A0A077ZEB0_TRITR Loading...

Kinase suppressor of ras

AlphaFold DB , UniProt , Accession A0A077ZEB0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,119 aa.

						>A0A077ZEB0_TRITR|A0A077ZEB0
MCVNVDFFLIDRIDFQAAAGWLRRKVGVLLPGGSMSSLYDALSCESTSSAEELKQAYRRALLLTHPDRSNEAVDSYLFQKVVQAWTILRDPVSRRAYDCWLREQRLRRKCCLNSGKCTLLELLGKDFSRGSVSIECHCGGCYLLSLKDQQYGCDFKLFGSVCWPMGDDSLCALLQELNDTQYIVRVNAENLRKHRAQNNVVFSEIEPFLKEREGKLVKLVSRILFLKSKVLACRKECNLSSFGGLHLWLEIVNLDQRSAQASCLCLLDELQDVDELLTLDDAQLFALCDRCSVKGEDRRRFVRAAQNLRWYASHWMFNSGTKPKEEPPDADLAWIGFDRFERCSQASKSPQLGASQGLAVDSSRLPANGGSDQGGADSGASDSGVGSNISQNSLPTVTPPSSPGLILTNPLAYDLNMAISNGQDEDKLLLSGQAAQPASVLLKSSSSSCSTCAPNDCVPHMIRSRSHESNLPKKIVRGKPTPINPLVDSGAVMRKAGVYLNSIVSGGLGGSKGADLGSYAKSKSSCLFHNSNGPTTGTDPAGSSAAVSPDSGCESCSTSTYAPRSPRGNVRMLHNINHRFVRMWKPSMSQCHVCSRPLGLTGERCSDCKMKIHSVCKEKIGPTCGLTARRMRQIYELLVLGNEEGSWDVSSEEKRSPQPAQSGKIPSSVSNSYLNAYPDRFDSASSSSCNSSAPSTPAPAVAAFVHSPGVSIQHRPKFSFTDVMPEVPVINIELQNGVAESRESEENGSAGSTLVMSRDGSFAGTGSEQTLSPDENLIDSLGSNDSTFGGHQWRRDVWSAGTIRGGSASWREWTIPIEEVRFKKDSLIGRGRFGEVHAAYWHQDVAVKLLNMDHVEDEKQLEMFKVEVSTFRSTRHENLILFMGCCMKPPRLGIVMNLCKGRTLHTILHVRRERWDLGRFVNVAAQVCQGMSYLHGKKIIHKDLRTKNVFIENNSKVVITDFGLFSIHRLLRSQNHADCKFLSVPEHWLAYLAPEVMRSLLKFKENGDGVEELPFSGPSDVYSFGTVWFELLAGDFPFKRYAPETIIWQVGRGIKPALNNLQVPKETKEICMSCWAFRLGDRPSFNTLLKVFEKLPRKRLERSPSYPSSHVSRSAESLF
					

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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	28	Very low	29.6	Very low	234 Å²	234	143.4 Å²	143.4	100%	1.153	76%	0.757	S	S	*	*				0	141.8	0	-72.5	172	169.4	0	0	108
2	C	24.9	Very low	30.4	Very low	134 Å²	134	149.1 Å²	149.1	91%	0.905	76%	0.76	S	S	*	*			trans	40.9	75.7	168.7	-54.3	0	0	0	0	117
3	V	31.9	Very low	31.1	Very low	126 Å²	126	143 Å²	143	76%	0.764	73%	0.73	S	S	*	*			trans	-86.9	116	161.1	179	0	0	0	0	108	V5	V3-V5 PolarHBondContact O-N 3.07Å
4	N	28.3	Very low	31.8	Very low	145 Å²	145	139.2 Å²	139.2	78%	0.775	71%	0.712	S	S	*	*			trans	-71.5	119.3	165.9	-94.3	-7.5	0	0	0	108.5	D6	N4-D6 PolarHBondContact O-N 2.8Å
5	V	28	Very low	32.5	Very low	116 Å²	116	136.8 Å²	136.8	70%	0.703	69%	0.694	S	S	*	*			trans	-90.2	86	175.8	-176.6	0	0	0	0	108.4	V3	V3-V5 PolarHBondContact O-N 3.07Å
6	D	28.4	Very low	33	Very low	128 Å²	128	138.4 Å²	138.4	68%	0.684	70%	0.699	S	S	*	*			trans	-63.8	136.4	174	-87.3	-54.6	0	0	0	111.3	N4 F8	N4-D6 PolarHBondContact O-N 2.8Å; D6-F8 PolarHBondContact O-N 3.06Å
7	F	27.6	Very low	33.6	Very low	191 Å²	191	133.8 Å²	133.8	84%	0.838	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	1	-162.4	-110.6	-112	0	0	0	116.3
8	F	27.3	Very low	34.3	Very low	161 Å²	161	127.7 Å²	127.7	71%	0.706	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-14.6	-166.9	-94.3	-92.6	0	0	0	116.1	D6 I10 H976	D6-F8 PolarHBondContact O-N 3.06Å; F8-I10 PolarHBondContact O-N 3.45Å; F8-H976 AromaticContact CE1-CE1 3.64Å; F8-H976 AromaticContact CZ-CE1 3.48Å; F8-H976 VanDerWaalsContact CZ-CE1 3.48Å; F8-H976 WeakPolarHBondContact CZ-CE1 3.33Å; F8-H976 AromaticContact CZ-NE2 3.56Å
9	L	30.3	Very low	34.6	Very low	147 Å²	147	121.4 Å²	121.4	77%	0.77	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-82.7	-6.6	-173.7	-96.2	147.9	0	0	0	115.2	R12	L9-R12 PolarHBondContact O-N 2.8Å
10	I	33	Very low	35.2	Very low	71 Å²	71	116.5 Å²	116.5	36%	0.364	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-86.8	-6.9	-170.3	-50.9	-179.9	0	0	0	113.3	F8 R12 I13 R58	F8-I10 PolarHBondContact O-N 3.45Å; I10-R12 VanDerWaalsContact C-N 3.34Å; I10-I13 HydrophobicContact CG2-CD1 4.34Å; I10-R58 HydrophobicContact CG2-CG 4.42Å; I10-R58 PolarHBondContact O-NH2 3.05Å; I10-R58 VanDerWaalsContact O-NH2 3.14Å
11	D	37.6	Very low	36.2	Very low	124 Å²	124	115 Å²	115	66%	0.663	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-86.1	-3.8	170	-89.4	-13.5	0	0	0	113.3	R58	D11-R58 IonicContact OD1-CZ 3.13Å; D11-R58 IonicContact OD1-NH2 2.66Å; D11-R58 PolarHBondContact OD1-NH2 2.87Å
12	R	39.4	Very low	37.1	Very low	212 Å²	212	104.4 Å²	104.4	80%	0.8	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-123.6	48.5	173.7	-81.1	-174.1	163.9	-168.9	-4.6	112.1	L9 I10 D14	L9-R12 PolarHBondContact O-N 2.8Å; I10-R12 VanDerWaalsContact C-N 3.34Å; R12-D14 PolarHBondContact O-N 3.31Å; R12-D14 VanDerWaalsContact O-N 3.12Å
13	I	39.3	Very low	38.3	Very low	70 Å²	70	105.7 Å²	105.7	36%	0.359	53%	0.529	S	S	.	.			trans	-60.2	118.3	165.1	-63.9	177.3	0	0	0	107.8	I10 F15 L61	I10-I13 HydrophobicContact CG2-CD1 4.34Å; I13-F15 WeakPolarHBondContact O-CD2 3.35Å; I13-F15 PolarHBondContact O-N 2.78Å; I13-L61 HydrophobicContact CD1-CD1 4.21Å
14	D	41.7	Very low	39.3	Very low	90 Å²	90	109.2 Å²	109.2	48%	0.481	53%	0.529	S	S	.	.			trans	-66.6	102.8	174.2	177.2	2.9	0	0	0	109.6	R12 Q16 A17 A18	R12-D14 PolarHBondContact O-N 3.31Å; R12-D14 VanDerWaalsContact O-N 3.12Å; D14-Q16 PolarHBondContact O-N 3.34Å; D14-Q16 WeakPolarHBondContact OD1-CA 3.45Å; D14-Q16 VanDerWaalsContact OD1-CB 3.3Å; D14-Q16 WeakPolarHBondContact OD1-CB 3.34Å; D14-Q16 PolarHBondContact OD1-N 3.1Å; D14-A17 HydrophobicContact CB-CB 3.88Å; D14-A17 PolarHBondContact O-N 3Å; D14-A17 PolarHBondContact OD1-N 3.27Å; D14-A17 VanDerWaalsContact OD2-CB 3.32Å; D14-A17 WeakPolarHBondContact OD2-CB 3.33Å; D14-A17 PolarHBondContact OD2-N 3.09Å; D14-A18 PolarHBondContact O-N 2.62Å
15	F	42.8	Very low	40.4	Very low	103 Å²	103	109.4 Å²	109.4	45%	0.452	52%	0.523	S	S	.	.	H	α-helix	trans	-61.6	-24.6	177.1	-81	-92.3	0	0	0	112.5	I13 A19	I13-F15 WeakPolarHBondContact O-CD2 3.35Å; I13-F15 PolarHBondContact O-N 2.78Å; F15-A19 WeakPolarHBondContact O-CB 3.12Å; F15-A19 PolarHBondContact O-N 3.41Å
16	Q	39.3	Very low	41.3	Very low	163 Å²	163	106.1 Å²	106.1	76%	0.762	50%	0.503	S	S	*	.	H	α-helix	trans	-76.1	-45.3	174	-60.9	-173.7	-50.5	0	0	111.3	D14 A19 G20	D14-Q16 PolarHBondContact O-N 3.34Å; D14-Q16 WeakPolarHBondContact OD1-CA 3.45Å; D14-Q16 VanDerWaalsContact OD1-CB 3.3Å; D14-Q16 WeakPolarHBondContact OD1-CB 3.34Å; D14-Q16 PolarHBondContact OD1-N 3.1Å; Q16-A19 CarbonylContact O-C 3.56Å; Q16-A19 PolarHBondContact O-N 2.97Å; Q16-G20 PolarHBondContact O-N 2.91Å
17	A	43.6	Very low	41.6	Very low	59 Å²	59	104 Å²	104	49%	0.488	51%	0.512	S	S	.	.	H	α-helix	trans	-58.9	-47.8	174	0	0	0	0	0	111.9	D14 G20 W21	D14-A17 HydrophobicContact CB-CB 3.88Å; D14-A17 PolarHBondContact O-N 3Å; D14-A17 PolarHBondContact OD1-N 3.27Å; D14-A17 VanDerWaalsContact OD2-CB 3.32Å; D14-A17 WeakPolarHBondContact OD2-CB 3.33Å; D14-A17 PolarHBondContact OD2-N 3.09Å; A17-G20 PolarHBondContact O-N 3.08Å; A17-W21 PolarHBondContact O-N 3.28Å
18	A	45.4	Very low	42.2	Very low	25 Å²	25	99.9 Å²	99.9	21%	0.207	50%	0.502	C	S	.	.	H	α-helix	trans	-61.6	-45.2	175.6	0	0	0	0	0	112	D14 G20 W21 L22	D14-A18 PolarHBondContact O-N 2.62Å; A18-G20 VanDerWaalsContact C-N 3.25Å; A18-G20 PolarHBondContact O-N 2.93Å; A18-W21 PolarHBondContact O-N 3.43Å; A18-L22 WeakPolarHBondContact O-CG 3.31Å; A18-L22 PolarHBondContact O-N 3.05Å
19	A	40.6	Very low	42.7	Very low	7 Å²	7	98.1 Å²	98.1	6%	0.058	50%	0.499	C	S	.	.	H	α-helix	trans	-66.1	-24.3	175.7	0	0	0	0	0	113.8	F15 Q16 R23 W85	F15-A19 WeakPolarHBondContact O-CB 3.12Å; F15-A19 PolarHBondContact O-N 3.41Å; Q16-A19 CarbonylContact O-C 3.56Å; Q16-A19 PolarHBondContact O-N 2.97Å; A19-R23 VanDerWaalsContact O-CB 3.31Å; A19-R23 WeakPolarHBondContact O-CB 3.47Å; A19-R23 WeakPolarHBondContact O-CG 3.48Å; A19-R23 PolarHBondContact O-N 3.37Å; A19-R23 PolarHBondContact O-NE 3.3Å; A19-W85 HydrophobicContact CB-CZ2 3.63Å
20	G	47	Very low	43.1	Very low	24 Å²	24	96.9 Å²	96.9	25%	0.247	49%	0.493	C	S	.	.	H	α-helix	trans	-77.9	-33	173.3	0	0	0	0	0	112.6	Q16 A17 A18 R24	Q16-G20 PolarHBondContact O-N 2.91Å; A17-G20 PolarHBondContact O-N 3.08Å; A18-G20 VanDerWaalsContact C-N 3.25Å; A18-G20 PolarHBondContact O-N 2.93Å; G20-R24 PolarHBondContact O-NE 2.91Å; G20-R24 PolarHBondContact O-NH2 2.81Å
21	W	55.8	Low	43.4	Very low	84 Å²	84	99.2 Å²	99.2	32%	0.318	51%	0.512	S	S	.	.	H	α-helix	trans	-71	-50.9	170.3	-176.6	85.3	0	0	0	111.5	A17 A18 R23 R24 K25 F78	A17-W21 PolarHBondContact O-N 3.28Å; A18-W21 PolarHBondContact O-N 3.43Å; W21-R23 PolarHBondContact O-N 2.97Å; W21-R24 PolarHBondContact O-N 2.91Å; W21-K25 PolarHBondContact O-N 2.66Å; W21-F78 AromaticContact CH2-CE2 3.9Å; W21-F78 HydrophobicContact CH2-CE2 3.9Å; W21-F78 AromaticContact CZ3-CE2 3.93Å; W21-F78 HydrophobicContact CZ3-CE2 3.93Å
22	L	48.1	Very low	43.8	Very low	13 Å²	13	96.6 Å²	96.6	7%	0.068	51%	0.514	C	S	.	.	H	α-helix	trans	-56.6	-45.8	179.2	-72	171.8	0	0	0	112.3	A18 R24 K25 V26 V82 W85	A18-L22 WeakPolarHBondContact O-CG 3.31Å; A18-L22 PolarHBondContact O-N 3.05Å; L22-R24 PolarHBondContact O-N 3.5Å; L22-K25 PolarHBondContact O-N 3.09Å; L22-V26 PolarHBondContact O-N 3.31Å; L22-V82 HydrophobicContact CD2-CG2 4.24Å; L22-W85 HydrophobicContact CD1-CB 4.29Å; L22-W85 HydrophobicContact CD1-CD2 3.73Å; L22-W85 HydrophobicContact CD1-CE3 4.25Å; L22-W85 HydrophobicContact CD1-CG 3.73Å
23	R	48.5	Very low	44.5	Very low	161 Å²	161	87.4 Å²	87.4	61%	0.608	49%	0.486	S	S	*	.	H	α-helix	trans	-62.7	-21.5	177	-84.9	-174.5	-89.1	-163.4	-6.1	114.9	A19 W21	A19-R23 VanDerWaalsContact O-CB 3.31Å; A19-R23 WeakPolarHBondContact O-CB 3.47Å; A19-R23 WeakPolarHBondContact O-CG 3.48Å; A19-R23 PolarHBondContact O-N 3.37Å; A19-R23 PolarHBondContact O-NE 3.3Å; W21-R23 PolarHBondContact O-N 2.97Å
24	R	53.8	Low	45.4	Very low	200 Å²	200	86.7 Å²	86.7	76%	0.755	49%	0.487	S	S	*	.	H	α-helix	trans	-87.2	-13.6	174.5	-75.6	177.2	-72.3	-170.6	0.3	113.2	G20 W21 L22	G20-R24 PolarHBondContact O-NE 2.91Å; G20-R24 PolarHBondContact O-NH2 2.81Å; W21-R24 PolarHBondContact O-N 2.91Å; L22-R24 PolarHBondContact O-N 3.5Å
25	K	50.6	Low	46.5	Very low	149 Å²	149	84.3 Å²	84.3	65%	0.648	47%	0.473	S	S	*	.	H	α-helix	trans	-106	-30.7	-179.7	-93.9	-77.4	-173.8	171.6	0	114	W21 L22 F78	W21-K25 PolarHBondContact O-N 2.66Å; L22-K25 PolarHBondContact O-N 3.09Å; K25-F78 HydrophobicContact CB-CZ 4.38Å
26	V	46.4	Very low	47.7	Very low	46 Å²	46	82.7 Å²	82.7	28%	0.279	48%	0.475	S	S	.	.			trans	-134.6	104.5	-175.3	-170.3	0	0	0	0	110.3	L22 V28 F78 V82	L22-V26 PolarHBondContact O-N 3.31Å; V26-V28 HydrophobicContact CG1-CB 4.38Å; V26-V28 PolarHBondContact O-N 2.8Å; V26-V28 VanDerWaalsContact O-N 3.15Å; V26-F78 HydrophobicContact CG2-CE1 3.55Å; V26-F78 HydrophobicContact CG2-CZ 3.62Å; V26-V82 HydrophobicContact CG2-CG2 4.31Å
27	G	36.3	Very low	49.1	Very low	85 Å²	85	76.9 Å²	76.9	88%	0.876	45%	0.453	S	S	*	.			trans	-82.4	31.2	-177.8	0	0	0	0	0	115.2
28	V	39.7	Very low	50.4	Low	103 Å²	103	74.2 Å²	74.2	62%	0.624	43%	0.43	S	S	*	.			trans	-130.6	135.7	-171.6	-175.1	0	0	0	0	110.8	V26	V26-V28 HydrophobicContact CG1-CB 4.38Å; V26-V28 PolarHBondContact O-N 2.8Å; V26-V28 VanDerWaalsContact O-N 3.15Å
29	L	37.3	Very low	52	Low	125 Å²	125	74 Å²	74	65%	0.654	42%	0.424	S	S	*	.			trans	-110	127.4	169.5	-75.9	165.8	0	0	0	109.2
30	L	38.8	Very low	53.8	Low	121 Å²	121	78.6 Å²	78.6	63%	0.634	45%	0.448	S	S	*	.			trans	-105.9	134.6	166.2	-65.6	175.3	0	0	0	108.6	T86	L30-T86 WeakPolarHBondContact O-CG2 3.32Å
31	P	40.3	Very low	55.3	Low	119 Å²	119	77.6 Å²	77.6	77%	0.773	44%	0.437	S	S	*	.			trans	-88.2	146.8	-179	34.2	-33.9	0	0	0	112.5
32	G	45.6	Very low	56.4	Low	69 Å²	69	74.6 Å²	74.6	71%	0.711	43%	0.427	S	S	*	.			trans	61.7	102.1	158.4	0	0	0	0	0	117.3
33	G	53.9	Low	58	Low	19 Å²	19	77.9 Å²	77.9	20%	0.196	45%	0.451	C	S	.	.			trans	-134.2	145.8	168.6	0	0	0	0	0	112.1	S93	G33-S93 PolarHBondContact O-OG 3.21Å
34	S	58.7	Low	59.5	Low	56 Å²	56	71.3 Å²	71.3	39%	0.392	43%	0.43	S	S	.	.			trans	-84.9	173.6	-174.8	72.1	0	0	0	0	112.8	S36 S37 L38	S34-S36 VanDerWaalsContact C-N 3.26Å; S34-S36 PolarHBondContact O-N 3.34Å; S34-S36 WeakPolarHBondContact OG-CB 3.27Å; S34-S36 PolarHBondContact OG-N 3.45Å; S34-S37 PolarHBondContact N-OG 2.75Å; S34-S37 WeakPolarHBondContact O-CB 3.42Å; S34-S37 PolarHBondContact O-N 3.44Å; S34-S37 VanDerWaalsContact O-N 3.13Å; S34-S37 PolarHBondContact OG-N 3.04Å; S34-S37 VanDerWaalsContact OG-N 3.12Å; S34-S37 PolarHBondContact OG-OG 3.33Å; S34-L38 PolarHBondContact O-N 3.36Å; S34-L38 VanDerWaalsContact O-N 3.12Å
35	M	64.8	Low	60.7	Low	39 Å²	39	68.5 Å²	68.5	19%	0.192	43%	0.425	C	S	.	.	H	α-helix	trans	-59.1	-35.6	167	-85	-66.1	-63	0	0	112.5	S37 L38 Y39 A96	M35-S37 VanDerWaalsContact C-N 3.3Å; M35-S37 PolarHBondContact O-N 3.42Å; M35-L38 HydrophobicContact CE-CD2 4.5Å; M35-L38 WeakPolarHBondContact O-CB 3.39Å; M35-L38 PolarHBondContact O-N 2.96Å; M35-L38 VanDerWaalsContact O-N 3.11Å; M35-L38 HydrophobicContact SD-CD2 4Å; M35-Y39 HydrophobicContact CE-CE2 3.89Å; M35-Y39 WeakPolarHBondContact O-CD2 3.39Å; M35-Y39 PolarHBondContact O-N 3.1Å; M35-Y39 VanDerWaalsContact O-N 3.13Å; M35-A96 HydrophobicContact CG-CB 4.13Å
36	S	67.2	Low	61.6	Low	70 Å²	70	66 Å²	66	49%	0.49	43%	0.426	S	S	.	.	H	α-helix	trans	-58.8	-46.3	172.4	-165.7	0	0	0	0	110.5	S34 L38 Y39 D40	S34-S36 VanDerWaalsContact C-N 3.26Å; S34-S36 PolarHBondContact O-N 3.34Å; S34-S36 WeakPolarHBondContact OG-CB 3.27Å; S34-S36 PolarHBondContact OG-N 3.45Å; S36-L38 PolarHBondContact O-N 2.95Å; S36-L38 VanDerWaalsContact O-N 3.13Å; S36-Y39 WeakPolarHBondContact O-CA 3.32Å; S36-Y39 WeakPolarHBondContact O-CB 3.43Å; S36-Y39 PolarHBondContact O-N 2.87Å; S36-D40 VanDerWaalsContact O-CG 3.24Å; S36-D40 PolarHBondContact O-N 3.16Å
37	S	69	Low	62.9	Low	41 Å²	41	68.8 Å²	68.8	29%	0.287	44%	0.444	S	S	.	.	H	α-helix	trans	-61.2	-25	177.9	-43.7	0	0	0	0	113	S34 M35 A41 I87	S34-S37 PolarHBondContact N-OG 2.75Å; S34-S37 WeakPolarHBondContact O-CB 3.42Å; S34-S37 PolarHBondContact O-N 3.44Å; S34-S37 VanDerWaalsContact O-N 3.13Å; S34-S37 PolarHBondContact OG-N 3.04Å; S34-S37 VanDerWaalsContact OG-N 3.12Å; S34-S37 PolarHBondContact OG-OG 3.33Å; M35-S37 VanDerWaalsContact C-N 3.3Å; M35-S37 PolarHBondContact O-N 3.42Å; S37-A41 WeakPolarHBondContact O-CB 3.47Å; S37-A41 PolarHBondContact O-N 3.13Å; S37-I87 VanDerWaalsContact C-CD1 3.46Å; S37-I87 WeakPolarHBondContact O-CD1 3.45Å
38	L	71.4	Confident	64.4	Low	2 Å²	2	65.5 Å²	65.5	1%	0.01	41%	0.407	C	S	.	.	H	α-helix	trans	-76.5	-41.1	173.6	-175.5	63.6	0	0	0	111.6	S34 M35 S36 L42 A84 I87 L88 Y97	S34-L38 PolarHBondContact O-N 3.36Å; S34-L38 VanDerWaalsContact O-N 3.12Å; M35-L38 HydrophobicContact CE-CD2 4.5Å; M35-L38 WeakPolarHBondContact O-CB 3.39Å; M35-L38 PolarHBondContact O-N 2.96Å; M35-L38 VanDerWaalsContact O-N 3.11Å; M35-L38 HydrophobicContact SD-CD2 4Å; S36-L38 PolarHBondContact O-N 2.95Å; S36-L38 VanDerWaalsContact O-N 3.13Å; L38-L42 HydrophobicContact CD1-CD1 3.87Å; L38-L42 HydrophobicContact CD1-CG 4.29Å; L38-L42 HydrophobicContact CG-CD1 4.13Å; L38-L42 WeakPolarHBondContact O-CB 3.43Å; L38-L42 WeakPolarHBondContact O-CG 3.46Å; L38-L42 PolarHBondContact O-N 3.26Å; L38-A84 HydrophobicContact CD1-CB 3.84Å; L38-I87 HydrophobicContact CB-CD1 4.35Å; L38-I87 HydrophobicContact CB-CG2 4.09Å; L38-I87 HydrophobicContact CD1-CB 4.47Å; L38-I87 HydrophobicContact CD1-CG2 4.49Å; L38-L88 HydrophobicContact CD1-CD1 4.36Å; L38-L88 HydrophobicContact CD1-CG 4.14Å; L38-L88 HydrophobicContact CD2-CD2 3.95Å; L38-L88 HydrophobicContact CD2-CG 4.35Å; L38-Y97 HydrophobicContact CD2-CD2 4.19Å
39	Y	77.6	Confident	65.8	Low	20 Å²	20	62.3 Å²	62.3	8%	0.078	39%	0.389	C	S	.	.	H	α-helix	trans	-60	-47.7	171.3	-73.7	-69.3	0	0	0	110.7	M35 S36 L42 S43 C44 E45 L53	M35-Y39 HydrophobicContact CE-CE2 3.89Å; M35-Y39 WeakPolarHBondContact O-CD2 3.39Å; M35-Y39 PolarHBondContact O-N 3.1Å; M35-Y39 VanDerWaalsContact O-N 3.13Å; S36-Y39 WeakPolarHBondContact O-CA 3.32Å; S36-Y39 WeakPolarHBondContact O-CB 3.43Å; S36-Y39 PolarHBondContact O-N 2.87Å; Y39-L42 CarbonylContact O-C 3.55Å; Y39-L42 PolarHBondContact O-N 3.4Å; Y39-S43 WeakPolarHBondContact O-CA 3.47Å; Y39-S43 PolarHBondContact O-N 3.47Å; Y39-C44 CarbonylContact C-O 3.59Å; Y39-C44 WeakPolarHBondContact CB-O 3.27Å; Y39-C44 HydrophobicContact CD1-CB 3.92Å; Y39-C44 PolarHBondContact O-N 3.37Å; Y39-E45 WeakPolarHBondContact CD1-O 3.39Å; Y39-E45 VanDerWaalsContact CE1-O 3.22Å; Y39-E45 WeakPolarHBondContact CE1-O 3.14Å; Y39-L53 HydrophobicContact CD1-CD1 4.1Å; Y39-L53 HydrophobicContact CD1-CD2 3.9Å; Y39-L53 HydrophobicContact CD1-CG 4.27Å; Y39-L53 HydrophobicContact CE1-CD1 3.42Å; Y39-L53 VanDerWaalsContact CE1-CD1 3.42Å; Y39-L53 HydrophobicContact CE1-CD2 4.06Å; Y39-L53 HydrophobicContact CE1-CG 3.93Å
40	D	78.6	Confident	66.9	Low	105 Å²	105	56.8 Å²	56.8	56%	0.561	36%	0.362	S	S	*	.	H	α-helix	trans	-59.2	-51.1	177.1	-60.5	-43.5	0	0	0	111.9	S36 L42 S43	S36-D40 VanDerWaalsContact O-CG 3.24Å; S36-D40 PolarHBondContact O-N 3.16Å; D40-L42 VanDerWaalsContact C-N 3.32Å; D40-L42 PolarHBondContact O-N 3.05Å; D40-S43 PolarHBondContact O-N 3.19Å; D40-S43 VanDerWaalsContact O-N 3.09Å; D40-S43 PolarHBondContact O-OG 2.88Å
41	A	78.1	Confident	67.9	Low	3 Å²	3	54.1 Å²	54.1	3%	0.025	35%	0.346	C	S	.	.	H	α-helix	trans	-62.9	-34.9	-179.4	0	0	0	0	0	113	S37 K80 Q83 A84	S37-A41 WeakPolarHBondContact O-CB 3.47Å; S37-A41 PolarHBondContact O-N 3.13Å; A41-K80 VanDerWaalsContact O-CB 3.27Å; A41-K80 WeakPolarHBondContact O-CB 3.48Å; A41-K80 VanDerWaalsContact O-CD 3.27Å; A41-K80 WeakPolarHBondContact O-CD 3.43Å; A41-K80 WeakPolarHBondContact O-CG 3.3Å; A41-Q83 HydrophobicContact CB-CB 3.88Å; A41-A84 HydrophobicContact CB-CB 4.41Å
42	L	79.8	Confident	69.4	Low	21 Å²	21	53.4 Å²	53.4	11%	0.11	33%	0.332	C	S	.	.	H	α-helix	trans	-88.5	-7.9	175.9	-65.6	177.3	0	0	0	113.5	L38 Y39 D40 C44 L53 A56 Y57 A84	L38-L42 HydrophobicContact CD1-CD1 3.87Å; L38-L42 HydrophobicContact CD1-CG 4.29Å; L38-L42 HydrophobicContact CG-CD1 4.13Å; L38-L42 WeakPolarHBondContact O-CB 3.43Å; L38-L42 WeakPolarHBondContact O-CG 3.46Å; L38-L42 PolarHBondContact O-N 3.26Å; Y39-L42 CarbonylContact O-C 3.55Å; Y39-L42 PolarHBondContact O-N 3.4Å; D40-L42 VanDerWaalsContact C-N 3.32Å; D40-L42 PolarHBondContact O-N 3.05Å; L42-C44 VanDerWaalsContact C-N 3.3Å; L42-L53 HydrophobicContact CB-CD2 4.32Å; L42-L53 HydrophobicContact CD1-CD2 3.64Å; L42-A56 HydrophobicContact CB-CB 4.13Å; L42-Y57 HydrophobicContact CD2-CD2 4.08Å; L42-A84 HydrophobicContact CD2-CB 3.67Å; L42-A84 HydrophobicContact CG-CB 3.99Å
43	S	81.9	Confident	70.6	Confident	82 Å²	82	50.2 Å²	50.2	57%	0.573	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	47.7	-173.1	-55.6	0	0	0	0	112.5	Y39 D40 K80	Y39-S43 WeakPolarHBondContact O-CA 3.47Å; Y39-S43 PolarHBondContact O-N 3.47Å; D40-S43 PolarHBondContact O-N 3.19Å; D40-S43 VanDerWaalsContact O-N 3.09Å; D40-S43 PolarHBondContact O-OG 2.88Å; S43-K80 PolarHBondContact OG-NZ 2.9Å
44	C	79.4	Confident	71.3	Confident	23 Å²	23	51.5 Å²	51.5	16%	0.155	30%	0.299	C	S	.	.			trans	-105.8	145	170.6	-70.1	0	0	0	0	108.9	Y39 L42 S48 L53 A56	Y39-C44 CarbonylContact C-O 3.59Å; Y39-C44 WeakPolarHBondContact CB-O 3.27Å; Y39-C44 HydrophobicContact CD1-CB 3.92Å; Y39-C44 PolarHBondContact O-N 3.37Å; L42-C44 VanDerWaalsContact C-N 3.3Å; C44-S48 WeakPolarHBondContact CB-OG 3.43Å; C44-L53 HydrophobicContact CB-CD2 3.85Å; C44-L53 HydrophobicContact CB-CG 4.45Å; C44-A56 VanDerWaalsContact SG-CB 3.52Å
45	E	79	Confident	71.9	Confident	141 Å²	141	53.6 Å²	53.6	66%	0.659	30%	0.303	S	S	*	.			trans	-66.2	152.9	167.7	-65.2	179.2	-168.3	0	0	110.5	Y39 T47 S48	Y39-E45 WeakPolarHBondContact CD1-O 3.39Å; Y39-E45 VanDerWaalsContact CE1-O 3.22Å; Y39-E45 WeakPolarHBondContact CE1-O 3.14Å; E45-T47 WeakPolarHBondContact CB-OG1 3.31Å; E45-T47 PolarHBondContact O-N 3.49Å; E45-T47 PolarHBondContact OE2-OG1 3.5Å; E45-S48 PolarHBondContact N-OG 2.88Å; E45-S48 WeakPolarHBondContact O-CB 3.26Å; E45-S48 PolarHBondContact O-N 3.46Å; E45-S48 PolarHBondContact O-OG 2.93Å
46	S	69.9	Low	72.5	Confident	95 Å²	95	52.4 Å²	52.4	66%	0.664	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-13.6	175.2	54.9	0	0	0	0	114.4
47	T	73.1	Confident	72.9	Confident	106 Å²	106	50.5 Å²	50.5	65%	0.65	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-17.5	171.3	51.3	0	0	0	0	113.6	E45	E45-T47 WeakPolarHBondContact CB-OG1 3.31Å; E45-T47 PolarHBondContact O-N 3.49Å; E45-T47 PolarHBondContact OE2-OG1 3.5Å
48	S	69.3	Low	72.9	Confident	16 Å²	16	51.6 Å²	51.6	11%	0.112	28%	0.28	C	S	.	.			trans	-64.3	137.3	-167.2	-55.2	0	0	0	0	112.7	C44 E45 W100	C44-S48 WeakPolarHBondContact CB-OG 3.43Å; E45-S48 PolarHBondContact N-OG 2.88Å; E45-S48 WeakPolarHBondContact O-CB 3.26Å; E45-S48 PolarHBondContact O-N 3.46Å; E45-S48 PolarHBondContact O-OG 2.93Å; S48-W100 WeakPolarHBondContact O-CZ2 3.49Å
49	S	67.9	Low	72.9	Confident	35 Å²	35	58.9 Å²	58.9	25%	0.245	31%	0.307	C	S	.	.			trans	-72.2	165.9	-178.1	75.5	0	0	0	0	113.3	E51 E52 L53	S49-E51 PolarHBondContact O-N 3.46Å; S49-E51 VanDerWaalsContact O-N 3.16Å; S49-E52 WeakPolarHBondContact CA-OE2 3.45Å; S49-E52 WeakPolarHBondContact CB-OE2 3.3Å; S49-E52 PolarHBondContact N-OE2 3.34Å; S49-E52 PolarHBondContact O-N 3.44Å; S49-E52 VanDerWaalsContact O-N 3.11Å; S49-E52 PolarHBondContact OG-N 3.03Å; S49-E52 PolarHBondContact OG-OE2 3.01Å; S49-L53 PolarHBondContact O-N 3.04Å
50	A	61.3	Low	72.6	Confident	9 Å²	9	58.5 Å²	58.5	7%	0.074	31%	0.308	C	S	.	.	H	α-helix	trans	-59	-28.6	179	0	0	0	0	0	113.8	K54 W100 L101 Q104	A50-K54 WeakPolarHBondContact O-CB 3.42Å; A50-K54 WeakPolarHBondContact O-CD 3.49Å; A50-K54 WeakPolarHBondContact O-CG 3.23Å; A50-K54 PolarHBondContact O-N 3.4Å; A50-W100 HydrophobicContact CB-CE3 4.41Å; A50-W100 HydrophobicContact CB-CH2 3.78Å; A50-W100 HydrophobicContact CB-CZ3 3.59Å; A50-L101 HydrophobicContact CB-CD1 3.65Å; A50-Q104 HydrophobicContact CB-CB 4.41Å; A50-Q104 HydrophobicContact CB-CG 4.41Å
51	E	59.7	Low	71.9	Confident	65 Å²	65	55.6 Å²	55.6	30%	0.304	29%	0.292	S	S	.	.	H	α-helix	trans	-82.5	-31.3	178.3	-138.4	60.9	-139.2	0	0	112	S49 K54 Q55 R58	S49-E51 PolarHBondContact O-N 3.46Å; S49-E51 VanDerWaalsContact O-N 3.16Å; E51-K54 WeakPolarHBondContact OE1-CD 3.47Å; E51-K54 IonicContact OE1-NZ 2.72Å; E51-K54 PolarHBondContact OE1-NZ 3.47Å; E51-K54 IonicContact OE2-NZ 2.79Å; E51-K54 PolarHBondContact OE2-NZ 3.25Å; E51-Q55 WeakPolarHBondContact O-CB 3.43Å; E51-Q55 PolarHBondContact O-N 3.5Å; E51-R58 IonicContact OE1-NH1 3.64Å
52	E	71.5	Confident	71.2	Confident	104 Å²	104	61 Å²	61	49%	0.486	32%	0.32	S	S	.	.	H	α-helix	trans	-68.4	-45.4	173	-72.8	155.1	131.9	0	0	111.5	S49 K54 Q55 A56	S49-E52 WeakPolarHBondContact CA-OE2 3.45Å; S49-E52 WeakPolarHBondContact CB-OE2 3.3Å; S49-E52 PolarHBondContact N-OE2 3.34Å; S49-E52 PolarHBondContact O-N 3.44Å; S49-E52 VanDerWaalsContact O-N 3.11Å; S49-E52 PolarHBondContact OG-N 3.03Å; S49-E52 PolarHBondContact OG-OE2 3.01Å; E52-K54 PolarHBondContact O-N 3.38Å; E52-Q55 CarbonylContact O-C 3.59Å; E52-Q55 PolarHBondContact O-N 2.83Å; E52-Q55 VanDerWaalsContact O-N 3.1Å; E52-A56 WeakPolarHBondContact O-CB 3.36Å; E52-A56 PolarHBondContact O-N 3.17Å
53	L	71.6	Confident	70.4	Confident	3 Å²	3	64.5 Å²	64.5	2%	0.016	34%	0.338	C	S	.	.	H	α-helix	trans	-60	-44.5	173.9	-87.7	172.1	0	0	0	112.1	Y39 L42 C44 S49 Q55 Y57 W100	Y39-L53 HydrophobicContact CD1-CD1 4.1Å; Y39-L53 HydrophobicContact CD1-CD2 3.9Å; Y39-L53 HydrophobicContact CD1-CG 4.27Å; Y39-L53 HydrophobicContact CE1-CD1 3.42Å; Y39-L53 VanDerWaalsContact CE1-CD1 3.42Å; Y39-L53 HydrophobicContact CE1-CD2 4.06Å; Y39-L53 HydrophobicContact CE1-CG 3.93Å; L42-L53 HydrophobicContact CB-CD2 4.32Å; L42-L53 HydrophobicContact CD1-CD2 3.64Å; C44-L53 HydrophobicContact CB-CD2 3.85Å; C44-L53 HydrophobicContact CB-CG 4.45Å; S49-L53 PolarHBondContact O-N 3.04Å; L53-Q55 VanDerWaalsContact C-N 3.33Å; L53-Q55 PolarHBondContact O-N 3.45Å; L53-Y57 PolarHBondContact O-N 3.09Å; L53-Y57 VanDerWaalsContact O-N 3.08Å; L53-W100 HydrophobicContact CD1-CH2 3.57Å; L53-W100 HydrophobicContact CD1-CZ2 4.39Å; L53-W100 HydrophobicContact CD1-CZ3 3.88Å
54	K	67	Low	69.5	Low	45 Å²	45	61 Å²	61	20%	0.196	31%	0.313	C	S	.	.	H	α-helix	trans	-59.8	-42.9	171.7	-77	168.1	176.7	178	0	111.7	A50 E51 E52 Y57 R58	A50-K54 WeakPolarHBondContact O-CB 3.42Å; A50-K54 WeakPolarHBondContact O-CD 3.49Å; A50-K54 WeakPolarHBondContact O-CG 3.23Å; A50-K54 PolarHBondContact O-N 3.4Å; E51-K54 WeakPolarHBondContact OE1-CD 3.47Å; E51-K54 IonicContact OE1-NZ 2.72Å; E51-K54 PolarHBondContact OE1-NZ 3.47Å; E51-K54 IonicContact OE2-NZ 2.79Å; E51-K54 PolarHBondContact OE2-NZ 3.25Å; E52-K54 PolarHBondContact O-N 3.38Å; K54-Y57 PolarHBondContact O-N 2.87Å; K54-R58 WeakPolarHBondContact O-CB 3.4Å; K54-R58 VanDerWaalsContact O-CG 3.25Å; K54-R58 WeakPolarHBondContact O-CG 3.38Å; K54-R58 PolarHBondContact O-N 3.37Å
55	Q	72.6	Confident	68.3	Low	100 Å²	100	64.7 Å²	64.7	47%	0.467	33%	0.328	S	S	.	.	H	α-helix	trans	-74.5	-30.5	-174.8	-166.1	160.7	13.6	0	0	112.1	E51 E52 L53 R59	E51-Q55 WeakPolarHBondContact O-CB 3.43Å; E51-Q55 PolarHBondContact O-N 3.5Å; E52-Q55 CarbonylContact O-C 3.59Å; E52-Q55 PolarHBondContact O-N 2.83Å; E52-Q55 VanDerWaalsContact O-N 3.1Å; L53-Q55 VanDerWaalsContact C-N 3.33Å; L53-Q55 PolarHBondContact O-N 3.45Å; Q55-R59 WeakPolarHBondContact O-CB 3.5Å; Q55-R59 WeakPolarHBondContact O-CG 3.15Å; Q55-R59 PolarHBondContact O-N 3.33Å
56	A	76.4	Confident	66.8	Low	15 Å²	15	61.9 Å²	61.9	12%	0.124	32%	0.322	C	S	.	.	H	α-helix	trans	-63.5	-50.4	167.4	0	0	0	0	0	111.3	L42 C44 E52 R58 R59 A60	L42-A56 HydrophobicContact CB-CB 4.13Å; C44-A56 VanDerWaalsContact SG-CB 3.52Å; E52-A56 WeakPolarHBondContact O-CB 3.36Å; E52-A56 PolarHBondContact O-N 3.17Å; A56-R58 VanDerWaalsContact C-N 3.35Å; A56-R58 PolarHBondContact O-N 2.85Å; A56-R59 PolarHBondContact O-N 3.42Å; A56-A60 WeakPolarHBondContact O-CB 3.49Å; A56-A60 PolarHBondContact O-N 3.1Å
57	Y	76.4	Confident	66	Low	30 Å²	30	64 Å²	64	12%	0.118	33%	0.326	C	S	.	.	H	α-helix	trans	-61.2	-40.7	176.3	-174.6	-114.1	0	0	0	112.4	L42 L53 K54 A60 L61 A84	L42-Y57 HydrophobicContact CD2-CD2 4.08Å; L53-Y57 PolarHBondContact O-N 3.09Å; L53-Y57 VanDerWaalsContact O-N 3.08Å; K54-Y57 PolarHBondContact O-N 2.87Å; Y57-A60 PolarHBondContact O-N 3.38Å; Y57-L61 HydrophobicContact CD1-CD1 3.86Å; Y57-L61 HydrophobicContact CE1-CD1 3.46Å; Y57-L61 VanDerWaalsContact CE1-CD1 3.46Å; Y57-L61 HydrophobicContact CE2-CD1 4.38Å; Y57-L61 HydrophobicContact CG-CD1 4.47Å; Y57-L61 WeakPolarHBondContact O-CB 3.4Å; Y57-L61 PolarHBondContact O-N 3.34Å; Y57-A84 HydrophobicContact CD2-CB 4.15Å; Y57-A84 HydrophobicContact CE2-CB 4.29Å
58	R	68.7	Low	64.8	Low	64 Å²	64	67.9 Å²	67.9	24%	0.242	33%	0.329	C	S	.	.	H	α-helix	trans	-61.3	-46.1	172.5	-77.8	170.5	166.5	160.4	-1.7	112.4	I10 D11 E51 K54 A56 L61 L62	I10-R58 HydrophobicContact CG2-CG 4.42Å; I10-R58 PolarHBondContact O-NH2 3.05Å; I10-R58 VanDerWaalsContact O-NH2 3.14Å; D11-R58 IonicContact OD1-CZ 3.13Å; D11-R58 IonicContact OD1-NH2 2.66Å; D11-R58 PolarHBondContact OD1-NH2 2.87Å; E51-R58 IonicContact OE1-NH1 3.64Å; K54-R58 WeakPolarHBondContact O-CB 3.4Å; K54-R58 VanDerWaalsContact O-CG 3.25Å; K54-R58 WeakPolarHBondContact O-CG 3.38Å; K54-R58 PolarHBondContact O-N 3.37Å; A56-R58 VanDerWaalsContact C-N 3.35Å; A56-R58 PolarHBondContact O-N 2.85Å; R58-L61 PolarHBondContact O-N 3.36Å; R58-L62 WeakPolarHBondContact O-CB 3.04Å; R58-L62 VanDerWaalsContact O-CG 3.26Å; R58-L62 WeakPolarHBondContact O-CG 3.45Å; R58-L62 PolarHBondContact O-N 3.01Å
59	R	72.3	Confident	63.1	Low	154 Å²	154	71.9 Å²	71.9	58%	0.581	36%	0.357	S	S	*	.	H	α-helix	trans	-59.5	-47.1	176	-77.8	167.5	179.8	167.6	2.2	111.1	Q55 A56 L62 L63	Q55-R59 WeakPolarHBondContact O-CB 3.5Å; Q55-R59 WeakPolarHBondContact O-CG 3.15Å; Q55-R59 PolarHBondContact O-N 3.33Å; A56-R59 PolarHBondContact O-N 3.42Å; R59-L62 PolarHBondContact O-N 3.08Å; R59-L63 WeakPolarHBondContact O-CB 3.34Å; R59-L63 VanDerWaalsContact O-CG 3.29Å; R59-L63 WeakPolarHBondContact O-CG 3.4Å; R59-L63 PolarHBondContact O-N 3.08Å
60	A	69.8	Low	61.8	Low	12 Å²	12	78.4 Å²	78.4	10%	0.099	39%	0.389	C	S	.	.	H	α-helix	trans	-64.6	-40.4	-179.7	0	0	0	0	0	112.6	A56 Y57 T64 V81	A56-A60 WeakPolarHBondContact O-CB 3.49Å; A56-A60 PolarHBondContact O-N 3.1Å; Y57-A60 PolarHBondContact O-N 3.38Å; A60-T64 WeakPolarHBondContact O-CG2 3.22Å; A60-T64 PolarHBondContact O-N 3.39Å; A60-T64 PolarHBondContact O-OG1 3.36Å; A60-V81 HydrophobicContact CB-CG2 3.49Å; A60-V81 VanDerWaalsContact CB-CG2 3.49Å
61	L	65	Low	60.9	Low	44 Å²	44	86.3 Å²	86.3	23%	0.23	42%	0.424	C	S	.	.	H	α-helix	trans	-62.3	-47	170.8	-86.8	166.4	0	0	0	113	I13 Y57 R58 L63 T64 H65 V81	I13-L61 HydrophobicContact CD1-CD1 4.21Å; Y57-L61 HydrophobicContact CD1-CD1 3.86Å; Y57-L61 HydrophobicContact CE1-CD1 3.46Å; Y57-L61 VanDerWaalsContact CE1-CD1 3.46Å; Y57-L61 HydrophobicContact CE2-CD1 4.38Å; Y57-L61 HydrophobicContact CG-CD1 4.47Å; Y57-L61 WeakPolarHBondContact O-CB 3.4Å; Y57-L61 PolarHBondContact O-N 3.34Å; R58-L61 PolarHBondContact O-N 3.36Å; L61-L63 VanDerWaalsContact C-N 3.27Å; L61-L63 PolarHBondContact O-N 2.87Å; L61-T64 PolarHBondContact O-N 2.98Å; L61-T64 VanDerWaalsContact O-N 3.14Å; L61-T64 PolarHBondContact O-OG1 3.42Å; L61-H65 PolarHBondContact O-N 3.3Å; L61-V81 HydrophobicContact CD2-CG1 4.13Å; L61-V81 HydrophobicContact CG-CG1 4.4Å
62	L	63.1	Low	60.3	Low	117 Å²	117	88.1 Å²	88.1	61%	0.613	45%	0.45	S	S	*	.	H	α-helix	trans	-64.6	-31.3	-180	-73.3	167.6	0	0	0	112.9	R58 R59 T64	R58-L62 WeakPolarHBondContact O-CB 3.04Å; R58-L62 VanDerWaalsContact O-CG 3.26Å; R58-L62 WeakPolarHBondContact O-CG 3.45Å; R58-L62 PolarHBondContact O-N 3.01Å; R59-L62 PolarHBondContact O-N 3.08Å; L62-T64 VanDerWaalsContact C-N 3.33Å
63	L	63.3	Low	59.4	Low	94 Å²	94	87.3 Å²	87.3	49%	0.492	45%	0.452	S	S	.	.	H	α-helix	trans	-81	-9.9	176.7	-70.9	167.8	0	0	0	113.7	R59 L61 L77	R59-L63 WeakPolarHBondContact O-CB 3.34Å; R59-L63 VanDerWaalsContact O-CG 3.29Å; R59-L63 WeakPolarHBondContact O-CG 3.4Å; R59-L63 PolarHBondContact O-N 3.08Å; L61-L63 VanDerWaalsContact C-N 3.27Å; L61-L63 PolarHBondContact O-N 2.87Å; L63-L77 HydrophobicContact CB-CD2 3.41Å; L63-L77 VanDerWaalsContact CB-CD2 3.41Å; L63-L77 HydrophobicContact CD1-CD2 3.6Å; L63-L77 HydrophobicContact CG-CD2 4.14Å
64	T	61.7	Low	58.8	Low	8 Å²	8	91.1 Å²	91.1	5%	0.049	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	8.3	178.7	51.8	0	0	0	0	113.4	A60 L61 L62 V73 F78 V81	A60-T64 WeakPolarHBondContact O-CG2 3.22Å; A60-T64 PolarHBondContact O-N 3.39Å; A60-T64 PolarHBondContact O-OG1 3.36Å; L61-T64 PolarHBondContact O-N 2.98Å; L61-T64 VanDerWaalsContact O-N 3.14Å; L61-T64 PolarHBondContact O-OG1 3.42Å; L62-T64 VanDerWaalsContact C-N 3.33Å; T64-V73 HydrophobicContact CG2-CG1 4.48Å; T64-F78 HydrophobicContact CG2-CB 4.12Å; T64-F78 HydrophobicContact CG2-CD2 4.3Å; T64-V81 HydrophobicContact CG2-CG2 4.26Å
65	H	55.7	Low	58.5	Low	101 Å²	101	93.3 Å²	93.3	47%	0.468	49%	0.493	S	S	.	.			trans	-74.7	134.2	-179.4	-160.1	-97.6	0	0	0	112.1	L61 D67 R68	L61-H65 PolarHBondContact O-N 3.3Å; H65-D67 VanDerWaalsContact C-N 3.26Å; H65-D67 IonicContact CE1-OD2 3.79Å; H65-D67 PolarHBondContact CE1-OD2 3.5Å; H65-D67 IonicContact ND1-OD2 2.66Å; H65-D67 PolarHBondContact ND1-OD2 3.04Å; H65-D67 PolarHBondContact O-N 3Å; H65-D67 VanDerWaalsContact O-N 3.14Å; H65-R68 PolarHBondContact O-N 2.87Å
66	P	47.8	Very low	58.2	Low	82 Å²	82	95 Å²	95	53%	0.532	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-13	-170.7	26.1	-36	0	0	0	116.1	R68	P66-R68 PolarHBondContact O-N 3.45Å
67	D	53	Low	57.6	Low	141 Å²	141	96.3 Å²	96.3	75%	0.754	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	1.1	178.3	-68.8	-51.6	0	0	0	114.4	H65	H65-D67 VanDerWaalsContact C-N 3.26Å; H65-D67 IonicContact CE1-OD2 3.79Å; H65-D67 PolarHBondContact CE1-OD2 3.5Å; H65-D67 IonicContact ND1-OD2 2.66Å; H65-D67 PolarHBondContact ND1-OD2 3.04Å; H65-D67 PolarHBondContact O-N 3Å; H65-D67 VanDerWaalsContact O-N 3.14Å
68	R	46.7	Very low	57.1	Low	186 Å²	186	96.8 Å²	96.8	70%	0.702	50%	0.504	S	S	*	.	S	Bend	trans	-86.1	109.9	167.1	-79.9	-169.2	169.3	-138.3	-3.4	110.2	H65 P66	H65-R68 PolarHBondContact O-N 2.87Å; P66-R68 PolarHBondContact O-N 3.45Å
69	S	34.8	Very low	57	Low	100 Å²	100	99 Å²	99	70%	0.699	52%	0.517	S	S	*	.			trans	-70	142.6	-175.1	54.2	0	0	0	0	114.9	E71	S69-E71 VanDerWaalsContact C-N 3.33Å; S69-E71 PolarHBondContact O-N 3.13Å
70	N	39.3	Very low	56.9	Low	172 Å²	172	93.1 Å²	93.1	92%	0.92	50%	0.496	S	S	*	.	S	Bend	trans	63.4	-5.1	154.7	-78.6	8.8	0	0	0	121.4
71	E	43	Very low	56.9	Low	176 Å²	176	92.7 Å²	92.7	82%	0.822	49%	0.492	S	S	*	.	S	Bend	trans	-106.1	151.3	170.7	-67.5	-172.4	151.4	0	0	111.9	S69 V73	S69-E71 VanDerWaalsContact C-N 3.33Å; S69-E71 PolarHBondContact O-N 3.13Å; E71-V73 PolarHBondContact O-N 3.39Å; E71-V73 VanDerWaalsContact O-N 3.16Å
72	A	47.7	Very low	57.1	Low	102 Å²	102	92 Å²	92	84%	0.843	49%	0.489	S	S	*	.			trans	-63.3	118.2	-173.5	0	0	0	0	0	110.7	D74	A72-D74 PolarHBondContact O-N 3.23Å
73	V	51.8	Low	57.5	Low	88 Å²	88	90.2 Å²	90.2	53%	0.533	48%	0.478	S	S	.	.			trans	-56.5	116.7	172	179.7	0	0	0	0	107.8	T64 E71 S75 F78	T64-V73 HydrophobicContact CG2-CG1 4.48Å; E71-V73 PolarHBondContact O-N 3.39Å; E71-V73 VanDerWaalsContact O-N 3.16Å; V73-S75 PolarHBondContact O-N 3.27Å; V73-F78 HydrophobicContact CG1-CB 4.44Å
74	D	58.7	Low	58	Low	83 Å²	83	85.7 Å²	85.7	44%	0.444	45%	0.454	S	S	.	.			trans	-59.3	108.8	-177.1	177.5	11.3	0	0	0	109.9	A72 Y76 L77 F78	A72-D74 PolarHBondContact O-N 3.23Å; D74-Y76 PolarHBondContact O-N 3.33Å; D74-Y76 WeakPolarHBondContact OD1-CB 3.28Å; D74-Y76 PolarHBondContact OD1-N 3.24Å; D74-L77 HydrophobicContact CB-CB 4Å; D74-L77 PolarHBondContact O-N 3.04Å; D74-L77 VanDerWaalsContact O-N 3.15Å; D74-L77 PolarHBondContact OD2-N 3.42Å; D74-F78 WeakPolarHBondContact O-CB 3.32Å; D74-F78 PolarHBondContact O-N 3.1Å
75	S	61.2	Low	58.4	Low	90 Å²	90	86.7 Å²	86.7	63%	0.629	46%	0.457	S	S	*	.	H	α-helix	trans	-57.2	-35.3	-177.9	-168.7	0	0	0	0	111.3	V73 Q79	V73-S75 PolarHBondContact O-N 3.27Å; S75-Q79 VanDerWaalsContact O-CB 3.26Å; S75-Q79 WeakPolarHBondContact O-CB 3.19Å; S75-Q79 PolarHBondContact O-N 2.91Å
76	Y	65.6	Low	59.1	Low	136 Å²	136	83.4 Å²	83.4	53%	0.533	44%	0.444	S	S	.	.	H	α-helix	trans	-69.6	-45.2	178.3	178	-113.2	0	0	0	111.7	D74 Q79 K80	D74-Y76 PolarHBondContact O-N 3.33Å; D74-Y76 WeakPolarHBondContact OD1-CB 3.28Å; D74-Y76 PolarHBondContact OD1-N 3.24Å; Y76-Q79 PolarHBondContact O-N 3.13Å; Y76-K80 HydrophobicContact CE1-CD 4.23Å; Y76-K80 VanDerWaalsContact CE1-NZ 3.27Å; Y76-K80 VanDerWaalsContact CZ-NZ 3.27Å; Y76-K80 PolarHBondContact O-N 2.85Å; Y76-K80 VanDerWaalsContact OH-CE 3.28Å; Y76-K80 WeakPolarHBondContact OH-CE 3.49Å; Y76-K80 PolarHBondContact OH-NZ 3.25Å
77	L	63.1	Low	60.1	Low	43 Å²	43	80.1 Å²	80.1	23%	0.225	42%	0.422	C	S	.	.	H	α-helix	trans	-66.6	-38.3	176.2	-139.6	85.8	0	0	0	112.3	L63 D74 K80 V81	L63-L77 HydrophobicContact CB-CD2 3.41Å; L63-L77 VanDerWaalsContact CB-CD2 3.41Å; L63-L77 HydrophobicContact CD1-CD2 3.6Å; L63-L77 HydrophobicContact CG-CD2 4.14Å; D74-L77 HydrophobicContact CB-CB 4Å; D74-L77 PolarHBondContact O-N 3.04Å; D74-L77 VanDerWaalsContact O-N 3.15Å; D74-L77 PolarHBondContact OD2-N 3.42Å; L77-K80 WeakPolarHBondContact O-CB 3.49Å; L77-K80 PolarHBondContact O-N 3.08Å; L77-V81 PolarHBondContact O-N 3.31Å; L77-V81 VanDerWaalsContact O-N 3.1Å
78	F	66.3	Low	60.7	Low	40 Å²	40	74.6 Å²	74.6	18%	0.175	39%	0.392	C	S	.	.	H	α-helix	trans	-63.1	-44	173.9	-179.1	-105.6	0	0	0	111.8	W21 K25 V26 T64 V73 D74 K80 V81 V82	W21-F78 AromaticContact CH2-CE2 3.9Å; W21-F78 HydrophobicContact CH2-CE2 3.9Å; W21-F78 AromaticContact CZ3-CE2 3.93Å; W21-F78 HydrophobicContact CZ3-CE2 3.93Å; K25-F78 HydrophobicContact CB-CZ 4.38Å; V26-F78 HydrophobicContact CG2-CE1 3.55Å; V26-F78 HydrophobicContact CG2-CZ 3.62Å; T64-F78 HydrophobicContact CG2-CB 4.12Å; T64-F78 HydrophobicContact CG2-CD2 4.3Å; V73-F78 HydrophobicContact CG1-CB 4.44Å; D74-F78 WeakPolarHBondContact O-CB 3.32Å; D74-F78 PolarHBondContact O-N 3.1Å; F78-K80 VanDerWaalsContact C-N 3.29Å; F78-K80 PolarHBondContact O-N 3.28Å; F78-V81 PolarHBondContact O-N 2.98Å; F78-V82 HydrophobicContact CE1-CG2 4.18Å; F78-V82 HydrophobicContact CZ-CG2 4.21Å; F78-V82 WeakPolarHBondContact O-CG2 3.41Å; F78-V82 PolarHBondContact O-N 3.18Å
79	Q	67.6	Low	61.5	Low	111 Å²	111	71.6 Å²	71.6	52%	0.519	38%	0.381	S	S	.	.	H	α-helix	trans	-60.1	-38.3	175.2	-169.1	173	20.4	0	0	111.9	S75 Y76 V82 Q83	S75-Q79 VanDerWaalsContact O-CB 3.26Å; S75-Q79 WeakPolarHBondContact O-CB 3.19Å; S75-Q79 PolarHBondContact O-N 2.91Å; Y76-Q79 PolarHBondContact O-N 3.13Å; Q79-V82 PolarHBondContact O-N 2.72Å; Q79-Q83 WeakPolarHBondContact O-CG 3.3Å; Q79-Q83 PolarHBondContact O-N 3.45Å
80	K	69.7	Low	63	Low	29 Å²	29	69.1 Å²	69.1	13%	0.126	36%	0.36	C	S	.	.	H	α-helix	trans	-63.7	-43.3	173.5	-80	-177.9	171.1	178.1	0	113.7	A41 S43 Y76 L77 F78 V82 Q83 A84	A41-K80 VanDerWaalsContact O-CB 3.27Å; A41-K80 WeakPolarHBondContact O-CB 3.48Å; A41-K80 VanDerWaalsContact O-CD 3.27Å; A41-K80 WeakPolarHBondContact O-CD 3.43Å; A41-K80 WeakPolarHBondContact O-CG 3.3Å; S43-K80 PolarHBondContact OG-NZ 2.9Å; Y76-K80 HydrophobicContact CE1-CD 4.23Å; Y76-K80 VanDerWaalsContact CE1-NZ 3.27Å; Y76-K80 VanDerWaalsContact CZ-NZ 3.27Å; Y76-K80 PolarHBondContact O-N 2.85Å; Y76-K80 VanDerWaalsContact OH-CE 3.28Å; Y76-K80 WeakPolarHBondContact OH-CE 3.49Å; Y76-K80 PolarHBondContact OH-NZ 3.25Å; L77-K80 WeakPolarHBondContact O-CB 3.49Å; L77-K80 PolarHBondContact O-N 3.08Å; F78-K80 VanDerWaalsContact C-N 3.29Å; F78-K80 PolarHBondContact O-N 3.28Å; K80-V82 VanDerWaalsContact C-N 3.32Å; K80-V82 PolarHBondContact O-N 3.42Å; K80-Q83 PolarHBondContact O-N 3.44Å; K80-A84 WeakPolarHBondContact O-CB 3.43Å; K80-A84 PolarHBondContact O-N 3.38Å
81	V	69.7	Low	63.7	Low	3 Å²	3	65 Å²	65	2%	0.018	34%	0.342	C	S	.	.	H	α-helix	trans	-59.8	-44	173.9	175.9	0	0	0	0	110.7	A60 L61 T64 L77 F78 W85	A60-V81 HydrophobicContact CB-CG2 3.49Å; A60-V81 VanDerWaalsContact CB-CG2 3.49Å; L61-V81 HydrophobicContact CD2-CG1 4.13Å; L61-V81 HydrophobicContact CG-CG1 4.4Å; T64-V81 HydrophobicContact CG2-CG2 4.26Å; L77-V81 PolarHBondContact O-N 3.31Å; L77-V81 VanDerWaalsContact O-N 3.1Å; F78-V81 PolarHBondContact O-N 2.98Å; V81-W85 VanDerWaalsContact O-CB 3.3Å; V81-W85 WeakPolarHBondContact O-CB 3.33Å; V81-W85 PolarHBondContact O-N 2.99Å
82	V	70.1	Confident	64.4	Low	29 Å²	29	61.7 Å²	61.7	18%	0.176	33%	0.334	C	S	.	.	H	α-helix	trans	-63.6	-43.2	177.9	173.9	0	0	0	0	111.4	L22 V26 F78 Q79 K80 T86	L22-V82 HydrophobicContact CD2-CG2 4.24Å; V26-V82 HydrophobicContact CG2-CG2 4.31Å; F78-V82 HydrophobicContact CE1-CG2 4.18Å; F78-V82 HydrophobicContact CZ-CG2 4.21Å; F78-V82 WeakPolarHBondContact O-CG2 3.41Å; F78-V82 PolarHBondContact O-N 3.18Å; Q79-V82 PolarHBondContact O-N 2.72Å; K80-V82 VanDerWaalsContact C-N 3.32Å; K80-V82 PolarHBondContact O-N 3.42Å; V82-T86 WeakPolarHBondContact O-CB 3.38Å; V82-T86 PolarHBondContact O-N 3.3Å; V82-T86 PolarHBondContact O-OG1 2.98Å
83	Q	71.7	Confident	64.9	Low	80 Å²	80	57.5 Å²	57.5	37%	0.374	30%	0.299	S	S	.	.	H	α-helix	trans	-61.7	-52.4	175.9	-76.3	172.7	-20.1	0	0	111.7	A41 Q79 K80 W85 T86 I87	A41-Q83 HydrophobicContact CB-CB 3.88Å; Q79-Q83 WeakPolarHBondContact O-CG 3.3Å; Q79-Q83 PolarHBondContact O-N 3.45Å; K80-Q83 PolarHBondContact O-N 3.44Å; Q83-W85 VanDerWaalsContact C-N 3.33Å; Q83-W85 PolarHBondContact O-N 2.82Å; Q83-T86 WeakPolarHBondContact O-CB 3.4Å; Q83-T86 PolarHBondContact O-N 2.81Å; Q83-T86 VanDerWaalsContact O-N 3.11Å; Q83-I87 WeakPolarHBondContact O-CG1 3.32Å; Q83-I87 PolarHBondContact O-N 3.4Å
84	A	73.7	Confident	65.4	Low	0 Å²	0	57 Å²	57	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.1	-40.6	179.3	0	0	0	0	0	112.6	L38 A41 L42 Y57 K80 I87 L88	L38-A84 HydrophobicContact CD1-CB 3.84Å; A41-A84 HydrophobicContact CB-CB 4.41Å; L42-A84 HydrophobicContact CD2-CB 3.67Å; L42-A84 HydrophobicContact CG-CB 3.99Å; Y57-A84 HydrophobicContact CD2-CB 4.15Å; Y57-A84 HydrophobicContact CE2-CB 4.29Å; K80-A84 WeakPolarHBondContact O-CB 3.43Å; K80-A84 PolarHBondContact O-N 3.38Å; A84-I87 PolarHBondContact O-N 3.09Å; A84-L88 WeakPolarHBondContact O-CB 3.32Å; A84-L88 WeakPolarHBondContact O-CG 3.33Å; A84-L88 PolarHBondContact O-N 3.5Å
85	W	70.1	Confident	65.1	Low	28 Å²	28	60.2 Å²	60.2	11%	0.106	29%	0.293	C	S	.	.	H	α-helix	trans	-64.3	-40.2	174	177.8	82.1	0	0	0	112.6	A19 L22 V81 Q83 I87 L88 R89	A19-W85 HydrophobicContact CB-CZ2 3.63Å; L22-W85 HydrophobicContact CD1-CB 4.29Å; L22-W85 HydrophobicContact CD1-CD2 3.73Å; L22-W85 HydrophobicContact CD1-CE3 4.25Å; L22-W85 HydrophobicContact CD1-CG 3.73Å; V81-W85 VanDerWaalsContact O-CB 3.3Å; V81-W85 WeakPolarHBondContact O-CB 3.33Å; V81-W85 PolarHBondContact O-N 2.99Å; Q83-W85 VanDerWaalsContact C-N 3.33Å; Q83-W85 PolarHBondContact O-N 2.82Å; W85-I87 VanDerWaalsContact C-N 3.32Å; W85-I87 PolarHBondContact O-N 3.19Å; W85-L88 PolarHBondContact O-N 3.27Å; W85-R89 VanDerWaalsContact O-CB 3.31Å; W85-R89 WeakPolarHBondContact O-CB 3.39Å; W85-R89 PolarHBondContact O-N 3.37Å
86	T	69	Low	64.8	Low	33 Å²	33	58 Å²	58	20%	0.202	28%	0.28	C	S	.	.	H	α-helix	trans	-64.2	-39.3	178.8	-57.7	0	0	0	0	111	L30 V82 Q83 R89 D90	L30-T86 WeakPolarHBondContact O-CG2 3.32Å; V82-T86 WeakPolarHBondContact O-CB 3.38Å; V82-T86 PolarHBondContact O-N 3.3Å; V82-T86 PolarHBondContact O-OG1 2.98Å; Q83-T86 WeakPolarHBondContact O-CB 3.4Å; Q83-T86 PolarHBondContact O-N 2.81Å; Q83-T86 VanDerWaalsContact O-N 3.11Å; T86-R89 PolarHBondContact O-N 3.36Å; T86-D90 PolarHBondContact O-N 3.1Å
87	I	68.6	Low	64.6	Low	13 Å²	13	52.6 Å²	52.6	7%	0.067	26%	0.259	C	S	.	.	H	α-helix	trans	-68.7	-44.8	175.7	-62	162.1	0	0	0	111.4	S37 L38 Q83 A84 W85 R89 D90 S93	S37-I87 VanDerWaalsContact C-CD1 3.46Å; S37-I87 WeakPolarHBondContact O-CD1 3.45Å; L38-I87 HydrophobicContact CB-CD1 4.35Å; L38-I87 HydrophobicContact CB-CG2 4.09Å; L38-I87 HydrophobicContact CD1-CB 4.47Å; L38-I87 HydrophobicContact CD1-CG2 4.49Å; Q83-I87 WeakPolarHBondContact O-CG1 3.32Å; Q83-I87 PolarHBondContact O-N 3.4Å; A84-I87 PolarHBondContact O-N 3.09Å; W85-I87 VanDerWaalsContact C-N 3.32Å; W85-I87 PolarHBondContact O-N 3.19Å; I87-R89 PolarHBondContact O-N 3.27Å; I87-D90 PolarHBondContact O-N 3.37Å; I87-S93 WeakPolarHBondContact O-CB 3.45Å
88	L	66.3	Low	64.2	Low	24 Å²	24	53.1 Å²	53.1	13%	0.126	26%	0.262	C	S	.	.	H	α-helix	trans	-71.5	-9.6	178.5	-71.8	171.7	0	0	0	114.1	L38 A84 W85 R94 Y97	L38-L88 HydrophobicContact CD1-CD1 4.36Å; L38-L88 HydrophobicContact CD1-CG 4.14Å; L38-L88 HydrophobicContact CD2-CD2 3.95Å; L38-L88 HydrophobicContact CD2-CG 4.35Å; A84-L88 WeakPolarHBondContact O-CB 3.32Å; A84-L88 WeakPolarHBondContact O-CG 3.33Å; A84-L88 PolarHBondContact O-N 3.5Å; W85-L88 PolarHBondContact O-N 3.27Å; L88-R94 WeakPolarHBondContact O-CD 2.99Å; L88-Y97 HydrophobicContact CD2-CD1 4.3Å; L88-Y97 HydrophobicContact CD2-CD2 4.24Å; L88-Y97 HydrophobicContact CD2-CG 3.98Å
89	R	64	Low	63.6	Low	123 Å²	123	55 Å²	55	46%	0.464	28%	0.28	S	S	.	.	H	α-helix	trans	-89.6	-23	172.8	179.1	174.4	171.6	-157.7	-8.1	112.9	W85 T86 I87	W85-R89 VanDerWaalsContact O-CB 3.31Å; W85-R89 WeakPolarHBondContact O-CB 3.39Å; W85-R89 PolarHBondContact O-N 3.37Å; T86-R89 PolarHBondContact O-N 3.36Å; I87-R89 PolarHBondContact O-N 3.27Å
90	D	65.1	Low	63.3	Low	48 Å²	48	51.8 Å²	51.8	26%	0.257	26%	0.263	S	S	.	.	S	Bend	trans	-66.3	129.3	175	175.4	76.3	0	0	0	110.7	T86 I87 V92 S93 R94	T86-D90 PolarHBondContact O-N 3.1Å; I87-D90 PolarHBondContact O-N 3.37Å; D90-V92 VanDerWaalsContact C-N 3.27Å; D90-V92 PolarHBondContact O-N 3.12Å; D90-V92 WeakPolarHBondContact OD2-CA 3.49Å; D90-V92 VanDerWaalsContact OD2-CB 3.28Å; D90-V92 WeakPolarHBondContact OD2-CB 3.41Å; D90-V92 PolarHBondContact OD2-N 3.29Å; D90-S93 PolarHBondContact OD2-N 2.83Å; D90-R94 WeakPolarHBondContact O-CB 3.2Å; D90-R94 PolarHBondContact O-N 3.26Å
91	P	55.1	Low	62.6	Low	85 Å²	85	51.4 Å²	51.4	55%	0.552	26%	0.262	S	S	*	.	H	α-helix	trans	-62.2	-27.2	-177.1	-25.7	35.5	0	0	0	115	R95	P91-R95 WeakPolarHBondContact O-CB 3.34Å; P91-R95 VanDerWaalsContact O-CD 3.31Å; P91-R95 WeakPolarHBondContact O-CD 3.4Å; P91-R95 WeakPolarHBondContact O-CG 3.39Å; P91-R95 PolarHBondContact O-N 3.34Å
92	V	58.1	Low	61.7	Low	108 Å²	108	57.7 Å²	57.7	66%	0.655	29%	0.285	S	S	*	.	H	α-helix	trans	-79.7	-51.7	-179.5	-172.1	0	0	0	0	109.7	D90 R94 R95 A96	D90-V92 VanDerWaalsContact C-N 3.27Å; D90-V92 PolarHBondContact O-N 3.12Å; D90-V92 WeakPolarHBondContact OD2-CA 3.49Å; D90-V92 VanDerWaalsContact OD2-CB 3.28Å; D90-V92 WeakPolarHBondContact OD2-CB 3.41Å; D90-V92 PolarHBondContact OD2-N 3.29Å; V92-R94 VanDerWaalsContact C-N 3.29Å; V92-R94 PolarHBondContact O-N 3.32Å; V92-R95 WeakPolarHBondContact O-CB 3.41Å; V92-R95 PolarHBondContact O-N 3.15Å; V92-R95 VanDerWaalsContact O-N 3.16Å; V92-A96 PolarHBondContact O-N 3.04Å
93	S	57.3	Low	60.8	Low	13 Å²	13	59.5 Å²	59.5	9%	0.091	29%	0.292	C	S	.	.	H	α-helix	trans	-66.2	-30.5	177.1	-75.4	0	0	0	0	112.6	G33 I87 D90 A96 Y97	G33-S93 PolarHBondContact O-OG 3.21Å; I87-S93 WeakPolarHBondContact O-CB 3.45Å; D90-S93 PolarHBondContact OD2-N 2.83Å; S93-A96 PolarHBondContact O-N 2.77Å; S93-Y97 WeakPolarHBondContact O-CB 3.38Å; S93-Y97 PolarHBondContact O-N 3.24Å
94	R	62.2	Low	59.9	Low	77 Å²	77	57.7 Å²	57.7	29%	0.291	28%	0.283	S	S	.	.	H	α-helix	trans	-63.7	-46.9	169.4	-176.4	69.2	-146.5	-158.1	6.5	112.1	L88 D90 V92 A96 Y97 D98	L88-R94 WeakPolarHBondContact O-CD 2.99Å; D90-R94 WeakPolarHBondContact O-CB 3.2Å; D90-R94 PolarHBondContact O-N 3.26Å; V92-R94 VanDerWaalsContact C-N 3.29Å; V92-R94 PolarHBondContact O-N 3.32Å; R94-A96 VanDerWaalsContact C-N 3.33Å; R94-A96 PolarHBondContact O-N 3.19Å; R94-Y97 PolarHBondContact O-N 3.38Å; R94-D98 IonicContact CZ-OD1 3.69Å; R94-D98 IonicContact CZ-OD2 2.84Å; R94-D98 IonicContact NE-OD1 2.72Å; R94-D98 IonicContact NE-OD2 3.85Å; R94-D98 PolarHBondContact NE-OD2 2.9Å; R94-D98 IonicContact NH2-OD1 3.35Å; R94-D98 PolarHBondContact NH2-OD1 3.46Å; R94-D98 IonicContact NH2-OD2 3.08Å; R94-D98 PolarHBondContact NH2-OD2 2.82Å; R94-D98 PolarHBondContact O-N 3.37Å
95	R	52.6	Low	58.8	Low	152 Å²	152	62.9 Å²	62.9	57%	0.574	30%	0.303	S	S	*	.	H	α-helix	trans	-61	-41.4	175.1	-75	167.5	-169.8	-161.1	2.4	111.6	P91 V92 D98 C99	P91-R95 WeakPolarHBondContact O-CB 3.34Å; P91-R95 VanDerWaalsContact O-CD 3.31Å; P91-R95 WeakPolarHBondContact O-CD 3.4Å; P91-R95 WeakPolarHBondContact O-CG 3.39Å; P91-R95 PolarHBondContact O-N 3.34Å; V92-R95 WeakPolarHBondContact O-CB 3.41Å; V92-R95 PolarHBondContact O-N 3.15Å; V92-R95 VanDerWaalsContact O-N 3.16Å; R95-D98 PolarHBondContact O-N 2.83Å; R95-C99 WeakPolarHBondContact O-CB 3.39Å; R95-C99 PolarHBondContact O-N 3.01Å
96	A	55.4	Low	57.6	Low	43 Å²	43	65.1 Å²	65.1	36%	0.355	32%	0.316	S	S	.	.	H	α-helix	trans	-60.6	-48.5	176.1	0	0	0	0	0	111.7	M35 V92 S93 R94 C99 W100	M35-A96 HydrophobicContact CG-CB 4.13Å; V92-A96 PolarHBondContact O-N 3.04Å; S93-A96 PolarHBondContact O-N 2.77Å; R94-A96 VanDerWaalsContact C-N 3.33Å; R94-A96 PolarHBondContact O-N 3.19Å; A96-C99 PolarHBondContact O-N 3.02Å; A96-W100 WeakPolarHBondContact O-CB 3.49Å; A96-W100 PolarHBondContact O-N 3.09Å
97	Y	60.4	Low	56.4	Low	23 Å²	23	68.5 Å²	68.5	9%	0.09	33%	0.326	C	S	.	.	H	α-helix	trans	-60.6	-47	175.8	179.9	-92.7	0	0	0	112.4	L38 L88 S93 R94 C99 W100 L101	L38-Y97 HydrophobicContact CD2-CD2 4.19Å; L88-Y97 HydrophobicContact CD2-CD1 4.3Å; L88-Y97 HydrophobicContact CD2-CD2 4.24Å; L88-Y97 HydrophobicContact CD2-CG 3.98Å; S93-Y97 WeakPolarHBondContact O-CB 3.38Å; S93-Y97 PolarHBondContact O-N 3.24Å; R94-Y97 PolarHBondContact O-N 3.38Å; Y97-C99 VanDerWaalsContact C-N 3.32Å; Y97-C99 PolarHBondContact O-N 2.93Å; Y97-W100 HydrophobicContact CD2-CE3 4.38Å; Y97-W100 HydrophobicContact CD2-CZ3 4.47Å; Y97-W100 HydrophobicContact CE2-CE3 4.36Å; Y97-W100 HydrophobicContact CE2-CZ3 4.07Å; Y97-W100 PolarHBondContact O-N 2.84Å; Y97-L101 HydrophobicContact CE1-CD2 4.22Å; Y97-L101 VanDerWaalsContact O-CB 3.25Å; Y97-L101 WeakPolarHBondContact O-CB 3.2Å; Y97-L101 PolarHBondContact O-N 3.1Å
98	D	54.6	Low	55.3	Low	54 Å²	54	76 Å²	76	29%	0.289	35%	0.353	S	S	.	.	H	α-helix	trans	-68.7	-29.3	179.9	-74.6	-37.7	0	0	0	112.9	R94 R95 R102	R94-D98 IonicContact CZ-OD1 3.69Å; R94-D98 IonicContact CZ-OD2 2.84Å; R94-D98 IonicContact NE-OD1 2.72Å; R94-D98 IonicContact NE-OD2 3.85Å; R94-D98 PolarHBondContact NE-OD2 2.9Å; R94-D98 IonicContact NH2-OD1 3.35Å; R94-D98 PolarHBondContact NH2-OD1 3.46Å; R94-D98 IonicContact NH2-OD2 3.08Å; R94-D98 PolarHBondContact NH2-OD2 2.82Å; R94-D98 PolarHBondContact O-N 3.37Å; R95-D98 PolarHBondContact O-N 2.83Å; D98-R102 WeakPolarHBondContact O-CB 3.19Å; D98-R102 PolarHBondContact O-N 2.94Å; D98-R102 VanDerWaalsContact O-N 3.14Å
99	C	53.5	Low	54.2	Low	80 Å²	80	80.1 Å²	80.1	54%	0.541	37%	0.37	S	S	.	.	H	α-helix	trans	-70	-50.2	172.9	-170.4	0	0	0	0	111.1	R95 A96 Y97 L101 R102 E103	R95-C99 WeakPolarHBondContact O-CB 3.39Å; R95-C99 PolarHBondContact O-N 3.01Å; A96-C99 PolarHBondContact O-N 3.02Å; Y97-C99 VanDerWaalsContact C-N 3.32Å; Y97-C99 PolarHBondContact O-N 2.93Å; C99-L101 VanDerWaalsContact C-N 3.34Å; C99-L101 PolarHBondContact O-N 3.38Å; C99-R102 WeakPolarHBondContact O-CA 3.16Å; C99-R102 VanDerWaalsContact O-CB 3.3Å; C99-R102 WeakPolarHBondContact O-CB 3.26Å; C99-R102 PolarHBondContact O-N 3.2Å; C99-R102 VanDerWaalsContact O-N 3.09Å; C99-E103 PolarHBondContact O-N 2.96Å
100	W	61.9	Low	53	Low	43 Å²	43	76.6 Å²	76.6	16%	0.163	36%	0.363	C	S	.	.	H	α-helix	trans	-61.1	-40.6	175.6	175.1	85.4	0	0	0	112.1	S48 A50 L53 A96 Y97 R102 E103 Q104	S48-W100 WeakPolarHBondContact O-CZ2 3.49Å; A50-W100 HydrophobicContact CB-CE3 4.41Å; A50-W100 HydrophobicContact CB-CH2 3.78Å; A50-W100 HydrophobicContact CB-CZ3 3.59Å; L53-W100 HydrophobicContact CD1-CH2 3.57Å; L53-W100 HydrophobicContact CD1-CZ2 4.39Å; L53-W100 HydrophobicContact CD1-CZ3 3.88Å; A96-W100 WeakPolarHBondContact O-CB 3.49Å; A96-W100 PolarHBondContact O-N 3.09Å; Y97-W100 HydrophobicContact CD2-CE3 4.38Å; Y97-W100 HydrophobicContact CD2-CZ3 4.47Å; Y97-W100 HydrophobicContact CE2-CE3 4.36Å; Y97-W100 HydrophobicContact CE2-CZ3 4.07Å; Y97-W100 PolarHBondContact O-N 2.84Å; W100-R102 VanDerWaalsContact C-N 3.28Å; W100-R102 PolarHBondContact O-N 3.11Å; W100-E103 WeakPolarHBondContact O-CB 3.43Å; W100-E103 PolarHBondContact O-N 2.73Å; W100-E103 VanDerWaalsContact O-N 3.16Å; W100-Q104 HydrophobicContact CD2-CG 4.16Å; W100-Q104 HydrophobicContact CZ2-CG 4.24Å; W100-Q104 WeakPolarHBondContact O-CG 3.39Å; W100-Q104 PolarHBondContact O-N 2.98Å
101	L	55	Low	51.8	Low	20 Å²	20	77.9 Å²	77.9	11%	0.105	38%	0.375	C	S	.	.	H	α-helix	trans	-60.6	-38	173.8	-173.1	70.5	0	0	0	111.9	A50 Y97 C99 R105	A50-L101 HydrophobicContact CB-CD1 3.65Å; Y97-L101 HydrophobicContact CE1-CD2 4.22Å; Y97-L101 VanDerWaalsContact O-CB 3.25Å; Y97-L101 WeakPolarHBondContact O-CB 3.2Å; Y97-L101 PolarHBondContact O-N 3.1Å; C99-L101 VanDerWaalsContact C-N 3.34Å; C99-L101 PolarHBondContact O-N 3.38Å; L101-R105 WeakPolarHBondContact O-CG 3.48Å; L101-R105 PolarHBondContact O-N 3.3Å; L101-R105 VanDerWaalsContact O-N 3.1Å
102	R	50.2	Low	51.1	Low	135 Å²	135	80.6 Å²	80.6	51%	0.509	38%	0.384	S	S	.	.	H	α-helix	trans	-66.5	-41.9	175.2	-160.1	178.7	-63.2	-142.2	0.5	110.9	D98 C99 W100 R105 L106	D98-R102 WeakPolarHBondContact O-CB 3.19Å; D98-R102 PolarHBondContact O-N 2.94Å; D98-R102 VanDerWaalsContact O-N 3.14Å; C99-R102 WeakPolarHBondContact O-CA 3.16Å; C99-R102 VanDerWaalsContact O-CB 3.3Å; C99-R102 WeakPolarHBondContact O-CB 3.26Å; C99-R102 PolarHBondContact O-N 3.2Å; C99-R102 VanDerWaalsContact O-N 3.09Å; W100-R102 VanDerWaalsContact C-N 3.28Å; W100-R102 PolarHBondContact O-N 3.11Å; R102-R105 PolarHBondContact O-N 2.84Å; R102-L106 WeakPolarHBondContact O-CG 3.29Å; R102-L106 PolarHBondContact O-N 2.92Å
103	E	51	Low	50.1	Low	68 Å²	68	83.3 Å²	83.3	32%	0.318	40%	0.395	S	S	.	.	H	α-helix	trans	-60.5	-47.6	174	-156	-148.8	136	0	0	112	C99 W100 R105 L106 R107	C99-E103 PolarHBondContact O-N 2.96Å; W100-E103 WeakPolarHBondContact O-CB 3.43Å; W100-E103 PolarHBondContact O-N 2.73Å; W100-E103 VanDerWaalsContact O-N 3.16Å; E103-R105 VanDerWaalsContact C-N 3.32Å; E103-R105 PolarHBondContact O-N 3.31Å; E103-L106 WeakPolarHBondContact O-CB 3.42Å; E103-L106 PolarHBondContact O-N 2.8Å; E103-L106 VanDerWaalsContact O-N 3.07Å; E103-R107 WeakPolarHBondContact O-CG 3.25Å; E103-R107 PolarHBondContact O-N 3.41Å; E103-R107 IonicContact OE1-CZ 2.74Å; E103-R107 IonicContact OE1-NE 3.26Å; E103-R107 PolarHBondContact OE1-NE 3.23Å; E103-R107 IonicContact OE1-NH2 2.65Å; E103-R107 PolarHBondContact OE1-NH2 3.48Å
104	Q	53.1	Low	49.4	Very low	41 Å²	41	86.2 Å²	86.2	19%	0.192	42%	0.416	C	S	.	.	H	α-helix	trans	-63.4	-34.6	178	-64.3	-62.3	-21.7	0	0	112.7	A50 W100 R108	A50-Q104 HydrophobicContact CB-CB 4.41Å; A50-Q104 HydrophobicContact CB-CG 4.41Å; W100-Q104 HydrophobicContact CD2-CG 4.16Å; W100-Q104 HydrophobicContact CZ2-CG 4.24Å; W100-Q104 WeakPolarHBondContact O-CG 3.39Å; W100-Q104 PolarHBondContact O-N 2.98Å; Q104-R108 PolarHBondContact O-N 3.31Å
105	R	50.5	Low	48.2	Very low	109 Å²	109	86.3 Å²	86.3	41%	0.411	44%	0.44	S	S	.	.	H	α-helix	trans	-66.9	-37.4	171.9	-71.6	179.1	-169.9	-155.1	4.4	112.2	L101 R102 E103 R108 K109 D978	L101-R105 WeakPolarHBondContact O-CG 3.48Å; L101-R105 PolarHBondContact O-N 3.3Å; L101-R105 VanDerWaalsContact O-N 3.1Å; R102-R105 PolarHBondContact O-N 2.84Å; E103-R105 VanDerWaalsContact C-N 3.32Å; E103-R105 PolarHBondContact O-N 3.31Å; R105-R108 PolarHBondContact O-N 3.39Å; R105-K109 PolarHBondContact O-N 3.03Å; R105-K109 VanDerWaalsContact O-N 3.08Å; R105-D978 IonicContact CZ-OD1 3.51Å; R105-D978 IonicContact CZ-OD2 2.67Å; R105-D978 IonicContact NH1-OD1 3.51Å; R105-D978 PolarHBondContact NH1-OD1 3.48Å; R105-D978 IonicContact NH1-OD2 2.7Å; R105-D978 PolarHBondContact NH1-OD2 3.16Å
106	L	45.8	Very low	47.6	Very low	75 Å²	75	87.9 Å²	87.9	39%	0.393	45%	0.451	S	S	.	.	H	α-helix	trans	-68.5	-43.5	175.2	-69.9	163.7	0	0	0	111.8	R102 E103 R108 K109 C110 L144	R102-L106 WeakPolarHBondContact O-CG 3.29Å; R102-L106 PolarHBondContact O-N 2.92Å; E103-L106 WeakPolarHBondContact O-CB 3.42Å; E103-L106 PolarHBondContact O-N 2.8Å; E103-L106 VanDerWaalsContact O-N 3.07Å; L106-R108 VanDerWaalsContact C-N 3.27Å; L106-R108 PolarHBondContact O-N 3.32Å; L106-K109 PolarHBondContact O-N 3.43Å; L106-K109 VanDerWaalsContact O-N 3.12Å; L106-C110 PolarHBondContact O-N 2.9Å; L106-L144 HydrophobicContact CD1-CD1 3.93Å; L106-L144 HydrophobicContact CD1-CD2 4.23Å
107	R	44.4	Very low	46.8	Very low	105 Å²	105	87.9 Å²	87.9	40%	0.396	45%	0.448	S	S	.	.	H	α-helix	trans	-52.2	-44.5	172.2	-70.3	177.1	-177.5	-151	4.3	111.3	E103 C111	E103-R107 WeakPolarHBondContact O-CG 3.25Å; E103-R107 PolarHBondContact O-N 3.41Å; E103-R107 IonicContact OE1-CZ 2.74Å; E103-R107 IonicContact OE1-NE 3.26Å; E103-R107 PolarHBondContact OE1-NE 3.23Å; E103-R107 IonicContact OE1-NH2 2.65Å; E103-R107 PolarHBondContact OE1-NH2 3.48Å; R107-C111 PolarHBondContact O-SG 3.39Å; R107-C111 VanDerWaalsContact O-SG 3.4Å
108	R	45.8	Very low	46	Very low	171 Å²	171	91 Å²	91	65%	0.645	47%	0.47	S	S	*	.	H	α-helix	trans	-69	-38.8	176	-73.1	-172.8	177.7	-179.1	1.3	114.1	Q104 R105 L106	Q104-R108 PolarHBondContact O-N 3.31Å; R105-R108 PolarHBondContact O-N 3.39Å; L106-R108 VanDerWaalsContact C-N 3.27Å; L106-R108 PolarHBondContact O-N 3.32Å
109	K	42.6	Very low	45.1	Very low	110 Å²	110	91.7 Å²	91.7	48%	0.478	47%	0.473	S	S	.	.	H	α-helix	trans	-68.3	-33.3	178	-81.3	-171.5	170.8	-172.5	0	113.2	R105 L106 C979	R105-K109 PolarHBondContact O-N 3.03Å; R105-K109 VanDerWaalsContact O-N 3.08Å; L106-K109 PolarHBondContact O-N 3.43Å; L106-K109 VanDerWaalsContact O-N 3.12Å; K109-C979 PolarHBondContact NZ-SG 3.39Å
110	C	39.2	Very low	44.2	Very low	48 Å²	48	93.6 Å²	93.6	32%	0.324	48%	0.477	S	S	.	.	H	α-helix	trans	-74.5	-28.9	-174.5	-163.9	0	0	0	0	114.3	L106	L106-C110 PolarHBondContact O-N 2.9Å
111	C	39.3	Very low	43	Very low	76 Å²	76	98.4 Å²	98.4	51%	0.514	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-1.5	-167.4	-65.7	0	0	0	0	115.6	R107 N113	R107-C111 PolarHBondContact O-SG 3.39Å; R107-C111 VanDerWaalsContact O-SG 3.4Å; C111-N113 PolarHBondContact O-N 3.22Å
112	L	39.7	Very low	42.2	Very low	141 Å²	141	100.8 Å²	100.8	74%	0.738	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-7.7	-166.4	-84.6	164	0	0	0	116.7
113	N	38.6	Very low	41.6	Very low	165 Å²	165	98.8 Å²	98.8	88%	0.882	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.6	0.9	-170.5	-93.3	-24.8	0	0	0	117.2	C111	C111-N113 PolarHBondContact O-N 3.22Å
114	S	41.8	Very low	40.8	Very low	75 Å²	75	98.9 Å²	98.9	52%	0.524	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.8	-17.8	-176.2	67.9	0	0	0	0	117.2	K116	S114-K116 PolarHBondContact O-N 2.97Å; S114-K116 PolarHBondContact OG-O 2.87Å
115	G	37.6	Very low	39.8	Very low	78 Å²	78	103.9 Å²	103.9	80%	0.804	55%	0.553	S	S	*	*	S	Bend	trans	62.6	2.8	-179	0	0	0	0	0	116.1
116	K	39.2	Very low	38.8	Very low	186 Å²	186	106.2 Å²	106.2	81%	0.809	57%	0.574	S	S	*	*			trans	-134.3	107.2	-177.3	-65.6	-176.7	179.6	-176.6	0	109.4	S114	S114-K116 PolarHBondContact O-N 2.97Å; S114-K116 PolarHBondContact OG-O 2.87Å
117	C	39.4	Very low	38.2	Very low	42 Å²	42	109.2 Å²	109.2	28%	0.284	58%	0.584	S	S	.	*			trans	-140.2	103.9	174.2	-170.9	0	0	0	0	109.5	L119	C117-L119 PolarHBondContact O-N 3.37Å; C117-L119 VanDerWaalsContact O-N 3.17Å
118	T	42.5	Very low	37.4	Very low	89 Å²	89	108.8 Å²	108.8	55%	0.546	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.6	-8	-178	40	0	0	0	0	114	L120 E121	T118-L120 PolarHBondContact O-N 2.82Å; T118-L120 VanDerWaalsContact O-N 3.1Å; T118-E121 PolarHBondContact O-N 3.36Å; T118-E121 VanDerWaalsContact O-N 3.16Å
119	L	35.7	Very low	36.4	Very low	68 Å²	68	112.8 Å²	112.8	36%	0.356	61%	0.612	S	S	.	*	H	α-helix	trans	-55.9	-27.6	176.9	-159.3	77.2	0	0	0	113	C117 L123 I134	C117-L119 PolarHBondContact O-N 3.37Å; C117-L119 VanDerWaalsContact O-N 3.17Å; L119-L123 HydrophobicContact CD2-CD1 4.25Å; L119-L123 HydrophobicContact CG-CD1 4.04Å; L119-L123 WeakPolarHBondContact O-CG 3.09Å; L119-L123 PolarHBondContact O-N 3.32Å; L119-I134 HydrophobicContact CD1-CG2 3.65Å
120	L	34.4	Very low	35.8	Very low	121 Å²	121	110.7 Å²	110.7	63%	0.634	62%	0.622	S	S	*	*	H	α-helix	trans	-72.1	-24.6	-179.4	-75	166.8	0	0	0	114.3	T118	T118-L120 PolarHBondContact O-N 2.82Å; T118-L120 VanDerWaalsContact O-N 3.1Å
121	E	37.3	Very low	35.3	Very low	144 Å²	144	113.5 Å²	113.5	67%	0.673	64%	0.642	S	S	*	*	H	α-helix	trans	-86	-12.5	-178.9	-66.2	-173	114.7	0	0	113.9	T118	T118-E121 PolarHBondContact O-N 3.36Å; T118-E121 VanDerWaalsContact O-N 3.16Å
122	L	39	Very low	34.9	Very low	70 Å²	70	113 Å²	113	37%	0.366	64%	0.636	S	S	.	*	H	α-helix	trans	-102.9	-29.1	-177.2	-74.4	164.1	0	0	0	113.1	G124 F127 V132	L122-G124 PolarHBondContact O-N 3.12Å; L122-F127 WeakPolarHBondContact O-CE2 3.48Å; L122-V132 HydrophobicContact CD1-CG1 4Å
123	L	37.2	Very low	34.5	Very low	92 Å²	92	109.2 Å²	109.2	48%	0.482	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75	2.3	178.7	-68.2	173	0	0	0	114.4	L119	L119-L123 HydrophobicContact CD2-CD1 4.25Å; L119-L123 HydrophobicContact CG-CD1 4.04Å; L119-L123 WeakPolarHBondContact O-CG 3.09Å; L119-L123 PolarHBondContact O-N 3.32Å
124	G	33.3	Very low	34.3	Very low	70 Å²	70	104.9 Å²	104.9	72%	0.722	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	21.4	178.5	0	0	0	0	0	114.7	L122	L122-G124 PolarHBondContact O-N 3.12Å
125	K	32.8	Very low	33.9	Very low	147 Å²	147	106 Å²	106	64%	0.639	60%	0.595	S	S	*	*	S	Bend	trans	-133.3	145.6	-178.6	-67.3	174.9	-177.5	164.4	0	110.6	F127	K125-F127 VanDerWaalsContact O-CD2 3.25Å; K125-F127 WeakPolarHBondContact O-CD2 3.49Å; K125-F127 PolarHBondContact O-N 3.07Å
126	D	29	Very low	33.8	Very low	158 Å²	158	104.1 Å²	104.1	85%	0.845	57%	0.569	S	S	*	*			trans	-63.4	116.8	-177.3	-66.7	-64	0	0	0	112.3	S128	D126-S128 PolarHBondContact O-N 2.75Å
127	F	33	Very low	33.7	Very low	138 Å²	138	103.8 Å²	103.8	61%	0.605	57%	0.57	S	S	*	*			trans	-75.5	63.4	179.8	-82.4	-95.4	0	0	0	112.4	L122 K125 V132	L122-F127 WeakPolarHBondContact O-CE2 3.48Å; K125-F127 VanDerWaalsContact O-CD2 3.25Å; K125-F127 WeakPolarHBondContact O-CD2 3.49Å; K125-F127 PolarHBondContact O-N 3.07Å; F127-V132 HydrophobicContact CE1-CG2 4.06Å
128	S	27.5	Very low	33.6	Very low	96 Å²	96	105 Å²	105	67%	0.671	58%	0.578	S	S	*	*			trans	-102.5	116.1	169.3	68	0	0	0	0	110.8	D126	D126-S128 PolarHBondContact O-N 2.75Å
129	R	26.4	Very low	33.2	Very low	254 Å²	254	104.9 Å²	104.9	96%	0.958	59%	0.594	S	S	*	*	S	Bend	trans	53.2	81.9	172.5	-63.9	175.4	168.1	165.5	-4.4	116.3
130	G	29.4	Very low	33	Very low	66 Å²	66	103.6 Å²	103.6	68%	0.68	60%	0.597	S	S	*	*			trans	-175.3	142.7	163.7	0	0	0	0	0	114.7
131	S	29.2	Very low	32.8	Very low	108 Å²	108	100.8 Å²	100.8	76%	0.755	59%	0.588	S	S	*	*			trans	-79.2	122.1	167.7	52.4	0	0	0	0	110.2
132	V	30.3	Very low	32.7	Very low	64 Å²	64	100.9 Å²	100.9	39%	0.388	58%	0.583	S	S	.	*			trans	-108.8	121.6	-179	-179.2	0	0	0	0	110.8	L122 F127 I134	L122-V132 HydrophobicContact CD1-CG1 4Å; F127-V132 HydrophobicContact CE1-CG2 4.06Å; V132-I134 HydrophobicContact CG1-CG1 4.33Å
133	S	31.5	Very low	32.2	Very low	63 Å²	63	102.3 Å²	102.3	44%	0.441	59%	0.59	S	S	.	*			trans	-80.7	135.4	170	-171.8	0	0	0	0	109.9	N238	S133-N238 PolarHBondContact OG-ND2 2.81Å
134	I	33.4	Very low	32.1	Very low	74 Å²	74	100.9 Å²	100.9	38%	0.379	58%	0.583	S	S	.	*			trans	-121.6	83.9	-176.3	-53.4	179	0	0	0	110.1	L119 V132 C136	L119-I134 HydrophobicContact CD1-CG2 3.65Å; V132-I134 HydrophobicContact CG1-CG1 4.33Å; I134-C136 PolarHBondContact O-N 3.46Å
135	E	33.4	Very low	32.1	Very low	99 Å²	99	101.9 Å²	101.9	46%	0.463	58%	0.579	S	S	.	*			trans	-79.7	105	179	-61.9	-163.4	160.7	0	0	111.8
136	C	35.3	Very low	32.2	Very low	37 Å²	37	99.4 Å²	99.4	25%	0.25	57%	0.572	C	S	.	*			trans	-94.7	111.2	165.1	-162.5	0	0	0	0	110.3	I134 C138	I134-C136 PolarHBondContact O-N 3.46Å; C136-C138 HydrophobicContact CB-CB 4.41Å; C136-C138 WeakPolarHBondContact CB-SG 3.43Å; C136-C138 PolarHBondContact O-N 2.83Å; C136-C138 WeakPolarHBondContact SG-CB 3.48Å; C136-C138 CovalentContact SG-SG 2.05Å; C136-C138 PolarHBondContact SG-SG 2.97Å
137	H	38.5	Very low	32.3	Very low	180 Å²	180	97.9 Å²	97.9	83%	0.833	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	9.9	170.3	-60	-42.2	0	0	0	113.9
