact CG-CE2 3.85Å; F431-F466 HydrophobicContact CG-CZ 4.17Å; F431-F466 HydrophobicContact CZ-CD2 4.06Å; F431-F466 AromaticContact CZ-CE2 3.78Å; F431-F466 HydrophobicContact CZ-CE2 3.78Å; F431-F466 HydrophobicContact CZ-CZ 4.11Å
432	L	84.6	Confident	85.7	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-12.9	174.9	-63.8	-179.2	0	0	0	113.7	Y375 L379 L396 P429 K434 Y435 S436 I439 I477	Y375-L432 HydrophobicContact CD1-CD1 4.46Å; Y375-L432 HydrophobicContact CE1-CD1 3.72Å; L379-L432 HydrophobicContact CD2-CD1 3.79Å; L379-L432 HydrophobicContact CD2-CD2 4.34Å; L396-L432 HydrophobicContact CD2-CD1 4.29Å; P429-L432 HydrophobicContact CG-CD1 4.33Å; P429-L432 WeakPolarHBondContact O-CA 3.27Å; P429-L432 PolarHBondContact O-N 3.03Å; L432-K434 PolarHBondContact O-N 3.43Å; L432-Y435 CarbonylContact O-C 3.6Å; L432-Y435 PolarHBondContact O-N 3.27Å; L432-S436 PolarHBondContact O-N 3.46Å; L432-S436 VanDerWaalsContact O-N 3.15Å; L432-I439 HydrophobicContact CD2-CD1 4.4Å; L432-I477 HydrophobicContact CD2-CD1 3.95Å
433	A	85.5	Confident	85.8	Confident	52 Å²	52	47.9 Å²	47.9	43%	0.43	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-28	-173.6	0	0	0	0	0	114.9	I428 P429 Y435 S436	I428-A433 HydrophobicContact CG2-CB 3.89Å; P429-A433 PolarHBondContact O-N 2.9Å; A433-Y435 VanDerWaalsContact C-N 3.28Å; A433-Y435 PolarHBondContact O-N 3.11Å; A433-S436 PolarHBondContact O-OG 3.37Å
434	K	87.9	Confident	85.8	Confident	166 Å²	166	47.3 Å²	47.3	72%	0.722	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-16.7	174.5	-64.9	178.2	-178.1	173.4	0	114.3	L432	L432-K434 PolarHBondContact O-N 3.43Å
435	Y	87.9	Confident	85.9	Confident	49 Å²	49	46 Å²	46	19%	0.192	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.9	2.4	-169.9	-55.4	-70.1	0	0	0	113.3	L432 A433 D437 K438 I439 V474	L432-Y435 CarbonylContact O-C 3.6Å; L432-Y435 PolarHBondContact O-N 3.27Å; A433-Y435 VanDerWaalsContact C-N 3.28Å; A433-Y435 PolarHBondContact O-N 3.11Å; Y435-D437 PolarHBondContact O-N 3.31Å; Y435-K438 WeakPolarHBondContact O-CB 3.33Å; Y435-K438 PolarHBondContact O-N 2.93Å; Y435-K438 VanDerWaalsContact O-N 3.1Å; Y435-I439 VanDerWaalsContact O-CG1 3.3Å; Y435-I439 WeakPolarHBondContact O-CG1 3.46Å; Y435-I439 PolarHBondContact O-N 3.31Å; Y435-V474 HydrophobicContact CD1-CG1 4.5Å; Y435-V474 HydrophobicContact CD2-CG1 4.32Å; Y435-V474 HydrophobicContact CD2-CG2 4.44Å; Y435-V474 HydrophobicContact CE1-CG1 3.85Å; Y435-V474 HydrophobicContact CE2-CB 4.42Å; Y435-V474 HydrophobicContact CE2-CG1 3.64Å; Y435-V474 HydrophobicContact CE2-CG2 3.87Å
436	S	87.7	Confident	86.1	Confident	18 Å²	18	39.9 Å²	39.9	13%	0.126	20%	0.196	C	C	.	.	H	α-helix	trans	-54.5	-46.7	-178.4	53.4	0	0	0	0	113.4	L432 A433 I439 L440	L432-S436 PolarHBondContact O-N 3.46Å; L432-S436 VanDerWaalsContact O-N 3.15Å; A433-S436 PolarHBondContact O-OG 3.37Å; S436-I439 PolarHBondContact O-N 3.27Å; S436-L440 WeakPolarHBondContact O-CB 3.28Å; S436-L440 PolarHBondContact O-N 2.87Å
437	D	88.1	Confident	86.4	Confident	73 Å²	73	33 Å²	33	39%	0.39	16%	0.164	S	C	.	.	H	α-helix	trans	-61.3	-42.3	175.1	171.8	81.9	0	0	0	112.3	Y435 L440 R441	Y435-D437 PolarHBondContact O-N 3.31Å; D437-L440 PolarHBondContact O-N 2.9Å; D437-R441 VanDerWaalsContact CG-NE 3.34Å; D437-R441 WeakPolarHBondContact O-CG 3.34Å; D437-R441 PolarHBondContact O-N 3.14Å; D437-R441 IonicContact OD1-CZ 2.73Å; D437-R441 IonicContact OD1-NE 3.43Å; D437-R441 PolarHBondContact OD1-NE 3.47Å; D437-R441 IonicContact OD1-NH2 2.65Å; D437-R441 PolarHBondContact OD1-NH2 2.93Å; D437-R441 IonicContact OD2-CZ 3.16Å; D437-R441 IonicContact OD2-NE 2.68Å; D437-R441 PolarHBondContact OD2-NE 3.05Å; D437-R441 IonicContact OD2-NH2 3.5Å; D437-R441 PolarHBondContact OD2-NH2 2.75Å
438	K	88.3	Confident	86.4	Confident	54 Å²	54	32.6 Å²	32.6	24%	0.235	16%	0.163	C	C	.	.	H	α-helix	trans	-62.1	-47.1	174.4	-67.7	-159.8	-179.8	-163.8	0	111.4	Y435 L440 R441 T442 N478 Y481	Y435-K438 WeakPolarHBondContact O-CB 3.33Å; Y435-K438 PolarHBondContact O-N 2.93Å; Y435-K438 VanDerWaalsContact O-N 3.1Å; K438-L440 VanDerWaalsContact C-N 3.29Å; K438-L440 PolarHBondContact O-N 2.84Å; K438-R441 PolarHBondContact O-N 3.11Å; K438-T442 PolarHBondContact O-N 3Å; K438-T442 PolarHBondContact O-OG1 3.2Å; K438-N478 PolarHBondContact NZ-OD1 3.19Å; K438-Y481 HydrophobicContact CB-CD2 4.26Å; K438-Y481 HydrophobicContact CD-CD1 4.41Å; K438-Y481 HydrophobicContact CD-CG 4.42Å
439	I	89.8	Confident	86.3	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-58.4	-43.4	178.4	-66.9	163.1	0	0	0	110.3	L379 W382 I383 L396 L432 Y435 S436 G443 I477	L379-I439 HydrophobicContact CD1-CD1 4.16Å; L379-I439 HydrophobicContact CD1-CG1 4.31Å; L379-I439 HydrophobicContact CD1-CG2 3.44Å; L379-I439 VanDerWaalsContact CD1-CG2 3.44Å; W382-I439 PolarHBondContact NE1-O 3.41Å; I383-I439 HydrophobicContact CD1-CG1 4.34Å; I383-I439 HydrophobicContact CD1-CG2 4.5Å; L396-I439 HydrophobicContact CD1-CG2 4.13Å; L396-I439 HydrophobicContact CD2-CD1 4.42Å; L396-I439 HydrophobicContact CD2-CG2 4.32Å; L432-I439 HydrophobicContact CD2-CD1 4.4Å; Y435-I439 VanDerWaalsContact O-CG1 3.3Å; Y435-I439 WeakPolarHBondContact O-CG1 3.46Å; Y435-I439 PolarHBondContact O-N 3.31Å; S436-I439 PolarHBondContact O-N 3.27Å; I439-G443 PolarHBondContact O-N 2.76Å; I439-I477 HydrophobicContact CD1-CD1 4.36Å; I439-I477 HydrophobicContact CD1-CG2 4.43Å; I439-I477 HydrophobicContact CG1-CG2 3.79Å
440	L	90	Very high	86.1	Confident	18 Å²	18	36.8 Å²	36.8	9%	0.094	18%	0.177	C	C	.	.	H	α-helix	trans	-61	-49.9	175.1	-172.9	72.9	0	0	0	111.4	V397 L423 S436 D437 K438 T442 G443 K444	V397-L440 HydrophobicContact CB-CD1 4.41Å; V397-L440 HydrophobicContact CG1-CD1 3.66Å; V397-L440 HydrophobicContact CG2-CD1 3.92Å; L423-L440 HydrophobicContact CD2-CB 4.25Å; L423-L440 HydrophobicContact CD2-CD1 4.28Å; L423-L440 HydrophobicContact CG-CD2 4.24Å; S436-L440 WeakPolarHBondContact O-CB 3.28Å; S436-L440 PolarHBondContact O-N 2.87Å; D437-L440 PolarHBondContact O-N 2.9Å; K438-L440 VanDerWaalsContact C-N 3.29Å; K438-L440 PolarHBondContact O-N 2.84Å; L440-T442 PolarHBondContact O-N 3.05Å; L440-G443 PolarHBondContact O-N 2.76Å; L440-K444 HydrophobicContact CG-CD 4.27Å; L440-K444 WeakPolarHBondContact O-CB 3.49Å; L440-K444 WeakPolarHBondContact O-CG 3.49Å; L440-K444 PolarHBondContact O-N 2.89Å
441	R	88	Confident	85.7	Confident	77 Å²	77	37.2 Å²	37.2	29%	0.291	17%	0.173	S	C	.	.	H	α-helix	trans	-57.8	-46.9	177.8	-73.6	178.8	-157.9	-85.3	-24.2	112.1	D437 K438 G443 K444 Y445 Y481 D703	D437-R441 VanDerWaalsContact CG-NE 3.34Å; D437-R441 WeakPolarHBondContact O-CG 3.34Å; D437-R441 PolarHBondContact O-N 3.14Å; D437-R441 IonicContact OD1-CZ 2.73Å; D437-R441 IonicContact OD1-NE 3.43Å; D437-R441 PolarHBondContact OD1-NE 3.47Å; D437-R441 IonicContact OD1-NH2 2.65Å; D437-R441 PolarHBondContact OD1-NH2 2.93Å; D437-R441 IonicContact OD2-CZ 3.16Å; D437-R441 IonicContact OD2-NE 2.68Å; D437-R441 PolarHBondContact OD2-NE 3.05Å; D437-R441 IonicContact OD2-NH2 3.5Å; D437-R441 PolarHBondContact OD2-NH2 2.75Å; K438-R441 PolarHBondContact O-N 3.11Å; R441-G443 PolarHBondContact O-N 3.25Å; R441-K444 PolarHBondContact O-N 3.38Å; R441-Y445 HydrophobicContact CB-CE2 3.9Å; R441-Y445 WeakPolarHBondContact O-CD2 3.38Å; R441-Y445 PolarHBondContact O-N 3.04Å; R441-Y481 HydrophobicContact CB-CD2 4.35Å; R441-Y481 HydrophobicContact CB-CE2 4.03Å; R441-D703 IonicContact CZ-OD1 3.79Å; R441-D703 IonicContact NE-OD1 2.69Å; R441-D703 IonicContact NH1-OD1 2.69Å; R441-D703 PolarHBondContact NH1-OD1 3Å
442	T	89.4	Confident	85.2	Confident	0 Å²	0	38 Å²	38	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-52.5	-53.3	179.2	-56.6	0	0	0	0	111.8	I383 K438 L440 Y445 L446 Y481 A484	I383-T442 HydrophobicContact CG2-CG2 4.33Å; K438-T442 PolarHBondContact O-N 3Å; K438-T442 PolarHBondContact O-OG1 3.2Å; L440-T442 PolarHBondContact O-N 3.05Å; T442-Y445 PolarHBondContact O-N 3.15Å; T442-L446 WeakPolarHBondContact O-CG 3.49Å; T442-L446 PolarHBondContact O-N 3.23Å; T442-Y481 VanDerWaalsContact OG1-CA 3.32Å; T442-Y481 WeakPolarHBondContact OG1-CA 3.27Å; T442-Y481 WeakPolarHBondContact OG1-CB 3.23Å; T442-A484 HydrophobicContact CG2-CB 3.88Å
443	G	87.8	Confident	84.3	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-73.6	-31.3	-179.6	0	0	0	0	0	113.9	W382 I439 L440 R441 Y445 L446 N447	W382-G443 VanDerWaalsContact CE2-CA 3.49Å; W382-G443 VanDerWaalsContact CZ2-CA 3.46Å; I439-G443 PolarHBondContact O-N 2.76Å; L440-G443 PolarHBondContact O-N 2.76Å; R441-G443 PolarHBondContact O-N 3.25Å; G443-Y445 VanDerWaalsContact C-N 3.35Å; G443-Y445 PolarHBondContact O-N 3.19Å; G443-L446 PolarHBondContact O-N 2.58Å; G443-N447 WeakPolarHBondContact O-CB 3.39Å; G443-N447 PolarHBondContact O-N 3.31Å
444	K	85.7	Confident	83.3	Confident	37 Å²	37	41.9 Å²	41.9	16%	0.161	21%	0.208	C	C	.	.	H	α-helix	trans	-56.3	-49	167.7	-78.9	-174.1	176.2	-169.1	0	110.4	W417 E418 Y421 L440 R441 N447 V448	W417-K444 WeakPolarHBondContact O-CE 3.4Å; W417-K444 PolarHBondContact O-NZ 2.72Å; E418-K444 PolarHBondContact O-NZ 2.8Å; Y421-K444 HydrophobicContact CD2-CG 4.14Å; Y421-K444 HydrophobicContact CG-CG 4.47Å; Y421-K444 WeakPolarHBondContact O-CE 3.41Å; Y421-K444 PolarHBondContact O-NZ 3.34Å; L440-K444 HydrophobicContact CG-CD 4.27Å; L440-K444 WeakPolarHBondContact O-CB 3.49Å; L440-K444 WeakPolarHBondContact O-CG 3.49Å; L440-K444 PolarHBondContact O-N 2.89Å; R441-K444 PolarHBondContact O-N 3.38Å; K444-N447 PolarHBondContact O-N 3.03Å; K444-V448 WeakPolarHBondContact O-CG2 3.44Å; K444-V448 PolarHBondContact O-N 3.48Å
445	Y	87.2	Confident	81.9	Confident	21 Å²	21	44.5 Å²	44.5	8%	0.082	21%	0.214	C	C	.	.	H	α-helix	trans	-64.1	-43.2	178.7	-57.5	-26.5	0	0	0	112.8	R441 T442 G443 N447 V448 I449 Y481 A485 L488 D703	R441-Y445 HydrophobicContact CB-CE2 3.9Å; R441-Y445 WeakPolarHBondContact O-CD2 3.38Å; R441-Y445 PolarHBondContact O-N 3.04Å; T442-Y445 PolarHBondContact O-N 3.15Å; G443-Y445 VanDerWaalsContact C-N 3.35Å; G443-Y445 PolarHBondContact O-N 3.19Å; Y445-N447 VanDerWaalsContact C-N 3.3Å; Y445-N447 PolarHBondContact O-N 2.83Å; Y445-V448 PolarHBondContact O-N 3.41Å; Y445-I449 WeakPolarHBondContact O-CD1 3.3Å; Y445-I449 VanDerWaalsContact O-CG1 3.29Å; Y445-I449 WeakPolarHBondContact O-CG1 3.5Å; Y445-I449 PolarHBondContact O-N 3.06Å; Y445-Y481 HydrophobicContact CE2-CE2 4.1Å; Y445-A485 HydrophobicContact CD2-CB 4.16Å; Y445-A485 HydrophobicContact CE2-CB 4.09Å; Y445-L488 HydrophobicContact CD1-CD2 3.44Å; Y445-L488 VanDerWaalsContact CD1-CD2 3.44Å; Y445-L488 HydrophobicContact CE1-CD2 4.22Å; Y445-L488 HydrophobicContact CG-CD2 3.8Å; Y445-D703 PolarHBondContact OH-OD1 3.36Å; Y445-D703 PolarHBondContact OH-OD2 3.43Å
446	L	85.1	Confident	80.6	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-36.5	175.1	-68	-170.1	0	0	0	112.5	I383 T442 G443 I449 R450 V456 A484	I383-L446 WeakPolarHBondContact O-CD1 3.46Å; T442-L446 WeakPolarHBondContact O-CG 3.49Å; T442-L446 PolarHBondContact O-N 3.23Å; G443-L446 PolarHBondContact O-N 2.58Å; L446-I449 HydrophobicContact CD2-CD1 4.16Å; L446-I449 PolarHBondContact O-N 2.84Å; L446-R450 WeakPolarHBondContact O-CB 3.36Å; L446-R450 WeakPolarHBondContact O-CG 3.5Å; L446-R450 PolarHBondContact O-N 3.18Å; L446-V456 HydrophobicContact CB-CG2 4.37Å; L446-V456 HydrophobicContact CD1-CG1 4.37Å; L446-V456 HydrophobicContact CD2-CG1 3.82Å; L446-V456 HydrophobicContact CD2-CG2 4.01Å; L446-A484 HydrophobicContact CD2-CB 3.76Å; L446-A484 HydrophobicContact CG-CB 4.04Å
447	N	84.5	Confident	78.9	Confident	11 Å²	11	48.1 Å²	48.1	6%	0.059	23%	0.233	C	C	.	.	H	α-helix	trans	-74.9	-30.3	177.2	-76.7	-22.4	0	0	0	113.4	W382 G386 W417 Y421 G443 K444 Y445 R450 Q451	W382-N447 WeakPolarHBondContact CZ3-ND2 3.48Å; G386-N447 WeakPolarHBondContact CA-OD1 3.39Å; G386-N447 PolarHBondContact O-ND2 3.29Å; G386-N447 PolarHBondContact O-OD1 3.09Å; G386-N447 VanDerWaalsContact O-OD1 3.06Å; W417-N447 HydrophobicContact CH2-CB 4.19Å; W417-N447 HydrophobicContact CZ3-CB 3.92Å; Y421-N447 HydrophobicContact CE2-CB 4.44Å; Y421-N447 PolarHBondContact OH-ND2 2.82Å; G443-N447 WeakPolarHBondContact O-CB 3.39Å; G443-N447 PolarHBondContact O-N 3.31Å; K444-N447 PolarHBondContact O-N 3.03Å; Y445-N447 VanDerWaalsContact C-N 3.3Å; Y445-N447 PolarHBondContact O-N 2.83Å; N447-R450 WeakPolarHBondContact OD1-CD 3.38Å; N447-Q451 WeakPolarHBondContact O-CG 3.4Å; N447-Q451 PolarHBondContact O-N 2.95Å; N447-Q451 VanDerWaalsContact O-N 3.15Å
448	V	81.3	Confident	77.2	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.03	24%	0.241	C	C	.	.	H	α-helix	trans	-60.8	-53.4	165.1	171.2	0	0	0	0	109.9	W417 K444 Y445 R450 Q451 C452 L488 W607 L611	W417-V448 HydrophobicContact CD2-CG2 4.12Å; W417-V448 HydrophobicContact CE3-CG2 4.15Å; W417-V448 HydrophobicContact CH2-CB 4.43Å; W417-V448 HydrophobicContact CH2-CG2 3.75Å; W417-V448 HydrophobicContact CZ2-CG2 3.75Å; W417-V448 HydrophobicContact CZ3-CG2 3.96Å; K444-V448 WeakPolarHBondContact O-CG2 3.44Å; K444-V448 PolarHBondContact O-N 3.48Å; Y445-V448 PolarHBondContact O-N 3.41Å; V448-R450 VanDerWaalsContact C-N 3.27Å; V448-R450 PolarHBondContact O-N 2.9Å; V448-Q451 PolarHBondContact O-N 3.35Å; V448-C452 PolarHBondContact O-N 2.89Å; V448-L488 HydrophobicContact CB-CD1 4.22Å; V448-L488 HydrophobicContact CG1-CD1 3.49Å; V448-L488 VanDerWaalsContact CG1-CD1 3.49Å; V448-L488 HydrophobicContact CG1-CD2 4.42Å; V448-W607 HydrophobicContact CG1-CZ2 3.96Å; V448-W607 WeakPolarHBondContact O-CH2 3.5Å; V448-L611 HydrophobicContact CB-CD1 4.29Å; V448-L611 HydrophobicContact CG1-CD1 3.46Å; V448-L611 VanDerWaalsContact CG1-CD1 3.46Å; V448-L611 HydrophobicContact CG2-CD1 3.77Å
449	I	82.4	Confident	75.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-56.2	-41.1	179.5	-65.5	159.1	0	0	0	111.5	Y445 L446 Q451 C452 K454 V456 M487 L488	Y445-I449 WeakPolarHBondContact O-CD1 3.3Å; Y445-I449 VanDerWaalsContact O-CG1 3.29Å; Y445-I449 WeakPolarHBondContact O-CG1 3.5Å; Y445-I449 PolarHBondContact O-N 3.06Å; L446-I449 HydrophobicContact CD2-CD1 4.16Å; L446-I449 PolarHBondContact O-N 2.84Å; I449-Q451 VanDerWaalsContact C-N 3.32Å; I449-Q451 PolarHBondContact O-N 3.5Å; I449-C452 VanDerWaalsContact O-CB 3.27Å; I449-C452 WeakPolarHBondContact O-CB 3.29Å; I449-C452 PolarHBondContact O-N 3.28Å; I449-C452 VanDerWaalsContact O-N 3.1Å; I449-K454 HydrophobicContact CG2-CB 3.93Å; I449-V456 HydrophobicContact CG2-CG2 4.21Å; I449-M487 HydrophobicContact CD1-CB 3.7Å; I449-L488 HydrophobicContact CD1-CB 4.05Å; I449-L488 HydrophobicContact CG1-CB 4.16Å; I449-L488 HydrophobicContact CG1-CD1 4.08Å
450	R	79.8	Confident	73.8	Confident	115 Å²	115	56.4 Å²	56.4	43%	0.434	29%	0.285	S	S	.	.	H	α-helix	trans	-63.5	-34.9	176.6	-75.4	167.9	56.8	118.7	6.7	113.2	K385 L446 N447 V448 C452 G453 V456	K385-R450 VanDerWaalsContact O-CD 3.25Å; K385-R450 WeakPolarHBondContact O-CD 3.29Å; K385-R450 PolarHBondContact O-NH1 3.08Å; L446-R450 WeakPolarHBondContact O-CB 3.36Å; L446-R450 WeakPolarHBondContact O-CG 3.5Å; L446-R450 PolarHBondContact O-N 3.18Å; N447-R450 WeakPolarHBondContact OD1-CD 3.38Å; V448-R450 VanDerWaalsContact C-N 3.27Å; V448-R450 PolarHBondContact O-N 2.9Å; R450-C452 PolarHBondContact O-N 3.01Å; R450-G453 PolarHBondContact O-N 2.71Å; R450-V456 HydrophobicContact CG-CG2 3.79Å
451	Q	76.2	Confident	72.2	Confident	59 Å²	59	64 Å²	64	28%	0.276	32%	0.321	S	S	.	.	H	α-helix	trans	-71.2	-16.4	175.6	-71.6	-176.6	32.9	0	0	112.4	W417 N447 V448 I449 G453 W607	W417-Q451 HydrophobicContact CH2-CG 4.42Å; N447-Q451 WeakPolarHBondContact O-CG 3.4Å; N447-Q451 PolarHBondContact O-N 2.95Å; N447-Q451 VanDerWaalsContact O-N 3.15Å; V448-Q451 PolarHBondContact O-N 3.35Å; I449-Q451 VanDerWaalsContact C-N 3.32Å; I449-Q451 PolarHBondContact O-N 3.5Å; Q451-G453 PolarHBondContact O-N 2.77Å; Q451-G453 VanDerWaalsContact O-N 3.14Å; Q451-W607 HydrophobicContact CB-CH2 3.51Å; Q451-W607 HydrophobicContact CB-CZ2 3.62Å; Q451-W607 HydrophobicContact CB-CZ3 4.37Å
452	C	71.5	Confident	70.9	Confident	40 Å²	40	61.6 Å²	61.6	27%	0.27	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	5.8	169.5	-54	0	0	0	0	113.2	V448 I449 R450 K454 W607	V448-C452 PolarHBondContact O-N 2.89Å; I449-C452 VanDerWaalsContact O-CB 3.27Å; I449-C452 WeakPolarHBondContact O-CB 3.29Å; I449-C452 PolarHBondContact O-N 3.28Å; I449-C452 VanDerWaalsContact O-N 3.1Å; R450-C452 PolarHBondContact O-N 3.01Å; C452-K454 PolarHBondContact O-N 3.29Å; C452-K454 VanDerWaalsContact O-N 3.13Å; C452-W607 HydrophobicContact CB-CH2 4.26Å; C452-W607 HydrophobicContact CB-CZ3 4.29Å; C452-W607 VanDerWaalsContact N-CH2 3.32Å; C452-W607 WeakPolarHBondContact SG-CH2 3.08Å
453	G	65.8	Low	69.8	Low	70 Å²	70	67.3 Å²	67.3	72%	0.722	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	-1.5	-169.8	0	0	0	0	0	114	R450 Q451	R450-G453 PolarHBondContact O-N 2.71Å; Q451-G453 PolarHBondContact O-N 2.77Å; Q451-G453 VanDerWaalsContact O-N 3.14Å
454	K	66.1	Low	69.1	Low	64 Å²	64	67.9 Å²	67.9	28%	0.278	35%	0.346	S	S	.	.			trans	-72.9	134.5	177.6	-84.7	-175.5	156.7	178.2	0	111	I449 C452 V456 V491 E495	I449-K454 HydrophobicContact CG2-CB 3.93Å; C452-K454 PolarHBondContact O-N 3.29Å; C452-K454 VanDerWaalsContact O-N 3.13Å; K454-V456 PolarHBondContact O-N 3.4Å; K454-V491 HydrophobicContact CD-CG2 3.8Å; K454-E495 WeakPolarHBondContact CE-OE1 3.38Å; K454-E495 WeakPolarHBondContact CE-OE2 3.35Å; K454-E495 IonicContact NZ-OE1 3.13Å; K454-E495 PolarHBondContact NZ-OE1 3.08Å; K454-E495 IonicContact NZ-OE2 3.21Å; K454-E495 PolarHBondContact NZ-OE2 2.96Å
455	R	58.2	Low	68.6	Low	220 Å²	220	72.4 Å²	72.4	83%	0.83	37%	0.368	S	S	*	.			trans	-71.6	122.7	161.5	-64.4	-176.4	-174.1	-112.9	-0.3	107.7	M457	R455-M457 PolarHBondContact O-N 3.25Å; R455-M457 VanDerWaalsContact O-N 3.11Å
456	V	60.7	Low	67.9	Low	24 Å²	24	71.7 Å²	71.7	15%	0.145	37%	0.365	C	S	.	.			trans	-60.6	113.9	161.7	176.1	0	0	0	0	106.3	Q384 L446 I449 R450 K454 P458	Q384-V456 WeakPolarHBondContact O-CG1 3.17Å; L446-V456 HydrophobicContact CB-CG2 4.37Å; L446-V456 HydrophobicContact CD1-CG1 4.37Å; L446-V456 HydrophobicContact CD2-CG1 3.82Å; L446-V456 HydrophobicContact CD2-CG2 4.01Å; I449-V456 HydrophobicContact CG2-CG2 4.21Å; R450-V456 HydrophobicContact CG-CG2 3.79Å; K454-V456 PolarHBondContact O-N 3.4Å; V456-P458 VanDerWaalsContact O-CD 3.28Å; V456-P458 WeakPolarHBondContact O-CD 3.49Å
457	M	51.4	Low	67.3	Low	119 Å²	119	72.6 Å²	72.6	59%	0.586	37%	0.37	S	S	*	.			trans	-85.9	110.8	-179	-66.6	-70.7	-82.8	0	0	108.1	R455 T459	R455-M457 PolarHBondContact O-N 3.25Å; R455-M457 VanDerWaalsContact O-N 3.11Å; M457-T459 VanDerWaalsContact C-N 3.31Å; M457-T459 PolarHBondContact O-N 3.4Å
458	P	52.9	Low	66.5	Low	85 Å²	85	73.3 Å²	73.3	55%	0.552	38%	0.375	S	S	*	.			trans	-78	84.8	177	33	-33.4	0	0	0	108.9	V456 Q460	V456-P458 VanDerWaalsContact O-CD 3.28Å; V456-P458 WeakPolarHBondContact O-CD 3.49Å; P458-Q460 PolarHBondContact O-N 2.92Å
459	T	50.4	Low	65.7	Low	105 Å²	105	78 Å²	78	64%	0.644	40%	0.404	S	S	*	.			trans	-72.7	-3.8	174.7	40.4	0	0	0	0	113.5	M457 F483	M457-T459 VanDerWaalsContact C-N 3.31Å; M457-T459 PolarHBondContact O-N 3.4Å; T459-F483 WeakPolarHBondContact OG1-CE2 3.5Å; T459-F483 VanDerWaalsContact OG1-CZ 3.3Å; T459-F483 WeakPolarHBondContact OG1-CZ 3.35Å
460	Q	55.6	Low	65.1	Low	112 Å²	112	79.6 Å²	79.6	52%	0.523	42%	0.415	S	S	.	.			trans	-140.9	122.8	175.8	-65.4	-179	-8.5	0	0	110.4	P458 M462	P458-Q460 PolarHBondContact O-N 2.92Å; Q460-M462 VanDerWaalsContact C-N 3.35Å; Q460-M462 HydrophobicContact CB-CG 3.83Å; Q460-M462 PolarHBondContact O-N 3.02Å; Q460-M462 VanDerWaalsContact O-N 3.13Å
461	E	56.6	Low	64.7	Low	178 Å²	178	80.6 Å²	80.6	83%	0.832	43%	0.425	S	S	*	.			trans	-78.8	85.4	164.2	-67.8	-168.2	143.7	0	0	108.8	N463	E461-N463 PolarHBondContact O-N 2.88Å
462	M	61.5	Low	64.9	Low	26 Å²	26	86.1 Å²	86.1	13%	0.128	44%	0.443	C	S	.	.			trans	-81.6	104.2	179.6	-39.6	176.4	85.3	0	0	109.3	Q380 Q384 Q460 L464 V476 D479 A480	Q380-M462 PolarHBondContact NE2-O 3.1Å; Q384-M462 PolarHBondContact NE2-O 3.5Å; Q460-M462 VanDerWaalsContact C-N 3.35Å; Q460-M462 HydrophobicContact CB-CG 3.83Å; Q460-M462 PolarHBondContact O-N 3.02Å; Q460-M462 VanDerWaalsContact O-N 3.13Å; M462-L464 PolarHBondContact O-N 3.34Å; M462-L464 VanDerWaalsContact O-N 3.15Å; M462-V476 HydrophobicContact CB-CG1 3.84Å; M462-V476 HydrophobicContact CE-CB 4.34Å; M462-V476 HydrophobicContact CE-CG1 3.96Å; M462-V476 HydrophobicContact SD-CG1 4.28Å; M462-D479 HydrophobicContact CE-CB 3.78Å; M462-A480 HydrophobicContact CE-CB 4.4Å; M462-A480 HydrophobicContact SD-CB 3.86Å
463	N	64.8	Low	65.2	Low	119 Å²	119	84.8 Å²	84.8	64%	0.636	43%	0.433	S	S	*	.			trans	-74.8	102.9	176.1	-70.4	-23.4	0	0	0	109.7	E461 E465	E461-N463 PolarHBondContact O-N 2.88Å; N463-E465 PolarHBondContact O-N 2.79Å
464	L	73.8	Confident	66.1	Low	12 Å²	12	82.1 Å²	82.1	6%	0.063	40%	0.403	C	S	.	.			trans	-85.6	83.8	-179.6	-174.5	63.3	0	0	0	110.2	M376 L379 Q380 M462 H473 V476	M376-L464 HydrophobicContact CB-CD2 4.49Å; M376-L464 HydrophobicContact CB-CG 4.35Å; M376-L464 WeakPolarHBondContact CB-O 3.45Å; M376-L464 HydrophobicContact SD-CD2 4.23Å; M376-L464 HydrophobicContact SD-CG 4.2Å; L379-L464 HydrophobicContact CB-CD2 4.02Å; L379-L464 HydrophobicContact CD2-CD2 3.86Å; L379-L464 HydrophobicContact CG-CD2 3.74Å; Q380-L464 HydrophobicContact CB-CB 4.33Å; Q380-L464 HydrophobicContact CB-CD2 4.43Å; M462-L464 PolarHBondContact O-N 3.34Å; M462-L464 VanDerWaalsContact O-N 3.15Å; L464-H473 HydrophobicContact CD1-CB 3.9Å; L464-V476 HydrophobicContact CD1-CB 4.26Å; L464-V476 HydrophobicContact CD1-CG1 3.92Å
465	E	74.1	Confident	66.9	Low	132 Å²	132	82 Å²	82	62%	0.617	41%	0.41	S	S	*	.			trans	-94.8	137.8	172.9	-62.3	-169	168.7	0	0	111	N463 D467	N463-E465 PolarHBondContact O-N 2.79Å; E465-D467 PolarHBondContact O-N 2.71Å
466	F	74.1	Confident	68.2	Low	6 Å²	6	72.8 Å²	72.8	3%	0.026	38%	0.378	C	S	.	.			trans	-90.2	103.7	176.6	-179.5	-103.7	0	0	0	111.3	V368 A372 M376 F431 P468 H473	V368-F466 HydrophobicContact CG1-CD1 4Å; V368-F466 HydrophobicContact CG1-CE1 3.6Å; A372-F466 HydrophobicContact CB-CB 3.97Å; A372-F466 HydrophobicContact CB-CD1 3.96Å; A372-F466 HydrophobicContact CB-CG 4.15Å; M376-F466 HydrophobicContact CE-CB 4.17Å; M376-F466 HydrophobicContact CE-CD2 4.27Å; M376-F466 HydrophobicContact CE-CG 4.36Å; M376-F466 HydrophobicContact CG-CB 3.85Å; M376-F466 HydrophobicContact SD-CB 4.23Å; F431-F466 HydrophobicContact CD1-CE2 4.22Å; F431-F466 HydrophobicContact CD1-CZ 4.16Å; F431-F466 HydrophobicContact CD2-CD2 4.04Å; F431-F466 AromaticContact CD2-CE2 3.39Å; F431-F466 HydrophobicContact CD2-CE2 3.39Å; F431-F466 HydrophobicContact CD2-CZ 4.14Å; F431-F466 HydrophobicContact CE1-CE2 4.19Å; F431-F466 HydrophobicContact CE1-CZ 4.13Å; F431-F466 AromaticContact CE2-CD2 3.59Å; F431-F466 HydrophobicContact CE2-CD2 3.59Å; F431-F466 AromaticContact CE2-CE2 3.35Å; F431-F466 HydrophobicContact CE2-CE2 3.35Å; F431-F466 HydrophobicContact CE2-CZ 4.11Å; F431-F466 AromaticContact CG-CE2 3.85Å; F431-F466 HydrophobicContact CG-CE2 3.85Å; F431-F466 HydrophobicContact CG-CZ 4.17Å; F431-F466 HydrophobicContact CZ-CD2 4.06Å; F431-F466 AromaticContact CZ-CE2 3.78Å; F431-F466 HydrophobicContact CZ-CE2 3.78Å; F431-F466 HydrophobicContact CZ-CZ 4.11Å; F466-P468 HydrophobicContact CE1-CB 3.74Å; F466-P468 HydrophobicContact CE1-CG 4.2Å; F466-P468 HydrophobicContact CZ-CB 3.94Å; F466-H473 AromaticContact CE2-CE1 3.92Å
467	D	72.5	Confident	69.5	Low	22 Å²	22	71.7 Å²	71.7	12%	0.118	37%	0.371	C	S	.	.			trans	-97.7	113.2	164.6	-82.6	-28.4	0	0	0	109.9	R369 E465 T469 S470 R472	R369-D467 IonicContact CZ-OD1 3.79Å; R369-D467 VanDerWaalsContact CZ-OD1 3.28Å; R369-D467 IonicContact NE-OD1 2.76Å; R369-D467 PolarHBondContact NE-OD1 3.22Å; R369-D467 IonicContact NH2-OD1 2.68Å; R369-D467 PolarHBondContact NH2-OD1 2.99Å; E465-D467 PolarHBondContact O-N 2.71Å; D467-T469 PolarHBondContact O-N 3.48Å; D467-T469 VanDerWaalsContact O-N 3.11Å; D467-S470 WeakPolarHBondContact CB-OG 3.47Å; D467-S470 PolarHBondContact O-N 3.02Å; D467-S470 VanDerWaalsContact O-N 3.15Å; D467-R472 IonicContact OD2-NH1 3.65Å
468	P	66.7	Low	71.3	Confident	26 Å²	26	67.2 Å²	67.2	17%	0.169	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-11.4	175.1	27	-34.7	0	0	0	113.3	I351 I365 F466	I351-P468 HydrophobicContact CD1-CB 4.08Å; I351-P468 HydrophobicContact CD1-CG 4.18Å; I365-P468 HydrophobicContact CB-CG 4.11Å; I365-P468 HydrophobicContact CG1-CG 3.78Å; I365-P468 HydrophobicContact CG2-CG 3.69Å; F466-P468 HydrophobicContact CE1-CB 3.74Å; F466-P468 HydrophobicContact CE1-CG 4.2Å; F466-P468 HydrophobicContact CZ-CB 3.94Å
469	T	64.4	Low	72.9	Confident	105 Å²	105	67.3 Å²	67.3	64%	0.644	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-4.7	177.4	52.9	0	0	0	0	113.8	I365 D467	I365-T469 HydrophobicContact CD1-CG2 3.9Å; D467-T469 PolarHBondContact O-N 3.48Å; D467-T469 VanDerWaalsContact O-N 3.11Å
470	S	69.3	Low	74.6	Confident	33 Å²	33	62.5 Å²	62.5	23%	0.231	32%	0.317	C	S	.	.			trans	-145.8	133.8	178.5	85.4	0	0	0	0	114.2	D467 R472 H473	D467-S470 WeakPolarHBondContact CB-OG 3.47Å; D467-S470 PolarHBondContact O-N 3.02Å; D467-S470 VanDerWaalsContact O-N 3.15Å; S470-R472 PolarHBondContact O-N 2.92Å; S470-R472 WeakPolarHBondContact OG-CD 3.45Å; S470-R472 WeakPolarHBondContact OG-CG 3.22Å; S470-H473 PolarHBondContact O-CE1 3.36Å; S470-H473 PolarHBondContact O-ND1 3.29Å; S470-H473 VanDerWaalsContact O-ND1 3.08Å
471	E	73.2	Confident	76.2	Confident	136 Å²	136	58.2 Å²	58.2	64%	0.636	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	23	178.8	-60.6	-168.3	157.7	0	0	113.3	H473 V474 S475	E471-H473 PolarHBondContact O-N 2.88Å; E471-V474 HydrophobicContact CB-CB 4.14Å; E471-V474 HydrophobicContact CB-CG2 3.92Å; E471-V474 HydrophobicContact CG-CG2 4.38Å; E471-V474 WeakPolarHBondContact O-CA 3.29Å; E471-V474 VanDerWaalsContact O-CB 3.24Å; E471-V474 WeakPolarHBondContact O-CB 3.31Å; E471-V474 PolarHBondContact O-N 2.78Å; E471-S475 PolarHBondContact O-N 3.46Å
472	R	78.6	Confident	77.7	Confident	174 Å²	174	55 Å²	55	66%	0.657	28%	0.277	S	S	*	.	H	α-helix	trans	-56.2	-35.6	174.9	-72.8	174.9	173.5	173.6	-7.1	112.7	D467 S470 V474 S475 V476	D467-R472 IonicContact OD2-NH1 3.65Å; S470-R472 PolarHBondContact O-N 2.92Å; S470-R472 WeakPolarHBondContact OG-CD 3.45Å; S470-R472 WeakPolarHBondContact OG-CG 3.22Å; R472-V474 PolarHBondContact O-N 3.08Å; R472-S475 PolarHBondContact O-N 2.99Å; R472-S475 PolarHBondContact O-OG 3.06Å; R472-V476 PolarHBondContact O-N 3.21Å
473	H	79.4	Confident	78.9	Confident	13 Å²	13	57.2 Å²	57.2	6%	0.06	29%	0.286	C	S	.	.	H	α-helix	trans	-63	-30.6	173.8	61.6	-86.6	0	0	0	112	L464 F466 S470 E471 I477	L464-H473 HydrophobicContact CD1-CB 3.9Å; F466-H473 AromaticContact CE2-CE1 3.92Å; S470-H473 PolarHBondContact O-CE1 3.36Å; S470-H473 PolarHBondContact O-ND1 3.29Å; S470-H473 VanDerWaalsContact O-ND1 3.08Å; E471-H473 PolarHBondContact O-N 2.88Å; H473-I477 VanDerWaalsContact O-CD1 3.29Å; H473-I477 WeakPolarHBondContact O-CD1 3.29Å; H473-I477 WeakPolarHBondContact O-CG1 3.49Å; H473-I477 PolarHBondContact O-N 3.48Å; H473-I477 VanDerWaalsContact O-N 3.15Å
474	V	84.1	Confident	79.9	Confident	13 Å²	13	51.6 Å²	51.6	8%	0.079	26%	0.256	C	S	.	.	H	α-helix	trans	-72.9	-41.5	178.1	-178.3	0	0	0	0	111.6	Y435 E471 R472 I477 N478	Y435-V474 HydrophobicContact CD1-CG1 4.5Å; Y435-V474 HydrophobicContact CD2-CG1 4.32Å; Y435-V474 HydrophobicContact CD2-CG2 4.44Å; Y435-V474 HydrophobicContact CE1-CG1 3.85Å; Y435-V474 HydrophobicContact CE2-CB 4.42Å; Y435-V474 HydrophobicContact CE2-CG1 3.64Å; Y435-V474 HydrophobicContact CE2-CG2 3.87Å; E471-V474 HydrophobicContact CB-CB 4.14Å; E471-V474 HydrophobicContact CB-CG2 3.92Å; E471-V474 HydrophobicContact CG-CG2 4.38Å; E471-V474 WeakPolarHBondContact O-CA 3.29Å; E471-V474 VanDerWaalsContact O-CB 3.24Å; E471-V474 WeakPolarHBondContact O-CB 3.31Å; E471-V474 PolarHBondContact O-N 2.78Å; R472-V474 PolarHBondContact O-N 3.08Å; V474-I477 PolarHBondContact O-N 3.01Å; V474-N478 WeakPolarHBondContact CG1-ND2 3.41Å; V474-N478 PolarHBondContact O-N 3.18Å; V474-N478 VanDerWaalsContact O-N 3.08Å; V474-N478 PolarHBondContact O-ND2 2.93Å
475	S	83.8	Confident	80.6	Confident	62 Å²	62	51 Å²	51	43%	0.434	25%	0.253	S	S	.	.	H	α-helix	trans	-62.1	-47.5	175.9	60.2	0	0	0	0	110.7	E471 R472 I477 N478 D479	E471-S475 PolarHBondContact O-N 3.46Å; R472-S475 PolarHBondContact O-N 2.99Å; R472-S475 PolarHBondContact O-OG 3.06Å; S475-I477 VanDerWaalsContact C-N 3.29Å; S475-I477 PolarHBondContact O-N 2.87Å; S475-N478 PolarHBondContact O-N 3.36Å; S475-D479 WeakPolarHBondContact O-CB 3.37Å; S475-D479 VanDerWaalsContact O-CG 3.23Å; S475-D479 PolarHBondContact O-N 3.46Å
476	V	85.4	Confident	81.2	Confident	26 Å²	26	52.9 Å²	52.9	16%	0.158	26%	0.255	C	S	.	.	H	α-helix	trans	-53.5	-42.8	175.3	169.9	0	0	0	0	112.6	M462 L464 R472 A480	M462-V476 HydrophobicContact CB-CG1 3.84Å; M462-V476 HydrophobicContact CE-CB 4.34Å; M462-V476 HydrophobicContact CE-CG1 3.96Å; M462-V476 HydrophobicContact SD-CG1 4.28Å; L464-V476 HydrophobicContact CD1-CB 4.26Å; L464-V476 HydrophobicContact CD1-CG1 3.92Å; R472-V476 PolarHBondContact O-N 3.21Å; V476-A480 VanDerWaalsContact O-CB 3.3Å; V476-A480 WeakPolarHBondContact O-CB 3.31Å; V476-A480 PolarHBondContact O-N 2.95Å; V476-A480 VanDerWaalsContact O-N 3.11Å
477	I	86.9	Confident	81.7	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-65.8	-39.6	177.3	-69.8	162.3	0	0	0	111.9	L379 I383 L432 I439 H473 V474 S475 Y481	L379-I477 HydrophobicContact CD2-CD1 4.47Å; I383-I477 HydrophobicContact CD1-CG1 3.84Å; I383-I477 HydrophobicContact CD1-CG2 4.45Å; L432-I477 HydrophobicContact CD2-CD1 3.95Å; I439-I477 HydrophobicContact CD1-CD1 4.36Å; I439-I477 HydrophobicContact CD1-CG2 4.43Å; I439-I477 HydrophobicContact CG1-CG2 3.79Å; H473-I477 VanDerWaalsContact O-CD1 3.29Å; H473-I477 WeakPolarHBondContact O-CD1 3.29Å; H473-I477 WeakPolarHBondContact O-CG1 3.49Å; H473-I477 PolarHBondContact O-N 3.48Å; H473-I477 VanDerWaalsContact O-N 3.15Å; V474-I477 PolarHBondContact O-N 3.01Å; S475-I477 VanDerWaalsContact C-N 3.29Å; S475-I477 PolarHBondContact O-N 2.87Å; I477-Y481 WeakPolarHBondContact O-CB 3.5Å; I477-Y481 PolarHBondContact O-N 2.87Å; I477-Y481 VanDerWaalsContact O-N 3.11Å
478	N	88.5	Confident	82.4	Confident	26 Å²	26	53.8 Å²	53.8	14%	0.139	26%	0.259	C	S	.	.	H	α-helix	trans	-73.1	-44.2	179.4	-75.4	-81.6	0	0	0	112.1	K438 V474 S475 A480 Y481 Y482	K438-N478 PolarHBondContact NZ-OD1 3.19Å; V474-N478 WeakPolarHBondContact CG1-ND2 3.41Å; V474-N478 PolarHBondContact O-N 3.18Å; V474-N478 VanDerWaalsContact O-N 3.08Å; V474-N478 PolarHBondContact O-ND2 2.93Å; S475-N478 PolarHBondContact O-N 3.36Å; N478-A480 VanDerWaalsContact C-N 3.32Å; N478-A480 PolarHBondContact O-N 3.19Å; N478-Y481 WeakPolarHBondContact O-CB 3.29Å; N478-Y481 PolarHBondContact O-N 3.41Å; N478-Y482 HydrophobicContact CB-CE2 4.32Å; N478-Y482 WeakPolarHBondContact O-CD2 3.46Å; N478-Y482 PolarHBondContact O-N 3.22Å
479	D	86.8	Confident	83.4	Confident	86 Å²	86	53.1 Å²	53.1	46%	0.46	25%	0.254	S	S	.	.	H	α-helix	trans	-60.1	-43.6	178.4	-64.6	-29.5	0	0	0	110.8	M462 S475 Y482 F483	M462-D479 HydrophobicContact CE-CB 3.78Å; S475-D479 WeakPolarHBondContact O-CB 3.37Å; S475-D479 VanDerWaalsContact O-CG 3.23Å; S475-D479 PolarHBondContact O-N 3.46Å; D479-Y482 PolarHBondContact O-N 3.28Å; D479-F483 WeakPolarHBondContact O-CB 3.4Å; D479-F483 PolarHBondContact O-N 3.47Å
480	A	86.6	Confident	84.4	Confident	5 Å²	5	52 Å²	52	4%	0.041	24%	0.244	C	C	.	.	H	α-helix	trans	-68.1	-34.8	175.7	0	0	0	0	0	113.6	I383 M462 V476 N478 F483 A484	I383-A480 HydrophobicContact CG2-CB 3.26Å; M462-A480 HydrophobicContact CE-CB 4.4Å; M462-A480 HydrophobicContact SD-CB 3.86Å; V476-A480 VanDerWaalsContact O-CB 3.3Å; V476-A480 WeakPolarHBondContact O-CB 3.31Å; V476-A480 PolarHBondContact O-N 2.95Å; V476-A480 VanDerWaalsContact O-N 3.11Å; N478-A480 VanDerWaalsContact C-N 3.32Å; N478-A480 PolarHBondContact O-N 3.19Å; A480-F483 PolarHBondContact O-N 2.9Å; A480-A484 WeakPolarHBondContact O-CB 3.27Å; A480-A484 PolarHBondContact O-N 3.49Å
481	Y	89.1	Confident	85.2	Confident	21 Å²	21	50.5 Å²	50.5	8%	0.082	23%	0.233	C	C	.	.	H	α-helix	trans	-61.6	-50	171.8	164.2	-94.5	0	0	0	111.2	K438 R441 T442 Y445 I477 N478 F483 A484 A485 D703	K438-Y481 HydrophobicContact CB-CD2 4.26Å; K438-Y481 HydrophobicContact CD-CD1 4.41Å; K438-Y481 HydrophobicContact CD-CG 4.42Å; R441-Y481 HydrophobicContact CB-CD2 4.35Å; R441-Y481 HydrophobicContact CB-CE2 4.03Å; T442-Y481 VanDerWaalsContact OG1-CA 3.32Å; T442-Y481 WeakPolarHBondContact OG1-CA 3.27Å; T442-Y481 WeakPolarHBondContact OG1-CB 3.23Å; Y445-Y481 HydrophobicContact CE2-CE2 4.1Å; I477-Y481 WeakPolarHBondContact O-CB 3.5Å; I477-Y481 PolarHBondContact O-N 2.87Å; I477-Y481 VanDerWaalsContact O-N 3.11Å; N478-Y481 WeakPolarHBondContact O-CB 3.29Å; N478-Y481 PolarHBondContact O-N 3.41Å; Y481-F483 VanDerWaalsContact C-N 3.33Å; Y481-F483 PolarHBondContact O-N 3.34Å; Y481-A484 PolarHBondContact O-N 2.9Å; Y481-A485 VanDerWaalsContact O-CB 3.29Å; Y481-A485 WeakPolarHBondContact O-CB 3.45Å; Y481-A485 PolarHBondContact O-N 3.42Å; Y481-D703 PolarHBondContact OH-OD2 2.86Å
482	Y	87.9	Confident	85.8	Confident	110 Å²	110	44.1 Å²	44.1	43%	0.431	20%	0.204	S	C	.	.	H	α-helix	trans	-64.8	-36.7	178	-68.5	-58.4	0	0	0	112.2	N478 D479 R486 N701	N478-Y482 HydrophobicContact CB-CE2 4.32Å; N478-Y482 WeakPolarHBondContact O-CD2 3.46Å; N478-Y482 PolarHBondContact O-N 3.22Å; D479-Y482 PolarHBondContact O-N 3.28Å; Y482-R486 WeakPolarHBondContact O-CB 3.01Å; Y482-R486 PolarHBondContact O-N 3.01Å; Y482-N701 WeakPolarHBondContact CD1-OD1 3.4Å
483	F	86.6	Confident	86.1	Confident	73 Å²	73	38.6 Å²	38.6	32%	0.32	19%	0.186	S	C	.	.	H	α-helix	trans	-61.4	-51	172.9	-179.5	-105.2	0	0	0	112	T459 D479 A480 Y481 R486 M487	T459-F483 WeakPolarHBondContact OG1-CE2 3.5Å; T459-F483 VanDerWaalsContact OG1-CZ 3.3Å; T459-F483 WeakPolarHBondContact OG1-CZ 3.35Å; D479-F483 WeakPolarHBondContact O-CB 3.4Å; D479-F483 PolarHBondContact O-N 3.47Å; A480-F483 PolarHBondContact O-N 2.9Å; Y481-F483 VanDerWaalsContact C-N 3.33Å; Y481-F483 PolarHBondContact O-N 3.34Å; F483-R486 PolarHBondContact O-N 3.2Å; F483-M487 HydrophobicContact CD1-SD 4.19Å; F483-M487 HydrophobicContact CE1-CG 4.29Å; F483-M487 HydrophobicContact CE1-SD 3.46Å; F483-M487 WeakPolarHBondContact CE1-SD 3.41Å; F483-M487 HydrophobicContact CE2-CG 4.35Å; F483-M487 HydrophobicContact CE2-SD 4.25Å; F483-M487 HydrophobicContact CZ-CG 4.17Å; F483-M487 HydrophobicContact CZ-SD 3.49Å; F483-M487 WeakPolarHBondContact CZ-SD 3.41Å; F483-M487 WeakPolarHBondContact O-CB 3.38Å; F483-M487 WeakPolarHBondContact O-CG 3.4Å; F483-M487 PolarHBondContact O-N 3.49Å
484	A	87.2	Confident	86.2	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.008	21%	0.212	C	C	.	.	H	α-helix	trans	-64.1	-41.6	179	0	0	0	0	0	112.5	T442 L446 A480 Y481 M487 L488	T442-A484 HydrophobicContact CG2-CB 3.88Å; L446-A484 HydrophobicContact CD2-CB 3.76Å; L446-A484 HydrophobicContact CG-CB 4.04Å; A480-A484 WeakPolarHBondContact O-CB 3.27Å; A480-A484 PolarHBondContact O-N 3.49Å; Y481-A484 PolarHBondContact O-N 2.9Å; A484-M487 PolarHBondContact O-N 2.82Å; A484-L488 PolarHBondContact O-N 3.13Å
485	A	87.6	Confident	86.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63.5	-43.9	176.2	0	0	0	0	0	111.8	Y445 Y481 L488 L489 N701 V702	Y445-A485 HydrophobicContact CD2-CB 4.16Å; Y445-A485 HydrophobicContact CE2-CB 4.09Å; Y481-A485 VanDerWaalsContact O-CB 3.29Å; Y481-A485 WeakPolarHBondContact O-CB 3.45Å; Y481-A485 PolarHBondContact O-N 3.42Å; A485-L488 PolarHBondContact O-N 2.88Å; A485-L489 WeakPolarHBondContact O-CB 3.16Å; A485-L489 PolarHBondContact O-N 2.93Å; A485-N701 HydrophobicContact CB-CB 4.46Å; A485-N701 WeakPolarHBondContact CB-OD1 3.43Å; A485-V702 WeakPolarHBondContact O-CG2 3.48Å
486	R	87	Confident	86	Confident	172 Å²	172	46.4 Å²	46.4	65%	0.649	22%	0.224	S	C	*	.	H	α-helix	trans	-67.8	-38.8	177.1	-174.6	175.2	178.5	132.6	1.6	112.5	Y482 F483 L489 D490	Y482-R486 WeakPolarHBondContact O-CB 3.01Å; Y482-R486 PolarHBondContact O-N 3.01Å; F483-R486 PolarHBondContact O-N 3.2Å; R486-L489 PolarHBondContact O-N 3.38Å; R486-D490 PolarHBondContact O-N 3.5Å
487	M	84.8	Confident	86.1	Confident	44 Å²	44	48 Å²	48	22%	0.217	23%	0.232	C	C	.	.	H	α-helix	trans	-62.3	-42.6	173.7	-77.6	-163.6	76.7	0	0	112	I449 F483 A484 V491	I449-M487 HydrophobicContact CD1-CB 3.7Å; F483-M487 HydrophobicContact CD1-SD 4.19Å; F483-M487 HydrophobicContact CE1-CG 4.29Å; F483-M487 HydrophobicContact CE1-SD 3.46Å; F483-M487 WeakPolarHBondContact CE1-SD 3.41Å; F483-M487 HydrophobicContact CE2-CG 4.35Å; F483-M487 HydrophobicContact CE2-SD 4.25Å; F483-M487 HydrophobicContact CZ-CG 4.17Å; F483-M487 HydrophobicContact CZ-SD 3.49Å; F483-M487 WeakPolarHBondContact CZ-SD 3.41Å; F483-M487 WeakPolarHBondContact O-CB 3.38Å; F483-M487 WeakPolarHBondContact O-CG 3.4Å; F483-M487 PolarHBondContact O-N 3.49Å; A484-M487 PolarHBondContact O-N 2.82Å; M487-V491 VanDerWaalsContact O-CG2 3.3Å; M487-V491 WeakPolarHBondContact O-CG2 3.25Å; M487-V491 PolarHBondContact O-N 2.92Å; M487-V491 VanDerWaalsContact O-N 3.15Å
488	L	86.7	Confident	86.3	Confident	3 Å²	3	48 Å²	48	2%	0.016	23%	0.231	C	C	.	.	H	α-helix	trans	-69.6	-36.7	177.6	-179.4	60.3	0	0	0	111.5	Y445 V448 I449 A484 A485 V491 L492 V702	Y445-L488 HydrophobicContact CD1-CD2 3.44Å; Y445-L488 VanDerWaalsContact CD1-CD2 3.44Å; Y445-L488 HydrophobicContact CE1-CD2 4.22Å; Y445-L488 HydrophobicContact CG-CD2 3.8Å; V448-L488 HydrophobicContact CB-CD1 4.22Å; V448-L488 HydrophobicContact CG1-CD1 3.49Å; V448-L488 VanDerWaalsContact CG1-CD1 3.49Å; V448-L488 HydrophobicContact CG1-CD2 4.42Å; I449-L488 HydrophobicContact CD1-CB 4.05Å; I449-L488 HydrophobicContact CG1-CB 4.16Å; I449-L488 HydrophobicContact CG1-CD1 4.08Å; A484-L488 PolarHBondContact O-N 3.13Å; A485-L488 PolarHBondContact O-N 2.88Å; L488-V491 PolarHBondContact O-N 3.33Å; L488-L492 HydrophobicContact CD1-CD1 4.2Å; L488-L492 HydrophobicContact CD1-CG 4.2Å; L488-L492 HydrophobicContact CG-CD1 3.96Å; L488-L492 HydrophobicContact CG-CG 4.42Å; L488-L492 WeakPolarHBondContact O-CB 3.47Å; L488-L492 WeakPolarHBondContact O-CG 3.06Å; L488-L492 PolarHBondContact O-N 3.15Å; L488-V702 HydrophobicContact CB-CG2 3.99Å; L488-V702 HydrophobicContact CD2-CG1 4.34Å; L488-V702 HydrophobicContact CD2-CG2 4.11Å; L488-V702 HydrophobicContact CG-CG2 3.89Å
489	L	87.8	Confident	86.4	Confident	12 Å²	12	48.6 Å²	48.6	6%	0.063	23%	0.234	C	C	.	.	H	α-helix	trans	-61.7	-44.1	175.7	-174.5	65.3	0	0	0	111.8	A485 R486 L492 L493 V699 E700 V702 V705	A485-L489 WeakPolarHBondContact O-CB 3.16Å; A485-L489 PolarHBondContact O-N 2.93Å; R486-L489 PolarHBondContact O-N 3.38Å; L489-L492 PolarHBondContact O-N 3Å; L489-L493 HydrophobicContact CD1-CD1 3.72Å; L489-L493 HydrophobicContact CD1-CG 3.97Å; L489-L493 HydrophobicContact CD2-CD1 4.46Å; L489-L493 HydrophobicContact CG-CD1 3.83Å; L489-L493 HydrophobicContact CG-CG 4.3Å; L489-L493 WeakPolarHBondContact O-CB 3.38Å; L489-L493 WeakPolarHBondContact O-CG 3.46Å; L489-L493 PolarHBondContact O-N 3.44Å; L489-V699 HydrophobicContact CD1-CG1 4.33Å; L489-V699 HydrophobicContact CD2-CG1 4.08Å; L489-V699 WeakPolarHBondContact CD2-O 3.47Å; L489-E700 VanDerWaalsContact CD2-C 3.46Å; L489-V702 HydrophobicContact CB-CG2 3.82Å; L489-V702 HydrophobicContact CD1-CG2 4.25Å; L489-V705 HydrophobicContact CD1-CG2 3.53Å
490	D	85.9	Confident	86.5	Confident	82 Å²	82	44.8 Å²	44.8	44%	0.439	21%	0.214	S	C	.	.	H	α-helix	trans	-59.4	-51.9	174.6	-177.7	35.8	0	0	0	111.1	R486 L492 L493 T494	R486-D490 PolarHBondContact O-N 3.5Å; D490-L492 VanDerWaalsContact C-N 3.28Å; D490-L492 PolarHBondContact O-N 3.35Å; D490-L493 PolarHBondContact O-N 2.92Å; D490-L493 VanDerWaalsContact O-N 3.15Å; D490-T494 PolarHBondContact O-N 2.99Å; D490-T494 PolarHBondContact O-OG1 3.42Å; D490-T494 WeakPolarHBondContact OD1-CG2 3.29Å; D490-T494 PolarHBondContact OD1-OG1 3.45Å
491	V	86.1	Confident	86.8	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.006	22%	0.216	C	C	.	.	I	π-helix	trans	-52.9	-42.6	175.8	171.6	0	0	0	0	112.5	K454 M487 L488 N496	K454-V491 HydrophobicContact CD-CG2 3.8Å; M487-V491 VanDerWaalsContact O-CG2 3.3Å; M487-V491 WeakPolarHBondContact O-CG2 3.25Å; M487-V491 PolarHBondContact O-N 2.92Å; M487-V491 VanDerWaalsContact O-N 3.15Å; L488-V491 PolarHBondContact O-N 3.33Å; V491-N496 PolarHBondContact O-N 3.36Å; V491-N496 PolarHBondContact O-ND2 2.95Å
492	L	85.4	Confident	86.9	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.01	21%	0.212	C	C	.	.	I	π-helix	trans	-73.3	-37.5	-180	-71.7	169.9	0	0	0	113.1	L488 L489 D490 L498 P608 V612 V702	L488-L492 HydrophobicContact CD1-CD1 4.2Å; L488-L492 HydrophobicContact CD1-CG 4.2Å; L488-L492 HydrophobicContact CG-CD1 3.96Å; L488-L492 HydrophobicContact CG-CG 4.42Å; L488-L492 WeakPolarHBondContact O-CB 3.47Å; L488-L492 WeakPolarHBondContact O-CG 3.06Å; L488-L492 PolarHBondContact O-N 3.15Å; L489-L492 PolarHBondContact O-N 3Å; D490-L492 VanDerWaalsContact C-N 3.28Å; D490-L492 PolarHBondContact O-N 3.35Å; L492-L498 HydrophobicContact CB-CD2 4.32Å; L492-L498 WeakPolarHBondContact O-CB 3.38Å; L492-L498 PolarHBondContact O-N 3.04Å; L492-L498 VanDerWaalsContact O-N 3.14Å; L492-P608 HydrophobicContact CD2-CB 4.16Å; L492-P608 HydrophobicContact CD2-CG 4.07Å; L492-V612 HydrophobicContact CD1-CG2 4.43Å; L492-V702 HydrophobicContact CD1-CG1 4.02Å; L492-V702 HydrophobicContact CD1-CG2 4.2Å
493	L	85.1	Confident	87	Confident	57 Å²	57	42.8 Å²	42.8	30%	0.298	21%	0.209	S	C	.	.	I	π-helix	trans	-88.6	-39.8	-174.6	-65.9	-176.2	0	0	0	114.2	L489 D490 L498 M696	L489-L493 HydrophobicContact CD1-CD1 3.72Å; L489-L493 HydrophobicContact CD1-CG 3.97Å; L489-L493 HydrophobicContact CD2-CD1 4.46Å; L489-L493 HydrophobicContact CG-CD1 3.83Å; L489-L493 HydrophobicContact CG-CG 4.3Å; L489-L493 WeakPolarHBondContact O-CB 3.38Å; L489-L493 WeakPolarHBondContact O-CG 3.46Å; L489-L493 PolarHBondContact O-N 3.44Å; D490-L493 PolarHBondContact O-N 2.92Å; D490-L493 VanDerWaalsContact O-N 3.15Å; L493-L498 HydrophobicContact CD2-CB 4.42Å; L493-L498 HydrophobicContact CD2-CD2 4.37Å; L493-M696 HydrophobicContact CD2-CE 3.75Å
494	T	81.9	Confident	87.3	Confident	97 Å²	97	39.3 Å²	39.3	60%	0.595	19%	0.194	S	C	*	.	I	π-helix	trans	-97.6	-30.8	-170.3	64.4	0	0	0	0	113.9	D490	D490-T494 PolarHBondContact O-N 2.99Å; D490-T494 PolarHBondContact O-OG1 3.42Å; D490-T494 WeakPolarHBondContact OD1-CG2 3.29Å; D490-T494 PolarHBondContact OD1-OG1 3.45Å
495	E	81.4	Confident	87.6	Confident	109 Å²	109	39.3 Å²	39.3	51%	0.509	19%	0.193	S	C	.	.	I	π-helix	trans	-100.7	-37.9	-178	-68.4	178.2	155.8	0	0	113.8	K454	K454-E495 WeakPolarHBondContact CE-OE1 3.38Å; K454-E495 WeakPolarHBondContact CE-OE2 3.35Å; K454-E495 IonicContact NZ-OE1 3.13Å; K454-E495 PolarHBondContact NZ-OE1 3.08Å; K454-E495 IonicContact NZ-OE2 3.21Å; K454-E495 PolarHBondContact NZ-OE2 2.96Å
496	N	81.8	Confident	87.8	Confident	47 Å²	47	39.8 Å²	39.8	25%	0.251	20%	0.195	S	C	.	.	S	Bend	trans	-104.2	7.2	-175.5	-62.7	-86.7	0	0	0	113.2	V491 L498 H501 P608	V491-N496 PolarHBondContact O-N 3.36Å; V491-N496 PolarHBondContact O-ND2 2.95Å; N496-L498 VanDerWaalsContact C-N 3.3Å; N496-L498 PolarHBondContact O-N 2.66Å; N496-L498 VanDerWaalsContact O-N 3.1Å; N496-H501 PolarHBondContact O-CD2 2.96Å; N496-P608 HydrophobicContact CB-CG 4.4Å; N496-P608 VanDerWaalsContact OD1-CD 3.27Å; N496-P608 WeakPolarHBondContact OD1-CD 3.37Å
497	D	87.8	Confident	88	Confident	60 Å²	60	34.5 Å²	34.5	32%	0.321	18%	0.176	S	C	.	.			trans	32.2	58.4	-178.5	-170.1	16.9	0	0	0	114.1	M499 G500 H501	D497-M499 PolarHBondContact O-N 2.8Å; D497-M499 PolarHBondContact OD1-N 2.99Å; D497-G500 VanDerWaalsContact CG-N 3.3Å; D497-G500 WeakPolarHBondContact O-CA 3.17Å; D497-G500 PolarHBondContact O-N 3.28Å; D497-G500 PolarHBondContact OD1-N 3.06Å; D497-G500 WeakPolarHBondContact OD2-CA 3.46Å; D497-H501 PolarHBondContact O-CD2 2.87Å; D497-H501 PolarHBondContact O-N 2.8Å; D497-H501 VanDerWaalsContact O-N 3.08Å
498	L	89.5	Confident	88.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-52.9	-28.1	174	174.8	63.9	0	0	0	111.9	L492 L493 N496 L502 C609 V612 M696 V705	L492-L498 HydrophobicContact CB-CD2 4.32Å; L492-L498 WeakPolarHBondContact O-CB 3.38Å; L492-L498 PolarHBondContact O-N 3.04Å; L492-L498 VanDerWaalsContact O-N 3.14Å; L493-L498 HydrophobicContact CD2-CB 4.42Å; L493-L498 HydrophobicContact CD2-CD2 4.37Å; N496-L498 VanDerWaalsContact C-N 3.3Å; N496-L498 PolarHBondContact O-N 2.66Å; N496-L498 VanDerWaalsContact O-N 3.1Å; L498-L502 HydrophobicContact CD1-CD1 4.27Å; L498-L502 HydrophobicContact CD1-CG 4.41Å; L498-L502 HydrophobicContact CG-CD1 4.03Å; L498-L502 VanDerWaalsContact O-CB 3.3Å; L498-L502 WeakPolarHBondContact O-CB 3.47Å; L498-L502 WeakPolarHBondContact O-CD1 3.28Å; L498-L502 WeakPolarHBondContact O-CG 3.37Å; L498-L502 PolarHBondContact O-N 3Å; L498-C609 HydrophobicContact CD1-CB 4.32Å; L498-V612 HydrophobicContact CD1-CB 4.04Å; L498-V612 HydrophobicContact CD1-CG1 4.24Å; L498-V612 HydrophobicContact CD1-CG2 4.45Å; L498-V612 HydrophobicContact CD2-CB 4.24Å; L498-V612 HydrophobicContact CD2-CG1 4.27Å; L498-V612 HydrophobicContact CD2-CG2 3.86Å; L498-M696 HydrophobicContact CD2-CE 4.38Å; L498-V705 HydrophobicContact CD2-CG1 4.21Å
499	M	90.6	Very high	88.6	Confident	39 Å²	39	32.2 Å²	32.2	19%	0.192	16%	0.164	C	C	.	.	H	α-helix	trans	-76.1	-32.5	178.7	-163	65.7	-96.7	0	0	112.7	D497 L502 Q503 W689 I693 M696	D497-M499 PolarHBondContact O-N 2.8Å; D497-M499 PolarHBondContact OD1-N 2.99Å; M499-L502 HydrophobicContact CE-CB 3.67Å; M499-L502 HydrophobicContact CE-CD1 4.18Å; M499-Q503 HydrophobicContact CE-CG 4.37Å; M499-Q503 VanDerWaalsContact O-CG 3.3Å; M499-Q503 WeakPolarHBondContact O-CG 3.34Å; M499-Q503 PolarHBondContact O-N 3.22Å; M499-Q503 VanDerWaalsContact O-N 3.1Å; M499-Q503 PolarHBondContact O-NE2 2.98Å; M499-W689 HydrophobicContact CE-CH2 4.29Å; M499-W689 HydrophobicContact CE-CZ2 4.22Å; M499-I693 HydrophobicContact CE-CD1 3.21Å; M499-I693 HydrophobicContact SD-CD1 3.68Å; M499-M696 HydrophobicContact SD-CG 4.24Å
500	G	90.3	Very high	88.8	Confident	5 Å²	5	31.9 Å²	31.9	5%	0.052	16%	0.163	C	C	.	.	H	α-helix	trans	-62.3	-54.6	166.5	0	0	0	0	0	111.5	D497 L502 Q503 S504	D497-G500 VanDerWaalsContact CG-N 3.3Å; D497-G500 WeakPolarHBondContact O-CA 3.17Å; D497-G500 PolarHBondContact O-N 3.28Å; D497-G500 PolarHBondContact OD1-N 3.06Å; D497-G500 WeakPolarHBondContact OD2-CA 3.46Å; G500-L502 VanDerWaalsContact C-N 3.34Å; G500-L502 PolarHBondContact O-N 3.01Å; G500-Q503 WeakPolarHBondContact O-CA 3.46Å; G500-Q503 WeakPolarHBondContact O-CB 3.38Å; G500-Q503 PolarHBondContact O-N 3.01Å; G500-S504 PolarHBondContact O-N 3.45Å; G500-S504 PolarHBondContact O-OG 2.96Å
501	H	91.4	Very high	89	Confident	16 Å²	16	28.5 Å²	28.5	7%	0.074	15%	0.145	C	C	.	.	H	α-helix	trans	-56.7	-44.4	177.6	-74.2	-73.8	0	0	0	112.7	N496 D497 Q503 S504 V505 Y558 D561 Y603 L613	N496-H501 PolarHBondContact O-CD2 2.96Å; D497-H501 PolarHBondContact O-CD2 2.87Å; D497-H501 PolarHBondContact O-N 2.8Å; D497-H501 VanDerWaalsContact O-N 3.08Å; H501-Q503 VanDerWaalsContact C-N 3.32Å; H501-Q503 PolarHBondContact O-N 3.34Å; H501-S504 PolarHBondContact O-N 2.98Å; H501-V505 WeakPolarHBondContact O-CG2 3.49Å; H501-V505 PolarHBondContact O-N 2.99Å; H501-Y558 AromaticContact CE1-CD1 3.22Å; H501-Y558 WeakPolarHBondContact CE1-CD1 3.3Å; H501-Y558 AromaticContact CE1-CE1 3.55Å; H501-Y558 AromaticContact CE1-CG 3.91Å; H501-Y558 AromaticContact ND1-CD1 3.55Å; H501-Y558 AromaticContact ND1-CG 3.74Å; H501-Y558 AromaticContact NE2-CD1 3.78Å; H501-Y558 AromaticContact NE2-CE1 3.6Å; H501-D561 IonicContact CE1-OD2 3.09Å; H501-Y603 WeakPolarHBondContact CA-OH 3.49Å; H501-Y603 HydrophobicContact CB-CE1 4.36Å; H501-Y603 AromaticContact ND1-CZ 3.9Å; H501-Y603 PolarHBondContact ND1-OH 3.05Å; H501-L613 HydrophobicContact CB-CD1 4.21Å
502	L	91.8	Very high	89.1	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.5	-36.7	175	-84.5	165.3	0	0	0	112.5	L498 M499 G500 K506 L613 W689 F692 M696	L498-L502 HydrophobicContact CD1-CD1 4.27Å; L498-L502 HydrophobicContact CD1-CG 4.41Å; L498-L502 HydrophobicContact CG-CD1 4.03Å; L498-L502 VanDerWaalsContact O-CB 3.3Å; L498-L502 WeakPolarHBondContact O-CB 3.47Å; L498-L502 WeakPolarHBondContact O-CD1 3.28Å; L498-L502 WeakPolarHBondContact O-CG 3.37Å; L498-L502 PolarHBondContact O-N 3Å; M499-L502 HydrophobicContact CE-CB 3.67Å; M499-L502 HydrophobicContact CE-CD1 4.18Å; G500-L502 VanDerWaalsContact C-N 3.34Å; G500-L502 PolarHBondContact O-N 3.01Å; L502-K506 PolarHBondContact O-N 3.46Å; L502-K506 VanDerWaalsContact O-N 3.13Å; L502-L613 HydrophobicContact CD2-CD2 3.84Å; L502-W689 HydrophobicContact CB-CH2 4.24Å; L502-W689 WeakPolarHBondContact O-CH2 3.33Å; L502-F692 HydrophobicContact CD1-CE1 4.22Å; L502-F692 HydrophobicContact CD1-CZ 4.06Å; L502-F692 HydrophobicContact CD2-CE1 4.49Å; L502-M696 HydrophobicContact CD1-CE 4.46Å
503	Q	91.4	Very high	89.2	Confident	79 Å²	79	34.1 Å²	34.1	37%	0.369	17%	0.173	S	C	.	.	H	α-helix	trans	-66.5	-41.6	173.4	-78.7	176	59.8	0	0	112.4	M499 G500 H501 K506 R507 W689	M499-Q503 HydrophobicContact CE-CG 4.37Å; M499-Q503 VanDerWaalsContact O-CG 3.3Å; M499-Q503 WeakPolarHBondContact O-CG 3.34Å; M499-Q503 PolarHBondContact O-N 3.22Å; M499-Q503 VanDerWaalsContact O-N 3.1Å; M499-Q503 PolarHBondContact O-NE2 2.98Å; G500-Q503 WeakPolarHBondContact O-CA 3.46Å; G500-Q503 WeakPolarHBondContact O-CB 3.38Å; G500-Q503 PolarHBondContact O-N 3.01Å; H501-Q503 VanDerWaalsContact C-N 3.32Å; H501-Q503 PolarHBondContact O-N 3.34Å; Q503-K506 PolarHBondContact O-N 3.05Å; Q503-K506 VanDerWaalsContact O-N 3.16Å; Q503-R507 WeakPolarHBondContact O-CG 3.32Å; Q503-R507 PolarHBondContact O-N 3.15Å; Q503-R507 VanDerWaalsContact OE1-NH2 3.11Å; Q503-W689 HydrophobicContact CG-CZ2 4.4Å
504	S	91.6	Very high	89.3	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62	-43.1	176	-58.9	0	0	0	0	111.3	G500 H501 K506 R507 Y508 D556	G500-S504 PolarHBondContact O-N 3.45Å; G500-S504 PolarHBondContact O-OG 2.96Å; H501-S504 PolarHBondContact O-N 2.98Å; S504-K506 VanDerWaalsContact C-N 3.29Å; S504-K506 PolarHBondContact O-N 2.97Å; S504-R507 PolarHBondContact O-N 3.39Å; S504-Y508 WeakPolarHBondContact O-CD2 3.5Å; S504-Y508 PolarHBondContact O-N 2.8Å; S504-D556 VanDerWaalsContact CB-OD2 3.31Å; S504-D556 WeakPolarHBondContact CB-OD2 3.16Å; S504-D556 VanDerWaalsContact OG-CG 3.32Å; S504-D556 PolarHBondContact OG-OD1 3.4Å; S504-D556 PolarHBondContact OG-OD2 3.38Å
505	V	92.8	Very high	89.7	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-55.3	-43.2	171.3	173	0	0	0	0	111.5	H501 L509 Y603 L613 Y621	H501-V505 WeakPolarHBondContact O-CG2 3.49Å; H501-V505 PolarHBondContact O-N 2.99Å; V505-L509 HydrophobicContact CG1-CB 4.48Å; V505-L509 WeakPolarHBondContact O-CB 3.33Å; V505-L509 PolarHBondContact O-N 2.71Å; V505-Y603 HydrophobicContact CG2-CD1 3.35Å; V505-Y603 HydrophobicContact CG2-CE1 3.47Å; V505-Y603 VanDerWaalsContact CG2-CE1 3.47Å; V505-Y603 HydrophobicContact CG2-CG 4.02Å; V505-L613 HydrophobicContact CG2-CD1 4.21Å; V505-Y621 HydrophobicContact CG1-CD1 3.81Å; V505-Y621 HydrophobicContact CG1-CD2 3.73Å; V505-Y621 HydrophobicContact CG1-CE1 3.74Å; V505-Y621 HydrophobicContact CG1-CE2 3.67Å; V505-Y621 HydrophobicContact CG1-CG 3.82Å
506	K	92.8	Very high	90.3	Very high	10 Å²	10	26 Å²	26	4%	0.043	14%	0.139	C	C	.	.	H	α-helix	trans	-66	-41	173.7	173.3	170.8	177.1	-179.9	0	113.2	L502 Q503 S504 Y508 L510 N512 E686 W689	L502-K506 PolarHBondContact O-N 3.46Å; L502-K506 VanDerWaalsContact O-N 3.13Å; Q503-K506 PolarHBondContact O-N 3.05Å; Q503-K506 VanDerWaalsContact O-N 3.16Å; S504-K506 VanDerWaalsContact C-N 3.29Å; S504-K506 PolarHBondContact O-N 2.97Å; K506-Y508 VanDerWaalsContact C-N 3.31Å; K506-Y508 PolarHBondContact O-N 2.7Å; K506-L510 HydrophobicContact CB-CD1 4.24Å; K506-L510 HydrophobicContact CG-CB 4.33Å; K506-L510 HydrophobicContact CG-CD1 4.21Å; K506-L510 WeakPolarHBondContact O-CB 3.43Å; K506-L510 PolarHBondContact O-N 3.02Å; K506-N512 HydrophobicContact CG-CB 3.95Å; K506-N512 WeakPolarHBondContact O-CB 3.29Å; K506-E686 WeakPolarHBondContact CE-OE2 3.41Å; K506-E686 IonicContact NZ-OE1 2.68Å; K506-E686 PolarHBondContact NZ-OE1 2.97Å; K506-E686 IonicContact NZ-OE2 3.96Å; K506-E686 PolarHBondContact NZ-OE2 3.1Å; K506-W689 HydrophobicContact CB-CH2 3.98Å; K506-W689 HydrophobicContact CB-CZ2 4.14Å; K506-W689 HydrophobicContact CB-CZ3 4.22Å; K506-W689 HydrophobicContact CD-CD2 3.49Å; K506-W689 VanDerWaalsContact CD-CD2 3.49Å; K506-W689 HydrophobicContact CD-CE3 4.04Å; K506-W689 HydrophobicContact CD-CG 3.75Å; K506-W689 HydrophobicContact CD-CH2 4.35Å; K506-W689 HydrophobicContact CD-CZ2 3.85Å; K506-W689 HydrophobicContact CD-CZ3 4.44Å; K506-W689 VanDerWaalsContact NZ-CG 3.34Å
507	R	90.9	Very high	90.6	Very high	61 Å²	61	24.1 Å²	24.1	23%	0.23	13%	0.129	C	C	.	.	H	α-helix	trans	-59.5	-43.4	-179.1	-72.7	171.8	-158.9	174	14.9	111.4	Q503 S504 N512 Q513 D556	Q503-R507 WeakPolarHBondContact O-CG 3.32Å; Q503-R507 PolarHBondContact O-N 3.15Å; Q503-R507 VanDerWaalsContact OE1-NH2 3.11Å; S504-R507 PolarHBondContact O-N 3.39Å; R507-N512 PolarHBondContact O-N 2.94Å; R507-Q513 HydrophobicContact CB-CB 4.1Å; R507-Q513 WeakPolarHBondContact O-CB 3.47Å; R507-Q513 PolarHBondContact O-N 3.28Å; R507-D556 IonicContact CZ-OD1 3.7Å; R507-D556 IonicContact NH1-OD1 2.8Å; R507-D556 PolarHBondContact NH1-OD1 2.93Å; R507-D556 IonicContact NH1-OD2 2.71Å; R507-D556 IonicContact NH2-OD1 2.73Å
508	Y	91.6	Very high	90.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-97.5	-55.5	-173.4	-52.7	-59.3	0	0	0	113.7	S504 K506 L511 F516 L548 A553 D556 K559 L562	S504-Y508 WeakPolarHBondContact O-CD2 3.5Å; S504-Y508 PolarHBondContact O-N 2.8Å; K506-Y508 VanDerWaalsContact C-N 3.31Å; K506-Y508 PolarHBondContact O-N 2.7Å; Y508-L511 PolarHBondContact O-N 2.86Å; Y508-F516 AromaticContact CD1-CD1 3.76Å; Y508-F516 HydrophobicContact CD1-CD1 3.76Å; Y508-F516 AromaticContact CD1-CE1 3.73Å; Y508-F516 HydrophobicContact CD1-CE1 3.73Å; Y508-F516 HydrophobicContact CD1-CG 4.45Å; Y508-F516 HydrophobicContact CD1-CZ 4.39Å; Y508-F516 HydrophobicContact CE1-CD1 4.17Å; Y508-F516 HydrophobicContact CE1-CE1 4.39Å; Y508-F516 HydrophobicContact CE1-CG 4.42Å; Y508-L548 HydrophobicContact CD1-CD2 4.42Å; Y508-L548 HydrophobicContact CE1-CD2 3.72Å; Y508-A553 HydrophobicContact CE1-CB 3.91Å; Y508-D556 WeakPolarHBondContact OH-CB 3.4Å; Y508-D556 PolarHBondContact OH-OD2 2.91Å; Y508-K559 HydrophobicContact CE2-CB 4.48Å; Y508-K559 WeakPolarHBondContact OH-CB 3.34Å; Y508-L562 HydrophobicContact CD1-CD2 3.83Å; Y508-L562 HydrophobicContact CD2-CD1 4.23Å; Y508-L562 HydrophobicContact CD2-CD2 3.98Å; Y508-L562 HydrophobicContact CE1-CD2 4.4Å; Y508-L562 HydrophobicContact CG-CD1 4.14Å; Y508-L562 HydrophobicContact CG-CD2 3.6Å; Y508-L562 HydrophobicContact CG-CG 4.47Å
509	L	91.8	Very high	90.8	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-79.1	-22.7	-173.4	-72.2	78.6	0	0	0	113.2	V505 L562 F601 F625	V505-L509 HydrophobicContact CG1-CB 4.48Å; V505-L509 WeakPolarHBondContact O-CB 3.33Å; V505-L509 PolarHBondContact O-N 2.71Å; L509-L562 HydrophobicContact CD1-CD1 3.92Å; L509-F601 HydrophobicContact CD1-CB 4.46Å; L509-F601 HydrophobicContact CG-CB 4.34Å; L509-F625 HydrophobicContact CB-CB 4.5Å; L509-F625 WeakPolarHBondContact O-CA 3.3Å; L509-F625 WeakPolarHBondContact O-CB 3.4Å
510	L	92.4	Very high	90.9	Very high	5 Å²	5	25.6 Å²	25.6	3%	0.026	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	14.3	174.2	-58.3	177.2	0	0	0	113.3	K506 N512 Y621 L624 I685 F712	K506-L510 HydrophobicContact CB-CD1 4.24Å; K506-L510 HydrophobicContact CG-CB 4.33Å; K506-L510 HydrophobicContact CG-CD1 4.21Å; K506-L510 WeakPolarHBondContact O-CB 3.43Å; K506-L510 PolarHBondContact O-N 3.02Å; L510-N512 PolarHBondContact O-N 2.8Å; L510-Y621 HydrophobicContact CD1-CD1 4.49Å; L510-Y621 HydrophobicContact CD1-CE1 4.12Å; L510-Y621 HydrophobicContact CD2-CD1 4.09Å; L510-Y621 HydrophobicContact CD2-CE1 4.47Å; L510-Y621 HydrophobicContact CG-CD1 4.26Å; L510-Y621 HydrophobicContact CG-CE1 4.37Å; L510-L624 HydrophobicContact CD2-CB 4.14Å; L510-L624 HydrophobicContact CD2-CD1 3.95Å; L510-I685 HydrophobicContact CB-CG2 4.34Å; L510-I685 HydrophobicContact CD1-CG2 3.95Å; L510-I685 HydrophobicContact CD2-CD1 4.26Å; L510-F712 HydrophobicContact CD1-CZ 4.1Å
511	L	90.1	Very high	90.9	Very high	11 Å²	11	25.5 Å²	25.5	6%	0.058	13%	0.133	C	C	.	.			trans	54.5	17.8	177.5	-52.2	-167.3	0	0	0	116.4	Y508 Q513 T517 F625 L628 K632 M681	Y508-L511 PolarHBondContact O-N 2.86Å; L511-Q513 PolarHBondContact O-N 3.5Å; L511-T517 HydrophobicContact CD1-CG2 4.31Å; L511-T517 HydrophobicContact CD2-CG2 3.79Å; L511-T517 HydrophobicContact CG-CG2 4.5Å; L511-F625 HydrophobicContact CD2-CD2 3.73Å; L511-F625 HydrophobicContact CD2-CE2 3.52Å; L511-L628 HydrophobicContact CD1-CB 3.64Å; L511-L628 HydrophobicContact CG-CB 4.08Å; L511-K632 HydrophobicContact CD1-CB 4.46Å; L511-K632 HydrophobicContact CD1-CG 4.06Å; L511-M681 HydrophobicContact CB-CE 4.03Å; L511-M681 HydrophobicContact CD1-CE 3.91Å; L511-M681 HydrophobicContact CG-CE 4.48Å
512	N	89.4	Confident	90.8	Very high	92 Å²	92	29.5 Å²	29.5	49%	0.492	16%	0.155	S	C	.	.			trans	-61.3	-28.4	179.7	-179.2	51.7	0	0	0	111.9	K506 R507 L510 G514	K506-N512 HydrophobicContact CG-CB 3.95Å; K506-N512 WeakPolarHBondContact O-CB 3.29Å; R507-N512 PolarHBondContact O-N 2.94Å; L510-N512 PolarHBondContact O-N 2.8Å; N512-G514 PolarHBondContact O-N 3.34Å
513	Q	87.9	Confident	90.7	Very high	28 Å²	28	31.2 Å²	31.2	13%	0.131	17%	0.169	C	C	.	.			trans	-91.2	78.7	174.5	-164.9	144.7	4.2	0	0	111.9	R507 L511 D515 F516 T517	R507-Q513 HydrophobicContact CB-CB 4.1Å; R507-Q513 WeakPolarHBondContact O-CB 3.47Å; R507-Q513 PolarHBondContact O-N 3.28Å; L511-Q513 PolarHBondContact O-N 3.5Å; Q513-D515 VanDerWaalsContact C-N 3.34Å; Q513-D515 WeakPolarHBondContact CG-OD1 3.41Å; Q513-D515 PolarHBondContact NE2-OD1 3.2Å; Q513-D515 PolarHBondContact O-N 3.35Å; Q513-F516 HydrophobicContact CG-CB 4.02Å; Q513-T517 PolarHBondContact O-N 3.02Å; Q513-T517 VanDerWaalsContact O-N 3.12Å; Q513-T517 PolarHBondContact O-OG1 2.86Å
514	G	87.3	Confident	90.6	Very high	37 Å²	37	27.4 Å²	27.4	38%	0.381	15%	0.151	S	C	.	.	H	α-helix	trans	-65.1	-27.3	-175	0	0	0	0	0	115.5	N512 T517 M518	N512-G514 PolarHBondContact O-N 3.34Å; G514-T517 PolarHBondContact O-N 3.37Å; G514-M518 WeakPolarHBondContact O-CB 3.41Å; G514-M518 WeakPolarHBondContact O-CG 3.35Å; G514-M518 PolarHBondContact O-N 3.12Å
515	D	89.9	Confident	90.4	Very high	57 Å²	57	28.7 Å²	28.7	31%	0.305	16%	0.157	S	C	.	.	H	α-helix	trans	-69.4	-46.6	179.5	75.3	-45.7	0	0	0	111.8	Q513 Q519 S552	Q513-D515 VanDerWaalsContact C-N 3.34Å; Q513-D515 WeakPolarHBondContact CG-OD1 3.41Å; Q513-D515 PolarHBondContact NE2-OD1 3.2Å; Q513-D515 PolarHBondContact O-N 3.35Å; D515-Q519 VanDerWaalsContact O-CG 3.31Å; D515-Q519 WeakPolarHBondContact O-CG 3.19Å; D515-Q519 PolarHBondContact O-N 3.21Å; D515-S552 WeakPolarHBondContact OD2-CB 3.34Å; D515-S552 PolarHBondContact OD2-N 3.14Å; D515-S552 PolarHBondContact OD2-OG 3.1Å
516	F	92.4	Very high	90	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-56.4	-50.7	167.7	162.4	-105.9	0	0	0	111.6	Y508 Q513 M518 Q519 F520 L544 T547 L548 A553 L562 F601	Y508-F516 AromaticContact CD1-CD1 3.76Å; Y508-F516 HydrophobicContact CD1-CD1 3.76Å; Y508-F516 AromaticContact CD1-CE1 3.73Å; Y508-F516 HydrophobicContact CD1-CE1 3.73Å; Y508-F516 HydrophobicContact CD1-CG 4.45Å; Y508-F516 HydrophobicContact CD1-CZ 4.39Å; Y508-F516 HydrophobicContact CE1-CD1 4.17Å; Y508-F516 HydrophobicContact CE1-CE1 4.39Å; Y508-F516 HydrophobicContact CE1-CG 4.42Å; Q513-F516 HydrophobicContact CG-CB 4.02Å; F516-M518 VanDerWaalsContact C-N 3.33Å; F516-M518 PolarHBondContact O-N 3.37Å; F516-Q519 PolarHBondContact O-N 2.79Å; F516-F520 HydrophobicContact CE2-CB 4.16Å; F516-F520 HydrophobicContact CZ-CB 4.22Å; F516-F520 HydrophobicContact CZ-CG 4.36Å; F516-F520 WeakPolarHBondContact O-CB 3.43Å; F516-F520 PolarHBondContact O-N 3.08Å; F516-L544 HydrophobicContact CE2-CD1 3.75Å; F516-L544 HydrophobicContact CZ-CD1 3.54Å; F516-T547 WeakPolarHBondContact CE2-OG1 3.48Å; F516-L548 HydrophobicContact CD2-CD2 3.72Å; F516-L548 HydrophobicContact CD2-CG 4.3Å; F516-L548 HydrophobicContact CE2-CD2 3.45Å; F516-L548 VanDerWaalsContact CE2-CD2 3.45Å; F516-L548 HydrophobicContact CE2-CG 3.77Å; F516-L548 HydrophobicContact CG-CD2 4.46Å; F516-L548 HydrophobicContact CZ-CD2 4Å; F516-L548 HydrophobicContact CZ-CG 4.49Å; F516-A553 HydrophobicContact CB-CB 4.26Å; F516-A553 HydrophobicContact CG-CB 4.49Å; F516-L562 HydrophobicContact CZ-CD2 4.22Å; F516-F601 HydrophobicContact CE1-CE2 4.09Å; F516-F601 HydrophobicContact CE1-CZ 4.07Å; F516-F601 HydrophobicContact CZ-CE2 4.33Å; F516-F601 AromaticContact CZ-CZ 3.83Å; F516-F601 HydrophobicContact CZ-CZ 3.83Å
517	T	90	Very high	89.7	Confident	6 Å²	6	36.6 Å²	36.6	4%	0.037	20%	0.199	C	C	.	.	H	α-helix	trans	-61	-42.3	-173.5	-53.2	0	0	0	0	111.7	L511 Q513 G514 F520 M521	L511-T517 HydrophobicContact CD1-CG2 4.31Å; L511-T517 HydrophobicContact CD2-CG2 3.79Å; L511-T517 HydrophobicContact CG-CG2 4.5Å; Q513-T517 PolarHBondContact O-N 3.02Å; Q513-T517 VanDerWaalsContact O-N 3.12Å; Q513-T517 PolarHBondContact O-OG1 2.86Å; G514-T517 PolarHBondContact O-N 3.37Å; T517-F520 PolarHBondContact O-N 3.48Å; T517-M521 HydrophobicContact CG2-CE 4.29Å; T517-M521 WeakPolarHBondContact O-CG 3.29Å; T517-M521 PolarHBondContact O-N 3.46Å
518	M	89.1	Confident	89.5	Confident	68 Å²	68	33.9 Å²	33.9	34%	0.335	19%	0.189	S	C	.	.	H	α-helix	trans	-66.9	-46	176.4	-70.4	-68.5	172.6	0	0	111.8	G514 F516 F520 M521 D522 K632	G514-M518 WeakPolarHBondContact O-CB 3.41Å; G514-M518 WeakPolarHBondContact O-CG 3.35Å; G514-M518 PolarHBondContact O-N 3.12Å; F516-M518 VanDerWaalsContact C-N 3.33Å; F516-M518 PolarHBondContact O-N 3.37Å; M518-F520 VanDerWaalsContact C-N 3.29Å; M518-F520 PolarHBondContact O-N 3.39Å; M518-M521 HydrophobicContact CE-CE 4.07Å; M518-M521 PolarHBondContact O-N 2.97Å; M518-M521 HydrophobicContact SD-CE 3.57Å; M518-M521 VanDerWaalsContact SD-CE 3.57Å; M518-D522 WeakPolarHBondContact O-CB 3.09Å; M518-D522 VanDerWaalsContact O-CG 3.3Å; M518-D522 PolarHBondContact O-N 3.22Å; M518-K632 HydrophobicContact CE-CD 4.31Å
519	Q	91.1	Very high	89.1	Confident	62 Å²	62	38 Å²	38	29%	0.29	21%	0.214	S	C	.	.	H	α-helix	trans	-61.3	-36.5	176.3	-70.9	177.4	18.6	0	0	112.6	D515 F516 D522 A523 T547	D515-Q519 VanDerWaalsContact O-CG 3.31Å; D515-Q519 WeakPolarHBondContact O-CG 3.19Å; D515-Q519 PolarHBondContact O-N 3.21Å; F516-Q519 PolarHBondContact O-N 2.79Å; Q519-D522 PolarHBondContact O-N 3.25Å; Q519-A523 VanDerWaalsContact O-CB 3.29Å; Q519-A523 WeakPolarHBondContact O-CB 3.4Å; Q519-A523 PolarHBondContact O-N 3.45Å; Q519-T547 HydrophobicContact CB-CG2 4.45Å
520	F	92.4	Very high	88.9	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-68.7	-43.6	175.5	-179.2	-96.6	0	0	0	112.4	F516 T517 M518 D522 A523 C524 L544 T547 F599 F601 F629	F516-F520 HydrophobicContact CE2-CB 4.16Å; F516-F520 HydrophobicContact CZ-CB 4.22Å; F516-F520 HydrophobicContact CZ-CG 4.36Å; F516-F520 WeakPolarHBondContact O-CB 3.43Å; F516-F520 PolarHBondContact O-N 3.08Å; T517-F520 PolarHBondContact O-N 3.48Å; M518-F520 VanDerWaalsContact C-N 3.29Å; M518-F520 PolarHBondContact O-N 3.39Å; F520-D522 VanDerWaalsContact C-N 3.32Å; F520-D522 PolarHBondContact O-N 3.06Å; F520-A523 PolarHBondContact O-N 3.38Å; F520-C524 WeakPolarHBondContact CE2-SG 3.14Å; F520-C524 HydrophobicContact CZ-CB 4.41Å; F520-C524 VanDerWaalsContact CZ-SG 3.58Å; F520-C524 WeakPolarHBondContact O-CB 3.47Å; F520-C524 PolarHBondContact O-N 3.38Å; F520-C524 PolarHBondContact O-SG 3.48Å; F520-L544 HydrophobicContact CD2-CB 4.4Å; F520-L544 HydrophobicContact CD2-CD1 4.04Å; F520-L544 HydrophobicContact CE2-CB 3.9Å; F520-L544 HydrophobicContact CE2-CD1 4.05Å; F520-T547 HydrophobicContact CB-CG2 4.48Å; F520-F599 AromaticContact CE1-CE1 3.6Å; F520-F599 HydrophobicContact CE1-CE1 3.6Å; F520-F599 HydrophobicContact CE1-CE2 4.41Å; F520-F599 AromaticContact CE1-CZ 3.48Å; F520-F599 HydrophobicContact CE1-CZ 3.48Å; F520-F599 VanDerWaalsContact CE1-CZ 3.48Å; F520-F599 HydrophobicContact CZ-CE1 4.02Å; F520-F599 HydrophobicContact CZ-CE2 4.03Å; F520-F599 AromaticContact CZ-CZ 3.38Å; F520-F599 HydrophobicContact CZ-CZ 3.38Å; F520-F601 AromaticContact CD1-CZ 3.88Å; F520-F601 HydrophobicContact CD1-CZ 3.88Å; F520-F601 HydrophobicContact CD2-CZ 4.47Å; F520-F601 HydrophobicContact CE1-CE1 4.19Å; F520-F601 AromaticContact CE1-CZ 3.74Å; F520-F601 HydrophobicContact CE1-CZ 3.74Å; F520-F601 HydrophobicContact CE2-CE1 4.32Å; F520-F601 HydrophobicContact CE2-CZ 4.34Å; F520-F601 HydrophobicContact CG-CZ 4.26Å; F520-F601 AromaticContact CZ-CE1 4Å; F520-F601 HydrophobicContact CZ-CE1 4Å; F520-F601 AromaticContact CZ-CZ 3.99Å; F520-F601 HydrophobicContact CZ-CZ 3.99Å; F520-F629 HydrophobicContact CD1-CE2 4.23Å; F520-F629 HydrophobicContact CD1-CZ 4.43Å; F520-F629 HydrophobicContact CE1-CE2 4.37Å; F520-F629 HydrophobicContact CE1-CZ 4.2Å
521	M	90.2	Very high	88.4	Confident	4 Å²	4	45.1 Å²	45.1	2%	0.02	25%	0.249	C	C	.	.	H	α-helix	trans	-64.4	-35	173	-73.6	-166.3	-65.8	0	0	112.8	T517 M518 E525 F629 K632 H633	T517-M521 HydrophobicContact CG2-CE 4.29Å; T517-M521 WeakPolarHBondContact O-CG 3.29Å; T517-M521 PolarHBondContact O-N 3.46Å; M518-M521 HydrophobicContact CE-CE 4.07Å; M518-M521 PolarHBondContact O-N 2.97Å; M518-M521 HydrophobicContact SD-CE 3.57Å; M518-M521 VanDerWaalsContact SD-CE 3.57Å; M521-E525 PolarHBondContact O-N 2.8Å; M521-F629 HydrophobicContact CG-CD2 4.38Å; M521-F629 HydrophobicContact CG-CE2 3.55Å; M521-F629 HydrophobicContact CG-CZ 4Å; M521-F629 HydrophobicContact SD-CD2 4.39Å; M521-F629 HydrophobicContact SD-CE2 4.08Å; M521-K632 HydrophobicContact CE-CB 4.09Å; M521-K632 HydrophobicContact SD-CB 4.36Å; M521-H633 HydrophobicContact SD-CB 4.4Å
522	D	89.8	Confident	87.9	Confident	99 Å²	99	45.7 Å²	45.7	53%	0.529	25%	0.252	S	S	.	.	H	α-helix	trans	-65.9	-43.9	173.2	-71.9	-24.8	0	0	0	111.7	M518 Q519 F520 R636	M518-D522 WeakPolarHBondContact O-CB 3.09Å; M518-D522 VanDerWaalsContact O-CG 3.3Å; M518-D522 PolarHBondContact O-N 3.22Å; Q519-D522 PolarHBondContact O-N 3.25Å; F520-D522 VanDerWaalsContact C-N 3.32Å; F520-D522 PolarHBondContact O-N 3.06Å; D522-R636 IonicContact OD1-CZ 3.15Å; D522-R636 IonicContact OD1-NE 2.8Å; D522-R636 PolarHBondContact OD1-NE 2.9Å; D522-R636 IonicContact OD1-NH2 2.71Å; D522-R636 PolarHBondContact OD1-NH2 2.94Å
523	A	90.1	Very high	87.4	Confident	36 Å²	36	46.1 Å²	46.1	30%	0.298	26%	0.255	S	S	.	.	H	α-helix	trans	-73.9	-26.3	-177.4	0	0	0	0	0	114.1	Q519 F520 L543 T547	Q519-A523 VanDerWaalsContact O-CB 3.29Å; Q519-A523 WeakPolarHBondContact O-CB 3.4Å; Q519-A523 PolarHBondContact O-N 3.45Å; F520-A523 PolarHBondContact O-N 3.38Å; A523-L543 HydrophobicContact CB-CD2 4.29Å; A523-T547 HydrophobicContact CB-CG2 3.68Å
524	C	89.3	Confident	87.2	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-107.6	4	-173.5	-55.5	0	0	0	0	114.5	F520 D526 E527 L528 L540	F520-C524 WeakPolarHBondContact CE2-SG 3.14Å; F520-C524 HydrophobicContact CZ-CB 4.41Å; F520-C524 VanDerWaalsContact CZ-SG 3.58Å; F520-C524 WeakPolarHBondContact O-CB 3.47Å; F520-C524 PolarHBondContact O-N 3.38Å; F520-C524 PolarHBondContact O-SG 3.48Å; C524-D526 PolarHBondContact O-N 3.41Å; C524-E527 PolarHBondContact O-N 2.86Å; C524-L528 HydrophobicContact CB-CD1 3.72Å; C524-L528 HydrophobicContact CB-CG 4.01Å; C524-L528 WeakPolarHBondContact O-CB 3.28Å; C524-L528 WeakPolarHBondContact O-CG 3.28Å; C524-L528 PolarHBondContact O-N 2.87Å; C524-L540 HydrophobicContact CB-CD2 4.17Å