138	C	35.9	Very low	32.4	Very low	67 Å²	67	95.1 Å²	95.1	45%	0.453	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-7.5	-173.5	58.7	0	0	0	0	115.1	C136 G140 C141	C136-C138 HydrophobicContact CB-CB 4.41Å; C136-C138 WeakPolarHBondContact CB-SG 3.43Å; C136-C138 PolarHBondContact O-N 2.83Å; C136-C138 WeakPolarHBondContact SG-CB 3.48Å; C136-C138 CovalentContact SG-SG 2.05Å; C136-C138 PolarHBondContact SG-SG 2.97Å; C138-G140 PolarHBondContact O-N 3.15Å; C138-C141 PolarHBondContact SG-SG 3.15Å
139	G	33.9	Very low	32.7	Very low	86 Å²	86	98.6 Å²	98.6	89%	0.887	56%	0.555	S	S	*	*	S	Bend	trans	66.9	2.1	170.5	0	0	0	0	0	117.3
140	G	31.8	Very low	33.1	Very low	41 Å²	41	93.8 Å²	93.8	42%	0.423	54%	0.543	S	S	.	.			trans	-153.3	55.3	-171.9	0	0	0	0	0	113.9	C138 Y142	C138-G140 PolarHBondContact O-N 3.15Å; G140-Y142 VanDerWaalsContact O-CD2 3.27Å; G140-Y142 WeakPolarHBondContact O-CD2 3.19Å; G140-Y142 VanDerWaalsContact O-CE2 3.25Å; G140-Y142 WeakPolarHBondContact O-CE2 3.48Å
141	C	31.2	Very low	33.2	Very low	63 Å²	63	98.5 Å²	98.5	43%	0.426	54%	0.542	S	S	.	.			trans	-82.2	129.8	171.7	-68.3	0	0	0	0	111.1	C138 G159	C138-C141 PolarHBondContact SG-SG 3.15Å; C141-G159 WeakPolarHBondContact CB-O 3.42Å
142	Y	35	Very low	33.1	Very low	145 Å²	145	97 Å²	97	57%	0.569	54%	0.543	S	S	*	.			trans	-99.8	165.2	-176.3	-64.1	-89.2	0	0	0	112.3	G140 L144 E733	G140-Y142 VanDerWaalsContact O-CD2 3.27Å; G140-Y142 WeakPolarHBondContact O-CD2 3.19Å; G140-Y142 VanDerWaalsContact O-CE2 3.25Å; G140-Y142 WeakPolarHBondContact O-CE2 3.48Å; Y142-L144 PolarHBondContact O-N 3.01Å; Y142-E733 WeakPolarHBondContact CD1-OE2 3.43Å; Y142-E733 WeakPolarHBondContact CE1-OE2 3.46Å
143	L	29.3	Very low	33.1	Very low	101 Å²	101	96.7 Å²	96.7	53%	0.529	54%	0.543	S	S	.	.			trans	-54.5	114.7	-178.2	-91.1	151.1	0	0	0	113.1
144	L	34.3	Very low	33.4	Very low	61 Å²	61	96.8 Å²	96.8	32%	0.319	54%	0.539	S	S	.	.			trans	-117.7	121.3	160.9	-77.7	167.4	0	0	0	108.7	L106 Y142 L157	L106-L144 HydrophobicContact CD1-CD1 3.93Å; L106-L144 HydrophobicContact CD1-CD2 4.23Å; Y142-L144 PolarHBondContact O-N 3.01Å; L144-L157 HydrophobicContact CB-CD1 3.89Å
145	S	32.3	Very low	33.7	Very low	92 Å²	92	96.7 Å²	96.7	64%	0.643	54%	0.536	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	108.1	165.7	-174	0	0	0	0	107.3
146	L	35.1	Very low	34.1	Very low	94 Å²	94	95.5 Å²	95.5	49%	0.492	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	98.6	175.2	-75.6	167.8	0	0	0	108.2	D148 F155	L146-D148 PolarHBondContact O-N 2.92Å; L146-F155 PolarHBondContact N-O 2.71Å; L146-F155 PolarHBondContact O-N 2.86Å
147	K	32.5	Very low	34.3	Very low	127 Å²	127	95.5 Å²	95.5	55%	0.552	53%	0.526	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	97.5	160.8	-79.9	-171.2	172.7	-170.8	0	108.2	D154 E740	K147-D154 WeakPolarHBondContact CG-OD1 3.34Å; K147-E740 IonicContact NZ-OE2 3.89Å; K147-E740 PolarHBondContact NZ-OE2 3.4Å
148	D	33.8	Very low	34.5	Very low	79 Å²	79	88.1 Å²	88.1	42%	0.422	49%	0.492	S	S	.	.			trans	-95	108.5	164	-168	-18.2	0	0	0	109.4	L146 Q150	L146-D148 PolarHBondContact O-N 2.92Å; D148-Q150 PolarHBondContact O-N 3.42Å; D148-Q150 VanDerWaalsContact OD1-CB 3.32Å; D148-Q150 WeakPolarHBondContact OD1-CB 3.27Å; D148-Q150 PolarHBondContact OD1-N 3.02Å
149	Q	34.5	Very low	35.1	Very low	169 Å²	169	86.9 Å²	86.9	79%	0.79	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-13.9	-178.9	-61.8	-165.2	-93.7	0	0	112.9
150	Q	34.2	Very low	35.4	Very low	154 Å²	154	84.3 Å²	84.3	72%	0.72	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-16.2	-174.5	-162	161.5	0.7	0	0	113.7	D148	D148-Q150 PolarHBondContact O-N 3.42Å; D148-Q150 VanDerWaalsContact OD1-CB 3.32Å; D148-Q150 WeakPolarHBondContact OD1-CB 3.27Å; D148-Q150 PolarHBondContact OD1-N 3.02Å
151	Y	32.8	Very low	35.8	Very low	165 Å²	165	83 Å²	83	65%	0.647	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.3	-2	-175.1	-63.4	-72.7	0	0	0	115.8	C153	Y151-C153 PolarHBondContact O-N 3.06Å; Y151-C153 VanDerWaalsContact O-N 3.12Å
152	G	26.7	Very low	36.3	Very low	75 Å²	75	82 Å²	82	77%	0.773	44%	0.436	S	S	*	.			trans	71.2	3.9	169.2	0	0	0	0	0	116.6
153	C	30	Very low	36.9	Very low	59 Å²	59	75.8 Å²	75.8	40%	0.399	41%	0.412	S	S	.	.			trans	-109.5	115.5	177.1	-65.7	0	0	0	0	110.1	Y151 F155	Y151-C153 PolarHBondContact O-N 3.06Å; Y151-C153 VanDerWaalsContact O-N 3.12Å; C153-F155 HydrophobicContact CB-CD2 4.26Å; C153-F155 HydrophobicContact CB-CE2 3.61Å; C153-F155 HydrophobicContact CB-CZ 4.14Å; C153-F155 VanDerWaalsContact O-CD2 3.24Å; C153-F155 WeakPolarHBondContact O-CD2 3.43Å
154	D	37.9	Very low	37.6	Very low	64 Å²	64	73 Å²	73	34%	0.342	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	138.8	165.2	-84.2	-34.1	0	0	0	109.6	K147 P164 M165	K147-D154 WeakPolarHBondContact CG-OD1 3.34Å; D154-P164 CarbonylContact O-C 3.58Å; D154-P164 WeakPolarHBondContact O-CA 3.2Å; D154-M165 HydrophobicContact CB-CB 4.01Å; D154-M165 HydrophobicContact CB-CE 3.51Å; D154-M165 HydrophobicContact CB-CG 3.99Å; D154-M165 PolarHBondContact O-N 3.08Å; D154-M165 VanDerWaalsContact OD2-CE 3.32Å; D154-M165 WeakPolarHBondContact OD2-CE 3.4Å
155	F	39.3	Very low	38.1	Very low	73 Å²	73	73.5 Å²	73.5	32%	0.32	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	140.1	174.5	-74.3	-93.9	0	0	0	113.1	L146 C153 W163 P164	L146-F155 PolarHBondContact N-O 2.71Å; L146-F155 PolarHBondContact O-N 2.86Å; C153-F155 HydrophobicContact CB-CD2 4.26Å; C153-F155 HydrophobicContact CB-CE2 3.61Å; C153-F155 HydrophobicContact CB-CZ 4.14Å; C153-F155 VanDerWaalsContact O-CD2 3.24Å; C153-F155 WeakPolarHBondContact O-CD2 3.43Å; F155-W163 CarbonylContact C-O 3.48Å; F155-W163 WeakPolarHBondContact CA-O 3.45Å; F155-P164 HydrophobicContact CD1-CB 4.04Å; F155-P164 HydrophobicContact CE1-CB 3.67Å; F155-P164 HydrophobicContact CE1-CG 4.19Å; F155-P164 HydrophobicContact CZ-CB 4.1Å
156	K	41.9	Very low	39	Very low	74 Å²	74	73.1 Å²	73.1	32%	0.322	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	108.5	-174.7	-155.9	168.2	-173	173.2	0	110.1	F158 W163 M165	K156-F158 HydrophobicContact CB-CE2 4.48Å; K156-F158 HydrophobicContact CD-CE2 3.73Å; K156-F158 HydrophobicContact CD-CZ 4.11Å; K156-F158 HydrophobicContact CG-CD2 4.3Å; K156-F158 HydrophobicContact CG-CE2 3.79Å; K156-F158 HydrophobicContact CG-CZ 4.28Å; K156-W163 PolarHBondContact N-O 3.21Å; K156-W163 PolarHBondContact O-N 3.15Å; K156-M165 HydrophobicContact CB-CG 4.18Å; K156-M165 HydrophobicContact CB-SD 4.46Å; K156-M165 HydrophobicContact CD-CG 4.42Å; K156-M165 HydrophobicContact CD-SD 3.79Å
157	L	40.4	Very low	40.3	Very low	37 Å²	37	71.8 Å²	71.8	19%	0.194	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	120.8	175.9	-91.2	153.2	0	0	0	111	L144 C162	L144-L157 HydrophobicContact CB-CD1 3.89Å; L157-C162 HydrophobicContact CD2-CB 3.89Å; L157-C162 HydrophobicContact CG-CB 4.1Å
158	F	41.5	Very low	41.9	Very low	24 Å²	24	72.7 Å²	72.7	11%	0.105	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	106.1	171.2	-78.7	-69.1	0	0	0	109.1	K156 S160 V161 W163	K156-F158 HydrophobicContact CB-CE2 4.48Å; K156-F158 HydrophobicContact CD-CE2 3.73Å; K156-F158 HydrophobicContact CD-CZ 4.11Å; K156-F158 HydrophobicContact CG-CD2 4.3Å; K156-F158 HydrophobicContact CG-CE2 3.79Å; K156-F158 HydrophobicContact CG-CZ 4.28Å; F158-S160 PolarHBondContact O-N 2.82Å; F158-V161 PolarHBondContact N-O 3.22Å; F158-V161 PolarHBondContact O-N 3.09Å; F158-W163 AromaticContact CD2-CD1 3.98Å
159	G	48.7	Very low	43.8	Very low	42 Å²	42	72 Å²	72	43%	0.433	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	-120.8	-173.7	0	0	0	0	0	111.4	C141	C141-G159 WeakPolarHBondContact CB-O 3.42Å
160	S	40.7	Very low	45.8	Very low	32 Å²	32	64.7 Å²	64.7	22%	0.224	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	7.6	178.7	58.3	0	0	0	0	114.3	F158	F158-S160 PolarHBondContact O-N 2.82Å
161	V	40.4	Very low	47.5	Very low	14 Å²	14	58.3 Å²	58.3	9%	0.085	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	133.3	-172.9	-160.8	0	0	0	0	111.6	F158 W163	F158-V161 PolarHBondContact N-O 3.22Å; F158-V161 PolarHBondContact O-N 3.09Å; V161-W163 HydrophobicContact CB-CH2 4.38Å; V161-W163 HydrophobicContact CB-CZ2 3.66Å; V161-W163 HydrophobicContact CG1-CD2 4.11Å; V161-W163 HydrophobicContact CG1-CE3 4.3Å; V161-W163 HydrophobicContact CG1-CH2 3.54Å; V161-W163 HydrophobicContact CG1-CZ2 3.3Å; V161-W163 HydrophobicContact CG1-CZ3 4.02Å; V161-W163 HydrophobicContact CG2-CZ2 4.29Å
162	C	41.2	Very low	49.6	Very low	41 Å²	41	53.4 Å²	53.4	28%	0.277	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	117.8	-176.9	-165.7	0	0	0	0	109.7	L157	L157-C162 HydrophobicContact CD2-CB 3.89Å; L157-C162 HydrophobicContact CG-CB 4.1Å
163	W	48.5	Very low	52.3	Low	15 Å²	15	51.2 Å²	51.2	6%	0.057	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	128.4	-174.4	-55.5	105.1	0	0	0	111.4	F155 K156 F158 V161 L174 C237 L239	F155-W163 CarbonylContact C-O 3.48Å; F155-W163 WeakPolarHBondContact CA-O 3.45Å; K156-W163 PolarHBondContact N-O 3.21Å; K156-W163 PolarHBondContact O-N 3.15Å; F158-W163 AromaticContact CD2-CD1 3.98Å; V161-W163 HydrophobicContact CB-CH2 4.38Å; V161-W163 HydrophobicContact CB-CZ2 3.66Å; V161-W163 HydrophobicContact CG1-CD2 4.11Å; V161-W163 HydrophobicContact CG1-CE3 4.3Å; V161-W163 HydrophobicContact CG1-CH2 3.54Å; V161-W163 HydrophobicContact CG1-CZ2 3.3Å; V161-W163 HydrophobicContact CG1-CZ3 4.02Å; V161-W163 HydrophobicContact CG2-CZ2 4.29Å; W163-L174 HydrophobicContact CD2-CD1 3.82Å; W163-L174 HydrophobicContact CE3-CD1 4.49Å; W163-L174 HydrophobicContact CG-CD1 3.84Å; W163-L174 HydrophobicContact CZ2-CD1 4.49Å; W163-L174 HydrophobicContact CZ2-CD2 3.98Å; W163-C237 HydrophobicContact CH2-CB 3.54Å; W163-C237 VanDerWaalsContact CH2-SG 3.58Å; W163-C237 HydrophobicContact CZ3-CB 3.81Å; W163-C237 WeakPolarHBondContact CZ3-SG 3.43Å; W163-L239 HydrophobicContact CH2-CD2 4.42Å; W163-L239 HydrophobicContact CZ2-CD2 4.26Å
164	P	43.1	Very low	54.7	Low	41 Å²	41	48.6 Å²	48.6	27%	0.266	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	135.8	168.9	28.1	-32.3	0	0	0	109.9	D154 F155 R234	D154-P164 CarbonylContact O-C 3.58Å; D154-P164 WeakPolarHBondContact O-CA 3.2Å; F155-P164 HydrophobicContact CD1-CB 4.04Å; F155-P164 HydrophobicContact CE1-CB 3.67Å; F155-P164 HydrophobicContact CE1-CG 4.19Å; F155-P164 HydrophobicContact CZ-CB 4.1Å; P164-R234 VanDerWaalsContact CG-NH1 3.3Å
165	M	44.3	Very low	56.7	Low	73 Å²	73	49 Å²	49	36%	0.36	30%	0.301	S	S	.	.	S	Bend	trans	-77.3	153.1	168.5	-54.9	-147.8	-59.6	0	0	110.3	D154 K156	D154-M165 HydrophobicContact CB-CB 4.01Å; D154-M165 HydrophobicContact CB-CE 3.51Å; D154-M165 HydrophobicContact CB-CG 3.99Å; D154-M165 PolarHBondContact O-N 3.08Å; D154-M165 VanDerWaalsContact OD2-CE 3.32Å; D154-M165 WeakPolarHBondContact OD2-CE 3.4Å; K156-M165 HydrophobicContact CB-CG 4.18Å; K156-M165 HydrophobicContact CB-SD 4.46Å; K156-M165 HydrophobicContact CD-CG 4.42Å; K156-M165 HydrophobicContact CD-SD 3.79Å
166	G	52.6	Low	58.9	Low	84 Å²	84	48.7 Å²	48.7	87%	0.866	30%	0.301	S	S	*	.	S	Bend	trans	151.6	-23.2	-175.6	0	0	0	0	0	112.7
167	D	61.5	Low	61.1	Low	66 Å²	66	45.2 Å²	45.2	35%	0.353	29%	0.286	S	S	.	.			trans	-124.9	105	171.6	-178.1	-6.1	0	0	0	110.1	S169 L170 C171	D167-S169 PolarHBondContact O-N 3.33Å; D167-S169 WeakPolarHBondContact OD1-CA 3.37Å; D167-S169 VanDerWaalsContact OD1-CB 3.26Å; D167-S169 WeakPolarHBondContact OD1-CB 3.49Å; D167-S169 PolarHBondContact OD1-N 2.88Å; D167-S169 PolarHBondContact OD1-OG 2.79Å; D167-S169 PolarHBondContact OD2-OG 3.38Å; D167-L170 HydrophobicContact CB-CB 3.98Å; D167-L170 PolarHBondContact O-N 2.9Å; D167-L170 PolarHBondContact OD1-N 2.85Å; D167-C171 PolarHBondContact O-N 3.06Å; D167-C171 VanDerWaalsContact O-N 3.13Å; D167-C171 PolarHBondContact O-SG 2.97Å
168	D	65.6	Low	63.1	Low	145 Å²	145	45.7 Å²	45.7	78%	0.775	29%	0.289	S	S	*	.	H	α-helix	trans	-64.7	-26.6	176.9	-80.1	-35.6	0	0	0	112.6	C171 A172	D168-C171 PolarHBondContact O-N 3.27Å; D168-A172 WeakPolarHBondContact O-CB 3.4Å; D168-A172 PolarHBondContact O-N 3.31Å
169	S	75.1	Confident	65.1	Low	64 Å²	64	48.4 Å²	48.4	45%	0.448	30%	0.304	S	S	.	.	H	α-helix	trans	-72.7	-42.9	179.6	79.9	0	0	0	0	111.2	D167 C171 A172 L173	D167-S169 PolarHBondContact O-N 3.33Å; D167-S169 WeakPolarHBondContact OD1-CA 3.37Å; D167-S169 VanDerWaalsContact OD1-CB 3.26Å; D167-S169 WeakPolarHBondContact OD1-CB 3.49Å; D167-S169 PolarHBondContact OD1-N 2.88Å; D167-S169 PolarHBondContact OD1-OG 2.79Å; D167-S169 PolarHBondContact OD2-OG 3.38Å; S169-C171 VanDerWaalsContact C-N 3.34Å; S169-C171 PolarHBondContact O-N 3Å; S169-A172 PolarHBondContact O-N 3.32Å; S169-L173 WeakPolarHBondContact O-CG 3.38Å; S169-L173 PolarHBondContact O-N 3.23Å
170	L	75.6	Confident	67.1	Low	16 Å²	16	46.8 Å²	46.8	8%	0.084	29%	0.286	C	S	.	.	H	α-helix	trans	-61	-42.1	170.4	-177.5	62.4	0	0	0	111.3	D167 A172 L173 L174 V230 C233 R234	D167-L170 HydrophobicContact CB-CB 3.98Å; D167-L170 PolarHBondContact O-N 2.9Å; D167-L170 PolarHBondContact OD1-N 2.85Å; L170-A172 VanDerWaalsContact C-N 3.34Å; L170-A172 PolarHBondContact O-N 2.84Å; L170-L173 PolarHBondContact O-N 2.79Å; L170-L174 HydrophobicContact CD1-CD1 4.24Å; L170-L174 HydrophobicContact CD1-CG 4.4Å; L170-L174 HydrophobicContact CG-CD1 4.02Å; L170-L174 WeakPolarHBondContact O-CB 3.38Å; L170-L174 WeakPolarHBondContact O-CG 3.43Å; L170-L174 PolarHBondContact O-N 2.92Å; L170-V230 HydrophobicContact CD1-CG1 3.93Å; L170-C233 HydrophobicContact CD1-CB 4.04Å; L170-R234 HydrophobicContact CD2-CB 4.37Å
171	C	69.2	Low	69.4	Low	21 Å²	21	45.4 Å²	45.4	14%	0.142	28%	0.276	C	S	.	.	H	α-helix	trans	-60.5	-41	175.3	-66.7	0	0	0	0	112.5	D167 D168 S169 Q175	D167-C171 PolarHBondContact O-N 3.06Å; D167-C171 VanDerWaalsContact O-N 3.13Å; D167-C171 PolarHBondContact O-SG 2.97Å; D168-C171 PolarHBondContact O-N 3.27Å; S169-C171 VanDerWaalsContact C-N 3.34Å; S169-C171 PolarHBondContact O-N 3Å; C171-Q175 PolarHBondContact O-N 3.39Å; C171-Q175 VanDerWaalsContact O-N 3.09Å
172	A	77.8	Confident	71.5	Confident	61 Å²	61	52.3 Å²	52.3	50%	0.504	30%	0.302	S	S	.	.	H	α-helix	trans	-67.3	-43.4	177.7	0	0	0	0	0	112.2	D168 S169 L170 Q175 E176	D168-A172 WeakPolarHBondContact O-CB 3.4Å; D168-A172 PolarHBondContact O-N 3.31Å; S169-A172 PolarHBondContact O-N 3.32Å; L170-A172 VanDerWaalsContact C-N 3.34Å; L170-A172 PolarHBondContact O-N 2.84Å; A172-Q175 PolarHBondContact O-N 3.35Å; A172-E176 PolarHBondContact O-N 2.89Å
173	L	83.6	Confident	73.7	Confident	29 Å²	29	54 Å²	54	15%	0.152	31%	0.307	C	S	.	.	H	α-helix	trans	-62.5	-42.7	177	-71.4	169.2	0	0	0	112.2	S169 L170 E176 L177 L226 K229 V230	S169-L173 WeakPolarHBondContact O-CG 3.38Å; S169-L173 PolarHBondContact O-N 3.23Å; L170-L173 PolarHBondContact O-N 2.79Å; L173-E176 PolarHBondContact O-N 2.81Å; L173-L177 WeakPolarHBondContact O-CB 3.34Å; L173-L177 PolarHBondContact O-N 3.12Å; L173-L226 HydrophobicContact CD2-CD2 3.98Å; L173-K229 HydrophobicContact CD1-CB 4.18Å; L173-K229 HydrophobicContact CD2-CB 4.1Å; L173-K229 HydrophobicContact CD2-CD 3.99Å; L173-V230 HydrophobicContact CB-CG2 3.8Å
174	L	80.2	Confident	75.7	Confident	4 Å²	4	53.3 Å²	53.3	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-65.7	-38.3	176.9	-73.8	168.5	0	0	0	112.4	W163 L170 N178 V230 L239	W163-L174 HydrophobicContact CD2-CD1 3.82Å; W163-L174 HydrophobicContact CE3-CD1 4.49Å; W163-L174 HydrophobicContact CG-CD1 3.84Å; W163-L174 HydrophobicContact CZ2-CD1 4.49Å; W163-L174 HydrophobicContact CZ2-CD2 3.98Å; L170-L174 HydrophobicContact CD1-CD1 4.24Å; L170-L174 HydrophobicContact CD1-CG 4.4Å; L170-L174 HydrophobicContact CG-CD1 4.02Å; L170-L174 WeakPolarHBondContact O-CB 3.38Å; L170-L174 WeakPolarHBondContact O-CG 3.43Å; L170-L174 PolarHBondContact O-N 2.92Å; L174-N178 WeakPolarHBondContact O-CB 3.45Å; L174-N178 PolarHBondContact O-N 3.39Å; L174-N178 VanDerWaalsContact O-N 3.11Å; L174-V230 HydrophobicContact CD2-CG1 3.9Å; L174-V230 HydrophobicContact CD2-CG2 4.12Å; L174-V230 HydrophobicContact CG-CG1 4.47Å; L174-V230 HydrophobicContact CG-CG2 4.32Å; L174-L239 HydrophobicContact CD2-CD2 4.18Å
175	Q	79.4	Confident	77.8	Confident	72 Å²	72	57 Å²	57	34%	0.336	31%	0.313	S	S	.	.	H	α-helix	trans	-64	-45.9	172.9	-176.4	68.9	60.8	0	0	111.2	C171 A172 L177 N178 D179	C171-Q175 PolarHBondContact O-N 3.39Å; C171-Q175 VanDerWaalsContact O-N 3.09Å; A172-Q175 PolarHBondContact O-N 3.35Å; Q175-L177 VanDerWaalsContact C-N 3.32Å; Q175-L177 PolarHBondContact O-N 2.92Å; Q175-N178 PolarHBondContact O-N 3.19Å; Q175-D179 PolarHBondContact NE2-OD1 3.17Å; Q175-D179 WeakPolarHBondContact O-CB 3.4Å; Q175-D179 PolarHBondContact O-N 3.3Å
176	E	86.8	Confident	79.6	Confident	68 Å²	68	56.1 Å²	56.1	32%	0.318	31%	0.312	S	S	.	.	H	α-helix	trans	-63.4	-38.4	179.2	-163.3	-171.8	130.8	0	0	112.1	A172 L173 T180 R222 L226	A172-E176 PolarHBondContact O-N 2.89Å; L173-E176 PolarHBondContact O-N 2.81Å; E176-T180 VanDerWaalsContact O-CB 3.27Å; E176-T180 WeakPolarHBondContact O-CB 3.34Å; E176-T180 PolarHBondContact O-N 3.27Å; E176-T180 PolarHBondContact O-OG1 3.27Å; E176-R222 IonicContact OE1-CZ 2.59Å; E176-R222 IonicContact OE1-NE 2.81Å; E176-R222 PolarHBondContact OE1-NE 2.98Å; E176-R222 IonicContact OE1-NH2 2.77Å; E176-R222 PolarHBondContact OE1-NH2 2.83Å; E176-R222 IonicContact OE2-NH2 2.66Å; E176-L226 HydrophobicContact CB-CD1 4.17Å; E176-L226 HydrophobicContact CB-CD2 4.41Å; E176-L226 HydrophobicContact CG-CD1 3.87Å; E176-L226 HydrophobicContact CG-CD2 4.43Å; E176-L226 WeakPolarHBondContact OE1-CD1 3.32Å
177	L	87.3	Confident	81.2	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61.4	-46.1	175.6	-178.7	67.5	0	0	0	111.3	L173 Q175 T180 Q181 I223 L226 K227 L239 F242	L173-L177 WeakPolarHBondContact O-CB 3.34Å; L173-L177 PolarHBondContact O-N 3.12Å; Q175-L177 VanDerWaalsContact C-N 3.32Å; Q175-L177 PolarHBondContact O-N 2.92Å; L177-T180 PolarHBondContact O-N 2.96Å; L177-Q181 PolarHBondContact O-N 2.81Å; L177-I223 HydrophobicContact CD1-CB 4.39Å; L177-I223 HydrophobicContact CD1-CG2 3.79Å; L177-L226 HydrophobicContact CB-CB 4.2Å; L177-L226 HydrophobicContact CB-CD1 4.44Å; L177-L226 HydrophobicContact CD1-CB 3.64Å; L177-L226 HydrophobicContact CG-CB 4.48Å; L177-K227 HydrophobicContact CD1-CG 4.38Å; L177-L239 HydrophobicContact CD2-CD2 4Å; L177-F242 HydrophobicContact CD1-CB 4.21Å; L177-F242 HydrophobicContact CD1-CD1 4.43Å; L177-F242 HydrophobicContact CD1-CG 4.36Å; L177-F242 HydrophobicContact CD2-CB 4.12Å; L177-F242 HydrophobicContact CD2-CD1 3.96Å; L177-F242 HydrophobicContact CD2-CD2 3.65Å; L177-F242 HydrophobicContact CD2-CE1 4.28Å; L177-F242 HydrophobicContact CD2-CE2 3.99Å; L177-F242 HydrophobicContact CD2-CG 3.63Å; L177-F242 HydrophobicContact CD2-CZ 4.28Å; L177-F242 HydrophobicContact CG-CB 4.2Å; L177-F242 HydrophobicContact CG-CD1 3.68Å; L177-F242 HydrophobicContact CG-CD2 4.31Å; L177-F242 HydrophobicContact CG-CE1 4.1Å; L177-F242 HydrophobicContact CG-CG 3.8Å
178	N	82.3	Confident	82.4	Confident	48 Å²	48	51.3 Å²	51.3	26%	0.257	27%	0.267	S	S	.	.	H	α-helix	trans	-67.8	-46	178.6	-174.1	43.8	0	0	0	112.5	L174 Q175 T180 Q181 Y182 F242	L174-N178 WeakPolarHBondContact O-CB 3.45Å; L174-N178 PolarHBondContact O-N 3.39Å; L174-N178 VanDerWaalsContact O-N 3.11Å; Q175-N178 PolarHBondContact O-N 3.19Å; N178-T180 VanDerWaalsContact C-N 3.29Å; N178-T180 PolarHBondContact O-N 3.28Å; N178-Q181 PolarHBondContact O-N 3.04Å; N178-Y182 PolarHBondContact O-N 3.39Å; N178-F242 HydrophobicContact CB-CE1 4.13Å
179	D	84.4	Confident	83.2	Confident	81 Å²	81	47.8 Å²	47.8	43%	0.433	25%	0.246	S	C	.	.	H	α-helix	trans	-59	-42.2	175.2	-74.2	1.3	0	0	0	110.9	Q175 Y182 I183	Q175-D179 PolarHBondContact NE2-OD1 3.17Å; Q175-D179 WeakPolarHBondContact O-CB 3.4Å; Q175-D179 PolarHBondContact O-N 3.3Å; D179-Y182 PolarHBondContact O-N 3.12Å; D179-I183 WeakPolarHBondContact O-CD1 3.41Å; D179-I183 VanDerWaalsContact O-CG1 3.26Å; D179-I183 WeakPolarHBondContact O-CG1 3.48Å; D179-I183 PolarHBondContact O-N 2.93Å
180	T	89.4	Confident	83.5	Confident	7 Å²	7	47.8 Å²	47.8	4%	0.043	24%	0.241	C	C	.	.	H	α-helix	trans	-64.5	-43.7	176.9	-56.3	0	0	0	0	111.5	E176 L177 N178 Y182 I183 V184 L219 R222 I223	E176-T180 VanDerWaalsContact O-CB 3.27Å; E176-T180 WeakPolarHBondContact O-CB 3.34Å; E176-T180 PolarHBondContact O-N 3.27Å; E176-T180 PolarHBondContact O-OG1 3.27Å; L177-T180 PolarHBondContact O-N 2.96Å; N178-T180 VanDerWaalsContact C-N 3.29Å; N178-T180 PolarHBondContact O-N 3.28Å; T180-Y182 PolarHBondContact O-N 2.69Å; T180-I183 PolarHBondContact O-N 2.96Å; T180-V184 PolarHBondContact O-N 2.8Å; T180-L219 HydrophobicContact CG2-CD2 4.28Å; T180-R222 HydrophobicContact CG2-CB 4.13Å; T180-R222 HydrophobicContact CG2-CG 4.3Å; T180-I223 HydrophobicContact CG2-CD1 4.33Å; T180-I223 HydrophobicContact CG2-CG1 3.61Å
181	Q	89.3	Confident	83.9	Confident	4 Å²	4	47 Å²	47	2%	0.019	24%	0.237	C	C	.	.	H	α-helix	trans	-68	-34.5	177.7	-161.6	-173.9	34.4	0	0	112.9	L177 N178 I183 V184 R185 I223 S241 F242 L247	L177-Q181 PolarHBondContact O-N 2.81Å; N178-Q181 PolarHBondContact O-N 3.04Å; Q181-I183 VanDerWaalsContact C-N 3.33Å; Q181-V184 PolarHBondContact O-N 3.02Å; Q181-R185 VanDerWaalsContact CD-CZ 3.43Å; Q181-R185 VanDerWaalsContact CD-NH2 3.31Å; Q181-R185 PolarHBondContact O-N 3.04Å; Q181-R185 VanDerWaalsContact OE1-NH2 3.16Å; Q181-I223 HydrophobicContact CB-CD1 3.92Å; Q181-I223 HydrophobicContact CG-CD1 4.02Å; Q181-S241 PolarHBondContact NE2-O 3.14Å; Q181-S241 PolarHBondContact OE1-O 2.81Å; Q181-F242 HydrophobicContact CB-CD1 4.36Å; Q181-L247 HydrophobicContact CG-CD2 4.36Å
182	Y	84.1	Confident	84.5	Confident	159 Å²	159	50.6 Å²	50.6	62%	0.624	25%	0.247	S	C	*	.	H	α-helix	trans	-59.2	-45.9	170.9	179.3	-96.1	0	0	0	111.1	N178 D179 T180 V184 R185 V186	N178-Y182 PolarHBondContact O-N 3.39Å; D179-Y182 PolarHBondContact O-N 3.12Å; T180-Y182 PolarHBondContact O-N 2.69Å; Y182-V184 VanDerWaalsContact C-N 3.33Å; Y182-V184 PolarHBondContact O-N 3.46Å; Y182-R185 PolarHBondContact O-N 3.23Å; Y182-V186 HydrophobicContact CD1-CG2 4.28Å; Y182-V186 HydrophobicContact CE1-CG2 3.84Å; Y182-V186 HydrophobicContact CE2-CG2 4.22Å; Y182-V186 WeakPolarHBondContact O-CG2 3.46Å; Y182-V186 PolarHBondContact O-N 2.92Å
183	I	87	Confident	84.4	Confident	77 Å²	77	52.8 Å²	52.8	40%	0.395	25%	0.245	S	C	.	.	H	α-helix	trans	-62.3	-39	176.4	-63.8	162.8	0	0	0	111.3	D179 T180 Q181 N187 L219	D179-I183 WeakPolarHBondContact O-CD1 3.41Å; D179-I183 VanDerWaalsContact O-CG1 3.26Å; D179-I183 WeakPolarHBondContact O-CG1 3.48Å; D179-I183 PolarHBondContact O-N 2.93Å; T180-I183 PolarHBondContact O-N 2.96Å; Q181-I183 VanDerWaalsContact C-N 3.33Å; I183-N187 WeakPolarHBondContact CG2-ND2 3.36Å; I183-N187 WeakPolarHBondContact O-CB 3.49Å; I183-N187 PolarHBondContact O-N 3.24Å; I183-N187 PolarHBondContact O-ND2 3.11Å; I183-L219 HydrophobicContact CG2-CD1 3.76Å; I183-L219 HydrophobicContact CG2-CD2 3.91Å
184	V	90.5	Very high	84	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-60.8	-53.6	173.7	170.6	0	0	0	0	111.4	T180 Q181 Y182 V186 N187 A188 L216 L219 V220 I223 L247 I251	T180-V184 PolarHBondContact O-N 2.8Å; Q181-V184 PolarHBondContact O-N 3.02Å; Y182-V184 VanDerWaalsContact C-N 3.33Å; Y182-V184 PolarHBondContact O-N 3.46Å; V184-V186 VanDerWaalsContact C-N 3.31Å; V184-V186 PolarHBondContact O-N 2.72Å; V184-N187 PolarHBondContact O-N 3.05Å; V184-N187 VanDerWaalsContact O-N 3.09Å; V184-A188 WeakPolarHBondContact O-CB 3.26Å; V184-A188 PolarHBondContact O-N 3.06Å; V184-L216 HydrophobicContact CG1-CD2 4.16Å; V184-L219 HydrophobicContact CG2-CB 3.5Å; V184-L219 VanDerWaalsContact CG2-CB 3.5Å; V184-L219 HydrophobicContact CG2-CD1 4.38Å; V184-L219 HydrophobicContact CG2-CG 4.48Å; V184-V220 HydrophobicContact CG1-CG2 4.11Å; V184-V220 HydrophobicContact CG2-CG2 4.19Å; V184-I223 HydrophobicContact CB-CD1 4.27Å; V184-I223 HydrophobicContact CG2-CD1 3.69Å; V184-L247 HydrophobicContact CG1-CD2 4Å; V184-L247 HydrophobicContact CG1-CG 4.41Å; V184-I251 HydrophobicContact CG1-CD1 3.64Å
185	R	87.3	Confident	83.8	Confident	118 Å²	118	56.4 Å²	56.4	45%	0.445	26%	0.26	S	S	.	.	H	α-helix	trans	-56.4	-44.1	-180	-72.6	-177.7	177.3	108.7	2.1	111.7	Q181 Y182 N187 A188 E189 L247	Q181-R185 VanDerWaalsContact CD-CZ 3.43Å; Q181-R185 VanDerWaalsContact CD-NH2 3.31Å; Q181-R185 PolarHBondContact O-N 3.04Å; Q181-R185 VanDerWaalsContact OE1-NH2 3.16Å; Y182-R185 PolarHBondContact O-N 3.23Å; R185-N187 PolarHBondContact O-N 2.84Å; R185-A188 PolarHBondContact O-N 2.94Å; R185-E189 WeakPolarHBondContact O-CB 3.42Å; R185-E189 PolarHBondContact O-N 2.92Å; R185-L247 HydrophobicContact CG-CD1 4.32Å; R185-L247 HydrophobicContact CG-CD2 4.13Å
186	V	82.7	Confident	83.4	Confident	55 Å²	55	56.3 Å²	56.3	33%	0.333	27%	0.271	S	S	.	.	H	α-helix	trans	-64.7	-38.7	177.5	172.7	0	0	0	0	112	Y182 V184 N190	Y182-V186 HydrophobicContact CD1-CG2 4.28Å; Y182-V186 HydrophobicContact CE1-CG2 3.84Å; Y182-V186 HydrophobicContact CE2-CG2 4.22Å; Y182-V186 WeakPolarHBondContact O-CG2 3.46Å; Y182-V186 PolarHBondContact O-N 2.92Å; V184-V186 VanDerWaalsContact C-N 3.31Å; V184-V186 PolarHBondContact O-N 2.72Å; V186-N190 WeakPolarHBondContact O-CB 3.45Å; V186-N190 PolarHBondContact O-N 2.79Å; V186-N190 PolarHBondContact O-ND2 3.27Å
187	N	87	Confident	82.4	Confident	41 Å²	41	57.5 Å²	57.5	22%	0.219	28%	0.276	C	S	.	.	H	α-helix	trans	-74.3	-37.1	177.8	-80.1	-81.6	0	0	0	112.6	I183 V184 R185 N190 L191 L216	I183-N187 WeakPolarHBondContact CG2-ND2 3.36Å; I183-N187 WeakPolarHBondContact O-CB 3.49Å; I183-N187 PolarHBondContact O-N 3.24Å; I183-N187 PolarHBondContact O-ND2 3.11Å; V184-N187 PolarHBondContact O-N 3.05Å; V184-N187 VanDerWaalsContact O-N 3.09Å; R185-N187 PolarHBondContact O-N 2.84Å; N187-N190 PolarHBondContact O-N 3.33Å; N187-L191 WeakPolarHBondContact O-CB 3.36Å; N187-L191 PolarHBondContact O-N 3.41Å; N187-L216 HydrophobicContact CB-CD2 3.67Å; N187-L216 HydrophobicContact CB-CG 4.21Å
188	A	86.8	Confident	80.6	Confident	7 Å²	7	64.4 Å²	64.4	6%	0.058	31%	0.313	C	S	.	.	H	α-helix	trans	-61.1	-51.8	175.9	0	0	0	0	0	111.9	V184 R185 N190 L191 R192 I251	V184-A188 WeakPolarHBondContact O-CB 3.26Å; V184-A188 PolarHBondContact O-N 3.06Å; R185-A188 PolarHBondContact O-N 2.94Å; A188-N190 VanDerWaalsContact C-N 3.32Å; A188-N190 PolarHBondContact O-N 2.82Å; A188-L191 WeakPolarHBondContact O-CA 3.18Å; A188-L191 WeakPolarHBondContact O-CB 3.45Å; A188-L191 PolarHBondContact O-N 2.82Å; A188-R192 PolarHBondContact O-N 3.47Å; A188-I251 HydrophobicContact CB-CD1 4.21Å; A188-I251 HydrophobicContact CB-CG1 3.59Å
189	E	81.4	Confident	79	Confident	72 Å²	72	69.8 Å²	69.8	34%	0.336	34%	0.342	S	S	.	.	H	α-helix	trans	-64.4	-36.6	178.4	169.5	53.6	-168.6	0	0	112	R185 K193	R185-E189 WeakPolarHBondContact O-CB 3.42Å; R185-E189 PolarHBondContact O-N 2.92Å; E189-K193 HydrophobicContact CG-CD 4.4Å; E189-K193 WeakPolarHBondContact O-CB 3.43Å; E189-K193 WeakPolarHBondContact O-CG 3.08Å; E189-K193 PolarHBondContact O-N 3.41Å; E189-K193 WeakPolarHBondContact OE1-CD 3.5Å; E189-K193 WeakPolarHBondContact OE1-CE 3.46Å; E189-K193 IonicContact OE1-NZ 3.17Å; E189-K193 PolarHBondContact OE1-NZ 2.82Å
190	N	81.3	Confident	77.4	Confident	63 Å²	63	69 Å²	69	34%	0.337	34%	0.34	S	S	.	.	H	α-helix	trans	-68.1	-34.6	171.9	-80	-63.5	0	0	0	112.1	V186 N187 A188 K193 H194 R212	V186-N190 WeakPolarHBondContact O-CB 3.45Å; V186-N190 PolarHBondContact O-N 2.79Å; V186-N190 PolarHBondContact O-ND2 3.27Å; N187-N190 PolarHBondContact O-N 3.33Å; A188-N190 VanDerWaalsContact C-N 3.32Å; A188-N190 PolarHBondContact O-N 2.82Å; N190-K193 PolarHBondContact O-N 3.44Å; N190-H194 PolarHBondContact O-CD2 2.96Å; N190-H194 PolarHBondContact O-N 2.85Å; N190-R212 PolarHBondContact O-NH1 3.32Å; N190-R212 VanDerWaalsContact O-NH1 3.15Å
191	L	84.8	Confident	75.6	Confident	1 Å²	1	73 Å²	73	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-66.4	-43.7	174.9	-178.8	58.8	0	0	0	111.1	N187 A188 K193 H194 R195 L209 R212 E213 L216	N187-L191 WeakPolarHBondContact O-CB 3.36Å; N187-L191 PolarHBondContact O-N 3.41Å; A188-L191 WeakPolarHBondContact O-CA 3.18Å; A188-L191 WeakPolarHBondContact O-CB 3.45Å; A188-L191 PolarHBondContact O-N 2.82Å; L191-K193 VanDerWaalsContact C-N 3.34Å; L191-K193 PolarHBondContact O-N 2.77Å; L191-H194 PolarHBondContact O-N 2.6Å; L191-H194 VanDerWaalsContact O-N 3.1Å; L191-R195 PolarHBondContact O-N 2.77Å; L191-L209 HydrophobicContact CD1-CD2 3.75Å; L191-R212 HydrophobicContact CD1-CB 4.25Å; L191-E213 HydrophobicContact CD2-CG 3.95Å; L191-L216 HydrophobicContact CB-CD1 4.45Å; L191-L216 HydrophobicContact CD2-CD1 3.59Å
192	R	80.9	Confident	74.2	Confident	95 Å²	95	78 Å²	78	36%	0.358	39%	0.386	S	S	.	.	H	α-helix	trans	-53.2	-49	171	-167.5	-173.9	-136.5	142.1	15.4	111.7	A188 H194 R195 A196 E250 D255	A188-R192 PolarHBondContact O-N 3.47Å; R192-H194 VanDerWaalsContact C-N 3.27Å; R192-H194 PolarHBondContact O-N 3.1Å; R192-R195 PolarHBondContact O-N 2.82Å; R192-A196 WeakPolarHBondContact O-CB 3.44Å; R192-A196 PolarHBondContact O-N 3.18Å; R192-E250 IonicContact CZ-OE1 2.76Å; R192-E250 IonicContact NH1-OE1 2.73Å; R192-E250 PolarHBondContact NH1-OE1 3.18Å; R192-E250 IonicContact NH2-OE1 3.27Å; R192-D255 IonicContact CZ-OD2 2.7Å; R192-D255 IonicContact NH2-OD1 3.68Å; R192-D255 PolarHBondContact NH2-OD1 3.48Å; R192-D255 IonicContact NH2-OD2 3.44Å; R192-D255 PolarHBondContact NH2-OD2 2.87Å
193	K	77	Confident	73.1	Confident	107 Å²	107	74.2 Å²	74.2	47%	0.465	38%	0.383	S	S	.	.	H	α-helix	trans	-60.1	-27.5	176.8	-82.5	166.1	164.3	137.6	0	114.5	E189 N190 L191 Q197	E189-K193 HydrophobicContact CG-CD 4.4Å; E189-K193 WeakPolarHBondContact O-CB 3.43Å; E189-K193 WeakPolarHBondContact O-CG 3.08Å; E189-K193 PolarHBondContact O-N 3.41Å; E189-K193 WeakPolarHBondContact OE1-CD 3.5Å; E189-K193 WeakPolarHBondContact OE1-CE 3.46Å; E189-K193 IonicContact OE1-NZ 3.17Å; E189-K193 PolarHBondContact OE1-NZ 2.82Å; N190-K193 PolarHBondContact O-N 3.44Å; L191-K193 VanDerWaalsContact C-N 3.34Å; L191-K193 PolarHBondContact O-N 2.77Å; K193-Q197 WeakPolarHBondContact O-CG 3.49Å; K193-Q197 PolarHBondContact O-NE2 3.5Å
194	H	74.9	Confident	72.1	Confident	65 Å²	65	77.3 Å²	77.3	30%	0.301	40%	0.396	S	S	.	.	H	α-helix	trans	-85	-40.7	172.8	-77.7	-82.4	0	0	0	112.5	N190 L191 R192 A196 Q197 F208 L209 R212	N190-H194 PolarHBondContact O-CD2 2.96Å; N190-H194 PolarHBondContact O-N 2.85Å; L191-H194 PolarHBondContact O-N 2.6Å; L191-H194 VanDerWaalsContact O-N 3.1Å; R192-H194 VanDerWaalsContact C-N 3.27Å; R192-H194 PolarHBondContact O-N 3.1Å; H194-A196 PolarHBondContact O-N 3.36Å; H194-Q197 PolarHBondContact O-N 2.87Å; H194-Q197 VanDerWaalsContact O-N 3.11Å; H194-F208 AromaticContact CD2-CE1 3.7Å; H194-F208 AromaticContact CG-CE1 3.9Å; H194-F208 AromaticContact ND1-CE1 3.89Å; H194-L209 HydrophobicContact CB-CD2 4.06Å; H194-R212 PolarHBondContact CD2-NH1 2.99Å; H194-R212 VanDerWaalsContact CD2-NH1 3.32Å
195	R	76.2	Confident	71.2	Confident	45 Å²	45	78.5 Å²	78.5	17%	0.17	40%	0.402	C	S	.	.	H	α-helix	trans	-57.3	-30.9	173.6	-71.1	177	178.3	152.3	-8.6	112.4	L191 R192 Q197 L209 E213 I251	L191-R195 PolarHBondContact O-N 2.77Å; R192-R195 PolarHBondContact O-N 2.82Å; R195-Q197 PolarHBondContact O-N 2.85Å; R195-L209 HydrophobicContact CG-CD2 4.5Å; R195-E213 IonicContact CZ-OE1 3.3Å; R195-E213 IonicContact NE-OE1 3.71Å; R195-E213 IonicContact NH2-OE1 2.73Å; R195-E213 PolarHBondContact NH2-OE1 2.88Å; R195-I251 PolarHBondContact NH1-O 2.73Å; R195-I251 PolarHBondContact NH2-O 3.31Å; R195-I251 VanDerWaalsContact NH2-O 3.13Å
196	A	71.1	Confident	70.6	Confident	69 Å²	69	75.1 Å²	75.1	57%	0.57	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-4	178	0	0	0	0	0	115.9	R192 H194 N198	R192-A196 WeakPolarHBondContact O-CB 3.44Å; R192-A196 PolarHBondContact O-N 3.18Å; H194-A196 PolarHBondContact O-N 3.36Å; A196-N198 PolarHBondContact O-N 2.91Å
197	Q	64.1	Low	70.5	Confident	93 Å²	93	76.4 Å²	76.4	44%	0.435	40%	0.4	S	S	.	.			trans	-85.5	72	-175	-77.4	172.4	55.3	0	0	112.8	K193 H194 R195 N199	K193-Q197 WeakPolarHBondContact O-CG 3.49Å; K193-Q197 PolarHBondContact O-NE2 3.5Å; H194-Q197 PolarHBondContact O-N 2.87Å; H194-Q197 VanDerWaalsContact O-N 3.11Å; R195-Q197 PolarHBondContact O-N 2.85Å; Q197-N199 PolarHBondContact O-N 3.36Å
198	N	49.3	Very low	70.2	Confident	145 Å²	145	77.7 Å²	77.7	78%	0.775	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	21	-177.5	-65.7	-17.6	0	0	0	117.1	A196	A196-N198 PolarHBondContact O-N 2.91Å
199	N	49.6	Very low	70	Confident	162 Å²	162	77.6 Å²	77.6	87%	0.866	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.6	18.1	-172.7	-83.5	-66	0	0	0	114.5	Q197	Q197-N199 PolarHBondContact O-N 3.36Å
200	V	51	Low	70.2	Confident	64 Å²	64	76.4 Å²	76.4	39%	0.388	40%	0.396	S	S	.	.	S	Bend	trans	-123.5	148.8	175.8	-173.5	0	0	0	0	109.2	F202 E204 I205	V200-F202 PolarHBondContact O-N 3.12Å; V200-E204 HydrophobicContact CG1-CB 4.33Å; V200-I205 HydrophobicContact CB-CD1 3.66Å; V200-I205 HydrophobicContact CB-CG1 4.23Å; V200-I205 HydrophobicContact CG1-CD1 3.76Å; V200-I205 HydrophobicContact CG1-CG1 3.78Å; V200-I205 HydrophobicContact CG2-CD1 4.02Å
201	V	51.8	Low	70.4	Confident	91 Å²	91	77.2 Å²	77.2	55%	0.552	40%	0.398	S	S	*	.			trans	-66.1	120.2	176	-171.7	0	0	0	0	108	S203 E204	V201-S203 PolarHBondContact O-N 3.12Å; V201-S203 VanDerWaalsContact O-N 3.09Å; V201-E204 HydrophobicContact CB-CG 4.27Å; V201-E204 WeakPolarHBondContact O-CB 3.46Å; V201-E204 PolarHBondContact O-N 2.87Å
202	F	59	Low	70.5	Confident	109 Å²	109	79.4 Å²	79.4	48%	0.478	41%	0.407	S	S	.	.	H	α-helix	trans	-56	-36.4	-165.9	-156.7	-86.4	0	0	0	113.3	V200 E204 I205 E206 L209 F337	V200-F202 PolarHBondContact O-N 3.12Å; F202-E204 PolarHBondContact O-N 2.98Å; F202-I205 PolarHBondContact O-N 2.73Å; F202-I205 VanDerWaalsContact O-N 3.08Å; F202-E206 PolarHBondContact O-N 3.27Å; F202-L209 HydrophobicContact CE1-CD1 4.23Å; F202-L209 HydrophobicContact CZ-CD1 3.97Å; F202-F337 HydrophobicContact CD1-CE2 4.32Å; F202-F337 AromaticContact CE1-CE2 3.76Å; F202-F337 HydrophobicContact CE1-CE2 3.76Å; F202-F337 HydrophobicContact CZ-CE2 4.46Å
203	S	61.7	Low	70.9	Confident	79 Å²	79	74.9 Å²	74.9	55%	0.552	39%	0.389	S	S	*	.	H	α-helix	trans	-62.3	-18.5	176.2	57.9	0	0	0	0	115.1	V201	V201-S203 PolarHBondContact O-N 3.12Å; V201-S203 VanDerWaalsContact O-N 3.09Å
204	E	65.3	Low	71.5	Confident	142 Å²	142	69.8 Å²	69.8	66%	0.664	37%	0.367	S	S	*	.	H	α-helix	trans	-82.5	-21.8	175.1	-63.3	-177.6	160.5	0	0	112.5	V200 V201 F202	V200-E204 HydrophobicContact CG1-CB 4.33Å; V201-E204 HydrophobicContact CB-CG 4.27Å; V201-E204 WeakPolarHBondContact O-CB 3.46Å; V201-E204 PolarHBondContact O-N 2.87Å; F202-E204 PolarHBondContact O-N 2.98Å
205	I	73	Confident	72.3	Confident	26 Å²	26	70.1 Å²	70.1	13%	0.133	37%	0.368	C	S	.	.	H	α-helix	trans	-104.7	-26.5	178.4	-45.6	-172.9	0	0	0	111.7	V200 F202 F208 L209	V200-I205 HydrophobicContact CB-CD1 3.66Å; V200-I205 HydrophobicContact CB-CG1 4.23Å; V200-I205 HydrophobicContact CG1-CD1 3.76Å; V200-I205 HydrophobicContact CG1-CG1 3.78Å; V200-I205 HydrophobicContact CG2-CD1 4.02Å; F202-I205 PolarHBondContact O-N 2.73Å; F202-I205 VanDerWaalsContact O-N 3.08Å; I205-F208 HydrophobicContact CG2-CD1 4.13Å; I205-F208 CarbonylContact O-C 3.55Å; I205-F208 WeakPolarHBondContact O-CA 3.49Å; I205-F208 WeakPolarHBondContact O-CB 3.43Å; I205-F208 PolarHBondContact O-N 2.55Å; I205-L209 HydrophobicContact CG2-CD2 4.04Å; I205-L209 HydrophobicContact CG2-CG 3.98Å; I205-L209 PolarHBondContact O-N 3.18Å
206	E	74.1	Confident	73.1	Confident	47 Å²	47	68 Å²	68	22%	0.22	36%	0.36	C	S	.	.	H	α-helix	trans	-41.4	-53.1	-179	-168.5	-165.9	142.7	0	0	115.4	F202 F208 L209 K210	F202-E206 PolarHBondContact O-N 3.27Å; E206-F208 VanDerWaalsContact C-N 3.26Å; E206-F208 PolarHBondContact O-N 3.43Å; E206-L209 WeakPolarHBondContact O-CB 3.4Å; E206-L209 PolarHBondContact O-N 3.02Å; E206-L209 VanDerWaalsContact O-N 3.13Å; E206-K210 HydrophobicContact CG-CD 4.36Å; E206-K210 PolarHBondContact O-N 2.76Å; E206-K210 WeakPolarHBondContact OE1-CE 3.21Å; E206-K210 IonicContact OE1-NZ 3.19Å; E206-K210 PolarHBondContact OE1-NZ 2.91Å
207	P	79.5	Confident	74.1	Confident	81 Å²	81	64.7 Å²	64.7	53%	0.526	33%	0.333	S	S	.	.	H	α-helix	trans	-62.6	-32.7	179.9	24.5	-34.9	0	0	0	113	K210 E211	P207-K210 PolarHBondContact O-N 2.65Å; P207-E211 WeakPolarHBondContact O-CB 3.2Å; P207-E211 PolarHBondContact O-N 3.4Å
208	F	80.6	Confident	75.3	Confident	69 Å²	69	61.6 Å²	61.6	30%	0.303	32%	0.318	S	S	.	.	H	α-helix	trans	-77.8	-26.5	177.2	174.5	-92.5	0	0	0	112.7	H194 I205 E206 R212	H194-F208 AromaticContact CD2-CE1 3.7Å; H194-F208 AromaticContact CG-CE1 3.9Å; H194-F208 AromaticContact ND1-CE1 3.89Å; I205-F208 HydrophobicContact CG2-CD1 4.13Å; I205-F208 CarbonylContact O-C 3.55Å; I205-F208 WeakPolarHBondContact O-CA 3.49Å; I205-F208 WeakPolarHBondContact O-CB 3.43Å; I205-F208 PolarHBondContact O-N 2.55Å; E206-F208 VanDerWaalsContact C-N 3.26Å; E206-F208 PolarHBondContact O-N 3.43Å; F208-R212 VanDerWaalsContact CZ-CZ 3.47Å; F208-R212 WeakPolarHBondContact O-CG 3.37Å; F208-R212 PolarHBondContact O-N 2.9Å
209	L	83.7	Confident	77.3	Confident	4 Å²	4	56.3 Å²	56.3	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-67.4	-51.4	166.5	-61.5	-179.5	0	0	0	109.7	L191 H194 R195 F202 I205 E206 E211 R212 E213 I335	L191-L209 HydrophobicContact CD1-CD2 3.75Å; H194-L209 HydrophobicContact CB-CD2 4.06Å; R195-L209 HydrophobicContact CG-CD2 4.5Å; F202-L209 HydrophobicContact CE1-CD1 4.23Å; F202-L209 HydrophobicContact CZ-CD1 3.97Å; I205-L209 HydrophobicContact CG2-CD2 4.04Å; I205-L209 HydrophobicContact CG2-CG 3.98Å; I205-L209 PolarHBondContact O-N 3.18Å; E206-L209 WeakPolarHBondContact O-CB 3.4Å; E206-L209 PolarHBondContact O-N 3.02Å; E206-L209 VanDerWaalsContact O-N 3.13Å; L209-E211 PolarHBondContact O-N 3.25Å; L209-R212 WeakPolarHBondContact O-CB 3.34Å; L209-R212 PolarHBondContact O-N 3.27Å; L209-E213 WeakPolarHBondContact O-CG 3.46Å; L209-E213 PolarHBondContact O-N 3.24Å; L209-I335 HydrophobicContact CD1-CD1 4.38Å
210	K	85.7	Confident	79.4	Confident	47 Å²	47	48.8 Å²	48.8	20%	0.204	25%	0.249	C	C	.	.	H	α-helix	trans	-55.6	-49.6	179.3	-72.7	178.1	164.1	168.4	0	112.1	E206 P207 R212 E213 G214 D329 A330 A333 I335	E206-K210 HydrophobicContact CG-CD 4.36Å; E206-K210 PolarHBondContact O-N 2.76Å; E206-K210 WeakPolarHBondContact OE1-CE 3.21Å; E206-K210 IonicContact OE1-NZ 3.19Å; E206-K210 PolarHBondContact OE1-NZ 2.91Å; P207-K210 PolarHBondContact O-N 2.65Å; K210-R212 PolarHBondContact O-N 3.31Å; K210-E213 PolarHBondContact O-N 2.91Å; K210-G214 PolarHBondContact O-N 3.47Å; K210-G214 VanDerWaalsContact O-N 3.12Å; K210-D329 VanDerWaalsContact O-O 3.11Å; K210-A330 HydrophobicContact CB-CB 4.19Å; K210-A333 HydrophobicContact CB-CB 3.69Å; K210-A333 HydrophobicContact CG-CB 3.69Å; K210-I335 WeakPolarHBondContact CE-O 3.44Å
211	E	84.6	Confident	81.3	Confident	81 Å²	81	45.8 Å²	45.8	38%	0.379	23%	0.231	S	C	.	.	H	α-helix	trans	-57.2	-30.5	175.8	-166	-162.6	160	0	0	113.3	P207 L209 K215 D329	P207-E211 WeakPolarHBondContact O-CB 3.2Å; P207-E211 PolarHBondContact O-N 3.4Å; L209-E211 PolarHBondContact O-N 3.25Å; E211-K215 WeakPolarHBondContact O-CD 3.5Å; E211-K215 VanDerWaalsContact O-CG 3.23Å; E211-K215 WeakPolarHBondContact O-CG 3.48Å; E211-K215 PolarHBondContact O-N 3.1Å; E211-K215 IonicContact OE1-NZ 3.82Å; E211-K215 PolarHBondContact OE1-NZ 3.12Å; E211-D329 HydrophobicContact CG-CB 4.18Å; E211-D329 WeakPolarHBondContact O-CB 3.44Å
212	R	87.1	Confident	83.1	Confident	47 Å²	47	45.8 Å²	45.8	18%	0.177	22%	0.221	C	C	.	.	H	α-helix	trans	-85.1	-34.3	177.7	-79.2	177.4	157	-149.4	3.5	113.7	N190 L191 H194 F208 L209 K210 K215 L216	N190-R212 PolarHBondContact O-NH1 3.32Å; N190-R212 VanDerWaalsContact O-NH1 3.15Å; L191-R212 HydrophobicContact CD1-CB 4.25Å; H194-R212 PolarHBondContact CD2-NH1 2.99Å; H194-R212 VanDerWaalsContact CD2-NH1 3.32Å; F208-R212 VanDerWaalsContact CZ-CZ 3.47Å; F208-R212 WeakPolarHBondContact O-CG 3.37Å; F208-R212 PolarHBondContact O-N 2.9Å; L209-R212 WeakPolarHBondContact O-CB 3.34Å; L209-R212 PolarHBondContact O-N 3.27Å; K210-R212 PolarHBondContact O-N 3.31Å; R212-K215 PolarHBondContact O-N 3.3Å; R212-L216 PolarHBondContact O-N 2.78Å
213	E	90.4	Very high	84.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.1	-50.5	175.3	-73.4	-176	171.6	0	0	110	L191 R195 L209 K210 K215 L216 V217 A333 W334 I335	L191-E213 HydrophobicContact CD2-CG 3.95Å; R195-E213 IonicContact CZ-OE1 3.3Å; R195-E213 IonicContact NE-OE1 3.71Å; R195-E213 IonicContact NH2-OE1 2.73Å; R195-E213 PolarHBondContact NH2-OE1 2.88Å; L209-E213 WeakPolarHBondContact O-CG 3.46Å; L209-E213 PolarHBondContact O-N 3.24Å; K210-E213 PolarHBondContact O-N 2.91Å; E213-K215 VanDerWaalsContact C-N 3.34Å; E213-K215 PolarHBondContact O-N 3.31Å; E213-L216 WeakPolarHBondContact O-CB 3.3Å; E213-L216 PolarHBondContact O-N 3.28Å; E213-V217 PolarHBondContact O-N 3.06Å; E213-A333 HydrophobicContact CB-CB 4.08Å; E213-W334 HydrophobicContact CB-CD2 4.12Å; E213-W334 HydrophobicContact CB-CE3 3.84Å; E213-W334 HydrophobicContact CB-CH2 3.73Å; E213-W334 HydrophobicContact CB-CZ2 4.02Å; E213-W334 HydrophobicContact CB-CZ3 3.65Å; E213-W334 HydrophobicContact CG-CD2 4.18Å; E213-W334 HydrophobicContact CG-CE3 4.36Å; E213-W334 HydrophobicContact CG-CH2 3.81Å; E213-W334 HydrophobicContact CG-CZ2 3.6Å; E213-W334 HydrophobicContact CG-CZ3 4.19Å; E213-W334 WeakPolarHBondContact O-CZ3 3.27Å; E213-W334 PolarHBondContact OE2-N 2.63Å; E213-I335 WeakPolarHBondContact OE1-CD1 3.3Å; E213-I335 WeakPolarHBondContact OE1-CG1 3.48Å; E213-I335 WeakPolarHBondContact OE2-CG1 3.35Å; E213-I335 PolarHBondContact OE2-N 2.93Å
214	G	89.8	Confident	86	Confident	0 Å²	0	37 Å²	37	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58	-42.2	174	0	0	0	0	0	113.6	K210 L216 V217 K218 D329	K210-G214 PolarHBondContact O-N 3.47Å; K210-G214 VanDerWaalsContact O-N 3.12Å; G214-L216 VanDerWaalsContact C-N 3.27Å; G214-L216 PolarHBondContact O-N 2.92Å; G214-V217 WeakPolarHBondContact O-CB 3.43Å; G214-V217 PolarHBondContact O-N 2.98Å; G214-V217 VanDerWaalsContact O-N 3.12Å; G214-K218 WeakPolarHBondContact O-CG 3.37Å; G214-K218 PolarHBondContact O-N 3.14Å; G214-D329 VanDerWaalsContact CA-O 3.25Å; G214-D329 WeakPolarHBondContact CA-O 3.4Å; G214-D329 PolarHBondContact N-O 3.01Å
215	K	90.4	Very high	87.1	Confident	71 Å²	71	31.1 Å²	31.1	31%	0.309	15%	0.145	S	C	.	.	H	α-helix	trans	-60.7	-34.6	175.3	-74.6	171.7	-167.3	176.9	0	113	E211 R212 E213 K218 L219 D329	E211-K215 WeakPolarHBondContact O-CD 3.5Å; E211-K215 VanDerWaalsContact O-CG 3.23Å; E211-K215 WeakPolarHBondContact O-CG 3.48Å; E211-K215 PolarHBondContact O-N 3.1Å; E211-K215 IonicContact OE1-NZ 3.82Å; E211-K215 PolarHBondContact OE1-NZ 3.12Å; R212-K215 PolarHBondContact O-N 3.3Å; E213-K215 VanDerWaalsContact C-N 3.34Å; E213-K215 PolarHBondContact O-N 3.31Å; K215-K218 PolarHBondContact O-N 2.89Å; K215-L219 WeakPolarHBondContact O-CB 3.09Å; K215-L219 WeakPolarHBondContact O-CD1 3.37Å; K215-L219 VanDerWaalsContact O-CG 3.24Å; K215-L219 WeakPolarHBondContact O-CG 3.4Å; K215-L219 PolarHBondContact O-N 2.8Å; K215-D329 WeakPolarHBondContact CE-OD2 3.48Å; K215-D329 HydrophobicContact CG-CB 4.36Å; K215-D329 IonicContact NZ-OD2 3.04Å
216	L	92.3	Very high	87.8	Confident	1 Å²	1	30 Å²	30	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-70	-39.4	173.9	-76.5	167.4	0	0	0	111.9	V184 N187 L191 R212 E213 G214 K218 L219 V220 I251 W334	V184-L216 HydrophobicContact CG1-CD2 4.16Å; N187-L216 HydrophobicContact CB-CD2 3.67Å; N187-L216 HydrophobicContact CB-CG 4.21Å; L191-L216 HydrophobicContact CB-CD1 4.45Å; L191-L216 HydrophobicContact CD2-CD1 3.59Å; R212-L216 PolarHBondContact O-N 2.78Å; E213-L216 WeakPolarHBondContact O-CB 3.3Å; E213-L216 PolarHBondContact O-N 3.28Å; G214-L216 VanDerWaalsContact C-N 3.27Å; G214-L216 PolarHBondContact O-N 2.92Å; L216-K218 PolarHBondContact O-N 2.79Å; L216-L219 PolarHBondContact O-N 2.88Å; L216-V220 WeakPolarHBondContact O-CB 3.34Å; L216-V220 WeakPolarHBondContact O-CG2 3.49Å; L216-V220 PolarHBondContact O-N 3.2Å; L216-I251 HydrophobicContact CB-CG2 4.2Å; L216-I251 HydrophobicContact CD1-CG1 4.35Å; L216-I251 HydrophobicContact CD1-CG2 3.99Å; L216-I251 HydrophobicContact CD2-CD1 4.19Å; L216-W334 HydrophobicContact CB-CH2 4.39Å
217	V	92.1	Very high	88.5	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-54.3	-53.6	169.2	-172.5	0	0	0	0	110	E213 G214 L219 V220 S221 W248 N307 L308 L332 W334	E213-V217 PolarHBondContact O-N 3.06Å; G214-V217 WeakPolarHBondContact O-CB 3.43Å; G214-V217 PolarHBondContact O-N 2.98Å; G214-V217 VanDerWaalsContact O-N 3.12Å; V217-L219 VanDerWaalsContact C-N 3.29Å; V217-L219 PolarHBondContact O-N 2.81Å; V217-V220 PolarHBondContact O-N 2.72Å; V217-S221 PolarHBondContact O-N 3.47Å; V217-S221 PolarHBondContact O-OG 3.26Å; V217-W248 HydrophobicContact CG2-CH2 4.47Å; V217-N307 HydrophobicContact CG1-CB 4.44Å; V217-N307 HydrophobicContact CG2-CB 4.39Å; V217-L308 HydrophobicContact CG1-CB 4.3Å; V217-L308 HydrophobicContact CG1-CD1 3.98Å; V217-L332 HydrophobicContact CG2-CB 4.42Å; V217-L332 WeakPolarHBondContact CG2-O 3.31Å; V217-W334 HydrophobicContact CG2-CE3 4.18Å; V217-W334 HydrophobicContact CG2-CZ3 3.73Å
218	K	91	Very high	88.8	Confident	27 Å²	27	27.3 Å²	27.3	12%	0.117	13%	0.126	C	C	.	.	H	α-helix	trans	-60.1	-35.4	-177	-63.6	-171.7	178.2	179	0	113.3	G214 K215 L216 R222 Y311 E326 P327 D329 L332	G214-K218 WeakPolarHBondContact O-CG 3.37Å; G214-K218 PolarHBondContact O-N 3.14Å; K215-K218 PolarHBondContact O-N 2.89Å; L216-K218 PolarHBondContact O-N 2.79Å; K218-R222 PolarHBondContact O-N 3.01Å; K218-Y311 HydrophobicContact CB-CD1 4.44Å; K218-Y311 HydrophobicContact CB-CE1 3.8Å; K218-Y311 HydrophobicContact CD-CE1 4.46Å; K218-Y311 HydrophobicContact CD-CE2 4.22Å; K218-Y311 HydrophobicContact CG-CD1 4.2Å; K218-Y311 HydrophobicContact CG-CD2 4.43Å; K218-Y311 HydrophobicContact CG-CE1 3.64Å; K218-Y311 HydrophobicContact CG-CE2 3.93Å; K218-E326 WeakPolarHBondContact CD-OE1 3.34Å; K218-E326 WeakPolarHBondContact CE-OE1 3.23Å; K218-E326 IonicContact NZ-OE1 2.66Å; K218-E326 PolarHBondContact NZ-OE1 3.05Å; K218-P327 PolarHBondContact NZ-O 2.96Å; K218-D329 WeakPolarHBondContact CD-OD1 3.35Å; K218-D329 WeakPolarHBondContact CE-OD1 3.43Å; K218-D329 IonicContact NZ-OD1 2.71Å; K218-D329 PolarHBondContact NZ-OD1 3.32Å; K218-L332 HydrophobicContact CD-CD1 4.29Å; K218-L332 HydrophobicContact CG-CD1 3.9Å
219	L	91.6	Very high	89.1	Confident	34 Å²	34	28 Å²	28	18%	0.178	13%	0.129	C	C	.	.	H	α-helix	trans	-76.7	-41.3	177.5	-72.5	164.1	0	0	0	112.7	T180 I183 V184 K215 L216 V217 R222 I223	T180-L219 HydrophobicContact CG2-CD2 4.28Å; I183-L219 HydrophobicContact CG2-CD1 3.76Å; I183-L219 HydrophobicContact CG2-CD2 3.91Å; V184-L219 HydrophobicContact CG2-CB 3.5Å; V184-L219 VanDerWaalsContact CG2-CB 3.5Å; V184-L219 HydrophobicContact CG2-CD1 4.38Å; V184-L219 HydrophobicContact CG2-CG 4.48Å; K215-L219 WeakPolarHBondContact O-CB 3.09Å; K215-L219 WeakPolarHBondContact O-CD1 3.37Å; K215-L219 VanDerWaalsContact O-CG 3.24Å; K215-L219 WeakPolarHBondContact O-CG 3.4Å; K215-L219 PolarHBondContact O-N 2.8Å; L216-L219 PolarHBondContact O-N 2.88Å; V217-L219 VanDerWaalsContact C-N 3.29Å; V217-L219 PolarHBondContact O-N 2.81Å; L219-R222 WeakPolarHBondContact O-CB 3.21Å; L219-R222 PolarHBondContact O-N 2.81Å; L219-R222 VanDerWaalsContact O-N 3.17Å; L219-I223 PolarHBondContact O-N 2.94Å; L219-I223 VanDerWaalsContact O-N 3.12Å
220	V	92.5	Very high	89.1	Confident	5 Å²	5	27.9 Å²	27.9	3%	0.03	13%	0.128	C	C	.	.	H	α-helix	trans	-67.2	-40.6	178.2	174.9	0	0	0	0	110.6	V184 L216 V217 R222 I223 L224 W248 I251 L308	V184-V220 HydrophobicContact CG1-CG2 4.11Å; V184-V220 HydrophobicContact CG2-CG2 4.19Å; L216-V220 WeakPolarHBondContact O-CB 3.34Å; L216-V220 WeakPolarHBondContact O-CG2 3.49Å; L216-V220 PolarHBondContact O-N 3.2Å; V217-V220 PolarHBondContact O-N 2.72Å; V220-R222 PolarHBondContact O-N 2.9Å; V220-I223 WeakPolarHBondContact O-CA 3.48Å; V220-I223 WeakPolarHBondContact O-CB 3.33Å; V220-I223 PolarHBondContact O-N 2.64Å; V220-L224 WeakPolarHBondContact O-CG 3.44Å; V220-L224 PolarHBondContact O-N 2.77Å; V220-W248 HydrophobicContact CB-CE3 4.37Å; V220-W248 HydrophobicContact CB-CZ3 4.18Å; V220-W248 HydrophobicContact CG1-CE3 4.12Å; V220-W248 HydrophobicContact CG1-CZ3 4.31Å; V220-W248 HydrophobicContact CG2-CE3 4.02Å; V220-W248 HydrophobicContact CG2-CZ3 4.01Å; V220-I251 HydrophobicContact CG2-CD1 4.27Å; V220-L308 HydrophobicContact CB-CD1 3.97Å; V220-L308 HydrophobicContact CG1-CD1 3.84Å; V220-L308 HydrophobicContact CG1-CD2 4.08Å
221	S	91	Very high	89.1	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-58.5	-34	170.9	-59.6	0	0	0	0	113.3	V217 L224 F225 L308 A312	V217-S221 PolarHBondContact O-N 3.47Å; V217-S221 PolarHBondContact O-OG 3.26Å; S221-L224 PolarHBondContact O-N 3.11Å; S221-F225 WeakPolarHBondContact O-CB 3.27Å; S221-F225 PolarHBondContact O-N 2.67Å; S221-L308 WeakPolarHBondContact OG-CD1 3.25Å; S221-A312 PolarHBondContact OG-N 3.5Å
222	R	90.4	Very high	89	Confident	91 Å²	91	29.2 Å²	29.2	34%	0.343	15%	0.152	S	C	.	.	H	α-helix	trans	-67.6	-37.1	173.4	-168.3	-173.1	-169.4	130.2	1.3	111.8	E176 T180 K218 L219 V220 F225 L226 W315	E176-R222 IonicContact OE1-CZ 2.59Å; E176-R222 IonicContact OE1-NE 2.81Å; E176-R222 PolarHBondContact OE1-NE 2.98Å; E176-R222 IonicContact OE1-NH2 2.77Å; E176-R222 PolarHBondContact OE1-NH2 2.83Å; E176-R222 IonicContact OE2-NH2 2.66Å; T180-R222 HydrophobicContact CG2-CB 4.13Å; T180-R222 HydrophobicContact CG2-CG 4.3Å; K218-R222 PolarHBondContact O-N 3.01Å; L219-R222 WeakPolarHBondContact O-CB 3.21Å; L219-R222 PolarHBondContact O-N 2.81Å; L219-R222 VanDerWaalsContact O-N 3.17Å; V220-R222 PolarHBondContact O-N 2.9Å; R222-F225 PolarHBondContact O-N 2.89Å; R222-L226 HydrophobicContact CG-CD1 3.95Å; R222-L226 HydrophobicContact CG-CG 4.39Å; R222-L226 WeakPolarHBondContact O-CB 3.48Å; R222-L226 VanDerWaalsContact O-CG 3.25Å; R222-L226 WeakPolarHBondContact O-CG 3.35Å; R222-L226 PolarHBondContact O-N 2.82Å; R222-W315 HydrophobicContact CG-CH2 4.38Å; R222-W315 HydrophobicContact CG-CZ3 4.25Å
223	I	90.6	Very high	88.6	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61.8	-47.3	173.9	-64.4	175.8	0	0	0	110.4	L177 T180 Q181 V184 L219 V220 F225 L226 K227 F242	L177-I223 HydrophobicContact CD1-CB 4.39Å; L177-I223 HydrophobicContact CD1-CG2 3.79Å; T180-I223 HydrophobicContact CG2-CD1 4.33Å; T180-I223 HydrophobicContact CG2-CG1 3.61Å; Q181-I223 HydrophobicContact CB-CD1 3.92Å; Q181-I223 HydrophobicContact CG-CD1 4.02Å; V184-I223 HydrophobicContact CB-CD1 4.27Å; V184-I223 HydrophobicContact CG2-CD1 3.69Å; L219-I223 PolarHBondContact O-N 2.94Å; L219-I223 VanDerWaalsContact O-N 3.12Å; V220-I223 WeakPolarHBondContact O-CA 3.48Å; V220-I223 WeakPolarHBondContact O-CB 3.33Å; V220-I223 PolarHBondContact O-N 2.64Å; I223-F225 PolarHBondContact O-N 3.35Å; I223-L226 PolarHBondContact O-N 3.37Å; I223-K227 PolarHBondContact O-N 2.89Å; I223-F242 HydrophobicContact CG2-CB 4.29Å
224	L	90	Very high	87.7	Confident	3 Å²	3	33.9 Å²	33.9	2%	0.016	18%	0.179	C	C	.	.	H	α-helix	trans	-61.4	-44.1	178.4	-60.7	170.9	0	0	0	111.7	V220 S221 L226 K227 S228 V273 D274 L277 L308 A312	V220-L224 WeakPolarHBondContact O-CG 3.44Å; V220-L224 PolarHBondContact O-N 2.77Å; S221-L224 PolarHBondContact O-N 3.11Å; L224-L226 VanDerWaalsContact C-N 3.35Å; L224-L226 PolarHBondContact O-N 2.69Å; L224-K227 HydrophobicContact CD2-CD 4.48Å; L224-K227 WeakPolarHBondContact O-CB 3.43Å; L224-K227 PolarHBondContact O-N 3.27Å; L224-S228 PolarHBondContact O-N 2.85Å; L224-V273 HydrophobicContact CD1-CG1 4.21Å; L224-V273 HydrophobicContact CD2-CB 4.34Å; L224-V273 HydrophobicContact CD2-CG1 4.16Å; L224-D274 WeakPolarHBondContact CD2-OD2 3.15Å; L224-L277 HydrophobicContact CD1-CD1 3.54Å; L224-L308 HydrophobicContact CD1-CD2 4.33Å; L224-L308 HydrophobicContact CD1-CG 4.46Å; L224-A312 HydrophobicContact CD1-CB 4.27Å
225	F	88.6	Confident	86.6	Confident	19 Å²	19	43.2 Å²	43.2	8%	0.083	22%	0.22	C	C	.	.	H	α-helix	trans	-61.4	-39.7	174	176.3	-102.6	0	0	0	113.1	S221 R222 I223 S228 K229 W315 S319 G320	S221-F225 WeakPolarHBondContact O-CB 3.27Å; S221-F225 PolarHBondContact O-N 2.67Å; R222-F225 PolarHBondContact O-N 2.89Å; I223-F225 PolarHBondContact O-N 3.35Å; F225-S228 WeakPolarHBondContact O-CB 3.46Å; F225-S228 PolarHBondContact O-N 2.92Å; F225-K229 HydrophobicContact CE1-CD 3.73Å; F225-K229 HydrophobicContact CE1-CG 4.37Å; F225-K229 HydrophobicContact CZ-CD 3.74Å; F225-K229 HydrophobicContact CZ-CG 4.2Å; F225-K229 PolarHBondContact O-N 2.92Å; F225-W315 HydrophobicContact CB-CE3 4.1Å; F225-W315 AromaticContact CD1-CE3 3.67Å; F225-W315 HydrophobicContact CD1-CE3 3.67Å; F225-W315 AromaticContact CD1-CZ3 3.89Å; F225-W315 HydrophobicContact CD1-CZ3 3.89Å; F225-W315 HydrophobicContact CD2-CE3 4.37Å; F225-W315 HydrophobicContact CE1-CE3 4.18Å; F225-W315 HydrophobicContact CE1-CZ3 4.19Å; F225-W315 AromaticContact CG-CE3 3.77Å; F225-W315 HydrophobicContact CG-CE3 3.77Å; F225-W315 HydrophobicContact CG-CZ3 4.45Å; F225-S319 WeakPolarHBondContact CZ-O 3.5Å; F225-G320 VanDerWaalsContact CZ-N 3.32Å
226	L	88.5	Confident	85.2	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-72.9	-36.1	176.7	-71.9	168.9	0	0	0	112.4	L173 E176 L177 R222 I223 L224 S228 K229 V230	L173-L226 HydrophobicContact CD2-CD2 3.98Å; E176-L226 HydrophobicContact CB-CD1 4.17Å; E176-L226 HydrophobicContact CB-CD2 4.41Å; E176-L226 HydrophobicContact CG-CD1 3.87Å; E176-L226 HydrophobicContact CG-CD2 4.43Å; E176-L226 WeakPolarHBondContact OE1-CD1 3.32Å; L177-L226 HydrophobicContact CB-CB 4.2Å; L177-L226 HydrophobicContact CB-CD1 4.44Å; L177-L226 HydrophobicContact CD1-CB 3.64Å; L177-L226 HydrophobicContact CG-CB 4.48Å; R222-L226 HydrophobicContact CG-CD1 3.95Å; R222-L226 HydrophobicContact CG-CG 4.39Å; R222-L226 WeakPolarHBondContact O-CB 3.48Å; R222-L226 VanDerWaalsContact O-CG 3.25Å; R222-L226 WeakPolarHBondContact O-CG 3.35Å; R222-L226 PolarHBondContact O-N 2.82Å; I223-L226 PolarHBondContact O-N 3.37Å; L224-L226 VanDerWaalsContact C-N 3.35Å; L224-L226 PolarHBondContact O-N 2.69Å; L226-S228 VanDerWaalsContact C-N 3.32Å; L226-S228 PolarHBondContact O-N 2.93Å; L226-K229 PolarHBondContact O-N 2.99Å; L226-V230 WeakPolarHBondContact O-CG2 3.29Å; L226-V230 PolarHBondContact O-N 2.66Å
227	K	88.5	Confident	83.9	Confident	15 Å²	15	46.7 Å²	46.7	7%	0.065	24%	0.238	C	C	.	.	H	α-helix	trans	-54.1	-51.3	167.5	-76.3	177.5	72.9	-175.1	0	109.7	L177 I223 L224 K229 V230 L231 L239 D272 D274	L177-K227 HydrophobicContact CD1-CG 4.38Å; I223-K227 PolarHBondContact O-N 2.89Å; L224-K227 HydrophobicContact CD2-CD 4.48Å; L224-K227 WeakPolarHBondContact O-CB 3.43Å; L224-K227 PolarHBondContact O-N 3.27Å; K227-K229 PolarHBondContact O-N 2.84Å; K227-V230 PolarHBondContact O-N 3Å; K227-L231 WeakPolarHBondContact O-CB 3.49Å; K227-L231 WeakPolarHBondContact O-CG 3.35Å; K227-L231 PolarHBondContact O-N 3.39Å; K227-L239 HydrophobicContact CB-CD1 4.21Å; K227-L239 HydrophobicContact CG-CB 4.45Å; K227-L239 HydrophobicContact CG-CD1 4.24Å; K227-D272 IonicContact NZ-OD2 3.86Å; K227-D272 PolarHBondContact NZ-OD2 3.38Å; K227-D274 IonicContact NZ-OD2 2.88Å; K227-D274 PolarHBondContact NZ-OD2 3.29Å
228	S	86	Confident	82.8	Confident	58 Å²	58	49 Å²	49	41%	0.406	25%	0.25	S	S	.	.	H	α-helix	trans	-57.4	-45.9	179.1	-178.9	0	0	0	0	112.4	L224 F225 L226 L231 A232	L224-S228 PolarHBondContact O-N 2.85Å; F225-S228 WeakPolarHBondContact O-CB 3.46Å; F225-S228 PolarHBondContact O-N 2.92Å; L226-S228 VanDerWaalsContact C-N 3.32Å; L226-S228 PolarHBondContact O-N 2.93Å; S228-L231 PolarHBondContact O-N 3.3Å; S228-A232 WeakPolarHBondContact O-CB 3.4Å; S228-A232 PolarHBondContact O-N 3.07Å
229	K	86.3	Confident	82	Confident	84 Å²	84	48.2 Å²	48.2	37%	0.365	25%	0.247	S	C	.	.	H	α-helix	trans	-63.1	-43.6	175.2	-84.2	-169.4	164.2	174.4	0	113.6	L173 F225 L226 K227 A232 C233	L173-K229 HydrophobicContact CD1-CB 4.18Å; L173-K229 HydrophobicContact CD2-CB 4.1Å; L173-K229 HydrophobicContact CD2-CD 3.99Å; F225-K229 HydrophobicContact CE1-CD 3.73Å; F225-K229 HydrophobicContact CE1-CG 4.37Å; F225-K229 HydrophobicContact CZ-CD 3.74Å; F225-K229 HydrophobicContact CZ-CG 4.2Å; F225-K229 PolarHBondContact O-N 2.92Å; L226-K229 PolarHBondContact O-N 2.99Å; K227-K229 PolarHBondContact O-N 2.84Å; K229-A232 PolarHBondContact O-N 2.75Å; K229-C233 PolarHBondContact O-N 3.45Å; K229-C233 VanDerWaalsContact O-N 3.07Å; K229-C233 PolarHBondContact O-SG 3.05Å
230	V	84.7	Confident	81	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.2	-43.1	177.6	171	0	0	0	0	110.9	L170 L173 L174 L226 K227 A232 C233 R234 C237 L239	L170-V230 HydrophobicContact CD1-CG1 3.93Å; L173-V230 HydrophobicContact CB-CG2 3.8Å; L174-V230 HydrophobicContact CD2-CG1 3.9Å; L174-V230 HydrophobicContact CD2-CG2 4.12Å; L174-V230 HydrophobicContact CG-CG1 4.47Å; L174-V230 HydrophobicContact CG-CG2 4.32Å; L226-V230 WeakPolarHBondContact O-CG2 3.29Å; L226-V230 PolarHBondContact O-N 2.66Å; K227-V230 PolarHBondContact O-N 3Å; V230-A232 VanDerWaalsContact C-N 3.33Å; V230-A232 PolarHBondContact O-N 2.82Å; V230-C233 PolarHBondContact O-N 2.92Å; V230-R234 PolarHBondContact O-N 2.91Å; V230-C237 HydrophobicContact CG1-CB 3.9Å; V230-L239 HydrophobicContact CB-CD1 3.97Å; V230-L239 HydrophobicContact CG1-CD1 3.77Å; V230-L239 HydrophobicContact CG1-CD2 4.14Å; V230-L239 HydrophobicContact CG1-CG 4.44Å
231	L	84.1	Confident	80	Confident	69 Å²	69	51.8 Å²	51.8	36%	0.361	28%	0.275	S	S	.	.	H	α-helix	trans	-67.1	-31.3	177.2	-69.1	169.2	0	0	0	113.2	K227 S228 R234 K235 C237 L239	K227-L231 WeakPolarHBondContact O-CB 3.49Å; K227-L231 WeakPolarHBondContact O-CG 3.35Å; K227-L231 PolarHBondContact O-N 3.39Å; S228-L231 PolarHBondContact O-N 3.3Å; L231-R234 CarbonylContact O-C 3.55Å; L231-K235 PolarHBondContact O-N 2.86Å; L231-C237 HydrophobicContact CD2-CB 4.37Å; L231-L239 HydrophobicContact CD2-CD1 4.23Å; L231-L239 HydrophobicContact CG-CD1 3.97Å
232	A	83.4	Confident	79.4	Confident	87 Å²	87	52.1 Å²	52.1	72%	0.719	28%	0.276	S	S	*	.	H	α-helix	trans	-68.4	-38.5	172.8	0	0	0	0	0	112.3	S228 K229 V230	S228-A232 WeakPolarHBondContact O-CB 3.4Å; S228-A232 PolarHBondContact O-N 3.07Å; K229-A232 PolarHBondContact O-N 2.75Å; V230-A232 VanDerWaalsContact C-N 3.33Å; V230-A232 PolarHBondContact O-N 2.82Å
233	C	78	Confident	78.7	Confident	67 Å²	67	48.1 Å²	48.1	45%	0.453	26%	0.264	S	S	.	.	H	α-helix	trans	-69.2	-42.1	171	-68.3	0	0	0	0	112	L170 K229 V230	L170-C233 HydrophobicContact CD1-CB 4.04Å; K229-C233 PolarHBondContact O-N 3.45Å; K229-C233 VanDerWaalsContact O-N 3.07Å; K229-C233 PolarHBondContact O-SG 3.05Å; V230-C233 PolarHBondContact O-N 2.92Å
234	R	72.4	Confident	78.4	Confident	78 Å²	78	49.2 Å²	49.2	29%	0.294	28%	0.275	S	S	.	.			trans	-152.9	113.7	-177.8	-173	172.1	-175.6	-171.2	-1.6	113	P164 L170 V230 L231 E236 C237	P164-R234 VanDerWaalsContact CG-NH1 3.3Å; L170-R234 HydrophobicContact CD2-CB 4.37Å; V230-R234 PolarHBondContact O-N 2.91Å; L231-R234 CarbonylContact O-C 3.55Å; R234-E236 VanDerWaalsContact C-N 3.32Å; R234-E236 HydrophobicContact CG-CB 4.48Å; R234-E236 IonicContact CZ-OE2 2.65Å; R234-E236 IonicContact NE-OE2 3.75Å; R234-E236 PolarHBondContact NE-OE2 3.31Å; R234-E236 IonicContact NH2-OE2 3.1Å; R234-E236 PolarHBondContact NH2-OE2 3.41Å; R234-E236 PolarHBondContact O-N 2.84Å; R234-C237 PolarHBondContact O-N 3.45Å; R234-C237 PolarHBondContact O-SG 3.26Å; R234-C237 VanDerWaalsContact O-SG 3.4Å
235	K	65.9	Low	78.3	Confident	197 Å²	197	49.4 Å²	49.4	86%	0.857	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-25.1	-177.5	-62.6	-175.6	178.8	-177.2	0	115.1	L231 C237	L231-K235 PolarHBondContact O-N 2.86Å; K235-C237 PolarHBondContact O-N 2.96Å
236	E	61.1	Low	78.1	Confident	136 Å²	136	53.7 Å²	53.7	64%	0.636	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	7.4	-176.6	-59	173.5	154.7	0	0	113.7	R234 N238	R234-E236 VanDerWaalsContact C-N 3.32Å; R234-E236 HydrophobicContact CG-CB 4.48Å; R234-E236 IonicContact CZ-OE2 2.65Å; R234-E236 IonicContact NE-OE2 3.75Å; R234-E236 PolarHBondContact NE-OE2 3.31Å; R234-E236 IonicContact NH2-OE2 3.1Å; R234-E236 PolarHBondContact NH2-OE2 3.41Å; R234-E236 PolarHBondContact O-N 2.84Å; E236-N238 PolarHBondContact O-N 3.28Å
237	C	64.4	Low	78.1	Confident	9 Å²	9	54.6 Å²	54.6	6%	0.061	30%	0.301	C	S	.	.			trans	-75.6	108.6	-178.2	-74.1	0	0	0	0	111.8	W163 V230 L231 R234 K235 L239	W163-C237 HydrophobicContact CH2-CB 3.54Å; W163-C237 VanDerWaalsContact CH2-SG 3.58Å; W163-C237 HydrophobicContact CZ3-CB 3.81Å; W163-C237 WeakPolarHBondContact CZ3-SG 3.43Å; V230-C237 HydrophobicContact CG1-CB 3.9Å; L231-C237 HydrophobicContact CD2-CB 4.37Å; R234-C237 PolarHBondContact O-N 3.45Å; R234-C237 PolarHBondContact O-SG 3.26Å; R234-C237 VanDerWaalsContact O-SG 3.4Å; K235-C237 PolarHBondContact O-N 2.96Å; C237-L239 HydrophobicContact CB-CD1 4.36Å; C237-L239 HydrophobicContact CB-CD2 4.29Å; C237-L239 HydrophobicContact CB-CG 4.06Å; C237-L239 PolarHBondContact O-N 3.47Å; C237-L239 VanDerWaalsContact O-N 3.17Å
238	N	69.9	Low	78.2	Confident	49 Å²	49	54 Å²	54	26%	0.262	30%	0.298	S	S	.	.			trans	-66.4	112.8	165	-174.8	0.3	0	0	0	109.4	S133 E236 S240	S133-N238 PolarHBondContact OG-ND2 2.81Å; E236-N238 PolarHBondContact O-N 3.28Å; N238-S240 PolarHBondContact OD1-N 2.95Å; N238-S240 PolarHBondContact OD1-OG 2.76Å; N238-S240 VanDerWaalsContact OD1-OG 3.11Å