525	E	86.3	Confident	87	Confident	26 Å²	26	49.7 Å²	49.7	12%	0.121	26%	0.262	C	S	.	.	H	α-helix	trans	-56	-47	-176.5	-172.5	173.3	176.8	0	0	112.3	M521 E527 T529 R636 Q637 K640	M521-E525 PolarHBondContact O-N 2.8Å; E525-E527 VanDerWaalsContact C-N 3.33Å; E525-E527 PolarHBondContact O-N 3.37Å; E525-T529 WeakPolarHBondContact O-CB 3.49Å; E525-T529 PolarHBondContact O-N 2.88Å; E525-T529 VanDerWaalsContact O-N 3.13Å; E525-T529 PolarHBondContact O-OG1 3.05Å; E525-R636 VanDerWaalsContact CD-NH1 3.31Å; E525-R636 IonicContact OE1-NH1 3.83Å; E525-R636 IonicContact OE2-CZ 3.25Å; E525-R636 VanDerWaalsContact OE2-CZ 3.25Å; E525-R636 IonicContact OE2-NH1 2.81Å; E525-R636 PolarHBondContact OE2-NH1 3.17Å; E525-R636 IonicContact OE2-NH2 2.76Å; E525-R636 PolarHBondContact OE2-NH2 3.37Å; E525-Q637 PolarHBondContact OE1-NE2 2.96Å; E525-Q637 PolarHBondContact OE1-OE1 3.23Å; E525-K640 IonicContact OE1-NZ 2.65Å; E525-K640 PolarHBondContact OE1-NZ 2.95Å; E525-K640 IonicContact OE2-NZ 3.15Å; E525-K640 PolarHBondContact OE2-NZ 3.31Å; E525-K640 VanDerWaalsContact OE2-NZ 3.15Å
526	D	85.7	Confident	86.8	Confident	139 Å²	139	52 Å²	52	74%	0.743	27%	0.273	S	S	*	.	H	α-helix	trans	-68.7	-27.6	-178.1	-65.3	-25.1	0	0	0	113.5	C524 K530	C524-D526 PolarHBondContact O-N 3.41Å; D526-K530 VanDerWaalsContact O-CE 3.23Å; D526-K530 WeakPolarHBondContact O-CE 3.29Å
527	E	86.5	Confident	86.6	Confident	37 Å²	37	55.3 Å²	55.3	17%	0.173	30%	0.295	C	S	.	.	H	α-helix	trans	-83.7	-47.4	176.9	-68.1	-60.3	134.2	0	0	111.5	C524 E525 T529 K530 T539 L540 L543	C524-E527 PolarHBondContact O-N 2.86Å; E525-E527 VanDerWaalsContact C-N 3.33Å; E525-E527 PolarHBondContact O-N 3.37Å; E527-T529 VanDerWaalsContact C-N 3.29Å; E527-T529 PolarHBondContact O-N 2.9Å; E527-K530 WeakPolarHBondContact O-CB 3.37Å; E527-K530 WeakPolarHBondContact O-CG 3.15Å; E527-K530 PolarHBondContact O-N 2.98Å; E527-K530 IonicContact OE1-NZ 2.66Å; E527-K530 PolarHBondContact OE1-NZ 3.2Å; E527-K530 IonicContact OE2-NZ 2.74Å; E527-K530 PolarHBondContact OE2-NZ 2.73Å; E527-T539 PolarHBondContact OE2-OG1 3.2Å; E527-L540 HydrophobicContact CB-CD2 3.91Å; E527-L543 HydrophobicContact CG-CD1 4.15Å
528	L	86.6	Confident	86.5	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.026	33%	0.325	C	S	.	.	H	α-helix	trans	-70.6	-23.4	-176.3	-68	173.1	0	0	0	113.4	C524 K530 L540 S594 G595 L596 F599 F629	C524-L528 HydrophobicContact CB-CD1 3.72Å; C524-L528 HydrophobicContact CB-CG 4.01Å; C524-L528 WeakPolarHBondContact O-CB 3.28Å; C524-L528 WeakPolarHBondContact O-CG 3.28Å; C524-L528 PolarHBondContact O-N 2.87Å; L528-K530 VanDerWaalsContact C-N 3.25Å; L528-K530 PolarHBondContact O-N 2.92Å; L528-L540 HydrophobicContact CD2-CD1 4.18Å; L528-L540 HydrophobicContact CD2-CD2 4.04Å; L528-L540 HydrophobicContact CG-CD2 4.24Å; L528-S594 PolarHBondContact O-OG 2.78Å; L528-G595 CarbonylContact O-C 3.57Å; L528-G595 WeakPolarHBondContact O-CA 3.44Å; L528-G595 PolarHBondContact O-N 3.09Å; L528-L596 HydrophobicContact CB-CB 4.46Å; L528-L596 HydrophobicContact CB-CD1 4.47Å; L528-L596 HydrophobicContact CD1-CD1 4.41Å; L528-L596 PolarHBondContact O-N 2.95Å; L528-F599 HydrophobicContact CD2-CB 3.86Å; L528-F599 HydrophobicContact CD2-CD2 3.93Å; L528-F599 HydrophobicContact CD2-CG 3.88Å; L528-F629 HydrophobicContact CD1-CE1 4.27Å; L528-F629 HydrophobicContact CD1-CZ 4.04Å
529	T	83.9	Confident	86.5	Confident	85 Å²	85	60.1 Å²	60.1	52%	0.521	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-21.5	175.8	-57.5	0	0	0	0	112.3	E525 E527	E525-T529 WeakPolarHBondContact O-CB 3.49Å; E525-T529 PolarHBondContact O-N 2.88Å; E525-T529 VanDerWaalsContact O-N 3.13Å; E525-T529 PolarHBondContact O-OG1 3.05Å; E527-T529 VanDerWaalsContact C-N 3.29Å; E527-T529 PolarHBondContact O-N 2.9Å
530	K	85.8	Confident	86.4	Confident	71 Å²	71	57.1 Å²	57.1	31%	0.309	31%	0.307	S	S	.	.	S	Bend	trans	-68.7	159	178.6	-55.8	172.8	-170.7	171.3	0	111.7	D526 E527 L528 H534 V535 G595	D526-K530 VanDerWaalsContact O-CE 3.23Å; D526-K530 WeakPolarHBondContact O-CE 3.29Å; E527-K530 WeakPolarHBondContact O-CB 3.37Å; E527-K530 WeakPolarHBondContact O-CG 3.15Å; E527-K530 PolarHBondContact O-N 2.98Å; E527-K530 IonicContact OE1-NZ 2.66Å; E527-K530 PolarHBondContact OE1-NZ 3.2Å; E527-K530 IonicContact OE2-NZ 2.74Å; E527-K530 PolarHBondContact OE2-NZ 2.73Å; L528-K530 VanDerWaalsContact C-N 3.25Å; L528-K530 PolarHBondContact O-N 2.92Å; K530-H534 HydrophobicContact CB-CB 4.24Å; K530-H534 HydrophobicContact CD-CB 4.44Å; K530-V535 HydrophobicContact CB-CG2 4.19Å; K530-G595 PolarHBondContact O-N 3.43Å
531	N	83.3	Confident	86.4	Confident	85 Å²	85	59.7 Å²	59.7	46%	0.455	32%	0.319	S	S	.	.	B	Isolated β-bridge	trans	-61.9	145.1	165.6	-64.8	10.7	0	0	0	109.8	D533 H534	N531-D533 PolarHBondContact O-N 3.21Å; N531-D533 VanDerWaalsContact O-N 3.07Å; N531-H534 PolarHBondContact O-N 2.85Å
532	V	78.9	Confident	86.4	Confident	22 Å²	22	65 Å²	65	13%	0.133	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-49.3	-39.6	-174.9	171.4	0	0	0	0	113.9	H534 V535 L593 C598	V532-H534 PolarHBondContact O-N 3.13Å; V532-V535 PolarHBondContact O-N 3.06Å; V532-V535 VanDerWaalsContact O-N 3.17Å; V532-L593 HydrophobicContact CG2-CB 4.2Å; V532-L593 WeakPolarHBondContact CG2-O 3.26Å; V532-L593 PolarHBondContact N-O 2.77Å; V532-C598 HydrophobicContact CG2-CB 3.58Å
533	D	79.5	Confident	86.5	Confident	102 Å²	102	62.3 Å²	62.3	55%	0.545	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-65.7	-16.8	-179.7	-65.7	-21.9	0	0	0	114.3	N531 R590	N531-D533 PolarHBondContact O-N 3.21Å; N531-D533 VanDerWaalsContact O-N 3.07Å; D533-R590 WeakPolarHBondContact OD1-CD 3.3Å; D533-R590 IonicContact OD1-CZ 3.11Å; D533-R590 IonicContact OD1-NE 2.75Å; D533-R590 IonicContact OD1-NH1 3.44Å; D533-R590 PolarHBondContact OD1-NH1 2.77Å
534	H	83.2	Confident	86.6	Confident	131 Å²	131	60.6 Å²	60.6	61%	0.606	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-104.9	-1.7	178.2	-60.6	161.3	0	0	0	113.4	K530 N531 V532	K530-H534 HydrophobicContact CB-CB 4.24Å; K530-H534 HydrophobicContact CD-CB 4.44Å; N531-H534 PolarHBondContact O-N 2.85Å; V532-H534 PolarHBondContact O-N 3.13Å
535	V	83.9	Confident	86.6	Confident	9 Å²	9	61.7 Å²	61.7	6%	0.055	33%	0.33	C	S	.	.			trans	-84.5	127.9	176.5	-171.3	0	0	0	0	109	K530 V532 L540 L566	K530-V535 HydrophobicContact CB-CG2 4.19Å; V532-V535 PolarHBondContact O-N 3.06Å; V532-V535 VanDerWaalsContact O-N 3.17Å; V535-L540 HydrophobicContact CG1-CD1 3.68Å; V535-L540 HydrophobicContact CG1-CG 4.07Å; V535-L566 HydrophobicContact CB-CD1 4.01Å; V535-L566 HydrophobicContact CG1-CD1 3.75Å; V535-L566 HydrophobicContact CG1-CD2 4.37Å
536	L	85.4	Confident	86.8	Confident	104 Å²	104	64.4 Å²	64.4	55%	0.545	35%	0.345	S	S	.	.			trans	-94.3	117	177.8	-63.7	174.9	0	0	0	109.7	M538 T539 L540	L536-M538 PolarHBondContact O-N 3.48Å; L536-M538 VanDerWaalsContact O-N 3.15Å; L536-T539 HydrophobicContact CB-CG2 3.93Å; L536-T539 HydrophobicContact CD1-CG2 4.06Å; L536-T539 PolarHBondContact O-N 3.39Å; L536-T539 PolarHBondContact O-OG1 3.26Å; L536-L540 PolarHBondContact O-N 2.82Å
537	P	87.1	Confident	87.1	Confident	71 Å²	71	58 Å²	58	46%	0.461	31%	0.31	S	S	.	.	H	α-helix	trans	-56	-37.2	178.9	-23.4	31	0	0	0	112.4	T539 L540 E541 L566	P537-T539 VanDerWaalsContact C-N 3.33Å; P537-T539 PolarHBondContact O-N 2.61Å; P537-L540 PolarHBondContact O-N 3.15Å; P537-E541 WeakPolarHBondContact O-CB 3.47Å; P537-E541 PolarHBondContact O-N 3.19Å; P537-L566 HydrophobicContact CG-CD1 4.22Å
538	M	88.3	Confident	87.3	Confident	133 Å²	133	56.6 Å²	56.6	66%	0.655	30%	0.304	S	S	*	.	H	α-helix	trans	-67.4	-25.1	178.6	-61.2	-69.3	95	0	0	113.9	L536 N542	L536-M538 PolarHBondContact O-N 3.48Å; L536-M538 VanDerWaalsContact O-N 3.15Å; M538-N542 WeakPolarHBondContact O-CB 3.4Å; M538-N542 PolarHBondContact O-N 2.95Å; M538-N542 PolarHBondContact O-ND2 3.11Å
539	T	89.6	Confident	87.4	Confident	41 Å²	41	64.5 Å²	64.5	25%	0.252	33%	0.334	S	S	.	.	H	α-helix	trans	-77.3	-44.6	174	56.5	0	0	0	0	110.2	E527 L536 P537 E541 N542 L543	E527-T539 PolarHBondContact OE2-OG1 3.2Å; L536-T539 HydrophobicContact CB-CG2 3.93Å; L536-T539 HydrophobicContact CD1-CG2 4.06Å; L536-T539 PolarHBondContact O-N 3.39Å; L536-T539 PolarHBondContact O-OG1 3.26Å; P537-T539 VanDerWaalsContact C-N 3.33Å; P537-T539 PolarHBondContact O-N 2.61Å; T539-E541 VanDerWaalsContact C-N 3.34Å; T539-E541 PolarHBondContact O-N 3.26Å; T539-N542 PolarHBondContact O-N 3.01Å; T539-L543 WeakPolarHBondContact O-CB 3.12Å; T539-L543 VanDerWaalsContact O-CG 3.23Å; T539-L543 WeakPolarHBondContact O-CG 3.46Å; T539-L543 PolarHBondContact O-N 3.4Å
540	L	89.3	Confident	87.6	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-56.6	-45.5	174.1	-65.1	-178	0	0	0	112.2	C524 E527 L528 V535 L536 P537 N542 L543 L544 C564 L566 F599	C524-L540 HydrophobicContact CB-CD2 4.17Å; E527-L540 HydrophobicContact CB-CD2 3.91Å; L528-L540 HydrophobicContact CD2-CD1 4.18Å; L528-L540 HydrophobicContact CD2-CD2 4.04Å; L528-L540 HydrophobicContact CG-CD2 4.24Å; V535-L540 HydrophobicContact CG1-CD1 3.68Å; V535-L540 HydrophobicContact CG1-CG 4.07Å; L536-L540 PolarHBondContact O-N 2.82Å; P537-L540 PolarHBondContact O-N 3.15Å; L540-N542 PolarHBondContact O-N 3.42Å; L540-L543 PolarHBondContact O-N 3.18Å; L540-L544 WeakPolarHBondContact O-CB 3.46Å; L540-L544 PolarHBondContact O-N 2.6Å; L540-C564 HydrophobicContact CB-CB 4.08Å; L540-L566 HydrophobicContact CD1-CD1 4.2Å; L540-L566 HydrophobicContact CD1-CD2 4.22Å; L540-L566 HydrophobicContact CD1-CG 4.29Å; L540-F599 HydrophobicContact CD1-CD2 3.99Å; L540-F599 HydrophobicContact CD1-CE2 4.13Å
541	E	90.9	Very high	87.8	Confident	53 Å²	53	62.7 Å²	62.7	25%	0.248	32%	0.323	C	S	.	.	H	α-helix	trans	-65.3	-38.7	179.8	-163.8	63.4	-158.6	0	0	112.4	P537 T539 L544 G545 H563 C564	P537-E541 WeakPolarHBondContact O-CB 3.47Å; P537-E541 PolarHBondContact O-N 3.19Å; T539-E541 VanDerWaalsContact C-N 3.34Å; T539-E541 PolarHBondContact O-N 3.26Å; E541-L544 PolarHBondContact O-N 3.11Å; E541-G545 PolarHBondContact O-N 2.78Å; E541-H563 IonicContact OE1-CE1 3.8Å; E541-H563 IonicContact OE1-CG 3.67Å; E541-H563 IonicContact OE1-ND1 2.78Å; E541-H563 PolarHBondContact OE1-ND1 2.9Å; E541-C564 WeakPolarHBondContact OE2-CB 3.34Å; E541-C564 PolarHBondContact OE2-N 3.43Å
542	N	91.8	Very high	87.9	Confident	115 Å²	115	62 Å²	62	62%	0.615	33%	0.325	S	S	*	.	H	α-helix	trans	-67.9	-35.6	173.7	-84.1	-68	0	0	0	112.5	M538 T539 L540 L546	M538-N542 WeakPolarHBondContact O-CB 3.4Å; M538-N542 PolarHBondContact O-N 2.95Å; M538-N542 PolarHBondContact O-ND2 3.11Å; T539-N542 PolarHBondContact O-N 3.01Å; L540-N542 PolarHBondContact O-N 3.42Å; N542-L546 WeakPolarHBondContact O-CB 3.45Å; N542-L546 PolarHBondContact O-N 2.96Å; N542-L546 VanDerWaalsContact O-N 3.07Å
543	L	91.8	Very high	88.1	Confident	43 Å²	43	61 Å²	61	23%	0.225	32%	0.319	C	S	.	.	H	α-helix	trans	-69.9	-42	175.4	-68.6	165.1	0	0	0	111.2	A523 E527 T539 L540 L546 T547	A523-L543 HydrophobicContact CB-CD2 4.29Å; E527-L543 HydrophobicContact CG-CD1 4.15Å; T539-L543 WeakPolarHBondContact O-CB 3.12Å; T539-L543 VanDerWaalsContact O-CG 3.23Å; T539-L543 WeakPolarHBondContact O-CG 3.46Å; T539-L543 PolarHBondContact O-N 3.4Å; L540-L543 PolarHBondContact O-N 3.18Å; L543-L546 WeakPolarHBondContact O-CB 3.49Å; L543-L546 PolarHBondContact O-N 3.05Å; L543-L546 VanDerWaalsContact O-N 3.12Å; L543-T547 WeakPolarHBondContact O-CG2 3.24Å; L543-T547 PolarHBondContact O-N 3.18Å; L543-T547 PolarHBondContact O-OG1 2.88Å
544	L	91.6	Very high	88.3	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-57.2	-53.6	171.8	177.9	58.8	0	0	0	111	F516 F520 L540 E541 L546 T547 L548 L562 F601	F516-L544 HydrophobicContact CE2-CD1 3.75Å; F516-L544 HydrophobicContact CZ-CD1 3.54Å; F520-L544 HydrophobicContact CD2-CB 4.4Å; F520-L544 HydrophobicContact CD2-CD1 4.04Å; F520-L544 HydrophobicContact CE2-CB 3.9Å; F520-L544 HydrophobicContact CE2-CD1 4.05Å; L540-L544 WeakPolarHBondContact O-CB 3.46Å; L540-L544 PolarHBondContact O-N 2.6Å; E541-L544 PolarHBondContact O-N 3.11Å; L544-L546 PolarHBondContact O-N 3.31Å; L544-L546 VanDerWaalsContact O-N 3.1Å; L544-T547 PolarHBondContact O-N 3.18Å; L544-T547 PolarHBondContact O-OG1 3.31Å; L544-L548 HydrophobicContact CD1-CD1 3.9Å; L544-L548 HydrophobicContact CD1-CG 3.97Å; L544-L548 HydrophobicContact CG-CD1 3.9Å; L544-L548 HydrophobicContact CG-CG 4.4Å; L544-L548 WeakPolarHBondContact O-CB 3.42Å; L544-L548 WeakPolarHBondContact O-CG 3.49Å; L544-L548 PolarHBondContact O-N 3.41Å; L544-L562 HydrophobicContact CD1-CD2 4.06Å; L544-L562 HydrophobicContact CD2-CD2 4.48Å; L544-L562 HydrophobicContact CD2-CG 4.38Å; L544-L562 WeakPolarHBondContact CD2-O 3.13Å; L544-F601 HydrophobicContact CD1-CE1 3.71Å; L544-F601 HydrophobicContact CD1-CZ 4.14Å; L544-F601 HydrophobicContact CD2-CD1 4.37Å; L544-F601 HydrophobicContact CD2-CE1 4.05Å; L544-F601 HydrophobicContact CG-CE1 4.48Å
545	G	89.6	Confident	88.4	Confident	22 Å²	22	64.6 Å²	64.6	23%	0.227	33%	0.33	C	S	.	.	H	α-helix	trans	-61	-19.9	176.6	0	0	0	0	0	113.4	E541 R549	E541-G545 PolarHBondContact O-N 2.78Å; G545-R549 VanDerWaalsContact O-CZ 3.27Å; G545-R549 PolarHBondContact O-NE 3.16Å; G545-R549 PolarHBondContact O-NH2 2.85Å
546	L	91.1	Very high	88.5	Confident	84 Å²	84	64.4 Å²	64.4	44%	0.44	33%	0.329	S	S	.	.	H	α-helix	trans	-84.9	-45.6	173.6	177.5	140.7	0	0	0	111.7	N542 L543 L544 R549 I550	N542-L546 WeakPolarHBondContact O-CB 3.45Å; N542-L546 PolarHBondContact O-N 2.96Å; N542-L546 VanDerWaalsContact O-N 3.07Å; L543-L546 WeakPolarHBondContact O-CB 3.49Å; L543-L546 PolarHBondContact O-N 3.05Å; L543-L546 VanDerWaalsContact O-N 3.12Å; L544-L546 PolarHBondContact O-N 3.31Å; L544-L546 VanDerWaalsContact O-N 3.1Å; L546-R549 PolarHBondContact O-N 2.98Å; L546-R549 VanDerWaalsContact O-N 3.1Å; L546-I550 HydrophobicContact CD2-CD1 3.52Å; L546-I550 HydrophobicContact CG-CD1 3.98Å; L546-I550 WeakPolarHBondContact O-CG1 3.4Å; L546-I550 PolarHBondContact O-N 3Å
547	T	90.8	Very high	88.6	Confident	3 Å²	3	63.7 Å²	63.7	2%	0.018	33%	0.33	C	S	.	.	H	α-helix	trans	-72.3	-32.2	-177.7	61.5	0	0	0	0	112.3	F516 Q519 F520 A523 L543 L544 R549 I550 S551	F516-T547 WeakPolarHBondContact CE2-OG1 3.48Å; Q519-T547 HydrophobicContact CB-CG2 4.45Å; F520-T547 HydrophobicContact CB-CG2 4.48Å; A523-T547 HydrophobicContact CB-CG2 3.68Å; L543-T547 WeakPolarHBondContact O-CG2 3.24Å; L543-T547 PolarHBondContact O-N 3.18Å; L543-T547 PolarHBondContact O-OG1 2.88Å; L544-T547 PolarHBondContact O-N 3.18Å; L544-T547 PolarHBondContact O-OG1 3.31Å; T547-R549 PolarHBondContact O-N 2.87Å; T547-I550 PolarHBondContact O-N 2.84Å; T547-S551 WeakPolarHBondContact O-CB 3.16Å; T547-S551 PolarHBondContact O-N 3.07Å; T547-S551 PolarHBondContact O-OG 3.12Å
548	L	90.5	Very high	88.7	Confident	9 Å²	9	62.8 Å²	62.8	5%	0.047	32%	0.318	C	S	.	.	H	α-helix	trans	-61.7	-23.9	168.9	-71.6	173.3	0	0	0	113.3	Y508 F516 L544 A553 R554 K559 L562	Y508-L548 HydrophobicContact CD1-CD2 4.42Å; Y508-L548 HydrophobicContact CE1-CD2 3.72Å; F516-L548 HydrophobicContact CD2-CD2 3.72Å; F516-L548 HydrophobicContact CD2-CG 4.3Å; F516-L548 HydrophobicContact CE2-CD2 3.45Å; F516-L548 VanDerWaalsContact CE2-CD2 3.45Å; F516-L548 HydrophobicContact CE2-CG 3.77Å; F516-L548 HydrophobicContact CG-CD2 4.46Å; F516-L548 HydrophobicContact CZ-CD2 4Å; F516-L548 HydrophobicContact CZ-CG 4.49Å; L544-L548 HydrophobicContact CD1-CD1 3.9Å; L544-L548 HydrophobicContact CD1-CG 3.97Å; L544-L548 HydrophobicContact CG-CD1 3.9Å; L544-L548 HydrophobicContact CG-CG 4.4Å; L544-L548 WeakPolarHBondContact O-CB 3.42Å; L544-L548 WeakPolarHBondContact O-CG 3.49Å; L544-L548 PolarHBondContact O-N 3.41Å; L548-A553 HydrophobicContact CD2-CB 3.85Å; L548-R554 WeakPolarHBondContact O-CA 3.04Å; L548-R554 PolarHBondContact O-N 3.23Å; L548-K559 HydrophobicContact CD2-CB 4.37Å; L548-L562 HydrophobicContact CD1-CD2 4.4Å; L548-L562 HydrophobicContact CD2-CD2 4.27Å
549	R	89	Confident	88.6	Confident	171 Å²	171	58 Å²	58	65%	0.645	29%	0.294	S	S	*	.	H	α-helix	trans	-89.7	-24.3	176.7	-83.5	-179.2	-77.5	-174.3	-7.6	114	G545 L546 T547	G545-R549 VanDerWaalsContact O-CZ 3.27Å; G545-R549 PolarHBondContact O-NE 3.16Å; G545-R549 PolarHBondContact O-NH2 2.85Å; L546-R549 PolarHBondContact O-N 2.98Å; L546-R549 VanDerWaalsContact O-N 3.1Å; T547-R549 PolarHBondContact O-N 2.87Å
550	I	88.8	Confident	88.5	Confident	112 Å²	112	61.6 Å²	61.6	57%	0.574	31%	0.311	S	S	*	.	H	α-helix	trans	-90.2	-38.3	-179.7	-63.5	171.7	0	0	0	111.6	L546 T547	L546-I550 HydrophobicContact CD2-CD1 3.52Å; L546-I550 HydrophobicContact CG-CD1 3.98Å; L546-I550 WeakPolarHBondContact O-CG1 3.4Å; L546-I550 PolarHBondContact O-N 3Å; T547-I550 PolarHBondContact O-N 2.84Å
551	S	88.6	Confident	88.5	Confident	6 Å²	6	62.3 Å²	62.3	4%	0.042	32%	0.315	C	S	.	.	S	Bend	trans	-77.3	170.6	179.6	61.3	0	0	0	0	113.1	T547 A553 R554	T547-S551 WeakPolarHBondContact O-CB 3.16Å; T547-S551 PolarHBondContact O-N 3.07Å; T547-S551 PolarHBondContact O-OG 3.12Å; S551-A553 PolarHBondContact O-N 3.16Å; S551-A553 WeakPolarHBondContact OG-CB 3.13Å; S551-R554 PolarHBondContact O-N 2.75Å
552	S	85.5	Confident	88.5	Confident	71 Å²	71	59.9 Å²	59.9	50%	0.497	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-63	-10.1	174.8	-45	0	0	0	0	112.9	D515 R554 N555	D515-S552 WeakPolarHBondContact OD2-CB 3.34Å; D515-S552 PolarHBondContact OD2-N 3.14Å; D515-S552 PolarHBondContact OD2-OG 3.1Å; S552-R554 PolarHBondContact O-N 2.97Å; S552-N555 PolarHBondContact O-N 3Å
553	A	84.4	Confident	88.4	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-61	-21.2	173.5	0	0	0	0	0	112.8	Y508 F516 L548 S551 N555 D556	Y508-A553 HydrophobicContact CE1-CB 3.91Å; F516-A553 HydrophobicContact CB-CB 4.26Å; F516-A553 HydrophobicContact CG-CB 4.49Å; L548-A553 HydrophobicContact CD2-CB 3.85Å; S551-A553 PolarHBondContact O-N 3.16Å; S551-A553 WeakPolarHBondContact OG-CB 3.13Å; A553-N555 PolarHBondContact O-N 2.79Å; A553-D556 WeakPolarHBondContact O-CB 3.3Å; A553-D556 PolarHBondContact O-N 3.07Å
554	R	83.4	Confident	88.3	Confident	171 Å²	171	56.2 Å²	56.2	65%	0.645	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-48.2	-34.3	175.1	177.3	176.4	174	176.9	-1.1	113.5	L548 S551 S552 D556 K559	L548-R554 WeakPolarHBondContact O-CA 3.04Å; L548-R554 PolarHBondContact O-N 3.23Å; S551-R554 PolarHBondContact O-N 2.75Å; S552-R554 PolarHBondContact O-N 2.97Å; R554-D556 VanDerWaalsContact C-N 3.29Å; R554-D556 PolarHBondContact O-N 3.19Å; R554-K559 PolarHBondContact O-NZ 3.19Å
555	N	84.4	Confident	88.1	Confident	138 Å²	138	59.4 Å²	59.4	74%	0.738	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-76.9	-8.6	-176.9	-65.2	-18.6	0	0	0	114.1	S552 A553	S552-N555 PolarHBondContact O-N 3Å; A553-N555 PolarHBondContact O-N 2.79Å
556	D	87.2	Confident	88	Confident	5 Å²	5	60.2 Å²	60.2	3%	0.027	30%	0.298	C	S	.	.			trans	-82.6	132.7	179.2	-159.5	25.3	0	0	0	111.4	S504 R507 Y508 A553 R554 K559	S504-D556 VanDerWaalsContact CB-OD2 3.31Å; S504-D556 WeakPolarHBondContact CB-OD2 3.16Å; S504-D556 VanDerWaalsContact OG-CG 3.32Å; S504-D556 PolarHBondContact OG-OD1 3.4Å; S504-D556 PolarHBondContact OG-OD2 3.38Å; R507-D556 IonicContact CZ-OD1 3.7Å; R507-D556 IonicContact NH1-OD1 2.8Å; R507-D556 PolarHBondContact NH1-OD1 2.93Å; R507-D556 IonicContact NH1-OD2 2.71Å; R507-D556 IonicContact NH2-OD1 2.73Å; Y508-D556 WeakPolarHBondContact OH-CB 3.4Å; Y508-D556 PolarHBondContact OH-OD2 2.91Å; A553-D556 WeakPolarHBondContact O-CB 3.3Å; A553-D556 PolarHBondContact O-N 3.07Å; R554-D556 VanDerWaalsContact C-N 3.29Å; R554-D556 PolarHBondContact O-N 3.19Å; D556-K559 HydrophobicContact CB-CB 4.31Å; D556-K559 PolarHBondContact O-NZ 3.44Å
557	P	87.8	Confident	87.6	Confident	89 Å²	89	56.4 Å²	56.4	58%	0.578	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-64.9	-39.5	175.6	-22.8	34.9	0	0	0	112.9
558	Y	88.4	Confident	86.9	Confident	51 Å²	51	59.9 Å²	59.9	20%	0.2	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-97.8	18.1	-169.5	-48.2	-73.1	0	0	0	114.2	H501 D560 D561 Y603	H501-Y558 AromaticContact CE1-CD1 3.22Å; H501-Y558 WeakPolarHBondContact CE1-CD1 3.3Å; H501-Y558 AromaticContact CE1-CE1 3.55Å; H501-Y558 AromaticContact CE1-CG 3.91Å; H501-Y558 AromaticContact ND1-CD1 3.55Å; H501-Y558 AromaticContact ND1-CG 3.74Å; H501-Y558 AromaticContact NE2-CD1 3.78Å; H501-Y558 AromaticContact NE2-CE1 3.6Å; Y558-D560 PolarHBondContact O-N 3.26Å; Y558-D561 PolarHBondContact O-N 2.98Å; Y558-Y603 WeakPolarHBondContact CB-OH 3.31Å
559	K	85.8	Confident	86.3	Confident	34 Å²	34	62.1 Å²	62.1	15%	0.148	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-65.7	-27.2	177.6	69.4	-177.2	170.7	-85.2	0	113.4	Y508 L548 R554 D556 D561 L562	Y508-K559 HydrophobicContact CE2-CB 4.48Å; Y508-K559 WeakPolarHBondContact OH-CB 3.34Å; L548-K559 HydrophobicContact CD2-CB 4.37Å; R554-K559 PolarHBondContact O-NZ 3.19Å; D556-K559 HydrophobicContact CB-CB 4.31Å; D556-K559 PolarHBondContact O-NZ 3.44Å; K559-D561 PolarHBondContact O-N 3.5Å; K559-L562 WeakPolarHBondContact O-CB 3.28Å; K559-L562 PolarHBondContact O-N 3.39Å
560	D	87.1	Confident	85.6	Confident	115 Å²	115	56 Å²	56	62%	0.615	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-80.7	-7.2	-174.6	-58.1	-33.6	0	0	0	111.4	Y558 L562	Y558-D560 PolarHBondContact O-N 3.26Å; D560-L562 VanDerWaalsContact C-N 3.33Å
561	D	89.5	Confident	85.1	Confident	16 Å²	16	50.8 Å²	50.8	9%	0.086	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-86.2	1.7	171.5	-59	-45.3	0	0	0	112.6	H501 Y558 K559 Y603 E604 K606	H501-D561 IonicContact CE1-OD2 3.09Å; Y558-D561 PolarHBondContact O-N 2.98Å; K559-D561 PolarHBondContact O-N 3.5Å; D561-Y603 HydrophobicContact CB-CD2 4.08Å; D561-Y603 HydrophobicContact CB-CE2 3.67Å; D561-Y603 CarbonylContact O-C 3.57Å; D561-Y603 WeakPolarHBondContact O-CA 3.48Å; D561-Y603 WeakPolarHBondContact O-CD2 3.4Å; D561-E604 PolarHBondContact O-N 3.15Å; D561-K606 IonicContact OD1-NZ 2.68Å; D561-K606 PolarHBondContact OD1-NZ 3.08Å
562	L	91.3	Very high	84.3	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	126.4	-177.7	-175.2	78.4	0	0	0	111	Y508 L509 F516 L544 L548 K559 D560 F601 Y603	Y508-L562 HydrophobicContact CD1-CD2 3.83Å; Y508-L562 HydrophobicContact CD2-CD1 4.23Å; Y508-L562 HydrophobicContact CD2-CD2 3.98Å; Y508-L562 HydrophobicContact CE1-CD2 4.4Å; Y508-L562 HydrophobicContact CG-CD1 4.14Å; Y508-L562 HydrophobicContact CG-CD2 3.6Å; Y508-L562 HydrophobicContact CG-CG 4.47Å; L509-L562 HydrophobicContact CD1-CD1 3.92Å; F516-L562 HydrophobicContact CZ-CD2 4.22Å; L544-L562 HydrophobicContact CD1-CD2 4.06Å; L544-L562 HydrophobicContact CD2-CD2 4.48Å; L544-L562 HydrophobicContact CD2-CG 4.38Å; L544-L562 WeakPolarHBondContact CD2-O 3.13Å; L548-L562 HydrophobicContact CD1-CD2 4.4Å; L548-L562 HydrophobicContact CD2-CD2 4.27Å; K559-L562 WeakPolarHBondContact O-CB 3.28Å; K559-L562 PolarHBondContact O-N 3.39Å; D560-L562 VanDerWaalsContact C-N 3.33Å; L562-F601 HydrophobicContact CD1-CB 3.96Å; L562-F601 HydrophobicContact CD1-CD1 4.35Å; L562-F601 HydrophobicContact CD1-CG 4.1Å; L562-F601 HydrophobicContact CD2-CD1 4.45Å; L562-F601 HydrophobicContact CD2-CE1 4.49Å; L562-F601 HydrophobicContact CG-CD1 4.27Å; L562-F601 HydrophobicContact CG-CG 4.5Å; L562-Y603 HydrophobicContact CD1-CD2 4.47Å
563	H	91	Very high	83.8	Confident	61 Å²	61	51.2 Å²	51.2	28%	0.282	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	159.6	-176.3	-60.4	-52.7	0	0	0	113.2	E541 F601 T602	E541-H563 IonicContact OE1-CE1 3.8Å; E541-H563 IonicContact OE1-CG 3.67Å; E541-H563 IonicContact OE1-ND1 2.78Å; E541-H563 PolarHBondContact OE1-ND1 2.9Å; H563-F601 WeakPolarHBondContact O-CA 3.08Å; H563-T602 PolarHBondContact N-O 3.11Å; H563-T602 PolarHBondContact O-N 3.34Å; H563-T602 PolarHBondContact O-OG1 3.5Å
564	C	89.6	Confident	83.3	Confident	19 Å²	19	51.2 Å²	51.2	13%	0.128	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	122.8	175.1	-72.6	0	0	0	0	112.4	L540 E541 F599	L540-C564 HydrophobicContact CB-CB 4.08Å; E541-C564 WeakPolarHBondContact OE2-CB 3.34Å; E541-C564 PolarHBondContact OE2-N 3.43Å; C564-F599 HydrophobicContact CB-CE2 3.9Å
565	E	87.5	Confident	82.8	Confident	68 Å²	68	43.6 Å²	43.6	32%	0.318	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	140.6	171.1	-174	177.5	-155.2	0	0	111.4	L567 A600 T602 Q622	E565-L567 HydrophobicContact CG-CD2 4.06Å; E565-L567 HydrophobicContact CG-CG 4.29Å; E565-L567 WeakPolarHBondContact OE1-CD2 3.37Å; E565-L567 WeakPolarHBondContact OE2-CD2 3.26Å; E565-A600 PolarHBondContact N-O 2.78Å; E565-A600 PolarHBondContact O-N 3.13Å; E565-A600 VanDerWaalsContact O-O 3.1Å; E565-T602 HydrophobicContact CB-CG2 3.75Å; E565-T602 HydrophobicContact CG-CG2 4.34Å; E565-T602 WeakPolarHBondContact OE2-CG2 3.4Å; E565-Q622 PolarHBondContact OE2-NE2 3.15Å
566	L	85.6	Confident	81.9	Confident	40 Å²	40	39.1 Å²	39.1	21%	0.209	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	95.9	170.4	-74.5	166.8	0	0	0	108.9	V535 P537 L540	V535-L566 HydrophobicContact CB-CD1 4.01Å; V535-L566 HydrophobicContact CG1-CD1 3.75Å; V535-L566 HydrophobicContact CG1-CD2 4.37Å; P537-L566 HydrophobicContact CG-CD1 4.22Å; L540-L566 HydrophobicContact CD1-CD1 4.2Å; L540-L566 HydrophobicContact CD1-CD2 4.22Å; L540-L566 HydrophobicContact CD1-CG 4.29Å
567	L	82.8	Confident	81	Confident	3 Å²	3	42 Å²	42	2%	0.016	23%	0.225	C	C	.	.			trans	-70.1	127.8	-179.1	-67.6	171.7	0	0	0	109.7	E565 Y569 C598 A600	E565-L567 HydrophobicContact CG-CD2 4.06Å; E565-L567 HydrophobicContact CG-CG 4.29Å; E565-L567 WeakPolarHBondContact OE1-CD2 3.37Å; E565-L567 WeakPolarHBondContact OE2-CD2 3.26Å; L567-Y569 HydrophobicContact CB-CE1 4.35Å; L567-Y569 HydrophobicContact CD2-CE1 4.23Å; L567-Y569 PolarHBondContact O-N 3.3Å; L567-C598 PolarHBondContact N-O 2.9Å; L567-C598 VanDerWaalsContact O-CB 3.29Å; L567-C598 WeakPolarHBondContact O-CB 3.47Å; L567-C598 PolarHBondContact O-SG 2.84Å; L567-A600 HydrophobicContact CD1-CB 3.86Å; L567-A600 HydrophobicContact CG-CB 4.28Å
568	P	77.2	Confident	80	Confident	77 Å²	77	40.5 Å²	40.5	50%	0.5	21%	0.211	S	C	.	.	S	Bend	trans	-75.1	25.2	-176.6	27.5	-31.4	0	0	0	114
569	Y	77.6	Confident	78.5	Confident	55 Å²	55	43.4 Å²	43.4	22%	0.216	23%	0.228	C	C	.	.	S	Bend	trans	-161.1	151.9	-173	57	-89.8	0	0	0	111.2	L567 T573 Q574 K577 R626	L567-Y569 HydrophobicContact CB-CE1 4.35Å; L567-Y569 HydrophobicContact CD2-CE1 4.23Å; L567-Y569 PolarHBondContact O-N 3.3Å; Y569-T573 WeakPolarHBondContact CB-OG1 3.27Å; Y569-Q574 HydrophobicContact CD2-CB 4.04Å; Y569-Q574 HydrophobicContact CE2-CB 3.63Å; Y569-Q574 HydrophobicContact CE2-CG 3.9Å; Y569-K577 HydrophobicContact CD2-CD 4.4Å; Y569-K577 VanDerWaalsContact CE1-NZ 3.25Å; Y569-K577 HydrophobicContact CE2-CD 4.1Å; Y569-K577 VanDerWaalsContact CG-NZ 3.33Å; Y569-R626 PolarHBondContact O-NH1 3.44Å; Y569-R626 PolarHBondContact O-NH2 2.82Å
570	D	75.2	Confident	77	Confident	42 Å²	42	47.5 Å²	47.5	23%	0.225	25%	0.246	C	C	.	.			trans	-72.9	-179.5	-174.7	89.5	-48.1	0	0	0	113.2	V572 T573 Q574 L593 R626	D570-V572 PolarHBondContact OD1-N 2.7Å; D570-V572 VanDerWaalsContact OD2-CB 3.28Å; D570-V572 WeakPolarHBondContact OD2-CB 3.37Å; D570-V572 WeakPolarHBondContact OD2-CG2 3.42Å; D570-V572 PolarHBondContact OD2-N 2.76Å; D570-T573 PolarHBondContact N-OG1 3.38Å; D570-T573 VanDerWaalsContact N-OG1 3.17Å; D570-T573 PolarHBondContact O-OG1 3.1Å; D570-T573 VanDerWaalsContact OD1-CB 3.27Å; D570-T573 WeakPolarHBondContact OD1-CB 3.48Å; D570-T573 VanDerWaalsContact OD1-CG2 3.29Å; D570-T573 WeakPolarHBondContact OD1-CG2 3.08Å; D570-T573 PolarHBondContact OD1-N 3.19Å; D570-T573 PolarHBondContact OD1-OG1 3.17Å; D570-Q574 PolarHBondContact O-N 3.45Å; D570-Q574 VanDerWaalsContact O-N 3.14Å; D570-L593 HydrophobicContact CB-CD1 4.46Å; D570-L593 HydrophobicContact CB-CD2 4.46Å; D570-R626 VanDerWaalsContact C-NH2 3.29Å; D570-R626 PolarHBondContact O-NH1 3.24Å
571	L	77.5	Confident	75.2	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-69.6	-36.1	178.3	-176.7	55.2	0	0	0	112.2	Q574 M575 M623 R626 Q627 F733	L571-Q574 HydrophobicContact CD1-CB 4.48Å; L571-Q574 WeakPolarHBondContact O-CB 3.31Å; L571-Q574 PolarHBondContact O-N 3.15Å; L571-M575 HydrophobicContact CD1-CE 3.62Å; L571-M575 HydrophobicContact CD2-CE 3.88Å; L571-M575 HydrophobicContact CG-CE 3.48Å; L571-M575 VanDerWaalsContact CG-CE 3.48Å; L571-M575 WeakPolarHBondContact O-CG 3.3Å; L571-M575 PolarHBondContact O-N 3.08Å; L571-M575 VanDerWaalsContact O-N 3.08Å; L571-M623 HydrophobicContact CD1-CB 4.1Å; L571-M623 HydrophobicContact CD1-CG 4.06Å; L571-R626 HydrophobicContact CD1-CB 4.08Å; L571-R626 HydrophobicContact CD2-CB 4.02Å; L571-R626 HydrophobicContact CG-CB 4.49Å; L571-Q627 HydrophobicContact CD2-CB 4.04Å; L571-F733 HydrophobicContact CB-CE2 4.15Å; L571-F733 HydrophobicContact CB-CZ 3.95Å; L571-F733 HydrophobicContact CD2-CE2 3.89Å; L571-F733 HydrophobicContact CD2-CZ 3.83Å; L571-F733 HydrophobicContact CG-CE2 4.4Å; L571-F733 HydrophobicContact CG-CZ 4.44Å
572	V	72.3	Confident	72.9	Confident	44 Å²	44	54.1 Å²	54.1	27%	0.267	27%	0.27	S	S	.	.	H	α-helix	trans	-68.5	-38.3	-177.8	-174.9	0	0	0	0	111.5	D570 M575 S576	D570-V572 PolarHBondContact OD1-N 2.7Å; D570-V572 VanDerWaalsContact OD2-CB 3.28Å; D570-V572 WeakPolarHBondContact OD2-CB 3.37Å; D570-V572 WeakPolarHBondContact OD2-CG2 3.42Å; D570-V572 PolarHBondContact OD2-N 2.76Å; V572-M575 PolarHBondContact O-N 3.35Å; V572-S576 PolarHBondContact O-N 3.07Å; V572-S576 VanDerWaalsContact O-N 3.09Å; V572-S576 PolarHBondContact O-OG 3.24Å
573	T	74.2	Confident	70.5	Confident	41 Å²	41	63 Å²	63	25%	0.252	31%	0.311	S	S	.	.	H	α-helix	trans	-72.5	-30.4	172.5	51.4	0	0	0	0	112.8	Y569 D570 S576 K577	Y569-T573 WeakPolarHBondContact CB-OG1 3.27Å; D570-T573 PolarHBondContact N-OG1 3.38Å; D570-T573 VanDerWaalsContact N-OG1 3.17Å; D570-T573 PolarHBondContact O-OG1 3.1Å; D570-T573 VanDerWaalsContact OD1-CB 3.27Å; D570-T573 WeakPolarHBondContact OD1-CB 3.48Å; D570-T573 VanDerWaalsContact OD1-CG2 3.29Å; D570-T573 WeakPolarHBondContact OD1-CG2 3.08Å; D570-T573 PolarHBondContact OD1-N 3.19Å; D570-T573 PolarHBondContact OD1-OG1 3.17Å; T573-S576 PolarHBondContact O-N 3.12Å; T573-K577 WeakPolarHBondContact O-CG 3.37Å; T573-K577 PolarHBondContact O-N 3.38Å
574	Q	75.1	Confident	67.9	Low	1 Å²	1	67.5 Å²	67.5	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-59.4	-47.1	169.5	-170.9	167.3	25.4	0	0	111.3	Y569 D570 L571 S576 K577 I578 Q622 M623	Y569-Q574 HydrophobicContact CD2-CB 4.04Å; Y569-Q574 HydrophobicContact CE2-CB 3.63Å; Y569-Q574 HydrophobicContact CE2-CG 3.9Å; D570-Q574 PolarHBondContact O-N 3.45Å; D570-Q574 VanDerWaalsContact O-N 3.14Å; L571-Q574 HydrophobicContact CD1-CB 4.48Å; L571-Q574 WeakPolarHBondContact O-CB 3.31Å; L571-Q574 PolarHBondContact O-N 3.15Å; Q574-S576 VanDerWaalsContact C-N 3.32Å; Q574-S576 PolarHBondContact O-N 3.24Å; Q574-K577 PolarHBondContact O-N 3.32Å; Q574-I578 HydrophobicContact CG-CD1 3.82Å; Q574-I578 PolarHBondContact O-N 3Å; Q574-Q622 VanDerWaalsContact NE2-OE1 3.13Å; Q574-M623 HydrophobicContact CG-CG 3.9Å; Q574-M623 HydrophobicContact CG-SD 4.45Å
575	M	71.5	Confident	65.5	Low	10 Å²	10	72.1 Å²	72.1	5%	0.049	35%	0.352	C	S	.	.	H	α-helix	trans	-59.3	-46.3	176	-41.5	-139.7	163	0	0	110.8	L571 V572 K577 I578 M579 M623 L722	L571-M575 HydrophobicContact CD1-CE 3.62Å; L571-M575 HydrophobicContact CD2-CE 3.88Å; L571-M575 HydrophobicContact CG-CE 3.48Å; L571-M575 VanDerWaalsContact CG-CE 3.48Å; L571-M575 WeakPolarHBondContact O-CG 3.3Å; L571-M575 PolarHBondContact O-N 3.08Å; L571-M575 VanDerWaalsContact O-N 3.08Å; V572-M575 PolarHBondContact O-N 3.35Å; M575-K577 VanDerWaalsContact C-N 3.32Å; M575-K577 PolarHBondContact O-N 2.81Å; M575-I578 PolarHBondContact O-N 3.36Å; M575-M579 HydrophobicContact CB-SD 4.22Å; M575-M579 VanDerWaalsContact O-CB 3.27Å; M575-M579 WeakPolarHBondContact O-CB 3.14Å; M575-M579 VanDerWaalsContact O-CG 3.26Å; M575-M579 WeakPolarHBondContact O-CG 3.43Å; M575-M579 PolarHBondContact O-N 3.3Å; M575-M623 HydrophobicContact CB-CE 4.07Å; M575-M623 HydrophobicContact CE-CE 3.88Å; M575-M623 HydrophobicContact CG-CE 3.75Å; M575-M623 HydrophobicContact SD-CE 3.74Å; M575-L722 HydrophobicContact CE-CB 3.94Å; M575-L722 HydrophobicContact CE-CD1 3.95Å; M575-L722 HydrophobicContact CE-CD2 3.38Å; M575-L722 HydrophobicContact CE-CG 3.92Å; M575-L722 HydrophobicContact SD-CB 3.91Å; M575-L722 HydrophobicContact SD-CD2 4.17Å
576	S	65.4	Low	63.3	Low	45 Å²	45	77.6 Å²	77.6	32%	0.315	38%	0.378	S	S	.	.	H	α-helix	trans	-60	-39.3	-177.5	-58.4	0	0	0	0	112.6	V572 T573 Q574 K580	V572-S576 PolarHBondContact O-N 3.07Å; V572-S576 VanDerWaalsContact O-N 3.09Å; V572-S576 PolarHBondContact O-OG 3.24Å; T573-S576 PolarHBondContact O-N 3.12Å; Q574-S576 VanDerWaalsContact C-N 3.32Å; Q574-S576 PolarHBondContact O-N 3.24Å; S576-K580 VanDerWaalsContact O-CB 3.28Å; S576-K580 WeakPolarHBondContact O-CB 3.33Å; S576-K580 WeakPolarHBondContact O-CG 3.32Å; S576-K580 PolarHBondContact O-N 2.73Å
577	K	68.1	Low	61.2	Low	65 Å²	65	80.5 Å²	80.5	28%	0.283	41%	0.407	S	S	.	.	H	α-helix	trans	-65.1	-53.1	175	-71.3	171.4	179.6	-179.8	0	111.7	Y569 T573 Q574 M575 K580 K581	Y569-K577 HydrophobicContact CD2-CD 4.4Å; Y569-K577 VanDerWaalsContact CE1-NZ 3.25Å; Y569-K577 HydrophobicContact CE2-CD 4.1Å; Y569-K577 VanDerWaalsContact CG-NZ 3.33Å; T573-K577 WeakPolarHBondContact O-CG 3.37Å; T573-K577 PolarHBondContact O-N 3.38Å; Q574-K577 PolarHBondContact O-N 3.32Å; M575-K577 VanDerWaalsContact C-N 3.32Å; M575-K577 PolarHBondContact O-N 2.81Å; K577-K580 PolarHBondContact O-N 2.92Å; K577-K581 PolarHBondContact O-N 3.48Å
578	I	66.8	Low	59.4	Low	58 Å²	58	86.9 Å²	86.9	30%	0.297	44%	0.437	S	S	.	.	H	α-helix	trans	-68.8	-39.4	-173	-67.1	164.5	0	0	0	111.6	Q574 M575 M623	Q574-I578 HydrophobicContact CG-CD1 3.82Å; Q574-I578 PolarHBondContact O-N 3Å; M575-I578 PolarHBondContact O-N 3.36Å; I578-M623 HydrophobicContact CD1-CG 4.38Å; I578-M623 HydrophobicContact CD1-SD 3.55Å; I578-M623 VanDerWaalsContact CD1-SD 3.55Å
579	M	58.2	Low	58.1	Low	111 Å²	111	88.6 Å²	88.6	55%	0.547	45%	0.448	S	S	.	.	H	α-helix	trans	-74	-28.6	-179.2	-68.9	177	67.9	0	0	113.8	M575 T723	M575-M579 HydrophobicContact CB-SD 4.22Å; M575-M579 VanDerWaalsContact O-CB 3.27Å; M575-M579 WeakPolarHBondContact O-CB 3.14Å; M575-M579 VanDerWaalsContact O-CG 3.26Å; M575-M579 WeakPolarHBondContact O-CG 3.43Å; M575-M579 PolarHBondContact O-N 3.3Å; M579-T723 WeakPolarHBondContact CE-O 3.35Å
580	K	52.9	Low	56.9	Low	121 Å²	121	93.6 Å²	93.6	53%	0.526	47%	0.467	S	S	.	.	H	α-helix	trans	-97.2	-22.6	-174.8	-71.6	-169.4	172.1	-167.2	0	115.6	S576 K577 E582	S576-K580 VanDerWaalsContact O-CB 3.28Å; S576-K580 WeakPolarHBondContact O-CB 3.33Å; S576-K580 WeakPolarHBondContact O-CG 3.32Å; S576-K580 PolarHBondContact O-N 2.73Å; K577-K580 PolarHBondContact O-N 2.92Å; K580-E582 HydrophobicContact CB-CB 4.45Å; K580-E582 HydrophobicContact CB-CG 4.07Å; K580-E582 HydrophobicContact CD-CG 4.1Å; K580-E582 WeakPolarHBondContact CD-OE1 3.22Å; K580-E582 WeakPolarHBondContact CD-OE2 3.41Å; K580-E582 IonicContact NZ-OE1 2.93Å; K580-E582 PolarHBondContact NZ-OE1 2.77Å; K580-E582 IonicContact NZ-OE2 3.94Å; K580-E582 PolarHBondContact NZ-OE2 3.41Å; K580-E582 PolarHBondContact O-N 3Å
581	K	50.1	Low	56	Low	183 Å²	183	97.2 Å²	97.2	80%	0.796	49%	0.485	S	S	*	.			trans	51.7	33.1	-168.3	-62.3	-169.9	171.7	-167.1	0	113.9	K577 E583	K577-K581 PolarHBondContact O-N 3.48Å; K581-E583 PolarHBondContact O-N 2.81Å; K581-E583 VanDerWaalsContact O-N 3.1Å
582	E	41.7	Very low	55.3	Low	86 Å²	86	104.5 Å²	104.5	40%	0.402	53%	0.525	S	S	.	.			trans	-71.5	103.3	174	-82.9	170	170.7	0	0	109.2	K580 N584 W585	K580-E582 HydrophobicContact CB-CB 4.45Å; K580-E582 HydrophobicContact CB-CG 4.07Å; K580-E582 HydrophobicContact CD-CG 4.1Å; K580-E582 WeakPolarHBondContact CD-OE1 3.22Å; K580-E582 WeakPolarHBondContact CD-OE2 3.41Å; K580-E582 IonicContact NZ-OE1 2.93Å; K580-E582 PolarHBondContact NZ-OE1 2.77Å; K580-E582 IonicContact NZ-OE2 3.94Å; K580-E582 PolarHBondContact NZ-OE2 3.41Å; K580-E582 PolarHBondContact O-N 3Å; E582-N584 VanDerWaalsContact C-N 3.27Å; E582-N584 PolarHBondContact O-N 3.32Å; E582-W585 HydrophobicContact CB-CZ2 4.12Å; E582-W585 PolarHBondContact O-NE1 3.42Å; E582-W585 WeakPolarHBondContact OE2-CZ2 3.31Å
583	E	39.8	Very low	55.2	Low	189 Å²	189	103.5 Å²	103.5	88%	0.883	52%	0.518	S	S	*	.			trans	-69.2	-21.9	-177.4	-63.5	179.9	141.1	0	0	113.5	K581	K581-E583 PolarHBondContact O-N 2.81Å; K581-E583 VanDerWaalsContact O-N 3.1Å
584	N	36.6	Very low	55.5	Low	155 Å²	155	103 Å²	103	83%	0.829	52%	0.516	S	S	*	.			trans	-100.4	89.7	-176.7	-77.9	-56.4	0	0	0	112.1	E582	E582-N584 VanDerWaalsContact C-N 3.27Å; E582-N584 PolarHBondContact O-N 3.32Å
585	W	40.4	Very low	55.7	Low	117 Å²	117	103 Å²	103	44%	0.443	52%	0.516	S	S	.	.			trans	-110.8	111.1	168.3	-72.4	97.4	0	0	0	112	E582	E582-W585 HydrophobicContact CB-CZ2 4.12Å; E582-W585 PolarHBondContact O-NE1 3.42Å; E582-W585 WeakPolarHBondContact OE2-CZ2 3.31Å
586	Q	40.2	Very low	56.3	Low	182 Å²	182	103.3 Å²	103.3	85%	0.85	52%	0.517	S	S	*	.			trans	-64.3	131.9	153	-68.3	179	-7.8	0	0	107.9	Q588	Q586-Q588 PolarHBondContact O-N 3.5Å
587	A	41.5	Very low	57	Low	101 Å²	101	102.9 Å²	102.9	84%	0.835	51%	0.511	S	S	*	.			trans	-64	108.1	175.3	0	0	0	0	0	109.2
588	Q	46.1	Very low	57.7	Low	137 Å²	137	99.9 Å²	99.9	64%	0.64	50%	0.498	S	S	*	.			trans	-57.8	142	163.6	-70.4	-175.2	-16.9	0	0	108.1	Q586	Q586-Q588 PolarHBondContact O-N 3.5Å
589	P	48.3	Very low	58.8	Low	113 Å²	113	97.2 Å²	97.2	73%	0.734	48%	0.484	S	S	*	.			trans	-57.9	151.3	-180	26	-34.9	0	0	0	110.1	L591	P589-L591 PolarHBondContact O-N 3.41Å
590	R	53.8	Low	60.4	Low	160 Å²	160	92 Å²	92	60%	0.604	46%	0.458	S	S	*	.			trans	-54.1	112.9	170.8	-68.6	-179.3	179.7	166.8	-0.7	107.8	D533	D533-R590 WeakPolarHBondContact OD1-CD 3.3Å; D533-R590 IonicContact OD1-CZ 3.11Å; D533-R590 IonicContact OD1-NE 2.75Å; D533-R590 IonicContact OD1-NH1 3.44Å; D533-R590 PolarHBondContact OD1-NH1 2.77Å
591	L	55.7	Low	62.2	Low	118 Å²	118	86.2 Å²	86.2	62%	0.618	43%	0.433	S	S	*	.			trans	-64	159.8	165.3	-71	163	0	0	0	108.2	P589 L593	P589-L591 PolarHBondContact O-N 3.41Å; L591-L593 HydrophobicContact CB-CD1 4.24Å; L591-L593 HydrophobicContact CB-CD2 4.34Å; L591-L593 HydrophobicContact CB-CG 3.89Å; L591-L593 PolarHBondContact O-N 2.91Å
592	D	61.7	Low	64.1	Low	158 Å²	158	79.3 Å²	79.3	85%	0.845	41%	0.406	S	S	*	.	S	Bend	trans	-68.5	68.2	173.4	-62.5	-63.5	0	0	0	111.2
593	L	71.5	Confident	66.5	Low	23 Å²	23	75.6 Å²	75.6	12%	0.12	39%	0.389	C	S	.	.			trans	-91.6	141.8	-179.7	-62.8	171.3	0	0	0	109.6	V532 D570 L591 E597 C598	V532-L593 HydrophobicContact CG2-CB 4.2Å; V532-L593 WeakPolarHBondContact CG2-O 3.26Å; V532-L593 PolarHBondContact N-O 2.77Å; D570-L593 HydrophobicContact CB-CD1 4.46Å; D570-L593 HydrophobicContact CB-CD2 4.46Å; L591-L593 HydrophobicContact CB-CD1 4.24Å; L591-L593 HydrophobicContact CB-CD2 4.34Å; L591-L593 HydrophobicContact CB-CG 3.89Å; L591-L593 PolarHBondContact O-N 2.91Å; L593-E597 WeakPolarHBondContact CD2-OE2 3.42Å; L593-C598 VanDerWaalsContact CD1-SG 3.54Å
594	S	79.3	Confident	68.7	Low	31 Å²	31	70.8 Å²	70.8	22%	0.217	37%	0.366	C	S	.	.	B	Isolated β-bridge	trans	-73.1	149.2	168.4	172.5	0	0	0	0	110	L528 L596 E597 C598	L528-S594 PolarHBondContact O-OG 2.78Å; S594-L596 PolarHBondContact O-N 2.99Å; S594-L596 PolarHBondContact OG-N 3.29Å; S594-E597 PolarHBondContact O-N 2.99Å; S594-C598 PolarHBondContact O-N 2.76Å
595	G	79.8	Confident	71	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-49.6	-38.6	170.1	0	0	0	0	0	112.2	L528 K530 E597 C598 F599	L528-G595 CarbonylContact O-C 3.57Å; L528-G595 WeakPolarHBondContact O-CA 3.44Å; L528-G595 PolarHBondContact O-N 3.09Å; K530-G595 PolarHBondContact O-N 3.43Å; G595-E597 VanDerWaalsContact C-N 3.33Å; G595-E597 PolarHBondContact O-N 3.22Å; G595-C598 PolarHBondContact O-N 2.95Å; G595-F599 VanDerWaalsContact O-CB 3.27Å; G595-F599 WeakPolarHBondContact O-CB 3.44Å; G595-F599 PolarHBondContact O-N 3.5Å
596	L	83.6	Confident	73	Confident	16 Å²	16	63.9 Å²	63.9	8%	0.084	33%	0.333	C	S	.	.	H	α-helix	trans	-57.8	-38.3	174.2	-170	78.7	0	0	0	113.8	L528 S594 F629 Y630 H633	L528-L596 HydrophobicContact CB-CB 4.46Å; L528-L596 HydrophobicContact CB-CD1 4.47Å; L528-L596 HydrophobicContact CD1-CD1 4.41Å; L528-L596 PolarHBondContact O-N 2.95Å; S594-L596 PolarHBondContact O-N 2.99Å; S594-L596 PolarHBondContact OG-N 3.29Å; L596-F629 HydrophobicContact CD1-CD1 4.41Å; L596-F629 HydrophobicContact CD1-CE1 3.8Å; L596-Y630 HydrophobicContact CD2-CD2 3.88Å; L596-Y630 HydrophobicContact CD2-CE2 3.97Å; L596-Y630 HydrophobicContact CG-CD2 4.39Å; L596-H633 HydrophobicContact CD1-CB 4.11Å; L596-H633 HydrophobicContact CD2-CB 4.19Å; L596-H633 VanDerWaalsContact CD2-CD2 3.46Å; L596-H633 WeakPolarHBondContact CD2-CD2 3.26Å
597	E	80.8	Confident	74.7	Confident	37 Å²	37	59.2 Å²	59.2	17%	0.173	31%	0.308	C	S	.	.	H	α-helix	trans	-77.1	-26.1	-179.1	-70.1	178	157.4	0	0	111.6	L593 S594 G595 R626 K737	L593-E597 WeakPolarHBondContact CD2-OE2 3.42Å; S594-E597 PolarHBondContact O-N 2.99Å; G595-E597 VanDerWaalsContact C-N 3.33Å; G595-E597 PolarHBondContact O-N 3.22Å; E597-R626 PolarHBondContact O-NH2 3.49Å; E597-K737 IonicContact OE1-NZ 2.78Å; E597-K737 PolarHBondContact OE1-NZ 3.33Å; E597-K737 IonicContact OE2-NZ 2.76Å
598	C	83.9	Confident	76.5	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.014	27%	0.269	C	S	.	.	H	α-helix	trans	-97.7	-14.7	-179.5	-83.1	0	0	0	0	115.4	V532 L567 L593 S594 G595	V532-C598 HydrophobicContact CG2-CB 3.58Å; L567-C598 PolarHBondContact N-O 2.9Å; L567-C598 VanDerWaalsContact O-CB 3.29Å; L567-C598 WeakPolarHBondContact O-CB 3.47Å; L567-C598 PolarHBondContact O-SG 2.84Å; L593-C598 VanDerWaalsContact CD1-SG 3.54Å; S594-C598 PolarHBondContact O-N 2.76Å; G595-C598 PolarHBondContact O-N 2.95Å
599	F	89.9	Confident	78.3	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.009	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	139.1	-177.7	-179.4	-104.5	0	0	0	113.4	F520 L528 L540 C564 G595 F601 F625 R626 F629	F520-F599 AromaticContact CE1-CE1 3.6Å; F520-F599 HydrophobicContact CE1-CE1 3.6Å; F520-F599 HydrophobicContact CE1-CE2 4.41Å; F520-F599 AromaticContact CE1-CZ 3.48Å; F520-F599 HydrophobicContact CE1-CZ 3.48Å; F520-F599 VanDerWaalsContact CE1-CZ 3.48Å; F520-F599 HydrophobicContact CZ-CE1 4.02Å; F520-F599 HydrophobicContact CZ-CE2 4.03Å; F520-F599 AromaticContact CZ-CZ 3.38Å; F520-F599 HydrophobicContact CZ-CZ 3.38Å; L528-F599 HydrophobicContact CD2-CB 3.86Å; L528-F599 HydrophobicContact CD2-CD2 3.93Å; L528-F599 HydrophobicContact CD2-CG 3.88Å; L540-F599 HydrophobicContact CD1-CD2 3.99Å; L540-F599 HydrophobicContact CD1-CE2 4.13Å; C564-F599 HydrophobicContact CB-CE2 3.9Å; G595-F599 VanDerWaalsContact O-CB 3.27Å; G595-F599 WeakPolarHBondContact O-CB 3.44Å; G595-F599 PolarHBondContact O-N 3.5Å; F599-F601 HydrophobicContact CE1-CD1 4.43Å; F599-F601 HydrophobicContact CE1-CE1 4.17Å; F599-F601 HydrophobicContact CE1-CE2 4.46Å; F599-F601 HydrophobicContact CE1-CZ 4.18Å; F599-F601 AromaticContact CZ-CD1 3.91Å; F599-F601 HydrophobicContact CZ-CD1 3.91Å; F599-F601 AromaticContact CZ-CE1 3.61Å; F599-F601 HydrophobicContact CZ-CE1 3.61Å; F599-F601 HydrophobicContact CZ-CZ 4.03Å; F599-F625 AromaticContact CD1-CE1 3.96Å; F599-F625 HydrophobicContact CD1-CE1 3.96Å; F599-F625 HydrophobicContact CD1-CZ 4.25Å; F599-F625 AromaticContact CE1-CE1 3.89Å; F599-F625 HydrophobicContact CE1-CE1 3.89Å; F599-F625 AromaticContact CE1-CZ 3.83Å; F599-F625 HydrophobicContact CE1-CZ 3.83Å; F599-R626 WeakPolarHBondContact O-CG 3.49Å; F599-F629 HydrophobicContact CD1-CD1 4.14Å; F599-F629 AromaticContact CD1-CE1 3.59Å; F599-F629 HydrophobicContact CD1-CE1 3.59Å; F599-F629 AromaticContact CD1-CZ 3.93Å; F599-F629 HydrophobicContact CD1-CZ 3.93Å; F599-F629 HydrophobicContact CE1-CE1 4.15Å; F599-F629 HydrophobicContact CE1-CZ 4.02Å
600	A	90.1	Very high	80	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	156.3	170	0	0	0	0	0	110.9	E565 L567 Q622 R626	E565-A600 PolarHBondContact N-O 2.78Å; E565-A600 PolarHBondContact O-N 3.13Å; E565-A600 VanDerWaalsContact O-O 3.1Å; L567-A600 HydrophobicContact CD1-CB 3.86Å; L567-A600 HydrophobicContact CG-CB 4.28Å; A600-Q622 HydrophobicContact CB-CG 4.21Å; A600-R626 HydrophobicContact CB-CG 4.31Å
601	F	92	Very high	81.4	Confident	1 Å²	1	37 Å²	37	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	139.6	161.5	-72.6	-52	0	0	0	110.6	L509 F516 F520 L544 L562 H563 F599 Q622 F625	L509-F601 HydrophobicContact CD1-CB 4.46Å; L509-F601 HydrophobicContact CG-CB 4.34Å; F516-F601 HydrophobicContact CE1-CE2 4.09Å; F516-F601 HydrophobicContact CE1-CZ 4.07Å; F516-F601 HydrophobicContact CZ-CE2 4.33Å; F516-F601 AromaticContact CZ-CZ 3.83Å; F516-F601 HydrophobicContact CZ-CZ 3.83Å; F520-F601 AromaticContact CD1-CZ 3.88Å; F520-F601 HydrophobicContact CD1-CZ 3.88Å; F520-F601 HydrophobicContact CD2-CZ 4.47Å; F520-F601 HydrophobicContact CE1-CE1 4.19Å; F520-F601 AromaticContact CE1-CZ 3.74Å; F520-F601 HydrophobicContact CE1-CZ 3.74Å; F520-F601 HydrophobicContact CE2-CE1 4.32Å; F520-F601 HydrophobicContact CE2-CZ 4.34Å; F520-F601 HydrophobicContact CG-CZ 4.26Å; F520-F601 AromaticContact CZ-CE1 4Å; F520-F601 HydrophobicContact CZ-CE1 4Å; F520-F601 AromaticContact CZ-CZ 3.99Å; F520-F601 HydrophobicContact CZ-CZ 3.99Å; L544-F601 HydrophobicContact CD1-CE1 3.71Å; L544-F601 HydrophobicContact CD1-CZ 4.14Å; L544-F601 HydrophobicContact CD2-CD1 4.37Å; L544-F601 HydrophobicContact CD2-CE1 4.05Å; L544-F601 HydrophobicContact CG-CE1 4.48Å; L562-F601 HydrophobicContact CD1-CB 3.96Å; L562-F601 HydrophobicContact CD1-CD1 4.35Å; L562-F601 HydrophobicContact CD1-CG 4.1Å; L562-F601 HydrophobicContact CD2-CD1 4.45Å; L562-F601 HydrophobicContact CD2-CE1 4.49Å; L562-F601 HydrophobicContact CG-CD1 4.27Å; L562-F601 HydrophobicContact CG-CG 4.5Å; H563-F601 WeakPolarHBondContact O-CA 3.08Å; F599-F601 HydrophobicContact CE1-CD1 4.43Å; F599-F601 HydrophobicContact CE1-CE1 4.17Å; F599-F601 HydrophobicContact CE1-CE2 4.46Å; F599-F601 HydrophobicContact CE1-CZ 4.18Å; F599-F601 AromaticContact CZ-CD1 3.91Å; F599-F601 HydrophobicContact CZ-CD1 3.91Å; F599-F601 AromaticContact CZ-CE1 3.61Å; F599-F601 HydrophobicContact CZ-CE1 3.61Å; F599-F601 HydrophobicContact CZ-CZ 4.03Å; F601-Q622 VanDerWaalsContact O-CG 3.3Å; F601-Q622 WeakPolarHBondContact O-CG 3.21Å; F601-Q622 PolarHBondContact O-NE2 3.47Å; F601-F625 AromaticContact CD2-CD2 3.95Å; F601-F625 HydrophobicContact CD2-CD2 3.95Å; F601-F625 HydrophobicContact CD2-CE1 4.04Å; F601-F625 AromaticContact CD2-CE2 3.27Å; F601-F625 HydrophobicContact CD2-CE2 3.27Å; F601-F625 AromaticContact CD2-CZ 3.34Å; F601-F625 HydrophobicContact CD2-CZ 3.34Å; F601-F625 AromaticContact CE2-CE2 3.5Å; F601-F625 HydrophobicContact CE2-CE2 3.5Å; F601-F625 AromaticContact CE2-CZ 3.52Å; F601-F625 HydrophobicContact CE2-CZ 3.52Å; F601-F625 HydrophobicContact CG-CE2 4.39Å; F601-F625 HydrophobicContact CG-CZ 4.18Å; F601-F625 HydrophobicContact CZ-CZ 4.47Å
602	T	89.9	Confident	82.8	Confident	37 Å²	37	31.5 Å²	31.5	23%	0.227	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	158.4	161.9	39.9	0	0	0	0	109.9	H563 E565	H563-T602 PolarHBondContact N-O 3.11Å; H563-T602 PolarHBondContact O-N 3.34Å; H563-T602 PolarHBondContact O-OG1 3.5Å; E565-T602 HydrophobicContact CB-CG2 3.75Å; E565-T602 HydrophobicContact CG-CG2 4.34Å; E565-T602 WeakPolarHBondContact OE2-CG2 3.4Å
603	Y	90.9	Very high	84	Confident	9 Å²	9	24.2 Å²	24.2	4%	0.035	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	112.7	176.9	-172.6	-114.1	0	0	0	108.7	H501 V505 Y558 D561 L562 V605 L613 I618	H501-Y603 WeakPolarHBondContact CA-OH 3.49Å; H501-Y603 HydrophobicContact CB-CE1 4.36Å; H501-Y603 AromaticContact ND1-CZ 3.9Å; H501-Y603 PolarHBondContact ND1-OH 3.05Å; V505-Y603 HydrophobicContact CG2-CD1 3.35Å; V505-Y603 HydrophobicContact CG2-CE1 3.47Å; V505-Y603 VanDerWaalsContact CG2-CE1 3.47Å; V505-Y603 HydrophobicContact CG2-CG 4.02Å; Y558-Y603 WeakPolarHBondContact CB-OH 3.31Å; D561-Y603 HydrophobicContact CB-CD2 4.08Å; D561-Y603 HydrophobicContact CB-CE2 3.67Å; D561-Y603 CarbonylContact O-C 3.57Å; D561-Y603 WeakPolarHBondContact O-CA 3.48Å; D561-Y603 WeakPolarHBondContact O-CD2 3.4Å; L562-Y603 HydrophobicContact CD1-CD2 4.47Å; Y603-V605 HydrophobicContact CD1-CG2 3.43Å; Y603-V605 VanDerWaalsContact CD1-CG2 3.43Å; Y603-V605 HydrophobicContact CE1-CG2 3.75Å; Y603-V605 HydrophobicContact CG-CG2 4.47Å; Y603-V605 PolarHBondContact O-N 2.84Å; Y603-L613 HydrophobicContact CE1-CD1 4.27Å; Y603-I618 HydrophobicContact CD1-CD1 4.45Å
604	E	87.4	Confident	84.7	Confident	87 Å²	87	23.9 Å²	23.9	41%	0.407	12%	0.117	S	C	.	.			trans	-81.2	94.7	-175.3	-169.8	-159.5	97.7	0	0	110.4	D561 K606	D561-E604 PolarHBondContact O-N 3.15Å; E604-K606 PolarHBondContact O-N 3.34Å; E604-K606 IonicContact OE1-NZ 3.41Å; E604-K606 PolarHBondContact OE1-NZ 3.06Å
605	V	83.7	Confident	84.8	Confident	21 Å²	21	25 Å²	25	13%	0.127	12%	0.119	C	C	.	.			trans	-85.1	108.2	-179.3	-169.2	0	0	0	0	110.7	Y603 C609 L613 I618	Y603-V605 HydrophobicContact CD1-CG2 3.43Å; Y603-V605 VanDerWaalsContact CD1-CG2 3.43Å; Y603-V605 HydrophobicContact CE1-CG2 3.75Å; Y603-V605 HydrophobicContact CG-CG2 4.47Å; Y603-V605 PolarHBondContact O-N 2.84Å; V605-C609 VanDerWaalsContact CG1-C 3.42Å; V605-C609 HydrophobicContact CG1-CB 3.44Å; V605-C609 VanDerWaalsContact CG1-CB 3.44Å; V605-L613 HydrophobicContact CB-CB 4.21Å; V605-L613 HydrophobicContact CG1-CB 4.09Å; V605-L613 HydrophobicContact CG1-CD1 4.16Å; V605-L613 HydrophobicContact CG2-CB 3.66Å; V605-L613 HydrophobicContact CG2-CD1 3.8Å; V605-L613 HydrophobicContact CG2-CG 4.38Å; V605-I618 HydrophobicContact CG2-CD1 4.43Å
606	K	83.4	Confident	85	Confident	106 Å²	106	28.2 Å²	28.2	46%	0.461	14%	0.135	S	C	.	.			trans	-63.4	143.5	174.9	-67.6	168.5	177.9	58.1	0	110.8	D561 E604 C609	D561-K606 IonicContact OD1-NZ 2.68Å; D561-K606 PolarHBondContact OD1-NZ 3.08Å; E604-K606 PolarHBondContact O-N 3.34Å; E604-K606 IonicContact OE1-NZ 3.41Å; E604-K606 PolarHBondContact OE1-NZ 3.06Å; K606-C609 PolarHBondContact O-N 3.44Å; K606-C609 VanDerWaalsContact O-N 3.1Å
607	W	74.7	Confident	85.2	Confident	84 Å²	84	27.6 Å²	27.6	32%	0.318	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	135.7	175.7	-173.8	91.6	0	0	0	109.8	W417 V448 Q451 C452	W417-W607 AromaticContact NE1-NE1 3.96Å; V448-W607 HydrophobicContact CG1-CZ2 3.96Å; V448-W607 WeakPolarHBondContact O-CH2 3.5Å; Q451-W607 HydrophobicContact CB-CH2 3.51Å; Q451-W607 HydrophobicContact CB-CZ2 3.62Å; Q451-W607 HydrophobicContact CB-CZ3 4.37Å; C452-W607 HydrophobicContact CB-CH2 4.26Å; C452-W607 HydrophobicContact CB-CZ3 4.29Å; C452-W607 VanDerWaalsContact N-CH2 3.32Å; C452-W607 WeakPolarHBondContact SG-CH2 3.08Å
608	P	79.5	Confident	85.6	Confident	3 Å²	3	26.7 Å²	26.7	2%	0.019	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	cis	-93.6	-4.2	15	36.5	-36.7	0	0	0	116.1	L492 N496 S610 L611	L492-P608 HydrophobicContact CD2-CB 4.16Å; L492-P608 HydrophobicContact CD2-CG 4.07Å; N496-P608 HydrophobicContact CB-CG 4.4Å; N496-P608 VanDerWaalsContact OD1-CD 3.27Å; N496-P608 WeakPolarHBondContact OD1-CD 3.37Å; P608-S610 PolarHBondContact O-N 2.87Å; P608-S610 VanDerWaalsContact O-N 3.11Å; P608-L611 HydrophobicContact CB-CD1 4.46Å; P608-L611 WeakPolarHBondContact O-CB 3Å; P608-L611 WeakPolarHBondContact O-CG 3.24Å; P608-L611 PolarHBondContact O-N 3.48Å; P608-L611 VanDerWaalsContact O-N 3.15Å
609	C	84.8	Confident	85.8	Confident	2 Å²	2	28 Å²	28	1%	0.014	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-64	-18.9	-175.3	-72.6	0	0	0	0	113.8	L498 V605 K606 L611 V612 L613	L498-C609 HydrophobicContact CD1-CB 4.32Å; V605-C609 VanDerWaalsContact CG1-C 3.42Å; V605-C609 HydrophobicContact CG1-CB 3.44Å; V605-C609 VanDerWaalsContact CG1-CB 3.44Å; K606-C609 PolarHBondContact O-N 3.44Å; K606-C609 VanDerWaalsContact O-N 3.1Å; C609-L611 PolarHBondContact O-N 3.24Å; C609-L611 VanDerWaalsContact O-N 3.14Å; C609-V612 PolarHBondContact O-N 3.37Å; C609-L613 PolarHBondContact O-N 2.96Å
610	S	84.3	Confident	85.7	Confident	10 Å²	10	29.1 Å²	29.1	7%	0.07	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-59.6	-18.9	173.4	69.7	0	0	0	0	114.3	S413 P608 V612 L613 N614	S413-S610 WeakPolarHBondContact OG-CB 3.41Å; S413-S610 PolarHBondContact OG-OG 3.38Å; P608-S610 PolarHBondContact O-N 2.87Å; P608-S610 VanDerWaalsContact O-N 3.11Å; S610-V612 VanDerWaalsContact C-N 3.27Å; S610-V612 PolarHBondContact O-N 3.48Å; S610-L613 CarbonylContact O-C 3.59Å; S610-N614 WeakPolarHBondContact O-CA 3.47Å; S610-N614 PolarHBondContact O-N 2.87Å
611	L	82.8	Confident	85.9	Confident	29 Å²	29	29.1 Å²	29.1	15%	0.152	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-68.2	-24.3	173.6	-67.3	170.2	0	0	0	113.4	W417 V448 P608 C609 L706	W417-L611 HydrophobicContact CG-CD2 4.16Å; V448-L611 HydrophobicContact CB-CD1 4.29Å; V448-L611 HydrophobicContact CG1-CD1 3.46Å; V448-L611 VanDerWaalsContact CG1-CD1 3.46Å; V448-L611 HydrophobicContact CG2-CD1 3.77Å; P608-L611 HydrophobicContact CB-CD1 4.46Å; P608-L611 WeakPolarHBondContact O-CB 3Å; P608-L611 WeakPolarHBondContact O-CG 3.24Å; P608-L611 PolarHBondContact O-N 3.48Å; P608-L611 VanDerWaalsContact O-N 3.15Å; C609-L611 PolarHBondContact O-N 3.24Å; C609-L611 VanDerWaalsContact O-N 3.14Å; L611-L706 WeakPolarHBondContact O-CD2 3.44Å
612	V	85.4	Confident	85.8	Confident	3 Å²	3	29.4 Å²	29.4	2%	0.018	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-46.1	176.1	-179.5	0	0	0	0	109.9	L492 L498 C609 S610 N614 V705 L706 H709	L492-V612 HydrophobicContact CD1-CG2 4.43Å; L498-V612 HydrophobicContact CD1-CB 4.04Å; L498-V612 HydrophobicContact CD1-CG1 4.24Å; L498-V612 HydrophobicContact CD1-CG2 4.45Å; L498-V612 HydrophobicContact CD2-CB 4.24Å; L498-V612 HydrophobicContact CD2-CG1 4.27Å; L498-V612 HydrophobicContact CD2-CG2 3.86Å; C609-V612 PolarHBondContact O-N 3.37Å; S610-V612 VanDerWaalsContact C-N 3.27Å; S610-V612 PolarHBondContact O-N 3.48Å; V612-N614 VanDerWaalsContact C-N 3.28Å; V612-N614 PolarHBondContact O-N 2.98Å; V612-V705 HydrophobicContact CG1-CG1 4.03Å; V612-V705 HydrophobicContact CG2-CG1 4.37Å; V612-L706 HydrophobicContact CB-CD2 4.21Å; V612-L706 HydrophobicContact CG1-CD2 4.32Å; V612-L706 HydrophobicContact CG2-CD2 3.92Å; V612-H709 PolarHBondContact O-CE1 3.01Å; V612-H709 VanDerWaalsContact O-CE1 3.25Å
613	L	86.8	Confident	85.7	Confident	5 Å²	5	28 Å²	28	3%	0.026	14%	0.135	C	C	.	.	S	Bend	trans	-91.4	63.5	175	-64.5	172.4	0	0	0	110.4	H501 L502 V505 Y603 V605 C609 S610 I618 Y621 H709	H501-L613 HydrophobicContact CB-CD1 4.21Å; L502-L613 HydrophobicContact CD2-CD2 3.84Å; V505-L613 HydrophobicContact CG2-CD1 4.21Å; Y603-L613 HydrophobicContact CE1-CD1 4.27Å; V605-L613 HydrophobicContact CB-CB 4.21Å; V605-L613 HydrophobicContact CG1-CB 4.09Å; V605-L613 HydrophobicContact CG1-CD1 4.16Å; V605-L613 HydrophobicContact CG2-CB 3.66Å; V605-L613 HydrophobicContact CG2-CD1 3.8Å; V605-L613 HydrophobicContact CG2-CG 4.38Å; C609-L613 PolarHBondContact O-N 2.96Å; S610-L613 CarbonylContact O-C 3.59Å; L613-I618 HydrophobicContact CB-CD1 4.32Å; L613-Y621 HydrophobicContact CD2-CE2 4.2Å; L613-H709 VanDerWaalsContact CD2-CE1 3.46Å; L613-H709 WeakPolarHBondContact CD2-CE1 3.42Å
614	N	84.7	Confident	85.7	Confident	16 Å²	16	27.5 Å²	27.5	9%	0.086	13%	0.133	C	C	.	.			trans	-68.7	163.6	177.8	70	-1.3	0	0	0	112.2	D414 S610 V612 I616 S617 I618	D414-N614 HydrophobicContact CB-CB 4.02Å; D414-N614 WeakPolarHBondContact OD2-CB 3.26Å; D414-N614 PolarHBondContact OD2-ND2 3.38Å; S610-N614 WeakPolarHBondContact O-CA 3.47Å; S610-N614 PolarHBondContact O-N 2.87Å; V612-N614 VanDerWaalsContact C-N 3.28Å; V612-N614 PolarHBondContact O-N 2.98Å; N614-I616 PolarHBondContact O-N 3.13Å; N614-I616 VanDerWaalsContact O-N 3.13Å; N614-S617 PolarHBondContact O-N 2.96Å; N614-S617 WeakPolarHBondContact OD1-CB 3.47Å; N614-S617 PolarHBondContact OD1-N 2.96Å; N614-S617 PolarHBondContact OD1-OG 2.96Å; N614-I618 PolarHBondContact O-N 2.95Å
615	H	81.8	Confident	86	Confident	54 Å²	54	23.4 Å²	23.4	25%	0.25	11%	0.114	C	C	.	.	H	α-helix	trans	-57	-31.9	-178.5	75.9	-94.2	0	0	0	112.9	Y412 D415 S619	Y412-H615 AromaticContact CE1-CE1 3.98Å; D415-H615 IonicContact OD1-CE1 3.04Å; H615-S619 WeakPolarHBondContact O-CB 3.33Å; H615-S619 PolarHBondContact O-N 3.4Å; H615-S619 PolarHBondContact O-OG 3.35Å
616	I	83.9	Confident	86.3	Confident	68 Å²	68	22.9 Å²	22.9	35%	0.349	11%	0.11	S	C	.	.	H	α-helix	trans	-64.9	-45.7	175.5	-54.6	179.2	0	0	0	110.2	N614 S619 K620	N614-I616 PolarHBondContact O-N 3.13Å; N614-I616 VanDerWaalsContact O-N 3.13Å; I616-S619 WeakPolarHBondContact O-CB 3.4Å; I616-S619 PolarHBondContact O-N 3.44Å; I616-K620 WeakPolarHBondContact O-CG 3.3Å; I616-K620 PolarHBondContact O-N 2.9Å
617	S	88.7	Confident	86.6	Confident	4 Å²	4	18 Å²	18	3%	0.028	9%	0.088	C	C	.	.	H	α-helix	trans	-67.3	-42.1	178.6	-62.2	0	0	0	0	111.9	N614 S619 K620 Y621 H709	N614-S617 PolarHBondContact O-N 2.96Å; N614-S617 WeakPolarHBondContact OD1-CB 3.47Å; N614-S617 PolarHBondContact OD1-N 2.96Å; N614-S617 PolarHBondContact OD1-OG 2.96Å; S617-S619 VanDerWaalsContact C-N 3.29Å; S617-S619 PolarHBondContact O-N 3.29Å; S617-K620 WeakPolarHBondContact O-CB 3.43Å; S617-K620 PolarHBondContact O-N 3.22Å; S617-K620 VanDerWaalsContact O-N 3.15Å; S617-Y621 WeakPolarHBondContact O-CD2 3.19Å; S617-Y621 PolarHBondContact O-N 2.88Å; S617-H709 WeakPolarHBondContact CB-CE1 3.26Å; S617-H709 PolarHBondContact OG-CE1 2.95Å
618	I	89.8	Confident	87.4	Confident	17 Å²	17	14 Å²	14	9%	0.087	7%	0.073	C	C	.	.	H	α-helix	trans	-60.9	-40.3	172.5	-60.2	-55.4	0	0	0	110.6	Y603 V605 L613 N614 K620 Y621 Q622	Y603-I618 HydrophobicContact CD1-CD1 4.45Å; V605-I618 HydrophobicContact CG2-CD1 4.43Å; L613-I618 HydrophobicContact CB-CD1 4.32Å; N614-I618 PolarHBondContact O-N 2.95Å; I618-K620 PolarHBondContact O-N 3.35Å; I618-Y621 HydrophobicContact CD1-CD2 4.44Å; I618-Y621 PolarHBondContact O-N 3.38Å; I618-Q622 WeakPolarHBondContact O-CG 3.38Å; I618-Q622 PolarHBondContact O-N 3.26Å
619	S	87.3	Confident	88	Confident	29 Å²	29	14 Å²	14	20%	0.203	7%	0.073	C	C	.	.	H	α-helix	trans	-63	-38.1	173.4	-57.5	0	0	0	0	112.9	H615 I616 S617 Q622 M623	H615-S619 WeakPolarHBondContact O-CB 3.33Å; H615-S619 PolarHBondContact O-N 3.4Å; H615-S619 PolarHBondContact O-OG 3.35Å; I616-S619 WeakPolarHBondContact O-CB 3.4Å; I616-S619 PolarHBondContact O-N 3.44Å; S617-S619 VanDerWaalsContact C-N 3.29Å; S617-S619 PolarHBondContact O-N 3.29Å; S619-Q622 WeakPolarHBondContact O-CB 3.42Å; S619-Q622 PolarHBondContact O-N 3.39Å; S619-M623 WeakPolarHBondContact O-CG 3.48Å; S619-M623 PolarHBondContact O-N 2.64Å; S619-M623 VanDerWaalsContact O-N 3.1Å
620	K	88.6	Confident	88.2	Confident	27 Å²	27	14.3 Å²	14.3	12%	0.117	7%	0.074	C	C	.	.	H	α-helix	trans	-63.9	-42.2	172.2	-70.3	-175	-178.9	-173.3	0	111.5	I616 S617 I618 M623 L624 L713 D714 L717	I616-K620 WeakPolarHBondContact O-CG 3.3Å; I616-K620 PolarHBondContact O-N 2.9Å; S617-K620 WeakPolarHBondContact O-CB 3.43Å; S617-K620 PolarHBondContact O-N 3.22Å; S617-K620 VanDerWaalsContact O-N 3.15Å; I618-K620 PolarHBondContact O-N 3.35Å; K620-M623 PolarHBondContact O-N 2.85Å; K620-L624 PolarHBondContact O-N 3.25Å; K620-L713 HydrophobicContact CB-CD1 4.32Å; K620-L713 HydrophobicContact CB-CD2 4.07Å; K620-L713 HydrophobicContact CD-CB 4.13Å; K620-L713 HydrophobicContact CD-CD1 4.22Å; K620-D714 WeakPolarHBondContact CE-OD1 3.3Å; K620-D714 IonicContact NZ-OD1 3.51Å; K620-D714 PolarHBondContact NZ-OD1 2.81Å; K620-D714 IonicContact NZ-OD2 2.65Å; K620-D714 PolarHBondContact NZ-OD2 3.22Å; K620-L717 HydrophobicContact CB-CD1 3.95Å; K620-L717 HydrophobicContact CD-CD1 3.81Å; K620-L717 HydrophobicContact CG-CD1 3.75Å
621	Y	92.7	Very high	88.5	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-64.8	-39.1	173.6	-75.3	-68.7	0	0	0	112.4	V505 L510 L613 S617 I618 M623 L624 F625 H709 F712 L713	V505-Y621 HydrophobicContact CG1-CD1 3.81Å; V505-Y621 HydrophobicContact CG1-CD2 3.73Å; V505-Y621 HydrophobicContact CG1-CE1 3.74Å; V505-Y621 HydrophobicContact CG1-CE2 3.67Å; V505-Y621 HydrophobicContact CG1-CG 3.82Å; L510-Y621 HydrophobicContact CD1-CD1 4.49Å; L510-Y621 HydrophobicContact CD1-CE1 4.12Å; L510-Y621 HydrophobicContact CD2-CD1 4.09Å; L510-Y621 HydrophobicContact CD2-CE1 4.47Å; L510-Y621 HydrophobicContact CG-CD1 4.26Å; L510-Y621 HydrophobicContact CG-CE1 4.37Å; L613-Y621 HydrophobicContact CD2-CE2 4.2Å; S617-Y621 WeakPolarHBondContact O-CD2 3.19Å; S617-Y621 PolarHBondContact O-N 2.88Å; I618-Y621 HydrophobicContact CD1-CD2 4.44Å; I618-Y621 PolarHBondContact O-N 3.38Å; Y621-M623 VanDerWaalsContact C-N 3.32Å; Y621-M623 PolarHBondContact O-N 3.33Å; Y621-L624 PolarHBondContact O-N 3.21Å; Y621-F625 WeakPolarHBondContact O-CB 3.49Å; Y621-F625 PolarHBondContact O-N 3.22Å; Y621-H709 AromaticContact CE2-CE1 3.91Å; Y621-H709 AromaticContact CE2-NE2 2.71Å; Y621-H709 WeakPolarHBondContact CE2-NE2 3.47Å; Y621-H709 AromaticContact CZ-NE2 2.73Å; Y621-H709 PolarHBondContact OH-NE2 3.42Å; Y621-F712 HydrophobicContact CE1-CE1 4.06Å; Y621-L713 HydrophobicContact CD1-CD2 3.78Å; Y621-L713 HydrophobicContact CD2-CD1 4.43Å; Y621-L713 HydrophobicContact CD2-CD2 4.06Å; Y621-L713 HydrophobicContact CE1-CD2 3.63Å; Y621-L713 HydrophobicContact CE1-CG 4.49Å; Y621-L713 HydrophobicContact CE2-CD1 3.97Å; Y621-L713 HydrophobicContact CE2-CD2 3.91Å; Y621-L713 HydrophobicContact CE2-CG 4.3Å; Y621-L713 HydrophobicContact CG-CD2 3.98Å
622	Q	91.1	Very high	88.9	Confident	6 Å²	6	14.1 Å²	14.1	3%	0.028	7%	0.071	C	C	.	.	H	α-helix	trans	-59.4	-40.5	174	-78	-173.6	-18.4	0	0	112.5	E565 Q574 A600 F601 I618 S619 L624 F625 R626	E565-Q622 PolarHBondContact OE2-NE2 3.15Å; Q574-Q622 VanDerWaalsContact NE2-OE1 3.13Å; A600-Q622 HydrophobicContact CB-CG 4.21Å; F601-Q622 VanDerWaalsContact O-CG 3.3Å; F601-Q622 WeakPolarHBondContact O-CG 3.21Å; F601-Q622 PolarHBondContact O-NE2 3.47Å; I618-Q622 WeakPolarHBondContact O-CG 3.38Å; I618-Q622 PolarHBondContact O-N 3.26Å; S619-Q622 WeakPolarHBondContact O-CB 3.42Å; S619-Q622 PolarHBondContact O-N 3.39Å; Q622-L624 VanDerWaalsContact C-N 3.34Å; Q622-L624 PolarHBondContact O-N 2.89Å; Q622-F625 PolarHBondContact O-N 3.37Å; Q622-R626 WeakPolarHBondContact O-CB 3.29Å; Q622-R626 VanDerWaalsContact O-CG 3.29Å; Q622-R626 WeakPolarHBondContact O-CG 3.44Å; Q622-R626 PolarHBondContact O-N 3.37Å
623	M	87.6	Confident	89.2	Confident	7 Å²	7	14.8 Å²	14.8	3%	0.034	7%	0.073	C	C	.	.	H	α-helix	trans	-61.7	-41.9	177.3	-72.5	170.7	54	0	0	112.2	L571 Q574 M575 I578 S619 K620 Y621 Q627 L717 L722	L571-M623 HydrophobicContact CD1-CB 4.1Å; L571-M623 HydrophobicContact CD1-CG 4.06Å; Q574-M623 HydrophobicContact CG-CG 3.9Å; Q574-M623 HydrophobicContact CG-SD 4.45Å; M575-M623 HydrophobicContact CB-CE 4.07Å; M575-M623 HydrophobicContact CE-CE 3.88Å; M575-M623 HydrophobicContact CG-CE 3.75Å; M575-M623 HydrophobicContact SD-CE 3.74Å; I578-M623 HydrophobicContact CD1-CG 4.38Å; I578-M623 HydrophobicContact CD1-SD 3.55Å; I578-M623 VanDerWaalsContact CD1-SD 3.55Å; S619-M623 WeakPolarHBondContact O-CG 3.48Å; S619-M623 PolarHBondContact O-N 2.64Å; S619-M623 VanDerWaalsContact O-N 3.1Å; K620-M623 PolarHBondContact O-N 2.85Å; Y621-M623 VanDerWaalsContact C-N 3.32Å; Y621-M623 PolarHBondContact O-N 3.33Å; M623-Q627 PolarHBondContact O-N 3.01Å; M623-L717 HydrophobicContact CB-CD2 4.23Å; M623-L717 HydrophobicContact CE-CD2 4.16Å; M623-L722 HydrophobicContact CB-CD1 4.4Å
624	L	91.6	Very high	89.3	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-64.9	-49.9	173.5	-68.2	167.4	0	0	0	110.7	L510 K620 Y621 Q622 R626 Q627 L628 L713 C716 L717 C720 L722	L510-L624 HydrophobicContact CD2-CB 4.14Å; L510-L624 HydrophobicContact CD2-CD1 3.95Å; K620-L624 PolarHBondContact O-N 3.25Å; Y621-L624 PolarHBondContact O-N 3.21Å; Q622-L624 VanDerWaalsContact C-N 3.34Å; Q622-L624 PolarHBondContact O-N 2.89Å; L624-R626 PolarHBondContact O-N 2.95Å; L624-Q627 PolarHBondContact O-N 3.04Å; L624-L628 VanDerWaalsContact O-CG 3.28Å; L624-L628 WeakPolarHBondContact O-CG 3.2Å; L624-L628 PolarHBondContact O-N 3.42Å; L624-L713 HydrophobicContact CD1-CD2 4.39Å; L624-C716 HydrophobicContact CD1-CB 3.95Å; L624-C716 HydrophobicContact CD2-CB 4.38Å; L624-L717 HydrophobicContact CD1-CD2 4.4Å; L624-L717 HydrophobicContact CD2-CD2 4.01Å; L624-L717 HydrophobicContact CG-CD2 3.84Å; L624-C720 HydrophobicContact CD2-CB 3.94Å; L624-L722 HydrophobicContact CD2-CD1 3.99Å
625	F	93.1	Very high	89.7	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-51.9	-52.7	178.3	173.1	-100.5	0	0	0	111.9	L509 L511 F599 F601 Y621 Q622 Q627 L628 F629	L509-F625 HydrophobicContact CB-CB 4.5Å; L509-F625 WeakPolarHBondContact O-CA 3.3Å; L509-F625 WeakPolarHBondContact O-CB 3.4Å; L511-F625 HydrophobicContact CD2-CD2 3.73Å; L511-F625 HydrophobicContact CD2-CE2 3.52Å; F599-F625 AromaticContact CD1-CE1 3.96Å; F599-F625 HydrophobicContact CD1-CE1 3.96Å; F599-F625 HydrophobicContact CD1-CZ 4.25Å; F599-F625 AromaticContact CE1-CE1 3.89Å; F599-F625 HydrophobicContact CE1-CE1 3.89Å; F599-F625 AromaticContact CE1-CZ 3.83Å; F599-F625 HydrophobicContact CE1-CZ 3.83Å; F601-F625 AromaticContact CD2-CD2 3.95Å; F601-F625 HydrophobicContact CD2-CD2 3.95Å; F601-F625 HydrophobicContact CD2-CE1 4.04Å; F601-F625 AromaticContact CD2-CE2 3.27Å; F601-F625 HydrophobicContact CD2-CE2 3.27Å; F601-F625 AromaticContact CD2-CZ 3.34Å; F601-F625 HydrophobicContact CD2-CZ 3.34Å; F601-F625 AromaticContact CE2-CE2 3.5Å; F601-F625 HydrophobicContact CE2-CE2 3.5Å; F601-F625 AromaticContact CE2-CZ 3.52Å; F601-F625 HydrophobicContact CE2-CZ 3.52Å; F601-F625 HydrophobicContact CG-CE2 4.39Å; F601-F625 HydrophobicContact CG-CZ 4.18Å; F601-F625 HydrophobicContact CZ-CZ 4.47Å; Y621-F625 WeakPolarHBondContact O-CB 3.49Å; Y621-F625 PolarHBondContact O-N 3.22Å; Q622-F625 PolarHBondContact O-N 3.37Å; F625-Q627 VanDerWaalsContact C-N 3.33Å; F625-Q627 PolarHBondContact O-N 3.47Å; F625-L628 PolarHBondContact O-N 3.05Å; F625-F629 HydrophobicContact CD2-CB 4.49Å; F625-F629 HydrophobicContact CE1-CB 4.06Å; F625-F629 HydrophobicContact CE1-CD1 4.34Å; F625-F629 HydrophobicContact CE1-CD2 4.46Å; F625-F629 HydrophobicContact CE1-CG 4.06Å; F625-F629 HydrophobicContact CE2-CB 4.05Å; F625-F629 AromaticContact CE2-CD2 3.99Å; F625-F629 HydrophobicContact CE2-CD2 3.99Å; F625-F629 HydrophobicContact CE2-CG 4.2Å; F625-F629 HydrophobicContact CZ-CB 3.8Å; F625-F629 HydrophobicContact CZ-CD1 4.22Å; F625-F629 AromaticContact CZ-CD2 3.59Å; F625-F629 HydrophobicContact CZ-CD2 3.59Å; F625-F629 HydrophobicContact CZ-CE2 4.17Å; F625-F629 AromaticContact CZ-CG 3.62Å; F625-F629 HydrophobicContact CZ-CG 3.62Å; F625-F629 WeakPolarHBondContact O-CB 3.31Å; F625-F629 PolarHBondContact O-N 2.69Å
626	R	90.6	Very high	90	Very high	11 Å²	11	13.9 Å²	13.9	4%	0.042	7%	0.067	C	C	.	.	H	α-helix	trans	-60.1	-39.3	-175.7	-71.8	174.8	80	-172.6	9.5	112.5	Y569 D570 L571 E597 F599 A600 Q622 L624 Y630	Y569-R626 PolarHBondContact O-NH1 3.44Å; Y569-R626 PolarHBondContact O-NH2 2.82Å; D570-R626 VanDerWaalsContact C-NH2 3.29Å; D570-R626 PolarHBondContact O-NH1 3.24Å; L571-R626 HydrophobicContact CD1-CB 4.08Å; L571-R626 HydrophobicContact CD2-CB 4.02Å; L571-R626 HydrophobicContact CG-CB 4.49Å; E597-R626 PolarHBondContact O-NH2 3.49Å; F599-R626 WeakPolarHBondContact O-CG 3.49Å; A600-R626 HydrophobicContact CB-CG 4.31Å; Q622-R626 WeakPolarHBondContact O-CB 3.29Å; Q622-R626 VanDerWaalsContact O-CG 3.29Å; Q622-R626 WeakPolarHBondContact O-CG 3.44Å; Q622-R626 PolarHBondContact O-N 3.37Å; L624-R626 PolarHBondContact O-N 2.95Å; R626-Y630 VanDerWaalsContact O-CB 3.26Å; R626-Y630 WeakPolarHBondContact O-CB 3.32Å; R626-Y630 PolarHBondContact O-N 2.76Å; R626-Y630 VanDerWaalsContact O-N 3.08Å
627	Q	88.9	Confident	90.2	Very high	3 Å²	3	11.3 Å²	11.3	1%	0.014	5%	0.054	C	C	.	.	H	α-helix	trans	-67.8	-48.2	175.5	-176.5	-175.4	10.1	0	0	111.8	L571 M623 L624 F625 C631 M680 C720	L571-Q627 HydrophobicContact CD2-CB 4.04Å; M623-Q627 PolarHBondContact O-N 3.01Å; L624-Q627 PolarHBondContact O-N 3.04Å; F625-Q627 VanDerWaalsContact C-N 3.33Å; F625-Q627 PolarHBondContact O-N 3.47Å; Q627-C631 PolarHBondContact O-N 2.86Å; Q627-C631 VanDerWaalsContact O-N 3.1Å; Q627-C631 PolarHBondContact O-SG 3.01Å; Q627-M680 HydrophobicContact CG-SD 4.14Å; Q627-M680 PolarHBondContact NE2-SD 2.69Å; Q627-C720 PolarHBondContact NE2-O 3.15Å; Q627-C720 PolarHBondContact OE1-O 3.11Å