239	L	74.7	Confident	78.4	Confident	9 Å²	9	51.3 Å²	51.3	5%	0.047	28%	0.279	C	S	.	.			trans	-122.7	15.1	-178.9	-60.3	178	0	0	0	113	W163 L174 L177 K227 V230 L231 C237 S241 F242	W163-L239 HydrophobicContact CH2-CD2 4.42Å; W163-L239 HydrophobicContact CZ2-CD2 4.26Å; L174-L239 HydrophobicContact CD2-CD2 4.18Å; L177-L239 HydrophobicContact CD2-CD2 4Å; K227-L239 HydrophobicContact CB-CD1 4.21Å; K227-L239 HydrophobicContact CG-CB 4.45Å; K227-L239 HydrophobicContact CG-CD1 4.24Å; V230-L239 HydrophobicContact CB-CD1 3.97Å; V230-L239 HydrophobicContact CG1-CD1 3.77Å; V230-L239 HydrophobicContact CG1-CD2 4.14Å; V230-L239 HydrophobicContact CG1-CG 4.44Å; L231-L239 HydrophobicContact CD2-CD1 4.23Å; L231-L239 HydrophobicContact CG-CD1 3.97Å; C237-L239 HydrophobicContact CB-CD1 4.36Å; C237-L239 HydrophobicContact CB-CD2 4.29Å; C237-L239 HydrophobicContact CB-CG 4.06Å; C237-L239 PolarHBondContact O-N 3.47Å; C237-L239 VanDerWaalsContact O-N 3.17Å; L239-S241 PolarHBondContact O-N 2.59Å; L239-S241 VanDerWaalsContact O-N 3.13Å; L239-F242 HydrophobicContact CB-CD2 4.22Å; L239-F242 HydrophobicContact CD2-CD2 3.81Å; L239-F242 HydrophobicContact CD2-CE2 4Å; L239-F242 PolarHBondContact O-N 3.43Å
240	S	70.7	Confident	78.4	Confident	72 Å²	72	49.6 Å²	49.6	50%	0.503	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-32.7	-176.7	63.3	0	0	0	0	113.5	N238 F242	N238-S240 PolarHBondContact OD1-N 2.95Å; N238-S240 PolarHBondContact OD1-OG 2.76Å; N238-S240 VanDerWaalsContact OD1-OG 3.11Å; S240-F242 VanDerWaalsContact C-N 3.27Å; S240-F242 PolarHBondContact O-N 2.87Å
241	S	71.7	Confident	78.6	Confident	42 Å²	42	49.7 Å²	49.7	29%	0.294	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-16.3	178.8	60.6	0	0	0	0	114.2	Q181 L239	Q181-S241 PolarHBondContact NE2-O 3.14Å; Q181-S241 PolarHBondContact OE1-O 2.81Å; L239-S241 PolarHBondContact O-N 2.59Å; L239-S241 VanDerWaalsContact O-N 3.13Å
242	F	78.6	Confident	78.9	Confident	7 Å²	7	46.4 Å²	46.4	3%	0.031	26%	0.256	C	S	.	.	S	Bend	trans	-95.9	116.7	-179	-63.5	-74.7	0	0	0	111.6	L177 N178 Q181 I223 L239 S240 G244	L177-F242 HydrophobicContact CD1-CB 4.21Å; L177-F242 HydrophobicContact CD1-CD1 4.43Å; L177-F242 HydrophobicContact CD1-CG 4.36Å; L177-F242 HydrophobicContact CD2-CB 4.12Å; L177-F242 HydrophobicContact CD2-CD1 3.96Å; L177-F242 HydrophobicContact CD2-CD2 3.65Å; L177-F242 HydrophobicContact CD2-CE1 4.28Å; L177-F242 HydrophobicContact CD2-CE2 3.99Å; L177-F242 HydrophobicContact CD2-CG 3.63Å; L177-F242 HydrophobicContact CD2-CZ 4.28Å; L177-F242 HydrophobicContact CG-CB 4.2Å; L177-F242 HydrophobicContact CG-CD1 3.68Å; L177-F242 HydrophobicContact CG-CD2 4.31Å; L177-F242 HydrophobicContact CG-CE1 4.1Å; L177-F242 HydrophobicContact CG-CG 3.8Å; N178-F242 HydrophobicContact CB-CE1 4.13Å; Q181-F242 HydrophobicContact CB-CD1 4.36Å; I223-F242 HydrophobicContact CG2-CB 4.29Å; L239-F242 HydrophobicContact CB-CD2 4.22Å; L239-F242 HydrophobicContact CD2-CD2 3.81Å; L239-F242 HydrophobicContact CD2-CE2 4Å; L239-F242 PolarHBondContact O-N 3.43Å; S240-F242 VanDerWaalsContact C-N 3.27Å; S240-F242 PolarHBondContact O-N 2.87Å; F242-G244 VanDerWaalsContact C-N 3.25Å; F242-G244 PolarHBondContact O-N 2.7Å
243	G	75.5	Confident	79	Confident	7 Å²	7	43 Å²	43	7%	0.072	23%	0.225	C	C	.	.	S	Bend	trans	71.3	11.6	177.8	0	0	0	0	0	115.7	V273	G243-V273 WeakPolarHBondContact O-CG2 3.16Å
244	G	82.5	Confident	79.2	Confident	23 Å²	23	39.9 Å²	39.9	24%	0.237	20%	0.204	C	C	.	.			trans	-54.2	148.2	-175.8	0	0	0	0	0	115.2	F242 H246 L247	F242-G244 VanDerWaalsContact C-N 3.25Å; F242-G244 PolarHBondContact O-N 2.7Å; G244-H246 VanDerWaalsContact C-N 3.33Å; G244-H246 PolarHBondContact O-N 3.19Å; G244-H246 VanDerWaalsContact O-N 3.15Å; G244-L247 WeakPolarHBondContact O-CB 3.42Å; G244-L247 PolarHBondContact O-N 2.89Å
245	L	88.2	Confident	79.3	Confident	7 Å²	7	38 Å²	38	4%	0.037	20%	0.2	C	C	.	.	H	α-helix	trans	-55.2	-37.8	-163.8	-177.1	59.1	0	0	0	115	L247 W248 L249 L266 L267 L270 V273 L276	L245-L247 VanDerWaalsContact C-N 3.28Å; L245-L247 PolarHBondContact O-N 2.87Å; L245-W248 WeakPolarHBondContact O-CA 3.4Å; L245-W248 WeakPolarHBondContact O-CB 2.83Å; L245-W248 PolarHBondContact O-N 2.58Å; L245-L249 HydrophobicContact CD1-CD1 4.49Å; L245-L249 HydrophobicContact CD1-CD2 4.4Å; L245-L249 HydrophobicContact CD1-CG 4.19Å; L245-L249 HydrophobicContact CG-CD1 4.06Å; L245-L249 HydrophobicContact CG-CG 4.23Å; L245-L249 WeakPolarHBondContact O-CG 3.44Å; L245-L249 PolarHBondContact O-N 3.46Å; L245-L266 WeakPolarHBondContact CD2-O 3.22Å; L245-L267 HydrophobicContact CB-CD2 4.09Å; L245-L267 HydrophobicContact CD2-CD2 4.1Å; L245-L267 HydrophobicContact CG-CD2 3.95Å; L245-L270 HydrophobicContact CD2-CB 3.47Å; L245-L270 VanDerWaalsContact CD2-CB 3.47Å; L245-L270 HydrophobicContact CD2-CD1 4.09Å; L245-L270 HydrophobicContact CD2-CG 4.45Å; L245-V273 HydrophobicContact CB-CG2 4.22Å; L245-V273 HydrophobicContact CD1-CG2 3.99Å; L245-L276 HydrophobicContact CD1-CD2 4.11Å
246	H	86	Confident	79.3	Confident	109 Å²	109	33 Å²	33	51%	0.505	18%	0.18	S	C	.	.	H	α-helix	trans	-53.9	-42.2	175.8	-176.6	-59.7	0	0	0	112.8	G244 W248 L249 E250 L267	G244-H246 VanDerWaalsContact C-N 3.33Å; G244-H246 PolarHBondContact O-N 3.19Å; G244-H246 VanDerWaalsContact O-N 3.15Å; H246-W248 VanDerWaalsContact C-N 3.27Å; H246-W248 PolarHBondContact O-N 3.48Å; H246-L249 PolarHBondContact O-N 3.46Å; H246-E250 WeakPolarHBondContact O-CB 3.49Å; H246-E250 PolarHBondContact O-N 2.91Å; H246-L267 HydrophobicContact CB-CD2 4.23Å
247	L	87.2	Confident	79.6	Confident	22 Å²	22	37.7 Å²	37.7	12%	0.115	19%	0.192	C	C	.	.	H	α-helix	trans	-67.6	-30.8	179.1	179.9	60.5	0	0	0	111.4	Q181 V184 R185 G244 L245 I251	Q181-L247 HydrophobicContact CG-CD2 4.36Å; V184-L247 HydrophobicContact CG1-CD2 4Å; V184-L247 HydrophobicContact CG1-CG 4.41Å; R185-L247 HydrophobicContact CG-CD1 4.32Å; R185-L247 HydrophobicContact CG-CD2 4.13Å; G244-L247 WeakPolarHBondContact O-CB 3.42Å; G244-L247 PolarHBondContact O-N 2.89Å; L245-L247 VanDerWaalsContact C-N 3.28Å; L245-L247 PolarHBondContact O-N 2.87Å; L247-I251 HydrophobicContact CD1-CD1 4.45Å; L247-I251 HydrophobicContact CG-CD1 4.2Å; L247-I251 WeakPolarHBondContact O-CB 3.35Å; L247-I251 VanDerWaalsContact O-CD1 3.31Å; L247-I251 WeakPolarHBondContact O-CD1 3.44Å; L247-I251 WeakPolarHBondContact O-CG1 3.07Å; L247-I251 PolarHBondContact O-N 3.22Å
248	W	91.5	Very high	79.4	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-72.3	-45	174.8	-175.8	-118.9	0	0	0	111.9	V217 V220 L245 H246 E250 I251 V252 V273 A304 L308 W334	V217-W248 HydrophobicContact CG2-CH2 4.47Å; V220-W248 HydrophobicContact CB-CE3 4.37Å; V220-W248 HydrophobicContact CB-CZ3 4.18Å; V220-W248 HydrophobicContact CG1-CE3 4.12Å; V220-W248 HydrophobicContact CG1-CZ3 4.31Å; V220-W248 HydrophobicContact CG2-CE3 4.02Å; V220-W248 HydrophobicContact CG2-CZ3 4.01Å; L245-W248 WeakPolarHBondContact O-CA 3.4Å; L245-W248 WeakPolarHBondContact O-CB 2.83Å; L245-W248 PolarHBondContact O-N 2.58Å; H246-W248 VanDerWaalsContact C-N 3.27Å; H246-W248 PolarHBondContact O-N 3.48Å; W248-E250 VanDerWaalsContact C-N 3.32Å; W248-E250 PolarHBondContact O-N 2.91Å; W248-I251 HydrophobicContact CE3-CB 4.42Å; W248-I251 HydrophobicContact CE3-CD1 4.4Å; W248-I251 HydrophobicContact CE3-CG2 4.14Å; W248-I251 HydrophobicContact CZ3-CG2 4.06Å; W248-I251 WeakPolarHBondContact O-CB 3.46Å; W248-I251 PolarHBondContact O-N 2.85Å; W248-I251 VanDerWaalsContact O-N 3.15Å; W248-V252 HydrophobicContact CD2-CG2 4.34Å; W248-V252 HydrophobicContact CZ2-CG2 4.25Å; W248-V252 WeakPolarHBondContact O-CG2 3.23Å; W248-V252 PolarHBondContact O-N 3.33Å; W248-V273 HydrophobicContact CB-CG2 3.96Å; W248-V273 HydrophobicContact CG-CG2 4.39Å; W248-A304 HydrophobicContact CH2-CB 4.49Å; W248-A304 HydrophobicContact CZ2-CB 3.9Å; W248-L308 HydrophobicContact CD2-CD2 4.2Å; W248-L308 HydrophobicContact CE3-CD2 4.46Å; W248-L308 HydrophobicContact CH2-CB 4.06Å; W248-L308 HydrophobicContact CH2-CD1 4.11Å; W248-L308 HydrophobicContact CH2-CD2 4Å; W248-L308 HydrophobicContact CH2-CG 4.28Å; W248-L308 HydrophobicContact CZ2-CB 3.85Å; W248-L308 HydrophobicContact CZ2-CD2 3.7Å; W248-L308 HydrophobicContact CZ2-CG 4.24Å; W248-L308 HydrophobicContact CZ3-CD1 4.4Å; W248-L308 HydrophobicContact CZ3-CD2 4.37Å; W248-W334 HydrophobicContact CH2-CZ3 4.46Å
249	L	89.5	Confident	79.4	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-63.7	-36.6	176.5	-60.1	174.7	0	0	0	112.1	L245 H246 V252 N253 L254 L266 L267 F301	L245-L249 HydrophobicContact CD1-CD1 4.49Å; L245-L249 HydrophobicContact CD1-CD2 4.4Å; L245-L249 HydrophobicContact CD1-CG 4.19Å; L245-L249 HydrophobicContact CG-CD1 4.06Å; L245-L249 HydrophobicContact CG-CG 4.23Å; L245-L249 WeakPolarHBondContact O-CG 3.44Å; L245-L249 PolarHBondContact O-N 3.46Å; H246-L249 PolarHBondContact O-N 3.46Å; L249-V252 PolarHBondContact O-N 3.31Å; L249-N253 PolarHBondContact O-N 3.42Å; L249-N253 VanDerWaalsContact O-N 3.1Å; L249-L254 HydrophobicContact CB-CB 4.47Å; L249-L254 HydrophobicContact CD2-CD1 3.78Å; L249-L254 PolarHBondContact O-N 2.74Å; L249-L266 HydrophobicContact CD1-CB 4.09Å; L249-L266 HydrophobicContact CD2-CB 4.44Å; L249-L266 HydrophobicContact CD2-CD1 4.02Å; L249-L267 HydrophobicContact CD1-CD1 4.36Å; L249-L267 HydrophobicContact CD1-CD2 3.84Å; L249-L267 HydrophobicContact CD1-CG 3.74Å; L249-F301 HydrophobicContact CD2-CD2 4.17Å; L249-F301 HydrophobicContact CD2-CE2 3.64Å
250	E	85.5	Confident	79.4	Confident	48 Å²	48	44.5 Å²	44.5	22%	0.224	23%	0.233	C	C	.	.	H	α-helix	trans	-61.2	-47.6	169.4	171.5	171.5	-146.8	0	0	112.1	R192 H246 W248 V252 N253 D255	R192-E250 IonicContact CZ-OE1 2.76Å; R192-E250 IonicContact NH1-OE1 2.73Å; R192-E250 PolarHBondContact NH1-OE1 3.18Å; R192-E250 IonicContact NH2-OE1 3.27Å; H246-E250 WeakPolarHBondContact O-CB 3.49Å; H246-E250 PolarHBondContact O-N 2.91Å; W248-E250 VanDerWaalsContact C-N 3.32Å; W248-E250 PolarHBondContact O-N 2.91Å; E250-V252 VanDerWaalsContact C-N 3.34Å; E250-V252 PolarHBondContact O-N 3.23Å; E250-N253 PolarHBondContact O-N 3.37Å; E250-D255 WeakPolarHBondContact CB-OD2 3.25Å; E250-D255 WeakPolarHBondContact CG-OD2 3.32Å
251	I	89.6	Confident	80	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.015	24%	0.239	C	C	.	.	H	α-helix	trans	-57.9	-45.2	175.4	-77.8	164	0	0	0	111.3	V184 A188 R195 L216 V220 L247 W248 N253 W334	V184-I251 HydrophobicContact CG1-CD1 3.64Å; A188-I251 HydrophobicContact CB-CD1 4.21Å; A188-I251 HydrophobicContact CB-CG1 3.59Å; R195-I251 PolarHBondContact NH1-O 2.73Å; R195-I251 PolarHBondContact NH2-O 3.31Å; R195-I251 VanDerWaalsContact NH2-O 3.13Å; L216-I251 HydrophobicContact CB-CG2 4.2Å; L216-I251 HydrophobicContact CD1-CG1 4.35Å; L216-I251 HydrophobicContact CD1-CG2 3.99Å; L216-I251 HydrophobicContact CD2-CD1 4.19Å; V220-I251 HydrophobicContact CG2-CD1 4.27Å; L247-I251 HydrophobicContact CD1-CD1 4.45Å; L247-I251 HydrophobicContact CG-CD1 4.2Å; L247-I251 WeakPolarHBondContact O-CB 3.35Å; L247-I251 VanDerWaalsContact O-CD1 3.31Å; L247-I251 WeakPolarHBondContact O-CD1 3.44Å; L247-I251 WeakPolarHBondContact O-CG1 3.07Å; L247-I251 PolarHBondContact O-N 3.22Å; W248-I251 HydrophobicContact CE3-CB 4.42Å; W248-I251 HydrophobicContact CE3-CD1 4.4Å; W248-I251 HydrophobicContact CE3-CG2 4.14Å; W248-I251 HydrophobicContact CZ3-CG2 4.06Å; W248-I251 WeakPolarHBondContact O-CB 3.46Å; W248-I251 PolarHBondContact O-N 2.85Å; W248-I251 VanDerWaalsContact O-N 3.15Å; I251-N253 PolarHBondContact O-N 3.17Å; I251-W334 HydrophobicContact CG2-CH2 3.46Å; I251-W334 VanDerWaalsContact CG2-CH2 3.46Å; I251-W334 HydrophobicContact CG2-CZ2 3.71Å; I251-W334 WeakPolarHBondContact O-CZ2 3.44Å
252	V	89.8	Confident	80.6	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-68.6	-16.9	178.4	175.7	0	0	0	0	112.6	W248 L249 E250 L254 R300 F301 A304	W248-V252 HydrophobicContact CD2-CG2 4.34Å; W248-V252 HydrophobicContact CZ2-CG2 4.25Å; W248-V252 WeakPolarHBondContact O-CG2 3.23Å; W248-V252 PolarHBondContact O-N 3.33Å; L249-V252 PolarHBondContact O-N 3.31Å; E250-V252 VanDerWaalsContact C-N 3.34Å; E250-V252 PolarHBondContact O-N 3.23Å; V252-L254 HydrophobicContact CG1-CD1 4.17Å; V252-L254 HydrophobicContact CG1-CG 4.07Å; V252-R300 HydrophobicContact CG1-CB 4.48Å; V252-F301 HydrophobicContact CG1-CB 4.32Å; V252-F301 HydrophobicContact CG1-CD2 4.41Å; V252-A304 HydrophobicContact CG1-CB 4.43Å; V252-A304 HydrophobicContact CG2-CB 3.63Å
253	N	85.9	Confident	80.8	Confident	15 Å²	15	43.8 Å²	43.8	8%	0.08	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	44	-177.7	-166.1	103.4	0	0	0	113.4	L249 E250 I251 Q256 R300	L249-N253 PolarHBondContact O-N 3.42Å; L249-N253 VanDerWaalsContact O-N 3.1Å; E250-N253 PolarHBondContact O-N 3.37Å; I251-N253 PolarHBondContact O-N 3.17Å; N253-Q256 VanDerWaalsContact CG-NE2 3.35Å; N253-Q256 VanDerWaalsContact ND2-CD 3.31Å; N253-Q256 PolarHBondContact ND2-NE2 2.8Å; N253-Q256 PolarHBondContact OD1-NE2 2.91Å; N253-R300 PolarHBondContact ND2-NH1 3.13Å
254	L	83.4	Confident	81.3	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.01	25%	0.253	C	S	.	.			trans	-97.3	-9.6	172.3	-64.9	174.6	0	0	0	113.7	L249 V252 Q256 A259 C263 L266 D297 F301	L249-L254 HydrophobicContact CB-CB 4.47Å; L249-L254 HydrophobicContact CD2-CD1 3.78Å; L249-L254 PolarHBondContact O-N 2.74Å; V252-L254 HydrophobicContact CG1-CD1 4.17Å; V252-L254 HydrophobicContact CG1-CG 4.07Å; L254-Q256 PolarHBondContact O-N 2.87Å; L254-A259 CarbonylContact O-C 3.56Å; L254-A259 WeakPolarHBondContact O-CB 3.29Å; L254-C263 HydrophobicContact CB-CB 4.41Å; L254-C263 WeakPolarHBondContact O-CB 3.41Å; L254-L266 HydrophobicContact CD1-CD1 3.92Å; L254-D297 HydrophobicContact CD2-CB 3.77Å; L254-F301 HydrophobicContact CD1-CB 4.14Å; L254-F301 HydrophobicContact CD1-CD2 3.6Å; L254-F301 HydrophobicContact CD1-CE2 4.3Å; L254-F301 HydrophobicContact CD1-CG 4.06Å
255	D	72.9	Confident	81.6	Confident	37 Å²	37	48.5 Å²	48.5	20%	0.198	25%	0.253	C	S	.	.			trans	-81.2	6	-177.9	75.2	-1.5	0	0	0	115.3	R192 E250	R192-D255 IonicContact CZ-OD2 2.7Å; R192-D255 IonicContact NH2-OD1 3.68Å; R192-D255 PolarHBondContact NH2-OD1 3.48Å; R192-D255 IonicContact NH2-OD2 3.44Å; R192-D255 PolarHBondContact NH2-OD2 2.87Å; E250-D255 WeakPolarHBondContact CB-OD2 3.25Å; E250-D255 WeakPolarHBondContact CG-OD2 3.32Å
256	Q	67.4	Low	81.5	Confident	93 Å²	93	48.1 Å²	48.1	44%	0.435	25%	0.252	S	S	.	.	S	Bend	trans	-73.7	151.3	176.3	-61.3	-163.7	1.6	0	0	111.5	N253 L254 S258 A259 Q260	N253-Q256 VanDerWaalsContact CG-NE2 3.35Å; N253-Q256 VanDerWaalsContact ND2-CD 3.31Å; N253-Q256 PolarHBondContact ND2-NE2 2.8Å; N253-Q256 PolarHBondContact OD1-NE2 2.91Å; L254-Q256 PolarHBondContact O-N 2.87Å; Q256-S258 PolarHBondContact O-N 3.37Å; Q256-A259 CarbonylContact O-C 3.6Å; Q256-A259 PolarHBondContact O-N 2.89Å; Q256-Q260 PolarHBondContact O-N 2.9Å
257	R	65.8	Low	81.5	Confident	235 Å²	235	45.6 Å²	45.6	89%	0.887	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.7	-28.3	-176.7	-68	-176.8	178.6	179.9	-1.7	115.7
258	S	61.9	Low	81.5	Confident	105 Å²	105	51.2 Å²	51.2	73%	0.734	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-28.8	177.4	52.1	0	0	0	0	114.2	Q256	Q256-S258 PolarHBondContact O-N 3.37Å
259	A	68.1	Low	81.4	Confident	3 Å²	3	55 Å²	55	3%	0.025	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-7.9	-177.5	0	0	0	0	0	112.8	L254 Q256 A261 S262 C263	L254-A259 CarbonylContact O-C 3.56Å; L254-A259 WeakPolarHBondContact O-CB 3.29Å; Q256-A259 CarbonylContact O-C 3.6Å; Q256-A259 PolarHBondContact O-N 2.89Å; A259-A261 PolarHBondContact O-N 3.43Å; A259-A261 VanDerWaalsContact O-N 3.12Å; A259-S262 CarbonylContact O-C 3.59Å; A259-S262 WeakPolarHBondContact O-CA 3.29Å; A259-S262 WeakPolarHBondContact O-CB 3.43Å; A259-S262 PolarHBondContact O-N 3Å; A259-C263 PolarHBondContact O-N 2.6Å
260	Q	75.5	Confident	81.3	Confident	101 Å²	101	55.4 Å²	55.4	47%	0.472	29%	0.291	S	S	.	.	H	α-helix	trans	-52.1	-36.5	-176.6	-171.5	175.2	-3.1	0	0	113.8	Q256 C263 L264	Q256-Q260 PolarHBondContact O-N 2.9Å; Q260-C263 PolarHBondContact O-N 3.2Å; Q260-L264 HydrophobicContact CG-CD1 4.5Å; Q260-L264 WeakPolarHBondContact O-CG 3.35Å; Q260-L264 PolarHBondContact O-N 3.4Å
261	A	82.7	Confident	81.1	Confident	78 Å²	78	61.6 Å²	61.6	65%	0.645	32%	0.32	S	S	*	.	H	α-helix	trans	-66.6	-44.2	175.4	0	0	0	0	0	112.6	A259 C263 L264 C265	A259-A261 PolarHBondContact O-N 3.43Å; A259-A261 VanDerWaalsContact O-N 3.12Å; A261-C263 VanDerWaalsContact C-N 3.34Å; A261-L264 PolarHBondContact O-N 3.43Å; A261-C265 PolarHBondContact O-N 3.08Å; A261-C265 VanDerWaalsContact O-N 3.09Å
262	S	84.3	Confident	80.9	Confident	21 Å²	21	63.7 Å²	63.7	15%	0.147	33%	0.332	C	S	.	.	H	α-helix	trans	-67.1	-34.6	173.1	-65.8	0	0	0	0	112.2	A259 C265 L266 C291	A259-S262 CarbonylContact O-C 3.59Å; A259-S262 WeakPolarHBondContact O-CA 3.29Å; A259-S262 WeakPolarHBondContact O-CB 3.43Å; A259-S262 PolarHBondContact O-N 3Å; S262-C265 PolarHBondContact O-N 3.22Å; S262-L266 WeakPolarHBondContact O-CB 3.32Å; S262-L266 VanDerWaalsContact O-CG 3.27Å; S262-L266 WeakPolarHBondContact O-CG 3.38Å; S262-L266 PolarHBondContact O-N 3.32Å; S262-C291 VanDerWaalsContact CB-O 3.25Å; S262-C291 WeakPolarHBondContact CB-O 3.42Å; S262-C291 PolarHBondContact OG-O 3.29Å
263	C	83.7	Confident	80.8	Confident	8 Å²	8	63.8 Å²	63.8	5%	0.054	33%	0.332	C	S	.	.	H	α-helix	trans	-65.5	-37.7	175.1	-168.9	0	0	0	0	112.3	L254 A259 Q260 A261 L267	L254-C263 HydrophobicContact CB-CB 4.41Å; L254-C263 WeakPolarHBondContact O-CB 3.41Å; A259-C263 PolarHBondContact O-N 2.6Å; Q260-C263 PolarHBondContact O-N 3.2Å; A261-C263 VanDerWaalsContact C-N 3.34Å; C263-L267 WeakPolarHBondContact O-CD1 3.34Å; C263-L267 VanDerWaalsContact O-CG 3.3Å; C263-L267 WeakPolarHBondContact O-CG 3.49Å; C263-L267 PolarHBondContact O-N 3.03Å
264	L	85.6	Confident	80.9	Confident	93 Å²	93	65.4 Å²	65.4	49%	0.487	34%	0.341	S	S	.	.	H	α-helix	trans	-67.9	-47.8	174	-72.9	167.2	0	0	0	111.1	Q260 A261 L266 L267 D268	Q260-L264 HydrophobicContact CG-CD1 4.5Å; Q260-L264 WeakPolarHBondContact O-CG 3.35Å; Q260-L264 PolarHBondContact O-N 3.4Å; A261-L264 PolarHBondContact O-N 3.43Å; L264-L266 VanDerWaalsContact C-N 3.28Å; L264-L266 PolarHBondContact O-N 3.11Å; L264-L267 CarbonylContact O-C 3.47Å; L264-L267 WeakPolarHBondContact O-CA 3.47Å; L264-L267 WeakPolarHBondContact O-CB 3.43Å; L264-L267 PolarHBondContact O-N 3.21Å; L264-D268 PolarHBondContact O-N 3.17Å
265	C	88.5	Confident	81.1	Confident	35 Å²	35	68.5 Å²	68.5	24%	0.236	36%	0.355	C	S	.	.	H	α-helix	trans	-56.4	-40.9	174.1	177.2	0	0	0	0	112.6	A261 S262 L267 D268 E269 C291	A261-C265 PolarHBondContact O-N 3.08Å; A261-C265 VanDerWaalsContact O-N 3.09Å; S262-C265 PolarHBondContact O-N 3.22Å; C265-L267 PolarHBondContact O-N 3.48Å; C265-D268 PolarHBondContact O-N 3.07Å; C265-E269 WeakPolarHBondContact O-CB 3.03Å; C265-E269 WeakPolarHBondContact O-CG 3.45Å; C265-E269 PolarHBondContact O-N 2.91Å; C265-C291 HydrophobicContact CB-CB 3.63Å; C265-C291 WeakPolarHBondContact CB-SG 3.49Å; C265-C291 PolarHBondContact O-SG 3.21Å; C265-C291 WeakPolarHBondContact SG-CA 3.13Å; C265-C291 WeakPolarHBondContact SG-CB 3.36Å; C265-C291 CovalentContact SG-SG 2.05Å; C265-C291 PolarHBondContact SG-SG 3.48Å
266	L	87.3	Confident	81.9	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-67.5	-17.3	174.9	-73.4	172.7	0	0	0	113.9	L245 L249 L254 S262 L264 L270 L287 C291 V293 F301	L245-L266 WeakPolarHBondContact CD2-O 3.22Å; L249-L266 HydrophobicContact CD1-CB 4.09Å; L249-L266 HydrophobicContact CD2-CB 4.44Å; L249-L266 HydrophobicContact CD2-CD1 4.02Å; L254-L266 HydrophobicContact CD1-CD1 3.92Å; S262-L266 WeakPolarHBondContact O-CB 3.32Å; S262-L266 VanDerWaalsContact O-CG 3.27Å; S262-L266 WeakPolarHBondContact O-CG 3.38Å; S262-L266 PolarHBondContact O-N 3.32Å; L264-L266 VanDerWaalsContact C-N 3.28Å; L264-L266 PolarHBondContact O-N 3.11Å; L266-L270 WeakPolarHBondContact O-CB 3.42Å; L266-L287 HydrophobicContact CD2-CD1 4.09Å; L266-L287 HydrophobicContact CD2-CD2 3.78Å; L266-L287 HydrophobicContact CD2-CG 3.73Å; L266-C291 HydrophobicContact CD2-CB 4.22Å; L266-C291 HydrophobicContact CG-CB 4.15Å; L266-V293 HydrophobicContact CD1-CG2 3.95Å; L266-V293 HydrophobicContact CG-CG2 4.33Å; L266-F301 HydrophobicContact CD1-CE1 4.36Å; L266-F301 HydrophobicContact CD1-CE2 4.19Å; L266-F301 HydrophobicContact CD1-CZ 4.1Å; L266-F301 HydrophobicContact CD2-CE1 4.13Å; L266-F301 HydrophobicContact CD2-CZ 4.05Å
267	L	85.8	Confident	83	Confident	56 Å²	56	63.9 Å²	63.9	29%	0.293	33%	0.333	S	S	.	.	H	α-helix	trans	-92.4	-21.5	172.6	-70.2	165	0	0	0	112.6	L245 H246 L249 C263 L264 C265	L245-L267 HydrophobicContact CB-CD2 4.09Å; L245-L267 HydrophobicContact CD2-CD2 4.1Å; L245-L267 HydrophobicContact CG-CD2 3.95Å; H246-L267 HydrophobicContact CB-CD2 4.23Å; L249-L267 HydrophobicContact CD1-CD1 4.36Å; L249-L267 HydrophobicContact CD1-CD2 3.84Å; L249-L267 HydrophobicContact CD1-CG 3.74Å; C263-L267 WeakPolarHBondContact O-CD1 3.34Å; C263-L267 VanDerWaalsContact O-CG 3.3Å; C263-L267 WeakPolarHBondContact O-CG 3.49Å; C263-L267 PolarHBondContact O-N 3.03Å; L264-L267 CarbonylContact O-C 3.47Å; L264-L267 WeakPolarHBondContact O-CA 3.47Å; L264-L267 WeakPolarHBondContact O-CB 3.43Å; L264-L267 PolarHBondContact O-N 3.21Å; C265-L267 PolarHBondContact O-N 3.48Å
268	D	87.7	Confident	84.1	Confident	139 Å²	139	57.7 Å²	57.7	74%	0.743	32%	0.322	S	S	*	.	H	α-helix	trans	-84	-32.1	173.4	-63.8	-36	0	0	0	111.7	L264 C265	L264-D268 PolarHBondContact O-N 3.17Å; C265-D268 PolarHBondContact O-N 3.07Å
269	E	88.4	Confident	85.4	Confident	82 Å²	82	54.1 Å²	54.1	38%	0.383	29%	0.294	S	S	.	.	S	Bend	trans	-91.9	-5.6	-178.7	-72	-112.4	153.4	0	0	114.9	C265 L287 R290	C265-E269 WeakPolarHBondContact O-CB 3.03Å; C265-E269 WeakPolarHBondContact O-CG 3.45Å; C265-E269 PolarHBondContact O-N 2.91Å; E269-L287 HydrophobicContact CB-CD1 3.75Å; E269-L287 HydrophobicContact CG-CD1 4.33Å; E269-L287 WeakPolarHBondContact OE2-CD1 3.47Å; E269-R290 IonicContact OE1-NE 3.15Å; E269-R290 IonicContact OE2-CZ 3.47Å; E269-R290 IonicContact OE2-NE 2.68Å; E269-R290 PolarHBondContact OE2-NE 2.87Å; E269-R290 IonicContact OE2-NH2 2.65Å; E269-R290 PolarHBondContact OE2-NH2 2.83Å
270	L	87.1	Confident	86.5	Confident	9 Å²	9	57.5 Å²	57.5	5%	0.047	31%	0.312	C	S	.	.			trans	-141.8	130.3	179.2	-67.6	171.1	0	0	0	110.9	L245 L266 E275 L276 L279 L287	L245-L270 HydrophobicContact CD2-CB 3.47Å; L245-L270 VanDerWaalsContact CD2-CB 3.47Å; L245-L270 HydrophobicContact CD2-CD1 4.09Å; L245-L270 HydrophobicContact CD2-CG 4.45Å; L266-L270 WeakPolarHBondContact O-CB 3.42Å; L270-E275 WeakPolarHBondContact CA-OE2 3.3Å; L270-E275 HydrophobicContact CD2-CB 4.49Å; L270-E275 HydrophobicContact CD2-CG 3.91Å; L270-L276 HydrophobicContact CD1-CB 4.14Å; L270-L276 HydrophobicContact CD1-CD1 3.92Å; L270-L276 HydrophobicContact CD1-CG 4.49Å; L270-L279 HydrophobicContact CD2-CD1 4.25Å; L270-L287 HydrophobicContact CD1-CD2 3.69Å; L270-L287 HydrophobicContact CD2-CD2 4.26Å; L270-L287 HydrophobicContact CG-CD2 4.04Å
271	Q	82.2	Confident	87.2	Confident	179 Å²	179	54.1 Å²	54.1	84%	0.836	30%	0.297	S	S	*	.	S	Bend	trans	-77	-44	-178.4	-58	-177.4	25.2	0	0	112.1	E275	Q271-E275 PolarHBondContact N-OE2 3.4Å
272	D	85	Confident	87.5	Confident	47 Å²	47	53.8 Å²	53.8	25%	0.251	29%	0.294	S	S	.	.			trans	-151.5	-170.7	177	84.6	-4.1	0	0	0	114.1	K227 D274 E275 L276	K227-D272 IonicContact NZ-OD2 3.86Å; K227-D272 PolarHBondContact NZ-OD2 3.38Å; D272-D274 WeakPolarHBondContact OD1-CA 3.38Å; D272-D274 WeakPolarHBondContact OD1-CB 3.48Å; D272-D274 PolarHBondContact OD1-N 2.95Å; D272-E275 PolarHBondContact OD1-N 3.17Å; D272-L276 PolarHBondContact O-N 3.37Å
273	V	88.3	Confident	87.9	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.006	31%	0.307	C	S	.	.	H	α-helix	trans	-78.4	-24.8	179.7	178.2	0	0	0	0	112.1	L224 G243 L245 W248 L276 L277 L308	L224-V273 HydrophobicContact CD1-CG1 4.21Å; L224-V273 HydrophobicContact CD2-CB 4.34Å; L224-V273 HydrophobicContact CD2-CG1 4.16Å; G243-V273 WeakPolarHBondContact O-CG2 3.16Å; L245-V273 HydrophobicContact CB-CG2 4.22Å; L245-V273 HydrophobicContact CD1-CG2 3.99Å; W248-V273 HydrophobicContact CB-CG2 3.96Å; W248-V273 HydrophobicContact CG-CG2 4.39Å; V273-L276 PolarHBondContact O-N 3.38Å; V273-L277 WeakPolarHBondContact O-CG 3.35Å; V273-L277 PolarHBondContact O-N 3.15Å; V273-L308 HydrophobicContact CG1-CD2 3.7Å
274	D	86.8	Confident	88.2	Confident	49 Å²	49	56.8 Å²	56.8	26%	0.262	31%	0.305	S	S	.	.	H	α-helix	trans	-70.1	-39.5	177.3	-66.7	-94.9	0	0	0	109.9	L224 K227 D272 L277 T278	L224-D274 WeakPolarHBondContact CD2-OD2 3.15Å; K227-D274 IonicContact NZ-OD2 2.88Å; K227-D274 PolarHBondContact NZ-OD2 3.29Å; D272-D274 WeakPolarHBondContact OD1-CA 3.38Å; D272-D274 WeakPolarHBondContact OD1-CB 3.48Å; D272-D274 PolarHBondContact OD1-N 2.95Å; D274-L277 PolarHBondContact O-N 3.01Å; D274-T278 PolarHBondContact O-N 2.87Å
275	E	88.1	Confident	88.5	Confident	68 Å²	68	56.3 Å²	56.3	32%	0.318	30%	0.299	S	S	.	.	H	α-helix	trans	-59.1	-47.6	170.5	-174.7	172.3	-150.9	0	0	112.2	L270 Q271 D272 L277 T278	L270-E275 WeakPolarHBondContact CA-OE2 3.3Å; L270-E275 HydrophobicContact CD2-CB 4.49Å; L270-E275 HydrophobicContact CD2-CG 3.91Å; Q271-E275 PolarHBondContact N-OE2 3.4Å; D272-E275 PolarHBondContact OD1-N 3.17Å; E275-L277 PolarHBondContact O-N 2.76Å; E275-L277 VanDerWaalsContact O-N 3.1Å; E275-T278 WeakPolarHBondContact O-CB 3.17Å; E275-T278 PolarHBondContact O-N 2.84Å; E275-T278 PolarHBondContact O-OG1 3.47Å
276	L	90.5	Very high	88.6	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.016	31%	0.305	C	S	.	.	H	α-helix	trans	-54.5	-30.9	175.8	175.9	61.1	0	0	0	113.1	L245 L270 D272 V273 L284 F301 A305	L245-L276 HydrophobicContact CD1-CD2 4.11Å; L270-L276 HydrophobicContact CD1-CB 4.14Å; L270-L276 HydrophobicContact CD1-CD1 3.92Å; L270-L276 HydrophobicContact CD1-CG 4.49Å; D272-L276 PolarHBondContact O-N 3.37Å; V273-L276 PolarHBondContact O-N 3.38Å; L276-L284 HydrophobicContact CD1-CD1 3.74Å; L276-F301 HydrophobicContact CD1-CE1 4.41Å; L276-F301 HydrophobicContact CD1-CE2 4.49Å; L276-F301 HydrophobicContact CD1-CZ 3.75Å; L276-F301 HydrophobicContact CD2-CE2 4.26Å; L276-F301 HydrophobicContact CD2-CZ 4.29Å; L276-A305 HydrophobicContact CD1-CB 4.44Å
277	L	89.2	Confident	88.8	Confident	29 Å²	29	56.8 Å²	56.8	15%	0.152	31%	0.305	C	S	.	.	H	α-helix	trans	-83.5	-13.5	178.2	-66.4	-169.7	0	0	0	114.4	L224 V273 D274 E275 L279 L308 R309 A312	L224-L277 HydrophobicContact CD1-CD1 3.54Å; V273-L277 WeakPolarHBondContact O-CG 3.35Å; V273-L277 PolarHBondContact O-N 3.15Å; D274-L277 PolarHBondContact O-N 3.01Å; E275-L277 PolarHBondContact O-N 2.76Å; E275-L277 VanDerWaalsContact O-N 3.1Å; L277-L279 VanDerWaalsContact C-N 3.33Å; L277-L308 HydrophobicContact CD1-CD2 4.35Å; L277-L308 HydrophobicContact CD1-CG 4.26Å; L277-L308 HydrophobicContact CD2-CB 4.17Å; L277-L308 HydrophobicContact CD2-CD2 4.04Å; L277-L308 HydrophobicContact CD2-CG 4.08Å; L277-L308 HydrophobicContact CG-CD2 4.47Å; L277-R309 HydrophobicContact CD2-CB 3.84Å; L277-R309 HydrophobicContact CD2-CG 4.35Å; L277-R309 WeakPolarHBondContact O-CD 3.35Å; L277-A312 HydrophobicContact CD1-CB 3.92Å
278	T	88.8	Confident	89.1	Confident	106 Å²	106	54.1 Å²	54.1	65%	0.65	29%	0.291	S	S	*	.	H	α-helix	trans	-76.3	-22.3	171.5	67.4	0	0	0	0	112.9	D274 E275	D274-T278 PolarHBondContact O-N 2.87Å; E275-T278 WeakPolarHBondContact O-CB 3.17Å; E275-T278 PolarHBondContact O-N 2.84Å; E275-T278 PolarHBondContact O-OG1 3.47Å
279	L	90.8	Very high	89.2	Confident	30 Å²	30	51.5 Å²	51.5	16%	0.157	28%	0.277	C	S	.	.			trans	-68.6	132.7	-176.7	-58.6	-173.2	0	0	0	112.3	L270 L277 Q283 L284 L287 R309	L270-L279 HydrophobicContact CD2-CD1 4.25Å; L277-L279 VanDerWaalsContact C-N 3.33Å; L279-Q283 HydrophobicContact CB-CB 4.18Å; L279-Q283 HydrophobicContact CD2-CB 4.24Å; L279-L284 HydrophobicContact CB-CB 4.49Å; L279-L287 HydrophobicContact CD1-CD2 3.84Å; L279-R309 PolarHBondContact O-NH1 2.74Å
280	D	90.6	Very high	89.3	Confident	74 Å²	74	54.3 Å²	54.3	40%	0.396	28%	0.284	S	S	.	.			trans	-71	169.5	165	76.5	54.4	0	0	0	111.5	A282 Q283 L284	D280-A282 VanDerWaalsContact C-N 3.33Å; D280-A282 PolarHBondContact O-N 3.49Å; D280-A282 WeakPolarHBondContact OD1-CA 3.49Å; D280-A282 WeakPolarHBondContact OD1-CB 3.3Å; D280-A282 PolarHBondContact OD1-N 2.81Å; D280-Q283 PolarHBondContact O-N 3.17Å; D280-Q283 PolarHBondContact OD1-N 3.4Å; D280-Q283 VanDerWaalsContact OD2-CG 3.32Å; D280-Q283 WeakPolarHBondContact OD2-CG 3.44Å; D280-Q283 PolarHBondContact OD2-NE2 2.88Å; D280-Q283 PolarHBondContact OD2-OE1 3.42Å; D280-L284 VanDerWaalsContact O-CB 3.24Å; D280-L284 WeakPolarHBondContact O-CB 3.44Å; D280-L284 PolarHBondContact O-N 3.49Å
281	D	89.4	Confident	89.4	Confident	30 Å²	30	54.1 Å²	54.1	16%	0.16	28%	0.284	C	S	.	.	H	α-helix	trans	-67.2	-30.6	-176	-68.7	-32.5	0	0	0	113.6	F285 Q306 R309	D281-F285 WeakPolarHBondContact O-CB 3.46Å; D281-F285 WeakPolarHBondContact O-CD2 3.15Å; D281-F285 WeakPolarHBondContact O-CG 3.32Å; D281-F285 PolarHBondContact O-N 3.25Å; D281-Q306 PolarHBondContact OD1-NE2 3.48Å; D281-Q306 PolarHBondContact OD2-NE2 2.88Å; D281-R309 VanDerWaalsContact CG-NH2 3.31Å; D281-R309 IonicContact OD1-CZ 2.6Å; D281-R309 VanDerWaalsContact OD1-CZ 3.31Å; D281-R309 IonicContact OD1-NH1 2.76Å; D281-R309 PolarHBondContact OD1-NH1 3.32Å; D281-R309 IonicContact OD1-NH2 2.9Å; D281-R309 PolarHBondContact OD1-NH2 3.19Å; D281-R309 IonicContact OD2-NH2 3.03Å; D281-R309 PolarHBondContact OD2-NH2 3.14Å
282	A	89.6	Confident	89.6	Confident	70 Å²	70	48.3 Å²	48.3	58%	0.579	26%	0.263	S	S	*	.	H	α-helix	trans	-74.3	-40.5	176.2	0	0	0	0	0	111.3	D280 F285 A286	D280-A282 VanDerWaalsContact C-N 3.33Å; D280-A282 PolarHBondContact O-N 3.49Å; D280-A282 WeakPolarHBondContact OD1-CA 3.49Å; D280-A282 WeakPolarHBondContact OD1-CB 3.3Å; D280-A282 PolarHBondContact OD1-N 2.81Å; A282-F285 PolarHBondContact O-N 3.06Å; A282-A286 WeakPolarHBondContact O-CB 3.33Å; A282-A286 PolarHBondContact O-N 3.02Å
283	Q	92.4	Very high	89.7	Confident	91 Å²	91	46.2 Å²	46.2	43%	0.425	25%	0.252	S	S	.	.	H	α-helix	trans	-61.4	-43.6	171.4	-70	172.3	-13.1	0	0	111.7	L279 D280 A286 L287	L279-Q283 HydrophobicContact CB-CB 4.18Å; L279-Q283 HydrophobicContact CD2-CB 4.24Å; D280-Q283 PolarHBondContact O-N 3.17Å; D280-Q283 PolarHBondContact OD1-N 3.4Å; D280-Q283 VanDerWaalsContact OD2-CG 3.32Å; D280-Q283 WeakPolarHBondContact OD2-CG 3.44Å; D280-Q283 PolarHBondContact OD2-NE2 2.88Å; D280-Q283 PolarHBondContact OD2-OE1 3.42Å; Q283-A286 PolarHBondContact O-N 3.04Å; Q283-L287 WeakPolarHBondContact O-CB 3.37Å; Q283-L287 PolarHBondContact O-N 3.38Å
284	L	90.7	Very high	89.5	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-64.4	-39.6	176.9	-176.9	64.3	0	0	0	111.9	L276 L279 D280 C288 F301 V302 A305	L276-L284 HydrophobicContact CD1-CD1 3.74Å; L279-L284 HydrophobicContact CB-CB 4.49Å; D280-L284 VanDerWaalsContact O-CB 3.24Å; D280-L284 WeakPolarHBondContact O-CB 3.44Å; D280-L284 PolarHBondContact O-N 3.49Å; L284-C288 PolarHBondContact O-N 3.38Å; L284-C288 PolarHBondContact O-SG 3.48Å; L284-F301 HydrophobicContact CD1-CD1 4.37Å; L284-F301 HydrophobicContact CD1-CE1 3.68Å; L284-F301 HydrophobicContact CD1-CZ 4.32Å; L284-V302 HydrophobicContact CD2-CB 4.44Å; L284-V302 HydrophobicContact CD2-CG1 4.15Å; L284-V302 HydrophobicContact CD2-CG2 4.34Å; L284-V302 HydrophobicContact CG-CG2 4.29Å; L284-A305 HydrophobicContact CD1-CB 4.37Å; L284-A305 HydrophobicContact CD2-CB 3.91Å
285	F	91.2	Very high	89.3	Confident	84 Å²	84	52.6 Å²	52.6	37%	0.368	29%	0.292	S	S	.	.	H	α-helix	trans	-66.3	-42.7	171	-77.7	-48.7	0	0	0	112.4	D281 A282 L287 C288 D289 V302	D281-F285 WeakPolarHBondContact O-CB 3.46Å; D281-F285 WeakPolarHBondContact O-CD2 3.15Å; D281-F285 WeakPolarHBondContact O-CG 3.32Å; D281-F285 PolarHBondContact O-N 3.25Å; A282-F285 PolarHBondContact O-N 3.06Å; F285-L287 VanDerWaalsContact C-N 3.32Å; F285-L287 PolarHBondContact O-N 3.26Å; F285-C288 VanDerWaalsContact O-CB 3.32Å; F285-C288 WeakPolarHBondContact O-CB 3.42Å; F285-C288 PolarHBondContact O-N 3.11Å; F285-C288 VanDerWaalsContact O-N 3.14Å; F285-D289 PolarHBondContact O-N 2.81Å; F285-V302 HydrophobicContact CD1-CG2 3.95Å; F285-V302 HydrophobicContact CE1-CB 4.32Å; F285-V302 HydrophobicContact CE1-CG1 3.9Å; F285-V302 HydrophobicContact CE1-CG2 3.78Å; F285-V302 HydrophobicContact CZ-CG1 4.01Å
286	A	91	Very high	88.9	Confident	43 Å²	43	52.2 Å²	52.2	36%	0.355	29%	0.291	S	S	.	.	H	α-helix	trans	-63	-37.3	176.7	0	0	0	0	0	112.3	A282 Q283 D289 R290	A282-A286 WeakPolarHBondContact O-CB 3.33Å; A282-A286 PolarHBondContact O-N 3.02Å; Q283-A286 PolarHBondContact O-N 3.04Å; A286-D289 PolarHBondContact O-N 3.07Å; A286-R290 WeakPolarHBondContact O-CG 3.2Å; A286-R290 PolarHBondContact O-N 3.09Å
287	L	91.9	Very high	88.6	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-63.4	-43.1	171.5	176	66.2	0	0	0	111.6	L266 E269 L270 L279 Q283 F285 D289 R290 C291	L266-L287 HydrophobicContact CD2-CD1 4.09Å; L266-L287 HydrophobicContact CD2-CD2 3.78Å; L266-L287 HydrophobicContact CD2-CG 3.73Å; E269-L287 HydrophobicContact CB-CD1 3.75Å; E269-L287 HydrophobicContact CG-CD1 4.33Å; E269-L287 WeakPolarHBondContact OE2-CD1 3.47Å; L270-L287 HydrophobicContact CD1-CD2 3.69Å; L270-L287 HydrophobicContact CD2-CD2 4.26Å; L270-L287 HydrophobicContact CG-CD2 4.04Å; L279-L287 HydrophobicContact CD1-CD2 3.84Å; Q283-L287 WeakPolarHBondContact O-CB 3.37Å; Q283-L287 PolarHBondContact O-N 3.38Å; F285-L287 VanDerWaalsContact C-N 3.32Å; F285-L287 PolarHBondContact O-N 3.26Å; L287-D289 VanDerWaalsContact C-N 3.28Å; L287-D289 PolarHBondContact O-N 3.23Å; L287-R290 PolarHBondContact O-N 3.44Å; L287-C291 PolarHBondContact O-N 3.31Å
288	C	91.3	Very high	88.6	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-58.3	-41.5	173.5	-67.8	0	0	0	0	111.8	L284 F285 S292 V293 R298	L284-C288 PolarHBondContact O-N 3.38Å; L284-C288 PolarHBondContact O-SG 3.48Å; F285-C288 VanDerWaalsContact O-CB 3.32Å; F285-C288 WeakPolarHBondContact O-CB 3.42Å; F285-C288 PolarHBondContact O-N 3.11Å; F285-C288 VanDerWaalsContact O-N 3.14Å; C288-S292 CarbonylContact O-C 3.5Å; C288-S292 PolarHBondContact O-N 3.03Å; C288-S292 VanDerWaalsContact O-N 3.08Å; C288-V293 HydrophobicContact CB-CB 3.99Å; C288-V293 HydrophobicContact CB-CG2 4.47Å; C288-V293 PolarHBondContact O-N 2.83Å; C288-R298 HydrophobicContact CB-CG 4.06Å
289	D	89.9	Confident	88.5	Confident	84 Å²	84	58 Å²	58	45%	0.449	30%	0.301	S	S	.	.	H	α-helix	trans	-69.1	-42.3	178.4	-76.7	-54.1	0	0	0	112.5	F285 A286 L287 S292 R298	F285-D289 PolarHBondContact O-N 2.81Å; A286-D289 PolarHBondContact O-N 3.07Å; L287-D289 VanDerWaalsContact C-N 3.28Å; L287-D289 PolarHBondContact O-N 3.23Å; D289-S292 PolarHBondContact O-N 2.99Å; D289-R298 IonicContact OD1-CZ 2.66Å; D289-R298 IonicContact OD1-NH1 2.63Å; D289-R298 PolarHBondContact OD1-NH1 3.19Å; D289-R298 IonicContact OD1-NH2 3.13Å; D289-R298 IonicContact OD2-CZ 2.69Å; D289-R298 VanDerWaalsContact OD2-CZ 3.3Å; D289-R298 IonicContact OD2-NH1 2.79Å; D289-R298 PolarHBondContact OD2-NH1 3.17Å; D289-R298 IonicContact OD2-NH2 3.79Å; D289-R298 PolarHBondContact OD2-NH2 3.12Å
290	R	90	Very high	88.4	Confident	141 Å²	141	58.2 Å²	58.2	53%	0.532	30%	0.3	S	S	.	.	H	α-helix	trans	-58.2	-52.9	172.7	-70.6	-164.8	-53.4	-83.1	9.2	111.5	E269 A286 L287 S292	E269-R290 IonicContact OE1-NE 3.15Å; E269-R290 IonicContact OE2-CZ 3.47Å; E269-R290 IonicContact OE2-NE 2.68Å; E269-R290 PolarHBondContact OE2-NE 2.87Å; E269-R290 IonicContact OE2-NH2 2.65Å; E269-R290 PolarHBondContact OE2-NH2 2.83Å; A286-R290 WeakPolarHBondContact O-CG 3.2Å; A286-R290 PolarHBondContact O-N 3.09Å; L287-R290 PolarHBondContact O-N 3.44Å; R290-S292 PolarHBondContact O-N 2.69Å; R290-S292 VanDerWaalsContact O-N 3.14Å
291	C	89.7	Confident	88.4	Confident	5 Å²	5	54.7 Å²	54.7	3%	0.034	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	12.2	179.4	-68.6	0	0	0	0	114.8	S262 C265 L266 L287 V293	S262-C291 VanDerWaalsContact CB-O 3.25Å; S262-C291 WeakPolarHBondContact CB-O 3.42Å; S262-C291 PolarHBondContact OG-O 3.29Å; C265-C291 HydrophobicContact CB-CB 3.63Å; C265-C291 WeakPolarHBondContact CB-SG 3.49Å; C265-C291 PolarHBondContact O-SG 3.21Å; C265-C291 WeakPolarHBondContact SG-CA 3.13Å; C265-C291 WeakPolarHBondContact SG-CB 3.36Å; C265-C291 CovalentContact SG-SG 2.05Å; C265-C291 PolarHBondContact SG-SG 3.48Å; L266-C291 HydrophobicContact CD2-CB 4.22Å; L266-C291 HydrophobicContact CG-CB 4.15Å; L287-C291 PolarHBondContact O-N 3.31Å; C291-V293 HydrophobicContact CB-CG2 4.04Å; C291-V293 PolarHBondContact O-N 3.07Å
292	S	87.4	Confident	88.5	Confident	58 Å²	58	53.6 Å²	53.6	41%	0.406	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	25.4	179	-83.1	0	0	0	0	115.4	C288 D289 R290 K294	C288-S292 CarbonylContact O-C 3.5Å; C288-S292 PolarHBondContact O-N 3.03Å; C288-S292 VanDerWaalsContact O-N 3.08Å; D289-S292 PolarHBondContact O-N 2.99Å; R290-S292 PolarHBondContact O-N 2.69Å; R290-S292 VanDerWaalsContact O-N 3.14Å; S292-K294 WeakPolarHBondContact O-CD 3.48Å; S292-K294 WeakPolarHBondContact O-CG 3.16Å; S292-K294 PolarHBondContact O-N 2.92Å; S292-K294 VanDerWaalsContact O-N 3.13Å; S292-K294 PolarHBondContact OG-NZ 3.22Å
293	V	85.9	Confident	88.5	Confident	2 Å²	2	56 Å²	56	1%	0.012	27%	0.27	C	S	.	.			trans	-67.3	108.5	174.5	-168	0	0	0	0	108.3	L266 C288 C291 D297 R298	L266-V293 HydrophobicContact CD1-CG2 3.95Å; L266-V293 HydrophobicContact CG-CG2 4.33Å; C288-V293 HydrophobicContact CB-CB 3.99Å; C288-V293 HydrophobicContact CB-CG2 4.47Å; C288-V293 PolarHBondContact O-N 2.83Å; C291-V293 HydrophobicContact CB-CG2 4.04Å; C291-V293 PolarHBondContact O-N 3.07Å; V293-D297 HydrophobicContact CG1-CB 4.09Å; V293-R298 HydrophobicContact CG1-CB 4.24Å
294	K	83.6	Confident	88.5	Confident	130 Å²	130	51.7 Å²	51.7	57%	0.565	25%	0.25	S	C	*	.			trans	-126.3	159.1	-166.7	-78.2	160.1	-178.9	159.1	0	112.4	S292 E296 D297	S292-K294 WeakPolarHBondContact O-CD 3.48Å; S292-K294 WeakPolarHBondContact O-CG 3.16Å; S292-K294 PolarHBondContact O-N 2.92Å; S292-K294 VanDerWaalsContact O-N 3.13Å; S292-K294 PolarHBondContact OG-NZ 3.22Å; K294-E296 PolarHBondContact O-N 3.12Å; K294-D297 PolarHBondContact O-N 3.39Å
295	G	82.6	Confident	88.6	Confident	54 Å²	54	51.8 Å²	51.8	56%	0.557	25%	0.251	S	S	*	.	H	α-helix	trans	57.5	-128	175.5	0	0	0	0	0	113.7	D297 R298 R299	G295-D297 VanDerWaalsContact C-N 3.3Å; G295-D297 PolarHBondContact O-N 3.49Å; G295-R298 PolarHBondContact O-N 3.5Å; G295-R299 PolarHBondContact O-N 3.5Å
296	E	80.5	Confident	88.5	Confident	60 Å²	60	50.2 Å²	50.2	28%	0.28	24%	0.244	S	C	.	.	H	α-helix	trans	-68.1	-28.9	-176.6	-169.1	56	-155.2	0	0	113.2	K294 R298 R299 R300	K294-E296 PolarHBondContact O-N 3.12Å; E296-R298 VanDerWaalsContact C-N 3.33Å; E296-R298 PolarHBondContact O-N 2.94Å; E296-R299 PolarHBondContact O-N 2.95Å; E296-R299 IonicContact OE2-CZ 3.83Å; E296-R299 IonicContact OE2-NE 2.95Å; E296-R299 PolarHBondContact OE2-NE 3Å; E296-R299 IonicContact OE2-NH2 3.38Å; E296-R299 PolarHBondContact OE2-NH2 3.28Å; E296-R300 HydrophobicContact CG-CG 4.35Å; E296-R300 WeakPolarHBondContact O-CB 3.38Å; E296-R300 WeakPolarHBondContact O-CG 3.19Å; E296-R300 PolarHBondContact O-N 2.91Å
297	D	84.4	Confident	88.6	Confident	37 Å²	37	48.9 Å²	48.9	20%	0.198	23%	0.231	C	C	.	.	H	α-helix	trans	-68	-38.4	-179.4	-63.9	-6.8	0	0	0	110.4	L254 V293 K294 G295 R300 F301	L254-D297 HydrophobicContact CD2-CB 3.77Å; V293-D297 HydrophobicContact CG1-CB 4.09Å; K294-D297 PolarHBondContact O-N 3.39Å; G295-D297 VanDerWaalsContact C-N 3.3Å; G295-D297 PolarHBondContact O-N 3.49Å; D297-R300 IonicContact OD1-CZ 3.38Å; D297-R300 IonicContact OD1-NE 3.29Å; D297-R300 IonicContact OD1-NH2 3.58Å; D297-R300 PolarHBondContact OD1-NH2 3.31Å; D297-F301 VanDerWaalsContact O-CB 3.27Å; D297-F301 WeakPolarHBondContact O-CB 3.46Å; D297-F301 PolarHBondContact O-N 2.95Å
298	R	88.7	Confident	88.6	Confident	57 Å²	57	48.9 Å²	48.9	22%	0.215	23%	0.231	C	C	.	.	H	α-helix	trans	-62.3	-46.8	173.1	-172.1	-180	-177.4	136.6	0.6	111.4	C288 D289 V293 G295 E296 F301 V302	C288-R298 HydrophobicContact CB-CG 4.06Å; D289-R298 IonicContact OD1-CZ 2.66Å; D289-R298 IonicContact OD1-NH1 2.63Å; D289-R298 PolarHBondContact OD1-NH1 3.19Å; D289-R298 IonicContact OD1-NH2 3.13Å; D289-R298 IonicContact OD2-CZ 2.69Å; D289-R298 VanDerWaalsContact OD2-CZ 3.3Å; D289-R298 IonicContact OD2-NH1 2.79Å; D289-R298 PolarHBondContact OD2-NH1 3.17Å; D289-R298 IonicContact OD2-NH2 3.79Å; D289-R298 PolarHBondContact OD2-NH2 3.12Å; V293-R298 HydrophobicContact CG1-CB 4.24Å; G295-R298 PolarHBondContact O-N 3.5Å; E296-R298 VanDerWaalsContact C-N 3.33Å; E296-R298 PolarHBondContact O-N 2.94Å; R298-F301 PolarHBondContact O-N 3.41Å; R298-V302 HydrophobicContact CG-CG2 4.32Å; R298-V302 WeakPolarHBondContact O-CB 3.37Å; R298-V302 VanDerWaalsContact O-CG2 3.26Å; R298-V302 WeakPolarHBondContact O-CG2 3.14Å; R298-V302 PolarHBondContact O-N 2.95Å
299	R	86.2	Confident	88.6	Confident	165 Å²	165	52.2 Å²	52.2	62%	0.623	24%	0.244	S	C	*	.	H	α-helix	trans	-61.1	-48.1	179.6	-68.2	-161.1	-73.6	-148.8	1	111.5	G295 E296 R303	G295-R299 PolarHBondContact O-N 3.5Å; E296-R299 PolarHBondContact O-N 2.95Å; E296-R299 IonicContact OE2-CZ 3.83Å; E296-R299 IonicContact OE2-NE 2.95Å; E296-R299 PolarHBondContact OE2-NE 3Å; E296-R299 IonicContact OE2-NH2 3.38Å; E296-R299 PolarHBondContact OE2-NH2 3.28Å; R299-R303 VanDerWaalsContact O-CB 3.22Å; R299-R303 WeakPolarHBondContact O-CB 3.23Å; R299-R303 PolarHBondContact O-N 2.9Å
300	R	88.7	Confident	88.4	Confident	35 Å²	35	53.4 Å²	53.4	13%	0.132	24%	0.242	C	C	.	.	H	α-helix	trans	-63.9	-45.1	179.2	-69.5	-173.9	-63.6	161.5	-3.2	112.2	V252 N253 E296 D297 A304	V252-R300 HydrophobicContact CG1-CB 4.48Å; N253-R300 PolarHBondContact ND2-NH1 3.13Å; E296-R300 HydrophobicContact CG-CG 4.35Å; E296-R300 WeakPolarHBondContact O-CB 3.38Å; E296-R300 WeakPolarHBondContact O-CG 3.19Å; E296-R300 PolarHBondContact O-N 2.91Å; D297-R300 IonicContact OD1-CZ 3.38Å; D297-R300 IonicContact OD1-NE 3.29Å; D297-R300 IonicContact OD1-NH2 3.58Å; D297-R300 PolarHBondContact OD1-NH2 3.31Å; R300-A304 WeakPolarHBondContact O-CB 2.98Å; R300-A304 PolarHBondContact O-N 3.08Å
301	F	90.6	Very high	88.3	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.8	-51.2	179.2	-178.3	-112.9	0	0	0	112.8	L249 V252 L254 L266 L276 L284 D297 R298 R303 A304 A305	L249-F301 HydrophobicContact CD2-CD2 4.17Å; L249-F301 HydrophobicContact CD2-CE2 3.64Å; V252-F301 HydrophobicContact CG1-CB 4.32Å; V252-F301 HydrophobicContact CG1-CD2 4.41Å; L254-F301 HydrophobicContact CD1-CB 4.14Å; L254-F301 HydrophobicContact CD1-CD2 3.6Å; L254-F301 HydrophobicContact CD1-CE2 4.3Å; L254-F301 HydrophobicContact CD1-CG 4.06Å; L266-F301 HydrophobicContact CD1-CE1 4.36Å; L266-F301 HydrophobicContact CD1-CE2 4.19Å; L266-F301 HydrophobicContact CD1-CZ 4.1Å; L266-F301 HydrophobicContact CD2-CE1 4.13Å; L266-F301 HydrophobicContact CD2-CZ 4.05Å; L276-F301 HydrophobicContact CD1-CE1 4.41Å; L276-F301 HydrophobicContact CD1-CE2 4.49Å; L276-F301 HydrophobicContact CD1-CZ 3.75Å; L276-F301 HydrophobicContact CD2-CE2 4.26Å; L276-F301 HydrophobicContact CD2-CZ 4.29Å; L284-F301 HydrophobicContact CD1-CD1 4.37Å; L284-F301 HydrophobicContact CD1-CE1 3.68Å; L284-F301 HydrophobicContact CD1-CZ 4.32Å; D297-F301 VanDerWaalsContact O-CB 3.27Å; D297-F301 WeakPolarHBondContact O-CB 3.46Å; D297-F301 PolarHBondContact O-N 2.95Å; R298-F301 PolarHBondContact O-N 3.41Å; F301-R303 PolarHBondContact O-N 2.91Å; F301-A304 PolarHBondContact O-N 3.09Å; F301-A305 WeakPolarHBondContact O-CB 3.36Å; F301-A305 PolarHBondContact O-N 3.42Å
302	V	91.4	Very high	88.1	Confident	8 Å²	8	46.8 Å²	46.8	5%	0.048	22%	0.217	C	C	.	.	H	α-helix	trans	-61.2	-47	-179.9	172.6	0	0	0	0	110.7	L284 F285 R298 A304 A305 Q306	L284-V302 HydrophobicContact CD2-CB 4.44Å; L284-V302 HydrophobicContact CD2-CG1 4.15Å; L284-V302 HydrophobicContact CD2-CG2 4.34Å; L284-V302 HydrophobicContact CG-CG2 4.29Å; F285-V302 HydrophobicContact CD1-CG2 3.95Å; F285-V302 HydrophobicContact CE1-CB 4.32Å; F285-V302 HydrophobicContact CE1-CG1 3.9Å; F285-V302 HydrophobicContact CE1-CG2 3.78Å; F285-V302 HydrophobicContact CZ-CG1 4.01Å; R298-V302 HydrophobicContact CG-CG2 4.32Å; R298-V302 WeakPolarHBondContact O-CB 3.37Å; R298-V302 VanDerWaalsContact O-CG2 3.26Å; R298-V302 WeakPolarHBondContact O-CG2 3.14Å; R298-V302 PolarHBondContact O-N 2.95Å; V302-A304 PolarHBondContact O-N 3.24Å; V302-A305 PolarHBondContact O-N 3.49Å; V302-Q306 HydrophobicContact CG1-CG 4.33Å; V302-Q306 WeakPolarHBondContact O-CB 3.25Å; V302-Q306 VanDerWaalsContact O-CG 3.27Å; V302-Q306 WeakPolarHBondContact O-CG 3.48Å; V302-Q306 PolarHBondContact O-N 2.91Å
303	R	90.8	Very high	88	Confident	121 Å²	121	46.9 Å²	46.9	46%	0.457	22%	0.218	S	C	.	.	H	α-helix	trans	-64.5	-39.3	179.1	-172.3	62.3	174.3	-159	2.8	112.4	R299 F301 N307 W334	R299-R303 VanDerWaalsContact O-CB 3.22Å; R299-R303 WeakPolarHBondContact O-CB 3.23Å; R299-R303 PolarHBondContact O-N 2.9Å; F301-R303 PolarHBondContact O-N 2.91Å; R303-N307 WeakPolarHBondContact O-CB 3.39Å; R303-N307 PolarHBondContact O-N 3.04Å; R303-N307 PolarHBondContact O-ND2 3.48Å; R303-N307 PolarHBondContact O-OD1 2.88Å; R303-W334 HydrophobicContact CB-CB 4.04Å; R303-W334 HydrophobicContact CG-CB 4.07Å
304	A	91.9	Very high	87.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.5	-46.4	175.9	0	0	0	0	0	111.9	W248 V252 R300 F301 V302 N307 L308 W334	W248-A304 HydrophobicContact CH2-CB 4.49Å; W248-A304 HydrophobicContact CZ2-CB 3.9Å; V252-A304 HydrophobicContact CG1-CB 4.43Å; V252-A304 HydrophobicContact CG2-CB 3.63Å; R300-A304 WeakPolarHBondContact O-CB 2.98Å; R300-A304 PolarHBondContact O-N 3.08Å; F301-A304 PolarHBondContact O-N 3.09Å; V302-A304 PolarHBondContact O-N 3.24Å; A304-N307 PolarHBondContact O-N 3.39Å; A304-L308 WeakPolarHBondContact O-CB 3.44Å; A304-L308 PolarHBondContact O-N 3.49Å; A304-W334 HydrophobicContact CB-CB 3.97Å; A304-W334 HydrophobicContact CB-CD2 3.76Å; A304-W334 HydrophobicContact CB-CE3 3.86Å; A304-W334 HydrophobicContact CB-CG 3.83Å
305	A	92.1	Very high	87.1	Confident	3 Å²	3	44.5 Å²	44.5	3%	0.025	21%	0.207	C	C	.	.	H	α-helix	trans	-63.2	-43.8	177.8	0	0	0	0	0	111.8	L276 L284 F301 V302 L308 R309	L276-A305 HydrophobicContact CD1-CB 4.44Å; L284-A305 HydrophobicContact CD1-CB 4.37Å; L284-A305 HydrophobicContact CD2-CB 3.91Å; F301-A305 WeakPolarHBondContact O-CB 3.36Å; F301-A305 PolarHBondContact O-N 3.42Å; V302-A305 PolarHBondContact O-N 3.49Å; A305-L308 PolarHBondContact O-N 3.3Å; A305-R309 WeakPolarHBondContact O-CB 3.49Å; A305-R309 PolarHBondContact O-N 2.66Å
306	Q	90.9	Very high	86.4	Confident	51 Å²	51	46.2 Å²	46.2	24%	0.238	20%	0.202	C	C	.	.	H	α-helix	trans	-60.3	-47.2	174.9	-74.8	176	-26.3	0	0	112.4	D281 V302 L308 R309 W310	D281-Q306 PolarHBondContact OD1-NE2 3.48Å; D281-Q306 PolarHBondContact OD2-NE2 2.88Å; V302-Q306 HydrophobicContact CG1-CG 4.33Å; V302-Q306 WeakPolarHBondContact O-CB 3.25Å; V302-Q306 VanDerWaalsContact O-CG 3.27Å; V302-Q306 WeakPolarHBondContact O-CG 3.48Å; V302-Q306 PolarHBondContact O-N 2.91Å; Q306-L308 VanDerWaalsContact C-N 3.3Å; Q306-L308 PolarHBondContact O-N 3.46Å; Q306-R309 PolarHBondContact O-N 2.79Å; Q306-W310 WeakPolarHBondContact O-CB 3.5Å; Q306-W310 PolarHBondContact O-N 2.93Å
307	N	91.6	Very high	85.7	Confident	15 Å²	15	52 Å²	52	8%	0.08	23%	0.227	C	C	.	.	H	α-helix	trans	-62.8	-37.3	177.2	-69.2	-5.4	0	0	0	111.7	V217 R303 A304 Y311 L332 A333	V217-N307 HydrophobicContact CG1-CB 4.44Å; V217-N307 HydrophobicContact CG2-CB 4.39Å; R303-N307 WeakPolarHBondContact O-CB 3.39Å; R303-N307 PolarHBondContact O-N 3.04Å; R303-N307 PolarHBondContact O-ND2 3.48Å; R303-N307 PolarHBondContact O-OD1 2.88Å; A304-N307 PolarHBondContact O-N 3.39Å; N307-Y311 WeakPolarHBondContact O-CB 3.44Å; N307-Y311 PolarHBondContact O-N 3.49Å; N307-L332 HydrophobicContact CB-CD2 4.28Å; N307-L332 WeakPolarHBondContact ND2-CA 3.46Å; N307-L332 PolarHBondContact ND2-O 3.39Å; N307-A333 PolarHBondContact ND2-O 3.06Å
308	L	91.9	Very high	84.7	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-69.4	-43.4	175.6	-170.4	70.9	0	0	0	112	V217 V220 S221 L224 W248 V273 L277 A304 A305 Q306 W310 Y311 A312	V217-L308 HydrophobicContact CG1-CB 4.3Å; V217-L308 HydrophobicContact CG1-CD1 3.98Å; V220-L308 HydrophobicContact CB-CD1 3.97Å; V220-L308 HydrophobicContact CG1-CD1 3.84Å; V220-L308 HydrophobicContact CG1-CD2 4.08Å; S221-L308 WeakPolarHBondContact OG-CD1 3.25Å; L224-L308 HydrophobicContact CD1-CD2 4.33Å; L224-L308 HydrophobicContact CD1-CG 4.46Å; W248-L308 HydrophobicContact CD2-CD2 4.2Å; W248-L308 HydrophobicContact CE3-CD2 4.46Å; W248-L308 HydrophobicContact CH2-CB 4.06Å; W248-L308 HydrophobicContact CH2-CD1 4.11Å; W248-L308 HydrophobicContact CH2-CD2 4Å; W248-L308 HydrophobicContact CH2-CG 4.28Å; W248-L308 HydrophobicContact CZ2-CB 3.85Å; W248-L308 HydrophobicContact CZ2-CD2 3.7Å; W248-L308 HydrophobicContact CZ2-CG 4.24Å; W248-L308 HydrophobicContact CZ3-CD1 4.4Å; W248-L308 HydrophobicContact CZ3-CD2 4.37Å; V273-L308 HydrophobicContact CG1-CD2 3.7Å; L277-L308 HydrophobicContact CD1-CD2 4.35Å; L277-L308 HydrophobicContact CD1-CG 4.26Å; L277-L308 HydrophobicContact CD2-CB 4.17Å; L277-L308 HydrophobicContact CD2-CD2 4.04Å; L277-L308 HydrophobicContact CD2-CG 4.08Å; L277-L308 HydrophobicContact CG-CD2 4.47Å; A304-L308 WeakPolarHBondContact O-CB 3.44Å; A304-L308 PolarHBondContact O-N 3.49Å; A305-L308 PolarHBondContact O-N 3.3Å; Q306-L308 VanDerWaalsContact C-N 3.3Å; Q306-L308 PolarHBondContact O-N 3.46Å; L308-W310 VanDerWaalsContact C-N 3.34Å; L308-W310 PolarHBondContact O-N 3.47Å; L308-Y311 PolarHBondContact O-N 3.28Å; L308-A312 WeakPolarHBondContact O-CB 3.4Å; L308-A312 PolarHBondContact O-N 3.3Å
309	R	90.8	Very high	83.4	Confident	70 Å²	70	53.9 Å²	53.9	26%	0.264	25%	0.248	S	C	.	.	H	α-helix	trans	-59.4	-44.7	175.8	-161.2	174	67.5	-147.1	-8.6	111	L277 L279 D281 A305 Q306 S313	L277-R309 HydrophobicContact CD2-CB 3.84Å; L277-R309 HydrophobicContact CD2-CG 4.35Å; L277-R309 WeakPolarHBondContact O-CD 3.35Å; L279-R309 PolarHBondContact O-NH1 2.74Å; D281-R309 VanDerWaalsContact CG-NH2 3.31Å; D281-R309 IonicContact OD1-CZ 2.6Å; D281-R309 VanDerWaalsContact OD1-CZ 3.31Å; D281-R309 IonicContact OD1-NH1 2.76Å; D281-R309 PolarHBondContact OD1-NH1 3.32Å; D281-R309 IonicContact OD1-NH2 2.9Å; D281-R309 PolarHBondContact OD1-NH2 3.19Å; D281-R309 IonicContact OD2-NH2 3.03Å; D281-R309 PolarHBondContact OD2-NH2 3.14Å; A305-R309 WeakPolarHBondContact O-CB 3.49Å; A305-R309 PolarHBondContact O-N 2.66Å; Q306-R309 PolarHBondContact O-N 2.79Å; R309-S313 WeakPolarHBondContact O-CB 3.43Å; R309-S313 PolarHBondContact O-N 3.5Å; R309-S313 PolarHBondContact O-OG 2.79Å
310	W	86.9	Confident	82.2	Confident	110 Å²	110	47 Å²	47	42%	0.417	23%	0.228	S	C	.	.	H	α-helix	trans	-64.1	-49.2	175.9	-170.8	93.4	0	0	0	112.2	Q306 L308 S313 H314 P327 L332	Q306-W310 WeakPolarHBondContact O-CB 3.5Å; Q306-W310 PolarHBondContact O-N 2.93Å; L308-W310 VanDerWaalsContact C-N 3.34Å; L308-W310 PolarHBondContact O-N 3.47Å; W310-S313 PolarHBondContact O-OG 2.92Å; W310-H314 AromaticContact CD2-CE1 3.85Å; W310-H314 AromaticContact CD2-ND1 3.8Å; W310-H314 AromaticContact CE2-CE1 3.33Å; W310-H314 AromaticContact CE2-ND1 3.77Å; W310-H314 AromaticContact CZ2-CE1 3.52Å; W310-H314 AromaticContact CZ2-NE2 3.72Å; W310-H314 AromaticContact NE1-CE1 3.51Å; W310-H314 PolarHBondContact O-N 3.44Å; W310-H314 PolarHBondContact O-ND1 3.12Å; W310-P327 HydrophobicContact CH2-CG 3.96Å; W310-P327 HydrophobicContact CZ3-CG 3.63Å; W310-L332 HydrophobicContact CE3-CD2 4.44Å
311	Y	87.1	Confident	80.9	Confident	3 Å²	3	49.6 Å²	49.6	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-76.4	-32	-174.4	-160.6	-92.1	0	0	0	113.1	K218 N307 L308 W315 P323 E326 L332	K218-Y311 HydrophobicContact CB-CD1 4.44Å; K218-Y311 HydrophobicContact CB-CE1 3.8Å; K218-Y311 HydrophobicContact CD-CE1 4.46Å; K218-Y311 HydrophobicContact CD-CE2 4.22Å; K218-Y311 HydrophobicContact CG-CD1 4.2Å; K218-Y311 HydrophobicContact CG-CD2 4.43Å; K218-Y311 HydrophobicContact CG-CE1 3.64Å; K218-Y311 HydrophobicContact CG-CE2 3.93Å; N307-Y311 WeakPolarHBondContact O-CB 3.44Å; N307-Y311 PolarHBondContact O-N 3.49Å; L308-Y311 PolarHBondContact O-N 3.28Å; Y311-W315 AromaticContact CD1-CD1 3.78Å; Y311-W315 AromaticContact CE1-CD1 3.4Å; Y311-W315 AromaticContact CE1-NE1 3.16Å; Y311-W315 AromaticContact CZ-CD1 3.99Å; Y311-W315 AromaticContact CZ-NE1 3.54Å; Y311-W315 PolarHBondContact O-N 3.06Å; Y311-W315 PolarHBondContact OH-NE1 3.18Å; Y311-P323 HydrophobicContact CE2-CG 4.04Å; Y311-E326 HydrophobicContact CE2-CG 4.24Å; Y311-E326 PolarHBondContact OH-OE1 3.45Å; Y311-L332 HydrophobicContact CD2-CD1 3.77Å; Y311-L332 HydrophobicContact CD2-CD2 4.45Å; Y311-L332 HydrophobicContact CE2-CD1 4.12Å; Y311-L332 HydrophobicContact CG-CD1 4.39Å
312	A	86.7	Confident	79.6	Confident	4 Å²	4	55.2 Å²	55.2	3%	0.033	27%	0.273	C	S	.	.	H	α-helix	trans	-69.9	-44.3	175.8	0	0	0	0	0	112.5	S221 L224 L277 L308 H314 W315 M316	S221-A312 PolarHBondContact OG-N 3.5Å; L224-A312 HydrophobicContact CD1-CB 4.27Å; L277-A312 HydrophobicContact CD1-CB 3.92Å; L308-A312 WeakPolarHBondContact O-CB 3.4Å; L308-A312 PolarHBondContact O-N 3.3Å; A312-H314 VanDerWaalsContact C-N 3.32Å; A312-H314 PolarHBondContact O-N 2.88Å; A312-W315 WeakPolarHBondContact O-CB 3.45Å; A312-W315 PolarHBondContact O-N 3.43Å; A312-W315 VanDerWaalsContact O-N 3.07Å; A312-M316 PolarHBondContact O-N 2.98Å
313	S	84.1	Confident	78.3	Confident	60 Å²	60	55.3 Å²	55.3	42%	0.42	27%	0.274	S	S	.	.	H	α-helix	trans	-60.8	-40	176.5	52	0	0	0	0	112.2	R309 W310 W315 M316 F317	R309-S313 WeakPolarHBondContact O-CB 3.43Å; R309-S313 PolarHBondContact O-N 3.5Å; R309-S313 PolarHBondContact O-OG 2.79Å; W310-S313 PolarHBondContact O-OG 2.92Å; S313-W315 VanDerWaalsContact C-N 3.32Å; S313-W315 PolarHBondContact O-N 2.72Å; S313-M316 PolarHBondContact O-N 2.98Å; S313-F317 WeakPolarHBondContact O-CB 3.42Å; S313-F317 PolarHBondContact O-N 3.32Å
314	H	79.6	Confident	77	Confident	62 Å²	62	59.5 Å²	59.5	29%	0.287	30%	0.295	S	S	.	.	H	α-helix	trans	-64.2	-32.4	173.3	-77.5	77.3	0	0	0	113.4	W310 A312 N318 P323	W310-H314 AromaticContact CD2-CE1 3.85Å; W310-H314 AromaticContact CD2-ND1 3.8Å; W310-H314 AromaticContact CE2-CE1 3.33Å; W310-H314 AromaticContact CE2-ND1 3.77Å; W310-H314 AromaticContact CZ2-CE1 3.52Å; W310-H314 AromaticContact CZ2-NE2 3.72Å; W310-H314 AromaticContact NE1-CE1 3.51Å; W310-H314 PolarHBondContact O-N 3.44Å; W310-H314 PolarHBondContact O-ND1 3.12Å; A312-H314 VanDerWaalsContact C-N 3.32Å; A312-H314 PolarHBondContact O-N 2.88Å; H314-N318 WeakPolarHBondContact O-CB 3.31Å; H314-N318 PolarHBondContact O-N 3.42Å; H314-N318 PolarHBondContact O-ND2 2.99Å; H314-P323 HydrophobicContact CB-CG 4.09Å
315	W	71.7	Confident	75.8	Confident	19 Å²	19	67.9 Å²	67.9	7%	0.072	33%	0.334	C	S	.	.	H	α-helix	trans	-70.8	-41.2	174	-96.9	72.5	0	0	0	112.7	R222 F225 Y311 A312 S313 S319 G320 K322	R222-W315 HydrophobicContact CG-CH2 4.38Å; R222-W315 HydrophobicContact CG-CZ3 4.25Å; F225-W315 HydrophobicContact CB-CE3 4.1Å; F225-W315 AromaticContact CD1-CE3 3.67Å; F225-W315 HydrophobicContact CD1-CE3 3.67Å; F225-W315 AromaticContact CD1-CZ3 3.89Å; F225-W315 HydrophobicContact CD1-CZ3 3.89Å; F225-W315 HydrophobicContact CD2-CE3 4.37Å; F225-W315 HydrophobicContact CE1-CE3 4.18Å; F225-W315 HydrophobicContact CE1-CZ3 4.19Å; F225-W315 AromaticContact CG-CE3 3.77Å; F225-W315 HydrophobicContact CG-CE3 3.77Å; F225-W315 HydrophobicContact CG-CZ3 4.45Å; Y311-W315 AromaticContact CD1-CD1 3.78Å; Y311-W315 AromaticContact CE1-CD1 3.4Å; Y311-W315 AromaticContact CE1-NE1 3.16Å; Y311-W315 AromaticContact CZ-CD1 3.99Å; Y311-W315 AromaticContact CZ-NE1 3.54Å; Y311-W315 PolarHBondContact O-N 3.06Å; Y311-W315 PolarHBondContact OH-NE1 3.18Å; A312-W315 WeakPolarHBondContact O-CB 3.45Å; A312-W315 PolarHBondContact O-N 3.43Å; A312-W315 VanDerWaalsContact O-N 3.07Å; S313-W315 VanDerWaalsContact C-N 3.32Å; S313-W315 PolarHBondContact O-N 2.72Å; W315-S319 PolarHBondContact O-N 2.88Å; W315-G320 WeakPolarHBondContact CZ3-O 3.43Å; W315-G320 PolarHBondContact O-N 2.95Å; W315-K322 HydrophobicContact CZ2-CG 4.31Å
316	M	66.8	Low	74.8	Confident	91 Å²	91	70.9 Å²	70.9	45%	0.448	35%	0.348	S	S	.	.	H	α-helix	trans	-64.1	-51.2	175.7	-71.4	178.5	166.6	0	0	111.3	A312 S313 N318 S319	A312-M316 PolarHBondContact O-N 2.98Å; S313-M316 PolarHBondContact O-N 2.98Å; M316-N318 PolarHBondContact O-N 3.05Å; M316-S319 PolarHBondContact O-N 3.42Å
317	F	66.1	Low	74.1	Confident	180 Å²	180	69.7 Å²	69.7	79%	0.789	35%	0.345	S	S	*	.	H	α-helix	trans	-61.7	-41.3	-177.8	-165.6	-91.3	0	0	0	112.6	S313 S319	S313-F317 WeakPolarHBondContact O-CB 3.42Å; S313-F317 PolarHBondContact O-N 3.32Å; F317-S319 VanDerWaalsContact C-N 3.26Å; F317-S319 PolarHBondContact O-N 2.88Å
318	N	64.4	Low	73.5	Confident	41 Å²	41	72.7 Å²	72.7	22%	0.219	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	20.1	-179.2	-64.4	-68.8	0	0	0	113.8	H314 M316 G320 T321	H314-N318 WeakPolarHBondContact O-CB 3.31Å; H314-N318 PolarHBondContact O-N 3.42Å; H314-N318 PolarHBondContact O-ND2 2.99Å; M316-N318 PolarHBondContact O-N 3.05Å; N318-G320 PolarHBondContact O-N 3.28Å; N318-T321 WeakPolarHBondContact CB-OG1 3.38Å; N318-T321 PolarHBondContact O-N 3.49Å; N318-T321 PolarHBondContact O-OG1 3.35Å
319	S	61.2	Low	72.9	Confident	93 Å²	93	74.4 Å²	74.4	65%	0.65	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	26.5	176.3	-62.8	0	0	0	0	115.2	F225 W315 M316 F317	F225-S319 WeakPolarHBondContact CZ-O 3.5Å; W315-S319 PolarHBondContact O-N 2.88Å; M316-S319 PolarHBondContact O-N 3.42Å; F317-S319 VanDerWaalsContact C-N 3.26Å; F317-S319 PolarHBondContact O-N 2.88Å
320	G	60.8	Low	72.2	Confident	20 Å²	20	73.1 Å²	73.1	21%	0.206	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	7.3	-176.2	0	0	0	0	0	115.8	F225 W315 N318	F225-G320 VanDerWaalsContact CZ-N 3.32Å; W315-G320 WeakPolarHBondContact CZ3-O 3.43Å; W315-G320 PolarHBondContact O-N 2.95Å; N318-G320 PolarHBondContact O-N 3.28Å
321	T	61.6	Low	72	Confident	90 Å²	90	72.5 Å²	72.5	55%	0.552	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-79.2	147.8	161.3	61.8	0	0	0	0	109.7	N318	N318-T321 WeakPolarHBondContact CB-OG1 3.38Å; N318-T321 PolarHBondContact O-N 3.49Å; N318-T321 PolarHBondContact O-OG1 3.35Å
322	K	62.7	Low	71.9	Confident	119 Å²	119	72.7 Å²	72.7	52%	0.517	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-60.3	152.2	177.1	-80.8	166.4	163.1	-78.5	0	110.4	W315 K324 E326	W315-K322 HydrophobicContact CZ2-CG 4.31Å; K322-K324 PolarHBondContact O-N 3.21Å; K322-E326 WeakPolarHBondContact CD-OE2 3.36Å; K322-E326 IonicContact NZ-OE1 2.98Å; K322-E326 PolarHBondContact NZ-OE1 3.23Å; K322-E326 IonicContact NZ-OE2 2.65Å; K322-E326 PolarHBondContact NZ-OE2 3Å
323	P	65.1	Low	71.8	Confident	10 Å²	10	72.9 Å²	72.9	7%	0.065	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-51.4	139.3	168.3	-21.2	31	0	0	0	110.5	Y311 H314 E325	Y311-P323 HydrophobicContact CE2-CG 4.04Å; H314-P323 HydrophobicContact CB-CG 4.09Å; P323-E325 PolarHBondContact O-N 3.36Å
324	K	62.6	Low	71.9	Confident	208 Å²	208	70.2 Å²	70.2	90%	0.904	37%	0.367	S	S	*	.	S	Bend	trans	-57.9	-36.2	179.1	-70.6	-179.4	-179.9	174	0	111.9	K322	K322-K324 PolarHBondContact O-N 3.21Å
325	E	67.7	Low	71.5	Confident	176 Å²	176	67.9 Å²	67.9	82%	0.822	36%	0.356	S	S	*	.	S	Bend	trans	-116.6	97.3	168.6	-65.4	-178.7	172	0	0	107.2	P323	P323-E325 PolarHBondContact O-N 3.36Å
326	E	70.9	Confident	70.5	Confident	66 Å²	66	69 Å²	69	31%	0.308	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-85.4	117.6	179.9	-174.8	-176.4	164	0	0	109.3	K218 Y311 K322	K218-E326 WeakPolarHBondContact CD-OE1 3.34Å; K218-E326 WeakPolarHBondContact CE-OE1 3.23Å; K218-E326 IonicContact NZ-OE1 2.66Å; K218-E326 PolarHBondContact NZ-OE1 3.05Å; Y311-E326 HydrophobicContact CE2-CG 4.24Å; Y311-E326 PolarHBondContact OH-OE1 3.45Å; K322-E326 WeakPolarHBondContact CD-OE2 3.36Å; K322-E326 IonicContact NZ-OE1 2.98Å; K322-E326 PolarHBondContact NZ-OE1 3.23Å; K322-E326 IonicContact NZ-OE2 2.65Å; K322-E326 PolarHBondContact NZ-OE2 3Å
327	P	75.5	Confident	69.2	Low	27 Å²	27	70.3 Å²	70.3	18%	0.175	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-63.7	148.8	-176.4	23.7	-33.3	0	0	0	111.7	K218 W310 L332	K218-P327 PolarHBondContact NZ-O 2.96Å; W310-P327 HydrophobicContact CH2-CG 3.96Å; W310-P327 HydrophobicContact CZ3-CG 3.63Å; P327-L332 HydrophobicContact CG-CD1 4.07Å; P327-L332 HydrophobicContact CG-CD2 4.06Å; P327-L332 HydrophobicContact CG-CG 3.98Å
328	P	78.7	Confident	67.5	Low	77 Å²	77	68.5 Å²	68.5	50%	0.5	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-48.5	142.2	170.5	-27.8	34.6	0	0	0	112.1	A330 D331	P328-A330 PolarHBondContact O-N 2.96Å; P328-A330 VanDerWaalsContact O-N 3.09Å; P328-D331 VanDerWaalsContact CD-OD2 3.27Å; P328-D331 WeakPolarHBondContact CD-OD2 3.47Å; P328-D331 VanDerWaalsContact CG-OD2 3.29Å; P328-D331 WeakPolarHBondContact CG-OD2 3.12Å; P328-D331 PolarHBondContact O-N 3Å
329	D	80.2	Confident	65.7	Low	37 Å²	37	77.7 Å²	77.7	20%	0.198	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-26.5	179.1	-62.4	-29.8	0	0	0	112.1	K210 E211 G214 K215 K218 D331	K210-D329 VanDerWaalsContact O-O 3.11Å; E211-D329 HydrophobicContact CG-CB 4.18Å; E211-D329 WeakPolarHBondContact O-CB 3.44Å; G214-D329 VanDerWaalsContact CA-O 3.25Å; G214-D329 WeakPolarHBondContact CA-O 3.4Å; G214-D329 PolarHBondContact N-O 3.01Å; K215-D329 WeakPolarHBondContact CE-OD2 3.48Å; K215-D329 HydrophobicContact CG-CB 4.36Å; K215-D329 IonicContact NZ-OD2 3.04Å; K218-D329 WeakPolarHBondContact CD-OD1 3.35Å; K218-D329 WeakPolarHBondContact CE-OD1 3.43Å; K218-D329 IonicContact NZ-OD1 2.71Å; K218-D329 PolarHBondContact NZ-OD1 3.32Å; D329-D331 VanDerWaalsContact C-N 3.34Å
330	A	74.8	Confident	64	Low	43 Å²	43	82.9 Å²	82.9	36%	0.355	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-25.6	177	0	0	0	0	0	114.1	K210 P328 A333	K210-A330 HydrophobicContact CB-CB 4.19Å; P328-A330 PolarHBondContact O-N 2.96Å; P328-A330 VanDerWaalsContact O-N 3.09Å; A330-A333 VanDerWaalsContact O-CB 3.23Å; A330-A333 WeakPolarHBondContact O-CB 3.46Å; A330-A333 PolarHBondContact O-N 3.46Å
331	D	82.7	Confident	62.3	Low	97 Å²	97	89.7 Å²	89.7	52%	0.519	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-24.9	-174.4	-58.2	-9.9	0	0	0	111.2	P328 D329 A333	P328-D331 VanDerWaalsContact CD-OD2 3.27Å; P328-D331 WeakPolarHBondContact CD-OD2 3.47Å; P328-D331 VanDerWaalsContact CG-OD2 3.29Å; P328-D331 WeakPolarHBondContact CG-OD2 3.12Å; P328-D331 PolarHBondContact O-N 3Å; D329-D331 VanDerWaalsContact C-N 3.34Å; D331-A333 PolarHBondContact O-N 2.8Å