628	L	91.6	Very high	90.2	Very high	1 Å²	1	11.1 Å²	11.1	1%	0.005	5%	0.052	C	C	.	.	H	α-helix	trans	-63	-45	-179.4	-65.9	169.8	0	0	0	111.4	L511 L624 F625 C631 K632 M680 M681 I685	L511-L628 HydrophobicContact CD1-CB 3.64Å; L511-L628 HydrophobicContact CG-CB 4.08Å; L624-L628 VanDerWaalsContact O-CG 3.28Å; L624-L628 WeakPolarHBondContact O-CG 3.2Å; L624-L628 PolarHBondContact O-N 3.42Å; F625-L628 PolarHBondContact O-N 3.05Å; L628-C631 PolarHBondContact O-N 3.09Å; L628-K632 WeakPolarHBondContact O-CB 3.46Å; L628-K632 PolarHBondContact O-N 3.03Å; L628-M680 HydrophobicContact CD2-CB 3.76Å; L628-M680 HydrophobicContact CD2-CE 4Å; L628-M680 HydrophobicContact CD2-SD 4.2Å; L628-M681 HydrophobicContact CB-CE 4.41Å; L628-M681 HydrophobicContact CD2-CE 4.07Å; L628-M681 HydrophobicContact CD2-CG 4.17Å; L628-I685 HydrophobicContact CD1-CD1 3.78Å; L628-I685 HydrophobicContact CD2-CD1 4.31Å
629	F	91.6	Very high	90.1	Very high	2 Å²	2	12.2 Å²	12.2	1%	0.009	6%	0.062	C	C	.	.	H	α-helix	trans	-65.7	-42.5	-179.7	-175	-105.6	0	0	0	111.7	F520 M521 L528 L596 F599 F625 K632 H633	F520-F629 HydrophobicContact CD1-CE2 4.23Å; F520-F629 HydrophobicContact CD1-CZ 4.43Å; F520-F629 HydrophobicContact CE1-CE2 4.37Å; F520-F629 HydrophobicContact CE1-CZ 4.2Å; M521-F629 HydrophobicContact CG-CD2 4.38Å; M521-F629 HydrophobicContact CG-CE2 3.55Å; M521-F629 HydrophobicContact CG-CZ 4Å; M521-F629 HydrophobicContact SD-CD2 4.39Å; M521-F629 HydrophobicContact SD-CE2 4.08Å; L528-F629 HydrophobicContact CD1-CE1 4.27Å; L528-F629 HydrophobicContact CD1-CZ 4.04Å; L596-F629 HydrophobicContact CD1-CD1 4.41Å; L596-F629 HydrophobicContact CD1-CE1 3.8Å; F599-F629 HydrophobicContact CD1-CD1 4.14Å; F599-F629 AromaticContact CD1-CE1 3.59Å; F599-F629 HydrophobicContact CD1-CE1 3.59Å; F599-F629 AromaticContact CD1-CZ 3.93Å; F599-F629 HydrophobicContact CD1-CZ 3.93Å; F599-F629 HydrophobicContact CE1-CE1 4.15Å; F599-F629 HydrophobicContact CE1-CZ 4.02Å; F625-F629 HydrophobicContact CD2-CB 4.49Å; F625-F629 HydrophobicContact CE1-CB 4.06Å; F625-F629 HydrophobicContact CE1-CD1 4.34Å; F625-F629 HydrophobicContact CE1-CD2 4.46Å; F625-F629 HydrophobicContact CE1-CG 4.06Å; F625-F629 HydrophobicContact CE2-CB 4.05Å; F625-F629 AromaticContact CE2-CD2 3.99Å; F625-F629 HydrophobicContact CE2-CD2 3.99Å; F625-F629 HydrophobicContact CE2-CG 4.2Å; F625-F629 HydrophobicContact CZ-CB 3.8Å; F625-F629 HydrophobicContact CZ-CD1 4.22Å; F625-F629 AromaticContact CZ-CD2 3.59Å; F625-F629 HydrophobicContact CZ-CD2 3.59Å; F625-F629 HydrophobicContact CZ-CE2 4.17Å; F625-F629 AromaticContact CZ-CG 3.62Å; F625-F629 HydrophobicContact CZ-CG 3.62Å; F625-F629 WeakPolarHBondContact O-CB 3.31Å; F625-F629 PolarHBondContact O-N 2.69Å; F629-K632 PolarHBondContact O-N 2.81Å; F629-H633 PolarHBondContact O-N 3.41Å
630	Y	90	Very high	90	Very high	9 Å²	9	14 Å²	14	4%	0.035	7%	0.065	C	C	.	.	H	α-helix	trans	-63.4	-43.9	175.5	-174.1	-114.4	0	0	0	112	L596 R626 K632 H633 V634 F733 C736 L740	L596-Y630 HydrophobicContact CD2-CD2 3.88Å; L596-Y630 HydrophobicContact CD2-CE2 3.97Å; L596-Y630 HydrophobicContact CG-CD2 4.39Å; R626-Y630 VanDerWaalsContact O-CB 3.26Å; R626-Y630 WeakPolarHBondContact O-CB 3.32Å; R626-Y630 PolarHBondContact O-N 2.76Å; R626-Y630 VanDerWaalsContact O-N 3.08Å; Y630-K632 PolarHBondContact O-N 3.16Å; Y630-H633 PolarHBondContact O-N 2.81Å; Y630-V634 WeakPolarHBondContact O-CG2 3.41Å; Y630-V634 PolarHBondContact O-N 3.36Å; Y630-F733 AromaticContact CD1-CD1 3.58Å; Y630-F733 HydrophobicContact CD1-CD1 3.58Å; Y630-F733 AromaticContact CD1-CE1 3.43Å; Y630-F733 HydrophobicContact CD1-CE1 3.43Å; Y630-F733 VanDerWaalsContact CD1-CE1 3.43Å; Y630-F733 HydrophobicContact CD1-CZ 4.4Å; Y630-F733 AromaticContact CE1-CD1 3.3Å; Y630-F733 HydrophobicContact CE1-CD1 3.3Å; Y630-F733 AromaticContact CE1-CE1 3.62Å; Y630-F733 HydrophobicContact CE1-CE1 3.62Å; Y630-F733 HydrophobicContact CE1-CG 4.35Å; Y630-F733 HydrophobicContact CG-CD1 4.45Å; Y630-F733 AromaticContact CG-CE1 3.92Å; Y630-F733 HydrophobicContact CG-CE1 3.92Å; Y630-C736 HydrophobicContact CD1-CB 4.03Å; Y630-C736 HydrophobicContact CE1-CB 3.36Å; Y630-L740 HydrophobicContact CE2-CD1 4.09Å
631	C	91.1	Very high	89.7	Confident	1 Å²	1	12.7 Å²	12.7	1%	0.007	6%	0.06	C	C	.	.	H	α-helix	trans	-58.8	-48.3	173.8	-64.1	0	0	0	0	111.1	Q627 L628 H633 V634 E635 E677 M680	Q627-C631 PolarHBondContact O-N 2.86Å; Q627-C631 VanDerWaalsContact O-N 3.1Å; Q627-C631 PolarHBondContact O-SG 3.01Å; L628-C631 PolarHBondContact O-N 3.09Å; C631-H633 VanDerWaalsContact C-N 3.3Å; C631-H633 PolarHBondContact O-N 3.15Å; C631-V634 WeakPolarHBondContact O-CA 3.18Å; C631-V634 PolarHBondContact O-N 3.04Å; C631-E635 PolarHBondContact O-N 3.11Å; C631-E677 HydrophobicContact CB-CG 3.78Å; C631-E677 WeakPolarHBondContact CB-OE1 3.4Å; C631-E677 VanDerWaalsContact O-OE1 3.1Å; C631-M680 HydrophobicContact CB-CE 4.44Å
632	K	91.1	Very high	89.1	Confident	33 Å²	33	18.9 Å²	18.9	14%	0.143	8%	0.083	C	C	.	.	H	α-helix	trans	-64.6	-30.9	-178.5	-81.1	-65.5	-179.7	-155.2	0	113.9	L511 M518 M521 L628 F629 Y630 E635 R636 E677 M681	L511-K632 HydrophobicContact CD1-CB 4.46Å; L511-K632 HydrophobicContact CD1-CG 4.06Å; M518-K632 HydrophobicContact CE-CD 4.31Å; M521-K632 HydrophobicContact CE-CB 4.09Å; M521-K632 HydrophobicContact SD-CB 4.36Å; L628-K632 WeakPolarHBondContact O-CB 3.46Å; L628-K632 PolarHBondContact O-N 3.03Å; F629-K632 PolarHBondContact O-N 2.81Å; Y630-K632 PolarHBondContact O-N 3.16Å; K632-E635 VanDerWaalsContact CD-OE2 3.27Å; K632-E635 WeakPolarHBondContact CD-OE2 3.36Å; K632-E635 VanDerWaalsContact NZ-CD 3.27Å; K632-E635 IonicContact NZ-OE1 3.54Å; K632-E635 PolarHBondContact NZ-OE1 2.88Å; K632-E635 IonicContact NZ-OE2 3.96Å; K632-E635 PolarHBondContact NZ-OE2 3.03Å; K632-R636 VanDerWaalsContact O-CB 3.3Å; K632-R636 WeakPolarHBondContact O-CB 3.44Å; K632-R636 PolarHBondContact O-N 3.5Å; K632-E677 VanDerWaalsContact CA-OE1 3.24Å; K632-E677 WeakPolarHBondContact CA-OE1 3.41Å; K632-E677 WeakPolarHBondContact CD-OE1 3.46Å; K632-E677 WeakPolarHBondContact CE-OE2 3.19Å; K632-E677 PolarHBondContact N-OE1 3.39Å; K632-E677 IonicContact NZ-OE1 2.79Å; K632-E677 IonicContact NZ-OE2 2.61Å; K632-E677 PolarHBondContact NZ-OE2 3.09Å; K632-M681 HydrophobicContact CG-CE 4.03Å
633	H	90.1	Very high	88.5	Confident	17 Å²	17	25.8 Å²	25.8	8%	0.079	11%	0.113	C	C	.	.	H	α-helix	trans	-61.8	-44	168.7	179.9	92.1	0	0	0	111.4	M521 L596 F629 Y630 C631 R636 Q637	M521-H633 HydrophobicContact SD-CB 4.4Å; L596-H633 HydrophobicContact CD1-CB 4.11Å; L596-H633 HydrophobicContact CD2-CB 4.19Å; L596-H633 VanDerWaalsContact CD2-CD2 3.46Å; L596-H633 WeakPolarHBondContact CD2-CD2 3.26Å; F629-H633 PolarHBondContact O-N 3.41Å; Y630-H633 PolarHBondContact O-N 2.81Å; C631-H633 VanDerWaalsContact C-N 3.3Å; C631-H633 PolarHBondContact O-N 3.15Å; H633-R636 WeakPolarHBondContact O-CB 3.37Å; H633-R636 PolarHBondContact O-N 3.31Å; H633-Q637 WeakPolarHBondContact O-CG 3.41Å; H633-Q637 PolarHBondContact O-N 3.44Å
634	V	90.7	Very high	87.8	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-70.3	-37.8	178.9	-168.9	0	0	0	0	112.4	Y630 C631 R636 Q637 L638 I673 C736 C739 L740	Y630-V634 WeakPolarHBondContact O-CG2 3.41Å; Y630-V634 PolarHBondContact O-N 3.36Å; C631-V634 WeakPolarHBondContact O-CA 3.18Å; C631-V634 PolarHBondContact O-N 3.04Å; V634-R636 VanDerWaalsContact C-N 3.3Å; V634-R636 PolarHBondContact O-N 3.2Å; V634-Q637 PolarHBondContact O-N 2.97Å; V634-L638 HydrophobicContact CG1-CD1 4.11Å; V634-L638 HydrophobicContact CG1-CG 4.43Å; V634-L638 WeakPolarHBondContact O-CB 3.38Å; V634-L638 WeakPolarHBondContact O-CG 3.45Å; V634-L638 PolarHBondContact O-N 3.19Å; V634-I673 HydrophobicContact CB-CD1 4.1Å; V634-I673 HydrophobicContact CG1-CD1 3.51Å; V634-C736 HydrophobicContact CG2-CB 3.94Å; V634-C739 HydrophobicContact CG1-CB 3.51Å; V634-L740 HydrophobicContact CB-CD2 4.48Å; V634-L740 HydrophobicContact CG1-CD2 4.31Å; V634-L740 HydrophobicContact CG1-CG 4.29Å; V634-L740 HydrophobicContact CG2-CD1 3.94Å; V634-L740 HydrophobicContact CG2-CD2 3.96Å; V634-L740 HydrophobicContact CG2-CG 3.76Å
635	E	91.3	Very high	86.8	Confident	24 Å²	24	30.3 Å²	30.3	11%	0.112	14%	0.135	C	C	.	.	H	α-helix	trans	-55.4	-47.8	169.2	-172.6	-162.3	-149	0	0	110.5	C631 K632 Q637 L638 C639 M670 I673 Q674	C631-E635 PolarHBondContact O-N 3.11Å; K632-E635 VanDerWaalsContact CD-OE2 3.27Å; K632-E635 WeakPolarHBondContact CD-OE2 3.36Å; K632-E635 VanDerWaalsContact NZ-CD 3.27Å; K632-E635 IonicContact NZ-OE1 3.54Å; K632-E635 PolarHBondContact NZ-OE1 2.88Å; K632-E635 IonicContact NZ-OE2 3.96Å; K632-E635 PolarHBondContact NZ-OE2 3.03Å; E635-Q637 PolarHBondContact O-N 3.01Å; E635-L638 PolarHBondContact O-N 3.43Å; E635-C639 WeakPolarHBondContact O-CB 3.37Å; E635-C639 PolarHBondContact O-N 2.61Å; E635-C639 PolarHBondContact O-SG 2.85Å; E635-C639 VanDerWaalsContact O-SG 3.42Å; E635-M670 HydrophobicContact CG-SD 3.92Å; E635-I673 HydrophobicContact CB-CG2 4.26Å; E635-Q674 HydrophobicContact CG-CG 4.08Å; E635-Q674 WeakPolarHBondContact OE1-CG 3.29Å; E635-Q674 PolarHBondContact OE1-NE2 3.31Å
636	R	89.9	Confident	85.5	Confident	32 Å²	32	33 Å²	33	12%	0.121	15%	0.154	C	C	.	.	H	α-helix	trans	-61.1	-44.2	179.9	-177.5	175.7	166.9	-75	-8.1	112.2	D522 E525 K632 H633 V634 C639 K640	D522-R636 IonicContact OD1-CZ 3.15Å; D522-R636 IonicContact OD1-NE 2.8Å; D522-R636 PolarHBondContact OD1-NE 2.9Å; D522-R636 IonicContact OD1-NH2 2.71Å; D522-R636 PolarHBondContact OD1-NH2 2.94Å; E525-R636 VanDerWaalsContact CD-NH1 3.31Å; E525-R636 IonicContact OE1-NH1 3.83Å; E525-R636 IonicContact OE2-CZ 3.25Å; E525-R636 VanDerWaalsContact OE2-CZ 3.25Å; E525-R636 IonicContact OE2-NH1 2.81Å; E525-R636 PolarHBondContact OE2-NH1 3.17Å; E525-R636 IonicContact OE2-NH2 2.76Å; E525-R636 PolarHBondContact OE2-NH2 3.37Å; K632-R636 VanDerWaalsContact O-CB 3.3Å; K632-R636 WeakPolarHBondContact O-CB 3.44Å; K632-R636 PolarHBondContact O-N 3.5Å; H633-R636 WeakPolarHBondContact O-CB 3.37Å; H633-R636 PolarHBondContact O-N 3.31Å; V634-R636 VanDerWaalsContact C-N 3.3Å; V634-R636 PolarHBondContact O-N 3.2Å; R636-C639 WeakPolarHBondContact O-CB 3.24Å; R636-C639 PolarHBondContact O-N 3.43Å; R636-K640 PolarHBondContact O-N 2.93Å
637	Q	88.1	Confident	84.1	Confident	14 Å²	14	37.9 Å²	37.9	7%	0.065	18%	0.179	C	C	.	.	H	α-helix	trans	-68.7	-40.1	177.5	-60.3	-60.3	30.5	0	0	112.9	E525 H633 V634 E635 C639 K640 I641 L740 C743	E525-Q637 PolarHBondContact OE1-NE2 2.96Å; E525-Q637 PolarHBondContact OE1-OE1 3.23Å; H633-Q637 WeakPolarHBondContact O-CG 3.41Å; H633-Q637 PolarHBondContact O-N 3.44Å; V634-Q637 PolarHBondContact O-N 2.97Å; E635-Q637 PolarHBondContact O-N 3.01Å; Q637-C639 PolarHBondContact O-N 2.8Å; Q637-K640 WeakPolarHBondContact O-CB 3.27Å; Q637-K640 PolarHBondContact O-N 2.68Å; Q637-I641 PolarHBondContact O-N 2.89Å; Q637-I641 VanDerWaalsContact O-N 3.08Å; Q637-L740 HydrophobicContact CB-CD2 4.32Å; Q637-L740 HydrophobicContact CG-CD2 4.09Å; Q637-C743 HydrophobicContact CB-CB 4.46Å
638	L	88.4	Confident	82.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.5	-21.4	173.1	-70.7	169.5	0	0	0	113.1	V634 E635 R666 M669 M670 I673 C739 Y742	V634-L638 HydrophobicContact CG1-CD1 4.11Å; V634-L638 HydrophobicContact CG1-CG 4.43Å; V634-L638 WeakPolarHBondContact O-CB 3.38Å; V634-L638 WeakPolarHBondContact O-CG 3.45Å; V634-L638 PolarHBondContact O-N 3.19Å; E635-L638 PolarHBondContact O-N 3.43Å; L638-R666 HydrophobicContact CD2-CG 3.97Å; L638-R666 PolarHBondContact O-NH1 3.06Å; L638-M669 HydrophobicContact CD1-CB 4.02Å; L638-M669 HydrophobicContact CD2-CB 4.29Å; L638-M669 HydrophobicContact CD2-SD 4.48Å; L638-M670 HydrophobicContact CB-CE 3.46Å; L638-M670 VanDerWaalsContact CB-CE 3.46Å; L638-M670 HydrophobicContact CB-SD 4.32Å; L638-I673 HydrophobicContact CD1-CD1 3.64Å; L638-C739 HydrophobicContact CD1-CB 4.25Å; L638-Y742 HydrophobicContact CD2-CD1 4.27Å
639	C	87.4	Confident	81.2	Confident	41 Å²	41	45.6 Å²	45.6	28%	0.277	21%	0.21	S	C	.	.	H	α-helix	trans	-80.8	-42.5	170.5	-81.9	0	0	0	0	112.7	E635 R636 Q637 I641 W642 K643 M670	E635-C639 WeakPolarHBondContact O-CB 3.37Å; E635-C639 PolarHBondContact O-N 2.61Å; E635-C639 PolarHBondContact O-SG 2.85Å; E635-C639 VanDerWaalsContact O-SG 3.42Å; R636-C639 WeakPolarHBondContact O-CB 3.24Å; R636-C639 PolarHBondContact O-N 3.43Å; Q637-C639 PolarHBondContact O-N 2.8Å; C639-I641 VanDerWaalsContact C-N 3.35Å; C639-I641 PolarHBondContact O-N 3.47Å; C639-W642 WeakPolarHBondContact O-CB 3.49Å; C639-W642 PolarHBondContact O-N 3.42Å; C639-K643 PolarHBondContact O-N 3.12Å; C639-M670 HydrophobicContact CB-CE 4.24Å; C639-M670 WeakPolarHBondContact SG-CE 3.3Å
640	K	84.8	Confident	79.7	Confident	65 Å²	65	53.5 Å²	53.5	28%	0.283	25%	0.247	S	C	.	.	H	α-helix	trans	-55.5	-51.1	176.3	-175.8	173.9	-179.6	169.6	0	110.6	E525 R636 Q637 W642 K643 E644	E525-K640 IonicContact OE1-NZ 2.65Å; E525-K640 PolarHBondContact OE1-NZ 2.95Å; E525-K640 IonicContact OE2-NZ 3.15Å; E525-K640 PolarHBondContact OE2-NZ 3.31Å; E525-K640 VanDerWaalsContact OE2-NZ 3.15Å; R636-K640 PolarHBondContact O-N 2.93Å; Q637-K640 WeakPolarHBondContact O-CB 3.27Å; Q637-K640 PolarHBondContact O-N 2.68Å; K640-W642 VanDerWaalsContact C-N 3.27Å; K640-W642 PolarHBondContact O-N 2.99Å; K640-K643 WeakPolarHBondContact O-CB 3.49Å; K640-K643 PolarHBondContact O-N 2.97Å; K640-E644 WeakPolarHBondContact CG-OE1 3.48Å; K640-E644 PolarHBondContact O-N 2.87Å; K640-E644 VanDerWaalsContact O-N 3.17Å
641	I	82	Confident	78.3	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-63.9	-28	178.7	-72.8	179	0	0	0	113.8	Q637 C639 E644 N645 C743 I746 Q747	Q637-I641 PolarHBondContact O-N 2.89Å; Q637-I641 VanDerWaalsContact O-N 3.08Å; C639-I641 VanDerWaalsContact C-N 3.35Å; C639-I641 PolarHBondContact O-N 3.47Å; I641-E644 WeakPolarHBondContact CA-OE2 3.49Å; I641-E644 WeakPolarHBondContact CG1-OE2 3.14Å; I641-N645 WeakPolarHBondContact CG2-ND2 3.38Å; I641-N645 VanDerWaalsContact O-CB 3.26Å; I641-N645 WeakPolarHBondContact O-CB 3.42Å; I641-N645 PolarHBondContact O-N 3.4Å; I641-N645 PolarHBondContact O-ND2 3.05Å; I641-C743 HydrophobicContact CD1-CB 3.3Å; I641-C743 VanDerWaalsContact CD1-O 3.25Å; I641-C743 WeakPolarHBondContact CD1-O 3.47Å; I641-I746 HydrophobicContact CG2-CB 4.29Å; I641-I746 HydrophobicContact CG2-CG2 3.59Å; I641-Q747 HydrophobicContact CD1-CG 3.6Å; I641-Q747 HydrophobicContact CG1-CG 3.57Å
642	W	81.3	Confident	76.8	Confident	129 Å²	129	65.8 Å²	65.8	49%	0.489	30%	0.303	S	S	.	.	H	α-helix	trans	-70.7	-33.5	174.3	177	62.1	0	0	0	112.7	C639 K640 S646	C639-W642 WeakPolarHBondContact O-CB 3.49Å; C639-W642 PolarHBondContact O-N 3.42Å; K640-W642 VanDerWaalsContact C-N 3.27Å; K640-W642 PolarHBondContact O-N 2.99Å; W642-S646 PolarHBondContact O-N 3.29Å
643	K	77	Confident	75.5	Confident	151 Å²	151	69.5 Å²	69.5	66%	0.657	33%	0.331	S	S	*	.	H	α-helix	trans	-68.3	-48.9	173.2	-60.5	172.4	-176.7	174.4	0	110.3	C639 K640 S646	C639-K643 PolarHBondContact O-N 3.12Å; K640-K643 WeakPolarHBondContact O-CB 3.49Å; K640-K643 PolarHBondContact O-N 2.97Å; K643-S646 WeakPolarHBondContact O-CB 3.3Å; K643-S646 PolarHBondContact O-N 3.27Å; K643-S646 VanDerWaalsContact O-N 3.1Å
644	E	73.4	Confident	74.1	Confident	84 Å²	84	76.5 Å²	76.5	39%	0.393	36%	0.364	S	S	.	.	H	α-helix	trans	-58	-51.4	179.1	-68.1	158.3	175.3	0	0	111	K640 I641 S646 I647 Q747	K640-E644 WeakPolarHBondContact CG-OE1 3.48Å; K640-E644 PolarHBondContact O-N 2.87Å; K640-E644 VanDerWaalsContact O-N 3.17Å; I641-E644 WeakPolarHBondContact CA-OE2 3.49Å; I641-E644 WeakPolarHBondContact CG1-OE2 3.14Å; E644-S646 PolarHBondContact O-N 3.49Å; E644-S646 VanDerWaalsContact O-N 3.14Å; E644-I647 PolarHBondContact O-N 3.05Å; E644-Q747 PolarHBondContact OE2-NE2 3.45Å
645	N	71.2	Confident	72.8	Confident	19 Å²	19	78.2 Å²	78.2	10%	0.102	38%	0.378	C	S	.	.	H	α-helix	trans	-69.9	-6.4	177.2	-81	-89	0	0	0	115.1	I641 I647 A648 F663 I746	I641-N645 WeakPolarHBondContact CG2-ND2 3.38Å; I641-N645 VanDerWaalsContact O-CB 3.26Å; I641-N645 WeakPolarHBondContact O-CB 3.42Å; I641-N645 PolarHBondContact O-N 3.4Å; I641-N645 PolarHBondContact O-ND2 3.05Å; N645-I647 PolarHBondContact O-N 3.2Å; N645-A648 PolarHBondContact O-N 3.04Å; N645-F663 HydrophobicContact CB-CD1 4.49Å; N645-F663 HydrophobicContact CB-CE1 3.65Å; N645-F663 HydrophobicContact CB-CZ 4.19Å; N645-I746 WeakPolarHBondContact ND2-CG2 3.24Å
646	S	64.9	Low	71.5	Confident	56 Å²	56	78.6 Å²	78.6	39%	0.392	39%	0.385	S	S	.	.	H	α-helix	trans	-64.2	-30.6	172	-160.6	0	0	0	0	111.1	W642 K643 E644 R649	W642-S646 PolarHBondContact O-N 3.29Å; K643-S646 WeakPolarHBondContact O-CB 3.3Å; K643-S646 PolarHBondContact O-N 3.27Å; K643-S646 VanDerWaalsContact O-N 3.1Å; E644-S646 PolarHBondContact O-N 3.49Å; E644-S646 VanDerWaalsContact O-N 3.14Å; S646-R649 WeakPolarHBondContact O-CB 3.5Å; S646-R649 WeakPolarHBondContact O-CG 3.49Å; S646-R649 PolarHBondContact O-N 3.44Å
647	I	61.4	Low	70.4	Confident	113 Å²	113	80 Å²	80	58%	0.579	40%	0.399	S	S	*	.	H	α-helix	trans	-66.6	-39.7	175.3	-54.7	173.7	0	0	0	110.7	E644 N645 R649 Q650	E644-I647 PolarHBondContact O-N 3.05Å; N645-I647 PolarHBondContact O-N 3.2Å; I647-R649 PolarHBondContact O-N 3.14Å; I647-Q650 WeakPolarHBondContact O-CB 3.43Å; I647-Q650 WeakPolarHBondContact O-CG 3.18Å; I647-Q650 PolarHBondContact O-N 3.26Å
648	A	59.3	Low	69.4	Low	8 Å²	8	82.8 Å²	82.8	7%	0.066	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-62.8	-8.4	179.8	0	0	0	0	0	114.6	N645 Q650 F651 Y659	N645-A648 PolarHBondContact O-N 3.04Å; A648-Q650 PolarHBondContact O-N 3.3Å; A648-F651 HydrophobicContact CB-CD2 3.77Å; A648-F651 HydrophobicContact CB-CE2 3.59Å; A648-F651 VanDerWaalsContact O-CD2 3.31Å; A648-F651 WeakPolarHBondContact O-CD2 3.44Å; A648-Y659 HydrophobicContact CB-CD1 4.43Å; A648-Y659 HydrophobicContact CB-CE1 4.39Å
649	R	60	Low	68.7	Low	159 Å²	159	85.8 Å²	85.8	60%	0.6	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-70.5	-9	170.4	-61.8	175.6	169.3	-167.9	-6.4	113.7	S646 I647 F663	S646-R649 WeakPolarHBondContact O-CB 3.5Å; S646-R649 WeakPolarHBondContact O-CG 3.49Å; S646-R649 PolarHBondContact O-N 3.44Å; I647-R649 PolarHBondContact O-N 3.14Å; R649-F663 HydrophobicContact CG-CE2 4.42Å
650	Q	60.3	Low	68.2	Low	167 Å²	167	91.6 Å²	91.6	78%	0.78	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-92.6	-5.2	179.3	-58.4	-179.6	16	0	0	113.5	I647 A648	I647-Q650 WeakPolarHBondContact O-CB 3.43Å; I647-Q650 WeakPolarHBondContact O-CG 3.18Å; I647-Q650 PolarHBondContact O-N 3.26Å; A648-Q650 PolarHBondContact O-N 3.3Å
651	F	61.1	Low	67.8	Low	110 Å²	110	90.7 Å²	90.7	48%	0.482	45%	0.447	S	S	.	.	S	Bend	trans	-76.9	163.6	-179.5	-62.9	-43.9	0	0	0	113.7	A648 A655 Y659	A648-F651 HydrophobicContact CB-CD2 3.77Å; A648-F651 HydrophobicContact CB-CE2 3.59Å; A648-F651 VanDerWaalsContact O-CD2 3.31Å; A648-F651 WeakPolarHBondContact O-CD2 3.44Å; F651-A655 HydrophobicContact CB-CB 4.2Å; F651-Y659 HydrophobicContact CD2-CE2 4.04Å; F651-Y659 HydrophobicContact CE2-CE2 4.28Å
652	E	58.9	Low	67.8	Low	158 Å²	158	90.7 Å²	90.7	74%	0.738	45%	0.447	S	S	*	.			trans	-53.1	150.3	177	-83.3	-164.3	112.8	0	0	113.7	Q654 A655 A656	E652-Q654 PolarHBondContact O-N 3.17Å; E652-A655 PolarHBondContact O-N 3.47Å; E652-A656 PolarHBondContact O-N 3.2Å
653	P	64.3	Low	67.8	Low	112 Å²	112	87 Å²	87	73%	0.727	43%	0.434	S	S	*	.	H	α-helix	trans	-59.1	-28	-172.7	22.8	-34.5	0	0	0	114.1	S657	P653-S657 PolarHBondContact O-N 3.3Å; P653-S657 VanDerWaalsContact O-N 3.14Å
654	Q	60.9	Low	68.2	Low	164 Å²	164	83.6 Å²	83.6	77%	0.766	43%	0.427	S	S	*	.	H	α-helix	trans	-72.8	-43.7	177.8	-164.4	162.7	-4.1	0	0	111.6	E652 S657	E652-Q654 PolarHBondContact O-N 3.17Å; Q654-S657 WeakPolarHBondContact O-CB 3.35Å; Q654-S657 PolarHBondContact O-N 2.99Å; Q654-S657 PolarHBondContact O-OG 2.83Å
655	A	62.8	Low	68.8	Low	36 Å²	36	79.7 Å²	79.7	30%	0.298	41%	0.408	S	S	.	.	H	α-helix	trans	-65.5	-43.4	171.7	0	0	0	0	0	111.5	F651 E652 S657 L658 Y659	F651-A655 HydrophobicContact CB-CB 4.2Å; E652-A655 PolarHBondContact O-N 3.47Å; A655-S657 PolarHBondContact O-N 3.1Å; A655-S657 VanDerWaalsContact O-N 3.12Å; A655-L658 WeakPolarHBondContact O-CB 3.29Å; A655-L658 PolarHBondContact O-N 2.9Å; A655-Y659 WeakPolarHBondContact O-CD2 3.47Å; A655-Y659 PolarHBondContact O-N 3.11Å
656	A	64.7	Low	69.6	Low	31 Å²	31	79.4 Å²	79.4	26%	0.256	41%	0.406	S	S	.	.	H	α-helix	trans	-59.8	-23.3	177	0	0	0	0	0	113.5	E652 R660	E652-A656 PolarHBondContact O-N 3.2Å; A656-R660 PolarHBondContact O-N 2.94Å; A656-R660 VanDerWaalsContact O-N 3.17Å
657	S	66.6	Low	70.7	Confident	62 Å²	62	81.3 Å²	81.3	43%	0.434	41%	0.409	S	S	.	.	H	α-helix	trans	-67.4	-38.3	173.1	80.9	0	0	0	0	112.8	P653 Q654 A655 R660	P653-S657 PolarHBondContact O-N 3.3Å; P653-S657 VanDerWaalsContact O-N 3.14Å; Q654-S657 WeakPolarHBondContact O-CB 3.35Å; Q654-S657 PolarHBondContact O-N 2.99Å; Q654-S657 PolarHBondContact O-OG 2.83Å; A655-S657 PolarHBondContact O-N 3.1Å; A655-S657 VanDerWaalsContact O-N 3.12Å; S657-R660 PolarHBondContact O-N 3.48Å
658	L	67.2	Low	71.9	Confident	73 Å²	73	77.6 Å²	77.6	38%	0.382	39%	0.387	S	S	.	.	H	α-helix	trans	-70	-46.3	178.3	-59	172.5	0	0	0	110.7	A655 R660 A661 F758	A655-L658 WeakPolarHBondContact O-CB 3.29Å; A655-L658 PolarHBondContact O-N 2.9Å; L658-R660 VanDerWaalsContact C-N 3.25Å; L658-R660 PolarHBondContact O-N 3.35Å; L658-A661 PolarHBondContact O-N 2.97Å; L658-F758 HydrophobicContact CB-CD1 4.15Å; L658-F758 HydrophobicContact CB-CE1 4.41Å
659	Y	73	Confident	73.5	Confident	62 Å²	62	77.2 Å²	77.2	24%	0.243	38%	0.384	C	S	.	.	H	α-helix	trans	-62.7	-28	176.4	-77.3	-75.2	0	0	0	113.4	A648 F651 A655 A661 A662 F663 F758	A648-Y659 HydrophobicContact CB-CD1 4.43Å; A648-Y659 HydrophobicContact CB-CE1 4.39Å; F651-Y659 HydrophobicContact CD2-CE2 4.04Å; F651-Y659 HydrophobicContact CE2-CE2 4.28Å; A655-Y659 WeakPolarHBondContact O-CD2 3.47Å; A655-Y659 PolarHBondContact O-N 3.11Å; Y659-A661 VanDerWaalsContact C-N 3.27Å; Y659-A661 PolarHBondContact O-N 3.23Å; Y659-A662 PolarHBondContact O-N 2.99Å; Y659-F663 HydrophobicContact CD1-CE1 4.03Å; Y659-F663 HydrophobicContact CD1-CZ 4.3Å; Y659-F663 HydrophobicContact CG-CE1 4.41Å; Y659-F663 HydrophobicContact CG-CZ 4.3Å; Y659-F663 WeakPolarHBondContact O-CB 3.27Å; Y659-F663 VanDerWaalsContact O-CD1 3.28Å; Y659-F663 WeakPolarHBondContact O-CD1 3.22Å; Y659-F663 WeakPolarHBondContact O-CG 3.12Å; Y659-F663 PolarHBondContact O-N 3.15Å; Y659-F758 HydrophobicContact CD1-CZ 4.32Å; Y659-F758 HydrophobicContact CE1-CZ 4.12Å
660	R	76.3	Confident	74.9	Confident	163 Å²	163	70 Å²	70	62%	0.615	36%	0.357	S	S	*	.	H	α-helix	trans	-59.2	-36	175.3	-178.7	178.8	-82	106.5	-6.4	112.5	A656 S657 L658 T664	A656-R660 PolarHBondContact O-N 2.94Å; A656-R660 VanDerWaalsContact O-N 3.17Å; S657-R660 PolarHBondContact O-N 3.48Å; L658-R660 VanDerWaalsContact C-N 3.25Å; L658-R660 PolarHBondContact O-N 3.35Å; R660-T664 WeakPolarHBondContact O-CB 3.5Å; R660-T664 PolarHBondContact O-N 3.18Å; R660-T664 PolarHBondContact O-OG1 2.97Å
661	A	77.9	Confident	76.2	Confident	47 Å²	47	65.3 Å²	65.3	39%	0.388	34%	0.338	S	S	.	.	H	α-helix	trans	-66.4	-49.3	175.6	0	0	0	0	0	111.1	L658 Y659 F663 T664 L665 V762	L658-A661 PolarHBondContact O-N 2.97Å; Y659-A661 VanDerWaalsContact C-N 3.27Å; Y659-A661 PolarHBondContact O-N 3.23Å; A661-F663 PolarHBondContact O-N 2.97Å; A661-T664 WeakPolarHBondContact O-CB 3.43Å; A661-T664 PolarHBondContact O-N 3.25Å; A661-T664 VanDerWaalsContact O-N 3.14Å; A661-L665 PolarHBondContact O-N 2.7Å; A661-V762 HydrophobicContact CB-CG1 4.17Å
662	A	81.1	Confident	77.5	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-58.2	-44.6	176.5	0	0	0	0	0	112.2	Y659 T664 L665 R666 Y742 I746 F758 V762	Y659-A662 PolarHBondContact O-N 2.99Å; A662-T664 VanDerWaalsContact C-N 3.28Å; A662-T664 PolarHBondContact O-N 3.15Å; A662-L665 PolarHBondContact O-N 2.72Å; A662-R666 WeakPolarHBondContact O-CB 3.46Å; A662-R666 PolarHBondContact O-N 3.43Å; A662-Y742 PolarHBondContact O-OH 3.48Å; A662-I746 HydrophobicContact CB-CD1 4.4Å; A662-F758 HydrophobicContact CB-CE1 4.41Å; A662-F758 HydrophobicContact CB-CZ 4.34Å; A662-V762 HydrophobicContact CB-CG1 4.37Å; A662-V762 HydrophobicContact CB-CG2 4.21Å
663	F	82.5	Confident	79.1	Confident	51 Å²	51	53.4 Å²	53.4	22%	0.224	29%	0.285	C	S	.	.	H	α-helix	trans	-62.5	-34.8	177.5	-62.1	-10	0	0	0	112.8	N645 R649 Y659 A661 Q667	N645-F663 HydrophobicContact CB-CD1 4.49Å; N645-F663 HydrophobicContact CB-CE1 3.65Å; N645-F663 HydrophobicContact CB-CZ 4.19Å; R649-F663 HydrophobicContact CG-CE2 4.42Å; Y659-F663 HydrophobicContact CD1-CE1 4.03Å; Y659-F663 HydrophobicContact CD1-CZ 4.3Å; Y659-F663 HydrophobicContact CG-CE1 4.41Å; Y659-F663 HydrophobicContact CG-CZ 4.3Å; Y659-F663 WeakPolarHBondContact O-CB 3.27Å; Y659-F663 VanDerWaalsContact O-CD1 3.28Å; Y659-F663 WeakPolarHBondContact O-CD1 3.22Å; Y659-F663 WeakPolarHBondContact O-CG 3.12Å; Y659-F663 PolarHBondContact O-N 3.15Å; A661-F663 PolarHBondContact O-N 2.97Å; F663-Q667 WeakPolarHBondContact O-CB 3.42Å; F663-Q667 PolarHBondContact O-N 3.29Å; F663-Q667 VanDerWaalsContact O-N 3.1Å
664	T	84.4	Confident	80.3	Confident	80 Å²	80	51.5 Å²	51.5	49%	0.491	27%	0.267	S	S	.	.	H	α-helix	trans	-70.7	-43.9	177.2	-54	0	0	0	0	110.8	R660 A661 A662 Q667 R668	R660-T664 WeakPolarHBondContact O-CB 3.5Å; R660-T664 PolarHBondContact O-N 3.18Å; R660-T664 PolarHBondContact O-OG1 2.97Å; A661-T664 WeakPolarHBondContact O-CB 3.43Å; A661-T664 PolarHBondContact O-N 3.25Å; A661-T664 VanDerWaalsContact O-N 3.14Å; A662-T664 VanDerWaalsContact C-N 3.28Å; A662-T664 PolarHBondContact O-N 3.15Å; T664-Q667 PolarHBondContact O-N 2.87Å; T664-R668 PolarHBondContact O-N 3.44Å; T664-R668 VanDerWaalsContact O-N 3.1Å
665	L	86.8	Confident	81.6	Confident	2 Å²	2	45 Å²	45	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-62.4	-50.1	174.9	-179.6	57	0	0	0	111.7	A661 A662 Q667 R668 M669 Y742 V762 F765 D766 F769	A661-L665 PolarHBondContact O-N 2.7Å; A662-L665 PolarHBondContact O-N 2.72Å; L665-Q667 PolarHBondContact O-N 3.4Å; L665-R668 PolarHBondContact O-N 3.3Å; L665-M669 HydrophobicContact CD1-CE 3.97Å; L665-M669 HydrophobicContact CD1-CG 4.32Å; L665-M669 HydrophobicContact CD1-SD 4.42Å; L665-M669 HydrophobicContact CD2-CE 4.11Å; L665-M669 HydrophobicContact CG-CE 3.94Å; L665-M669 HydrophobicContact CG-SD 4.1Å; L665-M669 WeakPolarHBondContact O-CG 3.48Å; L665-M669 PolarHBondContact O-N 3.05Å; L665-Y742 HydrophobicContact CD2-CD2 3.92Å; L665-Y742 HydrophobicContact CD2-CE2 3.89Å; L665-Y742 HydrophobicContact CG-CE2 4.41Å; L665-V762 HydrophobicContact CD2-CG1 4.35Å; L665-F765 HydrophobicContact CD2-CB 3.78Å; L665-D766 HydrophobicContact CD1-CB 3.98Å; L665-D766 HydrophobicContact CD2-CB 4.13Å; L665-F769 HydrophobicContact CD1-CB 4.47Å; L665-F769 HydrophobicContact CD1-CD1 4.16Å
666	R	87.6	Confident	82.8	Confident	13 Å²	13	43.7 Å²	43.7	5%	0.049	23%	0.225	C	C	.	.	H	α-helix	trans	-55.1	-39.7	176	-169.8	-154.3	61.8	71.7	18.1	111.9	L638 A662 M670 Y742	L638-R666 HydrophobicContact CD2-CG 3.97Å; L638-R666 PolarHBondContact O-NH1 3.06Å; A662-R666 WeakPolarHBondContact O-CB 3.46Å; A662-R666 PolarHBondContact O-N 3.43Å; R666-M670 VanDerWaalsContact O-CB 3.25Å; R666-M670 WeakPolarHBondContact O-CB 3.39Å; R666-M670 PolarHBondContact O-N 3.32Å; R666-Y742 HydrophobicContact CB-CE1 3.89Å; R666-Y742 HydrophobicContact CG-CE1 4.11Å
667	Q	86.9	Confident	84	Confident	96 Å²	96	42.3 Å²	42.3	45%	0.449	21%	0.213	S	C	.	.	H	α-helix	trans	-70.2	-34	178.2	-169.2	59.3	34	0	0	112.7	F663 T664 L665 N671	F663-Q667 WeakPolarHBondContact O-CB 3.42Å; F663-Q667 PolarHBondContact O-N 3.29Å; F663-Q667 VanDerWaalsContact O-N 3.1Å; T664-Q667 PolarHBondContact O-N 2.87Å; L665-Q667 PolarHBondContact O-N 3.4Å; Q667-N671 WeakPolarHBondContact O-CB 3.45Å; Q667-N671 PolarHBondContact O-N 2.96Å
668	R	88.3	Confident	85.1	Confident	36 Å²	36	43.6 Å²	43.6	14%	0.136	21%	0.21	C	C	.	.	H	α-helix	trans	-69.5	-42.7	173	-75.8	174.2	55.8	-142.7	-14.4	112.3	T664 L665 N671 A672 D766 F769 T770 Y805	T664-R668 PolarHBondContact O-N 3.44Å; T664-R668 VanDerWaalsContact O-N 3.1Å; L665-R668 PolarHBondContact O-N 3.3Å; R668-N671 PolarHBondContact O-N 3.48Å; R668-A672 WeakPolarHBondContact O-CB 3.28Å; R668-A672 PolarHBondContact O-N 3.14Å; R668-D766 IonicContact CZ-OD1 3.83Å; R668-D766 IonicContact NH1-OD1 3.38Å; R668-D766 PolarHBondContact NH1-OD1 3.33Å; R668-D766 IonicContact NH1-OD2 2.7Å; R668-D766 PolarHBondContact NH1-OD2 3.04Å; R668-D766 IonicContact NH2-OD1 3.62Å; R668-D766 PolarHBondContact NH2-OD1 2.94Å; R668-F769 HydrophobicContact CB-CE1 4.31Å; R668-T770 PolarHBondContact NH2-OG1 3.33Å; R668-Y805 PolarHBondContact NE-OH 2.65Å; R668-Y805 VanDerWaalsContact NE-OH 3.09Å
669	M	91.2	Very high	86.1	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58.4	-50.5	172.5	-72.1	175.2	163.8	0	0	111.4	L638 L665 N671 A672 I673 I738 C739 Y742 F769	L638-M669 HydrophobicContact CD1-CB 4.02Å; L638-M669 HydrophobicContact CD2-CB 4.29Å; L638-M669 HydrophobicContact CD2-SD 4.48Å; L665-M669 HydrophobicContact CD1-CE 3.97Å; L665-M669 HydrophobicContact CD1-CG 4.32Å; L665-M669 HydrophobicContact CD1-SD 4.42Å; L665-M669 HydrophobicContact CD2-CE 4.11Å; L665-M669 HydrophobicContact CG-CE 3.94Å; L665-M669 HydrophobicContact CG-SD 4.1Å; L665-M669 WeakPolarHBondContact O-CG 3.48Å; L665-M669 PolarHBondContact O-N 3.05Å; M669-N671 PolarHBondContact O-N 3.25Å; M669-A672 PolarHBondContact O-N 2.88Å; M669-I673 PolarHBondContact O-N 3.48Å; M669-I673 VanDerWaalsContact O-N 3.13Å; M669-I738 HydrophobicContact CE-CG2 4.1Å; M669-C739 HydrophobicContact SD-CB 4.43Å; M669-Y742 HydrophobicContact CE-CD2 4.46Å; M669-Y742 HydrophobicContact CE-CG 4.02Å; M669-Y742 HydrophobicContact SD-CD1 3.67Å; M669-Y742 HydrophobicContact SD-CD2 4.48Å; M669-Y742 HydrophobicContact SD-CE1 4.33Å; M669-Y742 HydrophobicContact SD-CG 3.78Å; M669-F769 HydrophobicContact CB-CE2 4.35Å; M669-F769 HydrophobicContact CB-CZ 4.34Å; M669-F769 HydrophobicContact CE-CB 3.97Å; M669-F769 HydrophobicContact CE-CD2 4.03Å; M669-F769 HydrophobicContact CE-CG 4Å; M669-F769 HydrophobicContact CG-CD1 4.25Å; M669-F769 HydrophobicContact CG-CD2 3.85Å; M669-F769 HydrophobicContact CG-CE1 4.17Å; M669-F769 HydrophobicContact CG-CE2 3.76Å; M669-F769 HydrophobicContact CG-CG 4.11Å; M669-F769 HydrophobicContact CG-CZ 3.93Å
670	M	89.4	Confident	86.8	Confident	6 Å²	6	37.3 Å²	37.3	3%	0.03	18%	0.181	C	C	.	.	H	α-helix	trans	-56	-52.4	176.5	-178.1	64.1	81.8	0	0	111.6	E635 L638 C639 R666 A672 I673 Q674	E635-M670 HydrophobicContact CG-SD 3.92Å; L638-M670 HydrophobicContact CB-CE 3.46Å; L638-M670 VanDerWaalsContact CB-CE 3.46Å; L638-M670 HydrophobicContact CB-SD 4.32Å; C639-M670 HydrophobicContact CB-CE 4.24Å; C639-M670 WeakPolarHBondContact SG-CE 3.3Å; R666-M670 VanDerWaalsContact O-CB 3.25Å; R666-M670 WeakPolarHBondContact O-CB 3.39Å; R666-M670 PolarHBondContact O-N 3.32Å; M670-A672 VanDerWaalsContact C-N 3.29Å; M670-A672 PolarHBondContact O-N 3Å; M670-I673 PolarHBondContact O-N 3.22Å; M670-Q674 HydrophobicContact CG-CG 4.23Å; M670-Q674 WeakPolarHBondContact O-CB 3.47Å; M670-Q674 WeakPolarHBondContact O-CG 3.27Å; M670-Q674 PolarHBondContact O-N 3.46Å; M670-Q674 VanDerWaalsContact SD-CD 3.59Å; M670-Q674 HydrophobicContact SD-CG 3.83Å
671	N	88.6	Confident	87.5	Confident	69 Å²	69	31.5 Å²	31.5	37%	0.369	16%	0.161	S	C	.	.	H	α-helix	trans	-61.9	-35.6	-178.5	-175	79.7	0	0	0	112.7	Q667 R668 M669 N675	Q667-N671 WeakPolarHBondContact O-CB 3.45Å; Q667-N671 PolarHBondContact O-N 2.96Å; R668-N671 PolarHBondContact O-N 3.48Å; M669-N671 PolarHBondContact O-N 3.25Å; N671-N675 PolarHBondContact ND2-ND2 3.05Å; N671-N675 WeakPolarHBondContact O-CB 3.35Å; N671-N675 PolarHBondContact O-N 2.89Å; N671-N675 VanDerWaalsContact O-N 3.15Å; N671-N675 PolarHBondContact O-ND2 3.42Å; N671-N675 PolarHBondContact OD1-ND2 2.68Å
672	A	88.3	Confident	88	Confident	11 Å²	11	33.3 Å²	33.3	9%	0.091	16%	0.163	C	C	.	.	H	α-helix	trans	-66.2	-45.8	176.9	0	0	0	0	0	112.1	R668 M669 M670 L676 F769 L773	R668-A672 WeakPolarHBondContact O-CB 3.28Å; R668-A672 PolarHBondContact O-N 3.14Å; M669-A672 PolarHBondContact O-N 2.88Å; M670-A672 VanDerWaalsContact C-N 3.29Å; M670-A672 PolarHBondContact O-N 3Å; A672-L676 WeakPolarHBondContact O-CB 3.44Å; A672-L676 PolarHBondContact O-N 3.13Å; A672-L676 VanDerWaalsContact O-N 3.15Å; A672-F769 HydrophobicContact CB-CZ 3.89Å; A672-L773 HydrophobicContact CB-CD1 4.27Å
673	I	91.4	Very high	88.3	Confident	7 Å²	7	35 Å²	35	4%	0.036	17%	0.171	C	C	.	.	H	α-helix	trans	-68.1	-47	179.1	-70.5	160.9	0	0	0	110.8	V634 E635 L638 M669 M670 N675 L676 E677 C739	V634-I673 HydrophobicContact CB-CD1 4.1Å; V634-I673 HydrophobicContact CG1-CD1 3.51Å; E635-I673 HydrophobicContact CB-CG2 4.26Å; L638-I673 HydrophobicContact CD1-CD1 3.64Å; M669-I673 PolarHBondContact O-N 3.48Å; M669-I673 VanDerWaalsContact O-N 3.13Å; M670-I673 PolarHBondContact O-N 3.22Å; I673-N675 VanDerWaalsContact C-N 3.32Å; I673-N675 PolarHBondContact O-N 3.11Å; I673-L676 WeakPolarHBondContact O-CB 3.32Å; I673-L676 PolarHBondContact O-N 3.45Å; I673-E677 HydrophobicContact CG2-CG 4.24Å; I673-E677 WeakPolarHBondContact O-CG 3.34Å; I673-E677 PolarHBondContact O-N 3.34Å; I673-C739 HydrophobicContact CD1-CB 4.09Å
674	Q	90.4	Very high	88.6	Confident	73 Å²	73	32.6 Å²	32.6	34%	0.341	16%	0.16	S	C	.	.	H	α-helix	trans	-61.8	-36.3	-179.8	-71.2	-172.7	-46.1	0	0	113	E635 M670 Y678	E635-Q674 HydrophobicContact CG-CG 4.08Å; E635-Q674 WeakPolarHBondContact OE1-CG 3.29Å; E635-Q674 PolarHBondContact OE1-NE2 3.31Å; M670-Q674 HydrophobicContact CG-CG 4.23Å; M670-Q674 WeakPolarHBondContact O-CB 3.47Å; M670-Q674 WeakPolarHBondContact O-CG 3.27Å; M670-Q674 PolarHBondContact O-N 3.46Å; M670-Q674 VanDerWaalsContact SD-CD 3.59Å; M670-Q674 HydrophobicContact SD-CG 3.83Å; Q674-Y678 VanDerWaalsContact O-CB 3.23Å; Q674-Y678 WeakPolarHBondContact O-CB 3.44Å; Q674-Y678 PolarHBondContact O-N 3.41Å
675	N	88.9	Confident	88.9	Confident	26 Å²	26	29 Å²	29	14%	0.139	14%	0.138	C	C	.	.	H	α-helix	trans	-71.9	-33.9	173.9	-80.5	-78.6	0	0	0	112.7	N671 I673 Y679 I799	N671-N675 PolarHBondContact ND2-ND2 3.05Å; N671-N675 WeakPolarHBondContact O-CB 3.35Å; N671-N675 PolarHBondContact O-N 2.89Å; N671-N675 VanDerWaalsContact O-N 3.15Å; N671-N675 PolarHBondContact O-ND2 3.42Å; N671-N675 PolarHBondContact OD1-ND2 2.68Å; I673-N675 VanDerWaalsContact C-N 3.32Å; I673-N675 PolarHBondContact O-N 3.11Å; N675-Y679 WeakPolarHBondContact O-CB 3.47Å; N675-Y679 PolarHBondContact O-N 3.35Å; N675-I799 HydrophobicContact CB-CG1 4.23Å
676	L	87.9	Confident	89.1	Confident	9 Å²	9	31.5 Å²	31.5	5%	0.047	15%	0.15	C	C	.	.	H	α-helix	trans	-67.7	-42.3	175.1	-177.1	63.7	0	0	0	111.7	A672 I673 Y679 M680 I732 F776 L795	A672-L676 WeakPolarHBondContact O-CB 3.44Å; A672-L676 PolarHBondContact O-N 3.13Å; A672-L676 VanDerWaalsContact O-N 3.15Å; I673-L676 WeakPolarHBondContact O-CB 3.32Å; I673-L676 PolarHBondContact O-N 3.45Å; L676-Y679 WeakPolarHBondContact O-CB 3.21Å; L676-Y679 PolarHBondContact O-N 3.06Å; L676-M680 HydrophobicContact CG-CE 4.18Å; L676-M680 WeakPolarHBondContact O-CG 3.42Å; L676-M680 PolarHBondContact O-N 3.37Å; L676-M680 VanDerWaalsContact O-N 3.11Å; L676-I732 HydrophobicContact CD1-CD1 4.31Å; L676-I732 HydrophobicContact CD2-CB 4.48Å; L676-I732 HydrophobicContact CD2-CD1 4.16Å; L676-I732 HydrophobicContact CD2-CG1 3.97Å; L676-I732 HydrophobicContact CD2-CG2 3.78Å; L676-F776 HydrophobicContact CD1-CE1 4.34Å; L676-F776 HydrophobicContact CD1-CZ 3.97Å; L676-L795 HydrophobicContact CD1-CD1 4.47Å; L676-L795 HydrophobicContact CD1-CD2 4.2Å
677	E	89.3	Confident	89.3	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.009	16%	0.164	C	C	.	.	H	α-helix	trans	-66	-46.3	174.7	-69.3	174.2	160.8	0	0	112.3	C631 K632 I673 Y679 M680 M681	C631-E677 HydrophobicContact CB-CG 3.78Å; C631-E677 WeakPolarHBondContact CB-OE1 3.4Å; C631-E677 VanDerWaalsContact O-OE1 3.1Å; K632-E677 VanDerWaalsContact CA-OE1 3.24Å; K632-E677 WeakPolarHBondContact CA-OE1 3.41Å; K632-E677 WeakPolarHBondContact CD-OE1 3.46Å; K632-E677 WeakPolarHBondContact CE-OE2 3.19Å; K632-E677 PolarHBondContact N-OE1 3.39Å; K632-E677 IonicContact NZ-OE1 2.79Å; K632-E677 IonicContact NZ-OE2 2.61Å; K632-E677 PolarHBondContact NZ-OE2 3.09Å; I673-E677 HydrophobicContact CG2-CG 4.24Å; I673-E677 WeakPolarHBondContact O-CG 3.34Å; I673-E677 PolarHBondContact O-N 3.34Å; E677-Y679 PolarHBondContact O-N 3.31Å; E677-M680 HydrophobicContact CG-CE 4.46Å; E677-M680 PolarHBondContact O-N 2.89Å; E677-M681 WeakPolarHBondContact O-CB 3.4Å; E677-M681 WeakPolarHBondContact O-CG 3.27Å; E677-M681 PolarHBondContact O-N 3.47Å
678	Y	89.6	Confident	89.5	Confident	90 Å²	90	30.6 Å²	30.6	35%	0.353	15%	0.152	S	C	.	.	H	α-helix	trans	-54	-45.6	174.8	-178.9	-73.6	0	0	0	110.6	Q674 I682 E683 R798	Q674-Y678 VanDerWaalsContact O-CB 3.23Å; Q674-Y678 WeakPolarHBondContact O-CB 3.44Å; Q674-Y678 PolarHBondContact O-N 3.41Å; Y678-I682 HydrophobicContact CD1-CB 4.31Å; Y678-I682 HydrophobicContact CD2-CD1 3.68Å; Y678-I682 HydrophobicContact CE1-CB 4.04Å; Y678-I682 HydrophobicContact CE1-CG2 3.93Å; Y678-I682 HydrophobicContact CE2-CB 4.4Å; Y678-I682 HydrophobicContact CE2-CD1 3.62Å; Y678-I682 HydrophobicContact CE2-CG2 4.27Å; Y678-I682 HydrophobicContact CG-CD1 4.3Å; Y678-I682 WeakPolarHBondContact O-CA 3.35Å; Y678-I682 WeakPolarHBondContact O-CB 3.49Å; Y678-I682 PolarHBondContact O-N 3.26Å; Y678-E683 HydrophobicContact CD1-CG 4.24Å; Y678-E683 HydrophobicContact CE1-CG 3.91Å; Y678-E683 PolarHBondContact O-N 3.42Å; Y678-R798 PolarHBondContact OH-NH2 2.9Å
679	Y	88.5	Confident	89.8	Confident	1 Å²	1	29.8 Å²	29.8	0%	0.004	15%	0.149	C	C	.	.	I	π-helix	trans	-59.9	-50.7	177.7	168.9	-107.4	0	0	0	112.4	N675 L676 E677 M681 E683 I684 M721 C791 F792 L795	N675-Y679 WeakPolarHBondContact O-CB 3.47Å; N675-Y679 PolarHBondContact O-N 3.35Å; L676-Y679 WeakPolarHBondContact O-CB 3.21Å; L676-Y679 PolarHBondContact O-N 3.06Å; E677-Y679 PolarHBondContact O-N 3.31Å; Y679-M681 PolarHBondContact O-N 2.74Å; Y679-E683 HydrophobicContact CD2-CB 3.98Å; Y679-E683 WeakPolarHBondContact CD2-OE2 3.49Å; Y679-E683 CarbonylContact O-C 3.53Å; Y679-E683 WeakPolarHBondContact O-CA 3.19Å; Y679-E683 WeakPolarHBondContact O-CB 3.37Å; Y679-E683 PolarHBondContact O-N 2.97Å; Y679-E683 VanDerWaalsContact O-N 3.12Å; Y679-I684 HydrophobicContact CD1-CD1 3.8Å; Y679-I684 HydrophobicContact CD2-CD1 4.44Å; Y679-I684 HydrophobicContact CE1-CD1 3.3Å; Y679-I684 HydrophobicContact CE1-CG1 4.35Å; Y679-I684 HydrophobicContact CE2-CD1 4Å; Y679-I684 HydrophobicContact CE2-CG1 4.22Å; Y679-I684 HydrophobicContact CG-CD1 4.36Å; Y679-I684 VanDerWaalsContact CZ-CD1 3.43Å; Y679-I684 PolarHBondContact O-N 3.18Å; Y679-M721 HydrophobicContact CE1-CE 3.9Å; Y679-C791 HydrophobicContact CE2-CB 4.08Å; Y679-C791 WeakPolarHBondContact CE2-O 3.44Å; Y679-F792 WeakPolarHBondContact OH-CD1 3.44Å; Y679-F792 VanDerWaalsContact OH-CE1 3.26Å; Y679-F792 WeakPolarHBondContact OH-CE1 3.31Å; Y679-L795 HydrophobicContact CD1-CB 4.42Å; Y679-L795 HydrophobicContact CD1-CD1 4.1Å; Y679-L795 HydrophobicContact CD1-CD2 3.77Å; Y679-L795 HydrophobicContact CD1-CG 4.32Å; Y679-L795 HydrophobicContact CD2-CB 3.88Å; Y679-L795 HydrophobicContact CD2-CD1 4.41Å; Y679-L795 HydrophobicContact CE1-CB 4.48Å; Y679-L795 HydrophobicContact CE1-CD2 3.79Å; Y679-L795 HydrophobicContact CE2-CB 3.97Å; Y679-L795 HydrophobicContact CG-CB 4.1Å; Y679-L795 HydrophobicContact CG-CD1 3.84Å; Y679-L795 HydrophobicContact CG-CD2 4.22Å; Y679-L795 HydrophobicContact CG-CG 4.27Å
680	M	88.5	Confident	89.9	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.01	18%	0.176	C	C	.	.	I	π-helix	trans	-62.6	-44.2	179	-65.8	-177.5	-64.5	0	0	112.3	Q627 L628 C631 L676 E677 I684 I685	Q627-M680 HydrophobicContact CG-SD 4.14Å; Q627-M680 PolarHBondContact NE2-SD 2.69Å; L628-M680 HydrophobicContact CD2-CB 3.76Å; L628-M680 HydrophobicContact CD2-CE 4Å; L628-M680 HydrophobicContact CD2-SD 4.2Å; C631-M680 HydrophobicContact CB-CE 4.44Å; L676-M680 HydrophobicContact CG-CE 4.18Å; L676-M680 WeakPolarHBondContact O-CG 3.42Å; L676-M680 PolarHBondContact O-N 3.37Å; L676-M680 VanDerWaalsContact O-N 3.11Å; E677-M680 HydrophobicContact CG-CE 4.46Å; E677-M680 PolarHBondContact O-N 2.89Å; M680-I684 WeakPolarHBondContact O-CB 3.37Å; M680-I685 WeakPolarHBondContact O-CB 3.35Å; M680-I685 WeakPolarHBondContact O-CD1 3.32Å; M680-I685 VanDerWaalsContact O-CG1 3.25Å; M680-I685 WeakPolarHBondContact O-CG1 3.49Å; M680-I685 PolarHBondContact O-N 2.91Å
681	M	90.1	Very high	90	Very high	40 Å²	40	39 Å²	39	20%	0.197	19%	0.193	C	C	.	.	I	π-helix	trans	-78.5	-49.5	-175.6	-65.3	178.6	176	0	0	112.9	L511 L628 K632 E677 Y679 E686	L511-M681 HydrophobicContact CB-CE 4.03Å; L511-M681 HydrophobicContact CD1-CE 3.91Å; L511-M681 HydrophobicContact CG-CE 4.48Å; L628-M681 HydrophobicContact CB-CE 4.41Å; L628-M681 HydrophobicContact CD2-CE 4.07Å; L628-M681 HydrophobicContact CD2-CG 4.17Å; K632-M681 HydrophobicContact CG-CE 4.03Å; E677-M681 WeakPolarHBondContact O-CB 3.4Å; E677-M681 WeakPolarHBondContact O-CG 3.27Å; E677-M681 PolarHBondContact O-N 3.47Å; Y679-M681 PolarHBondContact O-N 2.74Å; M681-E686 PolarHBondContact O-N 3.16Å
682	I	89.3	Confident	90.2	Very high	85 Å²	85	36 Å²	36	44%	0.436	18%	0.177	S	C	.	.	I	π-helix	trans	-102.8	-29.1	-165.5	-63.6	167	0	0	0	112.8	Y678 P687	Y678-I682 HydrophobicContact CD1-CB 4.31Å; Y678-I682 HydrophobicContact CD2-CD1 3.68Å; Y678-I682 HydrophobicContact CE1-CB 4.04Å; Y678-I682 HydrophobicContact CE1-CG2 3.93Å; Y678-I682 HydrophobicContact CE2-CB 4.4Å; Y678-I682 HydrophobicContact CE2-CD1 3.62Å; Y678-I682 HydrophobicContact CE2-CG2 4.27Å; Y678-I682 HydrophobicContact CG-CD1 4.3Å; Y678-I682 WeakPolarHBondContact O-CA 3.35Å; Y678-I682 WeakPolarHBondContact O-CB 3.49Å; Y678-I682 PolarHBondContact O-N 3.26Å; I682-P687 VanDerWaalsContact O-CD 3.28Å; I682-P687 WeakPolarHBondContact O-CD 3.38Å; I682-P687 WeakPolarHBondContact O-CG 3.48Å
683	E	86.3	Confident	90.4	Very high	36 Å²	36	37.1 Å²	37.1	17%	0.168	18%	0.181	C	C	.	.	I	π-helix	trans	-94	-22.8	175.7	-58	-161.5	160.4	0	0	113.4	Y678 Y679 N794 R798	Y678-E683 HydrophobicContact CD1-CG 4.24Å; Y678-E683 HydrophobicContact CE1-CG 3.91Å; Y678-E683 PolarHBondContact O-N 3.42Å; Y679-E683 HydrophobicContact CD2-CB 3.98Å; Y679-E683 WeakPolarHBondContact CD2-OE2 3.49Å; Y679-E683 CarbonylContact O-C 3.53Å; Y679-E683 WeakPolarHBondContact O-CA 3.19Å; Y679-E683 WeakPolarHBondContact O-CB 3.37Å; Y679-E683 PolarHBondContact O-N 2.97Å; Y679-E683 VanDerWaalsContact O-N 3.12Å; E683-N794 WeakPolarHBondContact OE2-CB 3.47Å; E683-R798 IonicContact OE1-CZ 2.65Å; E683-R798 IonicContact OE1-NE 2.76Å; E683-R798 PolarHBondContact OE1-NE 3.46Å; E683-R798 IonicContact OE1-NH2 2.99Å; E683-R798 PolarHBondContact OE1-NH2 3.03Å; E683-R798 IonicContact OE2-NE 2.66Å
684	I	88.4	Confident	90.4	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	21%	0.21	C	C	.	.	I	π-helix	trans	-108.1	-64.2	178.3	-61.7	164.1	0	0	0	112.1	Y679 M680 N688 N719	Y679-I684 HydrophobicContact CD1-CD1 3.8Å; Y679-I684 HydrophobicContact CD2-CD1 4.44Å; Y679-I684 HydrophobicContact CE1-CD1 3.3Å; Y679-I684 HydrophobicContact CE1-CG1 4.35Å; Y679-I684 HydrophobicContact CE2-CD1 4Å; Y679-I684 HydrophobicContact CE2-CG1 4.22Å; Y679-I684 HydrophobicContact CG-CD1 4.36Å; Y679-I684 VanDerWaalsContact CZ-CD1 3.43Å; Y679-I684 PolarHBondContact O-N 3.18Å; M680-I684 WeakPolarHBondContact O-CB 3.37Å; I684-N688 WeakPolarHBondContact O-CB 3.47Å; I684-N688 PolarHBondContact O-N 3.1Å; I684-N688 PolarHBondContact O-ND2 2.69Å; I684-N719 HydrophobicContact CB-CB 4.43Å; I684-N719 VanDerWaalsContact CD1-C 3.43Å; I684-N719 HydrophobicContact CD1-CB 3.84Å; I684-N719 VanDerWaalsContact CD1-O 3.29Å; I684-N719 WeakPolarHBondContact CD1-O 3.44Å; I684-N719 HydrophobicContact CG1-CB 3.89Å; I684-N719 HydrophobicContact CG2-CB 3.66Å
685	I	91.1	Very high	90.5	Very high	5 Å²	5	44.8 Å²	44.8	3%	0.026	22%	0.215	C	C	.	.	I	π-helix	trans	-68.7	-48.6	-167.9	-72.2	163.8	0	0	0	111.6	L510 L628 M680 W689	L510-I685 HydrophobicContact CB-CG2 4.34Å; L510-I685 HydrophobicContact CD1-CG2 3.95Å; L510-I685 HydrophobicContact CD2-CD1 4.26Å; L628-I685 HydrophobicContact CD1-CD1 3.78Å; L628-I685 HydrophobicContact CD2-CD1 4.31Å; M680-I685 WeakPolarHBondContact O-CB 3.35Å; M680-I685 WeakPolarHBondContact O-CD1 3.32Å; M680-I685 VanDerWaalsContact O-CG1 3.25Å; M680-I685 WeakPolarHBondContact O-CG1 3.49Å; M680-I685 PolarHBondContact O-N 2.91Å; I685-W689 VanDerWaalsContact O-CB 3.26Å; I685-W689 WeakPolarHBondContact O-CB 3.42Å; I685-W689 PolarHBondContact O-N 3.07Å
686	E	91.8	Very high	90.4	Very high	54 Å²	54	44.1 Å²	44.1	25%	0.252	21%	0.211	S	C	.	.	H	α-helix	trans	-64.2	-45.4	-176.2	-158.5	57.6	-131.7	0	0	113.9	K506 M681 W689 H690	K506-E686 WeakPolarHBondContact CE-OE2 3.41Å; K506-E686 IonicContact NZ-OE1 2.68Å; K506-E686 PolarHBondContact NZ-OE1 2.97Å; K506-E686 IonicContact NZ-OE2 3.96Å; K506-E686 PolarHBondContact NZ-OE2 3.1Å; M681-E686 PolarHBondContact O-N 3.16Å; E686-W689 PolarHBondContact O-N 3.01Å; E686-H690 PolarHBondContact O-CD2 3.08Å; E686-H690 PolarHBondContact O-N 3.31Å; E686-H690 IonicContact OE1-CD2 2.75Å; E686-H690 IonicContact OE1-NE2 3.45Å
687	P	91.8	Very high	90.4	Very high	53 Å²	53	51.6 Å²	51.6	34%	0.344	24%	0.244	S	C	.	.	H	α-helix	trans	-67.3	-41.4	178.7	-22.8	36.6	0	0	0	112.7	I682 W689 H690 I691	I682-P687 VanDerWaalsContact O-CD 3.28Å; I682-P687 WeakPolarHBondContact O-CD 3.38Å; I682-P687 WeakPolarHBondContact O-CG 3.48Å; P687-W689 VanDerWaalsContact C-N 3.29Å; P687-W689 PolarHBondContact O-N 3.17Å; P687-H690 PolarHBondContact O-N 3.45Å; P687-I691 VanDerWaalsContact O-CG1 3.31Å; P687-I691 WeakPolarHBondContact O-CG1 3.34Å; P687-I691 PolarHBondContact O-N 3.45Å
688	N	91.3	Very high	90.3	Very high	36 Å²	36	57 Å²	57	19%	0.193	28%	0.276	C	S	.	.	H	α-helix	trans	-64.9	-35.6	175.5	-74.9	-65	0	0	0	111.4	I684 I691 F692 F712	I684-N688 WeakPolarHBondContact O-CB 3.47Å; I684-N688 PolarHBondContact O-N 3.1Å; I684-N688 PolarHBondContact O-ND2 2.69Å; N688-I691 PolarHBondContact O-N 3.35Å; N688-F692 WeakPolarHBondContact O-CB 3.21Å; N688-F692 PolarHBondContact O-N 3.5Å; N688-F712 HydrophobicContact CB-CD2 3.96Å; N688-F712 HydrophobicContact CB-CE2 4.03Å
689	W	93.6	Very high	90.2	Very high	19 Å²	19	53.6 Å²	53.6	7%	0.072	27%	0.265	C	S	.	.	H	α-helix	trans	-65.9	-43.5	173.6	-178.6	-96.5	0	0	0	112.4	M499 L502 Q503 K506 I685 E686 P687 I691 F692 I693 F712	M499-W689 HydrophobicContact CE-CH2 4.29Å; M499-W689 HydrophobicContact CE-CZ2 4.22Å; L502-W689 HydrophobicContact CB-CH2 4.24Å; L502-W689 WeakPolarHBondContact O-CH2 3.33Å; Q503-W689 HydrophobicContact CG-CZ2 4.4Å; K506-W689 HydrophobicContact CB-CH2 3.98Å; K506-W689 HydrophobicContact CB-CZ2 4.14Å; K506-W689 HydrophobicContact CB-CZ3 4.22Å; K506-W689 HydrophobicContact CD-CD2 3.49Å; K506-W689 VanDerWaalsContact CD-CD2 3.49Å; K506-W689 HydrophobicContact CD-CE3 4.04Å; K506-W689 HydrophobicContact CD-CG 3.75Å; K506-W689 HydrophobicContact CD-CH2 4.35Å; K506-W689 HydrophobicContact CD-CZ2 3.85Å; K506-W689 HydrophobicContact CD-CZ3 4.44Å; K506-W689 VanDerWaalsContact NZ-CG 3.34Å; I685-W689 VanDerWaalsContact O-CB 3.26Å; I685-W689 WeakPolarHBondContact O-CB 3.42Å; I685-W689 PolarHBondContact O-N 3.07Å; E686-W689 PolarHBondContact O-N 3.01Å; P687-W689 VanDerWaalsContact C-N 3.29Å; P687-W689 PolarHBondContact O-N 3.17Å; W689-I691 PolarHBondContact O-N 2.87Å; W689-F692 HydrophobicContact CE3-CD1 4.01Å; W689-F692 HydrophobicContact CH2-CE1 4.4Å; W689-F692 AromaticContact CZ3-CD1 3.99Å; W689-F692 HydrophobicContact CZ3-CD1 3.99Å; W689-F692 HydrophobicContact CZ3-CE1 4.08Å; W689-F692 WeakPolarHBondContact O-CB 3.33Å; W689-F692 PolarHBondContact O-N 2.76Å; W689-I693 HydrophobicContact CD2-CG1 4.16Å; W689-I693 HydrophobicContact CG-CG1 4.33Å; W689-I693 HydrophobicContact CH2-CD1 4.35Å; W689-I693 HydrophobicContact CZ2-CD1 3.72Å; W689-I693 HydrophobicContact CZ2-CG1 4.09Å; W689-I693 VanDerWaalsContact O-CG1 3.31Å; W689-I693 WeakPolarHBondContact O-CG1 3.3Å; W689-I693 PolarHBondContact O-N 3.46Å; W689-F712 HydrophobicContact CB-CE2 4.09Å; W689-F712 HydrophobicContact CE3-CE1 4.25Å; W689-F712 HydrophobicContact CE3-CE2 4.06Å; W689-F712 AromaticContact CE3-CZ 3.79Å; W689-F712 HydrophobicContact CE3-CZ 3.79Å; W689-F712 HydrophobicContact CZ3-CZ 4.45Å
690	H	92.9	Very high	89.9	Confident	122 Å²	122	59.8 Å²	59.8	57%	0.565	29%	0.294	S	S	*	.	H	α-helix	trans	-59.1	-45.8	174.8	-88.9	-71.3	0	0	0	112	E686 P687 F692 I693 E694	E686-H690 PolarHBondContact O-CD2 3.08Å; E686-H690 PolarHBondContact O-N 3.31Å; E686-H690 IonicContact OE1-CD2 2.75Å; E686-H690 IonicContact OE1-NE2 3.45Å; P687-H690 PolarHBondContact O-N 3.45Å; H690-F692 VanDerWaalsContact C-N 3.34Å; H690-F692 PolarHBondContact O-N 3.15Å; H690-I693 PolarHBondContact O-N 3.19Å; H690-E694 WeakPolarHBondContact O-CB 3.49Å; H690-E694 PolarHBondContact O-N 3.5Å
691	I	92.2	Very high	89.7	Confident	79 Å²	79	60.4 Å²	60.4	41%	0.405	30%	0.298	S	S	.	.	H	α-helix	trans	-62.1	-40.9	176.5	-66.6	164.6	0	0	0	111.1	P687 N688 W689 K695	P687-I691 VanDerWaalsContact O-CG1 3.31Å; P687-I691 WeakPolarHBondContact O-CG1 3.34Å; P687-I691 PolarHBondContact O-N 3.45Å; N688-I691 PolarHBondContact O-N 3.35Å; W689-I691 PolarHBondContact O-N 2.87Å; I691-K695 HydrophobicContact CG2-CD 4.03Å; I691-K695 WeakPolarHBondContact O-CB 3.36Å; I691-K695 VanDerWaalsContact O-CG 3.29Å; I691-K695 WeakPolarHBondContact O-CG 3.35Å; I691-K695 PolarHBondContact O-N 3.42Å; I691-K695 VanDerWaalsContact O-N 3.09Å
692	F	92.9	Very high	89.5	Confident	4 Å²	4	58.8 Å²	58.8	2%	0.018	29%	0.29	C	S	.	.	H	α-helix	trans	-61.4	-51.6	175.1	172.4	-110.9	0	0	0	111.5	L502 N688 W689 H690 E694 K695 M696 L708 H709 F712	L502-F692 HydrophobicContact CD1-CE1 4.22Å; L502-F692 HydrophobicContact CD1-CZ 4.06Å; L502-F692 HydrophobicContact CD2-CE1 4.49Å; N688-F692 WeakPolarHBondContact O-CB 3.21Å; N688-F692 PolarHBondContact O-N 3.5Å; W689-F692 HydrophobicContact CE3-CD1 4.01Å; W689-F692 HydrophobicContact CH2-CE1 4.4Å; W689-F692 AromaticContact CZ3-CD1 3.99Å; W689-F692 HydrophobicContact CZ3-CD1 3.99Å; W689-F692 HydrophobicContact CZ3-CE1 4.08Å; W689-F692 WeakPolarHBondContact O-CB 3.33Å; W689-F692 PolarHBondContact O-N 2.76Å; H690-F692 VanDerWaalsContact C-N 3.34Å; H690-F692 PolarHBondContact O-N 3.15Å; F692-E694 VanDerWaalsContact C-N 3.34Å; F692-E694 PolarHBondContact O-N 2.76Å; F692-K695 PolarHBondContact O-N 3.13Å; F692-M696 VanDerWaalsContact O-CB 3.22Å; F692-M696 WeakPolarHBondContact O-CB 3.21Å; F692-M696 PolarHBondContact O-N 3.45Å; F692-L708 HydrophobicContact CD2-CB 4.16Å; F692-L708 WeakPolarHBondContact CD2-O 3.28Å; F692-L708 HydrophobicContact CE2-CB 4.15Å; F692-H709 HydrophobicContact CE2-CB 3.99Å; F692-H709 HydrophobicContact CZ-CB 4.33Å; F692-F712 HydrophobicContact CB-CB 4.21Å; F692-F712 HydrophobicContact CB-CD2 4Å; F692-F712 HydrophobicContact CB-CG 4.23Å; F692-F712 HydrophobicContact CD2-CB 4.06Å; F692-F712 HydrophobicContact CG-CB 4.21Å; F692-F712 HydrophobicContact CG-CD2 4.47Å; F692-F712 HydrophobicContact CG-CG 4.27Å
693	I	92.1	Very high	89.2	Confident	35 Å²	35	55.1 Å²	55.1	18%	0.179	27%	0.271	C	S	.	.	H	α-helix	trans	-64.8	-34.7	-179.7	-66.4	-62.7	0	0	0	112.8	M499 W689 H690 K697	M499-I693 HydrophobicContact CE-CD1 3.21Å; M499-I693 HydrophobicContact SD-CD1 3.68Å; W689-I693 HydrophobicContact CD2-CG1 4.16Å; W689-I693 HydrophobicContact CG-CG1 4.33Å; W689-I693 HydrophobicContact CH2-CD1 4.35Å; W689-I693 HydrophobicContact CZ2-CD1 3.72Å; W689-I693 HydrophobicContact CZ2-CG1 4.09Å; W689-I693 VanDerWaalsContact O-CG1 3.31Å; W689-I693 WeakPolarHBondContact O-CG1 3.3Å; W689-I693 PolarHBondContact O-N 3.46Å; H690-I693 PolarHBondContact O-N 3.19Å; I693-K697 WeakPolarHBondContact O-CG 3.26Å
694	E	92.3	Very high	89.3	Confident	139 Å²	139	56.4 Å²	56.4	65%	0.65	28%	0.279	S	S	*	.	H	α-helix	trans	-67.2	-50.5	175.3	-175.1	167.5	-143	0	0	111.2	H690 F692 M696 K697	H690-E694 WeakPolarHBondContact O-CB 3.49Å; H690-E694 PolarHBondContact O-N 3.5Å; F692-E694 VanDerWaalsContact C-N 3.34Å; F692-E694 PolarHBondContact O-N 2.76Å; E694-M696 VanDerWaalsContact C-N 3.31Å; E694-M696 PolarHBondContact O-N 3.47Å; E694-K697 PolarHBondContact O-N 3.03Å
695	K	90.7	Very high	89.4	Confident	102 Å²	102	56.4 Å²	56.4	44%	0.443	28%	0.279	S	S	.	.	H	α-helix	trans	-62.4	-36.4	176.8	-68.9	175.6	-178.7	175.9	0	112.5	I691 F692 K697 T698 V699 L708	I691-K695 HydrophobicContact CG2-CD 4.03Å; I691-K695 WeakPolarHBondContact O-CB 3.36Å; I691-K695 VanDerWaalsContact O-CG 3.29Å; I691-K695 WeakPolarHBondContact O-CG 3.35Å; I691-K695 PolarHBondContact O-N 3.42Å; I691-K695 VanDerWaalsContact O-N 3.09Å; F692-K695 PolarHBondContact O-N 3.13Å; K695-K697 PolarHBondContact O-N 3.12Å; K695-T698 PolarHBondContact O-N 2.92Å; K695-T698 PolarHBondContact O-OG1 3.49Å; K695-V699 WeakPolarHBondContact O-CG2 3.41Å; K695-L708 HydrophobicContact CB-CD1 3.84Å; K695-L708 HydrophobicContact CB-CD2 3.98Å; K695-L708 HydrophobicContact CD-CD2 3.55Å; K695-L708 HydrophobicContact CG-CD2 4.39Å
696	M	88.2	Confident	89.2	Confident	12 Å²	12	58.3 Å²	58.3	6%	0.059	29%	0.289	C	S	.	.	H	α-helix	trans	-59.2	-31.2	179.1	-171.4	62.7	167.7	0	0	112.6	L493 L498 M499 L502 F692 E694 T698 V699 V705	L493-M696 HydrophobicContact CD2-CE 3.75Å; L498-M696 HydrophobicContact CD2-CE 4.38Å; M499-M696 HydrophobicContact SD-CG 4.24Å; L502-M696 HydrophobicContact CD1-CE 4.46Å; F692-M696 VanDerWaalsContact O-CB 3.22Å; F692-M696 WeakPolarHBondContact O-CB 3.21Å; F692-M696 PolarHBondContact O-N 3.45Å; E694-M696 VanDerWaalsContact C-N 3.31Å; E694-M696 PolarHBondContact O-N 3.47Å; M696-T698 VanDerWaalsContact C-N 3.27Å; M696-T698 PolarHBondContact O-N 3.17Å; M696-V699 PolarHBondContact O-N 3.04Å; M696-V699 HydrophobicContact SD-CG2 4.38Å; M696-V705 HydrophobicContact CE-CB 4.48Å; M696-V705 HydrophobicContact CE-CG1 3.65Å; M696-V705 HydrophobicContact CE-CG2 4.07Å; M696-V705 HydrophobicContact SD-CB 4.45Å; M696-V705 HydrophobicContact SD-CG1 4.02Å; M696-V705 HydrophobicContact SD-CG2 4.04Å
697	K	87.8	Confident	89.1	Confident	167 Å²	167	62.5 Å²	62.5	73%	0.726	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-19.1	176.1	-66.6	167.6	-172.9	175.5	0	113.9	I693 E694 K695	I693-K697 WeakPolarHBondContact O-CG 3.26Å; E694-K697 PolarHBondContact O-N 3.03Å; K695-K697 PolarHBondContact O-N 3.12Å
698	T	87.5	Confident	89.1	Confident	114 Å²	114	61.4 Å²	61.4	70%	0.699	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	15.1	-179.7	58.2	0	0	0	0	112.9	K695 M696	K695-T698 PolarHBondContact O-N 2.92Å; K695-T698 PolarHBondContact O-OG1 3.49Å; M696-T698 VanDerWaalsContact C-N 3.27Å; M696-T698 PolarHBondContact O-N 3.17Å
699	V	86.8	Confident	89.2	Confident	20 Å²	20	59.8 Å²	59.8	12%	0.121	29%	0.285	C	S	.	.			trans	-84.2	129.2	-178.3	177	0	0	0	0	111.6	L489 K695 M696 N701 N704 V705 L708	L489-V699 HydrophobicContact CD1-CG1 4.33Å; L489-V699 HydrophobicContact CD2-CG1 4.08Å; L489-V699 WeakPolarHBondContact CD2-O 3.47Å; K695-V699 WeakPolarHBondContact O-CG2 3.41Å; M696-V699 PolarHBondContact O-N 3.04Å; M696-V699 HydrophobicContact SD-CG2 4.38Å; V699-N701 WeakPolarHBondContact CG1-O 3.42Å; V699-N704 HydrophobicContact CG1-CB 3.93Å; V699-N704 HydrophobicContact CG2-CB 4.47Å; V699-V705 HydrophobicContact CB-CG2 4.48Å; V699-V705 HydrophobicContact CG1-CG2 3.68Å; V699-L708 HydrophobicContact CG2-CD1 3.58Å
700	E	82.3	Confident	89	Confident	130 Å²	130	63 Å²	63	61%	0.607	30%	0.301	S	S	*	.			trans	-105.1	-15.2	173.2	-57.8	-173.6	134.9	0	0	113.7	L489	L489-E700 VanDerWaalsContact CD2-C 3.46Å
701	N	84.2	Confident	88.9	Confident	16 Å²	16	61.7 Å²	61.7	9%	0.086	30%	0.298	C	S	.	.	S	Bend	trans	-135.9	140.3	-171.1	-66.1	-68.8	0	0	0	112.3	Y482 A485 V699 D703 N704 V705	Y482-N701 WeakPolarHBondContact CD1-OD1 3.4Å; A485-N701 HydrophobicContact CB-CB 4.46Å; A485-N701 WeakPolarHBondContact CB-OD1 3.43Å; V699-N701 WeakPolarHBondContact CG1-O 3.42Å; N701-D703 VanDerWaalsContact C-N 3.33Å; N701-D703 PolarHBondContact O-N 3.27Å; N701-N704 WeakPolarHBondContact O-CB 3.39Å; N701-N704 PolarHBondContact O-N 3.43Å; N701-V705 PolarHBondContact O-N 3.3Å
702	V	85.9	Confident	89	Confident	6 Å²	6	58.3 Å²	58.3	4%	0.036	28%	0.28	C	S	.	.	H	α-helix	trans	-61.7	-36.1	179.6	-178.7	0	0	0	0	112.9	A485 L488 L489 L492 N704 V705 L706	A485-V702 WeakPolarHBondContact O-CG2 3.48Å; L488-V702 HydrophobicContact CB-CG2 3.99Å; L488-V702 HydrophobicContact CD2-CG1 4.34Å; L488-V702 HydrophobicContact CD2-CG2 4.11Å; L488-V702 HydrophobicContact CG-CG2 3.89Å; L489-V702 HydrophobicContact CB-CG2 3.82Å; L489-V702 HydrophobicContact CD1-CG2 4.25Å; L492-V702 HydrophobicContact CD1-CG1 4.02Å; L492-V702 HydrophobicContact CD1-CG2 4.2Å; V702-N704 PolarHBondContact O-N 3.21Å; V702-N704 VanDerWaalsContact O-N 3.15Å; V702-V705 WeakPolarHBondContact O-CB 3.44Å; V702-V705 PolarHBondContact O-N 3.15Å; V702-L706 HydrophobicContact CG1-CD1 4.43Å; V702-L706 PolarHBondContact O-N 3.26Å
703	D	83.9	Confident	88.9	Confident	7 Å²	7	58.1 Å²	58.1	4%	0.037	28%	0.279	C	S	.	.	H	α-helix	trans	-53.9	-34	172.4	-74.7	-58.6	0	0	0	112.7	R441 Y445 Y481 N701 R707	R441-D703 IonicContact CZ-OD1 3.79Å; R441-D703 IonicContact NE-OD1 2.69Å; R441-D703 IonicContact NH1-OD1 2.69Å; R441-D703 PolarHBondContact NH1-OD1 3Å; Y445-D703 PolarHBondContact OH-OD1 3.36Å; Y445-D703 PolarHBondContact OH-OD2 3.43Å; Y481-D703 PolarHBondContact OH-OD2 2.86Å; N701-D703 VanDerWaalsContact C-N 3.33Å; N701-D703 PolarHBondContact O-N 3.27Å; D703-R707 WeakPolarHBondContact O-CB 3.23Å; D703-R707 VanDerWaalsContact O-CG 3.28Å; D703-R707 WeakPolarHBondContact O-CG 3.42Å; D703-R707 PolarHBondContact O-N 3.44Å; D703-R707 VanDerWaalsContact O-N 3.08Å
704	N	87.9	Confident	88.7	Confident	63 Å²	63	59.7 Å²	59.7	34%	0.337	29%	0.288	S	S	.	.	H	α-helix	trans	-77	-32.1	178.1	-67.6	-9.9	0	0	0	111.6	V699 N701 V702 L708	V699-N704 HydrophobicContact CG1-CB 3.93Å; V699-N704 HydrophobicContact CG2-CB 4.47Å; N701-N704 WeakPolarHBondContact O-CB 3.39Å; N701-N704 PolarHBondContact O-N 3.43Å; V702-N704 PolarHBondContact O-N 3.21Å; V702-N704 VanDerWaalsContact O-N 3.15Å; N704-L708 VanDerWaalsContact O-CB 3.28Å; N704-L708 WeakPolarHBondContact O-CB 3.27Å; N704-L708 WeakPolarHBondContact O-CD1 3.41Å; N704-L708 WeakPolarHBondContact O-CG 3.47Å; N704-L708 PolarHBondContact O-N 2.92Å
705	V	89.6	Confident	88.6	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-59.7	-51.2	170.4	179.9	0	0	0	0	110	L489 L498 V612 M696 V699 N701 V702 R707 L708 H709	L489-V705 HydrophobicContact CD1-CG2 3.53Å; L498-V705 HydrophobicContact CD2-CG1 4.21Å; V612-V705 HydrophobicContact CG1-CG1 4.03Å; V612-V705 HydrophobicContact CG2-CG1 4.37Å; M696-V705 HydrophobicContact CE-CB 4.48Å; M696-V705 HydrophobicContact CE-CG1 3.65Å; M696-V705 HydrophobicContact CE-CG2 4.07Å; M696-V705 HydrophobicContact SD-CB 4.45Å; M696-V705 HydrophobicContact SD-CG1 4.02Å; M696-V705 HydrophobicContact SD-CG2 4.04Å; V699-V705 HydrophobicContact CB-CG2 4.48Å; V699-V705 HydrophobicContact CG1-CG2 3.68Å; N701-V705 PolarHBondContact O-N 3.3Å; V702-V705 WeakPolarHBondContact O-CB 3.44Å; V702-V705 PolarHBondContact O-N 3.15Å; V705-R707 PolarHBondContact O-N 3.09Å; V705-L708 PolarHBondContact O-N 2.84Å; V705-H709 VanDerWaalsContact O-CB 3.27Å; V705-H709 WeakPolarHBondContact O-CB 3.42Å; V705-H709 PolarHBondContact O-N 2.9Å
706	L	87.3	Confident	88.5	Confident	45 Å²	45	50.4 Å²	50.4	24%	0.236	25%	0.252	C	S	.	.	H	α-helix	trans	-59.1	-46.8	-178.8	-66.3	172.3	0	0	0	111.6	L611 V612 V702 H709 Q710	L611-L706 WeakPolarHBondContact O-CD2 3.44Å; V612-L706 HydrophobicContact CB-CD2 4.21Å; V612-L706 HydrophobicContact CG1-CD2 4.32Å; V612-L706 HydrophobicContact CG2-CD2 3.92Å; V702-L706 HydrophobicContact CG1-CD1 4.43Å; V702-L706 PolarHBondContact O-N 3.26Å; L706-H709 PolarHBondContact O-N 3.41Å; L706-Q710 WeakPolarHBondContact O-CB 3.47Å; L706-Q710 VanDerWaalsContact O-CG 3.28Å; L706-Q710 WeakPolarHBondContact O-CG 3.41Å; L706-Q710 PolarHBondContact O-N 3.47Å
707	R	89.6	Confident	88.4	Confident	143 Å²	143	50.2 Å²	50.2	54%	0.54	25%	0.251	S	S	.	.	H	α-helix	trans	-62.6	-50.2	176.6	-73.2	170	-179.4	169.2	0.9	112.4	D703 V705 H709 Q710 D711	D703-R707 WeakPolarHBondContact O-CB 3.23Å; D703-R707 VanDerWaalsContact O-CG 3.28Å; D703-R707 WeakPolarHBondContact O-CG 3.42Å; D703-R707 PolarHBondContact O-N 3.44Å; D703-R707 VanDerWaalsContact O-N 3.08Å; V705-R707 PolarHBondContact O-N 3.09Å; R707-H709 PolarHBondContact O-N 3.31Å; R707-Q710 PolarHBondContact O-N 3.19Å; R707-D711 WeakPolarHBondContact O-CB 3.34Å; R707-D711 PolarHBondContact O-N 2.85Å
708	L	92	Very high	88.2	Confident	29 Å²	29	45.4 Å²	45.4	15%	0.152	23%	0.23	C	C	.	.	H	α-helix	trans	-61.8	-33.5	-179.5	-71.8	172.3	0	0	0	112.7	F692 K695 V699 N704 V705 F712	F692-L708 HydrophobicContact CD2-CB 4.16Å; F692-L708 WeakPolarHBondContact CD2-O 3.28Å; F692-L708 HydrophobicContact CE2-CB 4.15Å; K695-L708 HydrophobicContact CB-CD1 3.84Å; K695-L708 HydrophobicContact CB-CD2 3.98Å; K695-L708 HydrophobicContact CD-CD2 3.55Å; K695-L708 HydrophobicContact CG-CD2 4.39Å; V699-L708 HydrophobicContact CG2-CD1 3.58Å; N704-L708 VanDerWaalsContact O-CB 3.28Å; N704-L708 WeakPolarHBondContact O-CB 3.27Å; N704-L708 WeakPolarHBondContact O-CD1 3.41Å; N704-L708 WeakPolarHBondContact O-CG 3.47Å; N704-L708 PolarHBondContact O-N 2.92Å; V705-L708 PolarHBondContact O-N 2.84Å; L708-F712 VanDerWaalsContact O-CB 3.29Å; L708-F712 WeakPolarHBondContact O-CB 3.26Å; L708-F712 PolarHBondContact O-N 3.3Å
709	H	92.4	Very high	88	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.009	20%	0.204	C	C	.	.	H	α-helix	trans	-73	-41.4	176.8	-179.8	-120.2	0	0	0	112.3	V612 L613 S617 Y621 F692 V705 L706 R707 F712 L713	V612-H709 PolarHBondContact O-CE1 3.01Å; V612-H709 VanDerWaalsContact O-CE1 3.25Å; L613-H709 VanDerWaalsContact CD2-CE1 3.46Å; L613-H709 WeakPolarHBondContact CD2-CE1 3.42Å; S617-H709 WeakPolarHBondContact CB-CE1 3.26Å; S617-H709 PolarHBondContact OG-CE1 2.95Å; Y621-H709 AromaticContact CE2-CE1 3.91Å; Y621-H709 AromaticContact CE2-NE2 2.71Å; Y621-H709 WeakPolarHBondContact CE2-NE2 3.47Å; Y621-H709 AromaticContact CZ-NE2 2.73Å; Y621-H709 PolarHBondContact OH-NE2 3.42Å; F692-H709 HydrophobicContact CE2-CB 3.99Å; F692-H709 HydrophobicContact CZ-CB 4.33Å; V705-H709 VanDerWaalsContact O-CB 3.27Å; V705-H709 WeakPolarHBondContact O-CB 3.42Å; V705-H709 PolarHBondContact O-N 2.9Å; L706-H709 PolarHBondContact O-N 3.41Å; R707-H709 PolarHBondContact O-N 3.31Å; H709-F712 PolarHBondContact O-N 2.62Å; H709-L713 WeakPolarHBondContact O-CB 3.49Å; H709-L713 PolarHBondContact O-N 3.45Å
710	Q	90.4	Very high	87.7	Confident	86 Å²	86	40.5 Å²	40.5	40%	0.402	20%	0.199	S	C	.	.	H	α-helix	trans	-64.5	-47.3	172.1	-71.5	174.1	2.5	0	0	111.8	L706 R707 F712 L713 D714	L706-Q710 WeakPolarHBondContact O-CB 3.47Å; L706-Q710 VanDerWaalsContact O-CG 3.28Å; L706-Q710 WeakPolarHBondContact O-CG 3.41Å; L706-Q710 PolarHBondContact O-N 3.47Å; R707-Q710 PolarHBondContact O-N 3.19Å; Q710-F712 VanDerWaalsContact C-N 3.3Å; Q710-F712 PolarHBondContact O-N 3.4Å; Q710-L713 PolarHBondContact O-N 3.2Å; Q710-D714 PolarHBondContact O-N 2.92Å
711	D	91.4	Very high	87.5	Confident	95 Å²	95	34.6 Å²	34.6	51%	0.508	17%	0.171	S	C	.	.	H	α-helix	trans	-55.9	-44.1	175.5	-72.5	-22.3	0	0	0	111.3	R707 S715	R707-D711 WeakPolarHBondContact O-CB 3.34Å; R707-D711 PolarHBondContact O-N 2.85Å; D711-S715 WeakPolarHBondContact O-CB 3.35Å; D711-S715 PolarHBondContact O-N 3.17Å; D711-S715 PolarHBondContact O-OG 3.13Å
712	F	92.9	Very high	87	Confident	8 Å²	8	34 Å²	34	4%	0.035	17%	0.168	C	C	.	.	H	α-helix	trans	-61.7	-49.9	175.5	163.6	-97.4	0	0	0	111.8	L510 Y621 N688 W689 F692 L708 H709 Q710 S715 C716	L510-F712 HydrophobicContact CD1-CZ 4.1Å; Y621-F712 HydrophobicContact CE1-CE1 4.06Å; N688-F712 HydrophobicContact CB-CD2 3.96Å; N688-F712 HydrophobicContact CB-CE2 4.03Å; W689-F712 HydrophobicContact CB-CE2 4.09Å; W689-F712 HydrophobicContact CE3-CE1 4.25Å; W689-F712 HydrophobicContact CE3-CE2 4.06Å; W689-F712 AromaticContact CE3-CZ 3.79Å; W689-F712 HydrophobicContact CE3-CZ 3.79Å; W689-F712 HydrophobicContact CZ3-CZ 4.45Å; F692-F712 HydrophobicContact CB-CB 4.21Å; F692-F712 HydrophobicContact CB-CD2 4Å; F692-F712 HydrophobicContact CB-CG 4.23Å; F692-F712 HydrophobicContact CD2-CB 4.06Å; F692-F712 HydrophobicContact CG-CB 4.21Å; F692-F712 HydrophobicContact CG-CD2 4.47Å; F692-F712 HydrophobicContact CG-CG 4.27Å; L708-F712 VanDerWaalsContact O-CB 3.29Å; L708-F712 WeakPolarHBondContact O-CB 3.26Å; L708-F712 PolarHBondContact O-N 3.3Å; H709-F712 PolarHBondContact O-N 2.62Å; Q710-F712 VanDerWaalsContact C-N 3.3Å; Q710-F712 PolarHBondContact O-N 3.4Å; F712-S715 PolarHBondContact O-N 2.99Å; F712-C716 VanDerWaalsContact CE2-SG 3.52Å; F712-C716 PolarHBondContact O-N 3.3Å; F712-C716 PolarHBondContact O-SG 3.24Å
713	L	91.5	Very high	86	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.9	-47.4	-179	-87.5	171.9	0	0	0	112.1	K620 Y621 L624 H709 Q710 C716 L717	K620-L713 HydrophobicContact CB-CD1 4.32Å; K620-L713 HydrophobicContact CB-CD2 4.07Å; K620-L713 HydrophobicContact CD-CB 4.13Å; K620-L713 HydrophobicContact CD-CD1 4.22Å; Y621-L713 HydrophobicContact CD1-CD2 3.78Å; Y621-L713 HydrophobicContact CD2-CD1 4.43Å; Y621-L713 HydrophobicContact CD2-CD2 4.06Å; Y621-L713 HydrophobicContact CE1-CD2 3.63Å; Y621-L713 HydrophobicContact CE1-CG 4.49Å; Y621-L713 HydrophobicContact CE2-CD1 3.97Å; Y621-L713 HydrophobicContact CE2-CD2 3.91Å; Y621-L713 HydrophobicContact CE2-CG 4.3Å; Y621-L713 HydrophobicContact CG-CD2 3.98Å; L624-L713 HydrophobicContact CD1-CD2 4.39Å; H709-L713 WeakPolarHBondContact O-CB 3.49Å; H709-L713 PolarHBondContact O-N 3.45Å; Q710-L713 PolarHBondContact O-N 3.2Å; L713-C716 PolarHBondContact O-N 3.5Å; L713-L717 WeakPolarHBondContact O-CG 3.34Å; L713-L717 PolarHBondContact O-N 3.13Å
714	D	88.9	Confident	84.8	Confident	68 Å²	68	40.4 Å²	40.4	36%	0.364	20%	0.201	S	C	.	.	H	α-helix	trans	-73	-30.1	-177.6	-70.4	-33.8	0	0	0	112.3	K620 Q710 K718	K620-D714 WeakPolarHBondContact CE-OD1 3.3Å; K620-D714 IonicContact NZ-OD1 3.51Å; K620-D714 PolarHBondContact NZ-OD1 2.81Å; K620-D714 IonicContact NZ-OD2 2.65Å; K620-D714 PolarHBondContact NZ-OD2 3.22Å; Q710-D714 PolarHBondContact O-N 2.92Å; D714-K718 VanDerWaalsContact O-CB 3.29Å; D714-K718 WeakPolarHBondContact O-CB 3.22Å; D714-K718 PolarHBondContact O-N 2.97Å
715	S	88.4	Confident	83.3	Confident	46 Å²	46	39 Å²	39	32%	0.322	20%	0.196	S	C	.	.	H	α-helix	trans	-63.7	-43.9	167.3	-61.6	0	0	0	0	111.8	D711 F712 N719	D711-S715 WeakPolarHBondContact O-CB 3.35Å; D711-S715 PolarHBondContact O-N 3.17Å; D711-S715 PolarHBondContact O-OG 3.13Å; F712-S715 PolarHBondContact O-N 2.99Å; S715-N719 VanDerWaalsContact O-CB 3.29Å; S715-N719 WeakPolarHBondContact O-CB 3.48Å; S715-N719 VanDerWaalsContact O-CG 3.24Å; S715-N719 PolarHBondContact O-N 3.44Å; S715-N719 PolarHBondContact O-ND2 3.25Å
716	C	89.3	Confident	82	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.7	-47.8	176.2	-69.4	0	0	0	0	111.6	L624 F712 L713 K718 N719 C720	L624-C716 HydrophobicContact CD1-CB 3.95Å; L624-C716 HydrophobicContact CD2-CB 4.38Å; F712-C716 VanDerWaalsContact CE2-SG 3.52Å; F712-C716 PolarHBondContact O-N 3.3Å; F712-C716 PolarHBondContact O-SG 3.24Å; L713-C716 PolarHBondContact O-N 3.5Å; C716-K718 PolarHBondContact O-N 2.88Å; C716-N719 PolarHBondContact O-N 3.42Å; C716-C720 VanDerWaalsContact O-CB 3.23Å; C716-C720 WeakPolarHBondContact O-CB 3.33Å; C716-C720 PolarHBondContact O-N 3.05Å; C716-C720 PolarHBondContact O-SG 2.66Å; C716-C720 VanDerWaalsContact O-SG 3.38Å