332	L	84.9	Confident	60.5	Low	7 Å²	7	96.8 Å²	96.8	4%	0.037	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	3.9	168.6	-67.4	175.2	0	0	0	113.5	V217 K218 N307 W310 Y311 P327	V217-L332 HydrophobicContact CG2-CB 4.42Å; V217-L332 WeakPolarHBondContact CG2-O 3.31Å; K218-L332 HydrophobicContact CD-CD1 4.29Å; K218-L332 HydrophobicContact CG-CD1 3.9Å; N307-L332 HydrophobicContact CB-CD2 4.28Å; N307-L332 WeakPolarHBondContact ND2-CA 3.46Å; N307-L332 PolarHBondContact ND2-O 3.39Å; W310-L332 HydrophobicContact CE3-CD2 4.44Å; Y311-L332 HydrophobicContact CD2-CD1 3.77Å; Y311-L332 HydrophobicContact CD2-CD2 4.45Å; Y311-L332 HydrophobicContact CE2-CD1 4.12Å; Y311-L332 HydrophobicContact CG-CD1 4.39Å; P327-L332 HydrophobicContact CG-CD1 4.07Å; P327-L332 HydrophobicContact CG-CD2 4.06Å; P327-L332 HydrophobicContact CG-CG 3.98Å
333	A	85.3	Confident	58.7	Low	8 Å²	8	96.4 Å²	96.4	7%	0.066	47%	0.473	C	S	.	.			trans	-70.9	159.9	173.8	0	0	0	0	0	112.4	K210 E213 N307 A330 D331	K210-A333 HydrophobicContact CB-CB 3.69Å; K210-A333 HydrophobicContact CG-CB 3.69Å; E213-A333 HydrophobicContact CB-CB 4.08Å; N307-A333 PolarHBondContact ND2-O 3.06Å; A330-A333 VanDerWaalsContact O-CB 3.23Å; A330-A333 WeakPolarHBondContact O-CB 3.46Å; A330-A333 PolarHBondContact O-N 3.46Å; D331-A333 PolarHBondContact O-N 2.8Å
334	W	85.7	Confident	56.8	Low	4 Å²	4	100.3 Å²	100.3	2%	0.015	50%	0.5	C	S	.	.	S	Bend	trans	-116.6	-10.9	177.1	57.5	84.4	0	0	0	113.8	E213 L216 V217 W248 I251 R303 A304 G336	E213-W334 HydrophobicContact CB-CD2 4.12Å; E213-W334 HydrophobicContact CB-CE3 3.84Å; E213-W334 HydrophobicContact CB-CH2 3.73Å; E213-W334 HydrophobicContact CB-CZ2 4.02Å; E213-W334 HydrophobicContact CB-CZ3 3.65Å; E213-W334 HydrophobicContact CG-CD2 4.18Å; E213-W334 HydrophobicContact CG-CE3 4.36Å; E213-W334 HydrophobicContact CG-CH2 3.81Å; E213-W334 HydrophobicContact CG-CZ2 3.6Å; E213-W334 HydrophobicContact CG-CZ3 4.19Å; E213-W334 WeakPolarHBondContact O-CZ3 3.27Å; E213-W334 PolarHBondContact OE2-N 2.63Å; L216-W334 HydrophobicContact CB-CH2 4.39Å; V217-W334 HydrophobicContact CG2-CE3 4.18Å; V217-W334 HydrophobicContact CG2-CZ3 3.73Å; W248-W334 HydrophobicContact CH2-CZ3 4.46Å; I251-W334 HydrophobicContact CG2-CH2 3.46Å; I251-W334 VanDerWaalsContact CG2-CH2 3.46Å; I251-W334 HydrophobicContact CG2-CZ2 3.71Å; I251-W334 WeakPolarHBondContact O-CZ2 3.44Å; R303-W334 HydrophobicContact CB-CB 4.04Å; R303-W334 HydrophobicContact CG-CB 4.07Å; A304-W334 HydrophobicContact CB-CB 3.97Å; A304-W334 HydrophobicContact CB-CD2 3.76Å; A304-W334 HydrophobicContact CB-CE3 3.86Å; A304-W334 HydrophobicContact CB-CG 3.83Å; W334-G336 PolarHBondContact O-N 3.48Å
335	I	72.3	Confident	55.2	Low	12 Å²	12	99.6 Å²	99.6	6%	0.062	50%	0.501	C	S	.	.			trans	-74.8	77.6	161.8	-61.9	176.3	0	0	0	109.5	L209 K210 E213 F337	L209-I335 HydrophobicContact CD1-CD1 4.38Å; K210-I335 WeakPolarHBondContact CE-O 3.44Å; E213-I335 WeakPolarHBondContact OE1-CD1 3.3Å; E213-I335 WeakPolarHBondContact OE1-CG1 3.48Å; E213-I335 WeakPolarHBondContact OE2-CG1 3.35Å; E213-I335 PolarHBondContact OE2-N 2.93Å; I335-F337 HydrophobicContact CG2-CD2 3.6Å; I335-F337 HydrophobicContact CG2-CE2 3.64Å; I335-F337 PolarHBondContact O-N 3.01Å
336	G	51.1	Low	53.2	Low	43 Å²	43	95.5 Å²	95.5	44%	0.443	50%	0.496	S	S	.	.			trans	-87.1	87.1	173.3	0	0	0	0	0	112	W334 D338	W334-G336 PolarHBondContact O-N 3.48Å; G336-D338 PolarHBondContact O-N 2.97Å
337	F	38.1	Very low	51.2	Low	118 Å²	118	96.9 Å²	96.9	52%	0.518	51%	0.514	S	S	.	.			trans	-75.1	57.3	169.2	-86.9	-70.3	0	0	0	112.4	F202 I335 R339	F202-F337 HydrophobicContact CD1-CE2 4.32Å; F202-F337 AromaticContact CE1-CE2 3.76Å; F202-F337 HydrophobicContact CE1-CE2 3.76Å; F202-F337 HydrophobicContact CZ-CE2 4.46Å; I335-F337 HydrophobicContact CG2-CD2 3.6Å; I335-F337 HydrophobicContact CG2-CE2 3.64Å; I335-F337 PolarHBondContact O-N 3.01Å; F337-R339 PolarHBondContact O-N 2.86Å; F337-R339 VanDerWaalsContact O-N 3.07Å
338	D	31.8	Very low	49	Very low	143 Å²	143	104.8 Å²	104.8	77%	0.765	55%	0.545	S	S	*	.			trans	-67.3	107.8	164.4	-76.4	-41.9	0	0	0	108.8	G336 F340	G336-D338 PolarHBondContact O-N 2.97Å; D338-F340 PolarHBondContact O-N 3.47Å
339	R	26.1	Very low	46.5	Very low	233 Å²	233	106.7 Å²	106.7	88%	0.879	56%	0.561	S	S	*	*			trans	-68.6	85.7	168.5	-75.6	-175.2	173.1	-166.7	-0.1	108.7	F337 E341	F337-R339 PolarHBondContact O-N 2.86Å; F337-R339 VanDerWaalsContact O-N 3.07Å; R339-E341 VanDerWaalsContact C-N 3.32Å; R339-E341 PolarHBondContact O-N 3.05Å
340	F	26.3	Very low	44.2	Very low	202 Å²	202	110.9 Å²	110.9	89%	0.886	59%	0.59	S	S	*	*			trans	-59.6	103.2	153.5	-109.1	-86	0	0	0	107.7	D338 R342	D338-F340 PolarHBondContact O-N 3.47Å; F340-R342 PolarHBondContact O-N 3.28Å
341	E	24.6	Very low	42	Very low	163 Å²	163	117.7 Å²	117.7	76%	0.762	61%	0.614	S	S	*	*			trans	-62.4	120.8	177.2	-65.2	-164.4	133.5	0	0	108.9	R339 C343	R339-E341 VanDerWaalsContact C-N 3.32Å; R339-E341 PolarHBondContact O-N 3.05Å; E341-C343 PolarHBondContact O-N 3.28Å
342	R	23.2	Very low	39.5	Very low	239 Å²	239	121.6 Å²	121.6	90%	0.902	63%	0.634	S	S	*	*			trans	-70.8	74.7	152	-72.3	-172.3	179.8	-174.5	-0.2	107.7	F340 S344	F340-R342 PolarHBondContact O-N 3.28Å; R342-S344 PolarHBondContact O-N 3.42Å
343	C	24.2	Very low	36.8	Very low	111 Å²	111	124.9 Å²	124.9	75%	0.75	67%	0.669	S	S	*	*			trans	-68.1	92.7	156.2	-167	0	0	0	0	106.2	E341	E341-C343 PolarHBondContact O-N 3.28Å
344	S	27	Very low	34.3	Very low	92 Å²	92	129.1 Å²	129.1	64%	0.643	71%	0.705	S	S	*	*			trans	-58.7	170.7	175.5	-61.3	0	0	0	0	111.2	R342	R342-S344 PolarHBondContact O-N 3.42Å
345	Q	27.1	Very low	31.9	Very low	194 Å²	194	133.5 Å²	133.5	91%	0.907	74%	0.736	S	S	*	*	S	Bend	trans	-48.3	153.3	165.3	-63.4	160.8	-25.7	0	0	111.8
346	A	27.4	Very low	30.1	Very low	89 Å²	89	142.6 Å²	142.6	74%	0.736	78%	0.778	S	S	*	*			trans	80.9	137.5	-176.8	0	0	0	0	0	115.9
347	S	27.2	Very low	29.1	Very low	96 Å²	96	143.8 Å²	143.8	67%	0.671	79%	0.79	S	S	*	*			cis	-169.8	157.4	-12.4	53.7	0	0	0	0	111.9
348	K	30.1	Very low	28.9	Very low	192 Å²	192	146.7 Å²	146.7	84%	0.835	81%	0.81	S	S	*	*			trans	55.2	96.6	156.3	-65.9	170.5	-178.6	179.1	0	116.9	P350	K348-P350 WeakPolarHBondContact O-CD 3.43Å
349	S	25.5	Very low	29	Very low	118 Å²	118	143.7 Å²	143.7	83%	0.825	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-62.5	128.6	151.5	-49.1	0	0	0	0	109.9
350	P	32.4	Very low	29.5	Very low	124 Å²	124	139 Å²	139	81%	0.805	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-68.1	143.2	161.5	-15.2	31	0	0	0	109.9	K348	K348-P350 WeakPolarHBondContact O-CD 3.43Å
351	Q	28.6	Very low	29.8	Very low	186 Å²	186	136.3 Å²	136.3	87%	0.869	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-72.4	152.7	173.5	-61.7	171	-49.4	0	0	111
352	L	30.9	Very low	30.4	Very low	179 Å²	179	133.3 Å²	133.3	94%	0.937	79%	0.794	S	S	*	*				-168.4	108.8	126.3	-105.1	162	0	0	0	113.4
353	G	28.6	Very low	31	Very low	76 Å²	76	126.4 Å²	126.4	78%	0.784	78%	0.782	S	S	*	*			trans	40.7	106.7	145.8	0	0	0	0	0	122.4
354	A	31.8	Very low	31.4	Very low	98 Å²	98	131.9 Å²	131.9	81%	0.81	79%	0.787	S	S	*	*				159	134	129.4	0	0	0	0	0	110
355	S	34.5	Very low	31.8	Very low	96 Å²	96	135 Å²	135	67%	0.671	80%	0.796	S	S	*	*			cis	166.3	122.3	-26.8	42.6	0	0	0	0	105.5
356	Q	35.1	Very low	32.7	Very low	203 Å²	203	131.2 Å²	131.2	95%	0.949	79%	0.788	S	S	*	*			trans	68.8	135.9	172.2	-50.6	169.6	3.9	0	0	116.1
357	G	31	Very low	33.1	Very low	67 Å²	67	131 Å²	131	69%	0.691	79%	0.786	S	S	*	*			cis	167.8	167.8	-11.4	0	0	0	0	0	113.9
358	L	32.8	Very low	33.6	Very low	180 Å²	180	134.6 Å²	134.6	94%	0.942	80%	0.798	S	S	*	*			trans	71	148.3	165.3	-52.3	173.9	0	0	0	117.5
359	A	34.9	Very low	33.9	Very low	79 Å²	79	129.3 Å²	129.3	65%	0.653	80%	0.798	S	S	*	*			cis	-168.7	170.7	-21.6	0	0	0	0	0	111
360	V	35.5	Very low	34.5	Very low	135 Å²	135	126.7 Å²	126.7	82%	0.818	79%	0.79	S	S	*	*			trans	69.5	121.8	167.3	-165.8	0	0	0	0	115.4
361	D	33.9	Very low	34.7	Very low	145 Å²	145	126.3 Å²	126.3	78%	0.775	79%	0.79	S	S	*	*			cis	101.2	133.2	18.8	-166.8	27.9	0	0	0	115.8
362	S	36.1	Very low	35.2	Very low	101 Å²	101	123.6 Å²	123.6	71%	0.706	78%	0.782	S	S	*	*			trans	155.1	76.6	156.5	-71.9	0	0	0	0	116.3
363	S	36.1	Very low	35.6	Very low	93 Å²	93	123.4 Å²	123.4	65%	0.65	78%	0.776	S	S	*	*				65	138.2	123.8	80.9	0	0	0	0	126.3
364	R	33.3	Very low	35.8	Very low	226 Å²	226	123.7 Å²	123.7	85%	0.853	78%	0.779	S	S	*	*			trans	75.8	129	149.5	-64.4	164.9	-171.7	-144.1	1.3	119.5
365	L	34.7	Very low	35.9	Very low	159 Å²	159	122.5 Å²	122.5	83%	0.832	78%	0.776	S	S	*	*			cis	78.6	150.7	34.3	-65.1	179.6	0	0	0	115.4
366	P	45.4	Very low	36.1	Very low	113 Å²	113	122.5 Å²	122.5	73%	0.734	78%	0.782	S	S	*	*			cis	-147	-172.7	-20.4	36.2	-14.5	0	0	0	117.1
367	A	37.5	Very low	36.2	Very low	85 Å²	85	119.9 Å²	119.9	70%	0.702	77%	0.774	S	S	*	*			trans	106.7	150.6	131.5	0	0	0	0	0	123
368	N	37.4	Very low	36.5	Very low	171 Å²	171	121.8 Å²	121.8	91%	0.914	78%	0.777	S	S	*	*			trans	62.9	135.6	176.1	-61.9	-7.3	0	0	0	117.4
369	G	36.6	Very low	36.5	Very low	82 Å²	82	116.3 Å²	116.3	85%	0.845	76%	0.764	S	S	*	*			cis	139.7	141.4	-3	0	0	0	0	0	110.8
370	G	36.7	Very low	36.4	Very low	63 Å²	63	117.3 Å²	117.3	65%	0.649	77%	0.772	S	S	*	*			cis	178.9	-173.7	-3.1	0	0	0	0	0	110.1
371	S	37.9	Very low	36.1	Very low	116 Å²	116	115.8 Å²	115.8	81%	0.811	77%	0.768	S	S	*	*			trans	61.8	147.1	171.6	46	0	0	0	0	117.9
372	D	39.4	Very low	36	Very low	129 Å²	129	116.1 Å²	116.1	69%	0.69	77%	0.77	S	S	*	*			cis	-156.7	174.8	-6.8	-123.2	-46.5	0	0	0	114.1
373	Q	37.4	Very low	35.8	Very low	175 Å²	175	116.3 Å²	116.3	82%	0.818	77%	0.771	S	S	*	*			trans	1.4	145.7	157	-63.3	149.3	64.6	0	0	119.4
374	G	34.4	Very low	35.6	Very low	82 Å²	82	115 Å²	115	85%	0.845	77%	0.771	S	S	*	*			cis	162.2	173.6	9.1	0	0	0	0	0	107.5
375	G	34	Very low	35.5	Very low	73 Å²	73	111 Å²	111	75%	0.753	77%	0.772	S	S	*	*			cis	175.4	178.9	-2	0	0	0	0	0	108.7
376	A	37.5	Very low	35.4	Very low	95 Å²	95	106.7 Å²	106.7	79%	0.785	77%	0.766	S	S	*	*			trans	67.6	146.7	171.3	0	0	0	0	0	117.5
377	D	37.6	Very low	34.9	Very low	148 Å²	148	105.9 Å²	105.9	79%	0.791	76%	0.763	S	S	*	*			cis	-155.3	177.5	-9.2	-130.3	-44.1	0	0	0	115
378	S	36.7	Very low	34.8	Very low	108 Å²	108	108.7 Å²	108.7	76%	0.755	77%	0.766	S	S	*	*			trans	-29.1	164.1	168	59.9	0	0	0	0	119.7
379	G	34.5	Very low	34.7	Very low	64 Å²	64	107.7 Å²	107.7	66%	0.66	76%	0.759	S	S	*	*			cis	-164.2	162.8	7.5	0	0	0	0	0	110.8
380	A	31.2	Very low	34.7	Very low	100 Å²	100	108 Å²	108	83%	0.826	75%	0.748	S	S	*	*				63.2	134	58.4	0	0	0	0	0	113.1
381	S	30.5	Very low	34.6	Very low	103 Å²	103	112.7 Å²	112.7	72%	0.72	75%	0.754	S	S	*	*			cis	154.7	117.9	-24.7	48.6	0	0	0	0	107
382	D	32	Very low	34.4	Very low	153 Å²	153	113.8 Å²	113.8	82%	0.818	75%	0.75	S	S	*	*			trans	-170.7	145.9	151.5	-99.6	-30.1	0	0	0	108.4
383	S	30.4	Very low	34.1	Very low	105 Å²	105	112.3 Å²	112.3	73%	0.734	75%	0.75	S	S	*	*			cis	94.3	157.6	25.8	113.6	0	0	0	0	115.6
384	G	33.3	Very low	33.9	Very low	64 Å²	64	111.7 Å²	111.7	66%	0.66	75%	0.752	S	S	*	*			trans	100.2	97.7	-161.2	0	0	0	0	0	112.3
385	V	30.9	Very low	33.8	Very low	142 Å²	142	113.2 Å²	113.2	86%	0.861	75%	0.747	S	S	*	*			cis	84.2	132.1	35.6	-173.1	0	0	0	0	113.6
386	G	33.2	Very low	33.5	Very low	69 Å²	69	115.5 Å²	115.5	71%	0.711	75%	0.746	S	S	*	*			trans	129.2	72.2	-173.5	0	0	0	0	0	112
387	S	34.3	Very low	33.2	Very low	96 Å²	96	117.6 Å²	117.6	67%	0.671	75%	0.749	S	S	*	*				75.2	110.1	54.2	-52.3	0	0	0	0	114.1
388	N	35.6	Very low	32.9	Very low	145 Å²	145	116 Å²	116	78%	0.775	75%	0.745	S	S	*	*			trans	164.6	118.8	144.2	-84.7	-14.9	0	0	0	110.5
389	I	34.4	Very low	32.9	Very low	149 Å²	149	115.8 Å²	115.8	76%	0.764	74%	0.74	S	S	*	*				76	124.2	94	-72.5	173.6	0	0	0	112.2
390	S	36.4	Very low	32.9	Very low	88 Å²	88	118.5 Å²	118.5	62%	0.615	75%	0.746	S	S	*	*			cis	-169.9	163.2	1.5	48.5	0	0	0	0	116
391	Q	35.7	Very low	32.9	Very low	163 Å²	163	118.8 Å²	118.8	76%	0.762	74%	0.743	S	S	*	*			trans	82.9	138.4	141.9	-85.4	170.9	17.3	0	0	123.9
392	N	33.5	Very low	33.2	Very low	138 Å²	138	119.5 Å²	119.5	74%	0.738	75%	0.748	S	S	*	*			trans	70.6	146.5	153.5	-54.5	-15.5	0	0	0	120.4
393	S	33.4	Very low	33.3	Very low	98 Å²	98	118.7 Å²	118.7	69%	0.685	75%	0.75	S	S	*	*			cis	-166.6	144	-24.3	-95.5	0	0	0	0	111.2
394	L	32.4	Very low	33.3	Very low	163 Å²	163	116.8 Å²	116.8	85%	0.853	75%	0.747	S	S	*	*			trans	7.7	164.9	149.3	-73	155.6	0	0	0	122.8
395	P	33.3	Very low	33.1	Very low	114 Å²	114	121.2 Å²	121.2	74%	0.74	76%	0.755	S	S	*	*			cis	-131.6	177.6	-1.9	36.2	-16.6	0	0	0	116.5
396	T	26.1	Very low	33	Very low	121 Å²	121	122.2 Å²	122.2	74%	0.742	75%	0.754	S	S	*	*			trans	-88.8	153.1	174.6	-55.2	0	0	0	0	112.9	T398	T396-T398 HydrophobicContact CG2-CG2 4.25Å
397	V	32.1	Very low	32.6	Very low	139 Å²	139	125.4 Å²	125.4	84%	0.842	75%	0.754	S	S	*	*			trans	-134.8	139.2	163.2	-178.9	0	0	0	0	111
398	T	30.3	Very low	32.4	Very low	115 Å²	115	127.4 Å²	127.4	71%	0.706	76%	0.763	S	S	*	*			trans	-149.3	-175.6	177.1	54.3	0	0	0	0	109.1	T396	T396-T398 HydrophobicContact CG2-CG2 4.25Å
399	P	38.7	Very low	32	Very low	102 Å²	102	127.2 Å²	127.2	66%	0.662	76%	0.762	S	S	*	*				-104.9	-161.6	-67.5	37	-22.2	0	0	0	110.6
400	P	33.3	Very low	31.7	Very low	121 Å²	121	125.8 Å²	125.8	79%	0.786	76%	0.762	S	S	*	*				-133	151.5	86.1	10	14	0	0	0	112.9
401	S	32.5	Very low	31.3	Very low	107 Å²	107	129.8 Å²	129.8	75%	0.748	78%	0.775	S	S	*	*				95.5	131.2	52.4	-56.8	0	0	0	0	114
402	S	35.3	Very low	30.8	Very low	118 Å²	118	125.8 Å²	125.8	83%	0.825	77%	0.77	S	S	*	*			trans	-86.1	175	-173.9	-47.5	0	0	0	0	113.4
403	P	33.7	Very low	30.5	Very low	135 Å²	135	130 Å²	130	88%	0.877	78%	0.777	S	S	*	*				-143.4	179.1	80.3	36.7	-18.7	0	0	0	113.5
404	G	31.8	Very low	30.1	Very low	65 Å²	65	131.2 Å²	131.2	67%	0.67	78%	0.776	S	S	*	*			cis	-167.5	143.1	-7.2	0	0	0	0	0	107.3
405	L	27.6	Very low	29.8	Very low	158 Å²	158	131.4 Å²	131.4	83%	0.827	78%	0.777	S	S	*	*				68.3	81.5	72.7	-73.4	-177.1	0	0	0	116.6
406	I	29.3	Very low	29.6	Very low	163 Å²	163	132.2 Å²	132.2	84%	0.836	78%	0.775	S	S	*	*			trans	-147.3	112.7	135.4	-55.4	-176	0	0	0	103.8
407	L	25.8	Very low	29.6	Very low	136 Å²	136	134 Å²	134	71%	0.712	78%	0.777	S	S	*	*			cis	69.7	84.5	48.2	-74.2	177.8	0	0	0	115.9
408	T	28.9	Very low	29.4	Very low	138 Å²	138	132 Å²	132	85%	0.847	78%	0.775	S	S	*	*			trans	-134.9	134.8	144.3	49.7	0	0	0	0	108.3
409	N	28.1	Very low	29.1	Very low	141 Å²	141	134.2 Å²	134.2	75%	0.754	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-67.9	156	-177.4	-83.1	-15.8	0	0	0	112.8
410	P	27.8	Very low	28.7	Very low	118 Å²	118	134.8 Å²	134.8	77%	0.766	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-67.9	139	158.1	32	-33.1	0	0	0	109.4
411	L	28	Very low	28.4	Very low	173 Å²	173	136.8 Å²	136.8	91%	0.906	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-101.6	127	158.2	-76.6	174.8	0	0	0	107.8
412	A	24.9	Very low	28.3	Very low	79 Å²	79	134.7 Å²	134.7	65%	0.653	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-70.7	153.4	171.7	0	0	0	0	0	110.2
413	Y	26.5	Very low	28	Very low	226 Å²	226	137.6 Å²	137.6	89%	0.886	79%	0.787	S	S	*	*			trans	-121.7	94.8	150.6	-116.1	-84.3	0	0	0	107.5
414	D	25.1	Very low	27.9	Very low	124 Å²	124	137.7 Å²	137.7	66%	0.663	78%	0.78	S	S	*	*			trans	-61.2	132.2	160.1	-75.9	-63.9	0	0	0	108.6
415	L	27.5	Very low	28	Very low	166 Å²	166	141.2 Å²	141.2	87%	0.869	78%	0.779	S	S	*	*			trans	-125.2	78.1	157.6	-95.7	170	0	0	0	108.1
416	N	29.2	Very low	28.3	Very low	131 Å²	131	139.9 Å²	139.9	70%	0.701	77%	0.772	S	S	*	*			trans	-63.1	148.7	169	-84.7	-60.4	0	0	0	110.8	A418	N416-A418 PolarHBondContact O-N 3.15Å
417	M	24.4	Very low	28.4	Very low	160 Å²	160	138.4 Å²	138.4	79%	0.788	76%	0.76	S	S	*	*			trans	-60.2	125.7	163	-78.7	-78.5	-176.6	0	0	110
418	A	28.2	Very low	28.6	Very low	95 Å²	95	139.1 Å²	139.1	79%	0.785	76%	0.764	S	S	*	*			trans	-147.3	117.1	168.6	0	0	0	0	0	110.4	N416	N416-A418 PolarHBondContact O-N 3.15Å
419	I	24.5	Very low	28.7	Very low	163 Å²	163	139.5 Å²	139.5	84%	0.836	76%	0.76	S	S	*	*			trans	-98.8	130.8	175.2	-61.7	167.6	0	0	0	108.2
420	S	30.5	Very low	28.8	Very low	113 Å²	113	139.9 Å²	139.9	79%	0.79	76%	0.761	S	S	*	*			trans	-161	162.1	160.7	52.2	0	0	0	0	111.5
421	N	27.2	Very low	28.8	Very low	164 Å²	164	139.4 Å²	139.4	88%	0.877	76%	0.761	S	S	*	*			trans	-109	162.2	-163.3	-57.2	-44.8	0	0	0	114
422	G	30.9	Very low	28.9	Very low	62 Å²	62	135 Å²	135	64%	0.639	76%	0.757	S	S	*	*			trans	159.3	98.7	167.9	0	0	0	0	0	109.4
423	Q	28.7	Very low	29.2	Very low	180 Å²	180	140.4 Å²	140.4	84%	0.841	77%	0.769	S	S	*	*				60.6	113	83.4	-67.5	-167.3	-112.6	0	0	111.3
424	D	32.2	Very low	29.2	Very low	137 Å²	137	134.6 Å²	134.6	73%	0.733	77%	0.767	S	S	*	*				-154.9	167.8	62.3	-85.5	-34	0	0	0	115.5
425	E	32.1	Very low	29.5	Very low	138 Å²	138	133.8 Å²	133.8	65%	0.645	78%	0.778	S	S	*	*			trans	18.8	135.6	142.9	-49.5	-75.9	69.2	0	0	118.5	K427	E425-K427 IonicContact OE1-NZ 3.73Å; E425-K427 PolarHBondContact OE1-NZ 3.48Å; E425-K427 IonicContact OE2-NZ 3.01Å; E425-K427 PolarHBondContact OE2-NZ 3.48Å
426	D	34.5	Very low	29.5	Very low	130 Å²	130	135 Å²	135	70%	0.695	78%	0.779	S	S	*	*			cis	-158.7	171.2	29.3	-103.2	-35.7	0	0	0	109
427	K	31	Very low	29.7	Very low	133 Å²	133	134.7 Å²	134.7	58%	0.578	78%	0.784	S	S	*	*			cis	-172.2	167.7	-36	-118.8	-172.3	-155.9	82.9	0	105.9	E425	E425-K427 IonicContact OE1-NZ 3.73Å; E425-K427 PolarHBondContact OE1-NZ 3.48Å; E425-K427 IonicContact OE2-NZ 3.01Å; E425-K427 PolarHBondContact OE2-NZ 3.48Å
428	L	31.6	Very low	30	Very low	151 Å²	151	132.1 Å²	132.1	79%	0.791	79%	0.788	S	S	*	*			trans	70.3	109.9	177.1	-51.4	170.7	0	0	0	114.2
429	L	29.3	Very low	29.9	Very low	146 Å²	146	132.9 Å²	132.9	76%	0.764	79%	0.788	S	S	*	*				69.9	134.4	50.7	-53.9	172.7	0	0	0	112.4
430	L	31.3	Very low	30.2	Very low	148 Å²	148	131.2 Å²	131.2	78%	0.775	79%	0.785	S	S	*	*			cis	-149.9	172	12.8	-122.9	154.2	0	0	0	112.5
431	S	27.6	Very low	30.1	Very low	109 Å²	109	132.3 Å²	132.3	76%	0.762	78%	0.781	S	S	*	*			trans	-62.8	152.9	-177.1	54.3	0	0	0	0	116.7
432	G	30.6	Very low	30.1	Very low	80 Å²	80	131.1 Å²	131.1	83%	0.825	77%	0.774	S	S	*	*			trans	-161.1	128.5	163.1	0	0	0	0	0	112.5
433	Q	29.7	Very low	30	Very low	193 Å²	193	136.7 Å²	136.7	90%	0.902	78%	0.781	S	S	*	*			trans	-93.4	144.3	-170.9	-66.2	167.3	-52.5	0	0	114.3
434	A	26.7	Very low	29.9	Very low	103 Å²	103	132.8 Å²	132.8	85%	0.851	77%	0.773	S	S	*	*			trans	66.5	-176.8	144.5	0	0	0	0	0	120.1
435	A	31.1	Very low	29.7	Very low	108 Å²	108	130.9 Å²	130.9	89%	0.893	77%	0.771	S	S	*	*			trans	86.2	146.1	-176.7	0	0	0	0	0	118
436	Q	28.4	Very low	29.5	Very low	192 Å²	192	129.4 Å²	129.4	90%	0.897	78%	0.775	S	S	*	*			trans	-100.6	174.6	-166.2	-105.5	-169.2	2.6	0	0	112.9
437	P	33.2	Very low	29.4	Very low	124 Å²	124	128.5 Å²	128.5	81%	0.805	78%	0.78	S	S	*	*			trans	-90.8	163.7	-155.9	36.4	-38.5	0	0	0	115.7
438	A	30.2	Very low	29.3	Very low	105 Å²	105	127 Å²	127	87%	0.868	79%	0.786	S	S	*	*			trans	-137.1	159.4	164	0	0	0	0	0	110.8
439	S	26.4	Very low	29.1	Very low	111 Å²	111	125.4 Å²	125.4	78%	0.776	79%	0.786	S	S	*	*			trans	-108.1	156.9	-176.4	54.2	0	0	0	0	112.7
440	V	31.1	Very low	29.1	Very low	128 Å²	128	123 Å²	123	78%	0.776	78%	0.782	S	S	*	*			trans	-175.6	119.7	148.2	139.2	0	0	0	0	106.2
441	L	27.7	Very low	28.9	Very low	136 Å²	136	122.3 Å²	122.3	71%	0.712	78%	0.783	S	S	*	*				86.8	132.1	59	-96.2	167.5	0	0	0	114.3
442	L	27.8	Very low	29.1	Very low	139 Å²	139	123.5 Å²	123.5	73%	0.728	79%	0.79	S	S	*	*			trans	72.9	147	166.7	-53.7	166.1	0	0	0	115.1
443	K	29.2	Very low	28.9	Very low	180 Å²	180	124 Å²	124	78%	0.783	79%	0.787	S	S	*	*			cis	-145.2	156.9	5.8	-125.1	151.4	-168.5	177.1	0	112.7
444	S	25.9	Very low	29.2	Very low	98 Å²	98	120.1 Å²	120.1	69%	0.685	78%	0.778	S	S	*	*			trans	-65.3	172.6	-176.4	54.1	0	0	0	0	118.3
445	S	27.5	Very low	29.5	Very low	97 Å²	97	121.3 Å²	121.3	68%	0.678	77%	0.77	S	S	*	*			trans	86.2	111.8	131.4	57.7	0	0	0	0	122.5
446	S	28	Very low	29.4	Very low	106 Å²	106	123.3 Å²	123.3	74%	0.741	77%	0.766	S	S	*	*				99.5	158.6	121.3	78.1	0	0	0	0	120.9
447	S	32.2	Very low	29.5	Very low	112 Å²	112	120.2 Å²	120.2	78%	0.783	76%	0.764	S	S	*	*			trans	67.1	155	-179.7	74.6	0	0	0	0	117.1
448	S	29.1	Very low	29.2	Very low	101 Å²	101	120.7 Å²	120.7	71%	0.706	76%	0.764	S	S	*	*				174.1	160.9	-53	49.4	0	0	0	0	108.1
449	C	28	Very low	29.2	Very low	118 Å²	118	120.7 Å²	120.7	80%	0.797	76%	0.756	S	S	*	*			trans	66.3	122	-174.3	-67.4	0	0	0	0	113.4
450	S	29.3	Very low	29.4	Very low	96 Å²	96	123.1 Å²	123.1	67%	0.671	75%	0.754	S	S	*	*			cis	94.4	133.2	37.5	75.4	0	0	0	0	113.9
451	T	28.2	Very low	29.2	Very low	132 Å²	132	124.3 Å²	124.3	81%	0.81	75%	0.753	S	S	*	*			trans	71.7	89.9	163.4	-41	0	0	0	0	116.7
452	C	30.1	Very low	29.2	Very low	134 Å²	134	125.1 Å²	125.1	91%	0.905	76%	0.757	S	S	*	*			trans	-167.6	114.7	141.3	-109.4	0	0	0	0	110.2
453	A	28.2	Very low	29.1	Very low	92 Å²	92	128.7 Å²	128.7	76%	0.76	76%	0.761	S	S	*	*			trans	-110.6	145.3	159.8	0	0	0	0	0	107.6
454	P	35	Very low	29.1	Very low	110 Å²	110	125.6 Å²	125.6	71%	0.714	76%	0.762	S	S	*	*				-146.5	151	109.7	37.4	-22.8	0	0	0	115.8
455	N	32.6	Very low	29.1	Very low	128 Å²	128	131.3 Å²	131.3	68%	0.684	77%	0.768	S	S	*	*			trans	49.4	143.5	140	-60.5	-2.5	0	0	0	123.8
456	D	28.7	Very low	29.3	Very low	150 Å²	150	131.8 Å²	131.8	80%	0.802	77%	0.772	S	S	*	*			trans	58.6	82.6	145.8	-62.5	-33.5	0	0	0	119.7
457	C	31.2	Very low	29.4	Very low	128 Å²	128	133.8 Å²	133.8	87%	0.865	77%	0.769	S	S	*	*			trans	-145.3	107.5	142.7	-145.5	0	0	0	0	111.5
458	V	26.6	Very low	29.2	Very low	133 Å²	133	135 Å²	135	81%	0.806	76%	0.762	S	S	*	*			trans	-115.1	129.3	177.8	174	0	0	0	0	109.9
459	P	31.3	Very low	29.2	Very low	105 Å²	105	135 Å²	135	68%	0.682	76%	0.762	S	S	*	*			trans	-113.8	125.6	154.5	-0.2	21.7	0	0	0	112.4
460	H	30.3	Very low	29.2	Very low	162 Å²	162	137.6 Å²	137.6	75%	0.75	77%	0.768	S	S	*	*			trans	27.9	110.5	148.2	-52.1	-78.8	0	0	0	118.3
461	M	25.4	Very low	29.3	Very low	153 Å²	153	140.4 Å²	140.4	75%	0.754	78%	0.775	S	S	*	*				48.9	88.4	54.7	-159.4	-163.5	76.7	0	0	114.8
462	I	28.7	Very low	29.4	Very low	154 Å²	154	140 Å²	140	79%	0.79	77%	0.774	S	S	*	*			trans	-115.8	103.3	150.7	-62	-177.2	0	0	0	109.4	S464	I462-S464 WeakPolarHBondContact CG2-OG 3.33Å
463	R	25.5	Very low	29.4	Very low	214 Å²	214	142.9 Å²	142.9	81%	0.808	77%	0.772	S	S	*	*			trans	-85.4	109.6	155.2	-87.5	176	160.9	173.7	-4.1	107.7	R465	R463-R465 VanDerWaalsContact C-N 3.32Å; R463-R465 PolarHBondContact O-N 2.94Å
464	S	29.2	Very low	29.6	Very low	115 Å²	115	148.8 Å²	148.8	80%	0.804	78%	0.78	S	S	*	*			trans	-91.9	70.5	161	-61.2	0	0	0	0	110.2	I462	I462-S464 WeakPolarHBondContact CG2-OG 3.33Å
465	R	26.4	Very low	29.3	Very low	218 Å²	218	150.2 Å²	150.2	82%	0.823	78%	0.78	S	S	*	*			trans	-78.4	166.7	144.7	-93.6	-171.7	170.8	-167.9	-2.6	107.6	R463	R463-R465 VanDerWaalsContact C-N 3.32Å; R463-R465 PolarHBondContact O-N 2.94Å
466	S	30.3	Very low	29.3	Very low	107 Å²	107	150.8 Å²	150.8	75%	0.748	79%	0.788	S	S	*	*			trans	78	137.9	169.7	-49.4	0	0	0	0	115.1
467	H	30.9	Very low	29.4	Very low	148 Å²	148	154.8 Å²	154.8	69%	0.685	79%	0.792	S	S	*	*			cis	-157.6	178.8	-14.9	-135.5	-140.3	0	0	0	112.2
468	E	28.2	Very low	29.5	Very low	137 Å²	137	152.4 Å²	152.4	64%	0.64	79%	0.789	S	S	*	*			trans	12.1	116.4	147.5	-70.6	171.4	152.7	0	0	118
469	S	28.3	Very low	29.7	Very low	101 Å²	101	156.3 Å²	156.3	71%	0.706	80%	0.795	S	S	*	*				66.2	77.1	73.3	81.1	0	0	0	0	115.1	L471	S469-L471 PolarHBondContact O-N 3.45Å; S469-L471 VanDerWaalsContact O-N 3.13Å
470	N	28	Very low	29.9	Very low	172 Å²	172	156.6 Å²	156.6	92%	0.92	80%	0.797	S	S	*	*			trans	-79.4	84.4	165.3	-81.2	-33	0	0	0	111.5
471	L	31.5	Very low	30.1	Very low	156 Å²	156	155.8 Å²	155.8	82%	0.817	80%	0.804	S	S	*	*			trans	-125.3	129.2	153.9	-86.8	170.3	0	0	0	107.7	S469 K473	S469-L471 PolarHBondContact O-N 3.45Å; S469-L471 VanDerWaalsContact O-N 3.13Å; L471-K473 PolarHBondContact O-N 3.26Å
472	P	31.8	Very low	30.5	Very low	123 Å²	123	153.4 Å²	153.4	80%	0.799	80%	0.8	S	S	*	*			trans	-69.5	131.9	-168.6	26.3	-34	0	0	0	112.3
473	K	29	Very low	30.8	Very low	195 Å²	195	154.1 Å²	154.1	85%	0.848	80%	0.803	S	S	*	*			trans	-66.1	133.8	175.8	-64.8	171.9	-179	170.9	0	110.2	L471	L471-K473 PolarHBondContact O-N 3.26Å
474	K	32.8	Very low	31.1	Very low	215 Å²	215	150.6 Å²	150.6	94%	0.935	80%	0.801	S	S	*	*			trans	-122.7	146.2	161.1	-134.9	179.5	-175.8	-175.1	0	109.7
475	I	28.8	Very low	31.6	Very low	141 Å²	141	149.9 Å²	149.9	72%	0.723	79%	0.793	S	S	*	*			trans	-116.1	116.6	-155.4	-59.5	165.3	0	0	0	111.8	R477	I475-R477 HydrophobicContact CG2-CG 4.37Å
476	V	33.2	Very low	31.8	Very low	140 Å²	140	147.3 Å²	147.3	85%	0.848	80%	0.795	S	S	*	*			trans	-149.1	112.8	152.4	-174.5	0	0	0	0	105.1
477	R	30.5	Very low	32	Very low	234 Å²	234	147.7 Å²	147.7	88%	0.883	79%	0.793	S	S	*	*				64.3	70.1	56.2	-75.1	-166	170.9	-172.7	-0.3	115.2	I475	I475-R477 HydrophobicContact CG2-CG 4.37Å
478	G	33.4	Very low	32.1	Very low	78 Å²	78	147.6 Å²	147.6	80%	0.804	80%	0.797	S	S	*	*			trans	-128.6	145.2	153.5	0	0	0	0	0	109.4
479	K	30.5	Very low	32.3	Very low	214 Å²	214	146 Å²	146	93%	0.93	80%	0.801	S	S	*	*			trans	-102.8	158	-171.3	-99.6	-170.9	174	-175.5	0	113.8
480	P	35.5	Very low	32.4	Very low	112 Å²	112	144.7 Å²	144.7	73%	0.727	80%	0.803	S	S	*	*			trans	-104.2	175.5	-175	41.7	-36.3	0	0	0	113.7
481	T	33.8	Very low	32.6	Very low	144 Å²	144	140.9 Å²	140.9	88%	0.883	80%	0.795	S	S	*	*			trans	-154.4	155.3	140.1	14.4	0	0	0	0	111.7
482	P	34.4	Very low	32.4	Very low	103 Å²	103	139.5 Å²	139.5	67%	0.669	79%	0.794	S	S	*	*			trans	-124.8	-179.2	-167	44.5	-32.1	0	0	0	115
483	I	34.7	Very low	32.4	Very low	170 Å²	170	141.7 Å²	141.7	87%	0.872	80%	0.795	S	S	*	*			trans	-159.3	153.3	144.2	-86.4	129.5	0	0	0	105.7
484	N	32.9	Very low	32.4	Very low	140 Å²	140	143.1 Å²	143.1	75%	0.749	80%	0.795	S	S	*	*			cis	-174.1	166	-49.9	-122.9	11.9	0	0	0	104.5
485	P	38.1	Very low	32.3	Very low	100 Å²	100	142.6 Å²	142.6	65%	0.649	79%	0.793	S	S	*	*			trans	-128	-175	-146.3	43	-30.1	0	0	0	115.8
486	L	31.3	Very low	32.4	Very low	164 Å²	164	140.8 Å²	140.8	86%	0.859	80%	0.799	S	S	*	*			trans	-136.7	112.2	146.4	-86.7	112.6	0	0	0	107.6
487	V	35.1	Very low	32.2	Very low	115 Å²	115	137.3 Å²	137.3	70%	0.697	79%	0.792	S	S	*	*				90.9	102.7	79.4	160.1	0	0	0	0	110.2
488	D	31.9	Very low	32.1	Very low	146 Å²	146	131.5 Å²	131.5	78%	0.781	78%	0.782	S	S	*	*				74.9	144	82	-109.7	-18	0	0	0	113.1
489	S	33.6	Very low	31.9	Very low	104 Å²	104	137.6 Å²	137.6	73%	0.727	78%	0.782	S	S	*	*			cis	-131.1	-178.9	14.8	-54.2	0	0	0	0	110.8
490	G	29.3	Very low	31.8	Very low	73 Å²	73	133 Å²	133	75%	0.753	77%	0.767	S	S	*	*			cis	82.2	136.8	31.2	0	0	0	0	0	111.2
491	A	32	Very low	31.4	Very low	91 Å²	91	134.6 Å²	134.6	75%	0.752	77%	0.769	S	S	*	*			cis	-160.7	150.1	0.7	0	0	0	0	0	109.9
492	V	28.1	Very low	31.1	Very low	128 Å²	128	131.8 Å²	131.8	78%	0.776	76%	0.756	S	S	*	*				82.2	148.1	107.4	164.6	0	0	0	0	117.6
493	M	31.5	Very low	30.8	Very low	168 Å²	168	134 Å²	134	83%	0.828	76%	0.761	S	S	*	*			trans	69.5	165.5	176.3	-74.6	-178.2	-156.7	0	0	117.9
494	R	29.1	Very low	30.5	Very low	225 Å²	225	131.8 Å²	131.8	85%	0.849	76%	0.755	S	S	*	*				-176.6	154.1	-53.2	-111.7	-178.8	-178	173.6	-0.5	108.2
495	K	31.1	Very low	30.4	Very low	204 Å²	204	131.4 Å²	131.4	89%	0.887	76%	0.763	S	S	*	*			trans	73.3	128.2	168.4	-74.6	-169.8	170.4	-170.9	0	120
496	A	30	Very low	30	Very low	103 Å²	103	129.8 Å²	129.8	85%	0.851	76%	0.764	S	S	*	*			trans	43.9	128.7	132.6	0	0	0	0	0	122.8
497	G	29.6	Very low	29.9	Very low	68 Å²	68	125.7 Å²	125.7	70%	0.701	76%	0.762	S	S	*	*				120.1	110.8	100.4	0	0	0	0	0	119.2
498	V	29.2	Very low	29.6	Very low	112 Å²	112	128.9 Å²	128.9	68%	0.679	77%	0.774	S	S	*	*				60.5	117.7	129.2	-178.8	0	0	0	0	119.6
499	Y	28.4	Very low	29.5	Very low	205 Å²	205	125.9 Å²	125.9	80%	0.804	78%	0.778	S	S	*	*			trans	69.2	163.7	156	-83	-137.8	0	0	0	117.5
500	L	27.6	Very low	29.4	Very low	117 Å²	117	124.5 Å²	124.5	61%	0.613	78%	0.779	S	S	*	*			cis	-176.1	146.8	-41.4	-134.4	171.1	0	0	0	105.6
501	N	27.4	Very low	29.6	Very low	146 Å²	146	126.2 Å²	126.2	78%	0.781	78%	0.78	S	S	*	*			trans	62.7	156.9	170.9	-72.8	-20.2	0	0	0	116.5
502	S	28	Very low	29.5	Very low	86 Å²	86	131.7 Å²	131.7	60%	0.601	79%	0.787	S	S	*	*			cis	-175.1	173.2	-22.2	-175	0	0	0	0	106.7
503	I	27.1	Very low	29.6	Very low	149 Å²	149	129.1 Å²	129.1	76%	0.764	79%	0.786	S	S	*	*			trans	70.9	146.9	169.1	-55.4	139	0	0	0	110
504	V	29.5	Very low	29.7	Very low	124 Å²	124	125.6 Å²	125.6	75%	0.752	78%	0.784	S	S	*	*			cis	-136.9	134.2	43.2	-161.4	0	0	0	0	114.5
505	S	29.4	Very low	29.7	Very low	131 Å²	131	121.4 Å²	121.4	92%	0.916	78%	0.778	S	S	*	*			trans	-154.2	56.8	143.4	-85.4	0	0	0	0	108.4
506	G	31	Very low	29.6	Very low	66 Å²	66	119.1 Å²	119.1	68%	0.68	78%	0.775	S	S	*	*			trans	-92.1	114.1	176.6	0	0	0	0	0	111
507	G	28.1	Very low	29.7	Very low	78 Å²	78	117.8 Å²	117.8	80%	0.804	77%	0.771	S	S	*	*			trans	-105.7	64.4	-176.3	0	0	0	0	0	114.2
508	L	28.8	Very low	29.7	Very low	183 Å²	183	119.3 Å²	119.3	96%	0.958	77%	0.771	S	S	*	*			trans	-138.1	114.4	168	-77.6	176.1	0	0	0	109.6
509	G	31.1	Very low	29.8	Very low	83 Å²	83	123.9 Å²	123.9	86%	0.856	78%	0.777	S	S	*	*			trans	-178.6	91.2	-177.3	0	0	0	0	0	111
510	G	31.1	Very low	30	Very low	74 Å²	74	117.6 Å²	117.6	76%	0.763	77%	0.768	S	S	*	*			trans	-88.5	153.5	179.7	0	0	0	0	0	113.2
511	S	32.3	Very low	30.3	Very low	110 Å²	110	120.7 Å²	120.7	77%	0.769	78%	0.776	S	S	*	*			trans	72.7	108.7	161.2	-62.2	0	0	0	0	120.1
512	K	31.9	Very low	30.6	Very low	206 Å²	206	118 Å²	118	90%	0.896	77%	0.769	S	S	*	*			trans	71.7	103.4	133.7	-58.7	176.7	-178.2	-179.2	0	119.6
513	G	30.1	Very low	30.8	Very low	74 Å²	74	123.2 Å²	123.2	76%	0.763	78%	0.781	S	S	*	*				116.5	128.8	95.3	0	0	0	0	0	118.7
514	A	31.7	Very low	31.1	Very low	94 Å²	94	120.8 Å²	120.8	78%	0.777	78%	0.777	S	S	*	*			trans	65.3	146.2	152.9	0	0	0	0	0	118.8
515	D	30.1	Very low	31.3	Very low	136 Å²	136	119.4 Å²	119.4	73%	0.727	77%	0.773	S	S	*	*			cis	-160.7	167.1	-20.3	-121.1	-38.1	0	0	0	113.2
516	L	29.8	Very low	31.4	Very low	157 Å²	157	118.7 Å²	118.7	82%	0.822	77%	0.766	S	S	*	*			trans	45.5	100.2	147.7	-66.1	165.1	0	0	0	122.6
517	G	30.3	Very low	31.4	Very low	74 Å²	74	121.6 Å²	121.6	76%	0.763	77%	0.766	S	S	*	*				78.8	177.5	125	0	0	0	0	0	120.2
518	S	30.9	Very low	31.6	Very low	100 Å²	100	126.5 Å²	126.5	70%	0.699	77%	0.765	S	S	*	*			cis	-175.6	178.5	-20.2	49.3	0	0	0	0	110.2
519	Y	30.5	Very low	31.8	Very low	208 Å²	208	126 Å²	126	82%	0.816	76%	0.758	S	S	*	*			trans	71.7	141.5	174	-76.7	-103.9	0	0	0	116.8
520	A	33.9	Very low	31.7	Very low	73 Å²	73	127.6 Å²	127.6	60%	0.603	75%	0.747	S	S	*	*			cis	-162	156.2	-9	0	0	0	0	0	114.7
521	K	33	Very low	31.9	Very low	182 Å²	182	129.3 Å²	129.3	79%	0.791	75%	0.747	S	S	*	*				46.8	146.8	129.7	-69.7	176.7	-178.6	172	0	121.6
522	S	33.5	Very low	32	Very low	89 Å²	89	131.4 Å²	131.4	62%	0.622	75%	0.75	S	S	*	*			cis	179.9	160.2	-4.8	51.8	0	0	0	0	115
523	K	33.3	Very low	32	Very low	196 Å²	196	125.1 Å²	125.1	85%	0.852	74%	0.744	S	S	*	*			trans	70.3	156.2	150	-75.6	168.7	178.8	-171.9	0	117.9
524	S	33.6	Very low	32.6	Very low	98 Å²	98	127.5 Å²	127.5	69%	0.685	75%	0.745	S	S	*	*			cis	-157.1	136.1	0.3	23.1	0	0	0	0	109.6
525	S	32.7	Very low	32.8	Very low	96 Å²	96	130.2 Å²	130.2	67%	0.671	75%	0.752	S	S	*	*				42.7	136.7	96	69.7	0	0	0	0	115.8
526	C	32	Very low	33	Very low	115 Å²	115	130.7 Å²	130.7	78%	0.777	76%	0.76	S	S	*	*			cis	-138.1	159.4	49.2	-59.9	0	0	0	0	112.1
527	L	30.7	Very low	33.2	Very low	128 Å²	128	126.1 Å²	126.1	67%	0.67	75%	0.752	S	S	*	*			cis	67.6	136	41.4	-56.9	174.3	0	0	0	113.1
528	F	31.5	Very low	33.5	Very low	181 Å²	181	128.8 Å²	128.8	79%	0.794	75%	0.753	S	S	*	*			cis	-120.5	-154.5	5.6	-77.6	-77.5	0	0	0	110.7
529	H	34.4	Very low	33.8	Very low	171 Å²	171	131.5 Å²	131.5	79%	0.792	76%	0.76	S	S	*	*			cis	-157.2	-179.3	10.8	-153.8	-90.1	0	0	0	111.8
530	N	29.5	Very low	34.4	Very low	117 Å²	117	127.1 Å²	127.1	63%	0.626	76%	0.757	S	S	*	*			trans	-140.1	164.6	-178.3	-175.3	23	0	0	0	111.7
531	S	35.1	Very low	34.5	Very low	111 Å²	111	128.8 Å²	128.8	78%	0.776	77%	0.77	S	S	*	*			trans	-168.7	144.5	161.5	-101.2	0	0	0	0	113.1
532	N	33.2	Very low	34.7	Very low	154 Å²	154	123.6 Å²	123.6	82%	0.824	77%	0.769	S	S	*	*			trans	-111	168.3	-174	-57.7	-45.2	0	0	0	113.3
533	G	32.3	Very low	34.9	Very low	74 Å²	74	125 Å²	125	76%	0.763	78%	0.778	S	S	*	*			trans	155.5	111.4	155.1	0	0	0	0	0	117.5
534	P	42.5	Very low	35.1	Very low	123 Å²	123	121.7 Å²	121.7	80%	0.799	78%	0.78	S	S	*	*			trans	-118	154.1	172.5	38.8	-28.7	0	0	0	114.6
535	T	36.7	Very low	35.1	Very low	151 Å²	151	122 Å²	122	93%	0.926	79%	0.789	S	S	*	*			trans	-157.4	170.4	164.7	21.6	0	0	0	0	113
536	T	32.9	Very low	35.2	Very low	146 Å²	146	122 Å²	122	90%	0.896	79%	0.794	S	S	*	*			trans	-120.3	158.9	-159.9	50.5	0	0	0	0	115.9
537	G	35.9	Very low	35.4	Very low	62 Å²	62	122.9 Å²	122.9	64%	0.639	80%	0.796	S	S	*	*			trans	162.7	114.5	159.1	0	0	0	0	0	111.1
538	T	35.8	Very low	35.6	Very low	129 Å²	129	121.7 Å²	121.7	79%	0.791	80%	0.798	S	S	*	*				70	101.5	66.7	63.7	0	0	0	0	115.1
539	D	37.7	Very low	36	Very low	157 Å²	157	118 Å²	118	84%	0.84	79%	0.793	S	S	*	*				179.2	163.6	107.7	-86.6	-16.9	0	0	0	114
540	P	41.8	Very low	35.9	Very low	117 Å²	117	117 Å²	117	76%	0.76	79%	0.793	S	S	*	*			trans	-133.4	177.3	-167	42.3	-25.4	0	0	0	118.1
541	A	36.4	Very low	36.1	Very low	107 Å²	107	117.5 Å²	117.5	88%	0.884	81%	0.806	S	S	*	*			trans	90.6	139.7	148.2	0	0	0	0	0	122.8
542	G	36.3	Very low	35.8	Very low	73 Å²	73	115.2 Å²	115.2	75%	0.753	80%	0.8	S	S	*	*			trans	117.5	144.1	159.5	0	0	0	0	0	116.5
543	S	38	Very low	35.5	Very low	118 Å²	118	113.3 Å²	113.3	83%	0.825	80%	0.797	S	S	*	*			cis	-171.1	163.3	-19.4	-110	0	0	0	0	112.6
544	S	37.4	Very low	35.4	Very low	127 Å²	127	118 Å²	118	89%	0.888	80%	0.799	S	S	*	*			trans	80.9	147.5	157.3	-57.9	0	0	0	0	121.7
545	A	33.8	Very low	34.7	Very low	106 Å²	106	117.1 Å²	117.1	88%	0.876	80%	0.796	S	S	*	*			trans	-143.3	170	-165.9	0	0	0	0	0	114.7
546	A	35.5	Very low	34.3	Very low	94 Å²	94	115.4 Å²	115.4	78%	0.777	79%	0.788	S	S	*	*			trans	-166.5	-174.5	168.3	0	0	0	0	0	111.8
547	V	35.3	Very low	34	Very low	135 Å²	135	113 Å²	113	82%	0.818	78%	0.778	S	S	*	*				178.1	136	-88.6	151.4	0	0	0	0	109.7
548	S	35.9	Very low	33.6	Very low	103 Å²	103	115.5 Å²	115.5	72%	0.72	78%	0.781	S	S	*	*			cis	-145.5	-83	-19.8	-84.3	0	0	0	0	115.1
549	P	40	Very low	33.1	Very low	104 Å²	104	113.6 Å²	113.6	68%	0.675	77%	0.773	S	S	*	*			trans	-139.4	170.8	-137.3	42.3	-22.6	0	0	0	120.8
550	D	31.5	Very low	32.5	Very low	150 Å²	150	111.4 Å²	111.4	80%	0.802	77%	0.765	S	S	*	*			trans	66	149.4	142.6	-71.5	-36.6	0	0	0	126.4
551	S	34.2	Very low	31.8	Very low	127 Å²	127	116.6 Å²	116.6	89%	0.888	77%	0.771	S	S	*	*			trans	70.9	154.2	162.9	73.6	0	0	0	0	119.4
552	G	29.6	Very low	31.9	Very low	63 Å²	63	115.6 Å²	115.6	65%	0.649	76%	0.763	S	S	*	*			cis	173.2	148.6	-10.1	0	0	0	0	0	113.7
553	C	26.9	Very low	31.5	Very low	114 Å²	114	117.9 Å²	117.9	77%	0.77	77%	0.765	S	S	*	*			trans	53.4	170	170.1	83.2	0	0	0	0	119
554	E	29.2	Very low	31	Very low	173 Å²	173	124.5 Å²	124.5	81%	0.808	77%	0.772	S	S	*	*			cis	-150.1	-167.1	-2.2	-151.7	122.6	-126.2	0	0	113.4
555	S	28.1	Very low	31	Very low	103 Å²	103	123.2 Å²	123.2	72%	0.72	76%	0.763	S	S	*	*			trans	-62.1	175.7	-175.5	71.3	0	0	0	0	116.5
556	C	27.7	Very low	30.7	Very low	115 Å²	115	124.2 Å²	124.2	78%	0.777	76%	0.76	S	S	*	*			cis	-159.1	173.2	29.4	-155.7	0	0	0	0	115.8
557	S	27.4	Very low	30.4	Very low	97 Å²	97	131.5 Å²	131.5	68%	0.678	77%	0.768	S	S	*	*			trans	-81.3	172.6	175.9	56.7	0	0	0	0	112.9
558	T	26.4	Very low	30.1	Very low	113 Å²	113	128.4 Å²	128.4	69%	0.693	76%	0.763	S	S	*	*				174.6	111.3	81.5	-63.2	0	0	0	0	107.9
559	S	25.9	Very low	29.6	Very low	89 Å²	89	131.4 Å²	131.4	62%	0.622	77%	0.771	S	S	*	*				84.8	130.1	85.7	111.9	0	0	0	0	117.4
560	T	25.5	Very low	29	Very low	112 Å²	112	132.9 Å²	132.9	69%	0.687	78%	0.778	S	S	*	*			trans	65.3	153	162.8	69.2	0	0	0	0	117.4
561	Y	27	Very low	28.9	Very low	225 Å²	225	137 Å²	137	88%	0.882	78%	0.782	S	S	*	*			cis	-132.9	172.4	13.8	-98.2	-88	0	0	0	112.9
562	A	37.3	Very low	28.8	Very low	87 Å²	87	136.9 Å²	136.9	72%	0.719	77%	0.769	S	S	*	*			trans	-128.9	160	170.5	0	0	0	0	0	111.3
563	P	29.2	Very low	29.2	Very low	120 Å²	120	140.9 Å²	140.9	78%	0.779	78%	0.775	S	S	*	*			trans	-138.2	111	151.9	34.6	-18.2	0	0	0	115.8
564	R	26.8	Very low	29.9	Very low	257 Å²	257	139.7 Å²	139.7	97%	0.97	76%	0.758	S	S	*	*			trans	59.5	158.8	130.1	-61.9	-174.9	176.8	-131.9	-3.4	121.5
565	S	37.2	Very low	31.1	Very low	100 Å²	100	135.9 Å²	135.9	70%	0.699	74%	0.743	S	S	*	*			trans	-117.5	164.3	-166.9	61.2	0	0	0	0	113.8
566	P	28.3	Very low	32.7	Very low	128 Å²	128	135 Å²	135	83%	0.831	73%	0.729	S	S	*	*			trans	-75.7	161.4	155.9	-10.6	28.6	0	0	0	112
567	R	29.2	Very low	35	Very low	247 Å²	247	134.9 Å²	134.9	93%	0.932	72%	0.721	S	S	*	*			trans	-111.6	150.1	174.4	-74.2	174.1	166.3	171.1	-7.2	111
568	G	27.8	Very low	37.6	Very low	70 Å²	70	132 Å²	132	72%	0.722	70%	0.697	S	S	*	*			trans	83.5	114.9	143.4	0	0	0	0	0	118.8
569	N	26.6	Very low	40.4	Very low	166 Å²	166	135.2 Å²	135.2	89%	0.888	70%	0.696	S	S	*	*				-163.6	155.4	112.6	-117.8	-52	0	0	0	112.7
570	V	27.7	Very low	43.4	Very low	135 Å²	135	132.6 Å²	132.6	82%	0.818	67%	0.674	S	S	*	*			trans	-83.7	120.9	176.7	176.7	0	0	0	0	109.7
571	R	28	Very low	46.3	Very low	236 Å²	236	131.1 Å²	131.1	89%	0.891	66%	0.664	S	S	*	*			trans	-162.8	133.7	164.6	-110.2	160.8	-168.2	-172.4	2.8	112.2
572	M	32.7	Very low	49	Very low	124 Å²	124	129.9 Å²	129.9	61%	0.611	66%	0.658	S	S	*	*			trans	-70.2	141.6	174.2	-69.4	179.2	169.7	0	0	111.9	I634 L638	M572-I634 HydrophobicContact CE-CG2 4.18Å; M572-L638 HydrophobicContact CE-CD1 3.55Å
573	L	38.4	Very low	50.9	Low	147 Å²	147	126.7 Å²	126.7	77%	0.77	63%	0.629	S	S	*	*			trans	-143	65	172.5	-100.3	167.1	0	0	0	112.5	N575	L573-N575 PolarHBondContact O-N 3.25Å
574	H	41.8	Very low	52.6	Low	90 Å²	90	131.8 Å²	131.8	42%	0.417	63%	0.632	S	S	.	*			trans	-77.9	67.2	171.8	-53.8	-35.5	0	0	0	111.5	I576 T623	H574-I576 VanDerWaalsContact C-N 3.26Å; H574-I576 PolarHBondContact O-N 3.15Å; H574-T623 VanDerWaalsContact O-CG2 3.27Å; H574-T623 WeakPolarHBondContact O-CG2 3.41Å
575	N	54.7	Low	54.4	Low	93 Å²	93	125.9 Å²	125.9	50%	0.497	61%	0.614	S	S	.	*			trans	-75.1	68.2	-171	-162.5	16.8	0	0	0	114.2	L573	L573-N575 PolarHBondContact O-N 3.25Å
576	I	61.8	Low	55.4	Low	83 Å²	83	126.1 Å²	126.1	43%	0.426	61%	0.613	S	S	.	*			trans	-88.5	98.7	173.6	-54.2	177	0	0	0	108.1	H574 P622 C624	H574-I576 VanDerWaalsContact C-N 3.26Å; H574-I576 PolarHBondContact O-N 3.15Å; I576-P622 CarbonylContact C-O 3.35Å; I576-C624 HydrophobicContact CG2-CB 4.21Å; I576-C624 WeakPolarHBondContact O-CA 3.37Å; I576-C624 WeakPolarHBondContact O-CB 3.25Å; I576-C624 PolarHBondContact O-N 3.04Å
577	N	75.6	Confident	56.8	Low	114 Å²	114	121.5 Å²	121.5	61%	0.61	58%	0.584	S	S	*	*			trans	-60.7	142.3	-179.1	-73	-42.3	0	0	0	113.3	R579 P622	N577-R579 PolarHBondContact O-N 2.99Å; N577-P622 WeakPolarHBondContact CA-O 3.47Å
578	H	81.9	Confident	58.7	Low	37 Å²	37	118.7 Å²	118.7	17%	0.171	58%	0.583	C	S	.	*			trans	-69.8	118.6	173.2	-78.4	-99.8	0	0	0	112.4	F580 C608 M610 C624	H578-F580 HydrophobicContact CB-CD2 3.76Å; H578-F580 HydrophobicContact CB-CE2 3.23Å; H578-F580 HydrophobicContact CB-CZ 3.73Å; H578-F580 AromaticContact CG-CE2 3.82Å; H578-F580 AromaticContact CG-CZ 3.85Å; H578-F580 AromaticContact ND1-CZ 3.66Å; H578-F580 PolarHBondContact O-N 2.96Å; H578-C608 PolarHBondContact CE1-SG 3.39Å; H578-C608 PolarHBondContact ND1-SG 3.25Å; H578-M610 VanDerWaalsContact CE1-CE 3.48Å; H578-M610 WeakPolarHBondContact CE1-CE 3.09Å; H578-C624 HydrophobicContact CB-CB 4.18Å; H578-C624 WeakPolarHBondContact NE2-CA 3.49Å
579	R	85.9	Confident	61.1	Low	179 Å²	179	116.7 Å²	116.7	68%	0.675	56%	0.558	S	S	*	*			trans	-91.5	89.5	173.7	-175	177.9	-173.6	170.6	5	111.2	N577 C605 S606	N577-R579 PolarHBondContact O-N 2.99Å; R579-C605 CarbonylContact O-C 3.34Å; R579-C605 WeakPolarHBondContact O-CA 3.11Å; R579-S606 WeakPolarHBondContact CB-OG 3.45Å; R579-S606 WeakPolarHBondContact CD-OG 3.33Å; R579-S606 WeakPolarHBondContact CG-OG 3.4Å; R579-S606 PolarHBondContact O-N 2.98Å; R579-S606 PolarHBondContact O-OG 2.65Å; R579-S606 VanDerWaalsContact O-OG 3.1Å
580	F	88.1	Confident	63.9	Low	34 Å²	34	114.5 Å²	114.5	15%	0.149	54%	0.543	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	144	179.3	-70.7	-74.4	0	0	0	113.7	H578 E603 C605 I612 K617 I620	H578-F580 HydrophobicContact CB-CD2 3.76Å; H578-F580 HydrophobicContact CB-CE2 3.23Å; H578-F580 HydrophobicContact CB-CZ 3.73Å; H578-F580 AromaticContact CG-CE2 3.82Å; H578-F580 AromaticContact CG-CZ 3.85Å; H578-F580 AromaticContact ND1-CZ 3.66Å; H578-F580 PolarHBondContact O-N 2.96Å; F580-E603 HydrophobicContact CB-CB 4.13Å; F580-E603 HydrophobicContact CB-CG 4.43Å; F580-E603 WeakPolarHBondContact CB-OE2 3.38Å; F580-E603 HydrophobicContact CD1-CB 4.09Å; F580-E603 HydrophobicContact CG-CB 4.4Å; F580-C605 HydrophobicContact CD1-CB 4.02Å; F580-C605 HydrophobicContact CE1-CB 3.85Å; F580-C605 HydrophobicContact CZ-CB 4.49Å; F580-I612 HydrophobicContact CD1-CD1 3.94Å; F580-I612 HydrophobicContact CD1-CG1 4.04Å; F580-I612 HydrophobicContact CD2-CD1 4.44Å; F580-I612 HydrophobicContact CE1-CD1 3.39Å; F580-I612 HydrophobicContact CE1-CG1 3.62Å; F580-I612 HydrophobicContact CE2-CD1 3.9Å; F580-I612 HydrophobicContact CG-CD1 4.44Å; F580-I612 HydrophobicContact CZ-CD1 3.36Å; F580-I612 HydrophobicContact CZ-CG1 4.12Å; F580-K617 HydrophobicContact CD2-CD 4.36Å; F580-K617 HydrophobicContact CD2-CG 4.32Å; F580-K617 HydrophobicContact CE2-CG 4.15Å; F580-I620 HydrophobicContact CZ-CD1 4.08Å
581	V	86.9	Confident	66.8	Low	82 Å²	82	108.2 Å²	108.2	50%	0.497	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	133.7	176.5	-175.3	0	0	0	0	109.1	E603 R604	V581-E603 CarbonylContact O-C 3.38Å; V581-E603 WeakPolarHBondContact O-CA 3.47Å; V581-R604 PolarHBondContact N-O 3.19Å; V581-R604 PolarHBondContact O-N 3.03Å
582	R	84.2	Confident	69.5	Low	199 Å²	199	102.4 Å²	102.4	75%	0.751	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.4	140.1	178.3	-73.8	-177.4	174.1	174.7	-2.1	111.9	W584 E603	R582-W584 PolarHBondContact O-N 2.94Å; R582-E603 HydrophobicContact CG-CG 4.09Å
583	M	75.9	Confident	71.9	Confident	20 Å²	20	98.9 Å²	98.9	10%	0.099	47%	0.473	C	S	.	.			trans	-89.2	103.3	175.7	-62.4	-163.8	-60.6	0	0	110.6	K585 L598 G602 R604 K611	M583-K585 PolarHBondContact O-N 3.2Å; M583-L598 HydrophobicContact CE-CB 4.2Å; M583-L598 HydrophobicContact CE-CD1 3.72Å; M583-G602 WeakPolarHBondContact CB-O 3.37Å; M583-G602 PolarHBondContact N-O 3Å; M583-R604 HydrophobicContact CG-CB 3.99Å; M583-R604 HydrophobicContact SD-CB 4.04Å; M583-R604 PolarHBondContact SD-NE 3.39Å; M583-R604 VanDerWaalsContact SD-NE 3.44Å; M583-R604 PolarHBondContact SD-NH2 2.87Å; M583-K611 HydrophobicContact SD-CD 4.38Å
584	W	64.6	Low	74.3	Confident	226 Å²	226	94.2 Å²	94.2	86%	0.856	45%	0.452	S	S	*	.	S	Bend	trans	-75.8	4.1	-178.9	63.2	-75.5	0	0	0	115.3	R582	R582-W584 PolarHBondContact O-N 2.94Å
585	K	65	Low	76.3	Confident	134 Å²	134	93.8 Å²	93.8	58%	0.583	46%	0.459	S	S	*	.	S	Bend	trans	-125.2	134.3	171.5	-64	-169.2	177	-169.4	0	108.5	M583 S587	M583-K585 PolarHBondContact O-N 3.2Å; K585-S587 PolarHBondContact O-N 2.87Å
586	P	58.8	Low	77.7	Confident	104 Å²	104	98.1 Å²	98.1	68%	0.675	47%	0.468	S	S	*	.			trans	-57.5	131.7	177.7	24.9	-33.8	0	0	0	109.4	L600	P586-L600 HydrophobicContact CB-CD2 4.14Å
587	S	57.7	Low	78.8	Confident	32 Å²	32	98.8 Å²	98.8	22%	0.224	48%	0.478	C	S	.	.			trans	-126.9	114.7	-173.8	-158.3	0	0	0	0	110.4	K585 S589	K585-S587 PolarHBondContact O-N 2.87Å; S587-S589 PolarHBondContact O-N 3.07Å; S587-S589 PolarHBondContact OG-OG 2.91Å
588	M	68.9	Low	79	Confident	187 Å²	187	93.4 Å²	93.4	92%	0.921	45%	0.449	S	S	*	.			trans	-61.8	-3.9	178	-67.8	-64.3	-75.5	0	0	114.2
589	S	77.1	Confident	78.7	Confident	28 Å²	28	93.6 Å²	93.6	20%	0.196	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-70.8	145.8	174.2	53.5	0	0	0	0	112.8	S587 L598 K611	S587-S589 PolarHBondContact O-N 3.07Å; S587-S589 PolarHBondContact OG-OG 2.91Å; S589-L598 WeakPolarHBondContact O-CB 3.47Å; S589-L598 WeakPolarHBondContact O-CD1 3.33Å; S589-L598 WeakPolarHBondContact O-CG 3.32Å; S589-L598 PolarHBondContact O-N 2.71Å; S589-K611 VanDerWaalsContact OG-CD 3.22Å; S589-K611 WeakPolarHBondContact OG-CD 3.4Å; S589-K611 PolarHBondContact OG-NZ 3.4Å
590	Q	86.1	Confident	78.1	Confident	121 Å²	121	91.9 Å²	91.9	57%	0.565	47%	0.465	S	S	*	.	B	Isolated β-bridge	trans	-76	156.3	176.4	-63.8	169.8	-15.2	0	0	112.6	H592 S595 L598	Q590-H592 PolarHBondContact O-ND1 3.4Å; Q590-S595 WeakPolarHBondContact CB-O 3.46Å; Q590-S595 WeakPolarHBondContact CG-O 3.36Å; Q590-L598 WeakPolarHBondContact O-CD1 3.41Å
591	C	88.6	Confident	77.4	Confident	2 Å²	2	94.7 Å²	94.7	1%	0.014	49%	0.485	C	S	.	.	P	Polyproline II helix	trans	-70.5	128.9	169.5	176.1	0	0	0	0	110.5	V593 C594 S595 R596 L598 K611 H613 C616	C591-V593 PolarHBondContact O-N 3.41Å; C591-C594 VanDerWaalsContact CB-SG 3.56Å; C591-C594 PolarHBondContact O-N 3.33Å; C591-S595 VanDerWaalsContact O-CA 3.31Å; C591-S595 WeakPolarHBondContact O-CA 3.09Å; C591-S595 PolarHBondContact O-N 3.31Å; C591-R596 WeakPolarHBondContact CB-O 3.42Å; C591-R596 PolarHBondContact N-O 2.92Å; C591-L598 HydrophobicContact CB-CD2 3.66Å; C591-L598 HydrophobicContact CB-CG 4.24Å; C591-K611 WeakPolarHBondContact CA-O 3.14Å; C591-H613 VanDerWaalsContact CB-CE1 3.45Å; C591-H613 WeakPolarHBondContact CB-CE1 3.5Å; C591-H613 WeakPolarHBondContact CB-ND1 3.33Å; C591-H613 PolarHBondContact SG-ND1 3.45Å; C591-C616 VanDerWaalsContact SG-SG 3.61Å
592	H	84.1	Confident	77.2	Confident	114 Å²	114	90.8 Å²	90.8	53%	0.528	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-1.4	-176.2	-64.3	40	0	0	0	113.8	Q590 M610 K611	Q590-H592 PolarHBondContact O-ND1 3.4Å; H592-M610 HydrophobicContact CB-CG 3.72Å; H592-M610 HydrophobicContact CB-SD 4.4Å; H592-K611 PolarHBondContact N-O 3.27Å; H592-K611 PolarHBondContact ND1-N 2.72Å; H592-K611 PolarHBondContact ND1-O 3.17Å
593	V	84	Confident	77.5	Confident	50 Å²	50	82.1 Å²	82.1	30%	0.303	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-32.6	-177.6	175.6	0	0	0	0	112.4	C591 I612 C616 K619 I620	C591-V593 PolarHBondContact O-N 3.41Å; V593-I612 HydrophobicContact CG2-CG2 3.88Å; V593-C616 HydrophobicContact CB-CB 3.94Å; V593-C616 HydrophobicContact CG1-CB 4.02Å; V593-C616 HydrophobicContact CG2-CB 4.31Å; V593-K619 HydrophobicContact CG1-CB 3.79Å; V593-K619 HydrophobicContact CG1-CD 4.25Å; V593-I620 HydrophobicContact CG2-CD1 4.03Å; V593-I620 HydrophobicContact CG2-CG1 3.82Å
594	C	88.8	Confident	78.1	Confident	49 Å²	49	86.1 Å²	86.1	33%	0.331	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.9	3.8	-174.2	72.9	0	0	0	0	114.4	C591 R596 C616	C591-C594 VanDerWaalsContact CB-SG 3.56Å; C591-C594 PolarHBondContact O-N 3.33Å; C594-R596 PolarHBondContact O-N 3.4Å; C594-C616 VanDerWaalsContact SG-SG 3.65Å
595	S	83.5	Confident	79.3	Confident	81 Å²	81	75.3 Å²	75.3	57%	0.566	40%	0.403	S	S	*	.			trans	56.7	-0.7	180	-52.8	0	0	0	0	116.9	Q590 C591	Q590-S595 WeakPolarHBondContact CB-O 3.46Å; Q590-S595 WeakPolarHBondContact CG-O 3.36Å; C591-S595 VanDerWaalsContact O-CA 3.31Å; C591-S595 WeakPolarHBondContact O-CA 3.09Å; C591-S595 PolarHBondContact O-N 3.31Å
596	R	84.7	Confident	80.1	Confident	185 Å²	185	71 Å²	71	70%	0.698	39%	0.389	S	S	*	.	S	Bend	trans	-74.9	151.4	175.4	-64.5	179.6	-177.7	-173.4	-1.2	111.5	C591 C594	C591-R596 WeakPolarHBondContact CB-O 3.42Å; C591-R596 PolarHBondContact N-O 2.92Å; C594-R596 PolarHBondContact O-N 3.4Å
597	P	84.9	Confident	81	Confident	97 Å²	97	70.9 Å²	70.9	63%	0.63	38%	0.383	S	S	*	.	B	Isolated β-bridge	trans	-56.4	143.7	176.4	-25.1	34.7	0	0	0	113.1	H613	P597-H613 PolarHBondContact O-CE1 2.8Å; P597-H613 PolarHBondContact O-NE2 2.96Å
598	L	80	Confident	82.1	Confident	1 Å²	1	71 Å²	71	1%	0.005	38%	0.383	C	S	.	.			trans	-80.6	-20.1	-174.3	-75.3	167.6	0	0	0	115.3	M583 S589 Q590 C591 T601 G602 K611 I612	M583-L598 HydrophobicContact CE-CB 4.2Å; M583-L598 HydrophobicContact CE-CD1 3.72Å; S589-L598 WeakPolarHBondContact O-CB 3.47Å; S589-L598 WeakPolarHBondContact O-CD1 3.33Å; S589-L598 WeakPolarHBondContact O-CG 3.32Å; S589-L598 PolarHBondContact O-N 2.71Å; Q590-L598 WeakPolarHBondContact O-CD1 3.41Å; C591-L598 HydrophobicContact CB-CD2 3.66Å; C591-L598 HydrophobicContact CB-CG 4.24Å; L598-T601 PolarHBondContact O-N 3.2Å; L598-G602 PolarHBondContact O-N 3.35Å; L598-K611 HydrophobicContact CD1-CB 3.42Å; L598-K611 VanDerWaalsContact CD1-CB 3.42Å; L598-K611 HydrophobicContact CD1-CD 4.05Å; L598-K611 HydrophobicContact CD1-CG 4.39Å; L598-I612 WeakPolarHBondContact CD2-O 3.36Å
599	G	75.2	Confident	82.8	Confident	41 Å²	41	68.3 Å²	68.3	42%	0.423	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	-137.8	178.1	0	0	0	0	0	113.4
600	L	72.6	Confident	83.2	Confident	142 Å²	142	69.1 Å²	69.1	74%	0.743	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-8.6	177.1	-63.3	172.9	0	0	0	113.5	P586	P586-L600 HydrophobicContact CB-CD2 4.14Å
601	T	73.7	Confident	83.3	Confident	93 Å²	93	65.5 Å²	65.5	57%	0.571	35%	0.35	S	S	*	.	S	Bend	trans	-105.8	17.1	-173.8	54.6	0	0	0	0	113.3	L598	L598-T601 PolarHBondContact O-N 3.2Å
602	G	83.7	Confident	83.4	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.01	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	127.3	179.2	0	0	0	0	0	113.8	M583 L598 I612	M583-G602 WeakPolarHBondContact CB-O 3.37Å; M583-G602 PolarHBondContact N-O 3Å; L598-G602 PolarHBondContact O-N 3.35Å; G602-I612 CarbonylContact C-O 3.58Å; G602-I612 WeakPolarHBondContact CA-O 3.44Å
603	E	89	Confident	83.7	Confident	16 Å²	16	61.4 Å²	61.4	8%	0.075	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	145.5	166.3	-80.5	175	-138.6	0	0	110.5	F580 V581 R582 K611 I612 S614 K617	F580-E603 HydrophobicContact CB-CB 4.13Å; F580-E603 HydrophobicContact CB-CG 4.43Å; F580-E603 WeakPolarHBondContact CB-OE2 3.38Å; F580-E603 HydrophobicContact CD1-CB 4.09Å; F580-E603 HydrophobicContact CG-CB 4.4Å; V581-E603 CarbonylContact O-C 3.38Å; V581-E603 WeakPolarHBondContact O-CA 3.47Å; R582-E603 HydrophobicContact CG-CG 4.09Å; E603-K611 CarbonylContact O-C 3.57Å; E603-K611 WeakPolarHBondContact O-CA 3.33Å; E603-I612 HydrophobicContact CB-CG1 4.19Å; E603-I612 PolarHBondContact N-O 3.38Å; E603-I612 PolarHBondContact O-N 3.49Å; E603-S614 WeakPolarHBondContact OE1-CB 3.36Å; E603-S614 PolarHBondContact OE1-OG 2.83Å; E603-K617 IonicContact OE1-NZ 2.92Å; E603-K617 IonicContact OE2-NZ 2.67Å; E603-K617 PolarHBondContact OE2-NZ 3.06Å
604	R	89.2	Confident	83.8	Confident	104 Å²	104	61.2 Å²	61.2	39%	0.392	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129.9	174.3	-173.8	-173.9	-54.9	-172.6	3.8	109.6	V581 M583 S606 K609 M610 K611	V581-R604 PolarHBondContact N-O 3.19Å; V581-R604 PolarHBondContact O-N 3.03Å; M583-R604 HydrophobicContact CG-CB 3.99Å; M583-R604 HydrophobicContact SD-CB 4.04Å; M583-R604 PolarHBondContact SD-NE 3.39Å; M583-R604 VanDerWaalsContact SD-NE 3.44Å; M583-R604 PolarHBondContact SD-NH2 2.87Å; R604-S606 PolarHBondContact O-N 2.97Å; R604-K609 WeakPolarHBondContact CG-O 3.49Å; R604-M610 WeakPolarHBondContact CA-O 3.48Å; R604-K611 HydrophobicContact CG-CG 4.13Å
605	C	89.2	Confident	83.7	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	127.7	171.4	-173	0	0	0	0	110.1	R579 F580 D607 C608 K609 M610 C624	R579-C605 CarbonylContact O-C 3.34Å; R579-C605 WeakPolarHBondContact O-CA 3.11Å; F580-C605 HydrophobicContact CD1-CB 4.02Å; F580-C605 HydrophobicContact CE1-CB 3.85Å; F580-C605 HydrophobicContact CZ-CB 4.49Å; C605-D607 PolarHBondContact O-N 2.95Å; C605-C608 VanDerWaalsContact CB-SG 3.51Å; C605-K609 VanDerWaalsContact O-CA 3.23Å; C605-K609 WeakPolarHBondContact O-CA 3.49Å; C605-K609 PolarHBondContact O-N 2.84Å; C605-K609 VanDerWaalsContact O-N 3.17Å; C605-M610 PolarHBondContact N-O 3.34Å; C605-C624 PolarHBondContact SG-SG 3.1Å
606	S	83.2	Confident	83.9	Confident	44 Å²	44	61.3 Å²	61.3	31%	0.308	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-28.4	178.7	45	0	0	0	0	112.7	R579 R604 K609	R579-S606 WeakPolarHBondContact CB-OG 3.45Å; R579-S606 WeakPolarHBondContact CD-OG 3.33Å; R579-S606 WeakPolarHBondContact CG-OG 3.4Å; R579-S606 PolarHBondContact O-N 2.98Å; R579-S606 PolarHBondContact O-OG 2.65Å; R579-S606 VanDerWaalsContact O-OG 3.1Å; R604-S606 PolarHBondContact O-N 2.97Å; S606-K609 PolarHBondContact O-NZ 3.05Å
607	D	76.3	Confident	83.8	Confident	100 Å²	100	56.9 Å²	56.9	54%	0.535	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-68.3	-168.7	-57	-87.1	0	0	0	110.7	C605 K609	C605-D607 PolarHBondContact O-N 2.95Å; D607-K609 VanDerWaalsContact C-N 3.28Å; D607-K609 PolarHBondContact O-N 3.17Å
608	C	80.6	Confident	83.6	Confident	35 Å²	35	60.8 Å²	60.8	24%	0.236	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-0.2	179.2	72.2	0	0	0	0	115.4	H578 C605 M610	H578-C608 PolarHBondContact CE1-SG 3.39Å; H578-C608 PolarHBondContact ND1-SG 3.25Å; C605-C608 VanDerWaalsContact CB-SG 3.51Å; C608-M610 PolarHBondContact O-N 3.07Å
609	K	85.3	Confident	83.5	Confident	131 Å²	131	68.7 Å²	68.7	57%	0.57	36%	0.358	S	S	*	.			trans	62.5	-5.8	178.8	-45.2	-53.2	178.4	-173.1	0	117.1	R604 C605 S606 D607 K611	R604-K609 WeakPolarHBondContact CG-O 3.49Å; C605-K609 VanDerWaalsContact O-CA 3.23Å; C605-K609 WeakPolarHBondContact O-CA 3.49Å; C605-K609 PolarHBondContact O-N 2.84Å; C605-K609 VanDerWaalsContact O-N 3.17Å; S606-K609 PolarHBondContact O-NZ 3.05Å; D607-K609 VanDerWaalsContact C-N 3.28Å; D607-K609 PolarHBondContact O-N 3.17Å; K609-K611 PolarHBondContact O-N 3.05Å
610	M	84.4	Confident	83.3	Confident	44 Å²	44	68.4 Å²	68.4	22%	0.217	35%	0.346	C	S	.	.			trans	-52	133.7	177.3	-165.5	161.1	83.7	0	0	111.8	H578 H592 R604 C605 C608 I612 I620	H578-M610 VanDerWaalsContact CE1-CE 3.48Å; H578-M610 WeakPolarHBondContact CE1-CE 3.09Å; H592-M610 HydrophobicContact CB-CG 3.72Å; H592-M610 HydrophobicContact CB-SD 4.4Å; R604-M610 WeakPolarHBondContact CA-O 3.48Å; C605-M610 PolarHBondContact N-O 3.34Å; C608-M610 PolarHBondContact O-N 3.07Å; M610-I612 HydrophobicContact CG-CG2 4.4Å; M610-I620 HydrophobicContact CE-CD1 3.95Å; M610-I620 HydrophobicContact CE-CG1 4.3Å; M610-I620 HydrophobicContact CE-CG2 3.5Å; M610-I620 VanDerWaalsContact CE-CG2 3.5Å
611	K	89.5	Confident	83.1	Confident	46 Å²	46	63.8 Å²	63.8	20%	0.2	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	129.5	-174.8	-48.4	174.3	-177.6	170.9	0	111.1	M583 S589 C591 H592 L598 E603 R604 K609	M583-K611 HydrophobicContact SD-CD 4.38Å; S589-K611 VanDerWaalsContact OG-CD 3.22Å; S589-K611 WeakPolarHBondContact OG-CD 3.4Å; S589-K611 PolarHBondContact OG-NZ 3.4Å; C591-K611 WeakPolarHBondContact CA-O 3.14Å; H592-K611 PolarHBondContact N-O 3.27Å; H592-K611 PolarHBondContact ND1-N 2.72Å; H592-K611 PolarHBondContact ND1-O 3.17Å; L598-K611 HydrophobicContact CD1-CB 3.42Å; L598-K611 VanDerWaalsContact CD1-CB 3.42Å; L598-K611 HydrophobicContact CD1-CD 4.05Å; L598-K611 HydrophobicContact CD1-CG 4.39Å; E603-K611 CarbonylContact O-C 3.57Å; E603-K611 WeakPolarHBondContact O-CA 3.33Å; R604-K611 HydrophobicContact CG-CG 4.13Å; K609-K611 PolarHBondContact O-N 3.05Å
612	I	89.8	Confident	82.7	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	159.9	-171.4	65.1	167.5	0	0	0	112.1	F580 V593 L598 G602 E603 M610 C616 K617 I620	F580-I612 HydrophobicContact CD1-CD1 3.94Å; F580-I612 HydrophobicContact CD1-CG1 4.04Å; F580-I612 HydrophobicContact CD2-CD1 4.44Å; F580-I612 HydrophobicContact CE1-CD1 3.39Å; F580-I612 HydrophobicContact CE1-CG1 3.62Å; F580-I612 HydrophobicContact CE2-CD1 3.9Å; F580-I612 HydrophobicContact CG-CD1 4.44Å; F580-I612 HydrophobicContact CZ-CD1 3.36Å; F580-I612 HydrophobicContact CZ-CG1 4.12Å; V593-I612 HydrophobicContact CG2-CG2 3.88Å; L598-I612 WeakPolarHBondContact CD2-O 3.36Å; G602-I612 CarbonylContact C-O 3.58Å; G602-I612 WeakPolarHBondContact CA-O 3.44Å; E603-I612 HydrophobicContact CB-CG1 4.19Å; E603-I612 PolarHBondContact N-O 3.38Å; E603-I612 PolarHBondContact O-N 3.49Å; M610-I612 HydrophobicContact CG-CG2 4.4Å; I612-C616 HydrophobicContact CB-CB 4.25Å; I612-K617 HydrophobicContact CD1-CB 3.86Å; I612-K617 HydrophobicContact CD1-CG 4.1Å; I612-I620 HydrophobicContact CD1-CD1 3.49Å; I612-I620 VanDerWaalsContact CD1-CD1 3.49Å; I612-I620 HydrophobicContact CG2-CD1 3.86Å
613	H	91.1	Very high	81.9	Confident	30 Å²	30	66.1 Å²	66.1	14%	0.139	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	152.7	158.9	-52.4	98.2	0	0	0	109.9	C591 P597 V615 C616	C591-H613 VanDerWaalsContact CB-CE1 3.45Å; C591-H613 WeakPolarHBondContact CB-CE1 3.5Å; C591-H613 WeakPolarHBondContact CB-ND1 3.33Å; C591-H613 PolarHBondContact SG-ND1 3.45Å; P597-H613 PolarHBondContact O-CE1 2.8Å; P597-H613 PolarHBondContact O-NE2 2.96Å; H613-V615 PolarHBondContact O-N 2.99Å; H613-C616 HydrophobicContact CB-CB 4.38Å; H613-C616 WeakPolarHBondContact O-CB 3.42Å; H613-C616 PolarHBondContact O-N 2.96Å
614	S	85.8	Confident	81	Confident	46 Å²	46	65.7 Å²	65.7	32%	0.322	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-54.4	-34.9	173	-52.5	0	0	0	0	112.9	E603 C616 K617	E603-S614 WeakPolarHBondContact OE1-CB 3.36Å; E603-S614 PolarHBondContact OE1-OG 2.83Å; S614-C616 VanDerWaalsContact C-N 3.31Å; S614-C616 PolarHBondContact O-N 3.24Å; S614-K617 WeakPolarHBondContact O-CB 3.42Å; S614-K617 PolarHBondContact O-N 3.26Å
615	V	85.8	Confident	79.3	Confident	119 Å²	119	62 Å²	62	72%	0.721	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-72.1	-21.8	176.5	-171.3	0	0	0	0	112.9	H613 K617	H613-V615 PolarHBondContact O-N 2.99Å; V615-K617 VanDerWaalsContact C-N 3.25Å; V615-K617 PolarHBondContact O-N 3.35Å
616	C	87.8	Confident	77.6	Confident	13 Å²	13	66.3 Å²	66.3	9%	0.088	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-82.5	-3.6	176.6	-70.4	0	0	0	0	113	C591 V593 C594 I612 H613 S614 E618 K619 I620	C591-C616 VanDerWaalsContact SG-SG 3.61Å; V593-C616 HydrophobicContact CB-CB 3.94Å; V593-C616 HydrophobicContact CG1-CB 4.02Å; V593-C616 HydrophobicContact CG2-CB 4.31Å; C594-C616 VanDerWaalsContact SG-SG 3.65Å; I612-C616 HydrophobicContact CB-CB 4.25Å; H613-C616 HydrophobicContact CB-CB 4.38Å; H613-C616 WeakPolarHBondContact O-CB 3.42Å; H613-C616 PolarHBondContact O-N 2.96Å; S614-C616 VanDerWaalsContact C-N 3.31Å; S614-C616 PolarHBondContact O-N 3.24Å; C616-E618 PolarHBondContact O-N 2.93Å; C616-K619 PolarHBondContact O-N 3.12Å; C616-I620 WeakPolarHBondContact O-CD1 3.45Å; C616-I620 WeakPolarHBondContact O-CG1 3.24Å
617	K	83.5	Confident	76.3	Confident	92 Å²	92	67.8 Å²	67.8	40%	0.4	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-67.6	-32.4	-172.3	-167.7	170.1	-174.4	160	0	114	F580 E603 I612 S614 V615 K619	F580-K617 HydrophobicContact CD2-CD 4.36Å; F580-K617 HydrophobicContact CD2-CG 4.32Å; F580-K617 HydrophobicContact CE2-CG 4.15Å; E603-K617 IonicContact OE1-NZ 2.92Å; E603-K617 IonicContact OE2-NZ 2.67Å; E603-K617 PolarHBondContact OE2-NZ 3.06Å; I612-K617 HydrophobicContact CD1-CB 3.86Å; I612-K617 HydrophobicContact CD1-CG 4.1Å; S614-K617 WeakPolarHBondContact O-CB 3.42Å; S614-K617 PolarHBondContact O-N 3.26Å; V615-K617 VanDerWaalsContact C-N 3.25Å; V615-K617 PolarHBondContact O-N 3.35Å; K617-K619 VanDerWaalsContact C-N 3.29Å; K617-K619 PolarHBondContact O-N 3.02Å
618	E	79.1	Confident	75	Confident	178 Å²	178	66.5 Å²	66.5	83%	0.832	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-74	-20.2	178.7	-65.8	165.8	-173.4	0	0	112.8	C616 I620	C616-E618 PolarHBondContact O-N 2.93Å; E618-I620 PolarHBondContact O-N 3.47Å
619	K	77.9	Confident	73.5	Confident	168 Å²	168	74.1 Å²	74.1	73%	0.73	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-88.4	22.3	-178.1	-58.8	-171.1	177.1	-168	0	113.1	V593 C616 K617	V593-K619 HydrophobicContact CG1-CB 3.79Å; V593-K619 HydrophobicContact CG1-CD 4.25Å; C616-K619 PolarHBondContact O-N 3.12Å; K617-K619 VanDerWaalsContact C-N 3.29Å; K617-K619 PolarHBondContact O-N 3.02Å
620	I	71.6	Confident	71.9	Confident	35 Å²	35	74.3 Å²	74.3	18%	0.179	40%	0.395	C	S	.	.	S	Bend	trans	-130.1	132.8	-169.7	-52.4	168.1	0	0	0	107.9	F580 V593 M610 I612 C616 E618	F580-I620 HydrophobicContact CZ-CD1 4.08Å; V593-I620 HydrophobicContact CG2-CD1 4.03Å; V593-I620 HydrophobicContact CG2-CG1 3.82Å; M610-I620 HydrophobicContact CE-CD1 3.95Å; M610-I620 HydrophobicContact CE-CG1 4.3Å; M610-I620 HydrophobicContact CE-CG2 3.5Å; M610-I620 VanDerWaalsContact CE-CG2 3.5Å; I612-I620 HydrophobicContact CD1-CD1 3.49Å; I612-I620 VanDerWaalsContact CD1-CD1 3.49Å; I612-I620 HydrophobicContact CG2-CD1 3.86Å; C616-I620 WeakPolarHBondContact O-CD1 3.45Å; C616-I620 WeakPolarHBondContact O-CG1 3.24Å; E618-I620 PolarHBondContact O-N 3.47Å
621	G	67.9	Low	70.4	Confident	44 Å²	44	77.2 Å²	77.2	45%	0.454	41%	0.409	S	S	.	.			trans	-59.5	153.1	172.5	0	0	0	0	0	111.6	T623	G621-T623 PolarHBondContact O-N 3.47Å
622	P	66.5	Low	68.9	Low	80 Å²	80	83 Å²	83	52%	0.519	43%	0.43	S	S	.	.	S	Bend	trans	-66.9	-7.2	-175.6	27.5	-35.2	0	0	0	114	I576 N577 C624	I576-P622 CarbonylContact C-O 3.35Å; N577-P622 WeakPolarHBondContact CA-O 3.47Å; P622-C624 PolarHBondContact O-N 3.42Å
623	T	66.7	Low	67.3	Low	64 Å²	64	86.9 Å²	86.9	39%	0.393	45%	0.448	S	S	.	.			trans	-98.6	92	-165.5	52.9	0	0	0	0	114	H574 G621 G625	H574-T623 VanDerWaalsContact O-CG2 3.27Å; H574-T623 WeakPolarHBondContact O-CG2 3.41Å; G621-T623 PolarHBondContact O-N 3.47Å; T623-G625 PolarHBondContact O-N 2.94Å
624	C	69.9	Low	65.5	Low	6 Å²	6	87.1 Å²	87.1	4%	0.041	45%	0.45	C	S	.	.			trans	-70.7	112.8	176.3	177.8	0	0	0	0	113.5	I576 H578 C605 P622	I576-C624 HydrophobicContact CG2-CB 4.21Å; I576-C624 WeakPolarHBondContact O-CA 3.37Å; I576-C624 WeakPolarHBondContact O-CB 3.25Å; I576-C624 PolarHBondContact O-N 3.04Å; H578-C624 HydrophobicContact CB-CB 4.18Å; H578-C624 WeakPolarHBondContact NE2-CA 3.49Å; C605-C624 PolarHBondContact SG-SG 3.1Å; P622-C624 PolarHBondContact O-N 3.42Å
625	G	53.2	Low	63.7	Low	26 Å²	26	92.3 Å²	92.3	27%	0.268	46%	0.463	S	S	.	.			trans	86.5	56.7	153.5	0	0	0	0	0	115.7	T623 T627	T623-G625 PolarHBondContact O-N 2.94Å; G625-T627 PolarHBondContact O-N 3.23Å
626	L	53.6	Low	62.4	Low	91 Å²	91	90.6 Å²	90.6	48%	0.476	45%	0.448	S	S	.	.			trans	-62.8	70.4	148.1	-73.4	171.2	0	0	0	109.8	M631 I634	L626-M631 HydrophobicContact CB-CE 4.01Å; L626-M631 WeakPolarHBondContact O-CE 3.36Å; L626-I634 HydrophobicContact CD2-CD1 3.45Å; L626-I634 VanDerWaalsContact CD2-CD1 3.45Å
627	T	57	Low	60.9	Low	75 Å²	75	96.4 Å²	96.4	46%	0.46	48%	0.477	S	S	.	.			trans	-59.9	151.2	172.1	61.1	0	0	0	0	109.5	G625 R629 R630 M631	G625-T627 PolarHBondContact O-N 3.23Å; T627-R629 CarbonylContact O-C 3.42Å; T627-R629 PolarHBondContact O-N 3.11Å; T627-R630 CarbonylContact O-C 3.56Å; T627-R630 WeakPolarHBondContact O-CA 3.49Å; T627-R630 PolarHBondContact O-N 2.9Å; T627-R630 PolarHBondContact OG1-N 3.22Å; T627-M631 WeakPolarHBondContact O-CB 3.27Å; T627-M631 PolarHBondContact O-N 3.09Å
628	A	49.2	Very low	58.9	Low	74 Å²	74	97.1 Å²	97.1	61%	0.612	49%	0.485	S	S	*	.	H	α-helix	trans	-51.9	-32.3	179.5	0	0	0	0	0	113.2	R632	A628-R632 WeakPolarHBondContact O-CB 3.26Å; A628-R632 PolarHBondContact O-N 3.42Å
629	R	49.1	Very low	57.5	Low	194 Å²	194	92.3 Å²	92.3	73%	0.732	47%	0.467	S	S	*	.	H	α-helix	trans	-67.1	-45	171.9	-176.4	176.7	-178.2	151.4	6.7	113.1	T627 M631 R632 Q633	T627-R629 CarbonylContact O-C 3.42Å; T627-R629 PolarHBondContact O-N 3.11Å; R629-M631 VanDerWaalsContact C-N 3.34Å; R629-R632 PolarHBondContact O-N 2.75Å; R629-Q633 WeakPolarHBondContact O-CG 3.5Å; R629-Q633 PolarHBondContact O-N 3.03Å
630	R	51.7	Low	56.1	Low	135 Å²	135	90.1 Å²	90.1	51%	0.509	46%	0.463	S	S	.	.	H	α-helix	trans	-69.3	-35.6	177.8	-149.7	73	176.2	-111.6	6.4	111.5	T627 Q633 I634	T627-R630 CarbonylContact O-C 3.56Å; T627-R630 WeakPolarHBondContact O-CA 3.49Å; T627-R630 PolarHBondContact O-N 2.9Å; T627-R630 PolarHBondContact OG1-N 3.22Å; R630-Q633 PolarHBondContact O-N 2.7Å; R630-I634 WeakPolarHBondContact O-CB 3.35Å; R630-I634 WeakPolarHBondContact O-CD1 3.49Å; R630-I634 VanDerWaalsContact O-CG1 3.27Å; R630-I634 WeakPolarHBondContact O-CG1 3.47Å; R630-I634 PolarHBondContact O-N 2.82Å
631	M	52.5	Low	54.5	Low	105 Å²	105	91.3 Å²	91.3	52%	0.517	48%	0.484	S	S	.	.	H	α-helix	trans	-65.9	-42	174.6	-158.4	-179.5	-66.4	0	0	110.9	L626 T627 R629 I634 Y635	L626-M631 HydrophobicContact CB-CE 4.01Å; L626-M631 WeakPolarHBondContact O-CE 3.36Å; T627-M631 WeakPolarHBondContact O-CB 3.27Å; T627-M631 PolarHBondContact O-N 3.09Å; R629-M631 VanDerWaalsContact C-N 3.34Å; M631-I634 PolarHBondContact O-N 3.02Å; M631-Y635 WeakPolarHBondContact O-CB 3.43Å; M631-Y635 PolarHBondContact O-N 3.49Å
632	R	57.4	Low	52.8	Low	169 Å²	169	94.3 Å²	94.3	64%	0.638	49%	0.489	S	S	*	.	H	α-helix	trans	-64.3	-41.8	172.3	-153.7	-177.7	-67.4	176.6	-4.9	112.3	A628 R629 I634 Y635 E636	A628-R632 WeakPolarHBondContact O-CB 3.26Å; A628-R632 PolarHBondContact O-N 3.42Å; R629-R632 PolarHBondContact O-N 2.75Å; R632-I634 VanDerWaalsContact C-N 3.33Å; R632-I634 PolarHBondContact O-N 3.27Å; R632-Y635 CarbonylContact O-C 3.59Å; R632-Y635 WeakPolarHBondContact O-CB 3.4Å; R632-Y635 PolarHBondContact O-N 2.95Å; R632-Y635 VanDerWaalsContact O-N 3.14Å; R632-E636 VanDerWaalsContact CG-OE1 3.32Å; R632-E636 WeakPolarHBondContact CG-OE1 3.39Å; R632-E636 WeakPolarHBondContact O-CB 3.37Å; R632-E636 WeakPolarHBondContact O-CG 3.38Å; R632-E636 PolarHBondContact O-N 2.84Å
633	Q	56.3	Low	51.3	Low	81 Å²	81	99.2 Å²	99.2	38%	0.379	51%	0.506	S	S	.	.	H	α-helix	trans	-64.1	-33.4	172.7	-72	-176.5	-58.4	0	0	113.8	R629 R630 E636 L637	R629-Q633 WeakPolarHBondContact O-CG 3.5Å; R629-Q633 PolarHBondContact O-N 3.03Å; R630-Q633 PolarHBondContact O-N 2.7Å; Q633-E636 WeakPolarHBondContact CA-OE2 3.47Å; Q633-L637 VanDerWaalsContact O-CB 3.32Å; Q633-L637 WeakPolarHBondContact O-CB 3.45Å; Q633-L637 WeakPolarHBondContact O-CD1 3.37Å; Q633-L637 WeakPolarHBondContact O-CG 3.26Å; Q633-L637 PolarHBondContact O-N 3.43Å
634	I	53.1	Low	49.7	Very low	34 Å²	34	105.7 Å²	105.7	17%	0.174	53%	0.531	C	S	.	.	H	α-helix	trans	-72	-35.4	173.3	-73	162.9	0	0	0	110.5	M572 L626 R630 M631 R632 L638	M572-I634 HydrophobicContact CE-CG2 4.18Å; L626-I634 HydrophobicContact CD2-CD1 3.45Å; L626-I634 VanDerWaalsContact CD2-CD1 3.45Å; R630-I634 WeakPolarHBondContact O-CB 3.35Å; R630-I634 WeakPolarHBondContact O-CD1 3.49Å; R630-I634 VanDerWaalsContact O-CG1 3.27Å; R630-I634 WeakPolarHBondContact O-CG1 3.47Å; R630-I634 PolarHBondContact O-N 2.82Å; M631-I634 PolarHBondContact O-N 3.02Å; R632-I634 VanDerWaalsContact C-N 3.33Å; R632-I634 PolarHBondContact O-N 3.27Å; I634-L638 HydrophobicContact CG2-CD1 3.6Å; I634-L638 HydrophobicContact CG2-CG 4.33Å; I634-L638 VanDerWaalsContact O-CB 3.26Å; I634-L638 WeakPolarHBondContact O-CB 3.48Å; I634-L638 WeakPolarHBondContact O-CG 3.43Å; I634-L638 PolarHBondContact O-N 3.39Å
635	Y	47.9	Very low	47.7	Very low	155 Å²	155	107.5 Å²	107.5	61%	0.608	55%	0.551	S	S	*	*	H	α-helix	trans	-66.6	-47.6	172.7	-162.6	-91.1	0	0	0	111.4	M631 R632 L637 L638 V639	M631-Y635 WeakPolarHBondContact O-CB 3.43Å; M631-Y635 PolarHBondContact O-N 3.49Å; R632-Y635 CarbonylContact O-C 3.59Å; R632-Y635 WeakPolarHBondContact O-CB 3.4Å; R632-Y635 PolarHBondContact O-N 2.95Å; R632-Y635 VanDerWaalsContact O-N 3.14Å; Y635-L637 VanDerWaalsContact C-N 3.33Å; Y635-L637 PolarHBondContact O-N 3.18Å; Y635-L638 PolarHBondContact O-N 3.45Å; Y635-V639 HydrophobicContact CD1-CB 4.15Å; Y635-V639 HydrophobicContact CD1-CG2 4.06Å; Y635-V639 HydrophobicContact CD2-CG2 3.95Å; Y635-V639 HydrophobicContact CE1-CB 4.07Å; Y635-V639 HydrophobicContact CE1-CG1 4.04Å; Y635-V639 HydrophobicContact CE1-CG2 4.03Å; Y635-V639 HydrophobicContact CE2-CG2 3.91Å; Y635-V639 HydrophobicContact CG-CG2 4.02Å; Y635-V639 WeakPolarHBondContact O-CA 3.48Å; Y635-V639 WeakPolarHBondContact O-CB 3.46Å; Y635-V639 WeakPolarHBondContact O-CG2 3.27Å; Y635-V639 PolarHBondContact O-N 2.85Å
636	E	57.7	Low	46.5	Very low	84 Å²	84	111.4 Å²	111.4	39%	0.393	57%	0.574	S	S	.	*	I	π-helix	trans	-53.2	-48.6	172.1	-70	152.6	-161.2	0	0	110.7	R632 Q633 L638 L640 G641	R632-E636 VanDerWaalsContact CG-OE1 3.32Å; R632-E636 WeakPolarHBondContact CG-OE1 3.39Å; R632-E636 WeakPolarHBondContact O-CB 3.37Å; R632-E636 WeakPolarHBondContact O-CG 3.38Å; R632-E636 PolarHBondContact O-N 2.84Å; Q633-E636 WeakPolarHBondContact CA-OE2 3.47Å; E636-L638 PolarHBondContact O-N 3.15Å; E636-L640 HydrophobicContact CG-CD1 4.32Å; E636-L640 WeakPolarHBondContact O-CA 3.45Å; E636-L640 WeakPolarHBondContact O-CB 3.49Å; E636-L640 PolarHBondContact O-N 3.24Å; E636-G641 PolarHBondContact O-N 3.03Å
637	L	56.9	Low	45.2	Very low	134 Å²	134	118.3 Å²	118.3	70%	0.702	59%	0.594	S	S	*	*	I	π-helix	trans	-72.2	-22.6	179.9	-73.1	168.5	0	0	0	115.5	Q633 Y635	Q633-L637 VanDerWaalsContact O-CB 3.32Å; Q633-L637 WeakPolarHBondContact O-CB 3.45Å; Q633-L637 WeakPolarHBondContact O-CD1 3.37Å; Q633-L637 WeakPolarHBondContact O-CG 3.26Å; Q633-L637 PolarHBondContact O-N 3.43Å; Y635-L637 VanDerWaalsContact C-N 3.33Å; Y635-L637 PolarHBondContact O-N 3.18Å
638	L	42.5	Very low	43.8	Very low	108 Å²	108	121.5 Å²	121.5	57%	0.565	61%	0.608	S	S	*	*	I	π-helix	trans	-104.8	-18.3	-178.2	-67.5	175.3	0	0	0	114.1	M572 I634 Y635 E636	M572-L638 HydrophobicContact CE-CD1 3.55Å; I634-L638 HydrophobicContact CG2-CD1 3.6Å; I634-L638 HydrophobicContact CG2-CG 4.33Å; I634-L638 VanDerWaalsContact O-CB 3.26Å; I634-L638 WeakPolarHBondContact O-CB 3.48Å; I634-L638 WeakPolarHBondContact O-CG 3.43Å; I634-L638 PolarHBondContact O-N 3.39Å; Y635-L638 PolarHBondContact O-N 3.45Å; E636-L638 PolarHBondContact O-N 3.15Å
639	V	48.9	Very low	42.7	Very low	76 Å²	76	123.6 Å²	123.6	46%	0.461	61%	0.613	S	S	.	*	I	π-helix	trans	-118.1	-32	-173.8	-173.1	0	0	0	0	112	Y635	Y635-V639 HydrophobicContact CD1-CB 4.15Å; Y635-V639 HydrophobicContact CD1-CG2 4.06Å; Y635-V639 HydrophobicContact CD2-CG2 3.95Å; Y635-V639 HydrophobicContact CE1-CB 4.07Å; Y635-V639 HydrophobicContact CE1-CG1 4.04Å; Y635-V639 HydrophobicContact CE1-CG2 4.03Å; Y635-V639 HydrophobicContact CE2-CG2 3.91Å; Y635-V639 HydrophobicContact CG-CG2 4.02Å; Y635-V639 WeakPolarHBondContact O-CA 3.48Å; Y635-V639 WeakPolarHBondContact O-CB 3.46Å; Y635-V639 WeakPolarHBondContact O-CG2 3.27Å; Y635-V639 PolarHBondContact O-N 2.85Å
640	L	47.9	Very low	41.9	Very low	122 Å²	122	120 Å²	120	64%	0.639	62%	0.618	S	S	*	*	I	π-helix	trans	-102.3	-15.5	176	-52	177.4	0	0	0	112.8	E636 N642	E636-L640 HydrophobicContact CG-CD1 4.32Å; E636-L640 WeakPolarHBondContact O-CA 3.45Å; E636-L640 WeakPolarHBondContact O-CB 3.49Å; E636-L640 PolarHBondContact O-N 3.24Å; L640-N642 VanDerWaalsContact C-N 3.26Å; L640-N642 PolarHBondContact O-N 3.26Å
641	G	39.2	Very low	40.7	Very low	60 Å²	60	118.5 Å²	118.5	62%	0.619	63%	0.628	S	S	*	*	S	Bend	trans	-82.1	12.7	179.4	0	0	0	0	0	115.6	E636	E636-G641 PolarHBondContact O-N 3.03Å
642	N	32.5	Very low	39.5	Very low	107 Å²	107	122.3 Å²	122.3	57%	0.572	65%	0.645	S	S	*	*			trans	-133.7	30.1	-164.8	-149.4	92.4	0	0	0	114.2	L640 E644 G645	L640-N642 VanDerWaalsContact C-N 3.26Å; L640-N642 PolarHBondContact O-N 3.26Å; N642-E644 PolarHBondContact O-N 2.82Å; N642-G645 PolarHBondContact ND2-O 3.45Å
643	E	33.8	Very low	38.1	Very low	184 Å²	184	120.7 Å²	120.7	86%	0.86	64%	0.644	S	S	*	*	S	Bend	trans	-77.5	42.8	173.5	-63.7	-165.9	146.2	0	0	113.4
644	E	33.5	Very low	36.9	Very low	200 Å²	200	124.1 Å²	124.1	94%	0.935	66%	0.658	S	S	*	*	S	Bend	trans	-164.3	64.5	166.7	-122.6	177.3	-136.9	0	0	111.5	N642	N642-E644 PolarHBondContact O-N 2.82Å
645	G	29	Very low	35.8	Very low	44 Å²	44	133.9 Å²	133.9	45%	0.454	69%	0.693	S	S	.	*			trans	167.6	104.4	174.1	0	0	0	0	0	115.9	N642	N642-G645 PolarHBondContact ND2-O 3.45Å
646	S	26.7	Very low	34.9	Very low	108 Å²	108	131.5 Å²	131.5	76%	0.755	70%	0.699	S	S	*	*			trans	-62.8	129.4	178.5	179.6	0	0	0	0	113.5
647	W	27.2	Very low	33.9	Very low	235 Å²	235	132.7 Å²	132.7	89%	0.89	71%	0.714	S	S	*	*			trans	-145.4	85.4	161.6	-75.8	102.5	0	0	0	110.2
648	D	26.3	Very low	32.8	Very low	142 Å²	142	135 Å²	135	76%	0.759	72%	0.721	S	S	*	*			trans	-86	116.6	173.7	-174.9	9.6	0	0	0	110.6
649	V	27.8	Very low	32.5	Very low	118 Å²	118	134.9 Å²	134.9	72%	0.715	73%	0.727	S	S	*	*			trans	-146	84.6	172.2	-170.4	0	0	0	0	110.1
650	S	30.7	Very low	31.9	Very low	118 Å²	118	135.6 Å²	135.6	83%	0.825	74%	0.741	S	S	*	*			trans	-127.8	87.3	151.7	-76.2	0	0	0	0	109.1
651	S	26.4	Very low	31.4	Very low	105 Å²	105	138.1 Å²	138.1	73%	0.734	75%	0.749	S	S	*	*			trans	-53.1	127.4	174.5	49.5	0	0	0	0	113.6
652	E	28.6	Very low	31.1	Very low	185 Å²	185	140 Å²	140	86%	0.864	75%	0.753	S	S	*	*			trans	-158.8	142.8	133.7	-112.9	169.5	168.9	0	0	113.3
653	E	28.1	Very low	31.1	Very low	134 Å²	134	138.3 Å²	138.3	63%	0.626	76%	0.76	S	S	*	*			trans	65.6	104.3	150.7	-60	-104.8	93.5	0	0	123.1
654	K	30	Very low	31.2	Very low	153 Å²	153	139.5 Å²	139.5	67%	0.665	76%	0.763	S	S	*	*				76	117.1	127.1	-67.4	167.8	174.9	145.8	0	123.3
655	R	29.8	Very low	31.2	Very low	239 Å²	239	137.9 Å²	137.9	90%	0.902	76%	0.759	S	S	*	*			trans	67.1	148	144.2	-66.7	178.6	171.6	-177.6	-3.4	117.9
656	S	30	Very low	31.5	Very low	106 Å²	106	140.5 Å²	140.5	74%	0.741	77%	0.768	S	S	*	*			cis	-153	161.1	-9.1	-117.2	0	0	0	0	110.3
657	P	35.6	Very low	31.6	Very low	109 Å²	109	140 Å²	140	71%	0.708	77%	0.765	S	S	*	*			trans	-102.7	172.7	-170.5	40.3	-36.4	0	0	0	114.6
658	Q	34.5	Very low	31.6	Very low	181 Å²	181	133.6 Å²	133.6	85%	0.846	76%	0.755	S	S	*	*				-169.8	157.4	125.1	-96.4	-78.6	-51.3	0	0	111.9
659	P	36.9	Very low	31.7	Very low	107 Å²	107	133 Å²	133	70%	0.695	76%	0.757	S	S	*	*			trans	-135.6	171.4	-161.9	43.5	-27.1	0	0	0	117.4
660	A	35.3	Very low	31.6	Very low	91 Å²	91	131.8 Å²	131.8	75%	0.752	75%	0.754	S	S	*	*			trans	-172.6	158.3	156.1	0	0	0	0	0	110
661	Q	36.6	Very low	31.3	Very low	175 Å²	175	133.3 Å²	133.3	82%	0.818	75%	0.752	S	S	*	*			cis	-169.1	157.3	-27.1	-97.5	-141.5	83	0	0	107.5
662	S	34.5	Very low	31.3	Very low	99 Å²	99	131.7 Å²	131.7	69%	0.692	74%	0.741	S	S	*	*			cis	-169	156.3	-28.3	58.2	0	0	0	0	110.3
663	G	32.4	Very low	31.2	Very low	71 Å²	71	132.6 Å²	132.6	73%	0.732	74%	0.738	S	S	*	*			trans	103.3	144.6	163.2	0	0	0	0	0	117.2
664	K	36.3	Very low	31.1	Very low	210 Å²	210	132.4 Å²	132.4	91%	0.913	74%	0.74	S	S	*	*			cis	-138.6	155.9	-6.9	-73.1	-175.5	179	176.3	0	111.2
665	I	31.8	Very low	30.8	Very low	165 Å²	165	132.2 Å²	132.2	85%	0.846	75%	0.747	S	S	*	*			trans	-129.7	-155	178.8	-1.7	172.4	0	0	0	106
666	P	35.2	Very low	30.7	Very low	99 Å²	99	125.3 Å²	125.3	64%	0.643	74%	0.741	S	S	*	*			cis	-135.8	-170.8	-6.1	25.5	1	0	0	0	115.3
667	S	28.9	Very low	30.6	Very low	99 Å²	99	130.8 Å²	130.8	69%	0.692	75%	0.747	S	S	*	*			trans	73.9	153	132.9	50	0	0	0	0	122.8
668	S	28.8	Very low	30.5	Very low	99 Å²	99	130.8 Å²	130.8	69%	0.692	75%	0.747	S	S	*	*			cis	-178.1	170.9	-26.4	59.8	0	0	0	0	110.3
669	V	27.6	Very low	30.2	Very low	131 Å²	131	127.6 Å²	127.6	79%	0.794	74%	0.735	S	S	*	*			trans	66.1	151.9	147.1	161.6	0	0	0	0	118.1
670	S	25.6	Very low	29.7	Very low	92 Å²	92	131.7 Å²	131.7	64%	0.643	74%	0.737	S	S	*	*			cis	-164.5	162.8	-38.4	-82.3	0	0	0	0	108.8
671	N	25.2	Very low	29.3	Very low	150 Å²	150	135.4 Å²	135.4	80%	0.802	74%	0.736	S	S	*	*			trans	66.2	124.1	146.4	-103.1	11.7	0	0	0	122.8
672	S	26.4	Very low	29	Very low	71 Å²	71	133 Å²	133	50%	0.497	73%	0.729	S	S	.	*				85.8	145.2	121.3	69.6	0	0	0	0	122.7
673	Y	26	Very low	28.8	Very low	203 Å²	203	133.1 Å²	133.1	80%	0.796	73%	0.73	S	S	*	*			trans	69.4	155.6	164.8	-46.5	-59.1	0	0	0	117.2
674	L	25.5	Very low	28.8	Very low	130 Å²	130	133.7 Å²	133.7	68%	0.681	73%	0.728	S	S	*	*			cis	-166.3	148.2	-30.2	-111.5	168.1	0	0	0	107.3
675	N	24.9	Very low	28.7	Very low	150 Å²	150	129.3 Å²	129.3	80%	0.802	72%	0.724	S	S	*	*			trans	61.9	166.3	159.6	-64.3	-15.5	0	0	0	116.5
676	A	26.1	Very low	28.7	Very low	93 Å²	93	126.5 Å²	126.5	77%	0.769	72%	0.719	S	S	*	*			cis	-153	172	-25.1	0	0	0	0	0	110
677	Y	29.2	Very low	28.9	Very low	222 Å²	222	126.4 Å²	126.4	87%	0.871	72%	0.72	S	S	*	*			trans	-62	168.5	160.1	-86.5	-94.6	0	0	0	111.1
678	P	33.7	Very low	29.2	Very low	109 Å²	109	126.8 Å²	126.8	71%	0.708	72%	0.723	S	S	*	*			cis	-153	-176.3	34.8	41.5	-17.9	0	0	0	119.9
679	D	26.7	Very low	29.6	Very low	113 Å²	113	127.5 Å²	127.5	60%	0.604	73%	0.727	S	S	*	*			trans	78.9	132.3	133	-95.7	26.5	0	0	0	126.5
680	R	27.3	Very low	30	Very low	193 Å²	193	128 Å²	128	73%	0.728	73%	0.725	S	S	*	*			trans	93.1	125.3	132.9	-72.9	171.4	-171.5	-135.4	-4.3	124.1
681	F	26.7	Very low	30.6	Very low	169 Å²	169	128.4 Å²	128.4	74%	0.741	73%	0.728	S	S	*	*			trans	52	155.1	132.9	-65	-58	0	0	0	120.6
682	D	30.9	Very low	31.3	Very low	125 Å²	125	126.7 Å²	126.7	67%	0.668	73%	0.728	S	S	*	*			cis	-149.1	156.9	9.6	-128.1	-33.7	0	0	0	113.4
683	S	29.8	Very low	31.7	Very low	102 Å²	102	127.6 Å²	127.6	71%	0.713	74%	0.739	S	S	*	*				22	151.2	128.7	-60.3	0	0	0	0	122.7
684	A	32.3	Very low	32.6	Very low	82 Å²	82	123.4 Å²	123.4	68%	0.678	74%	0.737	S	S	*	*			cis	-172	175	-7.4	0	0	0	0	0	111.9
685	S	33.5	Very low	33.1	Very low	118 Å²	118	123.1 Å²	123.1	83%	0.825	75%	0.746	S	S	*	*			trans	67.3	163.7	155.2	-65.4	0	0	0	0	118.9
686	S	33.8	Very low	33.7	Very low	107 Å²	107	121.9 Å²	121.9	75%	0.748	74%	0.744	S	S	*	*			cis	-168.6	170.6	-31.3	65.5	0	0	0	0	106.3
687	S	37.4	Very low	34.2	Very low	96 Å²	96	123.4 Å²	123.4	67%	0.671	75%	0.746	S	S	*	*			cis	-170.6	161.8	24.4	47.1	0	0	0	0	111.4
688	S	37	Very low	34.5	Very low	108 Å²	108	116.8 Å²	116.8	76%	0.755	74%	0.737	S	S	*	*			trans	49.8	143.3	146.3	65.4	0	0	0	0	121.4
689	C	35.8	Very low	35	Very low	113 Å²	113	117.5 Å²	117.5	76%	0.764	74%	0.742	S	S	*	*			cis	-159.9	-169.4	21.1	70.5	0	0	0	0	109
690	N	37.2	Very low	35.4	Very low	143 Å²	143	116.3 Å²	116.3	77%	0.765	75%	0.748	S	S	*	*			cis	-171.5	144.3	-42.2	-91.5	4.9	0	0	0	105.8
691	S	38.4	Very low	35.7	Very low	100 Å²	100	113.9 Å²	113.9	70%	0.699	75%	0.754	S	S	*	*			cis	-136.8	-116.1	-11.5	-71.9	0	0	0	0	107.3
692	S	38.8	Very low	36	Very low	114 Å²	114	110.2 Å²	110.2	80%	0.797	76%	0.755	S	S	*	*			cis	-169.9	152.2	-18.7	-119.2	0	0	0	0	106.4
693	A	34.2	Very low	36.1	Very low	89 Å²	89	108.3 Å²	108.3	74%	0.736	76%	0.757	S	S	*	*			cis	-156.5	163.4	-16.9	0	0	0	0	0	109
694	P	45.7	Very low	36.2	Very low	115 Å²	115	112.4 Å²	112.4	75%	0.747	76%	0.762	S	S	*	*			trans	-131.4	-169.6	-161.6	43.6	-28.3	0	0	0	115.3
695	S	37	Very low	36.1	Very low	125 Å²	125	113.7 Å²	113.7	87%	0.874	76%	0.761	S	S	*	*			trans	-161.2	144	145.7	-84.5	0	0	0	0	113.6
696	T	36.3	Very low	36.1	Very low	124 Å²	124	116.5 Å²	116.5	76%	0.761	76%	0.761	S	S	*	*			trans	-145.8	167.1	-179	-28.4	0	0	0	0	108.9
697	P	37.7	Very low	36.1	Very low	124 Å²	124	116.8 Å²	116.8	81%	0.805	76%	0.763	S	S	*	*				-143.9	158	104.8	35.3	-20.1	0	0	0	114.2
698	A	34.8	Very low	35.8	Very low	84 Å²	84	118.5 Å²	118.5	69%	0.694	77%	0.772	S	S	*	*			cis	115.4	169.8	11.4	0	0	0	0	0	113.4
699	P	44.1	Very low	35.3	Very low	124 Å²	124	116.5 Å²	116.5	81%	0.805	77%	0.768	S	S	*	*				-144.7	-170.1	-100.7	41.5	-19.8	0	0	0	116.9
700	A	34.9	Very low	34.7	Very low	88 Å²	88	118.3 Å²	118.3	73%	0.727	78%	0.775	S	S	*	*			trans	-149.8	111.1	150.4	0	0	0	0	0	108.6
701	V	33.5	Very low	34.3	Very low	141 Å²	141	116.8 Å²	116.8	86%	0.855	78%	0.776	S	S	*	*				66.1	117.5	91.9	172.3	0	0	0	0	111.4
702	A	34.1	Very low	33.7	Very low	93 Å²	93	119.1 Å²	119.1	77%	0.769	78%	0.779	S	S	*	*			cis	-143.5	-158.2	5.5	0	0	0	0	0	109.8
703	A	33	Very low	33.2	Very low	85 Å²	85	122.5 Å²	122.5	70%	0.702	78%	0.782	S	S	*	*			cis	-154.4	-145.2	10.3	0	0	0	0	0	112.5
704	F	30.1	Very low	32.8	Very low	188 Å²	188	127 Å²	127	83%	0.825	79%	0.788	S	S	*	*			trans	-120.8	136.6	-162.2	-72.7	-87.7	0	0	0	112.4
705	V	31.2	Very low	31.9	Very low	108 Å²	108	129.7 Å²	129.7	66%	0.655	78%	0.783	S	S	*	*				81.5	124.3	63.1	174.4	0	0	0	0	111
706	H	33.4	Very low	31.4	Very low	177 Å²	177	129.2 Å²	129.2	82%	0.819	78%	0.777	S	S	*	*				-149.5	173.7	78	-77.4	75.8	0	0	0	115
707	S	33.3	Very low	31	Very low	114 Å²	114	131.1 Å²	131.1	80%	0.797	78%	0.775	S	S	*	*			trans	-137.4	171.3	171.2	-51.2	0	0	0	0	109.3
708	P	31.3	Very low	30.5	Very low	132 Å²	132	129.4 Å²	129.4	86%	0.857	75%	0.754	S	S	*	*				-152	176.8	83	40.8	-22.8	0	0	0	116
709	G	25.9	Very low	30.1	Very low	66 Å²	66	129.6 Å²	129.6	68%	0.68	75%	0.751	S	S	*	*			trans	118.9	108.1	138.6	0	0	0	0	0	119.8
710	V	24.9	Very low	29.3	Very low	150 Å²	150	129 Å²	129	91%	0.909	74%	0.736	S	S	*	*			trans	70.1	130.2	146	-168.4	0	0	0	0	119.5
711	S	26.8	Very low	28.9	Very low	111 Å²	111	129.2 Å²	129.2	78%	0.776	73%	0.728	S	S	*	*			trans	-80.5	138.5	-175.7	-50.5	0	0	0	0	114.7
712	I	27.6	Very low	28.5	Very low	149 Å²	149	129.7 Å²	129.7	76%	0.764	73%	0.726	S	S	*	*			trans	-130.1	129.7	147.9	-63.1	-176.3	0	0	0	109.2	H714	I712-H714 PolarHBondContact O-N 3.36Å; I712-H714 VanDerWaalsContact O-N 3.12Å
713	Q	26.9	Very low	28.2	Very low	186 Å²	186	130.8 Å²	130.8	87%	0.869	72%	0.723	S	S	*	*			trans	-71.3	103.1	176.9	-66	178.8	-3.1	0	0	110.4	R715	Q713-R715 VanDerWaalsContact C-N 3.3Å; Q713-R715 PolarHBondContact O-N 2.61Å
714	H	26.9	Very low	27.9	Very low	183 Å²	183	134.5 Å²	134.5	85%	0.847	73%	0.728	S	S	*	*			trans	-69.3	85.1	174.4	-93.6	-83.4	0	0	0	111.9	I712	I712-H714 PolarHBondContact O-N 3.36Å; I712-H714 VanDerWaalsContact O-N 3.12Å
715	R	25.5	Very low	27.7	Very low	171 Å²	171	128.6 Å²	128.6	65%	0.645	71%	0.708	S	S	*	*			trans	-61.4	121.4	173.2	-156.5	177	-141	-143.3	-1.6	109.2	Q713 K717 D844	Q713-R715 VanDerWaalsContact C-N 3.3Å; Q713-R715 PolarHBondContact O-N 2.61Å; R715-K717 PolarHBondContact O-N 3.49Å; R715-D844 IonicContact CZ-OD2 3.29Å; R715-D844 IonicContact NH1-OD2 2.94Å; R715-D844 PolarHBondContact NH1-OD2 2.93Å; R715-D844 IonicContact NH2-OD2 3.53Å; R715-D844 PolarHBondContact NH2-OD2 3.01Å
716	P	26.6	Very low	27.5	Very low	115 Å²	115	132.6 Å²	132.6	75%	0.747	72%	0.72	S	S	*	*			trans	-71.4	104.2	-175.8	27.6	-33.8	0	0	0	110.4	F718	P716-F718 PolarHBondContact O-N 3.37Å
717	K	28.2	Very low	27.4	Very low	165 Å²	165	126.6 Å²	126.6	72%	0.717	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-64.7	120.6	176.3	-149.2	-179.5	-175.5	-171.8	0	108.9	R715 S719 D825	R715-K717 PolarHBondContact O-N 3.49Å; K717-S719 PolarHBondContact O-N 2.94Å; K717-D825 IonicContact NZ-OD2 2.87Å; K717-D825 PolarHBondContact NZ-OD2 3.26Å
718	F	28.3	Very low	27.2	Very low	87 Å²	87	124.1 Å²	124.1	38%	0.382	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-78	117.7	-176.9	-162.7	-81.6	0	0	0	109.6	P716 F720 G901 R902	P716-F718 PolarHBondContact O-N 3.37Å; F718-F720 AromaticContact CE1-CD2 3.93Å; F718-F720 HydrophobicContact CE1-CD2 3.93Å; F718-F720 HydrophobicContact CE1-CE2 4.49Å; F718-G901 WeakPolarHBondContact CE2-O 3.34Å; F718-R902 HydrophobicContact CE2-CB 4.46Å; F718-R902 HydrophobicContact CE2-CG 4.1Å
719	S	24.9	Very low	27.3	Very low	89 Å²	89	121.8 Å²	121.8	62%	0.622	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-99	117	165.2	162.9	0	0	0	0	108.2	K717	K717-S719 PolarHBondContact O-N 2.94Å
720	F	28.3	Very low	27.7	Very low	111 Å²	111	119 Å²	119	49%	0.487	63%	0.629	S	S	.	*	P	Polyproline II helix	trans	-66.8	131.7	145.8	-123.7	-86.4	0	0	0	106.4	F718 D722 I828	F718-F720 AromaticContact CE1-CD2 3.93Å; F718-F720 HydrophobicContact CE1-CD2 3.93Å; F718-F720 HydrophobicContact CE1-CE2 4.49Å; F720-D722 PolarHBondContact O-N 2.98Å; F720-I828 WeakPolarHBondContact CD2-O 3.37Å
721	T	26.6	Very low	28.1	Very low	92 Å²	92	116.9 Å²	116.9	56%	0.564	61%	0.613	S	S	*	*			trans	-85	109.4	170.2	47.6	0	0	0	0	107.7	V723	T721-V723 PolarHBondContact O-N 3.43Å
722	D	25	Very low	28.7	Very low	151 Å²	151	113 Å²	113	81%	0.807	58%	0.583	S	S	*	*			trans	-63.1	104.3	172.8	-76.6	-55.9	0	0	0	110.2	F720	F720-D722 PolarHBondContact O-N 2.98Å
723	V	26.7	Very low	29.1	Very low	116 Å²	116	109.5 Å²	109.5	70%	0.703	56%	0.564	S	S	*	*			trans	-138.7	105.1	156.2	-178.5	0	0	0	0	104.8	T721 P725	T721-V723 PolarHBondContact O-N 3.43Å; V723-P725 VanDerWaalsContact O-CD 3.29Å; V723-P725 WeakPolarHBondContact O-CD 3.29Å
724	M	27.7	Very low	29.6	Very low	164 Å²	164	103.3 Å²	103.3	81%	0.808	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-73.6	116.2	157	-76.7	-171.4	60.3	0	0	106.8
725	P	25.5	Very low	29.9	Very low	64 Å²	64	100.4 Å²	100.4	42%	0.416	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-66.8	145.4	161.1	-6.6	24.7	0	0	0	107.4	V723 V727	V723-P725 VanDerWaalsContact O-CD 3.29Å; V723-P725 WeakPolarHBondContact O-CD 3.29Å; P725-V727 PolarHBondContact O-N 3.34Å
726	E	27.3	Very low	30.1	Very low	192 Å²	192	98.4 Å²	98.4	90%	0.897	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-56	116.6	162.9	-65.4	-173.9	124.7	0	0	108.2	P728	E726-P728 WeakPolarHBondContact O-CD 3.07Å
727	V	31.1	Very low	30.2	Very low	50 Å²	50	95.1 Å²	95.1	30%	0.303	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-78	121.1	-175.2	-179.3	0	0	0	0	107.9	P725 V729 V984	P725-V727 PolarHBondContact O-N 3.34Å; V727-V729 PolarHBondContact O-N 3.34Å; V727-V729 VanDerWaalsContact O-N 3.08Å; V727-V984 WeakPolarHBondContact CG1-O 3.4Å
728	P	29	Very low	30.3	Very low	63 Å²	63	93 Å²	93	41%	0.409	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-55.5	119	176.8	-25.7	35.4	0	0	0	110.7	E726 I730 P1043	E726-P728 WeakPolarHBondContact O-CD 3.07Å; P728-I730 PolarHBondContact O-N 2.92Å; P728-P1043 HydrophobicContact CB-CG 4.21Å
729	V	32.9	Very low	30.3	Very low	83 Å²	83	92.8 Å²	92.8	50%	0.503	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	108.1	174	-178.1	0	0	0	0	107.2	V727 N731 F981	V727-V729 PolarHBondContact O-N 3.34Å; V727-V729 VanDerWaalsContact O-N 3.08Å; V729-N731 PolarHBondContact O-N 3.47Å; V729-F981 HydrophobicContact CG1-CB 4.03Å; V729-F981 HydrophobicContact CG1-CD1 4.42Å; V729-F981 HydrophobicContact CG1-CG 4.14Å
730	I	35.5	Very low	30.5	Very low	6 Å²	6	94.7 Å²	94.7	3%	0.031	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	111.3	177.2	-47.4	178.4	0	0	0	107.7	P728 I732 V984 L989 P1043 I1047	P728-I730 PolarHBondContact O-N 2.92Å; I730-I732 HydrophobicContact CB-CG1 4.47Å; I730-I732 HydrophobicContact CG2-CD1 4.31Å; I730-I732 HydrophobicContact CG2-CG1 3.78Å; I730-I732 PolarHBondContact O-N 2.9Å; I730-V984 HydrophobicContact CD1-CB 3.81Å; I730-V984 HydrophobicContact CD1-CG1 4.49Å; I730-V984 HydrophobicContact CD1-CG2 3.78Å; I730-L989 HydrophobicContact CD1-CD1 4.08Å; I730-P1043 HydrophobicContact CD1-CB 3.5Å; I730-P1043 VanDerWaalsContact CD1-CB 3.5Å; I730-P1043 HydrophobicContact CD1-CG 4.34Å; I730-P1043 HydrophobicContact CG1-CB 3.87Å; I730-P1043 HydrophobicContact CG1-CG 4.34Å; I730-I1047 HydrophobicContact CD1-CD1 4.32Å; I730-I1047 HydrophobicContact CG2-CD1 4.3Å
731	N	33.8	Very low	30.7	Very low	107 Å²	107	94.7 Å²	94.7	57%	0.572	54%	0.54	S	S	*	.			trans	-76	74.4	176.1	-75.4	7	0	0	0	111	V729 E733 F981	V729-N731 PolarHBondContact O-N 3.47Å; N731-E733 PolarHBondContact O-N 3.39Å; N731-F981 HydrophobicContact CB-CE1 4.35Å; N731-F981 WeakPolarHBondContact OD1-CD1 3.47Å; N731-F981 VanDerWaalsContact OD1-CE1 3.27Å; N731-F981 WeakPolarHBondContact OD1-CE1 3.31Å
732	I	38.1	Very low	30.7	Very low	30 Å²	30	101.6 Å²	101.6	15%	0.154	56%	0.556	C	S	.	*			trans	-82.8	94.4	163.3	-51.1	-178.6	0	0	0	106.7	I730 L734 L982 L1001	I730-I732 HydrophobicContact CB-CG1 4.47Å; I730-I732 HydrophobicContact CG2-CD1 4.31Å; I730-I732 HydrophobicContact CG2-CG1 3.78Å; I730-I732 PolarHBondContact O-N 2.9Å; I732-L734 PolarHBondContact O-N 3.23Å; I732-L982 HydrophobicContact CD1-CB 4.41Å; I732-L982 HydrophobicContact CD1-CD2 4.04Å; I732-L1001 HydrophobicContact CG2-CD2 4.35Å
733	E	35.9	Very low	31	Very low	75 Å²	75	103.3 Å²	103.3	35%	0.35	56%	0.559	S	S	.	*			trans	-74.9	125.3	-178.3	-160.7	-176.7	-126.8	0	0	111.4	Y142 N731 Q735	Y142-E733 WeakPolarHBondContact CD1-OE2 3.43Å; Y142-E733 WeakPolarHBondContact CE1-OE2 3.46Å; N731-E733 PolarHBondContact O-N 3.39Å; E733-Q735 PolarHBondContact O-N 3.49Å
734	L	37	Very low	31.2	Very low	55 Å²	55	103.4 Å²	103.4	29%	0.288	56%	0.564	S	S	.	*			trans	-81.7	102.4	-176.4	-67.5	160.3	0	0	0	110.4	I732 N736 K980 F1003	I732-L734 PolarHBondContact O-N 3.23Å; L734-N736 PolarHBondContact O-N 3.07Å; L734-K980 HydrophobicContact CD1-CB 3.76Å; L734-F1003 HydrophobicContact CD2-CB 4.02Å; L734-F1003 WeakPolarHBondContact CD2-O 3.48Å
735	Q	33.7	Very low	31.2	Very low	123 Å²	123	104.8 Å²	104.8	58%	0.575	57%	0.569	S	S	*	*			trans	-74.6	108.9	179.7	-67.7	-173.7	1.1	0	0	111.8	E733 G737	E733-Q735 PolarHBondContact O-N 3.49Å; Q735-G737 PolarHBondContact O-N 3.4Å
736	N	29.2	Very low	31.6	Very low	128 Å²	128	110.7 Å²	110.7	68%	0.684	59%	0.591	S	S	*	*			trans	-72.8	60.9	171.1	-75.2	-15.5	0	0	0	112.1	L734	L734-N736 PolarHBondContact O-N 3.07Å
737	G	30	Very low	31.8	Very low	47 Å²	47	110 Å²	110	49%	0.485	59%	0.593	S	S	.	*			trans	-85.3	109.4	172.5	0	0	0	0	0	111.4	Q735 K1004	Q735-G737 PolarHBondContact O-N 3.4Å; G737-K1004 PolarHBondContact O-NZ 3.02Å
738	V	30	Very low	31.8	Very low	119 Å²	119	111.1 Å²	111.1	72%	0.721	62%	0.616	S	S	*	*			trans	-63.4	129	174	179.1	0	0	0	0	109.4	E740	V738-E740 HydrophobicContact CG1-CG 4.35Å
739	A	28.5	Very low	31.9	Very low	83 Å²	83	113.6 Å²	113.6	69%	0.686	63%	0.634	S	S	*	*			trans	-97.5	102.1	171.3	0	0	0	0	0	109.1	S741	A739-S741 PolarHBondContact O-N 3.33Å; A739-S741 VanDerWaalsContact O-N 3.16Å
740	E	27.8	Very low	31.7	Very low	130 Å²	130	114.6 Å²	114.6	61%	0.607	65%	0.651	S	S	*	*			trans	-76.6	93.5	168.6	-66.9	175.3	120.6	0	0	108.7	K147 V738 R742	K147-E740 IonicContact NZ-OE2 3.89Å; K147-E740 PolarHBondContact NZ-OE2 3.4Å; V738-E740 HydrophobicContact CG1-CG 4.35Å; E740-R742 PolarHBondContact O-N 2.76Å
741	S	32.5	Very low	31.5	Very low	110 Å²	110	118.4 Å²	118.4	77%	0.769	69%	0.692	S	S	*	*			trans	-68.6	115.6	166.8	47.3	0	0	0	0	109.2	A739 E743	A739-S741 PolarHBondContact O-N 3.33Å; A739-S741 VanDerWaalsContact O-N 3.16Å; S741-E743 PolarHBondContact O-N 2.77Å
742	R	26.8	Very low	31.2	Very low	238 Å²	238	118.8 Å²	118.8	90%	0.898	70%	0.703	S	S	*	*			trans	-72.1	114.8	173.4	-71.8	174.1	168.8	151	-6.3	109.8	E740	E740-R742 PolarHBondContact O-N 2.76Å
743	E	31	Very low	30.8	Very low	186 Å²	186	123.8 Å²	123.8	87%	0.869	74%	0.735	S	S	*	*			trans	-115.7	136.2	153.6	-66.6	-171.5	150	0	0	107.5	S741	S741-E743 PolarHBondContact O-N 2.77Å
744	S	31.6	Very low	30.2	Very low	118 Å²	118	127.6 Å²	127.6	83%	0.825	76%	0.757	S	S	*	*			trans	-105.9	117.6	-174.9	-59.2	0	0	0	0	109.3
745	E	27.6	Very low	29.9	Very low	193 Å²	193	132 Å²	132	90%	0.902	79%	0.786	S	S	*	*			trans	-78.7	126.7	170.5	-63.8	-177	131.1	0	0	110.2
746	E	34.5	Very low	29.6	Very low	189 Å²	189	134 Å²	134	88%	0.883	80%	0.797	S	S	*	*			trans	-119.4	147.9	157.4	-74.5	-161.4	137	0	0	110
747	N	30.4	Very low	29.8	Very low	176 Å²	176	133.6 Å²	133.6	94%	0.941	81%	0.805	S	S	*	*			trans	-77.3	147.1	-160.1	-64.1	-80.8	0	0	0	114.2
748	G	31.5	Very low	30	Very low	75 Å²	75	142.4 Å²	142.4	77%	0.773	82%	0.823	S	S	*	*			trans	-145.7	11.2	-169.3	0	0	0	0	0	120.1
749	S	31.2	Very low	30.1	Very low	114 Å²	114	144.4 Å²	144.4	80%	0.797	83%	0.83	S	S	*	*			trans	46.1	108	159.1	180	0	0	0	0	121.8
750	A	30.1	Very low	30.4	Very low	104 Å²	104	144.2 Å²	144.2	86%	0.86	84%	0.836	S	S	*	*			trans	70.3	146.3	139.5	0	0	0	0	0	121.8
751	G	31.1	Very low	30.5	Very low	86 Å²	86	143.8 Å²	143.8	89%	0.887	85%	0.848	S	S	*	*			trans	143.9	79.5	168.7	0	0	0	0	0	115.2
752	S	26.6	Very low	30.4	Very low	115 Å²	115	148.6 Å²	148.6	80%	0.804	86%	0.855	S	S	*	*			trans	-104.8	139.6	174.1	178.7	0	0	0	0	111.6
753	T	29.4	Very low	30.6	Very low	136 Å²	136	141.5 Å²	141.5	83%	0.834	85%	0.847	S	S	*	*			trans	-170.6	147.1	143.8	-78.6	0	0	0	0	110.9
754	L	24.5	Very low	30.7	Very low	155 Å²	155	135.7 Å²	135.7	81%	0.812	84%	0.838	S	S	*	*			trans	-92.6	148.5	179.4	-65.4	144.4	0	0	0	112.4
755	V	30.7	Very low	30.7	Very low	146 Å²	146	137.4 Å²	137.4	89%	0.885	84%	0.843	S	S	*	*			trans	-144.3	143.5	145.8	-168.1	0	0	0	0	109.4
756	M	26.9	Very low	30.8	Very low	166 Å²	166	131.5 Å²	131.5	82%	0.818	83%	0.834	S	S	*	*			trans	-117.5	147.2	174.7	-61.9	175.7	66.6	0	0	111.3
757	S	33.8	Very low	30.9	Very low	120 Å²	120	128.7 Å²	128.7	84%	0.839	84%	0.835	S	S	*	*			trans	168.2	160.4	148.1	-83.2	0	0	0	0	111.4
758	R	33.4	Very low	31	Very low	231 Å²	231	128.9 Å²	128.9	87%	0.872	83%	0.831	S	S	*	*			cis	-165.3	165.1	-37.1	-154.9	168.7	-176.2	170.4	0.2	107.5
759	D	32.4	Very low	31.1	Very low	161 Å²	161	135 Å²	135	86%	0.861	84%	0.839	S	S	*	*			trans	-73.8	157.9	-166.7	-41.8	-95	0	0	0	115.7
760	G	33.8	Very low	31	Very low	80 Å²	80	135.6 Å²	135.6	83%	0.825	84%	0.838	S	S	*	*			trans	-168.9	128	168.3	0	0	0	0	0	111.8
761	S	31	Very low	31.1	Very low	121 Å²	121	138.6 Å²	138.6	85%	0.846	84%	0.839	S	S	*	*			trans	-144.9	137	-174.2	178.3	0	0	0	0	111.6
762	F	31.2	Very low	31.1	Very low	210 Å²	210	139.3 Å²	139.3	92%	0.921	83%	0.83	S	S	*	*			trans	-158.1	166.1	157.5	-142.1	-103.3	0	0	0	112
763	A	30.5	Very low	31.5	Very low	90 Å²	90	139.5 Å²	139.5	74%	0.744	83%	0.829	S	S	*	*			trans	-131	160.7	-175.5	0	0	0	0	0	112.2
764	G	32.2	Very low	31.8	Very low	64 Å²	64	140.7 Å²	140.7	66%	0.66	83%	0.83	S	S	*	*			trans	170.9	107.7	171.2	0	0	0	0	0	116.2
765	T	31.9	Very low	32.3	Very low	153 Å²	153	140.6 Å²	140.6	94%	0.939	83%	0.825	S	S	*	*			trans	35	135.1	138.5	56.5	0	0	0	0	122.1
766	G	30.4	Very low	32.2	Very low	70 Å²	70	139.6 Å²	139.6	72%	0.722	82%	0.815	S	S	*	*			trans	161.7	83.5	146.8	0	0	0	0	0	120.1
767	S	35.2	Very low	32.5	Very low	129 Å²	129	139.9 Å²	139.9	90%	0.902	82%	0.819	S	S	*	*			trans	69.2	160.5	142.1	-51.7	0	0	0	0	121.6
768	E	32.5	Very low	32.5	Very low	181 Å²	181	140.8 Å²	140.8	85%	0.846	81%	0.813	S	S	*	*			trans	-110.2	157	-171.4	-53.5	151.9	107.3	0	0	111.9
769	Q	34.5	Very low	32.5	Very low	203 Å²	203	136.9 Å²	136.9	95%	0.949	81%	0.809	S	S	*	*				-170.6	155.1	123.6	-105.3	159.6	67.3	0	0	115.2
770	T	28.6	Very low	32.4	Very low	127 Å²	127	133.2 Å²	133.2	78%	0.779	80%	0.796	S	S	*	*			trans	-79.2	152.1	-172.6	-37.3	0	0	0	0	113.2
771	L	32.8	Very low	32.5	Very low	166 Å²	166	137.9 Å²	137.9	87%	0.869	80%	0.802	S	S	*	*				-175.7	173	124.3	-97.2	163.7	0	0	0	113.7
772	S	31.3	Very low	32.3	Very low	101 Å²	101	135.8 Å²	135.8	71%	0.706	80%	0.799	S	S	*	*			trans	-76.7	160.2	-157.5	43.1	0	0	0	0	117.4
773	P	34.4	Very low	32.5	Very low	120 Å²	120	131.5 Å²	131.5	78%	0.779	80%	0.795	S	S	*	*			trans	-88.1	163	173.4	37.7	-35.6	0	0	0	112.7
774	D	35	Very low	32.6	Very low	160 Å²	160	134.8 Å²	134.8	86%	0.856	80%	0.8	S	S	*	*			trans	-151.4	174.8	158	-126.6	-26.3	0	0	0	113.2
775	E	35.2	Very low	32.6	Very low	153 Å²	153	138.8 Å²	138.8	72%	0.715	81%	0.806	S	S	*	*			trans	-74.7	178.1	-152.9	-56.3	-170.3	139.1	0	0	120.7
776	N	29.8	Very low	32.4	Very low	126 Å²	126	136.7 Å²	136.7	67%	0.674	80%	0.798	S	S	*	*			trans	83.1	105.6	146.7	-66.8	-50.6	0	0	0	120.8
777	L	33.1	Very low	32.5	Very low	171 Å²	171	139.6 Å²	139.6	90%	0.895	80%	0.802	S	S	*	*				-156.5	153.1	114.7	-137.7	74.1	0	0	0	112.8
778	I	32.7	Very low	32.1	Very low	140 Å²	140	144 Å²	144	72%	0.718	81%	0.805	S	S	*	*			trans	-126.4	127.1	171.9	-64.6	169.5	0	0	0	107.5
779	D	34	Very low	31.9	Very low	148 Å²	148	138 Å²	138	79%	0.791	79%	0.792	S	S	*	*			trans	-167.4	139.5	141.7	-98.4	-26.7	0	0	0	108.5
780	S	30.6	Very low	31.5	Very low	84 Å²	84	132.1 Å²	132.1	59%	0.587	79%	0.785	S	S	*	*			cis	96.6	138.2	39.9	-62.2	0	0	0	0	111.8
781	L	35.5	Very low	31.6	Very low	179 Å²	179	133.6 Å²	133.6	94%	0.937	78%	0.783	S	S	*	*			trans	67.3	141.4	-178.4	-46.2	173.2	0	0	0	114.3
782	G	27.7	Very low	31.3	Very low	76 Å²	76	133.9 Å²	133.9	78%	0.784	78%	0.78	S	S	*	*			cis	127.3	89.2	-5.7	0	0	0	0	0	112.6
783	S	34	Very low	31.3	Very low	121 Å²	121	137.5 Å²	137.5	85%	0.846	78%	0.778	S	S	*	*			trans	-149	157.8	166.2	-164.7	0	0	0	0	111.2
784	N	32.5	Very low	30.9	Very low	158 Å²	158	140.1 Å²	140.1	85%	0.845	77%	0.773	S	S	*	*			trans	-93.3	143.1	-179.5	-53.7	-68.6	0	0	0	110.6
785	D	32.4	Very low	30.7	Very low	149 Å²	149	143.3 Å²	143.3	80%	0.797	77%	0.773	S	S	*	*			trans	-146.4	155	137.3	-155.9	-7.9	0	0	0	110
786	S	28.4	Very low	30.4	Very low	108 Å²	108	141.1 Å²	141.1	76%	0.755	77%	0.766	S	S	*	*			trans	-133.2	95.5	-171.1	58.2	0	0	0	0	111.2
787	T	33	Very low	30.6	Very low	131 Å²	131	139.6 Å²	139.6	80%	0.804	76%	0.761	S	S	*	*			trans	-138.2	141.2	170.5	-3.4	0	0	0	0	112.4	G789	T787-G789 PolarHBondContact O-N 2.83Å
788	F	26.3	Very low	30.4	Very low	223 Å²	223	141.1 Å²	141.1	98%	0.978	76%	0.755	S	S	*	*			trans	-90.3	83.1	-172.8	-171.5	-96.5	0	0	0	110
789	G	27.5	Very low	30.1	Very low	55 Å²	55	138.2 Å²	138.2	57%	0.567	75%	0.747	S	S	*	*			trans	-119.2	155	-174.3	0	0	0	0	0	114.3	T787	T787-G789 PolarHBondContact O-N 2.83Å
790	G	26.8	Very low	29.9	Very low	78 Å²	78	135.7 Å²	135.7	80%	0.804	75%	0.747	S	S	*	*			trans	-68.1	138	-173.2	0	0	0	0	0	114.2	Q792	G790-Q792 PolarHBondContact O-N 3.38Å
791	H	29.9	Very low	29.8	Very low	158 Å²	158	134.3 Å²	134.3	73%	0.731	75%	0.746	S	S	*	*			trans	-80	65.4	173.2	-45.9	-29.6	0	0	0	110.3	W793	H791-W793 PolarHBondContact O-N 2.96Å
792	Q	28.1	Very low	29.7	Very low	172 Å²	172	131.8 Å²	131.8	80%	0.804	74%	0.738	S	S	*	*			trans	-58.6	122	163.8	-172.6	-179.5	32.7	0	0	107.2	G790 R794	G790-Q792 PolarHBondContact O-N 3.38Å; Q792-R794 PolarHBondContact O-N 2.79Å
793	W	30.5	Very low	30.1	Very low	177 Å²	177	133.4 Å²	133.4	67%	0.67	73%	0.727	S	S	*	*			trans	-59.7	105.8	167.3	-78.5	97.3	0	0	0	107.6	H791 R795 E1012	H791-W793 PolarHBondContact O-N 2.96Å; W793-R795 PolarHBondContact O-N 3.43Å; W793-E1012 PolarHBondContact NE1-OE2 2.7Å
794	R	25.4	Very low	29.8	Very low	176 Å²	176	139.4 Å²	139.4	66%	0.664	73%	0.731	S	S	*	*			trans	-64	92.9	164.1	-78.2	-167.6	175.7	-165.8	-0.4	107.8	Q792 D796 V797	Q792-R794 PolarHBondContact O-N 2.79Å; R794-D796 PolarHBondContact O-N 2.82Å; R794-V797 HydrophobicContact CB-CB 4.14Å; R794-V797 HydrophobicContact CB-CG2 3.55Å; R794-V797 HydrophobicContact CG-CG2 4.29Å; R794-V797 PolarHBondContact O-N 3.43Å
795	R	31.3	Very low	29.7	Very low	227 Å²	227	134.8 Å²	134.8	86%	0.857	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-51.9	-23.5	169	-148.7	172.9	-74.1	163	-4.8	110.5	W793	W793-R795 PolarHBondContact O-N 3.43Å
796	D	29.5	Very low	29.5	Very low	107 Å²	107	130.5 Å²	130.5	57%	0.572	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-89	-13.5	-175.4	-14.5	-80.3	0	0	0	113.6	R794 W798 S799	R794-D796 PolarHBondContact O-N 2.82Å; D796-W798 PolarHBondContact O-N 2.97Å; D796-S799 WeakPolarHBondContact O-CB 3.27Å; D796-S799 PolarHBondContact O-N 2.83Å; D796-S799 PolarHBondContact O-OG 3.4Å
797	V	33.1	Very low	29.8	Very low	94 Å²	94	131.5 Å²	131.5	57%	0.57	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-69.7	-14.8	171.4	165.1	0	0	0	0	111.7	R794	R794-V797 HydrophobicContact CB-CB 4.14Å; R794-V797 HydrophobicContact CB-CG2 3.55Å; R794-V797 HydrophobicContact CG-CG2 4.29Å; R794-V797 PolarHBondContact O-N 3.43Å
798	W	30.1	Very low	30.6	Very low	203 Å²	203	127.8 Å²	127.8	77%	0.769	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-100.4	29.1	168	-67.9	71.7	0	0	0	112.5	D796 A800 I803	D796-W798 PolarHBondContact O-N 2.97Å; W798-A800 PolarHBondContact O-N 3Å; W798-I803 HydrophobicContact CE3-CD1 4.49Å
799	S	25.8	Very low	32.5	Very low	79 Å²	79	120 Å²	120	55%	0.552	68%	0.675	S	S	*	*			trans	-51.5	137.7	158.3	-71.8	0	0	0	0	110.1	D796 G801	D796-S799 WeakPolarHBondContact O-CB 3.27Å; D796-S799 PolarHBondContact O-N 2.83Å; D796-S799 PolarHBondContact O-OG 3.4Å; S799-G801 PolarHBondContact O-N 2.9Å
800	A	30.2	Very low	34.8	Very low	95 Å²	95	121 Å²	121	79%	0.785	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	8.1	-162.6	0	0	0	0	0	116.7	W798	W798-A800 PolarHBondContact O-N 3Å
801	G	28.2	Very low	37.1	Very low	55 Å²	55	127.9 Å²	127.9	57%	0.567	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-26.6	-178.4	0	0	0	0	0	115.3	S799	S799-G801 PolarHBondContact O-N 2.9Å
802	T	32.8	Very low	39.6	Very low	126 Å²	126	126.8 Å²	126.8	77%	0.773	66%	0.659	S	S	*	*	S	Bend	trans	-83.8	-15.1	-174.1	-42.1	0	0	0	0	113	R804	T802-R804 VanDerWaalsContact C-N 3.25Å; T802-R804 PolarHBondContact O-N 2.89Å; T802-R804 VanDerWaalsContact O-N 3.1Å
803	I	35.9	Very low	42.3	Very low	109 Å²	109	121.6 Å²	121.6	56%	0.559	63%	0.631	S	S	*	*			trans	-88	60.2	175.2	-45.2	-178.4	0	0	0	110.1	W798 G805	W798-I803 HydrophobicContact CE3-CD1 4.49Å; I803-G805 PolarHBondContact O-N 3.29Å
804	R	28.5	Very low	45.1	Very low	248 Å²	248	115.6 Å²	115.6	94%	0.936	61%	0.614	S	S	*	*			trans	-76.1	64	161.1	-67.2	-166.2	-177.2	-151.5	2.1	109.1	T802	T802-R804 VanDerWaalsContact C-N 3.25Å; T802-R804 PolarHBondContact O-N 2.89Å; T802-R804 VanDerWaalsContact O-N 3.1Å
805	G	29.5	Very low	48.2	Very low	61 Å²	61	107.5 Å²	107.5	63%	0.629	58%	0.584	S	S	*	*	S	Bend	trans	-161.3	30.5	-164	0	0	0	0	0	114.6	I803	I803-G805 PolarHBondContact O-N 3.29Å
806	G	28	Very low	51	Low	58 Å²	58	99.3 Å²	99.3	60%	0.598	56%	0.56	S	S	*	*			trans	81.6	135.4	170.6	0	0	0	0	0	115.7	A808	G806-A808 PolarHBondContact O-N 3.17Å
807	S	35.3	Very low	53.7	Low	129 Å²	129	95.2 Å²	95.2	90%	0.902	54%	0.539	S	S	*	.			trans	-75	79.8	165.2	-171.3	0	0	0	0	109	S809	S807-S809 VanDerWaalsContact C-N 3.25Å; S807-S809 PolarHBondContact O-N 3.08Å
808	A	50.2	Low	56.4	Low	53 Å²	53	96.5 Å²	96.5	44%	0.438	54%	0.538	S	S	.	.			trans	-69.4	81.7	-177.1	0	0	0	0	0	110.7	G806 W810 R872	G806-A808 PolarHBondContact O-N 3.17Å; A808-W810 PolarHBondContact O-N 2.9Å; A808-R872 PolarHBondContact O-NH1 2.88Å; A808-R872 PolarHBondContact O-NH2 2.88Å
809	S	66	Low	59.3	Low	61 Å²	61	91.1 Å²	91.1	43%	0.427	52%	0.522	S	S	.	.			trans	-44.5	129.1	-174.5	-173.4	0	0	0	0	112.3	S807 R811 E812	S807-S809 VanDerWaalsContact C-N 3.25Å; S807-S809 PolarHBondContact O-N 3.08Å; S809-R811 PolarHBondContact O-N 3.31Å; S809-E812 PolarHBondContact O-N 3.32Å; S809-E812 VanDerWaalsContact O-N 3.11Å
810	W	74.6	Confident	62.4	Low	76 Å²	76	87.7 Å²	87.7	29%	0.288	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-54.9	-23.1	-178.4	-69.4	103	0	0	0	113.4	A808 E812 W813 T814 K865 V868 M887	A808-W810 PolarHBondContact O-N 2.9Å; W810-E812 PolarHBondContact O-N 3.16Å; W810-W813 CarbonylContact O-C 3.55Å; W810-W813 PolarHBondContact O-N 2.96Å; W810-T814 PolarHBondContact O-N 3.04Å; W810-T814 PolarHBondContact O-OG1 2.96Å; W810-T814 VanDerWaalsContact O-OG1 3.05Å; W810-K865 HydrophobicContact CD2-CG 4.46Å; W810-K865 HydrophobicContact CH2-CB 3.95Å; W810-K865 HydrophobicContact CH2-CG 4.16Å; W810-K865 WeakPolarHBondContact CH2-O 3.32Å; W810-K865 HydrophobicContact CZ2-CB 3.72Å; W810-K865 HydrophobicContact CZ2-CD 4.42Å; W810-K865 HydrophobicContact CZ2-CG 3.81Å; W810-V868 HydrophobicContact CZ3-CG1 4.41Å; W810-M887 HydrophobicContact CB-SD 4.35Å; W810-M887 HydrophobicContact CD2-CE 3.76Å; W810-M887 HydrophobicContact CE3-CE 3.25Å; W810-M887 HydrophobicContact CE3-SD 4.44Å; W810-M887 HydrophobicContact CG-CE 4.32Å; W810-M887 HydrophobicContact CG-SD 4.49Å; W810-M887 HydrophobicContact CH2-CE 4.42Å; W810-M887 HydrophobicContact CZ3-CE 3.62Å
811	R	77	Confident	65.5	Low	221 Å²	221	92.1 Å²	92.1	83%	0.834	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-47.7	-32.4	173.6	-62.3	179.9	-172.3	174.7	1.7	114.1	S809 W813	S809-R811 PolarHBondContact O-N 3.31Å; R811-W813 VanDerWaalsContact C-N 3.31Å; R811-W813 PolarHBondContact O-N 3.46Å
812	E	80.9	Confident	68.5	Low	136 Å²	136	92.6 Å²	92.6	64%	0.636	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-66.9	-28.7	178.1	179.7	-172	-146.1	0	0	113.2	S809 W810 R872	S809-E812 PolarHBondContact O-N 3.32Å; S809-E812 VanDerWaalsContact O-N 3.11Å; W810-E812 PolarHBondContact O-N 3.16Å; E812-R872 IonicContact OE2-NH2 3.31Å; E812-R872 PolarHBondContact OE2-NH2 3.29Å
813	W	85.4	Confident	71.2	Confident	62 Å²	62	89.4 Å²	89.4	24%	0.235	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-2.4	-175	-56.9	81.6	0	0	0	113.4	W810 R811 I815 R872 F882 G884 C885	W810-W813 CarbonylContact O-C 3.55Å; W810-W813 PolarHBondContact O-N 2.96Å; R811-W813 VanDerWaalsContact C-N 3.31Å; R811-W813 PolarHBondContact O-N 3.46Å; W813-I815 PolarHBondContact O-N 2.96Å; W813-R872 HydrophobicContact CD2-CG 4.28Å; W813-R872 HydrophobicContact CG-CG 4.31Å; W813-R872 VanDerWaalsContact NE1-NH2 3.18Å; W813-F882 HydrophobicContact CD2-CE1 4.04Å; W813-F882 AromaticContact CE3-CD1 3.76Å; W813-F882 HydrophobicContact CE3-CD1 3.76Å; W813-F882 AromaticContact CE3-CE1 3.35Å; W813-F882 HydrophobicContact CE3-CE1 3.35Å; W813-F882 HydrophobicContact CE3-CZ 4.41Å; W813-F882 AromaticContact CZ3-CD1 3.8Å; W813-F882 HydrophobicContact CZ3-CD1 3.8Å; W813-F882 AromaticContact CZ3-CE1 3.89Å; W813-F882 HydrophobicContact CZ3-CE1 3.89Å; W813-G884 CarbonylContact O-C 3.59Å; W813-G884 WeakPolarHBondContact O-CA 3.27Å; W813-C885 PolarHBondContact O-N 3.47Å; W813-C885 PolarHBondContact O-SG 3.04Å; W813-C885 VanDerWaalsContact O-SG 3.39Å
814	T	89.7	Confident	73.4	Confident	51 Å²	51	93.1 Å²	93.1	31%	0.313	47%	0.468	S	S	.	.	B	Isolated β-bridge	trans	-82.5	109.7	174.9	-65.6	0	0	0	0	109.5	W810 C885 M887	W810-T814 PolarHBondContact O-N 3.04Å; W810-T814 PolarHBondContact O-OG1 2.96Å; W810-T814 VanDerWaalsContact O-OG1 3.05Å; T814-C885 CarbonylContact C-O 3.58Å; T814-C885 WeakPolarHBondContact CA-O 3.46Å; T814-M887 HydrophobicContact CG2-CB 4.11Å; T814-M887 HydrophobicContact CG2-CG 4.34Å
815	I	91.2	Very high	75.8	Confident	7 Å²	7	86.4 Å²	86.4	4%	0.036	45%	0.451	C	S	.	.			trans	-93	122.3	174	-62.7	168.1	0	0	0	108.2	W813 I817 V820 W841 C885 V895	W813-I815 PolarHBondContact O-N 2.96Å; I815-I817 PolarHBondContact O-N 2.95Å; I815-V820 HydrophobicContact CG2-CG2 3.64Å; I815-W841 HydrophobicContact CD1-CD2 3.9Å; I815-W841 HydrophobicContact CD1-CE3 3.91Å; I815-W841 HydrophobicContact CD1-CH2 3.74Å; I815-W841 HydrophobicContact CD1-CZ2 3.73Å; I815-W841 HydrophobicContact CD1-CZ3 3.83Å; I815-W841 HydrophobicContact CG1-CH2 4.11Å; I815-W841 HydrophobicContact CG1-CZ2 3.72Å; I815-W841 HydrophobicContact CG2-CD2 4.27Å; I815-W841 HydrophobicContact CG2-CG 4.25Å; I815-W841 HydrophobicContact CG2-CZ2 4.33Å; I815-C885 PolarHBondContact N-O 3.39Å; I815-V895 HydrophobicContact CD1-CB 3.9Å; I815-V895 HydrophobicContact CD1-CG1 4.07Å; I815-V895 HydrophobicContact CD1-CG2 3.95Å
816	P	89.6	Confident	78.3	Confident	54 Å²	54	84.5 Å²	84.5	35%	0.351	43%	0.428	S	S	.	.			trans	-56.6	129.7	170.6	-23.9	34.6	0	0	0	110.9	E818 E819	P816-E818 PolarHBondContact O-N 2.93Å; P816-E818 VanDerWaalsContact O-N 3.11Å; P816-E819 HydrophobicContact CB-CG 4.19Å; P816-E819 WeakPolarHBondContact CD-OE1 3.39Å; P816-E819 HydrophobicContact CG-CG 4.41Å; P816-E819 WeakPolarHBondContact CG-OE1 3.22Å; P816-E819 PolarHBondContact O-N 3.11Å
817	I	86.4	Confident	81.2	Confident	22 Å²	22	85.3 Å²	85.3	11%	0.113	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-21.9	-178.2	-170.9	65.2	0	0	0	111.7	I815 V820 F822 C886 K888 R891	I815-I817 PolarHBondContact O-N 2.95Å; I817-V820 PolarHBondContact O-N 2.66Å; I817-F822 HydrophobicContact CD1-CE2 3.8Å; I817-F822 HydrophobicContact CD1-CZ 3.86Å; I817-F822 HydrophobicContact CG1-CE2 4.47Å; I817-C886 HydrophobicContact CB-CB 4.4Å; I817-C886 HydrophobicContact CD1-CB 4.09Å; I817-K888 HydrophobicContact CG2-CD 4.25Å; I817-R891 HydrophobicContact CG1-CB 4.43Å
818	E	88.3	Confident	83.5	Confident	120 Å²	120	81.4 Å²	81.4	56%	0.561	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-26.3	175.7	-61.8	77.7	-171.9	0	0	113.5	P816 V820 K888	P816-E818 PolarHBondContact O-N 2.93Å; P816-E818 VanDerWaalsContact O-N 3.11Å; E818-V820 VanDerWaalsContact C-N 3.35Å; E818-K888 IonicContact OE1-NZ 3.88Å; E818-K888 PolarHBondContact OE1-NZ 3.12Å
819	E	91.6	Very high	84.9	Confident	91 Å²	91	79.6 Å²	79.6	43%	0.425	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-22	173.7	-66.2	175.2	-165.6	0	0	112.5	P816 R821 W841	P816-E819 HydrophobicContact CB-CG 4.19Å; P816-E819 WeakPolarHBondContact CD-OE1 3.39Å; P816-E819 HydrophobicContact CG-CG 4.41Å; P816-E819 WeakPolarHBondContact CG-OE1 3.22Å; P816-E819 PolarHBondContact O-N 3.11Å; E819-R821 PolarHBondContact O-N 2.68Å; E819-W841 PolarHBondContact OE2-NE1 2.95Å
820	V	92	Very high	85.5	Confident	6 Å²	6	85.7 Å²	85.7	4%	0.036	39%	0.387	C	S	.	.			trans	-85.4	96.9	-170.9	-179	0	0	0	0	110.1	I815 I817 E818 F822 A839 W841 V847	I815-V820 HydrophobicContact CG2-CG2 3.64Å; I817-V820 PolarHBondContact O-N 2.66Å; E818-V820 VanDerWaalsContact C-N 3.35Å; V820-F822 HydrophobicContact CB-CE2 4.28Å; V820-F822 HydrophobicContact CG1-CD2 4.39Å; V820-F822 HydrophobicContact CG1-CE2 3.89Å; V820-F822 HydrophobicContact CG1-CZ 4.08Å; V820-F822 WeakPolarHBondContact O-CD2 3.43Å; V820-F822 WeakPolarHBondContact O-CE2 3.38Å; V820-F822 PolarHBondContact O-N 2.8Å; V820-A839 HydrophobicContact CG1-CB 3.73Å; V820-W841 HydrophobicContact CG2-CB 4.5Å; V820-V847 HydrophobicContact CG1-CG2 3.63Å
821	R	93.6	Very high	85.2	Confident	188 Å²	188	84.3 Å²	84.3	71%	0.709	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	91.9	-176.4	-61.9	-176.6	-175.1	-178	1.4	111.1	E819 A839 Y840	E819-R821 PolarHBondContact O-N 2.68Å; R821-A839 CarbonylContact O-C 3.39Å; R821-A839 WeakPolarHBondContact O-CA 3.48Å; R821-Y840 PolarHBondContact N-O 3.26Å; R821-Y840 PolarHBondContact O-N 3.41Å
822	F	92.1	Very high	84.7	Confident	65 Å²	65	77.5 Å²	77.5	29%	0.285	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	135.2	173.1	-67.4	-93.5	0	0	0	111.3	I817 V820 H837 A839 V847 L849	I817-F822 HydrophobicContact CD1-CE2 3.8Å; I817-F822 HydrophobicContact CD1-CZ 3.86Å; I817-F822 HydrophobicContact CG1-CE2 4.47Å; V820-F822 HydrophobicContact CB-CE2 4.28Å; V820-F822 HydrophobicContact CG1-CD2 4.39Å; V820-F822 HydrophobicContact CG1-CE2 3.89Å; V820-F822 HydrophobicContact CG1-CZ 4.08Å; V820-F822 WeakPolarHBondContact O-CD2 3.43Å; V820-F822 WeakPolarHBondContact O-CE2 3.38Å; V820-F822 PolarHBondContact O-N 2.8Å; F822-H837 HydrophobicContact CD1-CB 3.72Å; F822-H837 HydrophobicContact CE1-CB 3.79Å; F822-A839 HydrophobicContact CD1-CB 4.31Å; F822-A839 HydrophobicContact CG-CB 4.43Å; F822-V847 HydrophobicContact CE1-CB 4.18Å; F822-V847 HydrophobicContact CE1-CG1 4.16Å; F822-V847 HydrophobicContact CE1-CG2 4.49Å; F822-V847 HydrophobicContact CZ-CB 4.5Å; F822-V847 HydrophobicContact CZ-CG1 4.07Å; F822-L849 HydrophobicContact CE1-CD1 4.37Å; F822-L849 HydrophobicContact CZ-CD2 4.49Å
823	K	90.4	Very high	84	Confident	59 Å²	59	72.6 Å²	72.6	26%	0.257	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	158.7	-178.7	-71.2	161.7	177.2	147.5	0	112.1	D825 S826 A838 A839 D844	K823-D825 PolarHBondContact O-N 3.35Å; K823-S826 WeakPolarHBondContact O-CB 3.4Å; K823-S826 PolarHBondContact O-N 3.47Å; K823-S826 VanDerWaalsContact O-N 3.15Å; K823-S826 PolarHBondContact O-OG 3.07Å; K823-A838 WeakPolarHBondContact CB-O 3.41Å; K823-A838 HydrophobicContact CD-CB 3.9Å; K823-A838 PolarHBondContact N-O 3.32Å; K823-A839 WeakPolarHBondContact CE-O 3.48Å; K823-A839 PolarHBondContact NZ-O 2.82Å; K823-D844 WeakPolarHBondContact CE-OD1 3.5Å; K823-D844 VanDerWaalsContact NZ-CG 3.34Å; K823-D844 IonicContact NZ-OD1 3.67Å; K823-D844 PolarHBondContact NZ-OD1 3.35Å
824	K	80.9	Confident	83.6	Confident	188 Å²	188	70.1 Å²	70.1	82%	0.817	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.1	135.1	161.7	-175.4	167.9	-178	175	0	108.8	S826	K824-S826 VanDerWaalsContact C-N 3.27Å; K824-S826 PolarHBondContact O-N 2.74Å
825	D	78.7	Confident	83.5	Confident	107 Å²	107	70.5 Å²	70.5	57%	0.572	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	55.6	40	-171.8	-36.4	-33.9	0	0	0	112.2	K717 K823 L827	K717-D825 IonicContact NZ-OD2 2.87Å; K717-D825 PolarHBondContact NZ-OD2 3.26Å; K823-D825 PolarHBondContact O-N 3.35Å; D825-L827 VanDerWaalsContact C-N 3.31Å; D825-L827 PolarHBondContact O-N 2.74Å
826	S	83.6	Confident	83.5	Confident	21 Å²	21	72.1 Å²	72.1	15%	0.147	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	-26.8	-171.3	48.8	0	0	0	0	115.4	K823 K824 I828 H837 A838	K823-S826 WeakPolarHBondContact O-CB 3.4Å; K823-S826 PolarHBondContact O-N 3.47Å; K823-S826 VanDerWaalsContact O-N 3.15Å; K823-S826 PolarHBondContact O-OG 3.07Å; K824-S826 VanDerWaalsContact C-N 3.27Å; K824-S826 PolarHBondContact O-N 2.74Å; S826-I828 PolarHBondContact O-N 2.9Å; S826-H837 CarbonylContact O-C 3.57Å; S826-H837 VanDerWaalsContact O-CA 3.32Å; S826-H837 WeakPolarHBondContact O-CA 3.14Å; S826-H837 PolarHBondContact OG-ND1 2.92Å; S826-A838 WeakPolarHBondContact CB-O 3.2Å; S826-A838 PolarHBondContact O-N 2.94Å
827	L	87.1	Confident	83.7	Confident	74 Å²	74	70.6 Å²	70.6	39%	0.387	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	107.4	-173.6	-176	62.8	0	0	0	111.2	D825 R830 E835	D825-L827 VanDerWaalsContact C-N 3.31Å; D825-L827 PolarHBondContact O-N 2.74Å; L827-R830 HydrophobicContact CD1-CG 4.06Å; L827-R830 HydrophobicContact CD2-CG 4.05Å; L827-E835 HydrophobicContact CD1-CB 4.05Å
828	I	85.4	Confident	84	Confident	47 Å²	47	70.3 Å²	70.3	24%	0.241	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	-34.4	176	-59.3	171.4	0	0	0	109.9	F720 S826 V836 A838 A846 L898	F720-I828 WeakPolarHBondContact CD2-O 3.37Å; S826-I828 PolarHBondContact O-N 2.9Å; I828-V836 HydrophobicContact CB-CG1 4.43Å; I828-V836 WeakPolarHBondContact CB-O 3.49Å; I828-V836 HydrophobicContact CD1-CG1 4.24Å; I828-V836 PolarHBondContact N-O 3.45Å; I828-A838 HydrophobicContact CD1-CB 3.88Å; I828-A838 HydrophobicContact CG1-CB 3.93Å; I828-A846 HydrophobicContact CD1-CB 4.4Å; I828-L898 HydrophobicContact CD1-CD1 3.47Å; I828-L898 VanDerWaalsContact CD1-CD1 3.47Å
829	G	78.7	Confident	84.3	Confident	16 Å²	16	64.6 Å²	64.6	17%	0.165	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.4	155.2	174.8	0	0	0	0	0	113.1	V836	G829-V836 PolarHBondContact N-O 2.86Å; G829-V836 PolarHBondContact O-N 2.65Å
830	R	78.8	Confident	84.5	Confident	188 Å²	188	65.6 Å²	65.6	71%	0.709	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	144	171.5	-70.5	178.2	157.7	170	-8.5	110.3	L827 E835	L827-R830 HydrophobicContact CD1-CG 4.06Å; L827-R830 HydrophobicContact CD2-CG 4.05Å; R830-E835 HydrophobicContact CG-CG 4.38Å; R830-E835 IonicContact CZ-OE1 3.88Å; R830-E835 IonicContact NE-OE1 2.58Å; R830-E835 PolarHBondContact NE-OE1 2.84Å; R830-E835 IonicContact NH2-OE1 3.87Å; R830-E835 PolarHBondContact NH2-OE1 2.94Å
831	G	67.8	Low	84.6	Confident	48 Å²	48	67.6 Å²	67.6	50%	0.495	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	170.9	173.3	0	0	0	0	0	112.2	F833 G834	G831-F833 PolarHBondContact O-N 3.26Å; G831-G834 PolarHBondContact N-O 3.36Å; G831-G834 PolarHBondContact O-N 3.29Å
832	R	66.3	Low	84.5	Confident	78 Å²	78	65.5 Å²	65.5	29%	0.294	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-8.2	178.5	-59.5	-177.2	71.3	125.1	-0.8	114.4	R969 L970 S983	R832-R969 PolarHBondContact NE-O 3.04Å; R832-R969 PolarHBondContact NH2-O 2.74Å; R832-L970 VanDerWaalsContact NH2-CA 3.32Å; R832-L970 PolarHBondContact NH2-O 2.9Å; R832-S983 PolarHBondContact NH1-O 2.73Å; R832-S983 PolarHBondContact NH1-OG 2.83Å
833	F	66.8	Low	84.5	Confident	32 Å²	32	66.9 Å²	66.9	14%	0.14	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-8.9	176	-58.7	-83.2	0	0	0	112.6	G831 L850 N851 L964 F965	G831-F833 PolarHBondContact O-N 3.26Å; F833-L850 HydrophobicContact CB-CD2 4.31Å; F833-L850 VanDerWaalsContact O-CA 3.32Å; F833-L850 WeakPolarHBondContact O-CA 3.33Å; F833-L850 VanDerWaalsContact O-CD2 3.3Å; F833-L850 WeakPolarHBondContact O-CD2 3.34Å; F833-N851 PolarHBondContact O-N 2.98Å; F833-L964 WeakPolarHBondContact CE1-O 3.5Å; F833-F965 HydrophobicContact CZ-CD2 4.05Å
834	G	77.6	Confident	84.7	Confident	11 Å²	11	65.5 Å²	65.5	11%	0.113	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	122.9	-157.2	-171.2	0	0	0	0	0	112.9	G831 L849	G831-G834 PolarHBondContact N-O 3.36Å; G831-G834 PolarHBondContact O-N 3.29Å; G834-L849 CarbonylContact C-O 3.5Å; G834-L849 WeakPolarHBondContact CA-O 3.43Å
835	E	87.3	Confident	85.4	Confident	58 Å²	58	56.6 Å²	56.6	27%	0.271	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	138.5	-171	-53.5	-163.8	121.9	0	0	111.7	L827 R830 H837 K848 L849	L827-E835 HydrophobicContact CD1-CB 4.05Å; R830-E835 HydrophobicContact CG-CG 4.38Å; R830-E835 IonicContact CZ-OE1 3.88Å; R830-E835 IonicContact NE-OE1 2.58Å; R830-E835 PolarHBondContact NE-OE1 2.84Å; R830-E835 IonicContact NH2-OE1 3.87Å; R830-E835 PolarHBondContact NH2-OE1 2.94Å; E835-H837 WeakPolarHBondContact CB-NE2 3.39Å; E835-H837 IonicContact OE2-NE2 2.7Å; E835-H837 PolarHBondContact OE2-NE2 3.47Å; E835-K848 CarbonylContact O-C 3.5Å; E835-K848 WeakPolarHBondContact O-CA 3.43Å; E835-L849 PolarHBondContact N-O 2.96Å; E835-L849 PolarHBondContact O-N 2.75Å
836	V	90.6	Very high	86.1	Confident	41 Å²	41	51.8 Å²	51.8	25%	0.248	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	119.3	176.2	-172.5	0	0	0	0	109.7	I828 G829 A846 V847 K848	I828-V836 HydrophobicContact CB-CG1 4.43Å; I828-V836 WeakPolarHBondContact CB-O 3.49Å; I828-V836 HydrophobicContact CD1-CG1 4.24Å; I828-V836 PolarHBondContact N-O 3.45Å; G829-V836 PolarHBondContact N-O 2.86Å; G829-V836 PolarHBondContact O-N 2.65Å; V836-A846 HydrophobicContact CG1-CB 4.34Å; V836-V847 WeakPolarHBondContact CA-O 3.18Å; V836-K848 HydrophobicContact CG2-CB 4.34Å; V836-K848 HydrophobicContact CG2-CG 4.1Å
837	H	93.2	Very high	86.5	Confident	23 Å²	23	50.8 Å²	50.8	11%	0.106	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	138.6	-176.2	-68.2	-100.2	0	0	0	112.7	F822 S826 E835 A839 A846 V847	F822-H837 HydrophobicContact CD1-CB 3.72Å; F822-H837 HydrophobicContact CE1-CB 3.79Å; S826-H837 CarbonylContact O-C 3.57Å; S826-H837 VanDerWaalsContact O-CA 3.32Å; S826-H837 WeakPolarHBondContact O-CA 3.14Å; S826-H837 PolarHBondContact OG-ND1 2.92Å; E835-H837 WeakPolarHBondContact CB-NE2 3.39Å; E835-H837 IonicContact OE2-NE2 2.7Å; E835-H837 PolarHBondContact OE2-NE2 3.47Å; H837-A839 PolarHBondContact O-N 3.03Å; H837-A846 CarbonylContact O-C 3.59Å; H837-A846 WeakPolarHBondContact O-CA 3.31Å; H837-V847 PolarHBondContact N-O 2.98Å; H837-V847 PolarHBondContact O-N 2.67Å
838	A	94	Very high	86.7	Confident	15 Å²	15	47.7 Å²	47.7	12%	0.124	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	118.4	163.4	0	0	0	0	0	109.3	K823 S826 I828 L898	K823-A838 WeakPolarHBondContact CB-O 3.41Å; K823-A838 HydrophobicContact CD-CB 3.9Å; K823-A838 PolarHBondContact N-O 3.32Å; S826-A838 WeakPolarHBondContact CB-O 3.2Å; S826-A838 PolarHBondContact O-N 2.94Å; I828-A838 HydrophobicContact CD1-CB 3.88Å; I828-A838 HydrophobicContact CG1-CB 3.93Å; A838-L898 HydrophobicContact CB-CD2 4.41Å
839	A	95.1	Very high	86.8	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	-176.8	175.3	0	0	0	0	0	110.6	V820 R821 F822 K823 H837 V845 V847	V820-A839 HydrophobicContact CG1-CB 3.73Å; R821-A839 CarbonylContact O-C 3.39Å; R821-A839 WeakPolarHBondContact O-CA 3.48Å; F822-A839 HydrophobicContact CD1-CB 4.31Å; F822-A839 HydrophobicContact CG-CB 4.43Å; K823-A839 WeakPolarHBondContact CE-O 3.48Å; K823-A839 PolarHBondContact NZ-O 2.82Å; H837-A839 PolarHBondContact O-N 3.03Å; A839-V845 HydrophobicContact CB-CG2 3.94Å; A839-V845 PolarHBondContact N-O 2.98Å; A839-V845 PolarHBondContact O-N 3.45Å; A839-V845 VanDerWaalsContact O-N 3.07Å; A839-V847 HydrophobicContact CB-CG2 3.68Å
840	Y	94.9	Very high	86.8	Confident	112 Å²	112	46.7 Å²	46.7	44%	0.439	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	124.9	173.4	-177.7	-85.3	0	0	0	109.4	R821 H842 Q843	R821-Y840 PolarHBondContact N-O 3.26Å; R821-Y840 PolarHBondContact O-N 3.41Å; Y840-H842 PolarHBondContact OH-O 3.42Å; Y840-Q843 WeakPolarHBondContact CA-O 3.47Å; Y840-Q843 WeakPolarHBondContact CD2-O 3.39Å
841	W	93.3	Very high	86.4	Confident	48 Å²	48	40.6 Å²	40.6	18%	0.182	21%	0.206	C	C	.	.	S	Bend	trans	-147.4	100.7	173.4	177.8	78.9	0	0	0	107.2	I815 E819 V820 Q843 V845 M883	I815-W841 HydrophobicContact CD1-CD2 3.9Å; I815-W841 HydrophobicContact CD1-CE3 3.91Å; I815-W841 HydrophobicContact CD1-CH2 3.74Å; I815-W841 HydrophobicContact CD1-CZ2 3.73Å; I815-W841 HydrophobicContact CD1-CZ3 3.83Å; I815-W841 HydrophobicContact CG1-CH2 4.11Å; I815-W841 HydrophobicContact CG1-CZ2 3.72Å; I815-W841 HydrophobicContact CG2-CD2 4.27Å; I815-W841 HydrophobicContact CG2-CG 4.25Å; I815-W841 HydrophobicContact CG2-CZ2 4.33Å; E819-W841 PolarHBondContact OE2-NE1 2.95Å; V820-W841 HydrophobicContact CG2-CB 4.5Å; W841-Q843 PolarHBondContact N-O 2.9Å; W841-Q843 PolarHBondContact O-N 2.99Å; W841-V845 HydrophobicContact CB-CG1 4.38Å; W841-V845 HydrophobicContact CB-CG2 4.11Å; W841-M883 HydrophobicContact CE3-CB 4.48Å; W841-M883 HydrophobicContact CE3-SD 4.18Å; W841-M883 HydrophobicContact CZ3-CB 4.01Å; W841-M883 HydrophobicContact CZ3-SD 4.24Å
842	H	91.3	Very high	86.5	Confident	144 Å²	144	38.8 Å²	38.8	67%	0.667	18%	0.184	S	C	*	.	S	Bend	trans	54.3	-27.3	-161.8	-58.6	-74.3	0	0	0	116.9	Y840	Y840-H842 PolarHBondContact OH-O 3.42Å
843	Q	92.9	Very high	86.5	Confident	94 Å²	94	41.4 Å²	41.4	44%	0.439	20%	0.204	S	C	.	.	S	Bend	trans	-150.9	-177	177.8	62.6	-171.3	-39.4	0	0	110.1	Y840 W841 V845 M883	Y840-Q843 WeakPolarHBondContact CA-O 3.47Å; Y840-Q843 WeakPolarHBondContact CD2-O 3.39Å; W841-Q843 PolarHBondContact N-O 2.9Å; W841-Q843 PolarHBondContact O-N 2.99Å; Q843-V845 HydrophobicContact CG-CG1 4.24Å; Q843-V845 PolarHBondContact O-N 3.31Å; Q843-M883 HydrophobicContact CG-CE 4.09Å; Q843-M883 HydrophobicContact CG-SD 4.48Å
844	D	94.1	Very high	86.1	Confident	31 Å²	31	44.1 Å²	44.1	17%	0.166	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	113.9	174.7	-84.1	-17.3	0	0	0	111.7	R715 K823 L898	R715-D844 IonicContact CZ-OD2 3.29Å; R715-D844 IonicContact NH1-OD2 2.94Å; R715-D844 PolarHBondContact NH1-OD2 2.93Å; R715-D844 IonicContact NH2-OD2 3.53Å; R715-D844 PolarHBondContact NH2-OD2 3.01Å; K823-D844 WeakPolarHBondContact CE-OD1 3.5Å; K823-D844 VanDerWaalsContact NZ-CG 3.34Å; K823-D844 IonicContact NZ-OD1 3.67Å; K823-D844 PolarHBondContact NZ-OD1 3.35Å; D844-L898 HydrophobicContact CB-CB 4.24Å; D844-L898 HydrophobicContact CB-CD2 4.1Å; D844-L898 VanDerWaalsContact O-CB 3.3Å; D844-L898 WeakPolarHBondContact O-CB 3.35Å; D844-L898 PolarHBondContact O-N 2.96Å
845	V	95.4	Very high	85.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	155.6	-177.6	-60.1	0	0	0	0	112.5	A839 W841 Q843 V847 M883 V895 M896	A839-V845 HydrophobicContact CB-CG2 3.94Å; A839-V845 PolarHBondContact N-O 2.98Å; A839-V845 PolarHBondContact O-N 3.45Å; A839-V845 VanDerWaalsContact O-N 3.07Å; W841-V845 HydrophobicContact CB-CG1 4.38Å; W841-V845 HydrophobicContact CB-CG2 4.11Å; Q843-V845 HydrophobicContact CG-CG1 4.24Å; Q843-V845 PolarHBondContact O-N 3.31Å; V845-V847 HydrophobicContact CG2-CG2 4.13Å; V845-M883 HydrophobicContact CG1-CE 4.02Å; V845-M883 HydrophobicContact CG1-SD 3.48Å; V845-M883 WeakPolarHBondContact CG1-SD 3.44Å; V845-V895 HydrophobicContact CB-CG1 4.04Å; V845-V895 HydrophobicContact CG1-CG1 4.19Å; V845-V895 HydrophobicContact CG2-CG1 4.13Å; V845-M896 CarbonylContact C-O 3.57Å; V845-M896 WeakPolarHBondContact CA-O 3.4Å; V845-M896 WeakPolarHBondContact CB-O 3.39Å
846	A	94.3	Very high	84	Confident	7 Å²	7	46.9 Å²	46.9	6%	0.058	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	135.4	162.6	0	0	0	0	0	109.1	I828 V836 H837 M896 L898	I828-A846 HydrophobicContact CD1-CB 4.4Å; V836-A846 HydrophobicContact CG1-CB 4.34Å; H837-A846 CarbonylContact O-C 3.59Å; H837-A846 WeakPolarHBondContact O-CA 3.31Å; A846-M896 HydrophobicContact CB-CG 3.91Å; A846-M896 PolarHBondContact N-O 3.47Å; A846-M896 PolarHBondContact O-N 3.41Å; A846-L898 HydrophobicContact CB-CD1 4.04Å