717	L	86.9	Confident	81.1	Confident	8 Å²	8	46.1 Å²	46.1	4%	0.042	24%	0.235	C	C	.	.	H	α-helix	trans	-59.9	-44.5	178	-71.8	174.1	0	0	0	112.7	K620 M623 L624 L713 L722 T723	K620-L717 HydrophobicContact CB-CD1 3.95Å; K620-L717 HydrophobicContact CD-CD1 3.81Å; K620-L717 HydrophobicContact CG-CD1 3.75Å; M623-L717 HydrophobicContact CB-CD2 4.23Å; M623-L717 HydrophobicContact CE-CD2 4.16Å; L624-L717 HydrophobicContact CD1-CD2 4.4Å; L624-L717 HydrophobicContact CD2-CD2 4.01Å; L624-L717 HydrophobicContact CG-CD2 3.84Å; L713-L717 WeakPolarHBondContact O-CG 3.34Å; L713-L717 PolarHBondContact O-N 3.13Å; L717-L722 HydrophobicContact CD2-CB 4.4Å; L717-L722 HydrophobicContact CD2-CD1 3.78Å; L717-L722 WeakPolarHBondContact O-CB 3.42Å; L717-L722 PolarHBondContact O-N 3.48Å; L717-T723 VanDerWaalsContact C-OG1 3.25Å; L717-T723 WeakPolarHBondContact CB-OG1 3.48Å; L717-T723 PolarHBondContact O-N 2.94Å; L717-T723 PolarHBondContact O-OG1 2.93Å
718	K	83.5	Confident	80.4	Confident	67 Å²	67	39.5 Å²	39.5	29%	0.291	21%	0.21	S	C	.	.	H	α-helix	trans	-65.3	-46.6	179.2	176.3	163.8	169.4	158	0	111.2	D714 C716 M721 T723 E724 N787	D714-K718 VanDerWaalsContact O-CB 3.29Å; D714-K718 WeakPolarHBondContact O-CB 3.22Å; D714-K718 PolarHBondContact O-N 2.97Å; C716-K718 PolarHBondContact O-N 2.88Å; K718-M721 PolarHBondContact O-N 3.21Å; K718-T723 WeakPolarHBondContact CA-OG1 3.48Å; K718-T723 PolarHBondContact N-OG1 3.31Å; K718-E724 VanDerWaalsContact CE-CD 3.49Å; K718-E724 WeakPolarHBondContact CE-OE1 3.46Å; K718-E724 WeakPolarHBondContact CE-OE2 3.34Å; K718-E724 IonicContact NZ-OE1 2.68Å; K718-E724 PolarHBondContact NZ-OE1 3.08Å; K718-E724 IonicContact NZ-OE2 3.68Å; K718-E724 PolarHBondContact NZ-OE2 3.24Å; K718-E724 VanDerWaalsContact NZ-OE2 3.13Å; K718-N787 PolarHBondContact NZ-OD1 3.08Å
719	N	82.2	Confident	79.8	Confident	28 Å²	28	38.1 Å²	38.1	15%	0.15	20%	0.203	C	C	.	.	H	α-helix	trans	-74.2	-34.4	-176.2	-65.9	-33.6	0	0	0	112.7	I684 S715 C716 M721	I684-N719 HydrophobicContact CB-CB 4.43Å; I684-N719 VanDerWaalsContact CD1-C 3.43Å; I684-N719 HydrophobicContact CD1-CB 3.84Å; I684-N719 VanDerWaalsContact CD1-O 3.29Å; I684-N719 WeakPolarHBondContact CD1-O 3.44Å; I684-N719 HydrophobicContact CG1-CB 3.89Å; I684-N719 HydrophobicContact CG2-CB 3.66Å; S715-N719 VanDerWaalsContact O-CB 3.29Å; S715-N719 WeakPolarHBondContact O-CB 3.48Å; S715-N719 VanDerWaalsContact O-CG 3.24Å; S715-N719 PolarHBondContact O-N 3.44Å; S715-N719 PolarHBondContact O-ND2 3.25Å; C716-N719 PolarHBondContact O-N 3.42Å; N719-M721 PolarHBondContact O-N 3.4Å
720	C	81.3	Confident	79.2	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.014	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	10.4	171.3	-69.9	0	0	0	0	114.3	L624 Q627 C716 L722	L624-C720 HydrophobicContact CD2-CB 3.94Å; Q627-C720 PolarHBondContact NE2-O 3.15Å; Q627-C720 PolarHBondContact OE1-O 3.11Å; C716-C720 VanDerWaalsContact O-CB 3.23Å; C716-C720 WeakPolarHBondContact O-CB 3.33Å; C716-C720 PolarHBondContact O-N 3.05Å; C716-C720 PolarHBondContact O-SG 2.66Å; C716-C720 VanDerWaalsContact O-SG 3.38Å; C720-L722 HydrophobicContact CB-CG 4.38Å
721	M	77.1	Confident	78.8	Confident	6 Å²	6	42.3 Å²	42.3	3%	0.03	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	26.9	175.8	-46.7	179.1	-177.4	0	0	115.2	Y679 K718 N719 L728 I732 F776 I780 F792 L795	Y679-M721 HydrophobicContact CE1-CE 3.9Å; K718-M721 PolarHBondContact O-N 3.21Å; N719-M721 PolarHBondContact O-N 3.4Å; M721-L728 HydrophobicContact CB-CB 4.1Å; M721-L728 HydrophobicContact CB-CD1 4.05Å; M721-L728 HydrophobicContact CG-CD1 4.02Å; M721-L728 HydrophobicContact SD-CB 4.26Å; M721-L728 HydrophobicContact SD-CD1 3.83Å; M721-L728 HydrophobicContact SD-CD2 4.49Å; M721-L728 HydrophobicContact SD-CG 4.45Å; M721-I732 HydrophobicContact SD-CD1 4Å; M721-F776 HydrophobicContact CE-CZ 4.4Å; M721-F776 HydrophobicContact SD-CE2 4.04Å; M721-F776 HydrophobicContact SD-CZ 4.17Å; M721-I780 HydrophobicContact CE-CD1 4.06Å; M721-I780 HydrophobicContact CE-CG1 4.07Å; M721-F792 HydrophobicContact CE-CD1 4.17Å; M721-F792 HydrophobicContact CE-CE1 4.2Å; M721-F792 HydrophobicContact CG-CE1 4.09Å; M721-L795 HydrophobicContact CE-CD2 3.26Å
722	L	74.3	Confident	78.6	Confident	4 Å²	4	38 Å²	38	2%	0.021	19%	0.194	C	C	.	.			trans	-95.3	-39.9	-176.5	-55.9	-176.1	0	0	0	113.1	M575 M623 L624 L717 C720 N729	M575-L722 HydrophobicContact CE-CB 3.94Å; M575-L722 HydrophobicContact CE-CD1 3.95Å; M575-L722 HydrophobicContact CE-CD2 3.38Å; M575-L722 HydrophobicContact CE-CG 3.92Å; M575-L722 HydrophobicContact SD-CB 3.91Å; M575-L722 HydrophobicContact SD-CD2 4.17Å; M623-L722 HydrophobicContact CB-CD1 4.4Å; L624-L722 HydrophobicContact CD2-CD1 3.99Å; L717-L722 HydrophobicContact CD2-CB 4.4Å; L717-L722 HydrophobicContact CD2-CD1 3.78Å; L717-L722 WeakPolarHBondContact O-CB 3.42Å; L717-L722 PolarHBondContact O-N 3.48Å; C720-L722 HydrophobicContact CB-CG 4.38Å; L722-N729 HydrophobicContact CD2-CB 4.33Å; L722-N729 WeakPolarHBondContact CD2-ND2 3.31Å
723	T	65.9	Low	78.2	Confident	53 Å²	53	39.5 Å²	39.5	33%	0.325	20%	0.201	S	C	.	.	S	Bend	trans	-80.3	-38.5	-169.3	-39.6	0	0	0	0	115.3	M579 L717 K718	M579-T723 WeakPolarHBondContact CE-O 3.35Å; L717-T723 VanDerWaalsContact C-OG1 3.25Å; L717-T723 WeakPolarHBondContact CB-OG1 3.48Å; L717-T723 PolarHBondContact O-N 2.94Å; L717-T723 PolarHBondContact O-OG1 2.93Å; K718-T723 WeakPolarHBondContact CA-OG1 3.48Å; K718-T723 PolarHBondContact N-OG1 3.31Å
724	E	57.2	Low	78	Confident	95 Å²	95	44.4 Å²	44.4	44%	0.444	22%	0.222	S	C	.	.	S	Bend	trans	-105.5	-6.4	-166.9	-82.1	179.8	171.6	0	0	115.4	K718 M783 N787	K718-E724 VanDerWaalsContact CE-CD 3.49Å; K718-E724 WeakPolarHBondContact CE-OE1 3.46Å; K718-E724 WeakPolarHBondContact CE-OE2 3.34Å; K718-E724 IonicContact NZ-OE1 2.68Å; K718-E724 PolarHBondContact NZ-OE1 3.08Å; K718-E724 IonicContact NZ-OE2 3.68Å; K718-E724 PolarHBondContact NZ-OE2 3.24Å; K718-E724 VanDerWaalsContact NZ-OE2 3.13Å; E724-M783 HydrophobicContact CB-CE 4.4Å; E724-N787 PolarHBondContact OE2-ND2 3.2Å
725	S	57.4	Low	78	Confident	32 Å²	32	41.8 Å²	41.8	22%	0.224	21%	0.208	C	C	.	.			trans	-161.3	98.2	177.8	-85	0	0	0	0	113.6	H727 L728	S725-H727 PolarHBondContact O-N 3.07Å; S725-L728 PolarHBondContact O-N 3.5Å
726	S	61.5	Low	78	Confident	67 Å²	67	39.7 Å²	39.7	47%	0.469	19%	0.193	S	C	.	.	H	α-helix	trans	-54.1	-24.5	167.4	58.8	0	0	0	0	113	R730	S726-R730 WeakPolarHBondContact O-CB 3.48Å; S726-R730 PolarHBondContact O-N 3.23Å
727	H	68.9	Low	78	Confident	130 Å²	130	44.4 Å²	44.4	60%	0.602	21%	0.214	S	C	*	.	H	α-helix	trans	-61.6	-42.2	171.8	-60.7	-78.4	0	0	0	113.6	S725 R730 S731	S725-H727 PolarHBondContact O-N 3.07Å; H727-R730 PolarHBondContact O-N 3.3Å; H727-S731 PolarHBondContact O-N 2.91Å; H727-S731 PolarHBondContact O-OG 3.3Å; H727-S731 VanDerWaalsContact O-OG 3.08Å
728	L	75.6	Confident	78.1	Confident	3 Å²	3	45 Å²	45	2%	0.016	22%	0.217	C	C	.	.	H	α-helix	trans	-68.9	-49.4	179.2	-82	-178.6	0	0	0	111.1	M721 S725 R730 S731 I732 F776 Q779 I780 M783	M721-L728 HydrophobicContact CB-CB 4.1Å; M721-L728 HydrophobicContact CB-CD1 4.05Å; M721-L728 HydrophobicContact CG-CD1 4.02Å; M721-L728 HydrophobicContact SD-CB 4.26Å; M721-L728 HydrophobicContact SD-CD1 3.83Å; M721-L728 HydrophobicContact SD-CD2 4.49Å; M721-L728 HydrophobicContact SD-CG 4.45Å; S725-L728 PolarHBondContact O-N 3.5Å; L728-R730 VanDerWaalsContact C-N 3.28Å; L728-R730 PolarHBondContact O-N 2.94Å; L728-S731 WeakPolarHBondContact O-CA 3.5Å; L728-S731 WeakPolarHBondContact O-CB 3.35Å; L728-S731 PolarHBondContact O-N 3.12Å; L728-I732 PolarHBondContact O-N 3.24Å; L728-F776 HydrophobicContact CD2-CD2 3.97Å; L728-F776 HydrophobicContact CD2-CE2 4.01Å; L728-Q779 HydrophobicContact CD2-CB 3.61Å; L728-I780 HydrophobicContact CD2-CG1 3.95Å; L728-M783 HydrophobicContact CD1-CE 3.89Å; L728-M783 HydrophobicContact CD1-SD 3.32Å; L728-M783 WeakPolarHBondContact CD1-SD 3.46Å; L728-M783 HydrophobicContact CG-SD 3.99Å
729	N	78.3	Confident	78.4	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-56.4	-43.5	175.2	178.4	-91.7	0	0	0	111.2	L722 S731 I732 F733	L722-N729 HydrophobicContact CD2-CB 4.33Å; L722-N729 WeakPolarHBondContact CD2-ND2 3.31Å; N729-S731 VanDerWaalsContact C-N 3.34Å; N729-S731 PolarHBondContact O-N 3.32Å; N729-I732 WeakPolarHBondContact O-CB 3.35Å; N729-I732 PolarHBondContact O-N 3.33Å; N729-F733 WeakPolarHBondContact O-CD2 2.91Å; N729-F733 PolarHBondContact O-N 3.19Å; N729-F733 WeakPolarHBondContact OD1-CD2 3.42Å; N729-F733 VanDerWaalsContact OD1-CE2 3.3Å; N729-F733 WeakPolarHBondContact OD1-CE2 3.17Å
730	R	80.1	Confident	78.7	Confident	163 Å²	163	41.6 Å²	41.6	62%	0.615	20%	0.202	S	C	*	.	H	α-helix	trans	-65.1	-32.1	174.4	-168.1	175.1	-173.2	-170.8	3	113.4	S726 H727 L728 K734	S726-R730 WeakPolarHBondContact O-CB 3.48Å; S726-R730 PolarHBondContact O-N 3.23Å; H727-R730 PolarHBondContact O-N 3.3Å; L728-R730 VanDerWaalsContact C-N 3.28Å; L728-R730 PolarHBondContact O-N 2.94Å; R730-K734 VanDerWaalsContact O-CG 3.29Å; R730-K734 WeakPolarHBondContact O-CG 3.26Å; R730-K734 PolarHBondContact O-N 3.31Å
731	S	82.8	Confident	79	Confident	13 Å²	13	47 Å²	47	9%	0.091	23%	0.225	C	C	.	.	H	α-helix	trans	-67.9	-40.1	172	-68.9	0	0	0	0	111.9	H727 L728 N729 K734 L735 Q779	H727-S731 PolarHBondContact O-N 2.91Å; H727-S731 PolarHBondContact O-OG 3.3Å; H727-S731 VanDerWaalsContact O-OG 3.08Å; L728-S731 WeakPolarHBondContact O-CA 3.5Å; L728-S731 WeakPolarHBondContact O-CB 3.35Å; L728-S731 PolarHBondContact O-N 3.12Å; N729-S731 VanDerWaalsContact C-N 3.34Å; N729-S731 PolarHBondContact O-N 3.32Å; S731-K734 PolarHBondContact O-N 3.34Å; S731-L735 WeakPolarHBondContact O-CG 3.36Å; S731-L735 PolarHBondContact O-N 3.23Å; S731-Q779 PolarHBondContact OG-NE2 3.47Å; S731-Q779 PolarHBondContact OG-OE1 3.41Å
732	I	85.9	Confident	79.6	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.015	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-48.8	173.3	-65.7	169.4	0	0	0	110.7	L676 M721 L728 N729 K734 L735 C736 F776	L676-I732 HydrophobicContact CD1-CD1 4.31Å; L676-I732 HydrophobicContact CD2-CB 4.48Å; L676-I732 HydrophobicContact CD2-CD1 4.16Å; L676-I732 HydrophobicContact CD2-CG1 3.97Å; L676-I732 HydrophobicContact CD2-CG2 3.78Å; M721-I732 HydrophobicContact SD-CD1 4Å; L728-I732 PolarHBondContact O-N 3.24Å; N729-I732 WeakPolarHBondContact O-CB 3.35Å; N729-I732 PolarHBondContact O-N 3.33Å; I732-K734 VanDerWaalsContact C-N 3.33Å; I732-K734 PolarHBondContact O-N 3.02Å; I732-L735 PolarHBondContact O-N 3.44Å; I732-C736 WeakPolarHBondContact O-CB 3.35Å; I732-C736 PolarHBondContact O-N 3.28Å; I732-C736 PolarHBondContact O-SG 3.07Å; I732-F776 HydrophobicContact CD1-CE2 3.99Å; I732-F776 HydrophobicContact CD1-CZ 4.01Å; I732-F776 HydrophobicContact CG1-CD2 4.39Å; I732-F776 HydrophobicContact CG1-CE2 3.49Å; I732-F776 VanDerWaalsContact CG1-CE2 3.49Å; I732-F776 HydrophobicContact CG1-CZ 3.62Å
733	F	84.8	Confident	80.1	Confident	40 Å²	40	46.9 Å²	46.9	18%	0.175	22%	0.224	C	C	.	.	H	α-helix	trans	-58.6	-42	176	-88.1	-72.7	0	0	0	112.4	L571 Y630 N729 C736 K737	L571-F733 HydrophobicContact CB-CE2 4.15Å; L571-F733 HydrophobicContact CB-CZ 3.95Å; L571-F733 HydrophobicContact CD2-CE2 3.89Å; L571-F733 HydrophobicContact CD2-CZ 3.83Å; L571-F733 HydrophobicContact CG-CE2 4.4Å; L571-F733 HydrophobicContact CG-CZ 4.44Å; Y630-F733 AromaticContact CD1-CD1 3.58Å; Y630-F733 HydrophobicContact CD1-CD1 3.58Å; Y630-F733 AromaticContact CD1-CE1 3.43Å; Y630-F733 HydrophobicContact CD1-CE1 3.43Å; Y630-F733 VanDerWaalsContact CD1-CE1 3.43Å; Y630-F733 HydrophobicContact CD1-CZ 4.4Å; Y630-F733 AromaticContact CE1-CD1 3.3Å; Y630-F733 HydrophobicContact CE1-CD1 3.3Å; Y630-F733 AromaticContact CE1-CE1 3.62Å; Y630-F733 HydrophobicContact CE1-CE1 3.62Å; Y630-F733 HydrophobicContact CE1-CG 4.35Å; Y630-F733 HydrophobicContact CG-CD1 4.45Å; Y630-F733 AromaticContact CG-CE1 3.92Å; Y630-F733 HydrophobicContact CG-CE1 3.92Å; N729-F733 WeakPolarHBondContact O-CD2 2.91Å; N729-F733 PolarHBondContact O-N 3.19Å; N729-F733 WeakPolarHBondContact OD1-CD2 3.42Å; N729-F733 VanDerWaalsContact OD1-CE2 3.3Å; N729-F733 WeakPolarHBondContact OD1-CE2 3.17Å; F733-C736 PolarHBondContact O-N 3.02Å; F733-K737 VanDerWaalsContact O-CB 3.28Å; F733-K737 WeakPolarHBondContact O-CB 3.35Å; F733-K737 PolarHBondContact O-N 2.91Å
734	K	87.1	Confident	81	Confident	104 Å²	104	49.3 Å²	49.3	45%	0.452	23%	0.232	S	C	.	.	H	α-helix	trans	-61.5	-46.1	175	-76.7	175.4	172.8	-171.5	0	112.4	R730 S731 I732 K737 I738 L772	R730-K734 VanDerWaalsContact O-CG 3.29Å; R730-K734 WeakPolarHBondContact O-CG 3.26Å; R730-K734 PolarHBondContact O-N 3.31Å; S731-K734 PolarHBondContact O-N 3.34Å; I732-K734 VanDerWaalsContact C-N 3.33Å; I732-K734 PolarHBondContact O-N 3.02Å; K734-K737 PolarHBondContact O-N 3.15Å; K734-I738 PolarHBondContact O-N 2.75Å; K734-L772 HydrophobicContact CB-CD1 3.76Å; K734-L772 HydrophobicContact CB-CD2 4.39Å; K734-L772 HydrophobicContact CD-CD2 4.21Å
735	L	88.9	Confident	82.2	Confident	13 Å²	13	46 Å²	46	7%	0.068	22%	0.216	C	C	.	.	H	α-helix	trans	-58.3	-49.3	177.4	-80.7	165.5	0	0	0	111.3	S731 I732 K737 I738 C739 F769 L772 L773 F776	S731-L735 WeakPolarHBondContact O-CG 3.36Å; S731-L735 PolarHBondContact O-N 3.23Å; I732-L735 PolarHBondContact O-N 3.44Å; L735-K737 PolarHBondContact O-N 3.22Å; L735-I738 PolarHBondContact O-N 3.06Å; L735-C739 PolarHBondContact O-N 3.13Å; L735-C739 PolarHBondContact O-SG 3.37Å; L735-F769 HydrophobicContact CD2-CD2 3.98Å; L735-F769 HydrophobicContact CD2-CE2 3.86Å; L735-L772 HydrophobicContact CD2-CB 3.57Å; L735-L772 HydrophobicContact CD2-CD1 4.37Å; L735-L772 HydrophobicContact CG-CB 4.06Å; L735-L772 HydrophobicContact CG-CD1 4.46Å; L735-L773 HydrophobicContact CD2-CB 4.24Å; L735-F776 HydrophobicContact CD1-CB 3.99Å; L735-F776 HydrophobicContact CD1-CD1 3.82Å; L735-F776 HydrophobicContact CD1-CE1 4.41Å; L735-F776 HydrophobicContact CD1-CG 3.93Å
736	C	89.1	Confident	83.2	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.007	21%	0.213	C	C	.	.	H	α-helix	trans	-60.8	-42.5	177.1	-66.6	0	0	0	0	112	Y630 V634 I732 F733 I738 C739 L740	Y630-C736 HydrophobicContact CD1-CB 4.03Å; Y630-C736 HydrophobicContact CE1-CB 3.36Å; V634-C736 HydrophobicContact CG2-CB 3.94Å; I732-C736 WeakPolarHBondContact O-CB 3.35Å; I732-C736 PolarHBondContact O-N 3.28Å; I732-C736 PolarHBondContact O-SG 3.07Å; F733-C736 PolarHBondContact O-N 3.02Å; C736-I738 PolarHBondContact O-N 3.2Å; C736-C739 WeakPolarHBondContact O-CB 3.39Å; C736-C739 PolarHBondContact O-N 3.43Å; C736-C739 VanDerWaalsContact O-N 3.15Å; C736-L740 PolarHBondContact O-N 3.06Å
737	K	88.6	Confident	83.9	Confident	100 Å²	100	46.1 Å²	46.1	44%	0.435	21%	0.206	S	C	.	.	H	α-helix	trans	-69.9	-30	179.5	-159.7	151.7	-164.4	151.7	0	113.4	E597 F733 K734 L735 K741	E597-K737 IonicContact OE1-NZ 2.78Å; E597-K737 PolarHBondContact OE1-NZ 3.33Å; E597-K737 IonicContact OE2-NZ 2.76Å; F733-K737 VanDerWaalsContact O-CB 3.28Å; F733-K737 WeakPolarHBondContact O-CB 3.35Å; F733-K737 PolarHBondContact O-N 2.91Å; K734-K737 PolarHBondContact O-N 3.15Å; L735-K737 PolarHBondContact O-N 3.22Å; K737-K741 WeakPolarHBondContact O-CG 3.31Å; K737-K741 PolarHBondContact O-N 3.38Å; K737-K741 VanDerWaalsContact O-N 3.07Å
738	I	89.9	Confident	83.7	Confident	20 Å²	20	44.9 Å²	44.9	10%	0.103	20%	0.203	C	C	.	.	H	α-helix	trans	-69.2	-40.4	168	-68.9	-160.7	0	0	0	111	M669 K734 L735 C736 L740 K741 Y742 F765 E768 F769 L772	M669-I738 HydrophobicContact CE-CG2 4.1Å; K734-I738 PolarHBondContact O-N 2.75Å; L735-I738 PolarHBondContact O-N 3.06Å; C736-I738 PolarHBondContact O-N 3.2Å; I738-L740 VanDerWaalsContact C-N 3.32Å; I738-L740 PolarHBondContact O-N 2.97Å; I738-K741 PolarHBondContact O-N 3.09Å; I738-Y742 WeakPolarHBondContact O-CB 3.46Å; I738-Y742 PolarHBondContact O-N 2.93Å; I738-F765 HydrophobicContact CG2-CD1 4.31Å; I738-E768 HydrophobicContact CD1-CB 3.77Å; I738-F769 HydrophobicContact CG2-CB 4.35Å; I738-L772 HydrophobicContact CD1-CD1 3.45Å; I738-L772 VanDerWaalsContact CD1-CD1 3.45Å; I738-L772 HydrophobicContact CD1-CG 4.18Å; I738-L772 HydrophobicContact CG1-CD1 3.91Å
739	C	90.2	Very high	82.7	Confident	0 Å²	0	54 Å²	54	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.5	-39.5	176.1	-63.4	0	0	0	0	111.7	V634 L638 M669 I673 L735 C736 Y742 C743	V634-C739 HydrophobicContact CG1-CB 3.51Å; L638-C739 HydrophobicContact CD1-CB 4.25Å; M669-C739 HydrophobicContact SD-CB 4.43Å; I673-C739 HydrophobicContact CD1-CB 4.09Å; L735-C739 PolarHBondContact O-N 3.13Å; L735-C739 PolarHBondContact O-SG 3.37Å; C736-C739 WeakPolarHBondContact O-CB 3.39Å; C736-C739 PolarHBondContact O-N 3.43Å; C736-C739 VanDerWaalsContact O-N 3.15Å; C739-Y742 PolarHBondContact O-N 3.26Å; C739-C743 PolarHBondContact O-N 2.92Å; C739-C743 PolarHBondContact O-SG 3.38Å
740	L	88.4	Confident	81.2	Confident	24 Å²	24	56.4 Å²	56.4	13%	0.126	26%	0.26	C	S	.	.	H	α-helix	trans	-66.3	-43.5	173.9	-71.4	175.2	0	0	0	113	Y630 V634 Q637 C736 I738 Y742 C743 E744	Y630-L740 HydrophobicContact CE2-CD1 4.09Å; V634-L740 HydrophobicContact CB-CD2 4.48Å; V634-L740 HydrophobicContact CG1-CD2 4.31Å; V634-L740 HydrophobicContact CG1-CG 4.29Å; V634-L740 HydrophobicContact CG2-CD1 3.94Å; V634-L740 HydrophobicContact CG2-CD2 3.96Å; V634-L740 HydrophobicContact CG2-CG 3.76Å; Q637-L740 HydrophobicContact CB-CD2 4.32Å; Q637-L740 HydrophobicContact CG-CD2 4.09Å; C736-L740 PolarHBondContact O-N 3.06Å; I738-L740 VanDerWaalsContact C-N 3.32Å; I738-L740 PolarHBondContact O-N 2.97Å; L740-Y742 VanDerWaalsContact C-N 3.29Å; L740-Y742 PolarHBondContact O-N 2.84Å; L740-C743 CarbonylContact O-C 3.35Å; L740-C743 WeakPolarHBondContact O-CA 3.45Å; L740-C743 VanDerWaalsContact O-CB 3.24Å; L740-C743 WeakPolarHBondContact O-CB 3.25Å; L740-C743 PolarHBondContact O-N 3.27Å; L740-E744 WeakPolarHBondContact O-CG 3.26Å; L740-E744 PolarHBondContact O-N 3.32Å
741	K	87.9	Confident	79.4	Confident	116 Å²	116	54.6 Å²	54.6	50%	0.504	27%	0.27	S	S	.	.	H	α-helix	trans	-60	-38.2	172.6	-76.5	-177.2	171.6	-165.9	0	113.3	K737 I738 C743 F745 F765	K737-K741 WeakPolarHBondContact O-CG 3.31Å; K737-K741 PolarHBondContact O-N 3.38Å; K737-K741 VanDerWaalsContact O-N 3.07Å; I738-K741 PolarHBondContact O-N 3.09Å; K741-C743 VanDerWaalsContact C-N 3.3Å; K741-F745 WeakPolarHBondContact O-CB 3.46Å; K741-F745 PolarHBondContact O-N 3.42Å; K741-F765 HydrophobicContact CB-CE1 3.94Å; K741-F765 HydrophobicContact CB-CZ 4.34Å
742	Y	87.9	Confident	77.9	Confident	3 Å²	3	57.6 Å²	57.6	1%	0.012	29%	0.285	C	S	.	.	H	α-helix	trans	-65.5	-35.9	171.8	171	-90.4	0	0	0	111.3	L638 A662 L665 R666 M669 I738 C739 L740 I746 F765	L638-Y742 HydrophobicContact CD2-CD1 4.27Å; A662-Y742 PolarHBondContact O-OH 3.48Å; L665-Y742 HydrophobicContact CD2-CD2 3.92Å; L665-Y742 HydrophobicContact CD2-CE2 3.89Å; L665-Y742 HydrophobicContact CG-CE2 4.41Å; R666-Y742 HydrophobicContact CB-CE1 3.89Å; R666-Y742 HydrophobicContact CG-CE1 4.11Å; M669-Y742 HydrophobicContact CE-CD2 4.46Å; M669-Y742 HydrophobicContact CE-CG 4.02Å; M669-Y742 HydrophobicContact SD-CD1 3.67Å; M669-Y742 HydrophobicContact SD-CD2 4.48Å; M669-Y742 HydrophobicContact SD-CE1 4.33Å; M669-Y742 HydrophobicContact SD-CG 3.78Å; I738-Y742 WeakPolarHBondContact O-CB 3.46Å; I738-Y742 PolarHBondContact O-N 2.93Å; C739-Y742 PolarHBondContact O-N 3.26Å; L740-Y742 VanDerWaalsContact C-N 3.29Å; L740-Y742 PolarHBondContact O-N 2.84Å; Y742-I746 HydrophobicContact CD2-CG1 4.35Å; Y742-I746 HydrophobicContact CE1-CG1 4.04Å; Y742-I746 HydrophobicContact CE2-CD1 4.14Å; Y742-I746 HydrophobicContact CE2-CG1 3.84Å; Y742-I746 VanDerWaalsContact O-CG1 3.27Å; Y742-I746 WeakPolarHBondContact O-CG1 3.3Å; Y742-I746 PolarHBondContact O-N 3.42Å; Y742-F765 HydrophobicContact CD2-CB 4.37Å; Y742-F765 HydrophobicContact CD2-CD2 4.22Å; Y742-F765 HydrophobicContact CD2-CG 4.35Å
743	C	85.8	Confident	75.9	Confident	3 Å²	3	61.8 Å²	61.8	2%	0.02	31%	0.307	C	S	.	.	H	α-helix	trans	-63.1	-53	174.1	-68	0	0	0	0	111.6	Q637 I641 C739 L740 K741 F745 I746 Q747	Q637-C743 HydrophobicContact CB-CB 4.46Å; I641-C743 HydrophobicContact CD1-CB 3.3Å; I641-C743 VanDerWaalsContact CD1-O 3.25Å; I641-C743 WeakPolarHBondContact CD1-O 3.47Å; C739-C743 PolarHBondContact O-N 2.92Å; C739-C743 PolarHBondContact O-SG 3.38Å; L740-C743 CarbonylContact O-C 3.35Å; L740-C743 WeakPolarHBondContact O-CA 3.45Å; L740-C743 VanDerWaalsContact O-CB 3.24Å; L740-C743 WeakPolarHBondContact O-CB 3.25Å; L740-C743 PolarHBondContact O-N 3.27Å; K741-C743 VanDerWaalsContact C-N 3.3Å; C743-F745 VanDerWaalsContact C-N 3.32Å; C743-F745 PolarHBondContact O-N 2.82Å; C743-I746 PolarHBondContact O-N 2.87Å; C743-I746 VanDerWaalsContact O-N 3.07Å; C743-Q747 PolarHBondContact O-N 3.09Å
744	E	84.5	Confident	74.3	Confident	105 Å²	105	66.7 Å²	66.7	49%	0.491	34%	0.343	S	S	.	.	H	α-helix	trans	-52.9	-47.8	176.3	-68.2	157.9	-162.1	0	0	111.6	L740 I746 Q747 I748	L740-E744 WeakPolarHBondContact O-CG 3.26Å; L740-E744 PolarHBondContact O-N 3.32Å; E744-I746 VanDerWaalsContact C-N 3.28Å; E744-I746 PolarHBondContact O-N 2.75Å; E744-Q747 PolarHBondContact O-N 2.97Å; E744-I748 WeakPolarHBondContact O-CG1 3.24Å; E744-I748 PolarHBondContact O-N 3.22Å
745	F	83.4	Confident	72.6	Confident	25 Å²	25	67.6 Å²	67.6	11%	0.11	36%	0.357	C	S	.	.	H	α-helix	trans	-61.9	-30.1	178.6	167.4	-115.3	0	0	0	114.1	K741 C743 F758 R761 V762 F765	K741-F745 WeakPolarHBondContact O-CB 3.46Å; K741-F745 PolarHBondContact O-N 3.42Å; C743-F745 VanDerWaalsContact C-N 3.32Å; C743-F745 PolarHBondContact O-N 2.82Å; F745-F758 HydrophobicContact CE1-CD2 4.25Å; F745-F758 AromaticContact CE1-CE2 4Å; F745-F758 HydrophobicContact CE1-CE2 4Å; F745-F758 HydrophobicContact CE2-CD2 4.45Å; F745-F758 AromaticContact CZ-CD2 3.6Å; F745-F758 HydrophobicContact CZ-CD2 3.6Å; F745-F758 AromaticContact CZ-CE2 3.76Å; F745-F758 HydrophobicContact CZ-CE2 3.76Å; F745-F758 HydrophobicContact CZ-CG 4.46Å; F745-R761 HydrophobicContact CE1-CG 4.46Å; F745-R761 VanDerWaalsContact CE2-CD 3.47Å; F745-R761 HydrophobicContact CE2-CG 4.21Å; F745-R761 HydrophobicContact CZ-CB 4.12Å; F745-R761 HydrophobicContact CZ-CG 4.13Å; F745-V762 HydrophobicContact CE1-CG2 3.91Å; F745-F765 HydrophobicContact CB-CE2 3.92Å; F745-F765 HydrophobicContact CB-CZ 4.19Å; F745-F765 HydrophobicContact CD1-CD2 4.08Å; F745-F765 AromaticContact CD1-CE2 3.59Å; F745-F765 HydrophobicContact CD1-CE2 3.59Å; F745-F765 HydrophobicContact CE1-CE2 4.34Å; F745-F765 AromaticContact CG-CE2 3.8Å; F745-F765 HydrophobicContact CG-CE2 3.8Å
746	I	78.5	Confident	71.2	Confident	29 Å²	29	68.1 Å²	68.1	15%	0.149	36%	0.36	C	S	.	.	H	α-helix	trans	-89.3	-22	179.9	-64.5	-69.1	0	0	0	112	I641 N645 A662 Y742 C743 E744 F758	I641-I746 HydrophobicContact CG2-CB 4.29Å; I641-I746 HydrophobicContact CG2-CG2 3.59Å; N645-I746 WeakPolarHBondContact ND2-CG2 3.24Å; A662-I746 HydrophobicContact CB-CD1 4.4Å; Y742-I746 HydrophobicContact CD2-CG1 4.35Å; Y742-I746 HydrophobicContact CE1-CG1 4.04Å; Y742-I746 HydrophobicContact CE2-CD1 4.14Å; Y742-I746 HydrophobicContact CE2-CG1 3.84Å; Y742-I746 VanDerWaalsContact O-CG1 3.27Å; Y742-I746 WeakPolarHBondContact O-CG1 3.3Å; Y742-I746 PolarHBondContact O-N 3.42Å; C743-I746 PolarHBondContact O-N 2.87Å; C743-I746 VanDerWaalsContact O-N 3.07Å; E744-I746 VanDerWaalsContact C-N 3.28Å; E744-I746 PolarHBondContact O-N 2.75Å; I746-F758 HydrophobicContact CD1-CE2 4.04Å; I746-F758 HydrophobicContact CD1-CZ 3.93Å
747	Q	74.4	Confident	70.3	Confident	73 Å²	73	71.6 Å²	71.6	34%	0.341	38%	0.381	S	S	.	.	H	α-helix	trans	-88.6	-33.3	177.3	-73.3	-178.8	-41.1	0	0	113.4	I641 E644 C743 E744	I641-Q747 HydrophobicContact CD1-CG 3.6Å; I641-Q747 HydrophobicContact CG1-CG 3.57Å; E644-Q747 PolarHBondContact OE2-NE2 3.45Å; C743-Q747 PolarHBondContact O-N 3.09Å; E744-Q747 PolarHBondContact O-N 2.97Å
748	I	66.6	Low	69.5	Low	104 Å²	104	68.7 Å²	68.7	53%	0.533	37%	0.369	S	S	.	.	S	Bend	trans	-88.2	116.7	176.6	-53.3	169	0	0	0	108.2	E744 T750	E744-I748 WeakPolarHBondContact O-CG1 3.24Å; E744-I748 PolarHBondContact O-N 3.22Å; I748-T750 HydrophobicContact CB-CG2 4.07Å; I748-T750 HydrophobicContact CG2-CG2 3.5Å; I748-T750 PolarHBondContact O-N 3.49Å
749	E	53.9	Low	68.8	Low	194 Å²	194	70.4 Å²	70.4	91%	0.907	38%	0.383	S	S	*	.			trans	-68.8	61.9	165.7	-65.6	-170.4	149.3	0	0	110.5	P751	E749-P751 WeakPolarHBondContact O-CD 3.25Å
750	T	46.2	Very low	68.3	Low	51 Å²	51	74.8 Å²	74.8	31%	0.313	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-61.6	125.1	175.1	55.8	0	0	0	0	108.3	I748 L752	I748-T750 HydrophobicContact CB-CG2 4.07Å; I748-T750 HydrophobicContact CG2-CG2 3.5Å; I748-T750 PolarHBondContact O-N 3.49Å; T750-L752 PolarHBondContact O-N 2.88Å
751	P	43.3	Very low	67.9	Low	126 Å²	126	76.1 Å²	76.1	82%	0.818	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-58.4	119	167.8	25.7	-32.5	0	0	0	107.2	E749	E749-P751 WeakPolarHBondContact O-CD 3.25Å
752	L	50.9	Low	67.7	Low	76 Å²	76	70.9 Å²	70.9	40%	0.398	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-65.5	139.5	-177.6	-66	100.9	0	0	0	109.6	T750 D756 F758	T750-L752 PolarHBondContact O-N 2.88Å; L752-D756 VanDerWaalsContact CD2-O 3.27Å; L752-D756 WeakPolarHBondContact CD2-O 3.48Å; L752-F758 HydrophobicContact CD2-CB 3.95Å; L752-F758 VanDerWaalsContact CD2-N 3.33Å
753	D	44.6	Very low	67.5	Low	91 Å²	91	80.1 Å²	80.1	49%	0.487	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-52.4	136.4	166.7	-57.1	-77.3	0	0	0	108.8	T755 D756 R761	D753-T755 PolarHBondContact O-N 2.84Å; D753-D756 HydrophobicContact CB-CB 4.25Å; D753-D756 PolarHBondContact O-N 3.28Å; D753-R761 IonicContact OD2-NH2 3.76Å; D753-R761 PolarHBondContact OD2-NH2 3.01Å; D753-R761 VanDerWaalsContact OD2-NH2 3.11Å
754	P	50.4	Low	67.5	Low	142 Å²	142	85.5 Å²	85.5	92%	0.922	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	2.9	-171.9	26.3	-35.8	0	0	0	114.7
755	T	50.7	Low	67.6	Low	124 Å²	124	81.9 Å²	81.9	76%	0.761	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.7	-4.5	178.8	55.4	0	0	0	0	114.1	D753	D753-T755 PolarHBondContact O-N 2.84Å
756	D	59.3	Low	67.8	Low	23 Å²	23	83.1 Å²	83.1	12%	0.123	43%	0.429	C	S	.	.			trans	-126	102.1	-168.8	-154.5	54.8	0	0	0	110.9	L752 D753 R761 R764	L752-D756 VanDerWaalsContact CD2-O 3.27Å; L752-D756 WeakPolarHBondContact CD2-O 3.48Å; D753-D756 HydrophobicContact CB-CB 4.25Å; D753-D756 PolarHBondContact O-N 3.28Å; D756-R761 IonicContact OD2-CZ 2.66Å; D756-R761 VanDerWaalsContact OD2-CZ 3.23Å; D756-R761 IonicContact OD2-NE 3.54Å; D756-R761 PolarHBondContact OD2-NE 2.88Å; D756-R761 IonicContact OD2-NH2 3.5Å; D756-R761 PolarHBondContact OD2-NH2 3.25Å; D756-R764 VanDerWaalsContact CG-NH1 3.28Å; D756-R764 IonicContact OD1-CZ 3.23Å; D756-R764 IonicContact OD1-NH1 2.87Å; D756-R764 PolarHBondContact OD1-NH1 3.35Å; D756-R764 IonicContact OD1-NH2 3.03Å; D756-R764 PolarHBondContact OD1-NH2 2.65Å; D756-R764 IonicContact OD2-NH1 2.77Å; D756-R764 PolarHBondContact OD2-NH1 3.17Å
757	T	71	Confident	68.2	Low	74 Å²	74	86.8 Å²	86.8	45%	0.454	45%	0.449	S	S	.	.			trans	-78.7	149.9	-174.4	72.1	0	0	0	0	112.6	S759 E760 R761	T757-S759 PolarHBondContact O-N 2.75Å; T757-S759 VanDerWaalsContact O-N 3.16Å; T757-E760 VanDerWaalsContact CB-OE2 3.28Å; T757-E760 WeakPolarHBondContact CB-OE2 3.42Å; T757-E760 WeakPolarHBondContact CG2-OE2 3.49Å; T757-E760 PolarHBondContact N-OE2 3.02Å; T757-E760 PolarHBondContact O-N 3.43Å; T757-E760 VanDerWaalsContact OG1-CD 3.29Å; T757-E760 WeakPolarHBondContact OG1-CG 3.5Å; T757-E760 PolarHBondContact OG1-N 2.84Å; T757-E760 PolarHBondContact OG1-OE2 2.68Å; T757-R761 PolarHBondContact O-N 3.45Å
758	F	72.4	Confident	68.8	Low	39 Å²	39	87.5 Å²	87.5	17%	0.171	45%	0.452	C	S	.	.	H	α-helix	trans	-51.9	-39.4	175.6	179.2	-90.5	0	0	0	112.2	L658 Y659 A662 F745 I746 L752 R761 V762	L658-F758 HydrophobicContact CB-CD1 4.15Å; L658-F758 HydrophobicContact CB-CE1 4.41Å; Y659-F758 HydrophobicContact CD1-CZ 4.32Å; Y659-F758 HydrophobicContact CE1-CZ 4.12Å; A662-F758 HydrophobicContact CB-CE1 4.41Å; A662-F758 HydrophobicContact CB-CZ 4.34Å; F745-F758 HydrophobicContact CE1-CD2 4.25Å; F745-F758 AromaticContact CE1-CE2 4Å; F745-F758 HydrophobicContact CE1-CE2 4Å; F745-F758 HydrophobicContact CE2-CD2 4.45Å; F745-F758 AromaticContact CZ-CD2 3.6Å; F745-F758 HydrophobicContact CZ-CD2 3.6Å; F745-F758 AromaticContact CZ-CE2 3.76Å; F745-F758 HydrophobicContact CZ-CE2 3.76Å; F745-F758 HydrophobicContact CZ-CG 4.46Å; I746-F758 HydrophobicContact CD1-CE2 4.04Å; I746-F758 HydrophobicContact CD1-CZ 3.93Å; L752-F758 HydrophobicContact CD2-CB 3.95Å; L752-F758 VanDerWaalsContact CD2-N 3.33Å; F758-R761 PolarHBondContact O-N 3.13Å; F758-V762 HydrophobicContact CD1-CG2 4.16Å; F758-V762 HydrophobicContact CE1-CG2 3.83Å; F758-V762 HydrophobicContact CZ-CG2 4.04Å; F758-V762 VanDerWaalsContact O-CG2 3.31Å; F758-V762 WeakPolarHBondContact O-CG2 3.29Å; F758-V762 PolarHBondContact O-N 2.72Å
759	S	74.6	Confident	69.9	Low	57 Å²	57	82.7 Å²	82.7	40%	0.399	43%	0.427	S	S	.	.	H	α-helix	trans	-62.6	-42.6	177.6	-162.8	0	0	0	0	112.6	T757 R763	T757-S759 PolarHBondContact O-N 2.75Å; T757-S759 VanDerWaalsContact O-N 3.16Å; S759-R763 VanDerWaalsContact O-CB 3.31Å; S759-R763 WeakPolarHBondContact O-CB 3.48Å; S759-R763 PolarHBondContact O-N 3.46Å
760	E	79.4	Confident	71.5	Confident	91 Å²	91	74.3 Å²	74.3	43%	0.425	39%	0.389	S	S	.	.	H	α-helix	trans	-69.7	-41.1	179	-70.3	162.9	125	0	0	111.6	T757 R763 R764	T757-E760 VanDerWaalsContact CB-OE2 3.28Å; T757-E760 WeakPolarHBondContact CB-OE2 3.42Å; T757-E760 WeakPolarHBondContact CG2-OE2 3.49Å; T757-E760 PolarHBondContact N-OE2 3.02Å; T757-E760 PolarHBondContact O-N 3.43Å; T757-E760 VanDerWaalsContact OG1-CD 3.29Å; T757-E760 WeakPolarHBondContact OG1-CG 3.5Å; T757-E760 PolarHBondContact OG1-N 2.84Å; T757-E760 PolarHBondContact OG1-OE2 2.68Å; E760-R763 CarbonylContact O-C 3.53Å; E760-R763 PolarHBondContact O-N 3.05Å; E760-R763 VanDerWaalsContact O-N 3.17Å; E760-R764 WeakPolarHBondContact O-CG 3.38Å; E760-R764 PolarHBondContact O-N 2.67Å
761	R	81.3	Confident	73.4	Confident	53 Å²	53	76.3 Å²	76.3	20%	0.2	40%	0.395	C	S	.	.	H	α-helix	trans	-65.5	-42	177.6	-161.1	171.6	-72.6	-169.3	-0.9	111.7	F745 D753 D756 T757 F758 R763 R764 F765	F745-R761 HydrophobicContact CE1-CG 4.46Å; F745-R761 VanDerWaalsContact CE2-CD 3.47Å; F745-R761 HydrophobicContact CE2-CG 4.21Å; F745-R761 HydrophobicContact CZ-CB 4.12Å; F745-R761 HydrophobicContact CZ-CG 4.13Å; D753-R761 IonicContact OD2-NH2 3.76Å; D753-R761 PolarHBondContact OD2-NH2 3.01Å; D753-R761 VanDerWaalsContact OD2-NH2 3.11Å; D756-R761 IonicContact OD2-CZ 2.66Å; D756-R761 VanDerWaalsContact OD2-CZ 3.23Å; D756-R761 IonicContact OD2-NE 3.54Å; D756-R761 PolarHBondContact OD2-NE 2.88Å; D756-R761 IonicContact OD2-NH2 3.5Å; D756-R761 PolarHBondContact OD2-NH2 3.25Å; T757-R761 PolarHBondContact O-N 3.45Å; F758-R761 PolarHBondContact O-N 3.13Å; R761-R763 VanDerWaalsContact C-N 3.33Å; R761-R763 PolarHBondContact O-N 3.37Å; R761-R764 PolarHBondContact O-N 3.46Å; R761-F765 HydrophobicContact CG-CE2 4.19Å; R761-F765 VanDerWaalsContact O-CD2 3.26Å; R761-F765 WeakPolarHBondContact O-CD2 3.44Å; R761-F765 PolarHBondContact O-N 2.66Å; R761-F765 VanDerWaalsContact O-N 3.15Å
762	V	83.4	Confident	75.5	Confident	6 Å²	6	72 Å²	72	4%	0.036	37%	0.365	C	S	.	.	H	α-helix	trans	-60.4	-40.8	170	171.5	0	0	0	0	111.6	A661 A662 L665 F745 F758 F765 D766	A661-V762 HydrophobicContact CB-CG1 4.17Å; A662-V762 HydrophobicContact CB-CG1 4.37Å; A662-V762 HydrophobicContact CB-CG2 4.21Å; L665-V762 HydrophobicContact CD2-CG1 4.35Å; F745-V762 HydrophobicContact CE1-CG2 3.91Å; F758-V762 HydrophobicContact CD1-CG2 4.16Å; F758-V762 HydrophobicContact CE1-CG2 3.83Å; F758-V762 HydrophobicContact CZ-CG2 4.04Å; F758-V762 VanDerWaalsContact O-CG2 3.31Å; F758-V762 WeakPolarHBondContact O-CG2 3.29Å; F758-V762 PolarHBondContact O-N 2.72Å; V762-F765 PolarHBondContact O-N 2.92Å; V762-D766 PolarHBondContact O-N 3.37Å
763	R	83.4	Confident	77.2	Confident	196 Å²	196	68.5 Å²	68.5	74%	0.74	35%	0.347	S	S	*	.	H	α-helix	trans	-68.2	-32.7	178.2	-173.5	174.1	-179.7	161.8	0.7	113.3	S759 E760 R761 D766 L767	S759-R763 VanDerWaalsContact O-CB 3.31Å; S759-R763 WeakPolarHBondContact O-CB 3.48Å; S759-R763 PolarHBondContact O-N 3.46Å; E760-R763 CarbonylContact O-C 3.53Å; E760-R763 PolarHBondContact O-N 3.05Å; E760-R763 VanDerWaalsContact O-N 3.17Å; R761-R763 VanDerWaalsContact C-N 3.33Å; R761-R763 PolarHBondContact O-N 3.37Å; R763-D766 PolarHBondContact O-N 3.11Å; R763-L767 PolarHBondContact O-N 3.17Å
764	R	85.5	Confident	79.1	Confident	116 Å²	116	64.2 Å²	64.2	44%	0.438	32%	0.324	S	S	.	.	H	α-helix	trans	-64.1	-49.4	171	-70	178.4	-163.2	135.6	9.5	110.8	D756 E760 R761 D766 L767 E768	D756-R764 VanDerWaalsContact CG-NH1 3.28Å; D756-R764 IonicContact OD1-CZ 3.23Å; D756-R764 IonicContact OD1-NH1 2.87Å; D756-R764 PolarHBondContact OD1-NH1 3.35Å; D756-R764 IonicContact OD1-NH2 3.03Å; D756-R764 PolarHBondContact OD1-NH2 2.65Å; D756-R764 IonicContact OD2-NH1 2.77Å; D756-R764 PolarHBondContact OD2-NH1 3.17Å; E760-R764 WeakPolarHBondContact O-CG 3.38Å; E760-R764 PolarHBondContact O-N 2.67Å; R761-R764 PolarHBondContact O-N 3.46Å; R764-D766 VanDerWaalsContact C-N 3.28Å; R764-D766 PolarHBondContact O-N 3.25Å; R764-L767 PolarHBondContact O-N 2.94Å; R764-L767 VanDerWaalsContact O-N 3.16Å; R764-E768 WeakPolarHBondContact O-CG 3.47Å; R764-E768 PolarHBondContact O-N 2.89Å
765	F	86.9	Confident	80.7	Confident	29 Å²	29	59.9 Å²	59.9	13%	0.127	30%	0.297	C	S	.	.	H	α-helix	trans	-58.2	-38.4	175.3	-76.9	-60.8	0	0	0	112.9	L665 I738 K741 Y742 F745 R761 V762 F769	L665-F765 HydrophobicContact CD2-CB 3.78Å; I738-F765 HydrophobicContact CG2-CD1 4.31Å; K741-F765 HydrophobicContact CB-CE1 3.94Å; K741-F765 HydrophobicContact CB-CZ 4.34Å; Y742-F765 HydrophobicContact CD2-CB 4.37Å; Y742-F765 HydrophobicContact CD2-CD2 4.22Å; Y742-F765 HydrophobicContact CD2-CG 4.35Å; F745-F765 HydrophobicContact CB-CE2 3.92Å; F745-F765 HydrophobicContact CB-CZ 4.19Å; F745-F765 HydrophobicContact CD1-CD2 4.08Å; F745-F765 AromaticContact CD1-CE2 3.59Å; F745-F765 HydrophobicContact CD1-CE2 3.59Å; F745-F765 HydrophobicContact CE1-CE2 4.34Å; F745-F765 AromaticContact CG-CE2 3.8Å; F745-F765 HydrophobicContact CG-CE2 3.8Å; R761-F765 HydrophobicContact CG-CE2 4.19Å; R761-F765 VanDerWaalsContact O-CD2 3.26Å; R761-F765 WeakPolarHBondContact O-CD2 3.44Å; R761-F765 PolarHBondContact O-N 2.66Å; R761-F765 VanDerWaalsContact O-N 3.15Å; V762-F765 PolarHBondContact O-N 2.92Å; F765-F769 WeakPolarHBondContact O-CB 3.32Å; F765-F769 PolarHBondContact O-N 2.83Å