847	V	93	Very high	82.8	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	110.2	-179.8	-176.1	0	0	0	0	107.5	V820 F822 V836 H837 A839 V845 L849 I894	V820-V847 HydrophobicContact CG1-CG2 3.63Å; F822-V847 HydrophobicContact CE1-CB 4.18Å; F822-V847 HydrophobicContact CE1-CG1 4.16Å; F822-V847 HydrophobicContact CE1-CG2 4.49Å; F822-V847 HydrophobicContact CZ-CB 4.5Å; F822-V847 HydrophobicContact CZ-CG1 4.07Å; V836-V847 WeakPolarHBondContact CA-O 3.18Å; H837-V847 PolarHBondContact N-O 2.98Å; H837-V847 PolarHBondContact O-N 2.67Å; A839-V847 HydrophobicContact CB-CG2 3.68Å; V845-V847 HydrophobicContact CG2-CG2 4.13Å; V847-L849 HydrophobicContact CG1-CD2 3.92Å; V847-L849 HydrophobicContact CG1-CG 4.31Å; V847-L849 PolarHBondContact O-N 3.13Å; V847-I894 WeakPolarHBondContact CA-O 3.26Å
848	K	90.6	Very high	81.4	Confident	8 Å²	8	58.1 Å²	58.1	4%	0.035	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	95	175.9	-176.7	177.1	-175.9	-177	0	108.4	E835 V836 L850 G893 I894 M896 D961 L964	E835-K848 CarbonylContact O-C 3.5Å; E835-K848 WeakPolarHBondContact O-CA 3.43Å; V836-K848 HydrophobicContact CG2-CB 4.34Å; V836-K848 HydrophobicContact CG2-CG 4.1Å; K848-L850 HydrophobicContact CD-CD2 3.95Å; K848-L850 HydrophobicContact CG-CD2 3.83Å; K848-L850 PolarHBondContact O-N 3.42Å; K848-G893 CarbonylContact O-C 3.6Å; K848-G893 WeakPolarHBondContact O-CA 3.24Å; K848-I894 HydrophobicContact CB-CB 4.46Å; K848-I894 PolarHBondContact N-O 3.34Å; K848-I894 PolarHBondContact O-N 2.94Å; K848-M896 HydrophobicContact CB-CE 4.07Å; K848-D961 IonicContact NZ-OD1 2.62Å; K848-D961 PolarHBondContact NZ-OD1 2.92Å; K848-L964 HydrophobicContact CD-CD1 4.16Å
849	L	87.7	Confident	80.4	Confident	32 Å²	32	62.2 Å²	62.2	17%	0.168	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	121.6	171.4	-60.9	177.8	0	0	0	107.6	F822 G834 E835 V847	F822-L849 HydrophobicContact CE1-CD1 4.37Å; F822-L849 HydrophobicContact CZ-CD2 4.49Å; G834-L849 CarbonylContact C-O 3.5Å; G834-L849 WeakPolarHBondContact CA-O 3.43Å; E835-L849 PolarHBondContact N-O 2.96Å; E835-L849 PolarHBondContact O-N 2.75Å; V847-L849 HydrophobicContact CG1-CD2 3.92Å; V847-L849 HydrophobicContact CG1-CG 4.31Å; V847-L849 PolarHBondContact O-N 3.13Å
850	L	78.6	Confident	79.3	Confident	11 Å²	11	62.9 Å²	62.9	6%	0.058	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	129.6	-175.2	-66.7	-178.8	0	0	0	110.9	F833 K848 M852 F864 E867 L892 I894	F833-L850 HydrophobicContact CB-CD2 4.31Å; F833-L850 VanDerWaalsContact O-CA 3.32Å; F833-L850 WeakPolarHBondContact O-CA 3.33Å; F833-L850 VanDerWaalsContact O-CD2 3.3Å; F833-L850 WeakPolarHBondContact O-CD2 3.34Å; K848-L850 HydrophobicContact CD-CD2 3.95Å; K848-L850 HydrophobicContact CG-CD2 3.83Å; K848-L850 PolarHBondContact O-N 3.42Å; L850-M852 HydrophobicContact CB-CE 4.21Å; L850-M852 PolarHBondContact O-N 3.42Å; L850-F864 HydrophobicContact CD1-CD2 3.9Å; L850-F864 HydrophobicContact CD1-CE2 3.86Å; L850-E867 WeakPolarHBondContact CD1-OE2 3.37Å; L850-L892 PolarHBondContact N-O 3.29Å; L850-I894 HydrophobicContact CD1-CD1 4.13Å; L850-I894 HydrophobicContact CD1-CG1 4.38Å
851	N	70.7	Confident	78.4	Confident	60 Å²	60	59.8 Å²	59.8	32%	0.321	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-72.4	126.1	168.7	-179.5	-75.5	0	0	0	108.7	F833 D853 H854 R969	F833-N851 PolarHBondContact O-N 2.98Å; N851-D853 VanDerWaalsContact CG-OD1 3.28Å; N851-D853 PolarHBondContact ND2-OD1 3.48Å; N851-D853 PolarHBondContact ND2-OD2 3.01Å; N851-D853 PolarHBondContact OD1-N 3.48Å; N851-D853 PolarHBondContact OD1-OD1 3.47Å; N851-H854 PolarHBondContact O-CE1 3.44Å; N851-R969 PolarHBondContact O-NH1 3.36Å
852	M	68.4	Low	77.5	Confident	9 Å²	9	63.5 Å²	63.5	4%	0.044	31%	0.311	C	S	.	.			trans	-122.2	3.4	-173.9	-63.2	-83.6	84	0	0	112.4	L850 H854 V855 Q860 L892 R969	L850-M852 HydrophobicContact CB-CE 4.21Å; L850-M852 PolarHBondContact O-N 3.42Å; M852-H854 PolarHBondContact O-N 3.34Å; M852-V855 VanDerWaalsContact O-CB 3.31Å; M852-V855 WeakPolarHBondContact O-CB 3.41Å; M852-V855 PolarHBondContact O-N 3.04Å; M852-Q860 HydrophobicContact CB-CB 4.31Å; M852-Q860 HydrophobicContact CB-CG 3.81Å; M852-Q860 HydrophobicContact CG-CB 4.47Å; M852-Q860 HydrophobicContact CG-CG 4.49Å; M852-Q860 HydrophobicContact SD-CB 4.46Å; M852-L892 HydrophobicContact CG-CD1 4.3Å; M852-L892 HydrophobicContact SD-CD1 4.48Å; M852-R969 VanDerWaalsContact CE-NH2 3.3Å
853	D	66.2	Low	76.6	Confident	133 Å²	133	61.1 Å²	61.1	71%	0.711	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-6.1	-167.8	-37.7	0.4	0	0	0	114.8	N851	N851-D853 VanDerWaalsContact CG-OD1 3.28Å; N851-D853 PolarHBondContact ND2-OD1 3.48Å; N851-D853 PolarHBondContact ND2-OD2 3.01Å; N851-D853 PolarHBondContact OD1-N 3.48Å; N851-D853 PolarHBondContact OD1-OD1 3.47Å
854	H	59.1	Low	75.9	Confident	90 Å²	90	56.6 Å²	56.6	42%	0.417	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	9.8	175.5	58.6	-71.3	0	0	0	112.6	N851 M852	N851-H854 PolarHBondContact O-CE1 3.44Å; M852-H854 PolarHBondContact O-N 3.34Å
855	V	60.2	Low	75.3	Confident	20 Å²	20	58 Å²	58	12%	0.121	29%	0.285	C	S	.	.	S	Bend	trans	-137.3	130.1	-173	-179.5	0	0	0	0	109.2	M852 D857 K859 Q860 M863	M852-V855 VanDerWaalsContact O-CB 3.31Å; M852-V855 WeakPolarHBondContact O-CB 3.41Å; M852-V855 PolarHBondContact O-N 3.04Å; V855-D857 PolarHBondContact O-N 3.01Å; V855-K859 HydrophobicContact CG1-CB 3.93Å; V855-Q860 HydrophobicContact CB-CG 3.89Å; V855-Q860 HydrophobicContact CG1-CB 4.41Å; V855-Q860 HydrophobicContact CG1-CG 3.77Å; V855-Q860 WeakPolarHBondContact O-CG 3.49Å; V855-Q860 PolarHBondContact O-NE2 3.28Å; V855-M863 HydrophobicContact CB-CE 4.04Å; V855-M863 HydrophobicContact CG1-CE 3.28Å; V855-M863 HydrophobicContact CG2-CE 3.49Å; V855-M863 VanDerWaalsContact CG2-CE 3.49Å
856	E	61	Low	74.2	Confident	106 Å²	106	62.9 Å²	62.9	50%	0.495	31%	0.314	S	S	.	.			trans	-54.7	130.4	172.8	-64.2	156.7	-177.2	0	0	110.5	E858 K859 Q860	E856-E858 PolarHBondContact O-N 2.78Å; E856-K859 PolarHBondContact O-N 3.01Å; E856-K859 WeakPolarHBondContact OE2-CD 3.44Å; E856-K859 WeakPolarHBondContact OE2-CE 3.45Å; E856-K859 IonicContact OE2-NZ 2.74Å; E856-K859 PolarHBondContact OE2-NZ 3.26Å; E856-Q860 PolarHBondContact O-N 3.07Å
857	D	65.9	Low	73.2	Confident	129 Å²	129	64.2 Å²	64.2	69%	0.69	32%	0.319	S	S	*	.	H	α-helix	trans	-49.5	-40	-167.7	-72.6	-25.7	0	0	0	114.2	V855 K859 Q860	V855-D857 PolarHBondContact O-N 3.01Å; D857-K859 VanDerWaalsContact C-N 3.27Å; D857-K859 PolarHBondContact O-N 3.5Å; D857-Q860 WeakPolarHBondContact O-CB 3.35Å; D857-Q860 PolarHBondContact O-N 3.24Å; D857-Q860 PolarHBondContact OD1-NE2 2.93Å
858	E	63.8	Low	72.6	Confident	172 Å²	172	64.2 Å²	64.2	80%	0.804	32%	0.319	S	S	*	.	H	α-helix	trans	-57.4	-37.4	177.3	-58.3	-176.1	156.8	0	0	112.8	E856	E856-E858 PolarHBondContact O-N 2.78Å
859	K	71.5	Confident	72	Confident	100 Å²	100	66.6 Å²	66.6	44%	0.435	34%	0.337	S	S	.	.	H	α-helix	trans	-90.5	-15	-176.8	-66.7	167.7	-172.5	159.6	0	113	V855 E856 D857 L861 E862 M863	V855-K859 HydrophobicContact CG1-CB 3.93Å; E856-K859 PolarHBondContact O-N 3.01Å; E856-K859 WeakPolarHBondContact OE2-CD 3.44Å; E856-K859 WeakPolarHBondContact OE2-CE 3.45Å; E856-K859 IonicContact OE2-NZ 2.74Å; E856-K859 PolarHBondContact OE2-NZ 3.26Å; D857-K859 VanDerWaalsContact C-N 3.27Å; D857-K859 PolarHBondContact O-N 3.5Å; K859-L861 PolarHBondContact O-N 3.48Å; K859-E862 PolarHBondContact O-N 3.31Å; K859-M863 PolarHBondContact O-N 2.8Å
860	Q	73	Confident	71.3	Confident	15 Å²	15	66.8 Å²	66.8	7%	0.07	34%	0.339	C	S	.	.	H	α-helix	trans	-58	-48.5	179.1	-67.1	-178.2	8.2	0	0	111.5	M852 V855 E856 D857 E862 F864 L892	M852-Q860 HydrophobicContact CB-CB 4.31Å; M852-Q860 HydrophobicContact CB-CG 3.81Å; M852-Q860 HydrophobicContact CG-CB 4.47Å; M852-Q860 HydrophobicContact CG-CG 4.49Å; M852-Q860 HydrophobicContact SD-CB 4.46Å; V855-Q860 HydrophobicContact CB-CG 3.89Å; V855-Q860 HydrophobicContact CG1-CB 4.41Å; V855-Q860 HydrophobicContact CG1-CG 3.77Å; V855-Q860 WeakPolarHBondContact O-CG 3.49Å; V855-Q860 PolarHBondContact O-NE2 3.28Å; E856-Q860 PolarHBondContact O-N 3.07Å; D857-Q860 WeakPolarHBondContact O-CB 3.35Å; D857-Q860 PolarHBondContact O-N 3.24Å; D857-Q860 PolarHBondContact OD1-NE2 2.93Å; Q860-E862 VanDerWaalsContact C-N 3.29Å; Q860-E862 PolarHBondContact O-N 3.43Å; Q860-F864 WeakPolarHBondContact O-CB 3.49Å; Q860-F864 PolarHBondContact O-N 3.32Å; Q860-L892 HydrophobicContact CB-CD1 3.96Å
861	L	74.8	Confident	71.4	Confident	47 Å²	47	66.4 Å²	66.4	25%	0.246	34%	0.337	C	S	.	.	H	α-helix	trans	-67	-30.6	-178.3	-178.9	60.3	0	0	0	112.3	K859 K865 M887 L892	K859-L861 PolarHBondContact O-N 3.48Å; L861-K865 HydrophobicContact CG-CD 4.41Å; L861-K865 WeakPolarHBondContact O-CB 3.01Å; L861-K865 WeakPolarHBondContact O-CD 3.35Å; L861-K865 WeakPolarHBondContact O-CG 3.33Å; L861-K865 PolarHBondContact O-N 3.01Å; L861-M887 HydrophobicContact CD1-CB 4.11Å; L861-M887 HydrophobicContact CD1-CG 4.4Å; L861-M887 HydrophobicContact CD1-SD 4.24Å; L861-L892 HydrophobicContact CD1-CD2 4.1Å
862	E	75.9	Confident	71.8	Confident	125 Å²	125	66.2 Å²	66.2	58%	0.584	33%	0.332	S	S	*	.	H	α-helix	trans	-73.5	-49.4	177.6	-58.1	-158.9	135.6	0	0	111.8	K859 Q860 F864 K865 V866	K859-E862 PolarHBondContact O-N 3.31Å; Q860-E862 VanDerWaalsContact C-N 3.29Å; Q860-E862 PolarHBondContact O-N 3.43Å; E862-F864 VanDerWaalsContact C-N 3.3Å; E862-F864 PolarHBondContact O-N 3.07Å; E862-K865 WeakPolarHBondContact O-CB 3.46Å; E862-K865 PolarHBondContact O-N 3.34Å; E862-V866 WeakPolarHBondContact O-CG2 3.47Å; E862-V866 PolarHBondContact O-N 3.23Å
863	M	71	Confident	72.2	Confident	94 Å²	94	68.8 Å²	68.8	46%	0.463	35%	0.351	S	S	.	.	H	α-helix	trans	-67.2	-32.2	176.2	-69.3	-160.4	-71.8	0	0	112.3	V855 K859 V866 E867	V855-M863 HydrophobicContact CB-CE 4.04Å; V855-M863 HydrophobicContact CG1-CE 3.28Å; V855-M863 HydrophobicContact CG2-CE 3.49Å; V855-M863 VanDerWaalsContact CG2-CE 3.49Å; K859-M863 PolarHBondContact O-N 2.8Å; M863-V866 PolarHBondContact O-N 3.19Å; M863-E867 PolarHBondContact O-N 3.47Å
864	F	77.9	Confident	73.2	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.4	-45.1	169.6	-178.8	-98.5	0	0	0	112.2	L850 Q860 E862 V866 E867 V868 C885 M887 L892 I894	L850-F864 HydrophobicContact CD1-CD2 3.9Å; L850-F864 HydrophobicContact CD1-CE2 3.86Å; Q860-F864 WeakPolarHBondContact O-CB 3.49Å; Q860-F864 PolarHBondContact O-N 3.32Å; E862-F864 VanDerWaalsContact C-N 3.3Å; E862-F864 PolarHBondContact O-N 3.07Å; F864-V866 VanDerWaalsContact C-N 3.29Å; F864-V866 PolarHBondContact O-N 2.9Å; F864-E867 PolarHBondContact O-N 3.44Å; F864-V868 HydrophobicContact CD1-CG2 4.22Å; F864-V868 HydrophobicContact CD2-CG2 4.29Å; F864-V868 HydrophobicContact CE1-CG2 3.84Å; F864-V868 HydrophobicContact CE2-CG2 3.92Å; F864-V868 HydrophobicContact CG-CG2 4.43Å; F864-V868 HydrophobicContact CZ-CG2 3.68Å; F864-V868 WeakPolarHBondContact O-CB 3.22Å; F864-V868 VanDerWaalsContact O-CG2 3.3Å; F864-V868 WeakPolarHBondContact O-CG2 3.44Å; F864-V868 PolarHBondContact O-N 3.29Å; F864-C885 HydrophobicContact CE1-CB 3.99Å; F864-C885 HydrophobicContact CZ-CB 3.95Å; F864-M887 HydrophobicContact CD1-CE 4.48Å; F864-M887 HydrophobicContact CE1-CE 4.34Å; F864-M887 HydrophobicContact CE1-CG 4.13Å; F864-L892 HydrophobicContact CB-CD1 4.04Å; F864-L892 HydrophobicContact CD1-CD2 4.48Å; F864-L892 HydrophobicContact CD2-CB 3.88Å; F864-L892 HydrophobicContact CE2-CB 3.99Å; F864-L892 HydrophobicContact CG-CB 4.19Å; F864-L892 HydrophobicContact CG-CD1 4.2Å; F864-L892 HydrophobicContact CZ-CB 4.39Å; F864-I894 HydrophobicContact CE2-CG1 4.16Å; F864-I894 HydrophobicContact CZ-CG1 4.35Å
865	K	81.5	Confident	74.7	Confident	61 Å²	61	68.4 Å²	68.4	27%	0.265	34%	0.337	S	S	.	.	H	α-helix	trans	-59.1	-39.9	173.3	-77.1	162	-176.1	163.8	0	111.6	W810 L861 E862 S869 M887	W810-K865 HydrophobicContact CD2-CG 4.46Å; W810-K865 HydrophobicContact CH2-CB 3.95Å; W810-K865 HydrophobicContact CH2-CG 4.16Å; W810-K865 WeakPolarHBondContact CH2-O 3.32Å; W810-K865 HydrophobicContact CZ2-CB 3.72Å; W810-K865 HydrophobicContact CZ2-CD 4.42Å; W810-K865 HydrophobicContact CZ2-CG 3.81Å; L861-K865 HydrophobicContact CG-CD 4.41Å; L861-K865 WeakPolarHBondContact O-CB 3.01Å; L861-K865 WeakPolarHBondContact O-CD 3.35Å; L861-K865 WeakPolarHBondContact O-CG 3.33Å; L861-K865 PolarHBondContact O-N 3.01Å; E862-K865 WeakPolarHBondContact O-CB 3.46Å; E862-K865 PolarHBondContact O-N 3.34Å; K865-S869 WeakPolarHBondContact O-CB 3.38Å; K865-S869 PolarHBondContact O-N 2.93Å; K865-M887 HydrophobicContact CG-CE 3.89Å; K865-M887 HydrophobicContact CG-SD 4.35Å
866	V	73.6	Confident	76.4	Confident	101 Å²	101	69.4 Å²	69.4	61%	0.612	34%	0.34	S	S	*	.	H	α-helix	trans	-64.4	-52.2	175.8	174.5	0	0	0	0	111.1	E862 M863 F864 V868 S869	E862-V866 WeakPolarHBondContact O-CG2 3.47Å; E862-V866 PolarHBondContact O-N 3.23Å; M863-V866 PolarHBondContact O-N 3.19Å; F864-V866 VanDerWaalsContact C-N 3.29Å; F864-V866 PolarHBondContact O-N 2.9Å; V866-V868 VanDerWaalsContact C-N 3.32Å; V866-V868 PolarHBondContact O-N 3Å; V866-S869 PolarHBondContact O-N 2.95Å; V866-S869 PolarHBondContact O-OG 3.2Å
867	E	72.2	Confident	78	Confident	35 Å²	35	70.3 Å²	70.3	16%	0.164	34%	0.344	C	S	.	.	H	α-helix	trans	-56	-45.3	177.1	-74.8	-170.7	164.3	0	0	111.6	L850 M863 F864 T870 L964 R969	L850-E867 WeakPolarHBondContact CD1-OE2 3.37Å; M863-E867 PolarHBondContact O-N 3.47Å; F864-E867 PolarHBondContact O-N 3.44Å; E867-T870 WeakPolarHBondContact O-CB 3.26Å; E867-T870 PolarHBondContact O-OG1 3.09Å; E867-L964 HydrophobicContact CB-CD2 4.08Å; E867-R969 VanDerWaalsContact CD-NH2 3.27Å; E867-R969 IonicContact OE1-CZ 3.5Å; E867-R969 IonicContact OE1-NE 2.65Å; E867-R969 IonicContact OE1-NH2 3.77Å; E867-R969 PolarHBondContact OE1-NH2 2.99Å; E867-R969 IonicContact OE2-NH2 2.61Å; E867-R969 PolarHBondContact OE2-NH2 3.11Å
868	V	81.5	Confident	79.4	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-73.8	-27.1	-178.3	174	0	0	0	0	113.6	W810 F864 V866 T870 F871 F882 C885 I894	W810-V868 HydrophobicContact CZ3-CG1 4.41Å; F864-V868 HydrophobicContact CD1-CG2 4.22Å; F864-V868 HydrophobicContact CD2-CG2 4.29Å; F864-V868 HydrophobicContact CE1-CG2 3.84Å; F864-V868 HydrophobicContact CE2-CG2 3.92Å; F864-V868 HydrophobicContact CG-CG2 4.43Å; F864-V868 HydrophobicContact CZ-CG2 3.68Å; F864-V868 WeakPolarHBondContact O-CB 3.22Å; F864-V868 VanDerWaalsContact O-CG2 3.3Å; F864-V868 WeakPolarHBondContact O-CG2 3.44Å; F864-V868 PolarHBondContact O-N 3.29Å; V866-V868 VanDerWaalsContact C-N 3.32Å; V866-V868 PolarHBondContact O-N 3Å; V868-T870 PolarHBondContact O-N 3.13Å; V868-T870 VanDerWaalsContact O-N 3.14Å; V868-F871 PolarHBondContact O-N 2.92Å; V868-F882 HydrophobicContact CG1-CE2 3.92Å; V868-F882 HydrophobicContact CG1-CZ 3.67Å; V868-C885 HydrophobicContact CG1-CB 4.17Å; V868-I894 HydrophobicContact CG2-CD1 3.94Å; V868-I894 HydrophobicContact CG2-CG1 3.88Å
869	S	77.7	Confident	80.9	Confident	58 Å²	58	56.4 Å²	56.4	41%	0.406	28%	0.276	S	S	.	.	H	α-helix	trans	-54	-37.4	179.5	70.9	0	0	0	0	112.5	K865 V866 F871 R872	K865-S869 WeakPolarHBondContact O-CB 3.38Å; K865-S869 PolarHBondContact O-N 2.93Å; V866-S869 PolarHBondContact O-N 2.95Å; V866-S869 PolarHBondContact O-OG 3.2Å; S869-F871 PolarHBondContact O-N 3.22Å; S869-R872 PolarHBondContact O-N 2.63Å
870	T	73.7	Confident	82	Confident	36 Å²	36	52 Å²	52	22%	0.221	26%	0.257	C	S	.	.	H	α-helix	trans	-51.2	-39.2	173.7	-45.9	0	0	0	0	113.1	E867 V868 T874 I939	E867-T870 WeakPolarHBondContact O-CB 3.26Å; E867-T870 PolarHBondContact O-OG1 3.09Å; V868-T870 PolarHBondContact O-N 3.13Å; V868-T870 VanDerWaalsContact O-N 3.14Å; T870-T874 WeakPolarHBondContact O-CG2 3.21Å; T870-I939 HydrophobicContact CG2-CB 4.42Å; T870-I939 HydrophobicContact CG2-CD1 3.89Å; T870-I939 HydrophobicContact CG2-CG1 3.97Å; T870-I939 HydrophobicContact CG2-CG2 3.58Å
871	F	79.3	Confident	82.9	Confident	4 Å²	4	54.2 Å²	54.2	2%	0.018	27%	0.269	C	S	.	.	H	α-helix	trans	-80.1	-34.1	-172.5	-75.2	-96.8	0	0	0	113.4	V868 S869 S873 T874 F882 F962 L964	V868-F871 PolarHBondContact O-N 2.92Å; S869-F871 PolarHBondContact O-N 3.22Å; F871-S873 PolarHBondContact O-N 3.27Å; F871-T874 PolarHBondContact O-N 2.77Å; F871-T874 PolarHBondContact O-OG1 3.14Å; F871-F882 HydrophobicContact CB-CB 3.98Å; F871-F882 HydrophobicContact CB-CD1 4.06Å; F871-F882 HydrophobicContact CB-CD2 3.72Å; F871-F882 HydrophobicContact CB-CE1 4.46Å; F871-F882 HydrophobicContact CB-CE2 4.15Å; F871-F882 HydrophobicContact CB-CG 3.67Å; F871-F882 HydrophobicContact CD1-CB 4.2Å; F871-F882 HydrophobicContact CD1-CD2 4.37Å; F871-F882 HydrophobicContact CG-CD2 4.24Å; F871-F882 HydrophobicContact CG-CG 4.49Å; F871-F962 AromaticContact CD1-CE2 3.62Å; F871-F962 HydrophobicContact CD1-CE2 3.62Å; F871-F962 AromaticContact CD1-CZ 3.7Å; F871-F962 HydrophobicContact CD1-CZ 3.7Å; F871-F962 AromaticContact CE1-CD2 4Å; F871-F962 HydrophobicContact CE1-CD2 4Å; F871-F962 HydrophobicContact CE1-CE1 4.12Å; F871-F962 AromaticContact CE1-CE2 3.45Å; F871-F962 HydrophobicContact CE1-CE2 3.45Å; F871-F962 VanDerWaalsContact CE1-CE2 3.45Å; F871-F962 AromaticContact CE1-CZ 3.53Å; F871-F962 HydrophobicContact CE1-CZ 3.53Å; F871-F962 HydrophobicContact CE2-CE2 4.44Å; F871-F962 HydrophobicContact CG-CE2 4.22Å; F871-F962 HydrophobicContact CZ-CD2 4Å; F871-F962 AromaticContact CZ-CE2 3.89Å; F871-F962 HydrophobicContact CZ-CE2 3.89Å; F871-F962 HydrophobicContact CZ-CZ 4.35Å; F871-F962 WeakPolarHBondContact CZ-O 3.14Å; F871-L964 HydrophobicContact CE2-CD1 4.15Å; F871-L964 HydrophobicContact CE2-CD2 3.6Å; F871-L964 HydrophobicContact CE2-CG 3.7Å; F871-L964 HydrophobicContact CZ-CD1 3.87Å; F871-L964 HydrophobicContact CZ-CD2 4.18Å; F871-L964 HydrophobicContact CZ-CG 3.78Å
872	R	80.1	Confident	83.7	Confident	55 Å²	55	52.4 Å²	52.4	21%	0.208	26%	0.259	C	S	.	.	H	α-helix	trans	-55.2	-28.2	-174.4	-69.8	-179.4	71.1	-178.3	-0.8	113.8	A808 E812 W813 S869 F882	A808-R872 PolarHBondContact O-NH1 2.88Å; A808-R872 PolarHBondContact O-NH2 2.88Å; E812-R872 IonicContact OE2-NH2 3.31Å; E812-R872 PolarHBondContact OE2-NH2 3.29Å; W813-R872 HydrophobicContact CD2-CG 4.28Å; W813-R872 HydrophobicContact CG-CG 4.31Å; W813-R872 VanDerWaalsContact NE1-NH2 3.18Å; S869-R872 PolarHBondContact O-N 2.63Å; R872-F882 HydrophobicContact CG-CE1 3.93Å; R872-F882 HydrophobicContact CG-CZ 4.5Å
873	S	76.3	Confident	84.4	Confident	64 Å²	64	47.6 Å²	47.6	45%	0.448	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	5.8	-178.5	72.4	0	0	0	0	115	F871 Y933	F871-S873 PolarHBondContact O-N 3.27Å; S873-Y933 PolarHBondContact O-OH 3.19Å
874	T	86.2	Confident	85.4	Confident	9 Å²	9	43.1 Å²	43.1	6%	0.055	22%	0.215	C	C	.	.			trans	-107.5	122.3	-173.1	61.5	0	0	0	0	113.4	T870 F871 Y933 L934 I939 F962	T870-T874 WeakPolarHBondContact O-CG2 3.21Å; F871-T874 PolarHBondContact O-N 2.77Å; F871-T874 PolarHBondContact O-OG1 3.14Å; T874-Y933 HydrophobicContact CG2-CE1 4.36Å; T874-L934 HydrophobicContact CG2-CD2 4.21Å; T874-I939 HydrophobicContact CG2-CD1 3.41Å; T874-I939 VanDerWaalsContact CG2-CD1 3.41Å; T874-F962 HydrophobicContact CG2-CE2 4.08Å; T874-F962 HydrophobicContact CG2-CZ 4.47Å
875	R	91.8	Very high	86	Confident	205 Å²	205	43.1 Å²	43.1	77%	0.774	22%	0.215	S	C	*	.			trans	-151.1	110.8	171.9	-176.8	172	175.9	161.4	-2.8	109.7	L881 Y933	R875-L881 HydrophobicContact CG-CD1 4.33Å; R875-Y933 PolarHBondContact N-OH 2.99Å; R875-Y933 PolarHBondContact O-OH 3.25Å
876	H	94.8	Very high	86.5	Confident	42 Å²	42	40.3 Å²	40.3	19%	0.194	20%	0.203	C	C	.	.			trans	-155	149.1	-179.5	-177.3	-98	0	0	0	109.7	N878 L879 Q929 Y933	H876-N878 VanDerWaalsContact C-N 3.29Å; H876-N878 PolarHBondContact CE1-OD1 3.08Å; H876-N878 PolarHBondContact ND1-N 2.98Å; H876-N878 PolarHBondContact O-N 3.41Å; H876-L879 HydrophobicContact CB-CB 4.26Å; H876-L879 HydrophobicContact CB-CD1 3.89Å; H876-L879 HydrophobicContact CB-CG 3.94Å; H876-L879 PolarHBondContact O-N 2.65Å; H876-L879 VanDerWaalsContact O-N 3.11Å; H876-Q929 PolarHBondContact CE1-NE2 3.49Å; H876-Q929 PolarHBondContact NE2-NE2 3.18Å; H876-Y933 HydrophobicContact CB-CD1 4.09Å; H876-Y933 HydrophobicContact CB-CD2 3.97Å; H876-Y933 HydrophobicContact CB-CE1 4.33Å; H876-Y933 HydrophobicContact CB-CE2 4.2Å; H876-Y933 HydrophobicContact CB-CG 3.91Å; H876-Y933 AromaticContact CD2-CD2 3.83Å
877	E	94.7	Very high	87.1	Confident	124 Å²	124	36.7 Å²	36.7	58%	0.579	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-31	-172.6	65.9	179.4	144.8	0	0	114.3	Q929	E877-Q929 PolarHBondContact OE1-NE2 3.19Å
878	N	96.4	Very high	87.5	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	9.8	177.5	-52	121.5	0	0	0	114.3	H876 Q926 V957 I959	H876-N878 VanDerWaalsContact C-N 3.29Å; H876-N878 PolarHBondContact CE1-OD1 3.08Å; H876-N878 PolarHBondContact ND1-N 2.98Å; H876-N878 PolarHBondContact O-N 3.41Å; N878-Q926 WeakPolarHBondContact CB-O 3.32Å; N878-Q926 PolarHBondContact ND2-OE1 3.35Å; N878-Q926 VanDerWaalsContact ND2-OE1 3.08Å; N878-Q926 PolarHBondContact OD1-O 3.05Å; N878-V957 VanDerWaalsContact CA-O 3.32Å; N878-V957 WeakPolarHBondContact CA-O 3.49Å; N878-V957 PolarHBondContact ND2-O 3.44Å; N878-I959 WeakPolarHBondContact O-CG1 3.28Å; N878-I959 PolarHBondContact O-N 2.98Å
879	L	95.2	Very high	87.2	Confident	8 Å²	8	44.2 Å²	44.2	4%	0.042	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-112.5	150.4	173	-62.5	-177.5	0	0	0	109.8	H876 L881 Y933 L934 I959 F962	H876-L879 HydrophobicContact CB-CB 4.26Å; H876-L879 HydrophobicContact CB-CD1 3.89Å; H876-L879 HydrophobicContact CB-CG 3.94Å; H876-L879 PolarHBondContact O-N 2.65Å; H876-L879 VanDerWaalsContact O-N 3.11Å; L879-L881 PolarHBondContact O-N 2.81Å; L879-Y933 HydrophobicContact CD1-CD1 3.58Å; L879-Y933 HydrophobicContact CD1-CE1 4.01Å; L879-Y933 HydrophobicContact CD1-CG 4.44Å; L879-L934 HydrophobicContact CD1-CD2 3.67Å; L879-L934 HydrophobicContact CD1-CG 3.86Å; L879-L934 HydrophobicContact CD2-CD1 3.88Å; L879-L934 HydrophobicContact CD2-CD2 4.44Å; L879-L934 HydrophobicContact CD2-CG 4.01Å; L879-I959 HydrophobicContact CD2-CB 4.02Å; L879-I959 HydrophobicContact CD2-CD1 4.19Å; L879-F962 HydrophobicContact CB-CE1 4.08Å; L879-F962 HydrophobicContact CD1-CE1 4.46Å; L879-F962 HydrophobicContact CD2-CD1 4.24Å; L879-F962 HydrophobicContact CD2-CE1 4.17Å; L879-F962 HydrophobicContact CG-CE1 4.47Å
880	I	93.9	Very high	87	Confident	7 Å²	7	47 Å²	47	4%	0.036	24%	0.236	C	C	.	.			trans	-66	130.1	173.6	-164.9	58.8	0	0	0	110.3	F882 M896 N897 C899 V958 I959 T960 F962	I880-F882 PolarHBondContact O-N 3.29Å; I880-M896 HydrophobicContact CG1-CB 4.12Å; I880-M896 HydrophobicContact CG1-CG 4.11Å; I880-M896 HydrophobicContact CG1-SD 3.89Å; I880-M896 HydrophobicContact CG2-SD 4.39Å; I880-N897 HydrophobicContact CD1-CB 4.03Å; I880-N897 WeakPolarHBondContact CD1-O 3.42Å; I880-C899 VanDerWaalsContact CD1-SG 3.55Å; I880-V958 HydrophobicContact CB-CG1 4.06Å; I880-V958 HydrophobicContact CD1-CG1 3.93Å; I880-I959 WeakPolarHBondContact CB-O 3.36Å; I880-I959 PolarHBondContact N-O 3.12Å; I880-T960 HydrophobicContact CB-CG2 4.07Å; I880-T960 HydrophobicContact CG1-CG2 4.3Å; I880-T960 HydrophobicContact CG2-CG2 4.35Å; I880-F962 HydrophobicContact CG2-CE1 4.01Å
881	L	92.1	Very high	87.2	Confident	62 Å²	62	52.4 Å²	52.4	33%	0.325	25%	0.252	S	S	.	.			trans	-75.6	114.2	179.8	-177.3	66.6	0	0	0	109.8	R875 L879 M896 N897	R875-L881 HydrophobicContact CG-CD1 4.33Å; L879-L881 PolarHBondContact O-N 2.81Å; L881-M896 CarbonylContact O-C 3.5Å; L881-M896 VanDerWaalsContact O-CA 3.27Å; L881-M896 WeakPolarHBondContact O-CA 3.21Å; L881-M896 WeakPolarHBondContact O-CB 3.27Å; L881-N897 HydrophobicContact CB-CB 4.19Å; L881-N897 PolarHBondContact O-N 3.49Å
882	F	91.4	Very high	87.5	Confident	10 Å²	10	52.2 Å²	52.2	4%	0.044	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	138.4	163.8	177.4	-110.8	0	0	0	110.2	W813 V868 F871 R872 I880 G884 C885 I894	W813-F882 HydrophobicContact CD2-CE1 4.04Å; W813-F882 AromaticContact CE3-CD1 3.76Å; W813-F882 HydrophobicContact CE3-CD1 3.76Å; W813-F882 AromaticContact CE3-CE1 3.35Å; W813-F882 HydrophobicContact CE3-CE1 3.35Å; W813-F882 HydrophobicContact CE3-CZ 4.41Å; W813-F882 AromaticContact CZ3-CD1 3.8Å; W813-F882 HydrophobicContact CZ3-CD1 3.8Å; W813-F882 AromaticContact CZ3-CE1 3.89Å; W813-F882 HydrophobicContact CZ3-CE1 3.89Å; V868-F882 HydrophobicContact CG1-CE2 3.92Å; V868-F882 HydrophobicContact CG1-CZ 3.67Å; F871-F882 HydrophobicContact CB-CB 3.98Å; F871-F882 HydrophobicContact CB-CD1 4.06Å; F871-F882 HydrophobicContact CB-CD2 3.72Å; F871-F882 HydrophobicContact CB-CE1 4.46Å; F871-F882 HydrophobicContact CB-CE2 4.15Å; F871-F882 HydrophobicContact CB-CG 3.67Å; F871-F882 HydrophobicContact CD1-CB 4.2Å; F871-F882 HydrophobicContact CD1-CD2 4.37Å; F871-F882 HydrophobicContact CG-CD2 4.24Å; F871-F882 HydrophobicContact CG-CG 4.49Å; R872-F882 HydrophobicContact CG-CE1 3.93Å; R872-F882 HydrophobicContact CG-CZ 4.5Å; I880-F882 PolarHBondContact O-N 3.29Å; F882-G884 WeakPolarHBondContact CE2-O 3.32Å; F882-C885 HydrophobicContact CE2-CB 4.44Å; F882-C885 HydrophobicContact CZ-CB 4.45Å; F882-I894 HydrophobicContact CD2-CG2 3.88Å; F882-I894 HydrophobicContact CE2-CG2 3.97Å
883	M	91.2	Very high	88	Confident	24 Å²	24	49.6 Å²	49.6	12%	0.118	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	-33.5	175.3	-63.3	-172.6	-172.7	0	0	112.4	W841 Q843 V845 V895 N897	W841-M883 HydrophobicContact CE3-CB 4.48Å; W841-M883 HydrophobicContact CE3-SD 4.18Å; W841-M883 HydrophobicContact CZ3-CB 4.01Å; W841-M883 HydrophobicContact CZ3-SD 4.24Å; Q843-M883 HydrophobicContact CG-CE 4.09Å; Q843-M883 HydrophobicContact CG-SD 4.48Å; V845-M883 HydrophobicContact CG1-CE 4.02Å; V845-M883 HydrophobicContact CG1-SD 3.48Å; V845-M883 WeakPolarHBondContact CG1-SD 3.44Å; M883-V895 HydrophobicContact CB-CG1 4.3Å; M883-V895 PolarHBondContact N-O 3.22Å; M883-N897 HydrophobicContact CE-CB 3.97Å; M883-N897 VanDerWaalsContact CE-CG 3.45Å; M883-N897 WeakPolarHBondContact CE-OD1 3.32Å
884	G	91.6	Very high	88.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164	-166.5	-176.3	0	0	0	0	0	111.1	W813 F882 V895	W813-G884 CarbonylContact O-C 3.59Å; W813-G884 WeakPolarHBondContact O-CA 3.27Å; F882-G884 WeakPolarHBondContact CE2-O 3.32Å; G884-V895 PolarHBondContact N-O 3.3Å; G884-V895 WeakPolarHBondContact O-CA 3.36Å; G884-V895 WeakPolarHBondContact O-CB 3.42Å; G884-V895 PolarHBondContact O-N 2.88Å
885	C	91.7	Very high	88.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	146.5	-173.8	57.2	0	0	0	0	112.2	W813 T814 I815 F864 V868 F882 M887 G893	W813-C885 PolarHBondContact O-N 3.47Å; W813-C885 PolarHBondContact O-SG 3.04Å; W813-C885 VanDerWaalsContact O-SG 3.39Å; T814-C885 CarbonylContact C-O 3.58Å; T814-C885 WeakPolarHBondContact CA-O 3.46Å; I815-C885 PolarHBondContact N-O 3.39Å; F864-C885 HydrophobicContact CE1-CB 3.99Å; F864-C885 HydrophobicContact CZ-CB 3.95Å; V868-C885 HydrophobicContact CG1-CB 4.17Å; F882-C885 HydrophobicContact CE2-CB 4.44Å; F882-C885 HydrophobicContact CZ-CB 4.45Å; C885-M887 WeakPolarHBondContact SG-CE 3Å; C885-G893 CarbonylContact C-O 3.6Å; C885-G893 VanDerWaalsContact CA-O 3.25Å; C885-G893 WeakPolarHBondContact CA-O 3.36Å
886	C	90.7	Very high	89	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.007	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	118.2	171.8	-57	0	0	0	0	108.1	I817 L892 G893	I817-C886 HydrophobicContact CB-CB 4.4Å; I817-C886 HydrophobicContact CD1-CB 4.09Å; C886-L892 WeakPolarHBondContact O-CA 3.45Å; C886-G893 PolarHBondContact N-O 2.86Å; C886-G893 PolarHBondContact O-N 2.97Å; C886-G893 VanDerWaalsContact O-N 3.14Å
887	M	85.8	Confident	88.9	Confident	26 Å²	26	37.7 Å²	37.7	13%	0.128	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	19.7	-175	-69.2	-152.3	169.6	0	0	114	W810 T814 L861 F864 K865 C885 P889	W810-M887 HydrophobicContact CB-SD 4.35Å; W810-M887 HydrophobicContact CD2-CE 3.76Å; W810-M887 HydrophobicContact CE3-CE 3.25Å; W810-M887 HydrophobicContact CE3-SD 4.44Å; W810-M887 HydrophobicContact CG-CE 4.32Å; W810-M887 HydrophobicContact CG-SD 4.49Å; W810-M887 HydrophobicContact CH2-CE 4.42Å; W810-M887 HydrophobicContact CZ3-CE 3.62Å; T814-M887 HydrophobicContact CG2-CB 4.11Å; T814-M887 HydrophobicContact CG2-CG 4.34Å; L861-M887 HydrophobicContact CD1-CB 4.11Å; L861-M887 HydrophobicContact CD1-CG 4.4Å; L861-M887 HydrophobicContact CD1-SD 4.24Å; F864-M887 HydrophobicContact CD1-CE 4.48Å; F864-M887 HydrophobicContact CE1-CE 4.34Å; F864-M887 HydrophobicContact CE1-CG 4.13Å; K865-M887 HydrophobicContact CG-CE 3.89Å; K865-M887 HydrophobicContact CG-SD 4.35Å; C885-M887 WeakPolarHBondContact SG-CE 3Å; M887-P889 WeakPolarHBondContact O-CD 3.38Å
888	K	81.9	Confident	88.9	Confident	119 Å²	119	33.4 Å²	33.4	52%	0.517	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	105.6	-175.5	-174.1	173.1	178.1	177.3	0	109.9	I817 E818 R891	I817-K888 HydrophobicContact CG2-CD 4.25Å; E818-K888 IonicContact OE1-NZ 3.88Å; E818-K888 PolarHBondContact OE1-NZ 3.12Å; K888-R891 CarbonylContact O-C 3.6Å; K888-R891 PolarHBondContact O-N 2.63Å
889	P	75.4	Confident	88.6	Confident	74 Å²	74	34.4 Å²	34.4	48%	0.481	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	149.8	176	-24.8	35	0	0	0	112	M887 R891 L892	M887-P889 WeakPolarHBondContact O-CD 3.38Å; P889-R891 VanDerWaalsContact C-N 3.29Å; P889-L892 HydrophobicContact CG-CD2 4.3Å
890	P	71.9	Confident	88.3	Confident	117 Å²	117	41.2 Å²	41.2	76%	0.76	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	cis	-80.1	0.2	-3.8	33.5	-36.3	0	0	0	113.7	L892	P890-L892 VanDerWaalsContact C-N 3.35Å; P890-L892 PolarHBondContact O-N 2.62Å; P890-L892 VanDerWaalsContact O-N 3.15Å
891	R	78.4	Confident	88.1	Confident	148 Å²	148	41.3 Å²	41.3	56%	0.558	21%	0.209	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92	60.9	-173.7	-65	-172.4	179.2	-177.4	1.1	112.7	I817 K888 P889	I817-R891 HydrophobicContact CG1-CB 4.43Å; K888-R891 CarbonylContact O-C 3.6Å; K888-R891 PolarHBondContact O-N 2.63Å; P889-R891 VanDerWaalsContact C-N 3.29Å
892	L	86.1	Confident	88.1	Confident	1 Å²	1	43 Å²	43	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	126.5	169.4	-59.8	-176.6	0	0	0	109.9	L850 M852 Q860 L861 F864 C886 P889 P890	L850-L892 PolarHBondContact N-O 3.29Å; M852-L892 HydrophobicContact CG-CD1 4.3Å; M852-L892 HydrophobicContact SD-CD1 4.48Å; Q860-L892 HydrophobicContact CB-CD1 3.96Å; L861-L892 HydrophobicContact CD1-CD2 4.1Å; F864-L892 HydrophobicContact CB-CD1 4.04Å; F864-L892 HydrophobicContact CD1-CD2 4.48Å; F864-L892 HydrophobicContact CD2-CB 3.88Å; F864-L892 HydrophobicContact CE2-CB 3.99Å; F864-L892 HydrophobicContact CG-CB 4.19Å; F864-L892 HydrophobicContact CG-CD1 4.2Å; F864-L892 HydrophobicContact CZ-CB 4.39Å; C886-L892 WeakPolarHBondContact O-CA 3.45Å; P889-L892 HydrophobicContact CG-CD2 4.3Å; P890-L892 VanDerWaalsContact C-N 3.35Å; P890-L892 PolarHBondContact O-N 2.62Å; P890-L892 VanDerWaalsContact O-N 3.15Å
893	G	89.7	Confident	88.3	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.7	151.8	-174.3	0	0	0	0	0	116.4	K848 C885 C886	K848-G893 CarbonylContact O-C 3.6Å; K848-G893 WeakPolarHBondContact O-CA 3.24Å; C885-G893 CarbonylContact C-O 3.6Å; C885-G893 VanDerWaalsContact CA-O 3.25Å; C885-G893 WeakPolarHBondContact CA-O 3.36Å; C886-G893 PolarHBondContact N-O 2.86Å; C886-G893 PolarHBondContact O-N 2.97Å; C886-G893 VanDerWaalsContact O-N 3.14Å
894	I	90.3	Very high	88.5	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	125	-176.1	-56.7	-178.2	0	0	0	109.4	V847 K848 L850 F864 V868 F882 M896 L964	V847-I894 WeakPolarHBondContact CA-O 3.26Å; K848-I894 HydrophobicContact CB-CB 4.46Å; K848-I894 PolarHBondContact N-O 3.34Å; K848-I894 PolarHBondContact O-N 2.94Å; L850-I894 HydrophobicContact CD1-CD1 4.13Å; L850-I894 HydrophobicContact CD1-CG1 4.38Å; F864-I894 HydrophobicContact CE2-CG1 4.16Å; F864-I894 HydrophobicContact CZ-CG1 4.35Å; V868-I894 HydrophobicContact CG2-CD1 3.94Å; V868-I894 HydrophobicContact CG2-CG1 3.88Å; F882-I894 HydrophobicContact CD2-CG2 3.88Å; F882-I894 HydrophobicContact CE2-CG2 3.97Å; I894-M896 HydrophobicContact CB-CE 4.21Å; I894-M896 HydrophobicContact CG2-CE 3.75Å; I894-L964 HydrophobicContact CD1-CD1 3.93Å; I894-L964 HydrophobicContact CD1-CD2 3.76Å
895	V	92.9	Very high	88.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	124.3	177.3	-171.5	0	0	0	0	109.3	I815 V845 M883 G884	I815-V895 HydrophobicContact CD1-CB 3.9Å; I815-V895 HydrophobicContact CD1-CG1 4.07Å; I815-V895 HydrophobicContact CD1-CG2 3.95Å; V845-V895 HydrophobicContact CB-CG1 4.04Å; V845-V895 HydrophobicContact CG1-CG1 4.19Å; V845-V895 HydrophobicContact CG2-CG1 4.13Å; M883-V895 HydrophobicContact CB-CG1 4.3Å; M883-V895 PolarHBondContact N-O 3.22Å; G884-V895 PolarHBondContact N-O 3.3Å; G884-V895 WeakPolarHBondContact O-CA 3.36Å; G884-V895 WeakPolarHBondContact O-CB 3.42Å; G884-V895 PolarHBondContact O-N 2.88Å
896	M	93.5	Very high	88.7	Confident	16 Å²	16	44 Å²	44	8%	0.079	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	168	-175.8	69.2	-173.4	72.3	0	0	111.6	V845 A846 K848 I880 L881 I894	V845-M896 CarbonylContact C-O 3.57Å; V845-M896 WeakPolarHBondContact CA-O 3.4Å; V845-M896 WeakPolarHBondContact CB-O 3.39Å; A846-M896 HydrophobicContact CB-CG 3.91Å; A846-M896 PolarHBondContact N-O 3.47Å; A846-M896 PolarHBondContact O-N 3.41Å; K848-M896 HydrophobicContact CB-CE 4.07Å; I880-M896 HydrophobicContact CG1-CB 4.12Å; I880-M896 HydrophobicContact CG1-CG 4.11Å; I880-M896 HydrophobicContact CG1-SD 3.89Å; I880-M896 HydrophobicContact CG2-SD 4.39Å; L881-M896 CarbonylContact O-C 3.5Å; L881-M896 VanDerWaalsContact O-CA 3.27Å; L881-M896 WeakPolarHBondContact O-CA 3.21Å; L881-M896 WeakPolarHBondContact O-CB 3.27Å; I894-M896 HydrophobicContact CB-CE 4.21Å; I894-M896 HydrophobicContact CG2-CE 3.75Å
897	N	93.3	Very high	88.8	Confident	53 Å²	53	44.2 Å²	44.2	28%	0.283	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	140.8	176.5	-119.1	-28.9	0	0	0	112.1	I880 L881 M883 C899	I880-N897 HydrophobicContact CD1-CB 4.03Å; I880-N897 WeakPolarHBondContact CD1-O 3.42Å; L881-N897 HydrophobicContact CB-CB 4.19Å; L881-N897 PolarHBondContact O-N 3.49Å; M883-N897 HydrophobicContact CE-CB 3.97Å; M883-N897 VanDerWaalsContact CE-CG 3.45Å; M883-N897 WeakPolarHBondContact CE-OD1 3.32Å; N897-C899 PolarHBondContact O-N 3.37Å
898	L	92.7	Very high	89.2	Confident	34 Å²	34	43.3 Å²	43.3	18%	0.178	21%	0.213	C	C	.	.			trans	-80.7	106.9	173.3	-176.8	58.7	0	0	0	110.8	I828 A838 D844 A846 K900	I828-L898 HydrophobicContact CD1-CD1 3.47Å; I828-L898 VanDerWaalsContact CD1-CD1 3.47Å; A838-L898 HydrophobicContact CB-CD2 4.41Å; D844-L898 HydrophobicContact CB-CB 4.24Å; D844-L898 HydrophobicContact CB-CD2 4.1Å; D844-L898 VanDerWaalsContact O-CB 3.3Å; D844-L898 WeakPolarHBondContact O-CB 3.35Å; D844-L898 PolarHBondContact O-N 2.96Å; A846-L898 HydrophobicContact CB-CD1 4.04Å; L898-K900 PolarHBondContact O-N 3.43Å
899	C	91.7	Very high	89.7	Confident	22 Å²	22	38.7 Å²	38.7	15%	0.149	19%	0.194	C	C	.	.			trans	-55.2	119.7	169.3	-71.9	0	0	0	0	110.7	I880 N897 G901 F950 E952	I880-C899 VanDerWaalsContact CD1-SG 3.55Å; N897-C899 PolarHBondContact O-N 3.37Å; C899-G901 VanDerWaalsContact C-N 3.32Å; C899-F950 HydrophobicContact CB-CB 4.33Å; C899-F950 HydrophobicContact CB-CD1 3.53Å; C899-F950 HydrophobicContact CB-CE1 3.87Å; C899-F950 HydrophobicContact CB-CG 3.91Å; C899-E952 WeakPolarHBondContact CA-OE1 3.21Å
900	K	88.7	Confident	90.4	Very high	152 Å²	152	39.1 Å²	39.1	66%	0.661	20%	0.195	S	C	*	.			trans	-86.1	-8.7	176.7	-63	171.2	-173.8	168.8	0	112.5	L898 E952	L898-K900 PolarHBondContact O-N 3.43Å; K900-E952 PolarHBondContact N-OE1 3.25Å
901	G	89.5	Confident	91.4	Very high	9 Å²	9	39.2 Å²	39.2	9%	0.093	18%	0.18	C	C	.	.	S	Bend	trans	-83	-160.9	-176.5	0	0	0	0	0	115.6	F718 C899 I951	F718-G901 WeakPolarHBondContact CE2-O 3.34Å; C899-G901 VanDerWaalsContact C-N 3.32Å; G901-I951 WeakPolarHBondContact CA-O 3.34Å
902	R	92.4	Very high	91.9	Very high	97 Å²	97	40.6 Å²	40.6	37%	0.366	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	150.8	171.2	-64.5	168.8	-179.6	166.1	5.4	109.6	F718 I907 R911 E913 F950 I951	F718-R902 HydrophobicContact CE2-CB 4.46Å; F718-R902 HydrophobicContact CE2-CG 4.1Å; R902-I907 HydrophobicContact CB-CD1 4.02Å; R902-I907 HydrophobicContact CB-CG1 4.01Å; R902-R911 VanDerWaalsContact NH1-CD 3.34Å; R902-E913 IonicContact NH1-OE1 2.75Å; R902-E913 PolarHBondContact NH1-OE1 2.96Å; R902-F950 CarbonylContact O-C 3.49Å; R902-F950 WeakPolarHBondContact O-CA 3.32Å; R902-I951 PolarHBondContact N-O 2.9Å; R902-I951 VanDerWaalsContact N-O 3.12Å; R902-I951 PolarHBondContact O-N 3.27Å
903	T	94.4	Very high	92.1	Very high	6 Å²	6	43 Å²	43	4%	0.037	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	146.4	168.2	66.7	0	0	0	0	110	H905 T906 I907 K947 V949 F950	T903-H905 PolarHBondContact O-N 3.18Å; T903-T906 PolarHBondContact O-N 2.93Å; T903-T906 VanDerWaalsContact O-N 3.1Å; T903-T906 WeakPolarHBondContact OG1-CB 3.19Å; T903-T906 PolarHBondContact OG1-N 3.49Å; T903-T906 VanDerWaalsContact OG1-N 3.14Å; T903-T906 PolarHBondContact OG1-OG1 2.65Å; T903-I907 PolarHBondContact O-N 3.44Å; T903-I907 VanDerWaalsContact O-N 3.12Å; T903-K947 WeakPolarHBondContact CG2-O 3.25Å; T903-V949 CarbonylContact C-O 3.56Å; T903-V949 VanDerWaalsContact CA-O 3.29Å; T903-V949 WeakPolarHBondContact CA-O 3.24Å; T903-F950 HydrophobicContact CG2-CD1 4.16Å; T903-F950 HydrophobicContact CG2-CD2 4.25Å; T903-F950 HydrophobicContact CG2-CE1 3.72Å; T903-F950 HydrophobicContact CG2-CE2 3.82Å; T903-F950 HydrophobicContact CG2-CG 4.41Å; T903-F950 HydrophobicContact CG2-CZ 3.54Å
904	L	95.5	Very high	91.9	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60	-33.3	175.6	-178.2	56.9	0	0	0	110.8	I907 L908 W915 V923 T946 V949 I951 V1027 L1031	L904-I907 WeakPolarHBondContact O-CB 3.33Å; L904-I907 PolarHBondContact O-N 3.1Å; L904-L908 HydrophobicContact CD1-CD1 3.92Å; L904-L908 HydrophobicContact CD1-CG 3.95Å; L904-L908 HydrophobicContact CG-CD1 3.87Å; L904-L908 HydrophobicContact CG-CG 4.32Å; L904-L908 WeakPolarHBondContact O-CB 3.47Å; L904-L908 WeakPolarHBondContact O-CG 3.28Å; L904-L908 PolarHBondContact O-N 2.84Å; L904-W915 HydrophobicContact CD1-CH2 4.25Å; L904-W915 HydrophobicContact CD1-CZ3 4.04Å; L904-V923 HydrophobicContact CD2-CG1 4.13Å; L904-T946 HydrophobicContact CB-CG2 4.48Å; L904-T946 HydrophobicContact CD2-CG2 3.93Å; L904-T946 HydrophobicContact CG-CG2 4Å; L904-T946 PolarHBondContact N-O 2.93Å; L904-V949 HydrophobicContact CB-CB 4.3Å; L904-V949 HydrophobicContact CB-CG1 4.29Å; L904-V949 HydrophobicContact CD2-CG1 4.23Å; L904-V949 PolarHBondContact N-O 3.35Å; L904-I951 HydrophobicContact CB-CG1 4.36Å; L904-I951 HydrophobicContact CD1-CD1 4.5Å; L904-I951 HydrophobicContact CD1-CG1 4.38Å; L904-V1027 HydrophobicContact CD2-CG1 4.23Å; L904-L1031 HydrophobicContact CD1-CD2 3.95Å; L904-L1031 HydrophobicContact CD2-CD2 4.07Å; L904-L1031 HydrophobicContact CD2-CG 4.39Å; L904-L1031 HydrophobicContact CG-CD2 4.5Å
905	H	94.4	Very high	91.9	Very high	31 Å²	31	56.4 Å²	56.4	14%	0.144	25%	0.247	C	C	.	.	H	α-helix	trans	-58.9	-47.5	171.9	175.8	79.1	0	0	0	112.7	T903 I907 L908 H909 T946 K947 F1036	T903-H905 PolarHBondContact O-N 3.18Å; H905-I907 VanDerWaalsContact C-N 3.27Å; H905-I907 PolarHBondContact O-N 3.23Å; H905-L908 PolarHBondContact O-N 3.45Å; H905-H909 AromaticContact CE1-CD2 3.87Å; H905-H909 AromaticContact ND1-CD2 3.31Å; H905-H909 PolarHBondContact ND1-CD2 2.66Å; H905-H909 VanDerWaalsContact ND1-CD2 3.31Å; H905-H909 WeakPolarHBondContact O-CB 3.46Å; H905-H909 PolarHBondContact O-N 2.93Å; H905-T946 WeakPolarHBondContact CB-O 3.33Å; H905-T946 PolarHBondContact N-O 3.06Å; H905-K947 HydrophobicContact CB-CB 4.32Å; H905-K947 HydrophobicContact CB-CG 3.61Å; H905-K947 WeakPolarHBondContact CE1-CE 3.39Å; H905-K947 VanDerWaalsContact CG-CG 3.44Å; H905-K947 VanDerWaalsContact NE2-CE 3.3Å; H905-K947 WeakPolarHBondContact NE2-CE 3.13Å; H905-F1036 AromaticContact CE1-CZ 3.69Å; H905-F1036 AromaticContact ND1-CZ 3.68Å
906	T	93.3	Very high	91.7	Very high	18 Å²	18	59.8 Å²	59.8	11%	0.11	27%	0.265	C	S	.	.	I	π-helix	trans	-66.3	-30.2	177.7	-64.3	0	0	0	0	112.2	T903 V910 R911	T903-T906 PolarHBondContact O-N 2.93Å; T903-T906 VanDerWaalsContact O-N 3.1Å; T903-T906 WeakPolarHBondContact OG1-CB 3.19Å; T903-T906 PolarHBondContact OG1-N 3.49Å; T903-T906 VanDerWaalsContact OG1-N 3.14Å; T903-T906 PolarHBondContact OG1-OG1 2.65Å; T906-V910 HydrophobicContact CG2-CB 4.32Å; T906-V910 WeakPolarHBondContact O-CB 3.47Å; T906-R911 WeakPolarHBondContact O-CB 3.38Å; T906-R911 PolarHBondContact O-N 2.98Å
907	I	93.5	Very high	91.6	Very high	5 Å²	5	61.3 Å²	61.3	3%	0.026	27%	0.273	C	S	.	.	I	π-helix	trans	-70.3	-53.2	175.1	-71.7	163.6	0	0	0	110.8	R902 T903 L904 H905 R912 E913 W915 I951	R902-I907 HydrophobicContact CB-CD1 4.02Å; R902-I907 HydrophobicContact CB-CG1 4.01Å; T903-I907 PolarHBondContact O-N 3.44Å; T903-I907 VanDerWaalsContact O-N 3.12Å; L904-I907 WeakPolarHBondContact O-CB 3.33Å; L904-I907 PolarHBondContact O-N 3.1Å; H905-I907 VanDerWaalsContact C-N 3.27Å; H905-I907 PolarHBondContact O-N 3.23Å; I907-R912 WeakPolarHBondContact O-CA 3.21Å; I907-R912 PolarHBondContact O-N 3.15Å; I907-E913 HydrophobicContact CG2-CB 4.01Å; I907-E913 HydrophobicContact CG2-CG 4.29Å; I907-E913 PolarHBondContact O-N 3Å; I907-E913 VanDerWaalsContact O-N 3.12Å; I907-W915 HydrophobicContact CB-CZ2 4.44Å; I907-W915 HydrophobicContact CD1-CH2 3.96Å; I907-W915 HydrophobicContact CD1-CZ2 3.91Å; I907-W915 HydrophobicContact CG1-CZ2 4.45Å; I907-W915 HydrophobicContact CG2-CD2 4.47Å; I907-W915 HydrophobicContact CG2-CH2 3.81Å; I907-W915 HydrophobicContact CG2-CZ2 3.33Å; I907-W915 HydrophobicContact CG2-CZ3 4.5Å; I907-I951 HydrophobicContact CD1-CB 3.73Å; I907-I951 HydrophobicContact CD1-CG1 3.67Å; I907-I951 HydrophobicContact CD1-CG2 4.34Å
908	L	93.4	Very high	91.4	Very high	7 Å²	7	59.6 Å²	59.6	4%	0.037	27%	0.269	C	S	.	.	I	π-helix	trans	-73.7	-49.3	-174.1	-65.8	174.6	0	0	0	112.9	L904 H905 R912 T946 E1030 L1031	L904-L908 HydrophobicContact CD1-CD1 3.92Å; L904-L908 HydrophobicContact CD1-CG 3.95Å; L904-L908 HydrophobicContact CG-CD1 3.87Å; L904-L908 HydrophobicContact CG-CG 4.32Å; L904-L908 WeakPolarHBondContact O-CB 3.47Å; L904-L908 WeakPolarHBondContact O-CG 3.28Å; L904-L908 PolarHBondContact O-N 2.84Å; H905-L908 PolarHBondContact O-N 3.45Å; L908-R912 VanDerWaalsContact O-CA 3.26Å; L908-R912 WeakPolarHBondContact O-CA 3.37Å; L908-R912 WeakPolarHBondContact O-CG 3.49Å; L908-T946 HydrophobicContact CD1-CG2 4.19Å; L908-E1030 HydrophobicContact CD1-CB 4.15Å; L908-L1031 HydrophobicContact CD1-CD2 4.29Å
909	H	92.3	Very high	91.4	Very high	22 Å²	22	61 Å²	61	10%	0.102	27%	0.271	C	S	.	.	I	π-helix	trans	-96.2	-39.5	-166.9	-61.1	-73	0	0	0	113.7	H905 R912 E1030 F1036	H905-H909 AromaticContact CE1-CD2 3.87Å; H905-H909 AromaticContact ND1-CD2 3.31Å; H905-H909 PolarHBondContact ND1-CD2 2.66Å; H905-H909 VanDerWaalsContact ND1-CD2 3.31Å; H905-H909 WeakPolarHBondContact O-CB 3.46Å; H905-H909 PolarHBondContact O-N 2.93Å; H909-R912 WeakPolarHBondContact O-CG 3.47Å; H909-R912 PolarHBondContact O-NE 2.95Å; H909-E1030 IonicContact CD2-OE2 2.65Å; H909-E1030 IonicContact CE1-OE2 2.63Å; H909-E1030 IonicContact NE2-OE2 3.92Å; H909-E1030 PolarHBondContact NE2-OE2 2.69Å; H909-F1036 AromaticContact CD2-CE2 3.9Å; H909-F1036 AromaticContact CD2-CZ 3.72Å; H909-F1036 AromaticContact CE1-CD2 3.55Å; H909-F1036 AromaticContact CE1-CE2 3.43Å; H909-F1036 VanDerWaalsContact CE1-CE2 3.43Å; H909-F1036 WeakPolarHBondContact CE1-CE2 3.43Å; H909-F1036 AromaticContact CE1-CG 3.92Å; H909-F1036 AromaticContact CE1-CZ 3.7Å; H909-F1036 AromaticContact CG-CE2 3.78Å; H909-F1036 AromaticContact ND1-CD2 3.79Å; H909-F1036 AromaticContact ND1-CE2 3.51Å; H909-F1036 AromaticContact NE2-CE1 3.73Å; H909-F1036 AromaticContact NE2-CE2 3.67Å; H909-F1036 AromaticContact NE2-CZ 3.44Å; H909-F1036 WeakPolarHBondContact NE2-CZ 3.4Å
910	V	91.3	Very high	91.5	Very high	83 Å²	83	61.2 Å²	61.2	50%	0.503	27%	0.27	S	S	.	.	I	π-helix	trans	-86	-54.7	-177.1	-176.1	0	0	0	0	111.2	T906	T906-V910 HydrophobicContact CG2-CB 4.32Å; T906-V910 WeakPolarHBondContact O-CB 3.47Å
911	R	91.3	Very high	91.7	Very high	120 Å²	120	54.1 Å²	54.1	45%	0.453	24%	0.239	S	C	.	.	I	π-helix	trans	-84.4	-26.3	178.9	-71.7	-171.3	165.3	83.7	4.4	113.8	R902 T906 E913	R902-R911 VanDerWaalsContact NH1-CD 3.34Å; T906-R911 WeakPolarHBondContact O-CB 3.38Å; T906-R911 PolarHBondContact O-N 2.98Å; R911-E913 HydrophobicContact CB-CG 3.83Å; R911-E913 WeakPolarHBondContact CD-OE1 3.47Å; R911-E913 PolarHBondContact O-N 3.4Å
912	R	90.8	Very high	91.9	Very high	177 Å²	177	57.1 Å²	57.1	67%	0.668	25%	0.253	S	S	*	.			trans	54.6	42.2	-178.4	-55.5	-177.9	179.9	-159.7	-2.4	112.3	I907 L908 H909 R914	I907-R912 WeakPolarHBondContact O-CA 3.21Å; I907-R912 PolarHBondContact O-N 3.15Å; L908-R912 VanDerWaalsContact O-CA 3.26Å; L908-R912 WeakPolarHBondContact O-CA 3.37Å; L908-R912 WeakPolarHBondContact O-CG 3.49Å; H909-R912 WeakPolarHBondContact O-CG 3.47Å; H909-R912 PolarHBondContact O-NE 2.95Å; R912-R914 PolarHBondContact O-N 2.91Å
913	E	89.5	Confident	92.1	Very high	52 Å²	52	52.7 Å²	52.7	24%	0.243	24%	0.237	C	C	.	.			trans	-62.8	124.1	177	-60.5	-176.1	-162.1	0	0	109.3	R902 I907 R911 W915	R902-E913 IonicContact NH1-OE1 2.75Å; R902-E913 PolarHBondContact NH1-OE1 2.96Å; I907-E913 HydrophobicContact CG2-CB 4.01Å; I907-E913 HydrophobicContact CG2-CG 4.29Å; I907-E913 PolarHBondContact O-N 3Å; I907-E913 VanDerWaalsContact O-N 3.12Å; R911-E913 HydrophobicContact CB-CG 3.83Å; R911-E913 WeakPolarHBondContact CD-OE1 3.47Å; R911-E913 PolarHBondContact O-N 3.4Å; E913-W915 PolarHBondContact O-N 3.15Å; E913-W915 PolarHBondContact OE2-NE1 3.42Å
914	R	85.6	Confident	92.2	Very high	248 Å²	248	52.4 Å²	52.4	94%	0.936	24%	0.235	S	C	*	.			trans	-83.3	117.2	176.1	-68.4	-175.3	178.4	-167.8	-2	109.5	R912	R912-R914 PolarHBondContact O-N 2.91Å
915	W	89.6	Confident	92.2	Very high	32 Å²	32	53 Å²	53	12%	0.121	24%	0.24	C	C	.	.			trans	-112.9	168.7	174	-61.2	-5.1	0	0	0	110.2	L904 I907 E913 R919 F920 V923 I951	L904-W915 HydrophobicContact CD1-CH2 4.25Å; L904-W915 HydrophobicContact CD1-CZ3 4.04Å; I907-W915 HydrophobicContact CB-CZ2 4.44Å; I907-W915 HydrophobicContact CD1-CH2 3.96Å; I907-W915 HydrophobicContact CD1-CZ2 3.91Å; I907-W915 HydrophobicContact CG1-CZ2 4.45Å; I907-W915 HydrophobicContact CG2-CD2 4.47Å; I907-W915 HydrophobicContact CG2-CH2 3.81Å; I907-W915 HydrophobicContact CG2-CZ2 3.33Å; I907-W915 HydrophobicContact CG2-CZ3 4.5Å; E913-W915 PolarHBondContact O-N 3.15Å; E913-W915 PolarHBondContact OE2-NE1 3.42Å; W915-R919 HydrophobicContact CB-CB 4.29Å; W915-R919 HydrophobicContact CD2-CG 4.1Å; W915-R919 VanDerWaalsContact CE2-NH1 3.25Å; W915-R919 HydrophobicContact CE3-CG 3.8Å; W915-R919 HydrophobicContact CG-CG 4.45Å; W915-R919 HydrophobicContact CZ3-CG 4.26Å; W915-F920 HydrophobicContact CB-CD1 4.2Å; W915-F920 HydrophobicContact CB-CE1 3.69Å; W915-F920 HydrophobicContact CB-CZ 4.17Å; W915-F920 HydrophobicContact CE3-CD1 4.06Å; W915-F920 HydrophobicContact CE3-CE1 4.07Å; W915-F920 HydrophobicContact CG-CE1 4.43Å; W915-V923 HydrophobicContact CZ3-CG2 4.03Å; W915-I951 HydrophobicContact CH2-CG1 4.14Å; W915-I951 HydrophobicContact CH2-CG2 4.11Å
916	D	89.8	Confident	92.4	Very high	71 Å²	71	52.8 Å²	52.8	38%	0.38	24%	0.239	S	C	.	.			trans	-96.9	168.3	175.8	84.6	-36.7	0	0	0	112	G918 R919 F920	D916-G918 PolarHBondContact O-N 3.42Å; D916-G918 PolarHBondContact OD1-N 3.46Å; D916-G918 PolarHBondContact OD2-N 2.97Å; D916-R919 PolarHBondContact O-N 3.41Å; D916-R919 WeakPolarHBondContact OD1-CB 3.08Å; D916-R919 PolarHBondContact OD1-N 3.05Å; D916-F920 WeakPolarHBondContact O-CG 3.45Å; D916-F920 PolarHBondContact O-N 2.98Å
917	L	90	Very high	92.6	Very high	48 Å²	48	52 Å²	52	25%	0.251	23%	0.234	S	C	.	.	H	α-helix	trans	-61.7	-29.7	178.7	-175.3	60.9	0	0	0	112.3	F920 V921 W1028 L1032 P1064 T1067	L917-F920 HydrophobicContact CD1-CB 4.46Å; L917-F920 HydrophobicContact CD1-CD2 4.43Å; L917-F920 PolarHBondContact O-N 3.06Å; L917-V921 HydrophobicContact CD1-CG2 4.18Å; L917-V921 HydrophobicContact CG-CG2 4.27Å; L917-V921 WeakPolarHBondContact O-CB 3.34Å; L917-V921 VanDerWaalsContact O-CG2 3.3Å; L917-V921 WeakPolarHBondContact O-CG2 3.45Å; L917-V921 PolarHBondContact O-N 3.1Å; L917-W1028 HydrophobicContact CD1-CH2 4.07Å; L917-L1032 HydrophobicContact CD1-CD2 3.92Å; L917-P1064 HydrophobicContact CD2-CG 4.06Å; L917-T1067 HydrophobicContact CD1-CG2 4.1Å; L917-T1067 HydrophobicContact CD2-CG2 4.12Å
918	G	90.6	Very high	92.8	Very high	18 Å²	18	51.8 Å²	51.8	19%	0.186	23%	0.233	C	C	.	.	H	α-helix	trans	-61	-46.5	174.5	0	0	0	0	0	112.4	D916 V921 N922	D916-G918 PolarHBondContact O-N 3.42Å; D916-G918 PolarHBondContact OD1-N 3.46Å; D916-G918 PolarHBondContact OD2-N 2.97Å; G918-V921 PolarHBondContact O-N 3.4Å; G918-N922 WeakPolarHBondContact O-CB 3.47Å; G918-N922 PolarHBondContact O-N 3.33Å
919	R	91.8	Very high	93	Very high	62 Å²	62	54.5 Å²	54.5	23%	0.234	25%	0.246	C	C	.	.	H	α-helix	trans	-68.5	-37.1	175.5	-166.1	169.8	-175.2	-168.2	0.4	112.4	W915 D916 N922 V923 N954	W915-R919 HydrophobicContact CB-CB 4.29Å; W915-R919 HydrophobicContact CD2-CG 4.1Å; W915-R919 VanDerWaalsContact CE2-NH1 3.25Å; W915-R919 HydrophobicContact CE3-CG 3.8Å; W915-R919 HydrophobicContact CG-CG 4.45Å; W915-R919 HydrophobicContact CZ3-CG 4.26Å; D916-R919 PolarHBondContact O-N 3.41Å; D916-R919 WeakPolarHBondContact OD1-CB 3.08Å; D916-R919 PolarHBondContact OD1-N 3.05Å; R919-N922 PolarHBondContact O-N 3.37Å; R919-V923 WeakPolarHBondContact O-CG2 3.31Å; R919-V923 PolarHBondContact O-N 3.04Å; R919-N954 PolarHBondContact NE-O 2.97Å; R919-N954 PolarHBondContact NH2-O 3.17Å; R919-N954 PolarHBondContact NH2-OD1 2.84Å
920	F	93.6	Very high	93.2	Very high	28 Å²	28	53.5 Å²	53.5	12%	0.123	24%	0.241	C	C	.	.	H	α-helix	trans	-61.8	-47.2	173.1	-63.6	-29.2	0	0	0	112.4	W915 D916 L917 N922 V923 A924 W1028 L1031 L1032	W915-F920 HydrophobicContact CB-CD1 4.2Å; W915-F920 HydrophobicContact CB-CE1 3.69Å; W915-F920 HydrophobicContact CB-CZ 4.17Å; W915-F920 HydrophobicContact CE3-CD1 4.06Å; W915-F920 HydrophobicContact CE3-CE1 4.07Å; W915-F920 HydrophobicContact CG-CE1 4.43Å; D916-F920 WeakPolarHBondContact O-CG 3.45Å; D916-F920 PolarHBondContact O-N 2.98Å; L917-F920 HydrophobicContact CD1-CB 4.46Å; L917-F920 HydrophobicContact CD1-CD2 4.43Å; L917-F920 PolarHBondContact O-N 3.06Å; F920-N922 VanDerWaalsContact C-N 3.33Å; F920-N922 PolarHBondContact O-N 3.46Å; F920-V923 PolarHBondContact O-N 3.43Å; F920-A924 VanDerWaalsContact O-CB 3.26Å; F920-A924 WeakPolarHBondContact O-CB 3.37Å; F920-A924 PolarHBondContact O-N 3.47Å; F920-W1028 HydrophobicContact CB-CH2 4.44Å; F920-W1028 HydrophobicContact CB-CZ3 4Å; F920-L1031 HydrophobicContact CD1-CB 4.15Å; F920-L1031 HydrophobicContact CD1-CD2 3.64Å; F920-L1031 HydrophobicContact CD1-CG 4.5Å; F920-L1031 HydrophobicContact CE1-CD2 4.11Å; F920-L1031 WeakPolarHBondContact CE2-O 3.34Å; F920-L1031 HydrophobicContact CG-CB 4.28Å; F920-L1031 HydrophobicContact CG-CD2 4.42Å; F920-L1031 WeakPolarHBondContact CZ-O 3.03Å; F920-L1032 HydrophobicContact CD2-CD2 4.48Å
921	V	94	Very high	93.5	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.012	22%	0.217	C	C	.	.	H	α-helix	trans	-62.6	-39.5	177.6	167.5	0	0	0	0	111.5	L917 G918 A924 A925 W1028 F1092 L1095 R1097	L917-V921 HydrophobicContact CD1-CG2 4.18Å; L917-V921 HydrophobicContact CG-CG2 4.27Å; L917-V921 WeakPolarHBondContact O-CB 3.34Å; L917-V921 VanDerWaalsContact O-CG2 3.3Å; L917-V921 WeakPolarHBondContact O-CG2 3.45Å; L917-V921 PolarHBondContact O-N 3.1Å; G918-V921 PolarHBondContact O-N 3.4Å; V921-A924 PolarHBondContact O-N 3.32Å; V921-A925 VanDerWaalsContact O-CB 3.31Å; V921-A925 WeakPolarHBondContact O-CB 3.3Å; V921-A925 PolarHBondContact O-N 2.91Å; V921-W1028 HydrophobicContact CG2-CH2 3.98Å; V921-F1092 HydrophobicContact CG1-CB 4.26Å; V921-F1092 HydrophobicContact CG1-CD1 4.26Å; V921-F1092 WeakPolarHBondContact CG1-O 3.46Å; V921-F1092 HydrophobicContact CG2-CD1 4.46Å; V921-L1095 HydrophobicContact CG2-CB 4.29Å; V921-L1095 HydrophobicContact CG2-CD1 3.74Å; V921-R1097 HydrophobicContact CG1-CG 4.28Å
922	N	94	Very high	93.8	Very high	73 Å²	73	44.6 Å²	44.6	39%	0.39	20%	0.201	S	C	.	.	H	α-helix	trans	-62	-48.8	175.5	-172.1	-10.2	0	0	0	111.7	G918 R919 F920 A924 A925 Q926	G918-N922 WeakPolarHBondContact O-CB 3.47Å; G918-N922 PolarHBondContact O-N 3.33Å; R919-N922 PolarHBondContact O-N 3.37Å; F920-N922 VanDerWaalsContact C-N 3.33Å; F920-N922 PolarHBondContact O-N 3.46Å; N922-A924 PolarHBondContact O-N 2.61Å; N922-A925 PolarHBondContact O-N 2.97Å; N922-Q926 PolarHBondContact O-N 2.79Å; N922-Q926 VanDerWaalsContact O-N 3.09Å; N922-Q926 PolarHBondContact OD1-NE2 2.96Å
923	V	95.6	Very high	94.1	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.024	18%	0.181	C	C	.	.	H	α-helix	trans	-63.6	-43.5	177.9	169.8	0	0	0	0	111.6	L904 W915 R919 F920 A925 Q926 V927 I951 V957	L904-V923 HydrophobicContact CD2-CG1 4.13Å; W915-V923 HydrophobicContact CZ3-CG2 4.03Å; R919-V923 WeakPolarHBondContact O-CG2 3.31Å; R919-V923 PolarHBondContact O-N 3.04Å; F920-V923 PolarHBondContact O-N 3.43Å; V923-A925 PolarHBondContact O-N 3.28Å; V923-Q926 PolarHBondContact O-N 2.82Å; V923-V927 WeakPolarHBondContact O-CG2 3.32Å; V923-V927 PolarHBondContact O-N 2.79Å; V923-I951 HydrophobicContact CG1-CD1 3.96Å; V923-I951 HydrophobicContact CG2-CD1 4.05Å; V923-V957 HydrophobicContact CB-CG2 4.11Å; V923-V957 HydrophobicContact CG1-CG2 3.95Å; V923-V957 HydrophobicContact CG2-CG2 3.92Å
924	A	96.4	Very high	94.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.8	-41.4	177.8	0	0	0	0	0	112.6	F920 V921 N922 V927 C928 F1024 W1028 F1092	F920-A924 VanDerWaalsContact O-CB 3.26Å; F920-A924 WeakPolarHBondContact O-CB 3.37Å; F920-A924 PolarHBondContact O-N 3.47Å; V921-A924 PolarHBondContact O-N 3.32Å; N922-A924 PolarHBondContact O-N 2.61Å; A924-V927 PolarHBondContact O-N 2.65Å; A924-C928 PolarHBondContact O-N 3.31Å; A924-C928 PolarHBondContact O-SG 3.22Å; A924-F1024 HydrophobicContact CB-CE2 4.48Å; A924-F1024 HydrophobicContact CB-CZ 4.09Å; A924-W1028 HydrophobicContact CB-CE3 3.68Å; A924-W1028 HydrophobicContact CB-CZ3 3.68Å; A924-F1092 HydrophobicContact CB-CD1 4.06Å; A924-F1092 HydrophobicContact CB-CE1 3.61Å; A924-F1092 HydrophobicContact CB-CE2 4.16Å; A924-F1092 HydrophobicContact CB-CZ 3.67Å
925	A	96.4	Very high	94.8	Very high	12 Å²	12	26.8 Å²	26.8	10%	0.099	13%	0.134	C	C	.	.	H	α-helix	trans	-63.6	-47.6	176	0	0	0	0	0	112.1	V921 N922 V923 V927 C928 Q929 L1089 F1092	V921-A925 VanDerWaalsContact O-CB 3.31Å; V921-A925 WeakPolarHBondContact O-CB 3.3Å; V921-A925 PolarHBondContact O-N 2.91Å; N922-A925 PolarHBondContact O-N 2.97Å; V923-A925 PolarHBondContact O-N 3.28Å; A925-V927 VanDerWaalsContact C-N 3.33Å; A925-V927 PolarHBondContact O-N 3.32Å; A925-C928 CarbonylContact O-C 3.55Å; A925-C928 WeakPolarHBondContact O-CA 3.34Å; A925-C928 WeakPolarHBondContact O-CB 3.33Å; A925-C928 PolarHBondContact O-N 2.81Å; A925-C928 VanDerWaalsContact O-N 3.08Å; A925-Q929 PolarHBondContact O-N 3.38Å; A925-L1089 HydrophobicContact CB-CD2 4.43Å; A925-L1089 VanDerWaalsContact O-CD2 3.32Å; A925-L1089 WeakPolarHBondContact O-CD2 3.17Å; A925-F1092 HydrophobicContact CB-CB 4.17Å
926	Q	97.1	Very high	94.9	Very high	27 Å²	27	28.2 Å²	28.2	13%	0.126	16%	0.158	C	C	.	.	H	α-helix	trans	-62.8	-35.9	177.3	-75.2	-179.4	62.9	0	0	112.9	N878 N922 V923 Q929 G930 S955 V957	N878-Q926 WeakPolarHBondContact CB-O 3.32Å; N878-Q926 PolarHBondContact ND2-OE1 3.35Å; N878-Q926 VanDerWaalsContact ND2-OE1 3.08Å; N878-Q926 PolarHBondContact OD1-O 3.05Å; N922-Q926 PolarHBondContact O-N 2.79Å; N922-Q926 VanDerWaalsContact O-N 3.09Å; N922-Q926 PolarHBondContact OD1-NE2 2.96Å; V923-Q926 PolarHBondContact O-N 2.82Å; Q926-Q929 PolarHBondContact O-N 3.38Å; Q926-G930 PolarHBondContact O-N 3.32Å; Q926-G930 VanDerWaalsContact O-N 3.1Å; Q926-S955 PolarHBondContact NE2-O 3.38Å; Q926-V957 HydrophobicContact CB-CB 3.76Å; Q926-V957 HydrophobicContact CB-CG2 3.73Å; Q926-V957 HydrophobicContact CG-CG2 4.36Å
927	V	98	Very high	95	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.006	16%	0.162	C	C	.	.	H	α-helix	trans	-63.1	-44.8	171	174.5	0	0	0	0	110.7	V923 A924 A925 Q929 G930 M931 L944 V949 V957 I959 F1024	V923-V927 WeakPolarHBondContact O-CG2 3.32Å; V923-V927 PolarHBondContact O-N 2.79Å; A924-V927 PolarHBondContact O-N 2.65Å; A925-V927 VanDerWaalsContact C-N 3.33Å; A925-V927 PolarHBondContact O-N 3.32Å; V927-Q929 VanDerWaalsContact C-N 3.29Å; V927-Q929 PolarHBondContact O-N 3.3Å; V927-G930 PolarHBondContact O-N 3.04Å; V927-M931 HydrophobicContact CG1-CG 4.25Å; V927-M931 WeakPolarHBondContact O-CB 3.45Å; V927-M931 VanDerWaalsContact O-CG 3.32Å; V927-M931 WeakPolarHBondContact O-CG 3.32Å; V927-M931 PolarHBondContact O-N 3.47Å; V927-L944 HydrophobicContact CG1-CD1 4.23Å; V927-V949 HydrophobicContact CG2-CG1 4.02Å; V927-V949 HydrophobicContact CG2-CG2 4.43Å; V927-V957 HydrophobicContact CG2-CG1 3.82Å; V927-I959 HydrophobicContact CG1-CD1 4.18Å; V927-F1024 HydrophobicContact CB-CD2 4.4Å; V927-F1024 HydrophobicContact CB-CE2 4.05Å; V927-F1024 HydrophobicContact CG1-CD2 3.68Å; V927-F1024 HydrophobicContact CG1-CE2 3.85Å
928	C	97.8	Very high	95	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.6	-34.9	176.8	-66.5	0	0	0	0	112.8	A924 A925 S932 F1024 F1085 L1089	A924-C928 PolarHBondContact O-N 3.31Å; A924-C928 PolarHBondContact O-SG 3.22Å; A925-C928 CarbonylContact O-C 3.55Å; A925-C928 WeakPolarHBondContact O-CA 3.34Å; A925-C928 WeakPolarHBondContact O-CB 3.33Å; A925-C928 PolarHBondContact O-N 2.81Å; A925-C928 VanDerWaalsContact O-N 3.08Å; C928-S932 VanDerWaalsContact O-CB 3.23Å; C928-S932 WeakPolarHBondContact O-CB 3.49Å; C928-S932 PolarHBondContact O-N 2.85Å; C928-F1024 WeakPolarHBondContact SG-CZ 3.37Å; C928-F1085 HydrophobicContact CB-CD1 4Å; C928-L1089 HydrophobicContact CB-CD2 3.69Å; C928-L1089 HydrophobicContact CB-CG 3.78Å
929	Q	97.4	Very high	94.9	Very high	65 Å²	65	36.1 Å²	36.1	30%	0.304	18%	0.182	S	C	.	.	H	α-helix	trans	-65.8	-50.6	177.4	-165.1	-171.8	-42.3	0	0	111.1	H876 E877 A925 Q926 V927 M931 S932 Y933 L1089	H876-Q929 PolarHBondContact CE1-NE2 3.49Å; H876-Q929 PolarHBondContact NE2-NE2 3.18Å; E877-Q929 PolarHBondContact OE1-NE2 3.19Å; A925-Q929 PolarHBondContact O-N 3.38Å; Q926-Q929 PolarHBondContact O-N 3.38Å; V927-Q929 VanDerWaalsContact C-N 3.29Å; V927-Q929 PolarHBondContact O-N 3.3Å; Q929-M931 PolarHBondContact O-N 3.26Å; Q929-S932 PolarHBondContact O-N 2.73Å; Q929-Y933 PolarHBondContact O-N 2.99Å; Q929-Y933 VanDerWaalsContact O-N 3.13Å; Q929-L1089 HydrophobicContact CB-CD2 4.34Å
930	G	97	Very high	94.9	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.1	-41	174.8	0	0	0	0	0	113.4	Q926 V927 Y933 L934	Q926-G930 PolarHBondContact O-N 3.32Å; Q926-G930 VanDerWaalsContact O-N 3.1Å; V927-G930 PolarHBondContact O-N 3.04Å; G930-Y933 PolarHBondContact O-N 2.77Å; G930-L934 PolarHBondContact O-N 3.12Å
931	M	98	Very high	94.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-69.5	-36.1	176.9	-73.1	-55.5	-51.4	0	0	113.4	V927 Q929 Y933 L934 H935 H941 L944 I959 D1020 F1085	V927-M931 HydrophobicContact CG1-CG 4.25Å; V927-M931 WeakPolarHBondContact O-CB 3.45Å; V927-M931 VanDerWaalsContact O-CG 3.32Å; V927-M931 WeakPolarHBondContact O-CG 3.32Å; V927-M931 PolarHBondContact O-N 3.47Å; Q929-M931 PolarHBondContact O-N 3.26Å; M931-Y933 VanDerWaalsContact C-N 3.34Å; M931-L934 HydrophobicContact CE-CD1 4.46Å; M931-L934 PolarHBondContact O-N 3.2Å; M931-L934 HydrophobicContact SD-CD1 4Å; M931-H935 PolarHBondContact O-N 3Å; M931-H941 HydrophobicContact CE-CB 3.79Å; M931-H941 HydrophobicContact SD-CB 4.05Å; M931-L944 HydrophobicContact CE-CD2 4.29Å; M931-L944 HydrophobicContact CG-CD1 4.49Å; M931-L944 HydrophobicContact CG-CD2 3.85Å; M931-L944 HydrophobicContact SD-CD1 4.15Å; M931-L944 HydrophobicContact SD-CD2 3.89Å; M931-I959 HydrophobicContact CG-CD1 3.97Å; M931-I959 HydrophobicContact SD-CD1 4.14Å; M931-D1020 HydrophobicContact CE-CB 3.83Å; M931-D1020 WeakPolarHBondContact CE-OD2 3.34Å; M931-F1085 HydrophobicContact CB-CD1 3.81Å; M931-F1085 HydrophobicContact CB-CD2 3.62Å; M931-F1085 HydrophobicContact CB-CE1 3.79Å; M931-F1085 HydrophobicContact CB-CE2 3.62Å; M931-F1085 HydrophobicContact CB-CG 3.72Å; M931-F1085 HydrophobicContact CB-CZ 3.7Å; M931-F1085 HydrophobicContact CE-CE2 3.88Å; M931-F1085 HydrophobicContact CE-CZ 4.23Å; M931-F1085 HydrophobicContact CG-CE1 4.04Å; M931-F1085 HydrophobicContact CG-CE2 4.12Å; M931-F1085 HydrophobicContact CG-CZ 3.82Å
932	S	96.8	Very high	94.7	Very high	17 Å²	17	35.1 Å²	35.1	12%	0.119	18%	0.181	C	C	.	.	H	α-helix	trans	-62.9	-41.4	174.5	-173.6	0	0	0	0	111.6	C928 Q929 H935 G936 N1086	C928-S932 VanDerWaalsContact O-CB 3.23Å; C928-S932 WeakPolarHBondContact O-CB 3.49Å; C928-S932 PolarHBondContact O-N 2.85Å; Q929-S932 PolarHBondContact O-N 2.73Å; S932-H935 PolarHBondContact O-N 3Å; S932-G936 PolarHBondContact O-N 3.39Å; S932-N1086 PolarHBondContact OG-ND2 2.88Å; S932-N1086 VanDerWaalsContact OG-ND2 3.09Å; S932-N1086 PolarHBondContact OG-OD1 2.79Å
933	Y	96.5	Very high	94.6	Very high	62 Å²	62	32 Å²	32	24%	0.243	16%	0.164	C	C	.	.	H	α-helix	trans	-58.4	-48	173	178.7	-81.4	0	0	0	112	S873 T874 R875 H876 L879 Q929 G930 M931 H935 G936 K937	S873-Y933 PolarHBondContact O-OH 3.19Å; T874-Y933 HydrophobicContact CG2-CE1 4.36Å; R875-Y933 PolarHBondContact N-OH 2.99Å; R875-Y933 PolarHBondContact O-OH 3.25Å; H876-Y933 HydrophobicContact CB-CD1 4.09Å; H876-Y933 HydrophobicContact CB-CD2 3.97Å; H876-Y933 HydrophobicContact CB-CE1 4.33Å; H876-Y933 HydrophobicContact CB-CE2 4.2Å; H876-Y933 HydrophobicContact CB-CG 3.91Å; H876-Y933 AromaticContact CD2-CD2 3.83Å; L879-Y933 HydrophobicContact CD1-CD1 3.58Å; L879-Y933 HydrophobicContact CD1-CE1 4.01Å; L879-Y933 HydrophobicContact CD1-CG 4.44Å; Q929-Y933 PolarHBondContact O-N 2.99Å; Q929-Y933 VanDerWaalsContact O-N 3.13Å; G930-Y933 PolarHBondContact O-N 2.77Å; M931-Y933 VanDerWaalsContact C-N 3.34Å; Y933-H935 PolarHBondContact O-N 3.27Å; Y933-G936 PolarHBondContact O-N 3.49Å; Y933-K937 HydrophobicContact CD1-CG 4.32Å; Y933-K937 HydrophobicContact CE1-CG 3.9Å; Y933-K937 PolarHBondContact O-N 3.4Å
934	L	94.9	Very high	94.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.8	-47.3	177.9	-71.9	176.9	0	0	0	111.6	T874 L879 G930 M931 G936 K937 K938 I939 F962	T874-L934 HydrophobicContact CG2-CD2 4.21Å; L879-L934 HydrophobicContact CD1-CD2 3.67Å; L879-L934 HydrophobicContact CD1-CG 3.86Å; L879-L934 HydrophobicContact CD2-CD1 3.88Å; L879-L934 HydrophobicContact CD2-CD2 4.44Å; L879-L934 HydrophobicContact CD2-CG 4.01Å; G930-L934 PolarHBondContact O-N 3.12Å; M931-L934 HydrophobicContact CE-CD1 4.46Å; M931-L934 PolarHBondContact O-N 3.2Å; M931-L934 HydrophobicContact SD-CD1 4Å; L934-G936 VanDerWaalsContact C-N 3.33Å; L934-G936 PolarHBondContact O-N 3.42Å; L934-K937 CarbonylContact O-C 3.56Å; L934-K937 WeakPolarHBondContact O-CA 3.39Å; L934-K937 WeakPolarHBondContact O-CB 3.27Å; L934-K937 PolarHBondContact O-N 3.33Å; L934-K937 VanDerWaalsContact O-N 3.09Å; L934-K938 PolarHBondContact O-N 3.18Å; L934-K938 VanDerWaalsContact O-N 3.1Å; L934-I939 CarbonylContact C-O 3.57Å; L934-I939 HydrophobicContact CB-CB 4.28Å; L934-I939 HydrophobicContact CD2-CB 4.08Å; L934-I939 HydrophobicContact CD2-CD1 4.1Å; L934-I939 HydrophobicContact CD2-CG2 3.98Å; L934-I939 PolarHBondContact O-N 2.82Å; L934-F962 HydrophobicContact CD1-CB 3.74Å; L934-F962 HydrophobicContact CD1-CD1 4.21Å; L934-F962 HydrophobicContact CD1-CD2 4.5Å; L934-F962 HydrophobicContact CD1-CG 3.92Å; L934-F962 HydrophobicContact CD2-CD2 3.89Å; L934-F962 HydrophobicContact CD2-CE2 4.12Å; L934-F962 HydrophobicContact CD2-CG 4.1Å
935	H	94.7	Very high	94.5	Very high	41 Å²	41	34 Å²	34	19%	0.19	17%	0.172	C	C	.	.	H	α-helix	trans	-66.5	-33.5	179.1	-73.5	-164.6	0	0	0	112.6	M931 S932 Y933 K937 K938 I939 G1017 D1020 F1085	M931-H935 PolarHBondContact O-N 3Å; S932-H935 PolarHBondContact O-N 3Å; Y933-H935 PolarHBondContact O-N 3.27Å; H935-K937 VanDerWaalsContact C-N 3.34Å; H935-K938 WeakPolarHBondContact O-CA 3.47Å; H935-K938 PolarHBondContact O-N 3.31Å; H935-I939 PolarHBondContact CD2-O 3.4Å; H935-G1017 WeakPolarHBondContact CE1-CA 3.42Å; H935-G1017 PolarHBondContact CE1-O 3.19Å; H935-D1020 IonicContact CD2-OD2 3.2Å; H935-D1020 IonicContact CE1-OD2 3.76Å; H935-D1020 IonicContact NE2-OD2 2.83Å; H935-D1020 PolarHBondContact NE2-OD2 2.8Å; H935-F1085 AromaticContact CE1-CD2 3.56Å; H935-F1085 AromaticContact CE1-CE2 3.43Å; H935-F1085 VanDerWaalsContact CE1-CE2 3.43Å; H935-F1085 WeakPolarHBondContact CE1-CE2 3.49Å; H935-F1085 AromaticContact ND1-CD2 3.59Å; H935-F1085 AromaticContact ND1-CE2 3.97Å
936	G	93.6	Very high	94.5	Very high	61 Å²	61	33.5 Å²	33.5	63%	0.629	17%	0.167	S	C	*	.	H	α-helix	trans	-61.3	-40.4	169.7	0	0	0	0	0	112.4	S932 Y933 L934 K938	S932-G936 PolarHBondContact O-N 3.39Å; Y933-G936 PolarHBondContact O-N 3.49Å; L934-G936 VanDerWaalsContact C-N 3.33Å; L934-G936 PolarHBondContact O-N 3.42Å; G936-K938 PolarHBondContact O-N 2.83Å
937	K	90.8	Very high	94.2	Very high	105 Å²	105	36 Å²	36	46%	0.457	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	5.1	171	-68.6	-68.2	-170.3	175.8	0	114.3	Y933 L934 H935 I939	Y933-K937 HydrophobicContact CD1-CG 4.32Å; Y933-K937 HydrophobicContact CE1-CG 3.9Å; Y933-K937 PolarHBondContact O-N 3.4Å; L934-K937 CarbonylContact O-C 3.56Å; L934-K937 WeakPolarHBondContact O-CA 3.39Å; L934-K937 WeakPolarHBondContact O-CB 3.27Å; L934-K937 PolarHBondContact O-N 3.33Å; L934-K937 VanDerWaalsContact O-N 3.09Å; H935-K937 VanDerWaalsContact C-N 3.34Å; K937-I939 HydrophobicContact CB-CD1 3.92Å; K937-I939 HydrophobicContact CB-CG1 4.12Å; K937-I939 PolarHBondContact O-N 2.78Å
938	K	89.9	Confident	94.1	Very high	181 Å²	181	36.2 Å²	36.2	79%	0.787	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.6	19.5	-175.4	-49.6	-60.8	-177.3	178.5	0	115	L934 H935 G936	L934-K938 PolarHBondContact O-N 3.18Å; L934-K938 VanDerWaalsContact O-N 3.1Å; H935-K938 WeakPolarHBondContact O-CA 3.47Å; H935-K938 PolarHBondContact O-N 3.31Å; G936-K938 PolarHBondContact O-N 2.83Å
939	I	89.5	Confident	94	Very high	17 Å²	17	36.2 Å²	36.2	9%	0.087	18%	0.178	C	C	.	.			trans	-90.6	127.4	177.5	-58.3	168.3	0	0	0	109.2	T870 T874 L934 H935 K937 F962	T870-I939 HydrophobicContact CG2-CB 4.42Å; T870-I939 HydrophobicContact CG2-CD1 3.89Å; T870-I939 HydrophobicContact CG2-CG1 3.97Å; T870-I939 HydrophobicContact CG2-CG2 3.58Å; T874-I939 HydrophobicContact CG2-CD1 3.41Å; T874-I939 VanDerWaalsContact CG2-CD1 3.41Å; L934-I939 CarbonylContact C-O 3.57Å; L934-I939 HydrophobicContact CB-CB 4.28Å; L934-I939 HydrophobicContact CD2-CB 4.08Å; L934-I939 HydrophobicContact CD2-CD1 4.1Å; L934-I939 HydrophobicContact CD2-CG2 3.98Å; L934-I939 PolarHBondContact O-N 2.82Å; H935-I939 PolarHBondContact CD2-O 3.4Å; K937-I939 HydrophobicContact CB-CD1 3.92Å; K937-I939 HydrophobicContact CB-CG1 4.12Å; K937-I939 PolarHBondContact O-N 2.78Å; I939-F962 HydrophobicContact CG2-CD2 4.46Å
940	I	91.6	Very high	93.9	Very high	38 Å²	38	34.9 Å²	34.9	20%	0.195	17%	0.172	C	C	.	.			trans	-100.2	134.9	174.3	-53	-51.4	0	0	0	108.8	K942 F1015 D1020	I940-K942 HydrophobicContact CB-CG 4.44Å; I940-K942 HydrophobicContact CG2-CG 4.01Å; I940-F1015 HydrophobicContact CG2-CB 4.24Å; I940-D1020 WeakPolarHBondContact CG2-OD2 3.41Å
941	H	93.2	Very high	93.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.174	C	C	.	.			trans	-77.5	-37	-175.7	-173.7	-23.3	0	0	0	112.4	M931 D943 L944 I959 T960 F962 G963 D1020	M931-H941 HydrophobicContact CE-CB 3.79Å; M931-H941 HydrophobicContact SD-CB 4.05Å; H941-D943 PolarHBondContact CE1-O 2.85Å; H941-D943 PolarHBondContact O-N 2.72Å; H941-L944 HydrophobicContact CB-CB 4.34Å; H941-I959 WeakPolarHBondContact NE2-CG2 3.34Å; H941-T960 PolarHBondContact CE1-O 3.38Å; H941-T960 VanDerWaalsContact CE1-O 3.23Å; H941-T960 PolarHBondContact NE2-O 3.41Å; H941-F962 HydrophobicContact CB-CB 4.3Å; H941-F962 WeakPolarHBondContact ND1-CA 3.18Å; H941-G963 PolarHBondContact O-N 3Å; H941-D1020 PolarHBondContact N-OD1 3.39Å; H941-D1020 PolarHBondContact N-OD2 3.4Å
942	K	90.6	Very high	93.5	Very high	33 Å²	33	36.3 Å²	36.3	14%	0.143	18%	0.179	C	C	.	.	S	Bend	trans	67.3	-31.7	178.2	-49.9	-177.1	-173.9	178.3	0	116.1	I940 F965 E1012 F1015 D1020	I940-K942 HydrophobicContact CB-CG 4.44Å; I940-K942 HydrophobicContact CG2-CG 4.01Å; K942-F965 HydrophobicContact CB-CB 3.76Å; K942-F965 HydrophobicContact CB-CD1 4.31Å; K942-F965 HydrophobicContact CB-CG 4.26Å; K942-F965 HydrophobicContact CD-CB 4.35Å; K942-E1012 IonicContact NZ-OE1 2.63Å; K942-E1012 PolarHBondContact NZ-OE1 3.06Å; K942-F1015 HydrophobicContact CB-CB 4.45Å; K942-F1015 HydrophobicContact CB-CD1 3.95Å; K942-F1015 HydrophobicContact CB-CD2 4.19Å; K942-F1015 HydrophobicContact CB-CE1 4.16Å; K942-F1015 HydrophobicContact CB-CE2 4.38Å; K942-F1015 HydrophobicContact CB-CG 3.96Å; K942-F1015 HydrophobicContact CB-CZ 4.37Å; K942-F1015 HydrophobicContact CD-CB 4.35Å; K942-F1015 HydrophobicContact CD-CD2 4.05Å; K942-F1015 HydrophobicContact CD-CG 4.28Å; K942-F1015 HydrophobicContact CG-CB 3.85Å; K942-F1015 HydrophobicContact CG-CD1 4.29Å; K942-F1015 HydrophobicContact CG-CD2 4.11Å; K942-F1015 HydrophobicContact CG-CG 3.85Å; K942-F1015 WeakPolarHBondContact O-CE1 3.43Å; K942-D1020 PolarHBondContact N-OD1 2.96Å
943	D	90.5	Very high	92.9	Very high	7 Å²	7	42 Å²	42	4%	0.037	21%	0.208	C	C	.	.			trans	-128.6	46.5	177.7	-168.7	52.4	0	0	0	112	H941 R945 N948 F965 W988	H941-D943 PolarHBondContact CE1-O 2.85Å; H941-D943 PolarHBondContact O-N 2.72Å; D943-R945 PolarHBondContact O-N 3.03Å; D943-R945 IonicContact OD1-CZ 3.99Å; D943-R945 IonicContact OD1-NE 2.67Å; D943-R945 IonicContact OD1-NH1 3.74Å; D943-R945 PolarHBondContact OD1-NH1 3.25Å; D943-R945 IonicContact OD2-CZ 2.77Å; D943-R945 IonicContact OD2-NE 2.64Å; D943-R945 PolarHBondContact OD2-NE 2.85Å; D943-R945 VanDerWaalsContact OD2-NE 3.17Å; D943-R945 IonicContact OD2-NH1 3.69Å; D943-R945 PolarHBondContact OD2-NH1 3.16Å; D943-R945 IonicContact OD2-NH2 2.76Å; D943-R945 PolarHBondContact OD2-NH2 3.14Å; D943-N948 PolarHBondContact O-ND2 3.13Å; D943-N948 PolarHBondContact OD2-ND2 2.69Å; D943-F965 HydrophobicContact CB-CB 4.3Å; D943-F965 HydrophobicContact CB-CD2 4.07Å; D943-F965 HydrophobicContact CB-CG 4.48Å; D943-W988 PolarHBondContact OD1-NE1 3.21Å
944	L	95.8	Very high	92	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	23%	0.226	C	C	.	.			trans	-72.4	111.4	175.9	177.1	63.2	0	0	0	110.9	V927 M931 H941 V949 I959 S1023 F1024 F1085	V927-L944 HydrophobicContact CG1-CD1 4.23Å; M931-L944 HydrophobicContact CE-CD2 4.29Å; M931-L944 HydrophobicContact CG-CD1 4.49Å; M931-L944 HydrophobicContact CG-CD2 3.85Å; M931-L944 HydrophobicContact SD-CD1 4.15Å; M931-L944 HydrophobicContact SD-CD2 3.89Å; H941-L944 HydrophobicContact CB-CB 4.34Å; L944-V949 HydrophobicContact CD1-CG2 4.3Å; L944-I959 HydrophobicContact CD1-CG2 4.43Å; L944-S1023 VanDerWaalsContact O-CB 3.26Å; L944-S1023 WeakPolarHBondContact O-CB 3.33Å; L944-F1024 HydrophobicContact CD2-CB 3.87Å; L944-F1085 HydrophobicContact CD2-CZ 4.11Å
945	R	94.8	Very high	91.5	Very high	47 Å²	47	47.9 Å²	47.9	18%	0.177	25%	0.249	C	C	.	.	S	Bend	trans	-156.2	163.5	-173.6	63.9	-175.7	-170	-164.4	-0.7	112.2	D943 K947 N948 Y991	D943-R945 PolarHBondContact O-N 3.03Å; D943-R945 IonicContact OD1-CZ 3.99Å; D943-R945 IonicContact OD1-NE 2.67Å; D943-R945 IonicContact OD1-NH1 3.74Å; D943-R945 PolarHBondContact OD1-NH1 3.25Å; D943-R945 IonicContact OD2-CZ 2.77Å; D943-R945 IonicContact OD2-NE 2.64Å; D943-R945 PolarHBondContact OD2-NE 2.85Å; D943-R945 VanDerWaalsContact OD2-NE 3.17Å; D943-R945 IonicContact OD2-NH1 3.69Å; D943-R945 PolarHBondContact OD2-NH1 3.16Å; D943-R945 IonicContact OD2-NH2 2.76Å; D943-R945 PolarHBondContact OD2-NH2 3.14Å; R945-K947 HydrophobicContact CG-CB 4.21Å; R945-K947 PolarHBondContact O-N 3.43Å; R945-N948 HydrophobicContact CG-CB 4.19Å; R945-N948 VanDerWaalsContact CZ-OD1 3.25Å; R945-N948 VanDerWaalsContact NE-CG 3.32Å; R945-N948 PolarHBondContact NE-ND2 3.5Å; R945-N948 PolarHBondContact NE-OD1 3.07Å; R945-N948 PolarHBondContact NH2-OD1 2.83Å; R945-N948 PolarHBondContact O-N 2.69Å; R945-Y991 HydrophobicContact CB-CD1 3.88Å; R945-Y991 HydrophobicContact CB-CD2 4.32Å; R945-Y991 HydrophobicContact CB-CE1 3.54Å; R945-Y991 HydrophobicContact CB-CE2 3.99Å; R945-Y991 HydrophobicContact CB-CG 4.26Å
946	T	95.2	Very high	91.5	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-61.1	-20.5	-178.7	53.1	0	0	0	0	114.9	L904 H905 L908 Y991 V1027 E1030	L904-T946 HydrophobicContact CB-CG2 4.48Å; L904-T946 HydrophobicContact CD2-CG2 3.93Å; L904-T946 HydrophobicContact CG-CG2 4Å; L904-T946 PolarHBondContact N-O 2.93Å; H905-T946 WeakPolarHBondContact CB-O 3.33Å; H905-T946 PolarHBondContact N-O 3.06Å; L908-T946 HydrophobicContact CD1-CG2 4.19Å; T946-Y991 PolarHBondContact OG1-OH 3.14Å; T946-V1027 HydrophobicContact CG2-CB 4.47Å; T946-V1027 HydrophobicContact CG2-CG1 4.01Å; T946-V1027 HydrophobicContact CG2-CG2 4.28Å; T946-E1030 WeakPolarHBondContact CB-OE2 3.49Å; T946-E1030 HydrophobicContact CG2-CB 4.14Å; T946-E1030 HydrophobicContact CG2-CG 4.42Å; T946-E1030 WeakPolarHBondContact CG2-OE1 3.49Å; T946-E1030 WeakPolarHBondContact CG2-OE2 3.27Å; T946-E1030 PolarHBondContact OG1-OE1 2.97Å; T946-E1030 PolarHBondContact OG1-OE2 2.84Å
947	K	92.5	Very high	91.6	Very high	81 Å²	81	46.8 Å²	46.8	35%	0.352	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-73	-25.2	172.7	-71.6	179.8	178.5	177.2	0	113.4	T903 H905 R945	T903-K947 WeakPolarHBondContact CG2-O 3.25Å; H905-K947 HydrophobicContact CB-CB 4.32Å; H905-K947 HydrophobicContact CB-CG 3.61Å; H905-K947 WeakPolarHBondContact CE1-CE 3.39Å; H905-K947 VanDerWaalsContact CG-CG 3.44Å; H905-K947 VanDerWaalsContact NE2-CE 3.3Å; H905-K947 WeakPolarHBondContact NE2-CE 3.13Å; R945-K947 HydrophobicContact CG-CB 4.21Å; R945-K947 PolarHBondContact O-N 3.43Å
948	N	94.2	Very high	91.9	Very high	4 Å²	4	42 Å²	42	2%	0.021	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-106.1	19	-175.8	-54.9	0.6	0	0	0	111.7	D943 R945 T960	D943-N948 PolarHBondContact O-ND2 3.13Å; D943-N948 PolarHBondContact OD2-ND2 2.69Å; R945-N948 HydrophobicContact CG-CB 4.19Å; R945-N948 VanDerWaalsContact CZ-OD1 3.25Å; R945-N948 VanDerWaalsContact NE-CG 3.32Å; R945-N948 PolarHBondContact NE-ND2 3.5Å; R945-N948 PolarHBondContact NE-OD1 3.07Å; R945-N948 PolarHBondContact NH2-OD1 2.83Å; R945-N948 PolarHBondContact O-N 2.69Å; N948-T960 PolarHBondContact O-N 2.96Å; N948-T960 PolarHBondContact O-OG1 3.29Å
949	V	96.7	Very high	92.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	117.8	177.5	176.3	0	0	0	0	107.8	T903 L904 V927 L944 V957	T903-V949 CarbonylContact C-O 3.56Å; T903-V949 VanDerWaalsContact CA-O 3.29Å; T903-V949 WeakPolarHBondContact CA-O 3.24Å; L904-V949 HydrophobicContact CB-CB 4.3Å; L904-V949 HydrophobicContact CB-CG1 4.29Å; L904-V949 HydrophobicContact CD2-CG1 4.23Å; L904-V949 PolarHBondContact N-O 3.35Å; V927-V949 HydrophobicContact CG2-CG1 4.02Å; V927-V949 HydrophobicContact CG2-CG2 4.43Å; L944-V949 HydrophobicContact CD1-CG2 4.3Å; V949-V957 HydrophobicContact CG1-CG1 3.49Å; V949-V957 VanDerWaalsContact CG1-CG1 3.49Å
950	F	96.2	Very high	92.3	Very high	38 Å²	38	32.9 Å²	32.9	17%	0.167	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	147.6	178.6	-76.9	-103.8	0	0	0	111.7	C899 R902 T903 V957 V958 T960	C899-F950 HydrophobicContact CB-CB 4.33Å; C899-F950 HydrophobicContact CB-CD1 3.53Å; C899-F950 HydrophobicContact CB-CE1 3.87Å; C899-F950 HydrophobicContact CB-CG 3.91Å; R902-F950 CarbonylContact O-C 3.49Å; R902-F950 WeakPolarHBondContact O-CA 3.32Å; T903-F950 HydrophobicContact CG2-CD1 4.16Å; T903-F950 HydrophobicContact CG2-CD2 4.25Å; T903-F950 HydrophobicContact CG2-CE1 3.72Å; T903-F950 HydrophobicContact CG2-CE2 3.82Å; T903-F950 HydrophobicContact CG2-CG 4.41Å; T903-F950 HydrophobicContact CG2-CZ 3.54Å; F950-V957 CarbonylContact O-C 3.54Å; F950-V957 WeakPolarHBondContact O-CA 3.3Å; F950-V958 HydrophobicContact CB-CB 4.44Å; F950-V958 PolarHBondContact N-O 2.99Å; F950-V958 PolarHBondContact O-N 2.05Å; F950-T960 HydrophobicContact CD2-CG2 3.6Å; F950-T960 HydrophobicContact CE2-CG2 3.67Å
951	I	95.4	Very high	92	Very high	8 Å²	8	33 Å²	33	4%	0.041	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	106.4	177.5	-49.5	-65.2	0	0	0	108.2	G901 R902 L904 I907 W915 V923 K956 V957	G901-I951 WeakPolarHBondContact CA-O 3.34Å; R902-I951 PolarHBondContact N-O 2.9Å; R902-I951 VanDerWaalsContact N-O 3.12Å; R902-I951 PolarHBondContact O-N 3.27Å; L904-I951 HydrophobicContact CB-CG1 4.36Å; L904-I951 HydrophobicContact CD1-CD1 4.5Å; L904-I951 HydrophobicContact CD1-CG1 4.38Å; I907-I951 HydrophobicContact CD1-CB 3.73Å; I907-I951 HydrophobicContact CD1-CG1 3.67Å; I907-I951 HydrophobicContact CD1-CG2 4.34Å; W915-I951 HydrophobicContact CH2-CG1 4.14Å; W915-I951 HydrophobicContact CH2-CG2 4.11Å; V923-I951 HydrophobicContact CG1-CD1 3.96Å; V923-I951 HydrophobicContact CG2-CD1 4.05Å; I951-K956 CarbonylContact C-O 3.59Å; I951-K956 WeakPolarHBondContact CA-O 3.38Å; I951-V957 HydrophobicContact CD1-CB 4.46Å; I951-V957 HydrophobicContact CD1-CG1 4.26Å; I951-V957 HydrophobicContact CD1-CG2 3.86Å
952	E	90	Very high	91.6	Very high	21 Å²	21	33 Å²	33	10%	0.098	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	149	176.9	-53.1	-162.5	108.5	0	0	111.2	C899 K900 N954 S955 K956 V958	C899-E952 WeakPolarHBondContact CA-OE1 3.21Å; K900-E952 PolarHBondContact N-OE1 3.25Å; E952-N954 PolarHBondContact O-N 3.31Å; E952-S955 PolarHBondContact O-N 3.22Å; E952-K956 HydrophobicContact CB-CB 4.33Å; E952-K956 PolarHBondContact N-O 3.11Å; E952-K956 PolarHBondContact O-N 3.25Å; E952-K956 IonicContact OE2-NZ 2.73Å; E952-K956 PolarHBondContact OE2-NZ 3.45Å; E952-V958 HydrophobicContact CG-CG2 4.39Å
953	N	83.6	Confident	90.9	Very high	136 Å²	136	32.1 Å²	32.1	73%	0.727	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.9	31.1	173.3	-58.2	-9.7	0	0	0	114.4	S955	N953-S955 PolarHBondContact O-N 3.13Å; N953-S955 PolarHBondContact O-OG 2.88Å
954	N	77.8	Confident	90.1	Very high	117 Å²	117	32 Å²	32	63%	0.626	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.6	-11.7	-171.1	-73.5	-41.5	0	0	0	117.5	R919 E952	R919-N954 PolarHBondContact NE-O 2.97Å; R919-N954 PolarHBondContact NH2-O 3.17Å; R919-N954 PolarHBondContact NH2-OD1 2.84Å; E952-N954 PolarHBondContact O-N 3.31Å
955	S	85.5	Confident	88.9	Confident	69 Å²	69	32.3 Å²	32.3	48%	0.483	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128.2	-30.5	-167.9	57.5	0	0	0	0	115.7	Q926 E952 N953	Q926-S955 PolarHBondContact NE2-O 3.38Å; E952-S955 PolarHBondContact O-N 3.22Å; N953-S955 PolarHBondContact O-N 3.13Å; N953-S955 PolarHBondContact O-OG 2.88Å
956	K	93.7	Very high	87.6	Confident	80 Å²	80	31.5 Å²	31.5	35%	0.348	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	129.5	-175.2	178.1	-169.3	169.6	-147.5	0	110.4	I951 E952 V958	I951-K956 CarbonylContact C-O 3.59Å; I951-K956 WeakPolarHBondContact CA-O 3.38Å; E952-K956 HydrophobicContact CB-CB 4.33Å; E952-K956 PolarHBondContact N-O 3.11Å; E952-K956 PolarHBondContact O-N 3.25Å; E952-K956 IonicContact OE2-NZ 2.73Å; E952-K956 PolarHBondContact OE2-NZ 3.45Å; K956-V958 HydrophobicContact CD-CG2 4.3Å; K956-V958 HydrophobicContact CG-CG2 4.33Å
957	V	96.8	Very high	86.1	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	139.7	174.5	-172.1	0	0	0	0	110.6	N878 V923 Q926 V927 V949 F950 I951	N878-V957 VanDerWaalsContact CA-O 3.32Å; N878-V957 WeakPolarHBondContact CA-O 3.49Å; N878-V957 PolarHBondContact ND2-O 3.44Å; V923-V957 HydrophobicContact CB-CG2 4.11Å; V923-V957 HydrophobicContact CG1-CG2 3.95Å; V923-V957 HydrophobicContact CG2-CG2 3.92Å; Q926-V957 HydrophobicContact CB-CB 3.76Å; Q926-V957 HydrophobicContact CB-CG2 3.73Å; Q926-V957 HydrophobicContact CG-CG2 4.36Å; V927-V957 HydrophobicContact CG2-CG1 3.82Å; V949-V957 HydrophobicContact CG1-CG1 3.49Å; V949-V957 VanDerWaalsContact CG1-CG1 3.49Å; F950-V957 CarbonylContact O-C 3.54Å; F950-V957 WeakPolarHBondContact O-CA 3.3Å; I951-V957 HydrophobicContact CD1-CB 4.46Å; I951-V957 HydrophobicContact CD1-CG1 4.26Å; I951-V957 HydrophobicContact CD1-CG2 3.86Å
958	V	96.1	Very high	84.6	Confident	3 Å²	3	32.2 Å²	32.2	2%	0.018	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	124.8	175.6	-175.5	0	0	0	0	110.1	I880 F950 E952 K956	I880-V958 HydrophobicContact CB-CG1 4.06Å; I880-V958 HydrophobicContact CD1-CG1 3.93Å; F950-V958 HydrophobicContact CB-CB 4.44Å; F950-V958 PolarHBondContact N-O 2.99Å; F950-V958 PolarHBondContact O-N 2.05Å; E952-V958 HydrophobicContact CG-CG2 4.39Å; K956-V958 HydrophobicContact CD-CG2 4.3Å; K956-V958 HydrophobicContact CG-CG2 4.33Å
959	I	96.2	Very high	83	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	135.6	177.2	-54.6	172.8	0	0	0	109.9	N878 L879 I880 V927 M931 H941 L944	N878-I959 WeakPolarHBondContact O-CG1 3.28Å; N878-I959 PolarHBondContact O-N 2.98Å; L879-I959 HydrophobicContact CD2-CB 4.02Å; L879-I959 HydrophobicContact CD2-CD1 4.19Å; I880-I959 WeakPolarHBondContact CB-O 3.36Å; I880-I959 PolarHBondContact N-O 3.12Å; V927-I959 HydrophobicContact CG1-CD1 4.18Å; M931-I959 HydrophobicContact CG-CD1 3.97Å; M931-I959 HydrophobicContact SD-CD1 4.14Å; H941-I959 WeakPolarHBondContact NE2-CG2 3.34Å; L944-I959 HydrophobicContact CD1-CG2 4.43Å
960	T	92.5	Very high	81.4	Confident	7 Å²	7	33.2 Å²	33.2	4%	0.043	18%	0.178	C	C	.	.			trans	-117.1	168.4	177.5	67	0	0	0	0	112	I880 H941 N948 F950 F962	I880-T960 HydrophobicContact CB-CG2 4.07Å; I880-T960 HydrophobicContact CG1-CG2 4.3Å; I880-T960 HydrophobicContact CG2-CG2 4.35Å; H941-T960 PolarHBondContact CE1-O 3.38Å; H941-T960 VanDerWaalsContact CE1-O 3.23Å; H941-T960 PolarHBondContact NE2-O 3.41Å; N948-T960 PolarHBondContact O-N 2.96Å; N948-T960 PolarHBondContact O-OG1 3.29Å; F950-T960 HydrophobicContact CD2-CG2 3.6Å; F950-T960 HydrophobicContact CE2-CG2 3.67Å; T960-F962 VanDerWaalsContact C-N 3.25Å; T960-F962 PolarHBondContact O-N 3.21Å; T960-F962 VanDerWaalsContact O-N 3.11Å
961	D	85.4	Confident	79.8	Confident	40 Å²	40	33.3 Å²	33.3	21%	0.214	18%	0.18	C	C	.	.			trans	60.7	21.5	168.1	-56.3	-70.7	0	0	0	116.7	K848	K848-D961 IonicContact NZ-OD1 2.62Å; K848-D961 PolarHBondContact NZ-OD1 2.92Å
962	F	85.3	Confident	77.8	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.203	C	C	.	.			trans	-63.7	141.4	171.9	55.3	-99.9	0	0	0	112	F871 T874 L879 I880 L934 I939 H941 T960 L964	F871-F962 AromaticContact CD1-CE2 3.62Å; F871-F962 HydrophobicContact CD1-CE2 3.62Å; F871-F962 AromaticContact CD1-CZ 3.7Å; F871-F962 HydrophobicContact CD1-CZ 3.7Å; F871-F962 AromaticContact CE1-CD2 4Å; F871-F962 HydrophobicContact CE1-CD2 4Å; F871-F962 HydrophobicContact CE1-CE1 4.12Å; F871-F962 AromaticContact CE1-CE2 3.45Å; F871-F962 HydrophobicContact CE1-CE2 3.45Å; F871-F962 VanDerWaalsContact CE1-CE2 3.45Å; F871-F962 AromaticContact CE1-CZ 3.53Å; F871-F962 HydrophobicContact CE1-CZ 3.53Å; F871-F962 HydrophobicContact CE2-CE2 4.44Å; F871-F962 HydrophobicContact CG-CE2 4.22Å; F871-F962 HydrophobicContact CZ-CD2 4Å; F871-F962 AromaticContact CZ-CE2 3.89Å; F871-F962 HydrophobicContact CZ-CE2 3.89Å; F871-F962 HydrophobicContact CZ-CZ 4.35Å; F871-F962 WeakPolarHBondContact CZ-O 3.14Å; T874-F962 HydrophobicContact CG2-CE2 4.08Å; T874-F962 HydrophobicContact CG2-CZ 4.47Å; L879-F962 HydrophobicContact CB-CE1 4.08Å; L879-F962 HydrophobicContact CD1-CE1 4.46Å; L879-F962 HydrophobicContact CD2-CD1 4.24Å; L879-F962 HydrophobicContact CD2-CE1 4.17Å; L879-F962 HydrophobicContact CG-CE1 4.47Å; I880-F962 HydrophobicContact CG2-CE1 4.01Å; L934-F962 HydrophobicContact CD1-CB 3.74Å; L934-F962 HydrophobicContact CD1-CD1 4.21Å; L934-F962 HydrophobicContact CD1-CD2 4.5Å; L934-F962 HydrophobicContact CD1-CG 3.92Å; L934-F962 HydrophobicContact CD2-CD2 3.89Å; L934-F962 HydrophobicContact CD2-CE2 4.12Å; L934-F962 HydrophobicContact CD2-CG 4.1Å; I939-F962 HydrophobicContact CG2-CD2 4.46Å; H941-F962 HydrophobicContact CB-CB 4.3Å; H941-F962 WeakPolarHBondContact ND1-CA 3.18Å; T960-F962 VanDerWaalsContact C-N 3.25Å; T960-F962 PolarHBondContact O-N 3.21Å; T960-F962 VanDerWaalsContact O-N 3.11Å; F962-L964 PolarHBondContact O-N 3.46Å
963	G	74.8	Confident	75.6	Confident	16 Å²	16	42.8 Å²	42.8	17%	0.165	23%	0.228	C	C	.	.	S	Bend	trans	74.5	-25.5	178.5	0	0	0	0	0	116.2	H941 F965	H941-G963 PolarHBondContact O-N 3Å; G963-F965 PolarHBondContact O-N 3.44Å; G963-F965 VanDerWaalsContact O-N 3.15Å
964	L	73	Confident	73.5	Confident	3 Å²	3	42.1 Å²	42.1	2%	0.016	22%	0.22	C	C	.	.			trans	-75.4	3	-173	-63.1	179.6	0	0	0	115.8	F833 K848 E867 F871 I894 F962	F833-L964 WeakPolarHBondContact CE1-O 3.5Å; K848-L964 HydrophobicContact CD-CD1 4.16Å; E867-L964 HydrophobicContact CB-CD2 4.08Å; F871-L964 HydrophobicContact CE2-CD1 4.15Å; F871-L964 HydrophobicContact CE2-CD2 3.6Å; F871-L964 HydrophobicContact CE2-CG 3.7Å; F871-L964 HydrophobicContact CZ-CD1 3.87Å; F871-L964 HydrophobicContact CZ-CD2 4.18Å; F871-L964 HydrophobicContact CZ-CG 3.78Å; I894-L964 HydrophobicContact CD1-CD1 3.93Å; I894-L964 HydrophobicContact CD1-CD2 3.76Å; F962-L964 PolarHBondContact O-N 3.46Å
965	F	72.2	Confident	71.3	Confident	9 Å²	9	43.5 Å²	43.5	4%	0.039	23%	0.228	C	C	.	.			trans	-81	124.7	179.7	-176.4	-86.3	0	0	0	111.6	F833 K942 D943 G963 I967 L970 W988 F1015	F833-F965 HydrophobicContact CZ-CD2 4.05Å; K942-F965 HydrophobicContact CB-CB 3.76Å; K942-F965 HydrophobicContact CB-CD1 4.31Å; K942-F965 HydrophobicContact CB-CG 4.26Å; K942-F965 HydrophobicContact CD-CB 4.35Å; D943-F965 HydrophobicContact CB-CB 4.3Å; D943-F965 HydrophobicContact CB-CD2 4.07Å; D943-F965 HydrophobicContact CB-CG 4.48Å; G963-F965 PolarHBondContact O-N 3.44Å; G963-F965 VanDerWaalsContact O-N 3.15Å; F965-I967 HydrophobicContact CE1-CB 4.13Å; F965-I967 HydrophobicContact CZ-CB 4.47Å; F965-L970 HydrophobicContact CE2-CD1 4.19Å; F965-L970 HydrophobicContact CE2-CG 4.42Å; F965-L970 HydrophobicContact CZ-CD1 3.76Å; F965-L970 HydrophobicContact CZ-CG 4.19Å; F965-W988 HydrophobicContact CD2-CZ2 4.48Å; F965-W988 HydrophobicContact CE1-CZ2 4.34Å; F965-W988 HydrophobicContact CE2-CH2 4.23Å; F965-W988 AromaticContact CE2-CZ2 3.48Å; F965-W988 HydrophobicContact CE2-CZ2 3.48Å; F965-W988 VanDerWaalsContact CE2-CZ2 3.48Å; F965-W988 AromaticContact CZ-CH2 3.75Å; F965-W988 HydrophobicContact CZ-CH2 3.75Å; F965-W988 AromaticContact CZ-CZ2 3.4Å; F965-W988 HydrophobicContact CZ-CZ2 3.4Å; F965-W988 VanDerWaalsContact CZ-CZ2 3.4Å; F965-F1015 AromaticContact CD1-CE2 3.75Å; F965-F1015 HydrophobicContact CD1-CE2 3.75Å; F965-F1015 AromaticContact CD1-CZ 3.97Å; F965-F1015 HydrophobicContact CD1-CZ 3.97Å; F965-F1015 AromaticContact CE1-CE2 3.66Å; F965-F1015 HydrophobicContact CE1-CE2 3.66Å; F965-F1015 AromaticContact CE1-CZ 3.78Å; F965-F1015 HydrophobicContact CE1-CZ 3.78Å; F965-F1015 HydrophobicContact CZ-CZ 4.47Å
966	S	66.8	Low	69.2	Low	30 Å²	30	48.1 Å²	48.1	21%	0.21	24%	0.242	C	C	.	.			trans	-132.7	130.4	168.4	172.6	0	0	0	0	109.9	H968 R969	S966-H968 VanDerWaalsContact C-N 3.26Å; S966-H968 PolarHBondContact O-N 3.14Å; S966-H968 PolarHBondContact OG-CD2 3.36Å; S966-R969 WeakPolarHBondContact O-CB 3.47Å; S966-R969 PolarHBondContact O-N 3.36Å
967	I	63.2	Low	66.3	Low	6 Å²	6	46.8 Å²	46.8	3%	0.031	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-70.2	-19.2	-177.9	177.8	153.5	0	0	0	113.2	F965 R969 L970 L971 L982 L1000 F1003 V1010 L1013	F965-I967 HydrophobicContact CE1-CB 4.13Å; F965-I967 HydrophobicContact CZ-CB 4.47Å; I967-R969 PolarHBondContact O-N 2.88Å; I967-L970 HydrophobicContact CG1-CB 4.4Å; I967-L970 WeakPolarHBondContact O-CB 3.11Å; I967-L970 PolarHBondContact O-N 3.09Å; I967-L971 PolarHBondContact O-N 2.92Å; I967-L982 HydrophobicContact CD1-CD1 4.11Å; I967-L982 HydrophobicContact CG1-CD1 4.27Å; I967-L1000 HydrophobicContact CD1-CD2 4.39Å; I967-F1003 HydrophobicContact CB-CZ 4.27Å; I967-F1003 HydrophobicContact CD1-CD2 4.22Å; I967-F1003 HydrophobicContact CD1-CE1 4.48Å; I967-F1003 HydrophobicContact CD1-CE2 3.46Å; I967-F1003 VanDerWaalsContact CD1-CE2 3.46Å; I967-F1003 HydrophobicContact CD1-CZ 3.61Å; I967-F1003 HydrophobicContact CG1-CE1 4.4Å; I967-F1003 HydrophobicContact CG1-CE2 4.04Å; I967-F1003 HydrophobicContact CG1-CZ 3.64Å; I967-F1003 HydrophobicContact CG2-CE2 4.11Å; I967-F1003 HydrophobicContact CG2-CZ 3.64Å; I967-V1010 HydrophobicContact CG2-CG1 4.48Å; I967-L1013 HydrophobicContact CB-CD1 4.39Å; I967-L1013 HydrophobicContact CD1-CD1 3.47Å; I967-L1013 VanDerWaalsContact CD1-CD1 3.47Å; I967-L1013 HydrophobicContact CD1-CD2 4.34Å; I967-L1013 HydrophobicContact CD1-CG 3.85Å; I967-L1013 HydrophobicContact CG1-CD1 4.5Å; I967-L1013 HydrophobicContact CG2-CG 4.48Å
968	H	61.4	Low	64	Low	90 Å²	90	51.8 Å²	51.8	42%	0.417	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-51.8	-32.4	169.8	-69.6	-100	0	0	0	112	S966 L970	S966-H968 VanDerWaalsContact C-N 3.26Å; S966-H968 PolarHBondContact O-N 3.14Å; S966-H968 PolarHBondContact OG-CD2 3.36Å; H968-L970 VanDerWaalsContact C-N 3.3Å; H968-L970 PolarHBondContact O-N 2.7Å
969	R	61.5	Low	61.2	Low	19 Å²	19	53.1 Å²	53.1	7%	0.072	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-79.2	-6.2	179.9	-50.6	173.8	-172.5	-97.7	13.4	113.7	R832 N851 M852 E867 S966 I967	R832-R969 PolarHBondContact NE-O 3.04Å; R832-R969 PolarHBondContact NH2-O 2.74Å; N851-R969 PolarHBondContact O-NH1 3.36Å; M852-R969 VanDerWaalsContact CE-NH2 3.3Å; E867-R969 VanDerWaalsContact CD-NH2 3.27Å; E867-R969 IonicContact OE1-CZ 3.5Å; E867-R969 IonicContact OE1-NE 2.65Å; E867-R969 IonicContact OE1-NH2 3.77Å; E867-R969 PolarHBondContact OE1-NH2 2.99Å; E867-R969 IonicContact OE2-NH2 2.61Å; E867-R969 PolarHBondContact OE2-NH2 3.11Å; S966-R969 WeakPolarHBondContact O-CB 3.47Å; S966-R969 PolarHBondContact O-N 3.36Å; I967-R969 PolarHBondContact O-N 2.88Å
970	L	63.2	Low	59.2	Low	6 Å²	6	56.7 Å²	56.7	3%	0.031	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-29.8	172.5	-65.3	-169.5	0	0	0	113.3	R832 F965 I967 H968 L982 S983 P985 W988	R832-L970 VanDerWaalsContact NH2-CA 3.32Å; R832-L970 PolarHBondContact NH2-O 2.9Å; F965-L970 HydrophobicContact CE2-CD1 4.19Å; F965-L970 HydrophobicContact CE2-CG 4.42Å; F965-L970 HydrophobicContact CZ-CD1 3.76Å; F965-L970 HydrophobicContact CZ-CG 4.19Å; I967-L970 HydrophobicContact CG1-CB 4.4Å; I967-L970 WeakPolarHBondContact O-CB 3.11Å; I967-L970 PolarHBondContact O-N 3.09Å; H968-L970 VanDerWaalsContact C-N 3.3Å; H968-L970 PolarHBondContact O-N 2.7Å; L970-L982 HydrophobicContact CB-CD1 3.68Å; L970-L982 HydrophobicContact CD1-CD1 4.48Å; L970-S983 PolarHBondContact O-N 2.92Å; L970-S983 VanDerWaalsContact O-N 3.08Å; L970-P985 HydrophobicContact CD2-CG 4.33Å; L970-W988 HydrophobicContact CD1-CE3 4.42Å; L970-W988 HydrophobicContact CD1-CH2 3.48Å; L970-W988 VanDerWaalsContact CD1-CH2 3.48Å; L970-W988 HydrophobicContact CD1-CZ2 4.06Å; L970-W988 HydrophobicContact CD1-CZ3 3.68Å
971	L	60.6	Low	57.6	Low	39 Å²	39	58.6 Å²	58.6	20%	0.204	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	143.5	173.9	-60.1	175.3	0	0	0	110.6	I967 L982 F1003	I967-L971 PolarHBondContact O-N 2.92Å; L971-L982 HydrophobicContact CD2-CD1 4.16Å; L971-F1003 HydrophobicContact CD1-CE1 4.24Å; L971-F1003 HydrophobicContact CD2-CD1 4.29Å; L971-F1003 HydrophobicContact CD2-CE1 4.11Å
972	R	53.4	Low	56.7	Low	141 Å²	141	57.3 Å²	57.3	53%	0.532	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	137.6	163.1	-81.5	-173.8	165.5	-174.7	-6.8	109.9	F981	R972-F981 PolarHBondContact N-O 3.44Å; R972-F981 PolarHBondContact O-N 3.27Å
973	S	45.6	Very low	55.9	Low	88 Å²	88	57.5 Å²	57.5	62%	0.615	30%	0.299	S	S	*	.			trans	-96.2	141.6	156.8	-174.1	0	0	0	0	108.1
974	Q	37.7	Very low	55.9	Low	121 Å²	121	57 Å²	57	57%	0.565	29%	0.293	S	S	*	.			trans	-126.5	128.2	165.8	-85.3	-174.3	-50.9	0	0	108.9
975	N	33.6	Very low	56.1	Low	146 Å²	146	58.4 Å²	58.4	78%	0.781	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	39.9	80.3	159.3	-58	4.6	0	0	0	116.7	A977	N975-A977 PolarHBondContact O-N 3.46Å
976	H	40.3	Very low	56.4	Low	167 Å²	167	62.7 Å²	62.7	77%	0.773	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	12	158.6	-68.4	-82.3	0	0	0	118.9	F8	F8-H976 AromaticContact CE1-CE1 3.64Å; F8-H976 AromaticContact CZ-CE1 3.48Å; F8-H976 VanDerWaalsContact CZ-CE1 3.48Å; F8-H976 WeakPolarHBondContact CZ-CE1 3.33Å; F8-H976 AromaticContact CZ-NE2 3.56Å
977	A	32.7	Very low	57.3	Low	52 Å²	52	63.1 Å²	63.1	43%	0.43	32%	0.321	S	S	.	.	S	Bend	trans	-116.2	147.5	172.9	0	0	0	0	0	111.3	N975 C979	N975-A977 PolarHBondContact O-N 3.46Å; A977-C979 PolarHBondContact O-N 3.22Å
978	D	48.5	Very low	58.6	Low	105 Å²	105	63.1 Å²	63.1	56%	0.561	32%	0.321	S	S	*	.	S	Bend	trans	-66.1	7.5	-171.9	-53.3	-73.8	0	0	0	116	R105 K980	R105-D978 IonicContact CZ-OD1 3.51Å; R105-D978 IonicContact CZ-OD2 2.67Å; R105-D978 IonicContact NH1-OD1 3.51Å; R105-D978 PolarHBondContact NH1-OD1 3.48Å; R105-D978 IonicContact NH1-OD2 2.7Å; R105-D978 PolarHBondContact NH1-OD2 3.16Å; D978-K980 PolarHBondContact O-N 2.76Å
979	C	38.2	Very low	60	Low	31 Å²	31	59.2 Å²	59.2	21%	0.209	30%	0.303	C	S	.	.			trans	-90.4	98.3	-175.8	-60.7	0	0	0	0	111.4	K109 A977 F981	K109-C979 PolarHBondContact NZ-SG 3.39Å; A977-C979 PolarHBondContact O-N 3.22Å; C979-F981 HydrophobicContact CB-CE1 4.26Å; C979-F981 HydrophobicContact CB-CE2 3.68Å; C979-F981 HydrophobicContact CB-CZ 3.53Å; C979-F981 WeakPolarHBondContact O-CD2 3.48Å; C979-F981 WeakPolarHBondContact O-CE2 3.31Å
980	K	53.4	Low	61.5	Low	74 Å²	74	58.4 Å²	58.4	32%	0.322	30%	0.3	S	S	.	.			trans	-83.9	131.2	167.7	-66.1	168.9	-179.6	173	0	109.6	L734 D978 E1005	L734-K980 HydrophobicContact CD1-CB 3.76Å; D978-K980 PolarHBondContact O-N 2.76Å; K980-E1005 IonicContact NZ-OE1 2.72Å; K980-E1005 PolarHBondContact NZ-OE1 3.31Å; K980-E1005 IonicContact NZ-OE2 2.69Å; K980-E1005 PolarHBondContact NZ-OE2 3.23Å
981	F	58.6	Low	63.1	Low	47 Å²	47	58.7 Å²	58.7	21%	0.206	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	142.5	-178.1	-60.8	-73	0	0	0	111.7	V729 N731 R972 C979 S983	V729-F981 HydrophobicContact CG1-CB 4.03Å; V729-F981 HydrophobicContact CG1-CD1 4.42Å; V729-F981 HydrophobicContact CG1-CG 4.14Å; N731-F981 HydrophobicContact CB-CE1 4.35Å; N731-F981 WeakPolarHBondContact OD1-CD1 3.47Å; N731-F981 VanDerWaalsContact OD1-CE1 3.27Å; N731-F981 WeakPolarHBondContact OD1-CE1 3.31Å; R972-F981 PolarHBondContact N-O 3.44Å; R972-F981 PolarHBondContact O-N 3.27Å; C979-F981 HydrophobicContact CB-CE1 4.26Å; C979-F981 HydrophobicContact CB-CE2 3.68Å; C979-F981 HydrophobicContact CB-CZ 3.53Å; C979-F981 WeakPolarHBondContact O-CD2 3.48Å; C979-F981 WeakPolarHBondContact O-CE2 3.31Å; F981-S983 PolarHBondContact O-N 3.35Å
982	L	67	Low	64.6	Low	13 Å²	13	57.1 Å²	57.1	7%	0.068	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	96.9	175.1	-169.2	72.7	0	0	0	109.8	I732 I967 L970 L971 V984 L1000	I732-L982 HydrophobicContact CD1-CB 4.41Å; I732-L982 HydrophobicContact CD1-CD2 4.04Å; I967-L982 HydrophobicContact CD1-CD1 4.11Å; I967-L982 HydrophobicContact CG1-CD1 4.27Å; L970-L982 HydrophobicContact CB-CD1 3.68Å; L970-L982 HydrophobicContact CD1-CD1 4.48Å; L971-L982 HydrophobicContact CD2-CD1 4.16Å; L982-V984 HydrophobicContact CD2-CG2 3.72Å; L982-V984 HydrophobicContact CG-CG2 3.76Å; L982-V984 PolarHBondContact O-N 3.24Å; L982-L1000 HydrophobicContact CD2-CD2 4.19Å
983	S	68.1	Low	66.6	Low	4 Å²	4	50.4 Å²	50.4	3%	0.028	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	99	177.4	174.2	0	0	0	0	109.7	R832 L970 F981	R832-S983 PolarHBondContact NH1-O 2.73Å; R832-S983 PolarHBondContact NH1-OG 2.83Å; L970-S983 PolarHBondContact O-N 2.92Å; L970-S983 VanDerWaalsContact O-N 3.08Å; F981-S983 PolarHBondContact O-N 3.35Å
984	V	74.4	Confident	68.9	Low	6 Å²	6	46.4 Å²	46.4	4%	0.036	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-94.6	129.4	-174.1	174.4	0	0	0	0	111.6	V727 I730 L982 W988 L989	V727-V984 WeakPolarHBondContact CG1-O 3.4Å; I730-V984 HydrophobicContact CD1-CB 3.81Å; I730-V984 HydrophobicContact CD1-CG1 4.49Å; I730-V984 HydrophobicContact CD1-CG2 3.78Å; L982-V984 HydrophobicContact CD2-CG2 3.72Å; L982-V984 HydrophobicContact CG-CG2 3.76Å; L982-V984 PolarHBondContact O-N 3.24Å; V984-W988 HydrophobicContact CG1-CB 4.16Å; V984-W988 HydrophobicContact CG1-CD2 4.39Å; V984-W988 HydrophobicContact CG1-CE3 3.57Å; V984-W988 HydrophobicContact CG1-CZ3 4.32Å; V984-L989 HydrophobicContact CG1-CD2 3.97Å; V984-L989 HydrophobicContact CG1-CG 3.87Å
985	P	77	Confident	71.5	Confident	33 Å²	33	41.7 Å²	41.7	21%	0.214	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-61.4	144.2	177.3	-20.8	32.1	0	0	0	113.1	L970 H987 W988	L970-P985 HydrophobicContact CD2-CG 4.33Å; P985-H987 PolarHBondContact O-N 2.89Å; P985-W988 HydrophobicContact CB-CB 4.15Å; P985-W988 HydrophobicContact CG-CB 4.48Å; P985-W988 WeakPolarHBondContact O-CB 3.43Å; P985-W988 PolarHBondContact O-N 2.85Å
986	E	79	Confident	74.2	Confident	99 Å²	99	34.8 Å²	34.8	46%	0.463	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	135.6	177.8	-162.2	-147.2	-158.7	0	0	111.6	W988	E986-W988 PolarHBondContact O-N 2.65Å; E986-W988 VanDerWaalsContact O-N 3.11Å
987	H	86.6	Confident	76.6	Confident	38 Å²	38	26.9 Å²	26.9	18%	0.176	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	-5.9	-174.7	-55.1	95.3	0	0	0	117	P985 L989 A990 F1036	P985-H987 PolarHBondContact O-N 2.89Å; H987-L989 PolarHBondContact O-N 3.44Å; H987-A990 PolarHBondContact O-N 3.24Å; H987-F1036 HydrophobicContact CB-CD1 3.76Å; H987-F1036 HydrophobicContact CB-CD2 4.33Å; H987-F1036 HydrophobicContact CB-CE1 3.84Å; H987-F1036 HydrophobicContact CB-CE2 4.39Å; H987-F1036 HydrophobicContact CB-CG 4.01Å; H987-F1036 HydrophobicContact CB-CZ 4.15Å; H987-F1036 VanDerWaalsContact CD2-CB 3.43Å; H987-F1036 WeakPolarHBondContact CD2-CB 3.5Å; H987-F1036 AromaticContact CD2-CD2 3.35Å; H987-F1036 WeakPolarHBondContact CD2-CD2 3.45Å; H987-F1036 AromaticContact CD2-CG 3.32Å; H987-F1036 WeakPolarHBondContact CD2-CG 3.31Å; H987-F1036 AromaticContact CE1-CD2 3.78Å; H987-F1036 AromaticContact CE1-CE2 3.95Å; H987-F1036 AromaticContact CG-CD1 3.96Å; H987-F1036 AromaticContact CG-CD2 3.63Å; H987-F1036 AromaticContact CG-CE2 3.84Å; H987-F1036 AromaticContact CG-CG 3.67Å; H987-F1036 AromaticContact ND1-CD2 3.87Å; H987-F1036 AromaticContact ND1-CE2 3.78Å; H987-F1036 AromaticContact NE2-CD2 3.45Å; H987-F1036 WeakPolarHBondContact NE2-CD2 3.39Å; H987-F1036 AromaticContact NE2-CG 3.9Å
988	W	89.9	Confident	79.1	Confident	7 Å²	7	28.7 Å²	28.7	3%	0.027	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-61.8	-37.3	-174.7	-175.4	73	0	0	0	114.3	D943 F965 L970 V984 P985 E986 A990 Y991 L992	D943-W988 PolarHBondContact OD1-NE1 3.21Å; F965-W988 HydrophobicContact CD2-CZ2 4.48Å; F965-W988 HydrophobicContact CE1-CZ2 4.34Å; F965-W988 HydrophobicContact CE2-CH2 4.23Å; F965-W988 AromaticContact CE2-CZ2 3.48Å; F965-W988 HydrophobicContact CE2-CZ2 3.48Å; F965-W988 VanDerWaalsContact CE2-CZ2 3.48Å; F965-W988 AromaticContact CZ-CH2 3.75Å; F965-W988 HydrophobicContact CZ-CH2 3.75Å; F965-W988 AromaticContact CZ-CZ2 3.4Å; F965-W988 HydrophobicContact CZ-CZ2 3.4Å; F965-W988 VanDerWaalsContact CZ-CZ2 3.4Å; L970-W988 HydrophobicContact CD1-CE3 4.42Å; L970-W988 HydrophobicContact CD1-CH2 3.48Å; L970-W988 VanDerWaalsContact CD1-CH2 3.48Å; L970-W988 HydrophobicContact CD1-CZ2 4.06Å; L970-W988 HydrophobicContact CD1-CZ3 3.68Å; V984-W988 HydrophobicContact CG1-CB 4.16Å; V984-W988 HydrophobicContact CG1-CD2 4.39Å; V984-W988 HydrophobicContact CG1-CE3 3.57Å; V984-W988 HydrophobicContact CG1-CZ3 4.32Å; P985-W988 HydrophobicContact CB-CB 4.15Å; P985-W988 HydrophobicContact CG-CB 4.48Å; P985-W988 WeakPolarHBondContact O-CB 3.43Å; P985-W988 PolarHBondContact O-N 2.85Å; E986-W988 PolarHBondContact O-N 2.65Å; E986-W988 VanDerWaalsContact O-N 3.11Å; W988-A990 PolarHBondContact O-N 3.44Å; W988-A990 VanDerWaalsContact O-N 3.08Å; W988-Y991 WeakPolarHBondContact O-CD2 3.35Å; W988-Y991 PolarHBondContact O-N 3.01Å; W988-L992 HydrophobicContact CE3-CD1 4Å; W988-L992 HydrophobicContact CE3-CD2 4.45Å; W988-L992 HydrophobicContact CE3-CG 4.28Å; W988-L992 HydrophobicContact CH2-CD1 4.02Å; W988-L992 HydrophobicContact CH2-CD2 3.83Å; W988-L992 HydrophobicContact CH2-CG 4.37Å; W988-L992 HydrophobicContact CZ2-CD2 3.81Å; W988-L992 HydrophobicContact CZ3-CD1 3.62Å; W988-L992 HydrophobicContact CZ3-CD2 4.17Å; W988-L992 HydrophobicContact CZ3-CG 4.21Å
989	L	91.6	Very high	80.8	Confident	8 Å²	8	25 Å²	25	4%	0.042	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-54.8	-29.8	178.6	-66.6	174.6	0	0	0	113.3	I730 V984 H987 Y991 L992 M997 L1000 P1043 I1046 I1047	I730-L989 HydrophobicContact CD1-CD1 4.08Å; V984-L989 HydrophobicContact CG1-CD2 3.97Å; V984-L989 HydrophobicContact CG1-CG 3.87Å; H987-L989 PolarHBondContact O-N 3.44Å; L989-Y991 PolarHBondContact O-N 3.46Å; L989-L992 HydrophobicContact CD2-CD1 4.11Å; L989-L992 PolarHBondContact O-N 2.86Å; L989-M997 HydrophobicContact CB-CE 4Å; L989-M997 HydrophobicContact CD2-CE 4.18Å; L989-M997 HydrophobicContact CD2-SD 4.05Å; L989-M997 WeakPolarHBondContact O-CE 3.29Å; L989-L1000 HydrophobicContact CD2-CD1 3.96Å; L989-P1043 HydrophobicContact CD1-CB 3.7Å; L989-I1046 HydrophobicContact CB-CB 4.44Å; L989-I1046 HydrophobicContact CB-CG2 3.8Å; L989-I1046 HydrophobicContact CD1-CB 4.38Å; L989-I1047 HydrophobicContact CD1-CD1 4.27Å; L989-I1047 HydrophobicContact CD1-CG1 4.04Å; L989-I1047 HydrophobicContact CD2-CG1 4.11Å
990	A	92.9	Very high	82.6	Confident	2 Å²	2	23.7 Å²	23.7	2%	0.017	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-72	-12.4	-178.8	0	0	0	0	0	113.8	H987 W988 T1026 P1037 F1038	H987-A990 PolarHBondContact O-N 3.24Å; W988-A990 PolarHBondContact O-N 3.44Å; W988-A990 VanDerWaalsContact O-N 3.08Å; A990-T1026 WeakPolarHBondContact O-CG2 3.41Å; A990-T1026 PolarHBondContact O-OG1 3.06Å; A990-P1037 HydrophobicContact CB-CG 4.13Å; A990-F1038 HydrophobicContact CB-CD2 4.36Å
991	Y	95.1	Very high	82.7	Confident	12 Å²	12	25.4 Å²	25.4	5%	0.047	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-91.5	-15.4	172.1	-59.6	-88.1	0	0	0	113	R945 T946 W988 L989 Y1022 S1023 T1026 V1027 E1030	R945-Y991 HydrophobicContact CB-CD1 3.88Å; R945-Y991 HydrophobicContact CB-CD2 4.32Å; R945-Y991 HydrophobicContact CB-CE1 3.54Å; R945-Y991 HydrophobicContact CB-CE2 3.99Å; R945-Y991 HydrophobicContact CB-CG 4.26Å; T946-Y991 PolarHBondContact OG1-OH 3.14Å; W988-Y991 WeakPolarHBondContact O-CD2 3.35Å; W988-Y991 PolarHBondContact O-N 3.01Å; L989-Y991 PolarHBondContact O-N 3.46Å; Y991-Y1022 WeakPolarHBondContact O-CD1 3.3Å; Y991-S1023 PolarHBondContact O-OG 2.99Å; Y991-T1026 HydrophobicContact CD1-CG2 3.48Å; Y991-T1026 VanDerWaalsContact CD1-CG2 3.48Å; Y991-T1026 HydrophobicContact CD2-CG2 4.49Å; Y991-T1026 HydrophobicContact CE1-CG2 3.52Å; Y991-T1026 HydrophobicContact CG-CG2 4Å; Y991-V1027 HydrophobicContact CE1-CG2 4.02Å; Y991-E1030 WeakPolarHBondContact CE1-OE1 3.25Å; Y991-E1030 PolarHBondContact OH-OE1 2.7Å; Y991-E1030 PolarHBondContact OH-OE2 3.46Å
992	L	93.5	Very high	82.4	Confident	5 Å²	5	30 Å²	30	3%	0.026	15%	0.145	C	C	.	.	S	Bend	trans	-76.9	130.2	-175.6	-64.6	-174.5	0	0	0	112.1	W988 L989 V996 M997 L1000 F1015 Y1022 V1050	W988-L992 HydrophobicContact CE3-CD1 4Å; W988-L992 HydrophobicContact CE3-CD2 4.45Å; W988-L992 HydrophobicContact CE3-CG 4.28Å; W988-L992 HydrophobicContact CH2-CD1 4.02Å; W988-L992 HydrophobicContact CH2-CD2 3.83Å; W988-L992 HydrophobicContact CH2-CG 4.37Å; W988-L992 HydrophobicContact CZ2-CD2 3.81Å; W988-L992 HydrophobicContact CZ3-CD1 3.62Å; W988-L992 HydrophobicContact CZ3-CD2 4.17Å; W988-L992 HydrophobicContact CZ3-CG 4.21Å; L989-L992 HydrophobicContact CD2-CD1 4.11Å; L989-L992 PolarHBondContact O-N 2.86Å; L992-V996 HydrophobicContact CD2-CG1 4.02Å; L992-M997 HydrophobicContact CB-CE 3.9Å; L992-M997 HydrophobicContact CD1-CE 4.27Å; L992-M997 HydrophobicContact CD1-SD 4.16Å; L992-L1000 HydrophobicContact CD1-CD1 3.75Å; L992-L1000 HydrophobicContact CD1-CD2 4.3Å; L992-L1000 HydrophobicContact CD1-CG 4.31Å; L992-F1015 HydrophobicContact CD2-CE1 4.33Å; L992-Y1022 WeakPolarHBondContact O-CE1 3.47Å; L992-V1050 WeakPolarHBondContact O-CG1 3.46Å
993	A	95.1	Very high	81.7	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.008	15%	0.147	C	C	.	.			trans	-66.4	149.7	171.7	0	0	0	0	0	111.9	E995 V996 M997 Y1022	A993-E995 VanDerWaalsContact CB-CD 3.48Å; A993-E995 WeakPolarHBondContact CB-OE1 3.48Å; A993-E995 WeakPolarHBondContact CB-OE2 3.25Å; A993-E995 PolarHBondContact O-N 2.92Å; A993-E995 VanDerWaalsContact O-N 3.12Å; A993-V996 HydrophobicContact CB-CG2 4.48Å; A993-V996 PolarHBondContact O-N 3.29Å; A993-M997 PolarHBondContact O-N 3.21Å; A993-Y1022 HydrophobicContact CB-CD1 4.19Å; A993-Y1022 HydrophobicContact CB-CD2 4.23Å; A993-Y1022 HydrophobicContact CB-CG 3.81Å
994	P	93.7	Very high	80.5	Confident	3 Å²	3	34.7 Å²	34.7	2%	0.019	16%	0.164	C	C	.	.	H	α-helix	trans	-53.9	-33	-176.9	-29.8	35.8	0	0	0	115.7	R998 Y1022 V1050 F1077	P994-R998 VanDerWaalsContact CB-NH2 3.28Å; P994-R998 WeakPolarHBondContact O-CG 3.07Å; P994-R998 PolarHBondContact O-N 3.35Å; P994-R998 VanDerWaalsContact O-N 3.12Å; P994-R998 PolarHBondContact O-NH1 2.93Å; P994-Y1022 HydrophobicContact CG-CE2 4.15Å; P994-V1050 WeakPolarHBondContact CB-O 3.45Å; P994-V1050 HydrophobicContact CG-CG1 4.14Å; P994-F1077 HydrophobicContact CB-CD2 4.49Å
995	E	92.5	Very high	79.2	Confident	22 Å²	22	39 Å²	39	10%	0.103	18%	0.183	C	C	.	.	H	α-helix	trans	-69.3	-40.8	174.8	65.4	-78.2	-174.7	0	0	113	A993 S999 L1079 R1082	A993-E995 VanDerWaalsContact CB-CD 3.48Å; A993-E995 WeakPolarHBondContact CB-OE1 3.48Å; A993-E995 WeakPolarHBondContact CB-OE2 3.25Å; A993-E995 PolarHBondContact O-N 2.92Å; A993-E995 VanDerWaalsContact O-N 3.12Å; E995-S999 PolarHBondContact O-N 3.2Å; E995-S999 PolarHBondContact O-OG 3.4Å; E995-L1079 HydrophobicContact CB-CD1 4.18Å; E995-L1079 HydrophobicContact CG-CD1 3.93Å; E995-L1079 HydrophobicContact CG-CD2 4.26Å; E995-L1079 HydrophobicContact CG-CG 4.27Å; E995-R1082 IonicContact OE1-CZ 3.58Å; E995-R1082 IonicContact OE1-NH1 2.86Å; E995-R1082 PolarHBondContact OE1-NH1 3.36Å; E995-R1082 IonicContact OE1-NH2 2.75Å; E995-R1082 PolarHBondContact OE1-NH2 3.35Å; E995-R1082 IonicContact OE2-CZ 3.43Å; E995-R1082 IonicContact OE2-NH1 3.46Å; E995-R1082 IonicContact OE2-NH2 3.52Å; E995-R1082 PolarHBondContact OE2-NH2 3.16Å
996	V	90.7	Very high	77.2	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.006	19%	0.191	C	C	.	.	H	α-helix	trans	-69.7	-41.3	174.5	-177.1	0	0	0	0	110	L992 A993 R998 S999 L1000 L1013 F1015	L992-V996 HydrophobicContact CD2-CG1 4.02Å; A993-V996 HydrophobicContact CB-CG2 4.48Å; A993-V996 PolarHBondContact O-N 3.29Å; V996-R998 PolarHBondContact O-N 3.32Å; V996-S999 PolarHBondContact O-N 2.67Å; V996-S999 VanDerWaalsContact O-N 3.07Å; V996-L1000 PolarHBondContact O-N 3.35Å; V996-L1000 VanDerWaalsContact O-N 3.17Å; V996-L1013 HydrophobicContact CG1-CB 4.23Å; V996-L1013 HydrophobicContact CG1-CD1 3.92Å; V996-L1013 HydrophobicContact CG1-CD2 4.45Å; V996-L1013 HydrophobicContact CG1-CG 4.45Å; V996-F1015 HydrophobicContact CG1-CD1 4.49Å; V996-F1015 HydrophobicContact CG1-CE1 4.02Å; V996-F1015 HydrophobicContact CG1-CZ 4.05Å; V996-F1015 HydrophobicContact CG2-CD1 4.19Å; V996-F1015 HydrophobicContact CG2-CE1 4.44Å
997	M	89.7	Confident	75.2	Confident	1 Å²	1	40 Å²	40	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-58.2	-42.8	178.3	-169.9	65.8	84.5	0	0	112.5	L989 L992 A993 S999 L1000 I1046 I1047 V1050	L989-M997 HydrophobicContact CB-CE 4Å; L989-M997 HydrophobicContact CD2-CE 4.18Å; L989-M997 HydrophobicContact CD2-SD 4.05Å; L989-M997 WeakPolarHBondContact O-CE 3.29Å; L992-M997 HydrophobicContact CB-CE 3.9Å; L992-M997 HydrophobicContact CD1-CE 4.27Å; L992-M997 HydrophobicContact CD1-SD 4.16Å; A993-M997 PolarHBondContact O-N 3.21Å; M997-S999 VanDerWaalsContact C-N 3.33Å; M997-L1000 WeakPolarHBondContact O-CB 3.04Å; M997-L1000 PolarHBondContact O-N 3.01Å; M997-L1000 HydrophobicContact SD-CD1 3.74Å; M997-I1046 HydrophobicContact CE-CG2 4.38Å; M997-I1047 HydrophobicContact CG-CG2 4.33Å; M997-I1047 HydrophobicContact SD-CB 4.1Å; M997-I1047 HydrophobicContact SD-CG1 3.7Å; M997-I1047 HydrophobicContact SD-CG2 4.28Å; M997-V1050 HydrophobicContact CB-CG1 4.16Å; M997-V1050 HydrophobicContact CE-CB 3.83Å; M997-V1050 HydrophobicContact CE-CG1 3.87Å; M997-V1050 HydrophobicContact CE-CG2 4.23Å; M997-V1050 HydrophobicContact CG-CB 4.23Å; M997-V1050 HydrophobicContact CG-CG1 4.18Å
998	R	86.2	Confident	72.9	Confident	91 Å²	91	46.2 Å²	46.2	34%	0.343	24%	0.244	S	C	.	.	H	α-helix	trans	-67.8	-32.8	175.1	-72	176.6	-147	105.9	12.6	112.7	P994 V996 L1000 L1001 G1051	P994-R998 VanDerWaalsContact CB-NH2 3.28Å; P994-R998 WeakPolarHBondContact O-CG 3.07Å; P994-R998 PolarHBondContact O-N 3.35Å; P994-R998 VanDerWaalsContact O-N 3.12Å; P994-R998 PolarHBondContact O-NH1 2.93Å; V996-R998 PolarHBondContact O-N 3.32Å; R998-L1000 VanDerWaalsContact C-N 3.3Å; R998-L1000 PolarHBondContact O-N 3.2Å; R998-L1001 WeakPolarHBondContact O-CB 3.48Å; R998-L1001 PolarHBondContact O-N 3.02Å; R998-G1051 VanDerWaalsContact CZ-O 3.27Å; R998-G1051 PolarHBondContact NE-O 3.18Å; R998-G1051 PolarHBondContact NH2-O 3.12Å
999	S	82.4	Confident	70.6	Confident	27 Å²	27	47.8 Å²	47.8	19%	0.189	26%	0.263	C	S	.	.	H	α-helix	trans	-75.2	-16.1	179.1	-65.4	0	0	0	0	113.8	E995 V996 M997 L1001 K1002 P1014	E995-S999 PolarHBondContact O-N 3.2Å; E995-S999 PolarHBondContact O-OG 3.4Å; V996-S999 PolarHBondContact O-N 2.67Å; V996-S999 VanDerWaalsContact O-N 3.07Å; M997-S999 VanDerWaalsContact C-N 3.33Å; S999-L1001 PolarHBondContact O-N 2.93Å; S999-K1002 PolarHBondContact O-N 2.94Å; S999-P1014 WeakPolarHBondContact OG-CG 3.46Å
1000	L	76.2	Confident	68.6	Low	3 Å²	3	49 Å²	49	2%	0.016	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-56.4	-34.3	165.4	-59	-176.1	0	0	0	112.1	I967 L982 L989 L992 V996 M997 R998 K1002 L1013	I967-L1000 HydrophobicContact CD1-CD2 4.39Å; L982-L1000 HydrophobicContact CD2-CD2 4.19Å; L989-L1000 HydrophobicContact CD2-CD1 3.96Å; L992-L1000 HydrophobicContact CD1-CD1 3.75Å; L992-L1000 HydrophobicContact CD1-CD2 4.3Å; L992-L1000 HydrophobicContact CD1-CG 4.31Å; V996-L1000 PolarHBondContact O-N 3.35Å; V996-L1000 VanDerWaalsContact O-N 3.17Å; M997-L1000 WeakPolarHBondContact O-CB 3.04Å; M997-L1000 PolarHBondContact O-N 3.01Å; M997-L1000 HydrophobicContact SD-CD1 3.74Å; R998-L1000 VanDerWaalsContact C-N 3.3Å; R998-L1000 PolarHBondContact O-N 3.2Å; L1000-K1002 VanDerWaalsContact C-N 3.35Å; L1000-L1013 HydrophobicContact CD2-CD1 3.89Å; L1000-L1013 HydrophobicContact CD2-CD2 4.1Å
1001	L	56.2	Low	66.7	Low	111 Å²	111	54 Å²	54	58%	0.581	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-83.1	-11.8	178.6	-56.1	174.7	0	0	0	113.1	I732 R998 S999 I1047	I732-L1001 HydrophobicContact CG2-CD2 4.35Å; R998-L1001 WeakPolarHBondContact O-CB 3.48Å; R998-L1001 PolarHBondContact O-N 3.02Å; S999-L1001 PolarHBondContact O-N 2.93Å; L1001-I1047 HydrophobicContact CD1-CG2 4.46Å; L1001-I1047 HydrophobicContact CD2-CG2 4.4Å
1002	K	52.8	Low	65.3	Low	144 Å²	144	57.5 Å²	57.5	63%	0.626	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-92.7	1.2	178.2	-74.3	-165.7	166.5	-162.2	0	113.5	S999 L1000 K1004	S999-K1002 PolarHBondContact O-N 2.94Å; L1000-K1002 VanDerWaalsContact C-N 3.35Å; K1002-K1004 PolarHBondContact O-N 3.39Å
1003	F	51.6	Low	64.7	Low	26 Å²	26	57.6 Å²	57.6	11%	0.114	31%	0.311	C	S	.	.			trans	-55.6	105.9	177.7	-117.5	-108.9	0	0	0	110.3	L734 I967 L971 V1010 L1013	L734-F1003 HydrophobicContact CD2-CB 4.02Å; L734-F1003 WeakPolarHBondContact CD2-O 3.48Å; I967-F1003 HydrophobicContact CB-CZ 4.27Å; I967-F1003 HydrophobicContact CD1-CD2 4.22Å; I967-F1003 HydrophobicContact CD1-CE1 4.48Å; I967-F1003 HydrophobicContact CD1-CE2 3.46Å; I967-F1003 VanDerWaalsContact CD1-CE2 3.46Å; I967-F1003 HydrophobicContact CD1-CZ 3.61Å; I967-F1003 HydrophobicContact CG1-CE1 4.4Å; I967-F1003 HydrophobicContact CG1-CE2 4.04Å; I967-F1003 HydrophobicContact CG1-CZ 3.64Å; I967-F1003 HydrophobicContact CG2-CE2 4.11Å; I967-F1003 HydrophobicContact CG2-CZ 3.64Å; L971-F1003 HydrophobicContact CD1-CE1 4.24Å; L971-F1003 HydrophobicContact CD2-CD1 4.29Å; L971-F1003 HydrophobicContact CD2-CE1 4.11Å; F1003-V1010 HydrophobicContact CE1-CG1 3.57Å; F1003-V1010 HydrophobicContact CE1-CG2 4.41Å; F1003-V1010 HydrophobicContact CE2-CG1 4.3Å; F1003-V1010 HydrophobicContact CZ-CG1 3.32Å; F1003-L1013 HydrophobicContact CE2-CD2 4.23Å; F1003-L1013 HydrophobicContact CE2-CG 4.39Å
1004	K	44.2	Very low	64.3	Low	88 Å²	88	59.8 Å²	59.8	38%	0.383	33%	0.325	S	S	.	.			trans	-117.6	132.7	168	-81.1	-163.8	169.3	-159.4	0	107.7	G737 K1002 N1006	G737-K1004 PolarHBondContact O-NZ 3.02Å; K1002-K1004 PolarHBondContact O-N 3.39Å; K1004-N1006 PolarHBondContact O-N 2.8Å; K1004-N1006 VanDerWaalsContact O-N 3.12Å
1005	E	45.2	Very low	64.1	Low	96 Å²	96	61.1 Å²	61.1	45%	0.449	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	82	151.6	-70.6	-178.1	152.4	0	0	107.1	K980	K980-E1005 IonicContact NZ-OE1 2.72Å; K980-E1005 PolarHBondContact NZ-OE1 3.31Å; K980-E1005 IonicContact NZ-OE2 2.69Å; K980-E1005 PolarHBondContact NZ-OE2 3.23Å
1006	N	36	Very low	64.1	Low	70 Å²	70	61.1 Å²	61.1	37%	0.374	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	144.7	150	-57.4	-29.6	0	0	0	106.1	K1004 D1008 G1009 E1011	K1004-N1006 PolarHBondContact O-N 2.8Å; K1004-N1006 VanDerWaalsContact O-N 3.12Å; N1006-D1008 PolarHBondContact O-N 3.08Å; N1006-G1009 PolarHBondContact O-N 3.05Å; N1006-G1009 VanDerWaalsContact O-N 3.11Å; N1006-E1011 PolarHBondContact ND2-OE1 2.05Å
1007	G	37.7	Very low	64.3	Low	83 Å²	83	61.8 Å²	61.8	86%	0.856	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-24.1	-167.8	0	0	0	0	0	115.1
1008	D	37.1	Very low	64.7	Low	169 Å²	169	63.8 Å²	63.8	90%	0.904	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	1.7	-173.3	-45.9	-70.9	0	0	0	114.4	N1006	N1006-D1008 PolarHBondContact O-N 3.08Å
1009	G	41.6	Very low	65.2	Low	40 Å²	40	59.6 Å²	59.6	41%	0.412	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	136.1	-176.2	168.5	0	0	0	0	0	115.8	N1006	N1006-G1009 PolarHBondContact O-N 3.05Å; N1006-G1009 VanDerWaalsContact O-N 3.11Å
1010	V	49.8	Very low	65.9	Low	35 Å²	35	58.3 Å²	58.3	21%	0.212	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	123.7	179.5	168.9	0	0	0	0	110.3	I967 F1003 E1012	I967-V1010 HydrophobicContact CG2-CG1 4.48Å; F1003-V1010 HydrophobicContact CE1-CG1 3.57Å; F1003-V1010 HydrophobicContact CE1-CG2 4.41Å; F1003-V1010 HydrophobicContact CE2-CG1 4.3Å; F1003-V1010 HydrophobicContact CZ-CG1 3.32Å; V1010-E1012 PolarHBondContact O-N 3.5Å
1011	E	53.2	Low	66.9	Low	106 Å²	106	58.3 Å²	58.3	50%	0.495	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-63	124.9	166.6	-72.8	-175	-165.5	0	0	110.2	N1006	N1006-E1011 PolarHBondContact ND2-OE1 2.05Å
1012	E	66.7	Low	68.9	Low	85 Å²	85	53.2 Å²	53.2	40%	0.397	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-70.8	138.7	175.8	-159.5	-170.5	173	0	0	110.7	W793 K942 V1010	W793-E1012 PolarHBondContact NE1-OE2 2.7Å; K942-E1012 IonicContact NZ-OE1 2.63Å; K942-E1012 PolarHBondContact NZ-OE1 3.06Å; V1010-E1012 PolarHBondContact O-N 3.5Å
1013	L	79.2	Confident	71.1	Confident	7 Å²	7	46.7 Å²	46.7	4%	0.037	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-58.6	142.2	173.8	-72.7	179	0	0	0	111.7	I967 V996 L1000 F1003 F1015	I967-L1013 HydrophobicContact CB-CD1 4.39Å; I967-L1013 HydrophobicContact CD1-CD1 3.47Å; I967-L1013 VanDerWaalsContact CD1-CD1 3.47Å; I967-L1013 HydrophobicContact CD1-CD2 4.34Å; I967-L1013 HydrophobicContact CD1-CG 3.85Å; I967-L1013 HydrophobicContact CG1-CD1 4.5Å; I967-L1013 HydrophobicContact CG2-CG 4.48Å; V996-L1013 HydrophobicContact CG1-CB 4.23Å; V996-L1013 HydrophobicContact CG1-CD1 3.92Å; V996-L1013 HydrophobicContact CG1-CD2 4.45Å; V996-L1013 HydrophobicContact CG1-CG 4.45Å; L1000-L1013 HydrophobicContact CD2-CD1 3.89Å; L1000-L1013 HydrophobicContact CD2-CD2 4.1Å; F1003-L1013 HydrophobicContact CE2-CD2 4.23Å; F1003-L1013 HydrophobicContact CE2-CG 4.39Å; L1013-F1015 HydrophobicContact CB-CD2 3.77Å; L1013-F1015 HydrophobicContact CB-CE2 3.58Å; L1013-F1015 HydrophobicContact CB-CZ 4.44Å; L1013-F1015 HydrophobicContact CD1-CE2 3.78Å; L1013-F1015 HydrophobicContact CD1-CZ 4.05Å; L1013-F1015 HydrophobicContact CG-CE2 4.33Å; L1013-F1015 PolarHBondContact O-N 2.76Å
1014	P	86.8	Confident	73.3	Confident	48 Å²	48	45.4 Å²	45.4	31%	0.312	27%	0.269	S	S	.	.			trans	-77.9	59.8	-175	34.6	-38.6	0	0	0	112.5	S999	S999-P1014 WeakPolarHBondContact OG-CG 3.46Å
1015	F	90	Very high	75.8	Confident	31 Å²	31	41.2 Å²	41.2	14%	0.136	25%	0.251	C	S	.	.			trans	-67.1	141	170.5	-70.3	-76.9	0	0	0	110.7	I940 K942 F965 L992 V996 L1013	I940-F1015 HydrophobicContact CG2-CB 4.24Å; K942-F1015 HydrophobicContact CB-CB 4.45Å; K942-F1015 HydrophobicContact CB-CD1 3.95Å; K942-F1015 HydrophobicContact CB-CD2 4.19Å; K942-F1015 HydrophobicContact CB-CE1 4.16Å; K942-F1015 HydrophobicContact CB-CE2 4.38Å; K942-F1015 HydrophobicContact CB-CG 3.96Å; K942-F1015 HydrophobicContact CB-CZ 4.37Å; K942-F1015 HydrophobicContact CD-CB 4.35Å; K942-F1015 HydrophobicContact CD-CD2 4.05Å; K942-F1015 HydrophobicContact CD-CG 4.28Å; K942-F1015 HydrophobicContact CG-CB 3.85Å; K942-F1015 HydrophobicContact CG-CD1 4.29Å; K942-F1015 HydrophobicContact CG-CD2 4.11Å; K942-F1015 HydrophobicContact CG-CG 3.85Å; K942-F1015 WeakPolarHBondContact O-CE1 3.43Å; F965-F1015 AromaticContact CD1-CE2 3.75Å; F965-F1015 HydrophobicContact CD1-CE2 3.75Å; F965-F1015 AromaticContact CD1-CZ 3.97Å; F965-F1015 HydrophobicContact CD1-CZ 3.97Å; F965-F1015 AromaticContact CE1-CE2 3.66Å; F965-F1015 HydrophobicContact CE1-CE2 3.66Å; F965-F1015 AromaticContact CE1-CZ 3.78Å; F965-F1015 HydrophobicContact CE1-CZ 3.78Å; F965-F1015 HydrophobicContact CZ-CZ 4.47Å; L992-F1015 HydrophobicContact CD2-CE1 4.33Å; V996-F1015 HydrophobicContact CG1-CD1 4.49Å; V996-F1015 HydrophobicContact CG1-CE1 4.02Å; V996-F1015 HydrophobicContact CG1-CZ 4.05Å; V996-F1015 HydrophobicContact CG2-CD1 4.19Å; V996-F1015 HydrophobicContact CG2-CE1 4.44Å; L1013-F1015 HydrophobicContact CB-CD2 3.77Å; L1013-F1015 HydrophobicContact CB-CE2 3.58Å; L1013-F1015 HydrophobicContact CB-CZ 4.44Å; L1013-F1015 HydrophobicContact CD1-CE2 3.78Å; L1013-F1015 HydrophobicContact CD1-CZ 4.05Å; L1013-F1015 HydrophobicContact CG-CE2 4.33Å; L1013-F1015 PolarHBondContact O-N 2.76Å
1016	S	93.2	Very high	78.3	Confident	21 Å²	21	36.7 Å²	36.7	15%	0.147	23%	0.23	C	C	.	.			trans	-152.6	170.6	-174.4	64.3	0	0	0	0	111	S1019 D1020	S1016-S1019 PolarHBondContact N-OG 2.9Å; S1016-S1019 PolarHBondContact O-N 2.95Å; S1016-S1019 PolarHBondContact O-OG 2.94Å; S1016-S1019 PolarHBondContact OG-N 3.29Å; S1016-D1020 PolarHBondContact O-N 3.48Å; S1016-D1020 VanDerWaalsContact O-N 3.15Å
1017	G	95.1	Very high	81.3	Confident	16 Å²	16	33.4 Å²	33.4	17%	0.165	21%	0.212	C	C	.	.	H	α-helix	trans	-54.2	-48	173.2	0	0	0	0	0	112.8	H935 S1019 D1020 V1021	H935-G1017 WeakPolarHBondContact CE1-CA 3.42Å; H935-G1017 PolarHBondContact CE1-O 3.19Å; G1017-S1019 VanDerWaalsContact C-N 3.26Å; G1017-S1019 PolarHBondContact O-N 2.88Å; G1017-D1020 PolarHBondContact O-N 3.09Å; G1017-V1021 PolarHBondContact O-N 2.84Å; G1017-V1021 VanDerWaalsContact O-N 3.15Å
1018	P	97.3	Very high	84.1	Confident	43 Å²	43	29.4 Å²	29.4	28%	0.279	17%	0.171	S	C	.	.	H	α-helix	trans	-59	-26.3	171.5	-29.3	37.8	0	0	0	115.4	Y1022 L1079 R1082	P1018-Y1022 PolarHBondContact O-N 2.88Å; P1018-L1079 HydrophobicContact CB-CB 3.91Å; P1018-L1079 HydrophobicContact CB-CG 4.24Å; P1018-L1079 HydrophobicContact CG-CB 4.18Å; P1018-R1082 VanDerWaalsContact C-NH1 3.31Å; P1018-R1082 WeakPolarHBondContact O-CD 3.1Å; P1018-R1082 PolarHBondContact O-NH1 3.4Å
1019	S	96.5	Very high	86.9	Confident	2 Å²	2	22.3 Å²	22.3	1%	0.014	13%	0.132	C	C	.	.	H	α-helix	trans	-74.5	-40.1	174.2	73	0	0	0	0	111.9	S1016 G1017 V1021 Y1022 S1023	S1016-S1019 PolarHBondContact N-OG 2.9Å; S1016-S1019 PolarHBondContact O-N 2.95Å; S1016-S1019 PolarHBondContact O-OG 2.94Å; S1016-S1019 PolarHBondContact OG-N 3.29Å; G1017-S1019 VanDerWaalsContact C-N 3.26Å; G1017-S1019 PolarHBondContact O-N 2.88Å; S1019-V1021 PolarHBondContact O-N 2.96Å; S1019-Y1022 WeakPolarHBondContact O-CB 3.47Å; S1019-Y1022 PolarHBondContact O-N 3.21Å; S1019-Y1022 VanDerWaalsContact O-N 3.09Å; S1019-S1023 PolarHBondContact O-N 3.23Å; S1019-S1023 PolarHBondContact O-OG 3.27Å; S1019-S1023 VanDerWaalsContact O-OG 3.08Å
1020	D	97.6	Very high	89.5	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-59.9	-36.6	172.5	-73.6	-19	0	0	0	111.6	M931 H935 I940 H941 K942 S1016 G1017 Y1022 S1023 F1024 F1085	M931-D1020 HydrophobicContact CE-CB 3.83Å; M931-D1020 WeakPolarHBondContact CE-OD2 3.34Å; H935-D1020 IonicContact CD2-OD2 3.2Å; H935-D1020 IonicContact CE1-OD2 3.76Å; H935-D1020 IonicContact NE2-OD2 2.83Å; H935-D1020 PolarHBondContact NE2-OD2 2.8Å; I940-D1020 WeakPolarHBondContact CG2-OD2 3.41Å; H941-D1020 PolarHBondContact N-OD1 3.39Å; H941-D1020 PolarHBondContact N-OD2 3.4Å; K942-D1020 PolarHBondContact N-OD1 2.96Å; S1016-D1020 PolarHBondContact O-N 3.48Å; S1016-D1020 VanDerWaalsContact O-N 3.15Å; G1017-D1020 PolarHBondContact O-N 3.09Å; D1020-Y1022 VanDerWaalsContact C-N 3.34Å; D1020-S1023 PolarHBondContact O-N 2.93Å; D1020-F1024 PolarHBondContact O-N 3.44Å; D1020-F1085 HydrophobicContact CB-CE2 4.09Å; D1020-F1085 HydrophobicContact CB-CZ 4.42Å
1021	V	98.1	Very high	91.6	Very high	3 Å²	3	18.9 Å²	18.9	2%	0.018	10%	0.103	C	C	.	.	H	α-helix	trans	-63.6	-38.2	174.5	170.6	0	0	0	0	111.8	G1017 S1019 F1024 G1025 C1074 R1082 P1083 F1085 L1088	G1017-V1021 PolarHBondContact O-N 2.84Å; G1017-V1021 VanDerWaalsContact O-N 3.15Å; S1019-V1021 PolarHBondContact O-N 2.96Å; V1021-F1024 PolarHBondContact O-N 3.12Å; V1021-G1025 PolarHBondContact O-N 3.3Å; V1021-C1074 HydrophobicContact CG1-CB 4.22Å; V1021-R1082 HydrophobicContact CG1-CB 4.03Å; V1021-P1083 WeakPolarHBondContact CG1-O 3.11Å; V1021-P1083 WeakPolarHBondContact CG2-O 3.37Å; V1021-F1085 HydrophobicContact CG2-CD2 3.89Å; V1021-F1085 HydrophobicContact CG2-CE2 3.6Å; V1021-F1085 HydrophobicContact CG2-CG 4.48Å; V1021-F1085 HydrophobicContact CG2-CZ 3.96Å; V1021-L1088 HydrophobicContact CG1-CD1 4.31Å
1022	Y	98.1	Very high	93.6	Very high	5 Å²	5	14.7 Å²	14.7	2%	0.02	8%	0.084	C	C	.	.	H	α-helix	trans	-63.9	-45.9	174.2	-174.5	-77.6	0	0	0	111	Y991 L992 A993 P994 P1018 S1019 D1020 F1024 G1025 T1026 C1074 W1075	Y991-Y1022 WeakPolarHBondContact O-CD1 3.3Å; L992-Y1022 WeakPolarHBondContact O-CE1 3.47Å; A993-Y1022 HydrophobicContact CB-CD1 4.19Å; A993-Y1022 HydrophobicContact CB-CD2 4.23Å; A993-Y1022 HydrophobicContact CB-CG 3.81Å; P994-Y1022 HydrophobicContact CG-CE2 4.15Å; P1018-Y1022 PolarHBondContact O-N 2.88Å; S1019-Y1022 WeakPolarHBondContact O-CB 3.47Å; S1019-Y1022 PolarHBondContact O-N 3.21Å; S1019-Y1022 VanDerWaalsContact O-N 3.09Å; D1020-Y1022 VanDerWaalsContact C-N 3.34Å; Y1022-F1024 VanDerWaalsContact C-N 3.3Å; Y1022-F1024 PolarHBondContact O-N 3.24Å; Y1022-G1025 WeakPolarHBondContact O-CA 3.09Å; Y1022-G1025 PolarHBondContact O-N 3.46Å; Y1022-T1026 PolarHBondContact O-N 3.19Å; Y1022-T1026 VanDerWaalsContact O-N 3.15Å; Y1022-C1074 WeakPolarHBondContact CA-O 3.41Å; Y1022-W1075 AromaticContact CD1-CD1 3.96Å; Y1022-W1075 HydrophobicContact CD2-CB 4.2Å; Y1022-W1075 AromaticContact CD2-CD1 3.72Å; Y1022-W1075 HydrophobicContact CD2-CG 4.33Å; Y1022-W1075 AromaticContact CE1-CD1 3.8Å; Y1022-W1075 HydrophobicContact CE2-CB 3.81Å; Y1022-W1075 AromaticContact CE2-CD1 3.53Å; Y1022-W1075 AromaticContact CE2-CG 3.92Å; Y1022-W1075 HydrophobicContact CE2-CG 3.92Å; Y1022-W1075 AromaticContact CG-CD1 3.92Å; Y1022-W1075 AromaticContact CZ-CD1 3.58Å