766	D	87	Confident	82.3	Confident	52 Å²	52	54.1 Å²	54.1	28%	0.278	26%	0.261	S	S	.	.	H	α-helix	trans	-64.4	-45.9	175.2	-168.2	3.9	0	0	0	112.1	L665 R668 V762 R763 R764 T770	L665-D766 HydrophobicContact CD1-CB 3.98Å; L665-D766 HydrophobicContact CD2-CB 4.13Å; R668-D766 IonicContact CZ-OD1 3.83Å; R668-D766 IonicContact NH1-OD1 3.38Å; R668-D766 PolarHBondContact NH1-OD1 3.33Å; R668-D766 IonicContact NH1-OD2 2.7Å; R668-D766 PolarHBondContact NH1-OD2 3.04Å; R668-D766 IonicContact NH2-OD1 3.62Å; R668-D766 PolarHBondContact NH2-OD1 2.94Å; V762-D766 PolarHBondContact O-N 3.37Å; R763-D766 PolarHBondContact O-N 3.11Å; R764-D766 VanDerWaalsContact C-N 3.28Å; R764-D766 PolarHBondContact O-N 3.25Å; D766-T770 WeakPolarHBondContact O-CB 3.36Å; D766-T770 PolarHBondContact O-N 2.94Å; D766-T770 PolarHBondContact O-OG1 2.96Å; D766-T770 PolarHBondContact OD1-OG1 2.81Å
767	L	86.6	Confident	83.4	Confident	105 Å²	105	53 Å²	53	55%	0.55	26%	0.255	S	S	.	.	H	α-helix	trans	-61.8	-49.6	177.8	-171	71	0	0	0	111.6	R763 R764 T770 Q771	R763-L767 PolarHBondContact O-N 3.17Å; R764-L767 PolarHBondContact O-N 2.94Å; R764-L767 VanDerWaalsContact O-N 3.16Å; L767-T770 PolarHBondContact O-N 3.47Å; L767-Q771 WeakPolarHBondContact O-CB 3.46Å; L767-Q771 WeakPolarHBondContact O-CG 3.35Å; L767-Q771 PolarHBondContact O-N 3.3Å
768	E	88.6	Confident	83.8	Confident	89 Å²	89	51.8 Å²	51.8	42%	0.416	24%	0.244	S	C	.	.	H	α-helix	trans	-62.5	-45.6	179.5	-69.7	178.1	-153.9	0	0	112	I738 R764 T770 Q771 L772	I738-E768 HydrophobicContact CD1-CB 3.77Å; R764-E768 WeakPolarHBondContact O-CG 3.47Å; R764-E768 PolarHBondContact O-N 2.89Å; E768-T770 VanDerWaalsContact C-N 3.35Å; E768-T770 PolarHBondContact O-N 2.91Å; E768-Q771 PolarHBondContact O-N 3.25Å; E768-L772 WeakPolarHBondContact O-CG 3.25Å; E768-L772 PolarHBondContact O-N 3.15Å
769	F	89.6	Confident	84.2	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.009	25%	0.248	C	C	.	.	H	α-helix	trans	-61.4	-43.2	176.3	175.7	-101.4	0	0	0	111.6	L665 R668 M669 A672 L735 I738 F765 L772 L773	L665-F769 HydrophobicContact CD1-CB 4.47Å; L665-F769 HydrophobicContact CD1-CD1 4.16Å; R668-F769 HydrophobicContact CB-CE1 4.31Å; M669-F769 HydrophobicContact CB-CE2 4.35Å; M669-F769 HydrophobicContact CB-CZ 4.34Å; M669-F769 HydrophobicContact CE-CB 3.97Å; M669-F769 HydrophobicContact CE-CD2 4.03Å; M669-F769 HydrophobicContact CE-CG 4Å; M669-F769 HydrophobicContact CG-CD1 4.25Å; M669-F769 HydrophobicContact CG-CD2 3.85Å; M669-F769 HydrophobicContact CG-CE1 4.17Å; M669-F769 HydrophobicContact CG-CE2 3.76Å; M669-F769 HydrophobicContact CG-CG 4.11Å; M669-F769 HydrophobicContact CG-CZ 3.93Å; A672-F769 HydrophobicContact CB-CZ 3.89Å; L735-F769 HydrophobicContact CD2-CD2 3.98Å; L735-F769 HydrophobicContact CD2-CE2 3.86Å; I738-F769 HydrophobicContact CG2-CB 4.35Å; F765-F769 WeakPolarHBondContact O-CB 3.32Å; F765-F769 PolarHBondContact O-N 2.83Å; F769-L772 PolarHBondContact O-N 3.07Å; F769-L773 HydrophobicContact CE1-CD2 4Å; F769-L773 HydrophobicContact CZ-CD2 4.2Å; F769-L773 VanDerWaalsContact O-CB 3.27Å; F769-L773 WeakPolarHBondContact O-CB 3.28Å; F769-L773 PolarHBondContact O-N 2.89Å
770	T	86.9	Confident	84.4	Confident	18 Å²	18	49.8 Å²	49.8	11%	0.11	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-42.9	178.6	-58.2	0	0	0	0	111.6	R668 D766 L767 E768 L773 I774 Q808	R668-T770 PolarHBondContact NH2-OG1 3.33Å; D766-T770 WeakPolarHBondContact O-CB 3.36Å; D766-T770 PolarHBondContact O-N 2.94Å; D766-T770 PolarHBondContact O-OG1 2.96Å; D766-T770 PolarHBondContact OD1-OG1 2.81Å; L767-T770 PolarHBondContact O-N 3.47Å; E768-T770 VanDerWaalsContact C-N 3.35Å; E768-T770 PolarHBondContact O-N 2.91Å; T770-L773 PolarHBondContact O-N 3.02Å; T770-I774 HydrophobicContact CG2-CD1 3.84Å; T770-I774 WeakPolarHBondContact O-CB 3.42Å; T770-I774 WeakPolarHBondContact O-CG1 3.37Å; T770-I774 PolarHBondContact O-N 3.19Å; T770-Q808 VanDerWaalsContact CG2-OE1 3.25Å
771	Q	86.7	Confident	84.3	Confident	93 Å²	93	47.1 Å²	47.1	44%	0.435	22%	0.217	S	C	.	.	H	α-helix	trans	-62.3	-46.1	175.4	-75.6	174.8	-13.1	0	0	112	L767 E768 S775 M812	L767-Q771 WeakPolarHBondContact O-CB 3.46Å; L767-Q771 WeakPolarHBondContact O-CG 3.35Å; L767-Q771 PolarHBondContact O-N 3.3Å; E768-Q771 PolarHBondContact O-N 3.25Å; Q771-S775 WeakPolarHBondContact O-CB 3.46Å; Q771-S775 PolarHBondContact O-N 2.55Å; Q771-M812 HydrophobicContact CG-SD 4.33Å
772	L	87.3	Confident	84	Confident	37 Å²	37	47.5 Å²	47.5	19%	0.194	23%	0.228	C	C	.	.	H	α-helix	trans	-62.6	-43	175.3	-72.6	-169	0	0	0	112.2	K734 L735 I738 E768 F769 S775 F776	K734-L772 HydrophobicContact CB-CD1 3.76Å; K734-L772 HydrophobicContact CB-CD2 4.39Å; K734-L772 HydrophobicContact CD-CD2 4.21Å; L735-L772 HydrophobicContact CD2-CB 3.57Å; L735-L772 HydrophobicContact CD2-CD1 4.37Å; L735-L772 HydrophobicContact CG-CB 4.06Å; L735-L772 HydrophobicContact CG-CD1 4.46Å; I738-L772 HydrophobicContact CD1-CD1 3.45Å; I738-L772 VanDerWaalsContact CD1-CD1 3.45Å; I738-L772 HydrophobicContact CD1-CG 4.18Å; I738-L772 HydrophobicContact CG1-CD1 3.91Å; E768-L772 WeakPolarHBondContact O-CG 3.25Å; E768-L772 PolarHBondContact O-N 3.15Å; F769-L772 PolarHBondContact O-N 3.07Å; L772-S775 PolarHBondContact O-N 3Å; L772-F776 WeakPolarHBondContact O-CB 3.44Å; L772-F776 PolarHBondContact O-N 3.43Å
773	L	86.3	Confident	83.4	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-65.4	-42.3	-177.9	-175.4	63.3	0	0	0	111.3	A672 L735 F769 T770 F776 L777 I799 Y805	A672-L773 HydrophobicContact CB-CD1 4.27Å; L735-L773 HydrophobicContact CD2-CB 4.24Å; F769-L773 HydrophobicContact CE1-CD2 4Å; F769-L773 HydrophobicContact CZ-CD2 4.2Å; F769-L773 VanDerWaalsContact O-CB 3.27Å; F769-L773 WeakPolarHBondContact O-CB 3.28Å; F769-L773 PolarHBondContact O-N 2.89Å; T770-L773 PolarHBondContact O-N 3.02Å; L773-F776 PolarHBondContact O-N 2.83Å; L773-L777 HydrophobicContact CG-CD1 4.38Å; L773-L777 WeakPolarHBondContact O-CB 3.47Å; L773-L777 WeakPolarHBondContact O-CG 3.4Å; L773-L777 PolarHBondContact O-N 2.74Å; L773-I799 HydrophobicContact CD1-CG2 3.96Å; L773-Y805 HydrophobicContact CD2-CD2 4.36Å; L773-Y805 HydrophobicContact CD2-CE1 3.98Å; L773-Y805 HydrophobicContact CD2-CE2 3.73Å
774	I	84.1	Confident	82.6	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-69	-37.8	175.2	-68.6	166.9	0	0	0	111.2	T770 F776 L777 K778 Q808 M809 M812	T770-I774 HydrophobicContact CG2-CD1 3.84Å; T770-I774 WeakPolarHBondContact O-CB 3.42Å; T770-I774 WeakPolarHBondContact O-CG1 3.37Å; T770-I774 PolarHBondContact O-N 3.19Å; I774-F776 VanDerWaalsContact C-N 3.35Å; I774-F776 PolarHBondContact O-N 3.49Å; I774-L777 PolarHBondContact O-N 2.9Å; I774-K778 HydrophobicContact CG2-CD 4.27Å; I774-K778 HydrophobicContact CG2-CG 4.37Å; I774-K778 WeakPolarHBondContact O-CB 3.32Å; I774-K778 WeakPolarHBondContact O-CG 3.4Å; I774-K778 PolarHBondContact O-N 3.17Å; I774-Q808 HydrophobicContact CD1-CB 3.59Å; I774-M809 HydrophobicContact CG1-CG 4.13Å; I774-M809 HydrophobicContact CG2-CB 4.49Å; I774-M809 HydrophobicContact CG2-CG 3.93Å; I774-M812 HydrophobicContact CB-CE 3.59Å; I774-M812 HydrophobicContact CD1-CE 3.8Å; I774-M812 HydrophobicContact CG1-CE 4.3Å; I774-M812 HydrophobicContact CG2-CE 3.31Å
775	S	84.8	Confident	81.8	Confident	51 Å²	51	43 Å²	43	36%	0.357	22%	0.22	S	C	.	.	H	α-helix	trans	-61.3	-43.5	173.9	-166.4	0	0	0	0	111.7	Q771 L772 K778 Q779	Q771-S775 WeakPolarHBondContact O-CB 3.46Å; Q771-S775 PolarHBondContact O-N 2.55Å; L772-S775 PolarHBondContact O-N 3Å; S775-K778 PolarHBondContact O-N 3.35Å; S775-Q779 WeakPolarHBondContact O-CG 3.45Å; S775-Q779 PolarHBondContact O-N 3.21Å; S775-Q779 PolarHBondContact OG-NE2 3.47Å
776	F	84.1	Confident	80.7	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.009	25%	0.248	C	C	.	.	H	α-helix	trans	-62.6	-45.8	174.3	179.5	-122.9	0	0	0	111.9	L676 M721 L728 I732 L735 L772 L773 I774 K778 Q779 I780 I799	L676-F776 HydrophobicContact CD1-CE1 4.34Å; L676-F776 HydrophobicContact CD1-CZ 3.97Å; M721-F776 HydrophobicContact CE-CZ 4.4Å; M721-F776 HydrophobicContact SD-CE2 4.04Å; M721-F776 HydrophobicContact SD-CZ 4.17Å; L728-F776 HydrophobicContact CD2-CD2 3.97Å; L728-F776 HydrophobicContact CD2-CE2 4.01Å; I732-F776 HydrophobicContact CD1-CE2 3.99Å; I732-F776 HydrophobicContact CD1-CZ 4.01Å; I732-F776 HydrophobicContact CG1-CD2 4.39Å; I732-F776 HydrophobicContact CG1-CE2 3.49Å; I732-F776 VanDerWaalsContact CG1-CE2 3.49Å; I732-F776 HydrophobicContact CG1-CZ 3.62Å; L735-F776 HydrophobicContact CD1-CB 3.99Å; L735-F776 HydrophobicContact CD1-CD1 3.82Å; L735-F776 HydrophobicContact CD1-CE1 4.41Å; L735-F776 HydrophobicContact CD1-CG 3.93Å; L772-F776 WeakPolarHBondContact O-CB 3.44Å; L772-F776 PolarHBondContact O-N 3.43Å; L773-F776 PolarHBondContact O-N 2.83Å; I774-F776 VanDerWaalsContact C-N 3.35Å; I774-F776 PolarHBondContact O-N 3.49Å; F776-K778 PolarHBondContact O-N 3.28Å; F776-Q779 WeakPolarHBondContact O-CB 3.03Å; F776-Q779 PolarHBondContact O-N 2.91Å; F776-I780 HydrophobicContact CD1-CD1 3.87Å; F776-I780 HydrophobicContact CD2-CD1 4.11Å; F776-I780 HydrophobicContact CD2-CG1 4.38Å; F776-I780 HydrophobicContact CE1-CD1 3.58Å; F776-I780 HydrophobicContact CE2-CD1 3.82Å; F776-I780 HydrophobicContact CE2-CG1 4.19Å; F776-I780 HydrophobicContact CG-CD1 4.14Å; F776-I780 HydrophobicContact CZ-CD1 3.57Å; F776-I780 HydrophobicContact CZ-CG1 4.39Å; F776-I780 WeakPolarHBondContact O-CG1 3.44Å; F776-I780 PolarHBondContact O-N 3.38Å; F776-I799 HydrophobicContact CE1-CD1 4.18Å
777	L	82.6	Confident	79.4	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.1	-39.9	175	-73.6	170.7	0	0	0	112.7	L773 I774 N781 V796 I799 M809	L773-L777 HydrophobicContact CG-CD1 4.38Å; L773-L777 WeakPolarHBondContact O-CB 3.47Å; L773-L777 WeakPolarHBondContact O-CG 3.4Å; L773-L777 PolarHBondContact O-N 2.74Å; I774-L777 PolarHBondContact O-N 2.9Å; L777-N781 WeakPolarHBondContact O-CB 3.24Å; L777-N781 PolarHBondContact O-N 3.09Å; L777-N781 PolarHBondContact O-ND2 2.94Å; L777-V796 HydrophobicContact CD2-CG1 4.49Å; L777-V796 HydrophobicContact CD2-CG2 4.34Å; L777-I799 HydrophobicContact CD1-CG2 4.1Å; L777-I799 HydrophobicContact CD2-CB 4.09Å; L777-I799 HydrophobicContact CD2-CG2 3.9Å; L777-I799 HydrophobicContact CG-CG2 4.31Å; L777-M809 HydrophobicContact CB-CE 4.33Å; L777-M809 HydrophobicContact CB-SD 4.39Å; L777-M809 HydrophobicContact CD1-SD 4.28Å
778	K	79.4	Confident	77.6	Confident	49 Å²	49	50.8 Å²	50.8	21%	0.213	26%	0.261	C	S	.	.	H	α-helix	trans	-61.3	-42.7	172.6	-78.7	-179.7	172.1	-176.6	0	111.1	I774 S775 F776 S782 M812 C813 D816	I774-K778 HydrophobicContact CG2-CD 4.27Å; I774-K778 HydrophobicContact CG2-CG 4.37Å; I774-K778 WeakPolarHBondContact O-CB 3.32Å; I774-K778 WeakPolarHBondContact O-CG 3.4Å; I774-K778 PolarHBondContact O-N 3.17Å; S775-K778 PolarHBondContact O-N 3.35Å; F776-K778 PolarHBondContact O-N 3.28Å; K778-S782 WeakPolarHBondContact O-CB 3.47Å; K778-S782 PolarHBondContact O-N 3.1Å; K778-M812 PolarHBondContact NZ-O 3.41Å; K778-C813 WeakPolarHBondContact CE-SG 3.03Å; K778-D816 IonicContact NZ-OD2 3.45Å; K778-D816 PolarHBondContact NZ-OD2 2.91Å
779	Q	79.8	Confident	76	Confident	53 Å²	53	48 Å²	48	25%	0.248	25%	0.253	C	S	.	.	H	α-helix	trans	-64.4	-48.4	177.2	-70.5	164.1	29.5	0	0	112.1	L728 S731 S775 F776 N781 S782 M783	L728-Q779 HydrophobicContact CD2-CB 3.61Å; S731-Q779 PolarHBondContact OG-NE2 3.47Å; S731-Q779 PolarHBondContact OG-OE1 3.41Å; S775-Q779 WeakPolarHBondContact O-CG 3.45Å; S775-Q779 PolarHBondContact O-N 3.21Å; S775-Q779 PolarHBondContact OG-NE2 3.47Å; F776-Q779 WeakPolarHBondContact O-CB 3.03Å; F776-Q779 PolarHBondContact O-N 2.91Å; Q779-N781 PolarHBondContact O-N 2.86Å; Q779-S782 WeakPolarHBondContact O-CB 3.25Å; Q779-S782 PolarHBondContact O-N 3.42Å; Q779-M783 PolarHBondContact O-N 3.02Å
780	I	77.9	Confident	74.6	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-61.5	-45.4	176.9	-60.7	160.2	0	0	0	110.6	M721 L728 F776 S782 M783 A784 F792 L795 V796	M721-I780 HydrophobicContact CE-CD1 4.06Å; M721-I780 HydrophobicContact CE-CG1 4.07Å; L728-I780 HydrophobicContact CD2-CG1 3.95Å; F776-I780 HydrophobicContact CD1-CD1 3.87Å; F776-I780 HydrophobicContact CD2-CD1 4.11Å; F776-I780 HydrophobicContact CD2-CG1 4.38Å; F776-I780 HydrophobicContact CE1-CD1 3.58Å; F776-I780 HydrophobicContact CE2-CD1 3.82Å; F776-I780 HydrophobicContact CE2-CG1 4.19Å; F776-I780 HydrophobicContact CG-CD1 4.14Å; F776-I780 HydrophobicContact CZ-CD1 3.57Å; F776-I780 HydrophobicContact CZ-CG1 4.39Å; F776-I780 WeakPolarHBondContact O-CG1 3.44Å; F776-I780 PolarHBondContact O-N 3.38Å; I780-S782 VanDerWaalsContact C-N 3.27Å; I780-S782 PolarHBondContact O-N 3.44Å; I780-M783 CarbonylContact O-C 3.58Å; I780-M783 PolarHBondContact O-N 2.72Å; I780-A784 WeakPolarHBondContact O-CB 3.48Å; I780-A784 PolarHBondContact O-N 2.79Å; I780-F792 HydrophobicContact CG2-CB 4.11Å; I780-F792 HydrophobicContact CG2-CD1 4.5Å; I780-L795 HydrophobicContact CD1-CD2 3.82Å; I780-V796 HydrophobicContact CB-CG2 4.02Å; I780-V796 HydrophobicContact CG2-CG2 3.56Å
781	N	77.4	Confident	73.4	Confident	35 Å²	35	55 Å²	55	19%	0.187	29%	0.292	C	S	.	.	H	α-helix	trans	-60.4	-34.9	176.6	-84.8	-75.9	0	0	0	112.8	L777 Q779 K785 V796	L777-N781 WeakPolarHBondContact O-CB 3.24Å; L777-N781 PolarHBondContact O-N 3.09Å; L777-N781 PolarHBondContact O-ND2 2.94Å; Q779-N781 PolarHBondContact O-N 2.86Å; N781-K785 WeakPolarHBondContact O-CB 3.43Å; N781-K785 VanDerWaalsContact O-CG 3.26Å; N781-K785 WeakPolarHBondContact O-CG 3.27Å; N781-K785 PolarHBondContact O-N 2.58Å; N781-V796 WeakPolarHBondContact ND2-CG1 3.35Å
782	S	75	Confident	72.6	Confident	61 Å²	61	50.7 Å²	50.7	43%	0.427	27%	0.272	S	S	.	.	H	α-helix	trans	-67.1	-35.9	173.9	-166	0	0	0	0	112.3	K778 Q779 I780 K786	K778-S782 WeakPolarHBondContact O-CB 3.47Å; K778-S782 PolarHBondContact O-N 3.1Å; Q779-S782 WeakPolarHBondContact O-CB 3.25Å; Q779-S782 PolarHBondContact O-N 3.42Å; I780-S782 VanDerWaalsContact C-N 3.27Å; I780-S782 PolarHBondContact O-N 3.44Å; S782-K786 WeakPolarHBondContact O-CG 3.39Å
783	M	70.8	Confident	71.8	Confident	28 Å²	28	52.4 Å²	52.4	14%	0.138	28%	0.28	C	S	.	.	H	α-helix	trans	-78.5	-37.6	176.5	-77.1	-175.4	56.7	0	0	113.4	E724 L728 Q779 I780 K785 K786 N787	E724-M783 HydrophobicContact CB-CE 4.4Å; L728-M783 HydrophobicContact CD1-CE 3.89Å; L728-M783 HydrophobicContact CD1-SD 3.32Å; L728-M783 WeakPolarHBondContact CD1-SD 3.46Å; L728-M783 HydrophobicContact CG-SD 3.99Å; Q779-M783 PolarHBondContact O-N 3.02Å; I780-M783 CarbonylContact O-C 3.58Å; I780-M783 PolarHBondContact O-N 2.72Å; M783-K785 PolarHBondContact O-N 3.31Å; M783-K786 CarbonylContact O-C 3.58Å; M783-K786 WeakPolarHBondContact O-CA 3.47Å; M783-K786 PolarHBondContact O-N 3.47Å; M783-N787 PolarHBondContact O-N 2.82Å
784	A	67.4	Low	71.3	Confident	13 Å²	13	55.8 Å²	55.8	11%	0.107	30%	0.299	C	S	.	.	H	α-helix	trans	-66.9	-24.8	175	0	0	0	0	0	112.8	I780 K786 N787 F792 M793	I780-A784 WeakPolarHBondContact O-CB 3.48Å; I780-A784 PolarHBondContact O-N 2.79Å; A784-K786 VanDerWaalsContact C-N 3.26Å; A784-K786 PolarHBondContact O-N 3Å; A784-N787 VanDerWaalsContact O-O 3.11Å; A784-F792 HydrophobicContact CB-CB 3.83Å; A784-M793 HydrophobicContact CB-CG 4.06Å; A784-M793 HydrophobicContact CB-SD 3.53Å; A784-M793 VanDerWaalsContact CB-SD 3.53Å
785	K	68.1	Low	70.9	Confident	181 Å²	181	55.7 Å²	55.7	79%	0.787	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-7.8	168.1	-73.9	174	-179.5	-178.3	0	114.1	N781 M783	N781-K785 WeakPolarHBondContact O-CB 3.43Å; N781-K785 VanDerWaalsContact O-CG 3.26Å; N781-K785 WeakPolarHBondContact O-CG 3.27Å; N781-K785 PolarHBondContact O-N 2.58Å; M783-K785 PolarHBondContact O-N 3.31Å
786	K	64.5	Low	70.5	Confident	166 Å²	166	53.7 Å²	53.7	72%	0.722	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	-44.3	-178.2	-69.9	175.3	179.7	179	0	113.1	S782 M783 A784	S782-K786 WeakPolarHBondContact O-CG 3.39Å; M783-K786 CarbonylContact O-C 3.58Å; M783-K786 WeakPolarHBondContact O-CA 3.47Å; M783-K786 PolarHBondContact O-N 3.47Å; A784-K786 VanDerWaalsContact C-N 3.26Å; A784-K786 PolarHBondContact O-N 3Å
787	N	59.8	Low	70.1	Confident	43 Å²	43	59.2 Å²	59.2	23%	0.23	31%	0.309	C	S	.	.	S	Bend	trans	-96.1	115.3	168	-89.5	-50.7	0	0	0	107.8	K718 E724 M783 A784 A789	K718-N787 PolarHBondContact NZ-OD1 3.08Å; E724-N787 PolarHBondContact OE2-ND2 3.2Å; M783-N787 PolarHBondContact O-N 2.82Å; A784-N787 VanDerWaalsContact O-O 3.11Å; N787-A789 PolarHBondContact O-N 3.42Å
788	T	48.1	Very low	69.8	Low	142 Å²	142	62.7 Å²	62.7	87%	0.871	32%	0.322	S	S	*	.			trans	-75.6	56.8	173.1	56.5	0	0	0	0	111.4
789	A	54.9	Low	69.6	Low	31 Å²	31	60.7 Å²	60.7	26%	0.256	31%	0.314	S	S	.	.			trans	-110.5	103.5	175.6	0	0	0	0	0	108.5	N787 C791 F792	N787-A789 PolarHBondContact O-N 3.42Å; A789-C791 PolarHBondContact O-N 3.07Å; A789-F792 HydrophobicContact CB-CD2 4.06Å; A789-F792 HydrophobicContact CB-CE2 4.27Å; A789-F792 PolarHBondContact O-N 2.91Å
790	D	60.4	Low	69.4	Low	123 Å²	123	59.3 Å²	59.3	66%	0.658	31%	0.308	S	S	*	.	H	α-helix	trans	-53	-28.2	-173.4	-58.9	-39.1	0	0	0	113.2	F792 M793 N794	D790-F792 VanDerWaalsContact C-N 3.28Å; D790-F792 PolarHBondContact O-N 3.01Å; D790-M793 WeakPolarHBondContact O-CA 3.37Å; D790-M793 WeakPolarHBondContact O-CB 3.34Å; D790-M793 PolarHBondContact O-N 3.1Å; D790-N794 PolarHBondContact O-N 3.32Å
791	C	61.9	Low	68.9	Low	42 Å²	42	65.8 Å²	65.8	28%	0.284	34%	0.337	S	S	.	.	H	α-helix	trans	-47.8	-43.9	172.8	-55.3	0	0	0	0	113.3	Y679 A789 M793 N794 L795	Y679-C791 HydrophobicContact CE2-CB 4.08Å; Y679-C791 WeakPolarHBondContact CE2-O 3.44Å; A789-C791 PolarHBondContact O-N 3.07Å; C791-M793 VanDerWaalsContact C-N 3.32Å; C791-M793 PolarHBondContact O-N 2.87Å; C791-N794 PolarHBondContact O-N 3.34Å; C791-L795 PolarHBondContact O-N 3.05Å
792	F	70	Confident	68.2	Low	3 Å²	3	70.7 Å²	70.7	1%	0.013	36%	0.363	C	S	.	.	H	α-helix	trans	-69.3	-30.7	180	-67.2	-58.8	0	0	0	112.6	Y679 M721 I780 A784 A789 D790 V796	Y679-F792 WeakPolarHBondContact OH-CD1 3.44Å; Y679-F792 VanDerWaalsContact OH-CE1 3.26Å; Y679-F792 WeakPolarHBondContact OH-CE1 3.31Å; M721-F792 HydrophobicContact CE-CD1 4.17Å; M721-F792 HydrophobicContact CE-CE1 4.2Å; M721-F792 HydrophobicContact CG-CE1 4.09Å; I780-F792 HydrophobicContact CG2-CB 4.11Å; I780-F792 HydrophobicContact CG2-CD1 4.5Å; A784-F792 HydrophobicContact CB-CB 3.83Å; A789-F792 HydrophobicContact CB-CD2 4.06Å; A789-F792 HydrophobicContact CB-CE2 4.27Å; A789-F792 PolarHBondContact O-N 2.91Å; D790-F792 VanDerWaalsContact C-N 3.28Å; D790-F792 PolarHBondContact O-N 3.01Å; F792-V796 WeakPolarHBondContact O-CG2 3.41Å; F792-V796 PolarHBondContact O-N 3.45Å
793	M	71.5	Confident	67.8	Low	73 Å²	73	70.4 Å²	70.4	36%	0.36	36%	0.364	S	S	.	.	H	α-helix	trans	-71.3	-41.2	173.9	-62.1	-67.5	-79.8	0	0	110.7	A784 D790 C791 L795 V796 H797	A784-M793 HydrophobicContact CB-CG 4.06Å; A784-M793 HydrophobicContact CB-SD 3.53Å; A784-M793 VanDerWaalsContact CB-SD 3.53Å; D790-M793 WeakPolarHBondContact O-CA 3.37Å; D790-M793 WeakPolarHBondContact O-CB 3.34Å; D790-M793 PolarHBondContact O-N 3.1Å; C791-M793 VanDerWaalsContact C-N 3.32Å; C791-M793 PolarHBondContact O-N 2.87Å; M793-L795 VanDerWaalsContact C-N 3.32Å; M793-L795 PolarHBondContact O-N 3.28Å; M793-V796 PolarHBondContact O-N 3.38Å; M793-V796 VanDerWaalsContact O-N 3.11Å; M793-H797 PolarHBondContact O-CD2 3.17Å; M793-H797 PolarHBondContact O-N 3.2Å
794	N	74.4	Confident	67.9	Low	73 Å²	73	75.1 Å²	75.1	39%	0.39	38%	0.384	S	S	.	.	H	α-helix	trans	-56.6	-44.1	175.8	-67.8	-14.2	0	0	0	112.1	E683 D790 C791 H797 R798	E683-N794 WeakPolarHBondContact OE2-CB 3.47Å; D790-N794 PolarHBondContact O-N 3.32Å; C791-N794 PolarHBondContact O-N 3.34Å; N794-H797 PolarHBondContact O-N 3.17Å; N794-R798 WeakPolarHBondContact O-CG 3.43Å; N794-R798 PolarHBondContact O-N 3.39Å
795	L	76.1	Confident	68.3	Low	0 Å²	0	75 Å²	75	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-60.4	-45.4	174.4	178.6	63.9	0	0	0	112.4	L676 Y679 M721 I780 C791 M793 H797 R798 I799	L676-L795 HydrophobicContact CD1-CD1 4.47Å; L676-L795 HydrophobicContact CD1-CD2 4.2Å; Y679-L795 HydrophobicContact CD1-CB 4.42Å; Y679-L795 HydrophobicContact CD1-CD1 4.1Å; Y679-L795 HydrophobicContact CD1-CD2 3.77Å; Y679-L795 HydrophobicContact CD1-CG 4.32Å; Y679-L795 HydrophobicContact CD2-CB 3.88Å; Y679-L795 HydrophobicContact CD2-CD1 4.41Å; Y679-L795 HydrophobicContact CE1-CB 4.48Å; Y679-L795 HydrophobicContact CE1-CD2 3.79Å; Y679-L795 HydrophobicContact CE2-CB 3.97Å; Y679-L795 HydrophobicContact CG-CB 4.1Å; Y679-L795 HydrophobicContact CG-CD1 3.84Å; Y679-L795 HydrophobicContact CG-CD2 4.22Å; Y679-L795 HydrophobicContact CG-CG 4.27Å; M721-L795 HydrophobicContact CE-CD2 3.26Å; I780-L795 HydrophobicContact CD1-CD2 3.82Å; C791-L795 PolarHBondContact O-N 3.05Å; M793-L795 VanDerWaalsContact C-N 3.32Å; M793-L795 PolarHBondContact O-N 3.28Å; L795-H797 VanDerWaalsContact C-N 3.33Å; L795-H797 PolarHBondContact O-N 2.78Å; L795-R798 PolarHBondContact O-N 3.02Å; L795-I799 HydrophobicContact CD1-CD1 3.62Å; L795-I799 HydrophobicContact CD1-CG1 3.97Å; L795-I799 HydrophobicContact CG-CD1 3.93Å; L795-I799 HydrophobicContact CG-CG1 4.5Å; L795-I799 WeakPolarHBondContact O-CG1 3.31Å; L795-I799 PolarHBondContact O-N 3.49Å
796	V	75.6	Confident	68.3	Low	9 Å²	9	68.4 Å²	68.4	6%	0.055	36%	0.356	C	S	.	.	H	α-helix	trans	-60.3	-43.6	177.2	169.7	0	0	0	0	110.7	L777 I780 N781 F792 M793 N800	L777-V796 HydrophobicContact CD2-CG1 4.49Å; L777-V796 HydrophobicContact CD2-CG2 4.34Å; I780-V796 HydrophobicContact CB-CG2 4.02Å; I780-V796 HydrophobicContact CG2-CG2 3.56Å; N781-V796 WeakPolarHBondContact ND2-CG1 3.35Å; F792-V796 WeakPolarHBondContact O-CG2 3.41Å; F792-V796 PolarHBondContact O-N 3.45Å; M793-V796 PolarHBondContact O-N 3.38Å; M793-V796 VanDerWaalsContact O-N 3.11Å; V796-N800 VanDerWaalsContact O-CB 3.29Å; V796-N800 WeakPolarHBondContact O-CB 3.46Å; V796-N800 PolarHBondContact O-N 2.71Å
797	H	75.8	Confident	68.2	Low	117 Å²	117	65.8 Å²	65.8	54%	0.542	35%	0.35	S	S	.	.	H	α-helix	trans	-69.3	-30.1	178.1	-68	-55.6	0	0	0	113.5	M793 N794 L795 N800 F801	M793-H797 PolarHBondContact O-CD2 3.17Å; M793-H797 PolarHBondContact O-N 3.2Å; N794-H797 PolarHBondContact O-N 3.17Å; L795-H797 VanDerWaalsContact C-N 3.33Å; L795-H797 PolarHBondContact O-N 2.78Å; H797-N800 CarbonylContact O-C 3.6Å; H797-F801 WeakPolarHBondContact O-CA 3.32Å; H797-F801 PolarHBondContact O-N 3.22Å
798	R	76.8	Confident	68.4	Low	74 Å²	74	67.2 Å²	67.2	28%	0.279	36%	0.355	S	S	.	.	H	α-helix	trans	-71.6	-46	172.1	-76.9	179	179.5	-91.4	1.9	112.9	Y678 E683 N794 L795	Y678-R798 PolarHBondContact OH-NH2 2.9Å; E683-R798 IonicContact OE1-CZ 2.65Å; E683-R798 IonicContact OE1-NE 2.76Å; E683-R798 PolarHBondContact OE1-NE 3.46Å; E683-R798 IonicContact OE1-NH2 2.99Å; E683-R798 PolarHBondContact OE1-NH2 3.03Å; E683-R798 IonicContact OE2-NE 2.66Å; N794-R798 WeakPolarHBondContact O-CG 3.43Å; N794-R798 PolarHBondContact O-N 3.39Å; L795-R798 PolarHBondContact O-N 3.02Å
799	I	75.2	Confident	69.1	Low	7 Å²	7	61.7 Å²	61.7	4%	0.036	32%	0.319	C	S	.	.	H	α-helix	trans	-71.7	-40	-179.9	-65.9	177.1	0	0	0	110.9	N675 L773 F776 L777 L795 F801	N675-I799 HydrophobicContact CB-CG1 4.23Å; L773-I799 HydrophobicContact CD1-CG2 3.96Å; F776-I799 HydrophobicContact CE1-CD1 4.18Å; L777-I799 HydrophobicContact CD1-CG2 4.1Å; L777-I799 HydrophobicContact CD2-CB 4.09Å; L777-I799 HydrophobicContact CD2-CG2 3.9Å; L777-I799 HydrophobicContact CG-CG2 4.31Å; L795-I799 HydrophobicContact CD1-CD1 3.62Å; L795-I799 HydrophobicContact CD1-CG1 3.97Å; L795-I799 HydrophobicContact CG-CD1 3.93Å; L795-I799 HydrophobicContact CG-CG1 4.5Å; L795-I799 WeakPolarHBondContact O-CG1 3.31Å; L795-I799 PolarHBondContact O-N 3.49Å; I799-F801 VanDerWaalsContact C-N 3.3Å; I799-F801 PolarHBondContact O-N 3.31Å
800	N	75.5	Confident	69.3	Low	24 Å²	24	64.6 Å²	64.6	13%	0.128	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	43.3	174	-166.4	22.4	0	0	0	112	V796 H797 A803 F804 Y805 T806	V796-N800 VanDerWaalsContact O-CB 3.29Å; V796-N800 WeakPolarHBondContact O-CB 3.46Å; V796-N800 PolarHBondContact O-N 2.71Å; H797-N800 CarbonylContact O-C 3.6Å; N800-A803 PolarHBondContact O-N 2.91Å; N800-A803 WeakPolarHBondContact OD1-CA 3.41Å; N800-A803 PolarHBondContact OD1-O 3.37Å; N800-F804 PolarHBondContact OD1-N 3.46Å; N800-F804 VanDerWaalsContact OD1-N 3.14Å; N800-Y805 PolarHBondContact OD1-N 2.96Å; N800-T806 PolarHBondContact ND2-OG1 2.96Å
801	F	67.9	Low	69.3	Low	137 Å²	137	65.1 Å²	65.1	60%	0.601	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-57.9	139.3	177.7	-173.4	-102.9	0	0	0	111.2	H797 I799 A803 F804	H797-F801 WeakPolarHBondContact O-CA 3.32Å; H797-F801 PolarHBondContact O-N 3.22Å; I799-F801 VanDerWaalsContact C-N 3.3Å; I799-F801 PolarHBondContact O-N 3.31Å; F801-A803 PolarHBondContact O-N 2.79Å; F801-A803 VanDerWaalsContact O-N 3.1Å; F801-F804 PolarHBondContact O-N 2.99Å
802	N	63.3	Low	68.9	Low	137 Å²	137	65.2 Å²	65.2	73%	0.733	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	49.2	29.7	-171.7	-69.9	-10.8	0	0	0	114.4	F804	N802-F804 PolarHBondContact O-N 2.84Å; N802-F804 VanDerWaalsContact O-N 3.11Å
803	A	66	Low	68.1	Low	55 Å²	55	67.9 Å²	67.9	46%	0.455	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	59.7	18.6	177.4	0	0	0	0	0	115.2	N800 F801 Y805 T806	N800-A803 PolarHBondContact O-N 2.91Å; N800-A803 WeakPolarHBondContact OD1-CA 3.41Å; N800-A803 PolarHBondContact OD1-O 3.37Å; F801-A803 PolarHBondContact O-N 2.79Å; F801-A803 VanDerWaalsContact O-N 3.1Å; A803-Y805 PolarHBondContact O-N 3.2Å; A803-T806 WeakPolarHBondContact CA-OG1 3.36Å; A803-T806 WeakPolarHBondContact CB-OG1 3.3Å; A803-T806 VanDerWaalsContact O-CB 3.31Å; A803-T806 WeakPolarHBondContact O-CB 3.28Å; A803-T806 PolarHBondContact O-N 3.31Å; A803-T806 PolarHBondContact O-OG1 2.88Å
804	F	73.3	Confident	66.9	Low	127 Å²	127	68.5 Å²	68.5	56%	0.557	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-32.3	-171.5	-179.1	-92.8	0	0	0	115.6	N800 F801 N802	N800-F804 PolarHBondContact OD1-N 3.46Å; N800-F804 VanDerWaalsContact OD1-N 3.14Å; F801-F804 PolarHBondContact O-N 2.99Å; N802-F804 PolarHBondContact O-N 2.84Å; N802-F804 VanDerWaalsContact O-N 3.11Å
805	Y	74.6	Confident	65.7	Low	11 Å²	11	71.3 Å²	71.3	4%	0.043	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-7.2	179.7	-67.2	-66.4	0	0	0	114	R668 L773 N800 A803 D807 Q808 M809	R668-Y805 PolarHBondContact NE-OH 2.65Å; R668-Y805 VanDerWaalsContact NE-OH 3.09Å; L773-Y805 HydrophobicContact CD2-CD2 4.36Å; L773-Y805 HydrophobicContact CD2-CE1 3.98Å; L773-Y805 HydrophobicContact CD2-CE2 3.73Å; N800-Y805 PolarHBondContact OD1-N 2.96Å; A803-Y805 PolarHBondContact O-N 3.2Å; Y805-D807 PolarHBondContact O-N 3.25Å; Y805-Q808 WeakPolarHBondContact O-CA 3.27Å; Y805-Q808 WeakPolarHBondContact O-CB 3.42Å; Y805-Q808 PolarHBondContact O-N 3.31Å; Y805-M809 WeakPolarHBondContact O-CG 3.35Å; Y805-M809 PolarHBondContact O-N 3.14Å
806	T	69.1	Low	64.2	Low	42 Å²	42	76.8 Å²	76.8	26%	0.258	39%	0.39	S	S	.	.	H	α-helix	trans	-62.4	-47.8	-170.1	-41.3	0	0	0	0	112	N800 A803 Q808 M809 D810	N800-T806 PolarHBondContact ND2-OG1 2.96Å; A803-T806 WeakPolarHBondContact CA-OG1 3.36Å; A803-T806 WeakPolarHBondContact CB-OG1 3.3Å; A803-T806 VanDerWaalsContact O-CB 3.31Å; A803-T806 WeakPolarHBondContact O-CB 3.28Å; A803-T806 PolarHBondContact O-N 3.31Å; A803-T806 PolarHBondContact O-OG1 2.88Å; T806-Q808 PolarHBondContact O-N 3.29Å; T806-M809 WeakPolarHBondContact O-CB 3.33Å; T806-M809 PolarHBondContact O-N 3.02Å; T806-D810 PolarHBondContact O-N 2.76Å
807	D	62.3	Low	62.6	Low	111 Å²	111	80 Å²	80	59%	0.594	42%	0.418	S	S	*	.	H	α-helix	trans	-54.9	-23.4	173.4	-75.8	28.6	0	0	0	114.5	Y805 K811	Y805-D807 PolarHBondContact O-N 3.25Å; D807-K811 WeakPolarHBondContact O-CD 3.36Å; D807-K811 WeakPolarHBondContact O-CE 3.29Å; D807-K811 VanDerWaalsContact O-CG 3.24Å; D807-K811 WeakPolarHBondContact O-CG 3.44Å
808	Q	64.4	Low	61	Low	74 Å²	74	81.1 Å²	81.1	35%	0.346	43%	0.426	S	S	.	.	H	α-helix	trans	-95	-35.3	178.3	-60.7	-177.9	-14.4	0	0	111.4	T770 I774 Y805 T806 D810 M812	T770-Q808 VanDerWaalsContact CG2-OE1 3.25Å; I774-Q808 HydrophobicContact CD1-CB 3.59Å; Y805-Q808 WeakPolarHBondContact O-CA 3.27Å; Y805-Q808 WeakPolarHBondContact O-CB 3.42Å; Y805-Q808 PolarHBondContact O-N 3.31Å; T806-Q808 PolarHBondContact O-N 3.29Å; Q808-D810 VanDerWaalsContact C-N 3.35Å; Q808-M812 PolarHBondContact O-N 3.09Å
809	M	61.3	Low	59	Low	25 Å²	25	83.7 Å²	83.7	12%	0.123	48%	0.476	C	S	.	.	H	α-helix	trans	-58.7	-48	169.6	-68.5	179.4	62.5	0	0	110.4	I774 L777 Y805 T806 M812 C813	I774-M809 HydrophobicContact CG1-CG 4.13Å; I774-M809 HydrophobicContact CG2-CB 4.49Å; I774-M809 HydrophobicContact CG2-CG 3.93Å; L777-M809 HydrophobicContact CB-CE 4.33Å; L777-M809 HydrophobicContact CB-SD 4.39Å; L777-M809 HydrophobicContact CD1-SD 4.28Å; Y805-M809 WeakPolarHBondContact O-CG 3.35Å; Y805-M809 PolarHBondContact O-N 3.14Å; T806-M809 WeakPolarHBondContact O-CB 3.33Å; T806-M809 PolarHBondContact O-N 3.02Å; M809-M812 PolarHBondContact O-N 3.18Å; M809-C813 WeakPolarHBondContact O-CB 3.44Å; M809-C813 PolarHBondContact O-N 2.8Å; M809-C813 PolarHBondContact O-SG 2.95Å
810	D	60.6	Low	58.2	Low	93 Å²	93	87.5 Å²	87.5	50%	0.497	50%	0.498	S	S	.	.	H	α-helix	trans	-66.9	-39.7	-177.8	-69.4	-20.2	0	0	0	112.3	T806 Q808 C813 V814	T806-D810 PolarHBondContact O-N 2.76Å; Q808-D810 VanDerWaalsContact C-N 3.35Å; D810-C813 WeakPolarHBondContact O-CB 3.37Å; D810-C813 PolarHBondContact O-N 3.1Å; D810-C813 VanDerWaalsContact O-N 3.12Å; D810-V814 WeakPolarHBondContact O-CG2 3.38Å; D810-V814 PolarHBondContact O-N 2.85Å
811	K	59.7	Low	57.3	Low	134 Å²	134	90.8 Å²	90.8	58%	0.583	52%	0.517	S	S	*	.	H	α-helix	trans	-60.5	-47.5	174.9	-76	168.1	-168.8	148.4	0	112	D807 C813 V814 E815	D807-K811 WeakPolarHBondContact O-CD 3.36Å; D807-K811 WeakPolarHBondContact O-CE 3.29Å; D807-K811 VanDerWaalsContact O-CG 3.24Å; D807-K811 WeakPolarHBondContact O-CG 3.44Å; K811-C813 VanDerWaalsContact C-N 3.28Å; K811-C813 PolarHBondContact O-N 3.46Å; K811-V814 PolarHBondContact O-N 3.48Å; K811-V814 VanDerWaalsContact O-N 3.16Å; K811-E815 PolarHBondContact O-N 3.32Å; K811-E815 VanDerWaalsContact O-N 3.12Å
812	M	54.4	Low	56.7	Low	44 Å²	44	88.3 Å²	88.3	22%	0.217	51%	0.513	C	S	.	.	H	α-helix	trans	-73.7	-17.4	175.4	-63.3	-157.5	-52.6	0	0	113	Q771 I774 K778 Q808 M809 D816	Q771-M812 HydrophobicContact CG-SD 4.33Å; I774-M812 HydrophobicContact CB-CE 3.59Å; I774-M812 HydrophobicContact CD1-CE 3.8Å; I774-M812 HydrophobicContact CG1-CE 4.3Å; I774-M812 HydrophobicContact CG2-CE 3.31Å; K778-M812 PolarHBondContact NZ-O 3.41Å; Q808-M812 PolarHBondContact O-N 3.09Å; M809-M812 PolarHBondContact O-N 3.18Å; M812-D816 VanDerWaalsContact O-CB 3.31Å; M812-D816 WeakPolarHBondContact O-CB 3.48Å; M812-D816 PolarHBondContact O-N 2.81Å
813	C	51.9	Low	56.3	Low	58 Å²	58	85.4 Å²	85.4	39%	0.392	50%	0.5	S	S	.	.	H	α-helix	trans	-73	-29.7	167.6	-73.9	0	0	0	0	112.5	K778 M809 D810 K811 A817	K778-C813 WeakPolarHBondContact CE-SG 3.03Å; M809-C813 WeakPolarHBondContact O-CB 3.44Å; M809-C813 PolarHBondContact O-N 2.8Å; M809-C813 PolarHBondContact O-SG 2.95Å; D810-C813 WeakPolarHBondContact O-CB 3.37Å; D810-C813 PolarHBondContact O-N 3.1Å; D810-C813 VanDerWaalsContact O-N 3.12Å; K811-C813 VanDerWaalsContact C-N 3.28Å; K811-C813 PolarHBondContact O-N 3.46Å; C813-A817 VanDerWaalsContact O-CB 3.29Å; C813-A817 WeakPolarHBondContact O-CB 3.47Å; C813-A817 PolarHBondContact O-N 3.48Å
814	V	47.2	Very low	55.7	Low	86 Å²	86	87.3 Å²	87.3	52%	0.521	50%	0.502	S	S	.	.	H	α-helix	trans	-72.7	-39.5	172.2	172.6	0	0	0	0	110.6	D810 K811 A817 I818	D810-V814 WeakPolarHBondContact O-CG2 3.38Å; D810-V814 PolarHBondContact O-N 2.85Å; K811-V814 PolarHBondContact O-N 3.48Å; K811-V814 VanDerWaalsContact O-N 3.16Å; V814-A817 PolarHBondContact O-N 3.35Å; V814-I818 HydrophobicContact CG1-CD1 3.7Å; V814-I818 WeakPolarHBondContact O-CD1 3.24Å; V814-I818 VanDerWaalsContact O-CG1 3.3Å; V814-I818 WeakPolarHBondContact O-CG1 3.34Å; V814-I818 PolarHBondContact O-N 3.14Å
815	E	47.9	Very low	54.6	Low	132 Å²	132	84.7 Å²	84.7	62%	0.617	50%	0.499	S	S	*	.	H	α-helix	trans	-65.2	-46	174.1	-66.8	173	153.8	0	0	111.9	K811 A817 I818 G819	K811-E815 PolarHBondContact O-N 3.32Å; K811-E815 VanDerWaalsContact O-N 3.12Å; E815-A817 PolarHBondContact O-N 2.55Å; E815-A817 VanDerWaalsContact O-N 3.07Å; E815-I818 PolarHBondContact O-N 2.71Å; E815-G819 PolarHBondContact O-N 2.95Å
816	D	45.1	Very low	53.1	Low	115 Å²	115	89.9 Å²	89.9	62%	0.615	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-13	173.3	-75.8	-15.9	0	0	0	114	K778 M812	K778-D816 IonicContact NZ-OD2 3.45Å; K778-D816 PolarHBondContact NZ-OD2 2.91Å; M812-D816 VanDerWaalsContact O-CB 3.31Å; M812-D816 WeakPolarHBondContact O-CB 3.48Å; M812-D816 PolarHBondContact O-N 2.81Å
817	A	42.2	Very low	51.9	Low	78 Å²	78	93.6 Å²	93.6	65%	0.645	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	2.8	-178.3	0	0	0	0	0	113.8	C813 V814 E815	C813-A817 VanDerWaalsContact O-CB 3.29Å; C813-A817 WeakPolarHBondContact O-CB 3.47Å; C813-A817 PolarHBondContact O-N 3.48Å; V814-A817 PolarHBondContact O-N 3.35Å; E815-A817 PolarHBondContact O-N 2.55Å; E815-A817 VanDerWaalsContact O-N 3.07Å
818	I	43	Very low	51	Low	139 Å²	139	92.2 Å²	92.2	71%	0.713	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.7	-13.4	179.7	-69.5	170.9	0	0	0	111.7	V814 E815	V814-I818 HydrophobicContact CG1-CD1 3.7Å; V814-I818 WeakPolarHBondContact O-CD1 3.24Å; V814-I818 VanDerWaalsContact O-CG1 3.3Å; V814-I818 WeakPolarHBondContact O-CG1 3.34Å; V814-I818 PolarHBondContact O-N 3.14Å; E815-I818 PolarHBondContact O-N 2.71Å
819	G	34.9	Very low	49.8	Very low	128 Å²	128	93.8 Å²	93.8	100%	1.32	57%	0.567	S	S	*	*			trans	-95.3	0	169.9	0	0	0	0	0	114	E815	E815-G819 PolarHBondContact O-N 2.95Å

Retrieved 819 of 819 residues in 319.7 ms (Link to these results)

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