1023	S	97.5	Very high	94.8	Very high	6 Å²	6	12.4 Å²	12.4	4%	0.042	8%	0.08	C	C	.	.	H	α-helix	trans	-60.3	-39.5	175.9	-44.6	0	0	0	0	111.8	L944 Y991 S1019 D1020 T1026 V1027	L944-S1023 VanDerWaalsContact O-CB 3.26Å; L944-S1023 WeakPolarHBondContact O-CB 3.33Å; Y991-S1023 PolarHBondContact O-OG 2.99Å; S1019-S1023 PolarHBondContact O-N 3.23Å; S1019-S1023 PolarHBondContact O-OG 3.27Å; S1019-S1023 VanDerWaalsContact O-OG 3.08Å; D1020-S1023 PolarHBondContact O-N 2.93Å; S1023-T1026 WeakPolarHBondContact O-CB 3.44Å; S1023-T1026 PolarHBondContact O-N 3.12Å; S1023-T1026 VanDerWaalsContact O-N 3.15Å; S1023-V1027 PolarHBondContact O-N 3.08Å
1024	F	98.2	Very high	95.4	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-62.8	-38.3	170.9	175.2	-100	0	0	0	112.8	A924 V927 C928 L944 D1020 V1021 Y1022 T1026 V1027 W1028 F1085 L1088 F1092	A924-F1024 HydrophobicContact CB-CE2 4.48Å; A924-F1024 HydrophobicContact CB-CZ 4.09Å; V927-F1024 HydrophobicContact CB-CD2 4.4Å; V927-F1024 HydrophobicContact CB-CE2 4.05Å; V927-F1024 HydrophobicContact CG1-CD2 3.68Å; V927-F1024 HydrophobicContact CG1-CE2 3.85Å; C928-F1024 WeakPolarHBondContact SG-CZ 3.37Å; L944-F1024 HydrophobicContact CD2-CB 3.87Å; D1020-F1024 PolarHBondContact O-N 3.44Å; V1021-F1024 PolarHBondContact O-N 3.12Å; Y1022-F1024 VanDerWaalsContact C-N 3.3Å; Y1022-F1024 PolarHBondContact O-N 3.24Å; F1024-T1026 PolarHBondContact O-N 3.36Å; F1024-V1027 PolarHBondContact O-N 2.86Å; F1024-V1027 VanDerWaalsContact O-N 3.12Å; F1024-W1028 WeakPolarHBondContact O-CB 3.43Å; F1024-W1028 PolarHBondContact O-N 3.07Å; F1024-F1085 HydrophobicContact CB-CE1 3.7Å; F1024-F1085 HydrophobicContact CB-CZ 3.83Å; F1024-F1085 HydrophobicContact CD1-CE1 4.04Å; F1024-F1085 HydrophobicContact CD2-CE1 4.08Å; F1024-F1085 AromaticContact CG-CE1 3.65Å; F1024-F1085 HydrophobicContact CG-CE1 3.65Å; F1024-F1085 HydrophobicContact CG-CZ 4.3Å; F1024-L1088 HydrophobicContact CD1-CD1 3.84Å; F1024-L1088 HydrophobicContact CE1-CD1 3.93Å; F1024-F1092 AromaticContact CE1-CE2 3.76Å; F1024-F1092 HydrophobicContact CE1-CE2 3.76Å; F1024-F1092 AromaticContact CE1-CZ 3.87Å; F1024-F1092 HydrophobicContact CE1-CZ 3.87Å; F1024-F1092 AromaticContact CZ-CE2 3.6Å; F1024-F1092 HydrophobicContact CZ-CE2 3.6Å; F1024-F1092 AromaticContact CZ-CZ 3.69Å; F1024-F1092 HydrophobicContact CZ-CZ 3.69Å
1025	G	97.6	Very high	95.6	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-55.7	-36.8	171.2	0	0	0	0	0	112.9	V1021 Y1022 F1029 C1074	V1021-G1025 PolarHBondContact O-N 3.3Å; Y1022-G1025 WeakPolarHBondContact O-CA 3.09Å; Y1022-G1025 PolarHBondContact O-N 3.46Å; G1025-F1029 PolarHBondContact O-N 3.44Å; G1025-C1074 VanDerWaalsContact CA-CB 3.46Å
1026	T	97.5	Very high	95.7	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-71.7	-41.2	173.5	-64.3	0	0	0	0	112.5	A990 Y991 Y1022 S1023 F1024 W1028 F1029 E1030 P1037 W1075	A990-T1026 WeakPolarHBondContact O-CG2 3.41Å; A990-T1026 PolarHBondContact O-OG1 3.06Å; Y991-T1026 HydrophobicContact CD1-CG2 3.48Å; Y991-T1026 VanDerWaalsContact CD1-CG2 3.48Å; Y991-T1026 HydrophobicContact CD2-CG2 4.49Å; Y991-T1026 HydrophobicContact CE1-CG2 3.52Å; Y991-T1026 HydrophobicContact CG-CG2 4Å; Y1022-T1026 PolarHBondContact O-N 3.19Å; Y1022-T1026 VanDerWaalsContact O-N 3.15Å; S1023-T1026 WeakPolarHBondContact O-CB 3.44Å; S1023-T1026 PolarHBondContact O-N 3.12Å; S1023-T1026 VanDerWaalsContact O-N 3.15Å; F1024-T1026 PolarHBondContact O-N 3.36Å; T1026-W1028 VanDerWaalsContact C-N 3.3Å; T1026-W1028 PolarHBondContact O-N 3.42Å; T1026-F1029 PolarHBondContact O-N 2.88Å; T1026-E1030 PolarHBondContact O-N 3.1Å; T1026-P1037 HydrophobicContact CG2-CG 3.72Å; T1026-W1075 PolarHBondContact OG1-NE1 2.98Å
1027	V	97.6	Very high	95.6	Very high	1 Å²	1	12.9 Å²	12.9	1%	0.006	9%	0.088	C	C	.	.	H	α-helix	trans	-60.7	-39.4	172.1	174.2	0	0	0	0	111.6	L904 T946 Y991 S1023 F1024 E1030 L1031	L904-V1027 HydrophobicContact CD2-CG1 4.23Å; T946-V1027 HydrophobicContact CG2-CB 4.47Å; T946-V1027 HydrophobicContact CG2-CG1 4.01Å; T946-V1027 HydrophobicContact CG2-CG2 4.28Å; Y991-V1027 HydrophobicContact CE1-CG2 4.02Å; S1023-V1027 PolarHBondContact O-N 3.08Å; F1024-V1027 PolarHBondContact O-N 2.86Å; F1024-V1027 VanDerWaalsContact O-N 3.12Å; V1027-E1030 PolarHBondContact O-N 2.83Å; V1027-L1031 HydrophobicContact CG1-CD1 4.39Å; V1027-L1031 WeakPolarHBondContact O-CG 3.42Å; V1027-L1031 PolarHBondContact O-N 3.38Å
1028	W	97	Very high	95.4	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-67.5	-39.3	175.3	-178.3	-123	0	0	0	112.1	L917 F920 V921 A924 F1024 T1026 L1031 L1032 T1067 I1070 F1092	L917-W1028 HydrophobicContact CD1-CH2 4.07Å; F920-W1028 HydrophobicContact CB-CH2 4.44Å; F920-W1028 HydrophobicContact CB-CZ3 4Å; V921-W1028 HydrophobicContact CG2-CH2 3.98Å; A924-W1028 HydrophobicContact CB-CE3 3.68Å; A924-W1028 HydrophobicContact CB-CZ3 3.68Å; F1024-W1028 WeakPolarHBondContact O-CB 3.43Å; F1024-W1028 PolarHBondContact O-N 3.07Å; T1026-W1028 VanDerWaalsContact C-N 3.3Å; T1026-W1028 PolarHBondContact O-N 3.42Å; W1028-L1031 HydrophobicContact CE3-CB 4.37Å; W1028-L1031 HydrophobicContact CE3-CD1 3.96Å; W1028-L1031 HydrophobicContact CZ3-CD1 4.44Å; W1028-L1031 PolarHBondContact O-N 2.95Å; W1028-L1032 HydrophobicContact CD2-CD1 4.29Å; W1028-L1032 HydrophobicContact CD2-CG 4.31Å; W1028-L1032 HydrophobicContact CH2-CD2 4.04Å; W1028-L1032 HydrophobicContact CZ2-CD1 4.04Å; W1028-L1032 HydrophobicContact CZ2-CD2 3.9Å; W1028-L1032 HydrophobicContact CZ2-CG 4.17Å; W1028-L1032 WeakPolarHBondContact O-CG 3.35Å; W1028-L1032 PolarHBondContact O-N 2.94Å; W1028-L1032 VanDerWaalsContact O-N 3.09Å; W1028-T1067 HydrophobicContact CZ2-CG2 4.13Å; W1028-T1067 PolarHBondContact NE1-O 3.11Å; W1028-I1070 VanDerWaalsContact CD1-CG2 3.5Å; W1028-I1070 HydrophobicContact CG-CG2 4.23Å; W1028-I1070 HydrophobicContact CZ2-CD1 4.4Å; W1028-F1092 HydrophobicContact CD2-CE1 4.13Å; W1028-F1092 HydrophobicContact CD2-CZ 4.23Å; W1028-F1092 HydrophobicContact CE3-CE1 4.04Å; W1028-F1092 HydrophobicContact CE3-CZ 4.31Å; W1028-F1092 AromaticContact CH2-CE1 3.81Å; W1028-F1092 HydrophobicContact CH2-CE1 3.81Å; W1028-F1092 AromaticContact CZ2-CE1 3.87Å; W1028-F1092 HydrophobicContact CZ2-CE1 3.87Å; W1028-F1092 AromaticContact CZ3-CE1 3.88Å; W1028-F1092 HydrophobicContact CZ3-CE1 3.88Å
1029	F	96.2	Very high	94.8	Very high	20 Å²	20	15.2 Å²	15.2	9%	0.088	9%	0.089	C	C	.	.	H	α-helix	trans	-61.4	-45.8	170.8	178.8	-86.2	0	0	0	112	G1025 T1026 L1031 L1032 A1033 D1035 P1037 P1056 L1058 L1061 W1075	G1025-F1029 PolarHBondContact O-N 3.44Å; T1026-F1029 PolarHBondContact O-N 2.88Å; F1029-L1031 VanDerWaalsContact C-N 3.3Å; F1029-L1031 PolarHBondContact O-N 3.16Å; F1029-L1032 PolarHBondContact O-N 3Å; F1029-A1033 HydrophobicContact CD1-CB 4.05Å; F1029-A1033 HydrophobicContact CE1-CB 3.64Å; F1029-A1033 HydrophobicContact CE2-CB 4.42Å; F1029-A1033 HydrophobicContact CZ-CB 3.86Å; F1029-A1033 WeakPolarHBondContact O-CB 3.08Å; F1029-A1033 PolarHBondContact O-N 3.47Å; F1029-D1035 WeakPolarHBondContact CE1-O 3.39Å; F1029-P1037 HydrophobicContact CD1-CB 3.82Å; F1029-P1037 HydrophobicContact CD1-CG 3.61Å; F1029-P1037 HydrophobicContact CE1-CB 3.76Å; F1029-P1037 HydrophobicContact CE1-CG 4.02Å; F1029-P1037 HydrophobicContact CG-CB 4.43Å; F1029-P1037 HydrophobicContact CG-CG 4.26Å; F1029-P1037 HydrophobicContact CZ-CB 4.31Å; F1029-P1056 HydrophobicContact CE2-CB 4.41Å; F1029-L1058 HydrophobicContact CD2-CD2 3.65Å; F1029-L1058 HydrophobicContact CE2-CD2 3.66Å; F1029-L1061 HydrophobicContact CD2-CD1 4.16Å; F1029-L1061 HydrophobicContact CE2-CD1 3.99Å; F1029-W1075 HydrophobicContact CB-CH2 3.64Å; F1029-W1075 HydrophobicContact CB-CZ2 3.72Å; F1029-W1075 HydrophobicContact CD1-CH2 4.44Å; F1029-W1075 AromaticContact CD2-CH2 3.48Å; F1029-W1075 HydrophobicContact CD2-CH2 3.48Å; F1029-W1075 VanDerWaalsContact CD2-CH2 3.48Å; F1029-W1075 HydrophobicContact CD2-CZ2 4.4Å; F1029-W1075 HydrophobicContact CD2-CZ3 4.14Å; F1029-W1075 HydrophobicContact CE2-CH2 4.25Å; F1029-W1075 AromaticContact CG-CH2 3.59Å; F1029-W1075 HydrophobicContact CG-CH2 3.59Å; F1029-W1075 HydrophobicContact CG-CZ2 4.08Å
1030	E	95.8	Very high	94.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-59	-40.1	177.3	-76	176.9	-93.4	0	0	112.4	L908 H909 T946 Y991 T1026 V1027 G1034 F1036	L908-E1030 HydrophobicContact CD1-CB 4.15Å; H909-E1030 IonicContact CD2-OE2 2.65Å; H909-E1030 IonicContact CE1-OE2 2.63Å; H909-E1030 IonicContact NE2-OE2 3.92Å; H909-E1030 PolarHBondContact NE2-OE2 2.69Å; T946-E1030 WeakPolarHBondContact CB-OE2 3.49Å; T946-E1030 HydrophobicContact CG2-CB 4.14Å; T946-E1030 HydrophobicContact CG2-CG 4.42Å; T946-E1030 WeakPolarHBondContact CG2-OE1 3.49Å; T946-E1030 WeakPolarHBondContact CG2-OE2 3.27Å; T946-E1030 PolarHBondContact OG1-OE1 2.97Å; T946-E1030 PolarHBondContact OG1-OE2 2.84Å; Y991-E1030 WeakPolarHBondContact CE1-OE1 3.25Å; Y991-E1030 PolarHBondContact OH-OE1 2.7Å; Y991-E1030 PolarHBondContact OH-OE2 3.46Å; T1026-E1030 PolarHBondContact O-N 3.1Å; V1027-E1030 PolarHBondContact O-N 2.83Å; E1030-G1034 WeakPolarHBondContact O-CA 3.35Å; E1030-G1034 PolarHBondContact O-N 3.44Å; E1030-F1036 HydrophobicContact CG-CD1 4.22Å; E1030-F1036 WeakPolarHBondContact OE2-CE1 3.47Å
1031	L	95.2	Very high	93.8	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-60.2	-50.2	173.8	-75.3	162.8	0	0	0	111.1	L904 L908 F920 V1027 W1028 F1029	L904-L1031 HydrophobicContact CD1-CD2 3.95Å; L904-L1031 HydrophobicContact CD2-CD2 4.07Å; L904-L1031 HydrophobicContact CD2-CG 4.39Å; L904-L1031 HydrophobicContact CG-CD2 4.5Å; L908-L1031 HydrophobicContact CD1-CD2 4.29Å; F920-L1031 HydrophobicContact CD1-CB 4.15Å; F920-L1031 HydrophobicContact CD1-CD2 3.64Å; F920-L1031 HydrophobicContact CD1-CG 4.5Å; F920-L1031 HydrophobicContact CE1-CD2 4.11Å; F920-L1031 WeakPolarHBondContact CE2-O 3.34Å; F920-L1031 HydrophobicContact CG-CB 4.28Å; F920-L1031 HydrophobicContact CG-CD2 4.42Å; F920-L1031 WeakPolarHBondContact CZ-O 3.03Å; V1027-L1031 HydrophobicContact CG1-CD1 4.39Å; V1027-L1031 WeakPolarHBondContact O-CG 3.42Å; V1027-L1031 PolarHBondContact O-N 3.38Å; W1028-L1031 HydrophobicContact CE3-CB 4.37Å; W1028-L1031 HydrophobicContact CE3-CD1 3.96Å; W1028-L1031 HydrophobicContact CZ3-CD1 4.44Å; W1028-L1031 PolarHBondContact O-N 2.95Å; F1029-L1031 VanDerWaalsContact C-N 3.3Å; F1029-L1031 PolarHBondContact O-N 3.16Å
1032	L	93.9	Very high	93.2	Very high	19 Å²	19	34.9 Å²	34.9	10%	0.099	17%	0.173	C	C	.	.	H	α-helix	trans	-71.7	-32.2	-177.7	-65.2	177.5	0	0	0	114.1	L917 F920 W1028 F1029 L1061 V1063	L917-L1032 HydrophobicContact CD1-CD2 3.92Å; F920-L1032 HydrophobicContact CD2-CD2 4.48Å; W1028-L1032 HydrophobicContact CD2-CD1 4.29Å; W1028-L1032 HydrophobicContact CD2-CG 4.31Å; W1028-L1032 HydrophobicContact CH2-CD2 4.04Å; W1028-L1032 HydrophobicContact CZ2-CD1 4.04Å; W1028-L1032 HydrophobicContact CZ2-CD2 3.9Å; W1028-L1032 HydrophobicContact CZ2-CG 4.17Å; W1028-L1032 WeakPolarHBondContact O-CG 3.35Å; W1028-L1032 PolarHBondContact O-N 2.94Å; W1028-L1032 VanDerWaalsContact O-N 3.09Å; F1029-L1032 PolarHBondContact O-N 3Å; L1032-L1061 HydrophobicContact CB-CD1 4.33Å; L1032-V1063 HydrophobicContact CD1-CG2 4.48Å; L1032-V1063 HydrophobicContact CD2-CG1 4.22Å
1033	A	92.4	Very high	92.5	Very high	37 Å²	37	36 Å²	36	31%	0.306	18%	0.182	S	C	.	.	H	α-helix	trans	-94.2	-27.1	-174.9	0	0	0	0	0	113.7	F1029 D1035 L1061	F1029-A1033 HydrophobicContact CD1-CB 4.05Å; F1029-A1033 HydrophobicContact CE1-CB 3.64Å; F1029-A1033 HydrophobicContact CE2-CB 4.42Å; F1029-A1033 HydrophobicContact CZ-CB 3.86Å; F1029-A1033 WeakPolarHBondContact O-CB 3.08Å; F1029-A1033 PolarHBondContact O-N 3.47Å; A1033-D1035 PolarHBondContact O-N 3.02Å; A1033-L1061 HydrophobicContact CB-CD2 3.79Å
1034	G	91.6	Very high	91.9	Very high	37 Å²	37	40.4 Å²	40.4	38%	0.381	20%	0.202	S	C	.	.	S	Bend	trans	64.8	15.9	-167	0	0	0	0	0	113.6	E1030	E1030-G1034 WeakPolarHBondContact O-CA 3.35Å; E1030-G1034 PolarHBondContact O-N 3.44Å
1035	D	91.3	Very high	91.4	Very high	56 Å²	56	43 Å²	43	30%	0.299	22%	0.217	S	C	.	.	S	Bend	trans	-155.8	164.3	-179.4	-148.1	-12.3	0	0	0	111.9	F1029 A1033 K1039	F1029-D1035 WeakPolarHBondContact CE1-O 3.39Å; A1033-D1035 PolarHBondContact O-N 3.02Å; D1035-K1039 WeakPolarHBondContact OD1-CD 3.45Å; D1035-K1039 WeakPolarHBondContact OD1-CE 3.25Å; D1035-K1039 IonicContact OD1-NZ 2.69Å; D1035-K1039 PolarHBondContact OD1-NZ 3.15Å; D1035-K1039 WeakPolarHBondContact OD2-CD 3.21Å; D1035-K1039 IonicContact OD2-NZ 3.67Å; D1035-K1039 PolarHBondContact OD2-NZ 2.68Å
1036	F	91.4	Very high	91.1	Very high	19 Å²	19	43.8 Å²	43.8	8%	0.083	22%	0.221	C	C	.	.			trans	-75.1	143.7	-177	-68.6	-77.6	0	0	0	113.6	H905 H909 H987 E1030 K1039	H905-F1036 AromaticContact CE1-CZ 3.69Å; H905-F1036 AromaticContact ND1-CZ 3.68Å; H909-F1036 AromaticContact CD2-CE2 3.9Å; H909-F1036 AromaticContact CD2-CZ 3.72Å; H909-F1036 AromaticContact CE1-CD2 3.55Å; H909-F1036 AromaticContact CE1-CE2 3.43Å; H909-F1036 VanDerWaalsContact CE1-CE2 3.43Å; H909-F1036 WeakPolarHBondContact CE1-CE2 3.43Å; H909-F1036 AromaticContact CE1-CG 3.92Å; H909-F1036 AromaticContact CE1-CZ 3.7Å; H909-F1036 AromaticContact CG-CE2 3.78Å; H909-F1036 AromaticContact ND1-CD2 3.79Å; H909-F1036 AromaticContact ND1-CE2 3.51Å; H909-F1036 AromaticContact NE2-CE1 3.73Å; H909-F1036 AromaticContact NE2-CE2 3.67Å; H909-F1036 AromaticContact NE2-CZ 3.44Å; H909-F1036 WeakPolarHBondContact NE2-CZ 3.4Å; H987-F1036 HydrophobicContact CB-CD1 3.76Å; H987-F1036 HydrophobicContact CB-CD2 4.33Å; H987-F1036 HydrophobicContact CB-CE1 3.84Å; H987-F1036 HydrophobicContact CB-CE2 4.39Å; H987-F1036 HydrophobicContact CB-CG 4.01Å; H987-F1036 HydrophobicContact CB-CZ 4.15Å; H987-F1036 VanDerWaalsContact CD2-CB 3.43Å; H987-F1036 WeakPolarHBondContact CD2-CB 3.5Å; H987-F1036 AromaticContact CD2-CD2 3.35Å; H987-F1036 WeakPolarHBondContact CD2-CD2 3.45Å; H987-F1036 AromaticContact CD2-CG 3.32Å; H987-F1036 WeakPolarHBondContact CD2-CG 3.31Å; H987-F1036 AromaticContact CE1-CD2 3.78Å; H987-F1036 AromaticContact CE1-CE2 3.95Å; H987-F1036 AromaticContact CG-CD1 3.96Å; H987-F1036 AromaticContact CG-CD2 3.63Å; H987-F1036 AromaticContact CG-CE2 3.84Å; H987-F1036 AromaticContact CG-CG 3.67Å; H987-F1036 AromaticContact ND1-CD2 3.87Å; H987-F1036 AromaticContact ND1-CE2 3.78Å; H987-F1036 AromaticContact NE2-CD2 3.45Å; H987-F1036 WeakPolarHBondContact NE2-CD2 3.39Å; H987-F1036 AromaticContact NE2-CG 3.9Å; E1030-F1036 HydrophobicContact CG-CD1 4.22Å; E1030-F1036 WeakPolarHBondContact OE2-CE1 3.47Å; F1036-K1039 HydrophobicContact CB-CB 4.26Å
1037	P	92.2	Very high	90.6	Very high	4 Å²	4	44.4 Å²	44.4	3%	0.026	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	151.4	166	17.2	-9.3	0	0	0	110.5	A990 T1026 F1029 K1039 P1056 W1075	A990-P1037 HydrophobicContact CB-CG 4.13Å; T1026-P1037 HydrophobicContact CG2-CG 3.72Å; F1029-P1037 HydrophobicContact CD1-CB 3.82Å; F1029-P1037 HydrophobicContact CD1-CG 3.61Å; F1029-P1037 HydrophobicContact CE1-CB 3.76Å; F1029-P1037 HydrophobicContact CE1-CG 4.02Å; F1029-P1037 HydrophobicContact CG-CB 4.43Å; F1029-P1037 HydrophobicContact CG-CG 4.26Å; F1029-P1037 HydrophobicContact CZ-CB 4.31Å; P1037-K1039 PolarHBondContact O-N 2.95Å; P1037-P1056 HydrophobicContact CB-CB 4.21Å; P1037-P1056 HydrophobicContact CB-CG 3.51Å; P1037-W1075 HydrophobicContact CB-CH2 4.26Å; P1037-W1075 HydrophobicContact CB-CZ2 4.36Å; P1037-W1075 HydrophobicContact CG-CH2 4.44Å; P1037-W1075 HydrophobicContact CG-CZ2 4.11Å
1038	F	89.6	Confident	90.2	Very high	15 Å²	15	51.5 Å²	51.5	7%	0.066	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	10.1	-177.3	-53.1	-75.2	0	0	0	118	A990 R1040 Y1041 I1046 Q1049 V1050 P1056	A990-F1038 HydrophobicContact CB-CD2 4.36Å; F1038-R1040 PolarHBondContact O-N 3.14Å; F1038-Y1041 HydrophobicContact CB-CD2 3.98Å; F1038-Y1041 AromaticContact CD1-CD2 3.99Å; F1038-Y1041 HydrophobicContact CD1-CD2 3.99Å; F1038-Y1041 HydrophobicContact CD1-CE2 4.18Å; F1038-Y1041 WeakPolarHBondContact O-CD2 3.14Å; F1038-Y1041 PolarHBondContact O-N 2.95Å; F1038-I1046 HydrophobicContact CB-CD1 3.83Å; F1038-I1046 HydrophobicContact CB-CG1 3.85Å; F1038-I1046 HydrophobicContact CB-CG2 4.48Å; F1038-I1046 HydrophobicContact CD2-CG2 4.26Å; F1038-I1046 HydrophobicContact CG-CG1 4.44Å; F1038-I1046 HydrophobicContact CG-CG2 4.43Å; F1038-Q1049 HydrophobicContact CE1-CB 4.38Å; F1038-Q1049 VanDerWaalsContact CE1-OE1 3.31Å; F1038-V1050 HydrophobicContact CD2-CG2 4.37Å; F1038-V1050 HydrophobicContact CE2-CG2 3.61Å; F1038-V1050 HydrophobicContact CZ-CG2 3.87Å; F1038-P1056 HydrophobicContact CD2-CG 4.04Å; F1038-P1056 HydrophobicContact CE1-CG 4.13Å; F1038-P1056 HydrophobicContact CE2-CG 3.62Å; F1038-P1056 HydrophobicContact CG-CG 4.48Å; F1038-P1056 VanDerWaalsContact CZ-CD 3.45Å; F1038-P1056 HydrophobicContact CZ-CG 3.68Å
1039	K	86	Confident	89.9	Confident	93 Å²	93	52.8 Å²	52.8	40%	0.404	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.4	-20.6	-175.7	-179.5	167	-179.6	179.1	0	118.7	D1035 F1036 P1037	D1035-K1039 WeakPolarHBondContact OD1-CD 3.45Å; D1035-K1039 WeakPolarHBondContact OD1-CE 3.25Å; D1035-K1039 IonicContact OD1-NZ 2.69Å; D1035-K1039 PolarHBondContact OD1-NZ 3.15Å; D1035-K1039 WeakPolarHBondContact OD2-CD 3.21Å; D1035-K1039 IonicContact OD2-NZ 3.67Å; D1035-K1039 PolarHBondContact OD2-NZ 2.68Å; F1036-K1039 HydrophobicContact CB-CB 4.26Å; P1037-K1039 PolarHBondContact O-N 2.95Å
1040	R	85.1	Confident	89.7	Confident	245 Å²	245	51.9 Å²	51.9	93%	0.925	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	2.3	-179.4	-64.8	-176.9	-179.7	-119.2	7.8	114.2	F1038	F1038-R1040 PolarHBondContact O-N 3.14Å
1041	Y	86.8	Confident	89.4	Confident	125 Å²	125	52.5 Å²	52.5	49%	0.49	26%	0.26	S	S	.	.	S	Bend	trans	-101.4	147.6	-178.9	-63.8	-82.5	0	0	0	111.3	F1038 T1045	F1038-Y1041 HydrophobicContact CB-CD2 3.98Å; F1038-Y1041 AromaticContact CD1-CD2 3.99Å; F1038-Y1041 HydrophobicContact CD1-CD2 3.99Å; F1038-Y1041 HydrophobicContact CD1-CE2 4.18Å; F1038-Y1041 WeakPolarHBondContact O-CD2 3.14Å; F1038-Y1041 PolarHBondContact O-N 2.95Å; Y1041-T1045 HydrophobicContact CD1-CG2 3.69Å; Y1041-T1045 HydrophobicContact CG-CG2 4.26Å
1042	A	86.3	Confident	89.1	Confident	48 Å²	48	60.8 Å²	60.8	40%	0.397	29%	0.291	S	S	.	.			trans	-68.7	151.9	173.3	0	0	0	0	0	111.2	E1044 T1045 I1046	A1042-E1044 VanDerWaalsContact C-N 3.27Å; A1042-E1044 WeakPolarHBondContact CB-OE2 3.35Å; A1042-E1044 PolarHBondContact O-N 3.08Å; A1042-T1045 WeakPolarHBondContact O-CA 3.47Å; A1042-T1045 VanDerWaalsContact O-CB 3.31Å; A1042-T1045 WeakPolarHBondContact O-CB 3.42Å; A1042-T1045 PolarHBondContact O-N 3.35Å; A1042-I1046 PolarHBondContact O-N 3.14Å
1043	P	84.4	Confident	88.9	Confident	30 Å²	30	60.9 Å²	60.9	20%	0.195	30%	0.297	C	S	.	.	H	α-helix	trans	-52.9	-40.8	-174.7	-26.8	35.2	0	0	0	114.2	P728 I730 L989 T1045 I1046 I1047	P728-P1043 HydrophobicContact CB-CG 4.21Å; I730-P1043 HydrophobicContact CD1-CB 3.5Å; I730-P1043 VanDerWaalsContact CD1-CB 3.5Å; I730-P1043 HydrophobicContact CD1-CG 4.34Å; I730-P1043 HydrophobicContact CG1-CB 3.87Å; I730-P1043 HydrophobicContact CG1-CG 4.34Å; L989-P1043 HydrophobicContact CD1-CB 3.7Å; P1043-T1045 VanDerWaalsContact C-N 3.3Å; P1043-T1045 PolarHBondContact O-N 2.72Å; P1043-I1046 WeakPolarHBondContact O-CB 3.47Å; P1043-I1046 PolarHBondContact O-N 2.81Å; P1043-I1046 VanDerWaalsContact O-N 3.12Å; P1043-I1047 WeakPolarHBondContact O-CG1 3.3Å; P1043-I1047 PolarHBondContact O-N 3.43Å
1044	E	83.4	Confident	88.8	Confident	98 Å²	98	62.7 Å²	62.7	46%	0.458	30%	0.3	S	S	.	.	H	α-helix	trans	-65.2	-37.2	179.6	-49.9	68.1	-144.3	0	0	110.7	A1042 I1047 W1048	A1042-E1044 VanDerWaalsContact C-N 3.27Å; A1042-E1044 WeakPolarHBondContact CB-OE2 3.35Å; A1042-E1044 PolarHBondContact O-N 3.08Å; E1044-I1047 PolarHBondContact O-N 2.95Å; E1044-W1048 WeakPolarHBondContact O-CB 3.32Å; E1044-W1048 PolarHBondContact O-N 3.22Å
1045	T	88.7	Confident	88.8	Confident	54 Å²	54	63.7 Å²	63.7	33%	0.331	29%	0.294	S	S	.	.	H	α-helix	trans	-69.2	-35.2	174.9	-56.8	0	0	0	0	111.3	Y1041 A1042 P1043 Q1049	Y1041-T1045 HydrophobicContact CD1-CG2 3.69Å; Y1041-T1045 HydrophobicContact CG-CG2 4.26Å; A1042-T1045 WeakPolarHBondContact O-CA 3.47Å; A1042-T1045 VanDerWaalsContact O-CB 3.31Å; A1042-T1045 WeakPolarHBondContact O-CB 3.42Å; A1042-T1045 PolarHBondContact O-N 3.35Å; P1043-T1045 VanDerWaalsContact C-N 3.3Å; P1043-T1045 PolarHBondContact O-N 2.72Å; T1045-Q1049 HydrophobicContact CG2-CG 4.34Å; T1045-Q1049 VanDerWaalsContact CG2-NE2 3.34Å; T1045-Q1049 VanDerWaalsContact O-CB 3.29Å; T1045-Q1049 WeakPolarHBondContact O-CB 3.25Å; T1045-Q1049 VanDerWaalsContact O-CG 3.29Å; T1045-Q1049 WeakPolarHBondContact O-CG 3.43Å; T1045-Q1049 PolarHBondContact O-N 3.49Å
1046	I	90.5	Very high	88.6	Confident	16 Å²	16	61.9 Å²	61.9	8%	0.082	29%	0.285	C	S	.	.	H	α-helix	trans	-68.3	-45.4	173.8	-56.9	177.2	0	0	0	110.2	L989 M997 F1038 A1042 P1043 W1048 Q1049 V1050	L989-I1046 HydrophobicContact CB-CB 4.44Å; L989-I1046 HydrophobicContact CB-CG2 3.8Å; L989-I1046 HydrophobicContact CD1-CB 4.38Å; M997-I1046 HydrophobicContact CE-CG2 4.38Å; F1038-I1046 HydrophobicContact CB-CD1 3.83Å; F1038-I1046 HydrophobicContact CB-CG1 3.85Å; F1038-I1046 HydrophobicContact CB-CG2 4.48Å; F1038-I1046 HydrophobicContact CD2-CG2 4.26Å; F1038-I1046 HydrophobicContact CG-CG1 4.44Å; F1038-I1046 HydrophobicContact CG-CG2 4.43Å; A1042-I1046 PolarHBondContact O-N 3.14Å; P1043-I1046 WeakPolarHBondContact O-CB 3.47Å; P1043-I1046 PolarHBondContact O-N 2.81Å; P1043-I1046 VanDerWaalsContact O-N 3.12Å; I1046-W1048 VanDerWaalsContact C-N 3.33Å; I1046-W1048 PolarHBondContact O-N 3.17Å; I1046-Q1049 PolarHBondContact O-N 3.4Å; I1046-V1050 HydrophobicContact CG2-CG2 4.01Å; I1046-V1050 WeakPolarHBondContact O-CB 3.4Å; I1046-V1050 WeakPolarHBondContact O-CG2 3.33Å; I1046-V1050 PolarHBondContact O-N 3.01Å
1047	I	87.8	Confident	88.4	Confident	14 Å²	14	64.7 Å²	64.7	7%	0.072	31%	0.312	C	S	.	.	H	α-helix	trans	-56.2	-48	175.6	-68.1	161.2	0	0	0	110.4	I730 L989 M997 L1001 P1043 E1044 G1051	I730-I1047 HydrophobicContact CD1-CD1 4.32Å; I730-I1047 HydrophobicContact CG2-CD1 4.3Å; L989-I1047 HydrophobicContact CD1-CD1 4.27Å; L989-I1047 HydrophobicContact CD1-CG1 4.04Å; L989-I1047 HydrophobicContact CD2-CG1 4.11Å; M997-I1047 HydrophobicContact CG-CG2 4.33Å; M997-I1047 HydrophobicContact SD-CB 4.1Å; M997-I1047 HydrophobicContact SD-CG1 3.7Å; M997-I1047 HydrophobicContact SD-CG2 4.28Å; L1001-I1047 HydrophobicContact CD1-CG2 4.46Å; L1001-I1047 HydrophobicContact CD2-CG2 4.4Å; P1043-I1047 WeakPolarHBondContact O-CG1 3.3Å; P1043-I1047 PolarHBondContact O-N 3.43Å; E1044-I1047 PolarHBondContact O-N 2.95Å; I1047-G1051 WeakPolarHBondContact O-CA 3.39Å; I1047-G1051 PolarHBondContact O-N 3.16Å
1048	W	87.9	Confident	88.3	Confident	150 Å²	150	65 Å²	65	57%	0.568	31%	0.313	S	S	*	.	H	α-helix	trans	-66.4	-47.9	178.3	-173	97.2	0	0	0	112.6	E1044 I1046 G1051 R1052 I1054	E1044-W1048 WeakPolarHBondContact O-CB 3.32Å; E1044-W1048 PolarHBondContact O-N 3.22Å; I1046-W1048 VanDerWaalsContact C-N 3.33Å; I1046-W1048 PolarHBondContact O-N 3.17Å; W1048-G1051 PolarHBondContact O-N 2.91Å; W1048-R1052 HydrophobicContact CD2-CG 4.09Å; W1048-R1052 HydrophobicContact CE3-CG 4.39Å; W1048-R1052 HydrophobicContact CH2-CG 4.47Å; W1048-R1052 HydrophobicContact CZ2-CG 4.17Å; W1048-R1052 VanDerWaalsContact O-CB 3.32Å; W1048-R1052 WeakPolarHBondContact O-CB 3.44Å; W1048-R1052 VanDerWaalsContact O-CG 3.25Å; W1048-R1052 WeakPolarHBondContact O-CG 3.17Å; W1048-R1052 PolarHBondContact O-N 3.21Å; W1048-I1054 HydrophobicContact CE3-CD1 4.32Å; W1048-I1054 HydrophobicContact CH2-CD1 4.27Å; W1048-I1054 HydrophobicContact CZ3-CD1 3.58Å
1049	Q	91.8	Very high	88	Confident	27 Å²	27	71 Å²	71	13%	0.126	35%	0.346	C	S	.	.	H	α-helix	trans	-63.8	-52.5	-178.3	-77.2	-173.9	31.6	0	0	111.8	F1038 T1045 I1046 G1051 R1052 G1053 I1054	F1038-Q1049 HydrophobicContact CE1-CB 4.38Å; F1038-Q1049 VanDerWaalsContact CE1-OE1 3.31Å; T1045-Q1049 HydrophobicContact CG2-CG 4.34Å; T1045-Q1049 VanDerWaalsContact CG2-NE2 3.34Å; T1045-Q1049 VanDerWaalsContact O-CB 3.29Å; T1045-Q1049 WeakPolarHBondContact O-CB 3.25Å; T1045-Q1049 VanDerWaalsContact O-CG 3.29Å; T1045-Q1049 WeakPolarHBondContact O-CG 3.43Å; T1045-Q1049 PolarHBondContact O-N 3.49Å; I1046-Q1049 PolarHBondContact O-N 3.4Å; Q1049-G1051 PolarHBondContact O-N 2.66Å; Q1049-R1052 CarbonylContact O-C 3.52Å; Q1049-R1052 PolarHBondContact O-N 2.79Å; Q1049-G1053 PolarHBondContact O-N 3.11Å; Q1049-I1054 HydrophobicContact CB-CB 4.01Å; Q1049-I1054 HydrophobicContact CB-CG2 4.3Å; Q1049-I1054 HydrophobicContact CG-CB 4.37Å; Q1049-I1054 HydrophobicContact CG-CD1 4.2Å; Q1049-I1054 HydrophobicContact CG-CG2 4.31Å; Q1049-I1054 WeakPolarHBondContact O-CB 3.35Å; Q1049-I1054 PolarHBondContact O-N 3.13Å
1050	V	91.8	Very high	87.8	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-65.2	-41.1	178.5	176.7	0	0	0	0	110.5	L992 P994 M997 F1038 I1046 R1052 G1053	L992-V1050 WeakPolarHBondContact O-CG1 3.46Å; P994-V1050 WeakPolarHBondContact CB-O 3.45Å; P994-V1050 HydrophobicContact CG-CG1 4.14Å; M997-V1050 HydrophobicContact CB-CG1 4.16Å; M997-V1050 HydrophobicContact CE-CB 3.83Å; M997-V1050 HydrophobicContact CE-CG1 3.87Å; M997-V1050 HydrophobicContact CE-CG2 4.23Å; M997-V1050 HydrophobicContact CG-CB 4.23Å; M997-V1050 HydrophobicContact CG-CG1 4.18Å; F1038-V1050 HydrophobicContact CD2-CG2 4.37Å; F1038-V1050 HydrophobicContact CE2-CG2 3.61Å; F1038-V1050 HydrophobicContact CZ-CG2 3.87Å; I1046-V1050 HydrophobicContact CG2-CG2 4.01Å; I1046-V1050 WeakPolarHBondContact O-CB 3.4Å; I1046-V1050 WeakPolarHBondContact O-CG2 3.33Å; I1046-V1050 PolarHBondContact O-N 3.01Å; V1050-R1052 VanDerWaalsContact C-N 3.27Å; V1050-R1052 PolarHBondContact O-N 3.11Å; V1050-G1053 PolarHBondContact O-N 3.12Å
1051	G	89.4	Confident	87.8	Confident	13 Å²	13	63.1 Å²	63.1	13%	0.134	33%	0.326	C	S	.	.	H	α-helix	trans	-59.9	-32.5	173.7	0	0	0	0	0	113.8	R998 I1047 W1048 Q1049	R998-G1051 VanDerWaalsContact CZ-O 3.27Å; R998-G1051 PolarHBondContact NE-O 3.18Å; R998-G1051 PolarHBondContact NH2-O 3.12Å; I1047-G1051 WeakPolarHBondContact O-CA 3.39Å; I1047-G1051 PolarHBondContact O-N 3.16Å; W1048-G1051 PolarHBondContact O-N 2.91Å; Q1049-G1051 PolarHBondContact O-N 2.66Å
1052	R	89.5	Confident	87.8	Confident	177 Å²	177	66.7 Å²	66.7	67%	0.668	35%	0.348	S	S	*	.	H	α-helix	trans	-86.1	-6.1	172.1	-68.4	-69.4	-178.3	172.4	-0.4	114.1	W1048 Q1049 V1050 I1054	W1048-R1052 HydrophobicContact CD2-CG 4.09Å; W1048-R1052 HydrophobicContact CE3-CG 4.39Å; W1048-R1052 HydrophobicContact CH2-CG 4.47Å; W1048-R1052 HydrophobicContact CZ2-CG 4.17Å; W1048-R1052 VanDerWaalsContact O-CB 3.32Å; W1048-R1052 WeakPolarHBondContact O-CB 3.44Å; W1048-R1052 VanDerWaalsContact O-CG 3.25Å; W1048-R1052 WeakPolarHBondContact O-CG 3.17Å; W1048-R1052 PolarHBondContact O-N 3.21Å; Q1049-R1052 CarbonylContact O-C 3.52Å; Q1049-R1052 PolarHBondContact O-N 2.79Å; V1050-R1052 VanDerWaalsContact C-N 3.27Å; V1050-R1052 PolarHBondContact O-N 3.11Å; R1052-I1054 HydrophobicContact CB-CD1 4.4Å; R1052-I1054 HydrophobicContact CB-CG1 4.45Å
1053	G	89.2	Confident	87.8	Confident	21 Å²	21	66.1 Å²	66.1	22%	0.216	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	10.8	178.7	0	0	0	0	0	115.6	Q1049 V1050 F1077	Q1049-G1053 PolarHBondContact O-N 3.11Å; V1050-G1053 PolarHBondContact O-N 3.12Å; G1053-F1077 VanDerWaalsContact CA-CD2 3.41Å
1054	I	90.8	Very high	88	Confident	74 Å²	74	67.4 Å²	67.4	38%	0.379	35%	0.347	S	S	.	.			trans	-72	131.1	176	-61.8	170	0	0	0	108.1	W1048 Q1049 R1052	W1048-I1054 HydrophobicContact CE3-CD1 4.32Å; W1048-I1054 HydrophobicContact CH2-CD1 4.27Å; W1048-I1054 HydrophobicContact CZ3-CD1 3.58Å; Q1049-I1054 HydrophobicContact CB-CB 4.01Å; Q1049-I1054 HydrophobicContact CB-CG2 4.3Å; Q1049-I1054 HydrophobicContact CG-CB 4.37Å; Q1049-I1054 HydrophobicContact CG-CD1 4.2Å; Q1049-I1054 HydrophobicContact CG-CG2 4.31Å; Q1049-I1054 WeakPolarHBondContact O-CB 3.35Å; Q1049-I1054 PolarHBondContact O-N 3.13Å; R1052-I1054 HydrophobicContact CB-CD1 4.4Å; R1052-I1054 HydrophobicContact CB-CG1 4.45Å
1055	K	91.2	Very high	88.3	Confident	59 Å²	59	69 Å²	69	26%	0.257	35%	0.353	S	S	.	.			trans	-110.9	155.7	-176.4	-50	-173.7	-165.2	-167.7	0	110.9	M1072 W1075	K1055-M1072 HydrophobicContact CD-CE 4.05Å; K1055-M1072 HydrophobicContact CD-SD 3.97Å; K1055-M1072 PolarHBondContact NZ-O 3.23Å; K1055-W1075 HydrophobicContact CB-CE3 4.45Å; K1055-W1075 HydrophobicContact CD-CB 3.96Å; K1055-W1075 WeakPolarHBondContact CE-O 3.22Å; K1055-W1075 PolarHBondContact NZ-O 3.4Å
1056	P	88	Confident	88.3	Confident	18 Å²	18	70.8 Å²	70.8	12%	0.117	36%	0.357	C	S	.	.			trans	-58	137.5	169.3	-22.4	34.2	0	0	0	112.1	F1029 P1037 F1038 L1058 W1075	F1029-P1056 HydrophobicContact CE2-CB 4.41Å; P1037-P1056 HydrophobicContact CB-CB 4.21Å; P1037-P1056 HydrophobicContact CB-CG 3.51Å; F1038-P1056 HydrophobicContact CD2-CG 4.04Å; F1038-P1056 HydrophobicContact CE1-CG 4.13Å; F1038-P1056 HydrophobicContact CE2-CG 3.62Å; F1038-P1056 HydrophobicContact CG-CG 4.48Å; F1038-P1056 VanDerWaalsContact CZ-CD 3.45Å; F1038-P1056 HydrophobicContact CZ-CG 3.68Å; P1056-L1058 PolarHBondContact O-N 3.45Å; P1056-W1075 HydrophobicContact CB-CH2 4.09Å; P1056-W1075 HydrophobicContact CB-CZ3 4.09Å; P1056-W1075 HydrophobicContact CG-CH2 3.61Å; P1056-W1075 HydrophobicContact CG-CZ2 4.34Å; P1056-W1075 HydrophobicContact CG-CZ3 3.8Å
1057	A	85.7	Confident	88.3	Confident	77 Å²	77	70 Å²	70	64%	0.636	35%	0.354	S	S	*	.			trans	-72.3	121	177.5	0	0	0	0	0	111.5	N1059	A1057-N1059 VanDerWaalsContact C-N 3.35Å
1058	L	89.8	Confident	88.6	Confident	11 Å²	11	71.6 Å²	71.6	6%	0.058	36%	0.36	C	S	.	.			trans	-88.5	2.1	-177.3	-55.4	-175.9	0	0	0	114	F1029 P1056 N1060 L1061 K1068 C1071 M1072 W1075	F1029-L1058 HydrophobicContact CD2-CD2 3.65Å; F1029-L1058 HydrophobicContact CE2-CD2 3.66Å; P1056-L1058 PolarHBondContact O-N 3.45Å; L1058-N1060 VanDerWaalsContact C-N 3.26Å; L1058-N1060 PolarHBondContact O-N 3.13Å; L1058-L1061 HydrophobicContact CD2-CD1 4.04Å; L1058-L1061 PolarHBondContact O-N 3.13Å; L1058-K1068 HydrophobicContact CB-CD 4.16Å; L1058-K1068 HydrophobicContact CB-CG 4.48Å; L1058-K1068 HydrophobicContact CD1-CB 3.91Å; L1058-K1068 WeakPolarHBondContact O-CE 3.19Å; L1058-K1068 PolarHBondContact O-NZ 3.21Å; L1058-C1071 HydrophobicContact CD1-CB 3.69Å; L1058-M1072 HydrophobicContact CD1-CG 3.7Å; L1058-M1072 HydrophobicContact CD1-SD 3.89Å; L1058-M1072 HydrophobicContact CG-SD 4.44Å; L1058-W1075 HydrophobicContact CD2-CZ3 4Å
1059	N	83.4	Confident	88.8	Confident	140 Å²	140	68.9 Å²	68.9	75%	0.749	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-37.4	-175.8	-64.3	28.1	0	0	0	111.7	A1057 L1061	A1057-N1059 VanDerWaalsContact C-N 3.35Å; N1059-L1061 VanDerWaalsContact C-N 3.26Å; N1059-L1061 PolarHBondContact O-N 3.08Å
1060	N	82.1	Confident	89	Confident	150 Å²	150	67.9 Å²	67.9	80%	0.802	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-10	-176.6	-61.7	-8.3	0	0	0	114.1	L1058	L1058-N1060 VanDerWaalsContact C-N 3.26Å; L1058-N1060 PolarHBondContact O-N 3.13Å
1061	L	86	Confident	89.1	Confident	23 Å²	23	67.9 Å²	67.9	12%	0.12	35%	0.349	C	S	.	.			trans	-84.3	121.4	177.8	-59.4	-179.2	0	0	0	110.8	F1029 L1032 A1033 L1058 N1059 V1063 K1068	F1029-L1061 HydrophobicContact CD2-CD1 4.16Å; F1029-L1061 HydrophobicContact CE2-CD1 3.99Å; L1032-L1061 HydrophobicContact CB-CD1 4.33Å; A1033-L1061 HydrophobicContact CB-CD2 3.79Å; L1058-L1061 HydrophobicContact CD2-CD1 4.04Å; L1058-L1061 PolarHBondContact O-N 3.13Å; N1059-L1061 VanDerWaalsContact C-N 3.26Å; N1059-L1061 PolarHBondContact O-N 3.08Å; L1061-V1063 VanDerWaalsContact C-N 3.3Å; L1061-V1063 HydrophobicContact CB-CG2 3.82Å; L1061-V1063 PolarHBondContact O-N 3.47Å; L1061-V1063 VanDerWaalsContact O-N 3.08Å; L1061-K1068 WeakPolarHBondContact O-CE 3.35Å; L1061-K1068 PolarHBondContact O-NZ 3.41Å
1062	Q	86	Confident	89.4	Confident	200 Å²	200	71.4 Å²	71.4	94%	0.935	36%	0.363	S	S	*	.			trans	-86.1	69.8	176.4	-65.3	-177.7	-3.4	0	0	110.5
1063	V	86.1	Confident	89.7	Confident	37 Å²	37	65 Å²	65	22%	0.224	35%	0.345	C	S	.	.	S	Bend	trans	-138.8	156	-174.6	-60	0	0	0	0	110.8	L1032 L1061 T1067 K1068	L1032-V1063 HydrophobicContact CD1-CG2 4.48Å; L1032-V1063 HydrophobicContact CD2-CG1 4.22Å; L1061-V1063 VanDerWaalsContact C-N 3.3Å; L1061-V1063 HydrophobicContact CB-CG2 3.82Å; L1061-V1063 PolarHBondContact O-N 3.47Å; L1061-V1063 VanDerWaalsContact O-N 3.08Å; V1063-T1067 WeakPolarHBondContact CB-OG1 3.38Å; V1063-T1067 VanDerWaalsContact CG2-OG1 3.27Å; V1063-T1067 WeakPolarHBondContact CG2-OG1 3.47Å; V1063-K1068 HydrophobicContact CG2-CD 4.36Å; V1063-K1068 HydrophobicContact CG2-CG 3.79Å; V1063-K1068 WeakPolarHBondContact O-CE 3.36Å
1064	P	88.5	Confident	90.1	Very high	56 Å²	56	64 Å²	64	36%	0.364	34%	0.335	S	S	.	.			trans	-56.1	152.8	-179.2	-24.3	34.3	0	0	0	113.4	L917 E1066 T1067	L917-P1064 HydrophobicContact CD2-CG 4.06Å; P1064-E1066 WeakPolarHBondContact CB-OE2 3.42Å; P1064-E1066 PolarHBondContact O-N 3.24Å; P1064-T1067 HydrophobicContact CB-CG2 4.33Å; P1064-T1067 HydrophobicContact CG-CG2 4.43Å; P1064-T1067 PolarHBondContact O-N 2.8Å; P1064-T1067 VanDerWaalsContact O-N 3.16Å; P1064-T1067 PolarHBondContact O-OG1 3.37Å
1065	K	89.3	Confident	90.4	Very high	133 Å²	133	60.6 Å²	60.6	58%	0.578	32%	0.317	S	S	*	.	H	α-helix	trans	-59.6	-39	-174.4	174.4	173.1	168.2	-70.6	0	111.7	T1067 K1068 E1069	K1065-T1067 VanDerWaalsContact C-N 3.28Å; K1065-T1067 PolarHBondContact O-N 3.1Å; K1065-K1068 WeakPolarHBondContact O-CB 3.49Å; K1065-K1068 PolarHBondContact O-N 2.85Å; K1065-K1068 VanDerWaalsContact O-N 3.1Å; K1065-E1069 VanDerWaalsContact CE-OE1 3.31Å; K1065-E1069 WeakPolarHBondContact CE-OE1 3.46Å; K1065-E1069 IonicContact NZ-OE1 2.62Å; K1065-E1069 PolarHBondContact NZ-OE1 3.47Å; K1065-E1069 IonicContact NZ-OE2 3.77Å; K1065-E1069 WeakPolarHBondContact O-CG 3.36Å; K1065-E1069 PolarHBondContact O-N 2.84Å
1066	E	88.9	Confident	90.6	Very high	90 Å²	90	58.2 Å²	58.2	42%	0.421	31%	0.308	S	S	.	.	H	α-helix	trans	-61.7	-35.9	-178.5	-53.6	66	-139.3	0	0	110.9	P1064 E1069 I1070 L1095	P1064-E1066 WeakPolarHBondContact CB-OE2 3.42Å; P1064-E1066 PolarHBondContact O-N 3.24Å; E1066-E1069 PolarHBondContact O-N 2.88Å; E1066-I1070 WeakPolarHBondContact O-CG1 3.29Å; E1066-I1070 PolarHBondContact O-N 3.36Å; E1066-L1095 HydrophobicContact CB-CD2 3.75Å
1067	T	91.4	Very high	91	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-73.5	-29.8	178.6	70.4	0	0	0	0	112.2	L917 W1028 V1063 P1064 K1065 L1095	L917-T1067 HydrophobicContact CD1-CG2 4.1Å; L917-T1067 HydrophobicContact CD2-CG2 4.12Å; W1028-T1067 HydrophobicContact CZ2-CG2 4.13Å; W1028-T1067 PolarHBondContact NE1-O 3.11Å; V1063-T1067 WeakPolarHBondContact CB-OG1 3.38Å; V1063-T1067 VanDerWaalsContact CG2-OG1 3.27Å; V1063-T1067 WeakPolarHBondContact CG2-OG1 3.47Å; P1064-T1067 HydrophobicContact CB-CG2 4.33Å; P1064-T1067 HydrophobicContact CG-CG2 4.43Å; P1064-T1067 PolarHBondContact O-N 2.8Å; P1064-T1067 VanDerWaalsContact O-N 3.16Å; P1064-T1067 PolarHBondContact O-OG1 3.37Å; K1065-T1067 VanDerWaalsContact C-N 3.28Å; K1065-T1067 PolarHBondContact O-N 3.1Å; T1067-L1095 HydrophobicContact CG2-CD1 4.23Å; T1067-L1095 HydrophobicContact CG2-CD2 4.32Å
1068	K	93	Very high	91.4	Very high	48 Å²	48	66.5 Å²	66.5	21%	0.209	32%	0.324	C	S	.	.	H	α-helix	trans	-73.4	-35.3	173.3	-55.6	-172.4	-176.8	-163.9	0	111.9	L1058 L1061 V1063 K1065 I1070 C1071 M1072	L1058-K1068 HydrophobicContact CB-CD 4.16Å; L1058-K1068 HydrophobicContact CB-CG 4.48Å; L1058-K1068 HydrophobicContact CD1-CB 3.91Å; L1058-K1068 WeakPolarHBondContact O-CE 3.19Å; L1058-K1068 PolarHBondContact O-NZ 3.21Å; L1061-K1068 WeakPolarHBondContact O-CE 3.35Å; L1061-K1068 PolarHBondContact O-NZ 3.41Å; V1063-K1068 HydrophobicContact CG2-CD 4.36Å; V1063-K1068 HydrophobicContact CG2-CG 3.79Å; V1063-K1068 WeakPolarHBondContact O-CE 3.36Å; K1065-K1068 WeakPolarHBondContact O-CB 3.49Å; K1065-K1068 PolarHBondContact O-N 2.85Å; K1065-K1068 VanDerWaalsContact O-N 3.1Å; K1068-I1070 VanDerWaalsContact C-N 3.28Å; K1068-I1070 PolarHBondContact O-N 3.02Å; K1068-C1071 WeakPolarHBondContact O-CB 3.34Å; K1068-C1071 PolarHBondContact O-N 3.42Å; K1068-M1072 WeakPolarHBondContact O-CG 3.26Å; K1068-M1072 PolarHBondContact O-N 2.93Å
1069	E	93.4	Very high	91.5	Very high	93 Å²	93	69 Å²	69	44%	0.435	34%	0.337	S	S	.	.	H	α-helix	trans	-64.2	-32.6	176.8	-73.2	171.5	164.2	0	0	112.2	K1065 E1066 M1072 S1073	K1065-E1069 VanDerWaalsContact CE-OE1 3.31Å; K1065-E1069 WeakPolarHBondContact CE-OE1 3.46Å; K1065-E1069 IonicContact NZ-OE1 2.62Å; K1065-E1069 PolarHBondContact NZ-OE1 3.47Å; K1065-E1069 IonicContact NZ-OE2 3.77Å; K1065-E1069 WeakPolarHBondContact O-CG 3.36Å; K1065-E1069 PolarHBondContact O-N 2.84Å; E1066-E1069 PolarHBondContact O-N 2.88Å; E1069-M1072 PolarHBondContact O-N 2.91Å; E1069-S1073 WeakPolarHBondContact O-CB 3.46Å; E1069-S1073 PolarHBondContact O-N 3.32Å; E1069-S1073 PolarHBondContact O-OG 3.43Å
1070	I	95.3	Very high	91.9	Very high	6 Å²	6	66 Å²	66	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-62.2	-49	169.9	-62.4	168.2	0	0	0	111.1	W1028 E1066 K1068 M1072 S1073 C1074 L1088 V1091 F1092 L1095	W1028-I1070 VanDerWaalsContact CD1-CG2 3.5Å; W1028-I1070 HydrophobicContact CG-CG2 4.23Å; W1028-I1070 HydrophobicContact CZ2-CD1 4.4Å; E1066-I1070 WeakPolarHBondContact O-CG1 3.29Å; E1066-I1070 PolarHBondContact O-N 3.36Å; K1068-I1070 VanDerWaalsContact C-N 3.28Å; K1068-I1070 PolarHBondContact O-N 3.02Å; I1070-M1072 VanDerWaalsContact C-N 3.32Å; I1070-M1072 PolarHBondContact O-N 3.1Å; I1070-S1073 PolarHBondContact O-N 2.96Å; I1070-S1073 PolarHBondContact O-OG 3.3Å; I1070-S1073 VanDerWaalsContact O-OG 3.13Å; I1070-C1074 WeakPolarHBondContact O-CB 3.41Å; I1070-C1074 PolarHBondContact O-N 2.94Å; I1070-C1074 PolarHBondContact O-SG 3.45Å; I1070-L1088 HydrophobicContact CG2-CD2 4.01Å; I1070-V1091 HydrophobicContact CD1-CG1 3.78Å; I1070-V1091 HydrophobicContact CG1-CG1 3.94Å; I1070-F1092 HydrophobicContact CD1-CD1 4.3Å; I1070-F1092 HydrophobicContact CD1-CE1 3.81Å; I1070-F1092 HydrophobicContact CD1-CZ 4.14Å; I1070-F1092 HydrophobicContact CG2-CZ 3.94Å; I1070-L1095 HydrophobicContact CD1-CD1 3.82Å
1071	C	94.6	Very high	92.6	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-56.7	-46.1	173.9	-72.4	0	0	0	0	111.6	L1058 K1068 S1073 W1075	L1058-C1071 HydrophobicContact CD1-CB 3.69Å; K1068-C1071 WeakPolarHBondContact O-CB 3.34Å; K1068-C1071 PolarHBondContact O-N 3.42Å; C1071-S1073 PolarHBondContact O-N 3.45Å; C1071-W1075 HydrophobicContact CB-CE3 4.3Å; C1071-W1075 HydrophobicContact CB-CZ3 4.36Å; C1071-W1075 WeakPolarHBondContact O-CB 3.4Å; C1071-W1075 PolarHBondContact O-N 3.06Å
1072	M	94.6	Very high	93.1	Very high	87 Å²	87	62.9 Å²	62.9	43%	0.429	32%	0.321	S	S	.	.	H	α-helix	trans	-68.5	-32.6	-174.6	-70.3	-62	-75.6	0	0	113.8	K1055 L1058 K1068 E1069 I1070	K1055-M1072 HydrophobicContact CD-CE 4.05Å; K1055-M1072 HydrophobicContact CD-SD 3.97Å; K1055-M1072 PolarHBondContact NZ-O 3.23Å; L1058-M1072 HydrophobicContact CD1-CG 3.7Å; L1058-M1072 HydrophobicContact CD1-SD 3.89Å; L1058-M1072 HydrophobicContact CG-SD 4.44Å; K1068-M1072 WeakPolarHBondContact O-CG 3.26Å; K1068-M1072 PolarHBondContact O-N 2.93Å; E1069-M1072 PolarHBondContact O-N 2.91Å; I1070-M1072 VanDerWaalsContact C-N 3.32Å; I1070-M1072 PolarHBondContact O-N 3.1Å
1073	S	96.2	Very high	93.7	Very high	41 Å²	41	54.6 Å²	54.6	29%	0.287	28%	0.284	S	S	.	.	H	α-helix	trans	-80.5	-42.1	176.6	53.4	0	0	0	0	112.5	E1069 I1070 C1071 W1075 A1076	E1069-S1073 WeakPolarHBondContact O-CB 3.46Å; E1069-S1073 PolarHBondContact O-N 3.32Å; E1069-S1073 PolarHBondContact O-OG 3.43Å; I1070-S1073 PolarHBondContact O-N 2.96Å; I1070-S1073 PolarHBondContact O-OG 3.3Å; I1070-S1073 VanDerWaalsContact O-OG 3.13Å; C1071-S1073 PolarHBondContact O-N 3.45Å; S1073-W1075 VanDerWaalsContact C-N 3.28Å; S1073-W1075 PolarHBondContact O-N 2.94Å; S1073-A1076 VanDerWaalsContact O-CB 3.28Å; S1073-A1076 WeakPolarHBondContact O-CB 3.05Å; S1073-A1076 PolarHBondContact O-N 3.36Å; S1073-A1076 VanDerWaalsContact O-N 3.1Å
1074	C	97.6	Very high	94.2	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-58.9	-40.4	171	-68.8	0	0	0	0	111.9	V1021 Y1022 G1025 I1070 A1076 R1082	V1021-C1074 HydrophobicContact CG1-CB 4.22Å; Y1022-C1074 WeakPolarHBondContact CA-O 3.41Å; G1025-C1074 VanDerWaalsContact CA-CB 3.46Å; I1070-C1074 WeakPolarHBondContact O-CB 3.41Å; I1070-C1074 PolarHBondContact O-N 2.94Å; I1070-C1074 PolarHBondContact O-SG 3.45Å; C1074-A1076 PolarHBondContact O-N 2.91Å; C1074-R1082 VanDerWaalsContact O-CD 3.32Å; C1074-R1082 WeakPolarHBondContact O-CD 3.45Å
1075	W	97	Very high	94.6	Very high	3 Å²	3	53 Å²	53	1%	0.011	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	23.7	175.3	-66.7	-29	0	0	0	114.3	Y1022 T1026 F1029 P1037 K1055 P1056 L1058 C1071 S1073	Y1022-W1075 AromaticContact CD1-CD1 3.96Å; Y1022-W1075 HydrophobicContact CD2-CB 4.2Å; Y1022-W1075 AromaticContact CD2-CD1 3.72Å; Y1022-W1075 HydrophobicContact CD2-CG 4.33Å; Y1022-W1075 AromaticContact CE1-CD1 3.8Å; Y1022-W1075 HydrophobicContact CE2-CB 3.81Å; Y1022-W1075 AromaticContact CE2-CD1 3.53Å; Y1022-W1075 AromaticContact CE2-CG 3.92Å; Y1022-W1075 HydrophobicContact CE2-CG 3.92Å; Y1022-W1075 AromaticContact CG-CD1 3.92Å; Y1022-W1075 AromaticContact CZ-CD1 3.58Å; T1026-W1075 PolarHBondContact OG1-NE1 2.98Å; F1029-W1075 HydrophobicContact CB-CH2 3.64Å; F1029-W1075 HydrophobicContact CB-CZ2 3.72Å; F1029-W1075 HydrophobicContact CD1-CH2 4.44Å; F1029-W1075 AromaticContact CD2-CH2 3.48Å; F1029-W1075 HydrophobicContact CD2-CH2 3.48Å; F1029-W1075 VanDerWaalsContact CD2-CH2 3.48Å; F1029-W1075 HydrophobicContact CD2-CZ2 4.4Å; F1029-W1075 HydrophobicContact CD2-CZ3 4.14Å; F1029-W1075 HydrophobicContact CE2-CH2 4.25Å; F1029-W1075 AromaticContact CG-CH2 3.59Å; F1029-W1075 HydrophobicContact CG-CH2 3.59Å; F1029-W1075 HydrophobicContact CG-CZ2 4.08Å; P1037-W1075 HydrophobicContact CB-CH2 4.26Å; P1037-W1075 HydrophobicContact CB-CZ2 4.36Å; P1037-W1075 HydrophobicContact CG-CH2 4.44Å; P1037-W1075 HydrophobicContact CG-CZ2 4.11Å; K1055-W1075 HydrophobicContact CB-CE3 4.45Å; K1055-W1075 HydrophobicContact CD-CB 3.96Å; K1055-W1075 WeakPolarHBondContact CE-O 3.22Å; K1055-W1075 PolarHBondContact NZ-O 3.4Å; P1056-W1075 HydrophobicContact CB-CH2 4.09Å; P1056-W1075 HydrophobicContact CB-CZ3 4.09Å; P1056-W1075 HydrophobicContact CG-CH2 3.61Å; P1056-W1075 HydrophobicContact CG-CZ2 4.34Å; P1056-W1075 HydrophobicContact CG-CZ3 3.8Å; L1058-W1075 HydrophobicContact CD2-CZ3 4Å; C1071-W1075 HydrophobicContact CB-CE3 4.3Å; C1071-W1075 HydrophobicContact CB-CZ3 4.36Å; C1071-W1075 WeakPolarHBondContact O-CB 3.4Å; C1071-W1075 PolarHBondContact O-N 3.06Å; S1073-W1075 VanDerWaalsContact C-N 3.28Å; S1073-W1075 PolarHBondContact O-N 2.94Å
1076	A	96.7	Very high	94.9	Very high	9 Å²	9	51 Å²	51	7%	0.074	27%	0.271	C	S	.	.			trans	-64.7	146.6	-179.9	0	0	0	0	0	112.6	S1073 C1074 D1081 R1082	S1073-A1076 VanDerWaalsContact O-CB 3.28Å; S1073-A1076 WeakPolarHBondContact O-CB 3.05Å; S1073-A1076 PolarHBondContact O-N 3.36Å; S1073-A1076 VanDerWaalsContact O-N 3.1Å; C1074-A1076 PolarHBondContact O-N 2.91Å; A1076-D1081 HydrophobicContact CB-CB 3.43Å; A1076-D1081 VanDerWaalsContact CB-CB 3.43Å; A1076-R1082 HydrophobicContact CB-CG 3.83Å; A1076-R1082 PolarHBondContact O-NE 2.78Å; A1076-R1082 PolarHBondContact O-NH2 3.1Å
1077	F	94.9	Very high	95.3	Very high	93 Å²	93	50 Å²	50	41%	0.408	27%	0.272	S	S	.	.	S	Bend	trans	-72.2	-44.1	-169.5	-178.9	-97.9	0	0	0	112.5	P994 G1053	P994-F1077 HydrophobicContact CB-CD2 4.49Å; G1053-F1077 VanDerWaalsContact CA-CD2 3.41Å
1078	R	93.9	Very high	95.6	Very high	177 Å²	177	50.1 Å²	50.1	67%	0.668	27%	0.272	S	S	*	.	S	Bend	trans	-84.9	148.9	173.3	-51.9	171.2	166.7	-177.9	-7.2	108.6	D1081	R1078-D1081 HydrophobicContact CB-CB 4.43Å; R1078-D1081 WeakPolarHBondContact CB-OD2 3.17Å; R1078-D1081 PolarHBondContact O-N 3.28Å
1079	L	92.7	Very high	95.7	Very high	62 Å²	62	49.1 Å²	49.1	33%	0.325	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-65.8	-42.1	-176.7	-71.8	71.1	0	0	0	111.6	E995 P1018 D1081 R1082	E995-L1079 HydrophobicContact CB-CD1 4.18Å; E995-L1079 HydrophobicContact CG-CD1 3.93Å; E995-L1079 HydrophobicContact CG-CD2 4.26Å; E995-L1079 HydrophobicContact CG-CG 4.27Å; P1018-L1079 HydrophobicContact CB-CB 3.91Å; P1018-L1079 HydrophobicContact CB-CG 4.24Å; P1018-L1079 HydrophobicContact CG-CB 4.18Å; L1079-D1081 VanDerWaalsContact C-N 3.27Å; L1079-D1081 PolarHBondContact O-N 3.26Å; L1079-R1082 PolarHBondContact O-N 3.14Å
1080	G	92.2	Very high	95.7	Very high	77 Å²	77	51.2 Å²	51.2	79%	0.794	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-71.3	-14.6	180	0	0	0	0	0	115.3	R1082	G1080-R1082 PolarHBondContact O-N 3.18Å
1081	D	95.7	Very high	95.6	Very high	91 Å²	91	53.6 Å²	53.6	49%	0.487	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-78	-9.9	175.1	-60.3	-9.8	0	0	0	111.8	A1076 R1078 L1079	A1076-D1081 HydrophobicContact CB-CB 3.43Å; A1076-D1081 VanDerWaalsContact CB-CB 3.43Å; R1078-D1081 HydrophobicContact CB-CB 4.43Å; R1078-D1081 WeakPolarHBondContact CB-OD2 3.17Å; R1078-D1081 PolarHBondContact O-N 3.28Å; L1079-D1081 VanDerWaalsContact C-N 3.27Å; L1079-D1081 PolarHBondContact O-N 3.26Å
1082	R	97.5	Very high	95.5	Very high	18 Å²	18	53.6 Å²	53.6	7%	0.068	29%	0.292	C	S	.	.	S	Bend	trans	-90.3	135.3	-176.5	-60	-178.7	-164	143	16.4	111.3	E995 P1018 V1021 C1074 A1076 L1079 G1080	E995-R1082 IonicContact OE1-CZ 3.58Å; E995-R1082 IonicContact OE1-NH1 2.86Å; E995-R1082 PolarHBondContact OE1-NH1 3.36Å; E995-R1082 IonicContact OE1-NH2 2.75Å; E995-R1082 PolarHBondContact OE1-NH2 3.35Å; E995-R1082 IonicContact OE2-CZ 3.43Å; E995-R1082 IonicContact OE2-NH1 3.46Å; E995-R1082 IonicContact OE2-NH2 3.52Å; E995-R1082 PolarHBondContact OE2-NH2 3.16Å; P1018-R1082 VanDerWaalsContact C-NH1 3.31Å; P1018-R1082 WeakPolarHBondContact O-CD 3.1Å; P1018-R1082 PolarHBondContact O-NH1 3.4Å; V1021-R1082 HydrophobicContact CG1-CB 4.03Å; C1074-R1082 VanDerWaalsContact O-CD 3.32Å; C1074-R1082 WeakPolarHBondContact O-CD 3.45Å; A1076-R1082 HydrophobicContact CB-CG 3.83Å; A1076-R1082 PolarHBondContact O-NE 2.78Å; A1076-R1082 PolarHBondContact O-NH2 3.1Å; L1079-R1082 PolarHBondContact O-N 3.14Å; G1080-R1082 PolarHBondContact O-N 3.18Å
1083	P	97.1	Very high	95.2	Very high	25 Å²	25	55.3 Å²	55.3	16%	0.162	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-70.5	144.9	179.9	29.7	-35.3	0	0	0	111.8	V1021 T1087 L1088	V1021-P1083 WeakPolarHBondContact CG1-O 3.11Å; V1021-P1083 WeakPolarHBondContact CG2-O 3.37Å; P1083-T1087 HydrophobicContact CB-CG2 4.03Å; P1083-L1088 HydrophobicContact CB-CD2 4.29Å; P1083-L1088 HydrophobicContact CB-CG 4.14Å; P1083-L1088 HydrophobicContact CG-CD1 4.28Å; P1083-L1088 HydrophobicContact CG-CD2 3.68Å; P1083-L1088 HydrophobicContact CG-CG 3.86Å
1084	S	97.2	Very high	94.8	Very high	58 Å²	58	61.9 Å²	61.9	41%	0.406	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-66.6	158.2	169.8	79.6	0	0	0	0	111.4	N1086 T1087 L1088	S1084-N1086 PolarHBondContact O-N 3.19Å; S1084-N1086 PolarHBondContact OG-N 3.06Å; S1084-T1087 WeakPolarHBondContact O-CA 3.47Å; S1084-T1087 VanDerWaalsContact O-CB 3.27Å; S1084-T1087 WeakPolarHBondContact O-CB 3.36Å; S1084-T1087 PolarHBondContact O-N 3.06Å; S1084-T1087 PolarHBondContact OG-N 2.69Å; S1084-T1087 PolarHBondContact OG-OG1 3.5Å; S1084-L1088 PolarHBondContact O-N 2.88Å
1085	F	97.8	Very high	94.1	Very high	3 Å²	3	62.5 Å²	62.5	1%	0.013	33%	0.325	C	S	.	.	H	α-helix	trans	-58.7	-32.6	173.5	-77.2	-69.8	0	0	0	113.1	C928 M931 H935 L944 D1020 V1021 F1024 T1087 L1088 L1089	C928-F1085 HydrophobicContact CB-CD1 4Å; M931-F1085 HydrophobicContact CB-CD1 3.81Å; M931-F1085 HydrophobicContact CB-CD2 3.62Å; M931-F1085 HydrophobicContact CB-CE1 3.79Å; M931-F1085 HydrophobicContact CB-CE2 3.62Å; M931-F1085 HydrophobicContact CB-CG 3.72Å; M931-F1085 HydrophobicContact CB-CZ 3.7Å; M931-F1085 HydrophobicContact CE-CE2 3.88Å; M931-F1085 HydrophobicContact CE-CZ 4.23Å; M931-F1085 HydrophobicContact CG-CE1 4.04Å; M931-F1085 HydrophobicContact CG-CE2 4.12Å; M931-F1085 HydrophobicContact CG-CZ 3.82Å; H935-F1085 AromaticContact CE1-CD2 3.56Å; H935-F1085 AromaticContact CE1-CE2 3.43Å; H935-F1085 VanDerWaalsContact CE1-CE2 3.43Å; H935-F1085 WeakPolarHBondContact CE1-CE2 3.49Å; H935-F1085 AromaticContact ND1-CD2 3.59Å; H935-F1085 AromaticContact ND1-CE2 3.97Å; L944-F1085 HydrophobicContact CD2-CZ 4.11Å; D1020-F1085 HydrophobicContact CB-CE2 4.09Å; D1020-F1085 HydrophobicContact CB-CZ 4.42Å; V1021-F1085 HydrophobicContact CG2-CD2 3.89Å; V1021-F1085 HydrophobicContact CG2-CE2 3.6Å; V1021-F1085 HydrophobicContact CG2-CG 4.48Å; V1021-F1085 HydrophobicContact CG2-CZ 3.96Å; F1024-F1085 HydrophobicContact CB-CE1 3.7Å; F1024-F1085 HydrophobicContact CB-CZ 3.83Å; F1024-F1085 HydrophobicContact CD1-CE1 4.04Å; F1024-F1085 HydrophobicContact CD2-CE1 4.08Å; F1024-F1085 AromaticContact CG-CE1 3.65Å; F1024-F1085 HydrophobicContact CG-CE1 3.65Å; F1024-F1085 HydrophobicContact CG-CZ 4.3Å; F1085-T1087 VanDerWaalsContact C-N 3.33Å; F1085-T1087 PolarHBondContact O-N 2.57Å; F1085-L1088 HydrophobicContact CD1-CD1 4.06Å; F1085-L1088 HydrophobicContact CE1-CD1 4.37Å; F1085-L1088 PolarHBondContact O-N 3.01Å; F1085-L1089 WeakPolarHBondContact O-CG 3.4Å; F1085-L1089 PolarHBondContact O-N 2.84Å
1086	N	95.9	Very high	92.7	Very high	89 Å²	89	67.3 Å²	67.3	48%	0.476	36%	0.357	S	S	.	.	H	α-helix	trans	-67.5	-30.8	171.2	-74.9	-41.8	0	0	0	113.4	S932 S1084 K1090	S932-N1086 PolarHBondContact OG-ND2 2.88Å; S932-N1086 VanDerWaalsContact OG-ND2 3.09Å; S932-N1086 PolarHBondContact OG-OD1 2.79Å; S1084-N1086 PolarHBondContact O-N 3.19Å; S1084-N1086 PolarHBondContact OG-N 3.06Å; N1086-K1090 WeakPolarHBondContact O-CG 3.18Å
1087	T	96.4	Very high	91.1	Very high	70 Å²	70	73.2 Å²	73.2	43%	0.429	38%	0.377	S	S	.	.	H	α-helix	trans	-71.1	-42.9	172.1	-47.5	0	0	0	0	110.2	P1083 S1084 F1085 K1090 V1091	P1083-T1087 HydrophobicContact CB-CG2 4.03Å; S1084-T1087 WeakPolarHBondContact O-CA 3.47Å; S1084-T1087 VanDerWaalsContact O-CB 3.27Å; S1084-T1087 WeakPolarHBondContact O-CB 3.36Å; S1084-T1087 PolarHBondContact O-N 3.06Å; S1084-T1087 PolarHBondContact OG-N 2.69Å; S1084-T1087 PolarHBondContact OG-OG1 3.5Å; F1085-T1087 VanDerWaalsContact C-N 3.33Å; F1085-T1087 PolarHBondContact O-N 2.57Å; T1087-K1090 PolarHBondContact O-N 3.37Å; T1087-V1091 PolarHBondContact O-N 3.03Å
1088	L	96.8	Very high	89	Confident	2 Å²	2	77.1 Å²	77.1	1%	0.01	39%	0.394	C	S	.	.	H	α-helix	trans	-63.5	-41.9	179.1	-73.1	169.1	0	0	0	112.7	V1021 F1024 I1070 P1083 S1084 F1085 K1090 V1091 F1092	V1021-L1088 HydrophobicContact CG1-CD1 4.31Å; F1024-L1088 HydrophobicContact CD1-CD1 3.84Å; F1024-L1088 HydrophobicContact CE1-CD1 3.93Å; I1070-L1088 HydrophobicContact CG2-CD2 4.01Å; P1083-L1088 HydrophobicContact CB-CD2 4.29Å; P1083-L1088 HydrophobicContact CB-CG 4.14Å; P1083-L1088 HydrophobicContact CG-CD1 4.28Å; P1083-L1088 HydrophobicContact CG-CD2 3.68Å; P1083-L1088 HydrophobicContact CG-CG 3.86Å; S1084-L1088 PolarHBondContact O-N 2.88Å; F1085-L1088 HydrophobicContact CD1-CD1 4.06Å; F1085-L1088 HydrophobicContact CE1-CD1 4.37Å; F1085-L1088 PolarHBondContact O-N 3.01Å; L1088-K1090 VanDerWaalsContact C-N 3.32Å; L1088-K1090 PolarHBondContact O-N 2.95Å; L1088-V1091 WeakPolarHBondContact O-CA 3.27Å; L1088-V1091 WeakPolarHBondContact O-CB 3.28Å; L1088-V1091 PolarHBondContact O-N 3.09Å; L1088-F1092 HydrophobicContact CB-CD2 4.34Å; L1088-F1092 HydrophobicContact CB-CE2 4.11Å; L1088-F1092 HydrophobicContact CD2-CE2 4.5Å; L1088-F1092 WeakPolarHBondContact O-CD2 3.26Å; L1088-F1092 PolarHBondContact O-N 3.37Å
1089	L	95.3	Very high	86.4	Confident	28 Å²	28	79.9 Å²	79.9	15%	0.147	40%	0.404	C	S	.	.	H	α-helix	trans	-51.8	-50.5	173	-76.3	169.1	0	0	0	111.5	A925 C928 Q929 F1085 V1091 F1092 E1093	A925-L1089 HydrophobicContact CB-CD2 4.43Å; A925-L1089 VanDerWaalsContact O-CD2 3.32Å; A925-L1089 WeakPolarHBondContact O-CD2 3.17Å; C928-L1089 HydrophobicContact CB-CD2 3.69Å; C928-L1089 HydrophobicContact CB-CG 3.78Å; Q929-L1089 HydrophobicContact CB-CD2 4.34Å; F1085-L1089 WeakPolarHBondContact O-CG 3.4Å; F1085-L1089 PolarHBondContact O-N 2.84Å; L1089-V1091 PolarHBondContact O-N 3.37Å; L1089-V1091 VanDerWaalsContact O-N 3.1Å; L1089-F1092 PolarHBondContact O-N 3.32Å; L1089-F1092 VanDerWaalsContact O-N 3.08Å; L1089-E1093 WeakPolarHBondContact O-CG 3.09Å; L1089-E1093 PolarHBondContact O-N 3.05Å
1090	K	94.1	Very high	83.8	Confident	136 Å²	136	84.4 Å²	84.4	59%	0.591	43%	0.428	S	S	*	.	H	α-helix	trans	-63.7	-14.1	177.8	-64.8	175.7	-178	-176.1	0	114.3	N1086 T1087 L1088 K1094	N1086-K1090 WeakPolarHBondContact O-CG 3.18Å; T1087-K1090 PolarHBondContact O-N 3.37Å; L1088-K1090 VanDerWaalsContact C-N 3.32Å; L1088-K1090 PolarHBondContact O-N 2.95Å; K1090-K1094 WeakPolarHBondContact O-CD 3.35Å; K1090-K1094 WeakPolarHBondContact O-CG 3.27Å
1091	V	93.7	Very high	81.1	Confident	56 Å²	56	89.5 Å²	89.5	34%	0.339	43%	0.431	S	S	.	.	H	α-helix	trans	-90.7	-44.5	170.6	-177.8	0	0	0	0	110.6	I1070 T1087 L1088 L1089 E1093 K1094 L1095	I1070-V1091 HydrophobicContact CD1-CG1 3.78Å; I1070-V1091 HydrophobicContact CG1-CG1 3.94Å; T1087-V1091 PolarHBondContact O-N 3.03Å; L1088-V1091 WeakPolarHBondContact O-CA 3.27Å; L1088-V1091 WeakPolarHBondContact O-CB 3.28Å; L1088-V1091 PolarHBondContact O-N 3.09Å; L1089-V1091 PolarHBondContact O-N 3.37Å; L1089-V1091 VanDerWaalsContact O-N 3.1Å; V1091-E1093 PolarHBondContact O-N 3.38Å; V1091-K1094 PolarHBondContact O-N 2.9Å; V1091-L1095 PolarHBondContact O-N 3.48Å; V1091-L1095 VanDerWaalsContact O-N 3.09Å
1092	F	93	Very high	78.5	Confident	0 Å²	0	96.1 Å²	96.1	0%	0	45%	0.449	C	S	.	.	H	α-helix	trans	-65.8	-20.7	175.8	-70.1	-63.4	0	0	0	114	V921 A924 A925 F1024 W1028 I1070 L1088 L1089 L1095	V921-F1092 HydrophobicContact CG1-CB 4.26Å; V921-F1092 HydrophobicContact CG1-CD1 4.26Å; V921-F1092 WeakPolarHBondContact CG1-O 3.46Å; V921-F1092 HydrophobicContact CG2-CD1 4.46Å; A924-F1092 HydrophobicContact CB-CD1 4.06Å; A924-F1092 HydrophobicContact CB-CE1 3.61Å; A924-F1092 HydrophobicContact CB-CE2 4.16Å; A924-F1092 HydrophobicContact CB-CZ 3.67Å; A925-F1092 HydrophobicContact CB-CB 4.17Å; F1024-F1092 AromaticContact CE1-CE2 3.76Å; F1024-F1092 HydrophobicContact CE1-CE2 3.76Å; F1024-F1092 AromaticContact CE1-CZ 3.87Å; F1024-F1092 HydrophobicContact CE1-CZ 3.87Å; F1024-F1092 AromaticContact CZ-CE2 3.6Å; F1024-F1092 HydrophobicContact CZ-CE2 3.6Å; F1024-F1092 AromaticContact CZ-CZ 3.69Å; F1024-F1092 HydrophobicContact CZ-CZ 3.69Å; W1028-F1092 HydrophobicContact CD2-CE1 4.13Å; W1028-F1092 HydrophobicContact CD2-CZ 4.23Å; W1028-F1092 HydrophobicContact CE3-CE1 4.04Å; W1028-F1092 HydrophobicContact CE3-CZ 4.31Å; W1028-F1092 AromaticContact CH2-CE1 3.81Å; W1028-F1092 HydrophobicContact CH2-CE1 3.81Å; W1028-F1092 AromaticContact CZ2-CE1 3.87Å; W1028-F1092 HydrophobicContact CZ2-CE1 3.87Å; W1028-F1092 AromaticContact CZ3-CE1 3.88Å; W1028-F1092 HydrophobicContact CZ3-CE1 3.88Å; I1070-F1092 HydrophobicContact CD1-CD1 4.3Å; I1070-F1092 HydrophobicContact CD1-CE1 3.81Å; I1070-F1092 HydrophobicContact CD1-CZ 4.14Å; I1070-F1092 HydrophobicContact CG2-CZ 3.94Å; L1088-F1092 HydrophobicContact CB-CD2 4.34Å; L1088-F1092 HydrophobicContact CB-CE2 4.11Å; L1088-F1092 HydrophobicContact CD2-CE2 4.5Å; L1088-F1092 WeakPolarHBondContact O-CD2 3.26Å; L1088-F1092 PolarHBondContact O-N 3.37Å; L1089-F1092 PolarHBondContact O-N 3.32Å; L1089-F1092 VanDerWaalsContact O-N 3.08Å; F1092-L1095 HydrophobicContact CD1-CD1 3.97Å; F1092-L1095 HydrophobicContact CE1-CD1 4.39Å
1093	E	87.9	Confident	75.8	Confident	124 Å²	124	100.1 Å²	100.1	58%	0.579	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-33.6	168.3	-74.2	165.8	175.8	0	0	113	L1089 V1091	L1089-E1093 WeakPolarHBondContact O-CG 3.09Å; L1089-E1093 PolarHBondContact O-N 3.05Å; V1091-E1093 PolarHBondContact O-N 3.38Å
1094	K	86.7	Confident	72.9	Confident	178 Å²	178	104.1 Å²	104.1	77%	0.774	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-21.1	-177.8	-67.8	177.5	-176	-174.7	0	113.7	K1090 V1091	K1090-K1094 WeakPolarHBondContact O-CD 3.35Å; K1090-K1094 WeakPolarHBondContact O-CG 3.27Å; V1091-K1094 PolarHBondContact O-N 2.9Å
1095	L	83.9	Confident	70.4	Confident	14 Å²	14	107 Å²	107	7%	0.073	53%	0.527	C	S	.	.	S	Bend	trans	-62.8	141.2	174.3	-74	-178.8	0	0	0	110.9	V921 E1066 T1067 I1070 V1091 F1092 R1097	V921-L1095 HydrophobicContact CG2-CB 4.29Å; V921-L1095 HydrophobicContact CG2-CD1 3.74Å; E1066-L1095 HydrophobicContact CB-CD2 3.75Å; T1067-L1095 HydrophobicContact CG2-CD1 4.23Å; T1067-L1095 HydrophobicContact CG2-CD2 4.32Å; I1070-L1095 HydrophobicContact CD1-CD1 3.82Å; V1091-L1095 PolarHBondContact O-N 3.48Å; V1091-L1095 VanDerWaalsContact O-N 3.09Å; F1092-L1095 HydrophobicContact CD1-CD1 3.97Å; F1092-L1095 HydrophobicContact CE1-CD1 4.39Å; L1095-R1097 PolarHBondContact O-N 3.15Å
1096	P	68.4	Low	67.7	Low	103 Å²	103	116 Å²	116	67%	0.669	56%	0.562	S	S	*	*			trans	-68.4	90.9	-179.1	28.1	-35	0	0	0	111.2	K1098	P1096-K1098 PolarHBondContact O-N 3Å
1097	R	61.6	Low	64.9	Low	134 Å²	134	118 Å²	118	51%	0.506	58%	0.579	S	S	.	*			trans	-59.3	129.4	158.9	-58.1	179.6	-170.9	-177.3	2.5	106.7	V921 L1095 R1099	V921-R1097 HydrophobicContact CG1-CG 4.28Å; L1095-R1097 PolarHBondContact O-N 3.15Å; R1097-R1099 VanDerWaalsContact C-N 3.31Å; R1097-R1099 PolarHBondContact O-N 3.23Å
1098	K	50.6	Low	62.1	Low	175 Å²	175	119.4 Å²	119.4	76%	0.761	59%	0.592	S	S	*	*			trans	-61.2	93.4	172.1	-78.6	-170.9	173	-171.5	0	109.8	P1096	P1096-K1098 PolarHBondContact O-N 3Å
1099	R	39.2	Very low	59.2	Low	234 Å²	234	124.5 Å²	124.5	88%	0.883	63%	0.628	S	S	*	*			trans	-56.3	137.5	146.1	-75	-177.8	170.6	173	-2.4	105.9	R1097 E1101	R1097-R1099 VanDerWaalsContact C-N 3.31Å; R1097-R1099 PolarHBondContact O-N 3.23Å; R1099-E1101 PolarHBondContact O-N 3.07Å
1100	L	38.9	Very low	56.4	Low	157 Å²	157	131.8 Å²	131.8	82%	0.822	66%	0.661	S	S	*	*			trans	-54.1	132.6	155.6	-107.4	67.7	0	0	0	106.4	R1102	L1100-R1102 PolarHBondContact O-N 2.93Å
1101	E	35.4	Very low	53.7	Low	185 Å²	185	132 Å²	132	86%	0.864	67%	0.673	S	S	*	*			trans	-61.5	98.3	153.7	-71.1	-179.1	158.7	0	0	105.8	R1099 S1103	R1099-E1101 PolarHBondContact O-N 3.07Å; E1101-S1103 VanDerWaalsContact C-N 3.3Å; E1101-S1103 PolarHBondContact O-N 3.16Å
1102	R	40.9	Very low	51	Low	229 Å²	229	134.4 Å²	134.4	86%	0.864	69%	0.693	S	S	*	*			trans	-63.7	104.7	156.5	-74.5	-178.5	174.5	170.7	-3	104.3	L1100 P1104	L1100-R1102 PolarHBondContact O-N 2.93Å; R1102-P1104 VanDerWaalsContact O-N 3.15Å
1103	S	40.1	Very low	48.3	Very low	102 Å²	102	145.7 Å²	145.7	71%	0.713	74%	0.735	S	S	*	*			trans	-43	123.6	169.7	-51.2	0	0	0	0	107.8	E1101 S1105	E1101-S1103 VanDerWaalsContact C-N 3.3Å; E1101-S1103 PolarHBondContact O-N 3.16Å; S1103-S1105 PolarHBondContact O-N 3.04Å
1104	P	38.2	Very low	46.2	Very low	110 Å²	110	145.1 Å²	145.1	71%	0.714	75%	0.745	S	S	*	*			trans	-53.6	121.7	-176.6	-27.6	35	0	0	0	109.3	R1102 Y1106	R1102-P1104 VanDerWaalsContact O-N 3.15Å; P1104-Y1106 HydrophobicContact CB-CD2 4.17Å; P1104-Y1106 PolarHBondContact O-N 2.87Å
1105	S	43	Very low	44.1	Very low	119 Å²	119	141.1 Å²	141.1	83%	0.832	75%	0.746	S	S	*	*			trans	-78.8	53.3	-176.7	58.8	0	0	0	0	111.1	S1103	S1103-S1105 PolarHBondContact O-N 3.04Å
1106	Y	42.5	Very low	42.1	Very low	191 Å²	191	149.6 Å²	149.6	75%	0.749	79%	0.785	S	S	*	*			trans	-102.8	111.5	170.4	-81.4	-80.6	0	0	0	108.2	P1104 S1108	P1104-Y1106 HydrophobicContact CB-CD2 4.17Å; P1104-Y1106 PolarHBondContact O-N 2.87Å; Y1106-S1108 PolarHBondContact O-N 2.78Å; Y1106-S1108 VanDerWaalsContact O-N 3.07Å
1107	P	36.6	Very low	41.1	Very low	130 Å²	130	149.4 Å²	149.4	84%	0.844	79%	0.786	S	S	*	*			trans	-70.6	103.1	168.1	29.3	-31	0	0	0	107.8
1108	S	38	Very low	40	Very low	100 Å²	100	149.9 Å²	149.9	70%	0.699	80%	0.797	S	S	*	*			trans	-134.9	109.8	177.9	-61.7	0	0	0	0	109.2	Y1106	Y1106-S1108 PolarHBondContact O-N 2.78Å; Y1106-S1108 VanDerWaalsContact O-N 3.07Å
1109	S	35.7	Very low	39.3	Very low	109 Å²	109	155.1 Å²	155.1	76%	0.762	82%	0.821	S	S	*	*			trans	-62.1	149.9	179.7	41.2	0	0	0	0	112.3
1110	H	35.3	Very low	39.3	Very low	182 Å²	182	151.2 Å²	151.2	84%	0.843	82%	0.818	S	S	*	*			trans	28	110.6	153.2	-75.3	-113.3	0	0	0	118.2
1111	V	39.3	Very low	39.4	Very low	139 Å²	139	150.8 Å²	150.8	84%	0.842	82%	0.817	S	S	*	*				-171	148.2	123.2	136.6	0	0	0	0	111.3
1112	S	36.1	Very low	39.6	Very low	108 Å²	108	148.9 Å²	148.9	76%	0.755	82%	0.815	S	S	*	*			trans	49.3	99.9	165.2	-64.7	0	0	0	0	120.9
1113	R	36.6	Very low	39.5	Very low	236 Å²	236	144.2 Å²	144.2	89%	0.891	81%	0.812	S	S	*	*			trans	-65.6	177.5	130.5	-68.3	175	171	167.3	-3.8	109.8
1114	S	43.5	Very low	39.5	Very low	112 Å²	112	146.9 Å²	146.9	78%	0.783	82%	0.818	S	S	*	*			trans	97.6	33.6	164.5	-46.3	0	0	0	0	119.1
1115	A	43.1	Very low	39.6	Very low	95 Å²	95	149.3 Å²	149.3	79%	0.785	83%	0.825	S	S	*	*	S	Bend	trans	-95.4	-26.3	176.5	0	0	0	0	0	116
1116	E	40.8	Very low	39.3	Very low	192 Å²	192	151.5 Å²	151.5	90%	0.897	82%	0.824	S	S	*	*	S	Bend	trans	-106.6	21.3	-167.5	-65.1	-174.6	128.6	0	0	114.8	L1118	E1116-L1118 VanDerWaalsContact C-N 3.31Å; E1116-L1118 PolarHBondContact O-N 2.91Å
1117	S	48.2	Very low	39.1	Very low	99 Å²	99	148.5 Å²	148.5	69%	0.692	83%	0.83	S	S	*	*	S	Bend	trans	-92.2	26.4	176.4	59.9	0	0	0	0	113.8
1118	L	37.4	Very low	39.3	Very low	143 Å²	143	150 Å²	150	75%	0.749	83%	0.829	S	S	*	*			trans	-145.4	36	-170	-74.3	178.6	0	0	0	115	E1116	E1116-L1118 VanDerWaalsContact C-N 3.31Å; E1116-L1118 PolarHBondContact O-N 2.91Å
1119	F	37.4	Very low	39.4	Very low	285 Å²	285	154.5 Å²	154.5	100%	1.25	84%	0.841	S	S	*	*			trans	-146.3	0	164	-78.4	-63.3	0	0	0	112.2

Retrieved 1,119 of 1,119 residues in 407.3 ms (Link to these results)

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