A0A087Y4U4_POEFO Loading...

Vacuolar protein sorting-associated protein 18 homolog

AlphaFold DB , UniProt , Accession A0A087Y4U4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 982 aa.

						>A0A087Y4U4_POEFO|A0A087Y4U4
MASILDEYEDSQNIRQSSQQHSRLSSANIGLTHSGFVNVRLEEEKPIFNKQRIDFTPPERINHLAVCNNQLCMSLGKDTLLRIDLAKPDQLNQTELGRKEDSKVYKLFLDPTGFHLLISLNTSECLYLNRNTQKVRSLSRWRGHLIESVGWNKLLGNETSTGPILVGTSQGIIFEAEISANEGSLFNTNPDQYFRQVHSLEEDGKPAPVCCLEIERSPENKYFIIATTRKRLFQFVGKVAEGSEQQGLSTIFSQNQDLLPSFQEFPANMGYSEITFYTAKLRNFPKAFAWMMGNGVLYGQLDYVRPDSLLSDVQVWEYTPDIDISQNKPISIVLTQFHFLLLLHDRIKAICTLNGQVVYEDVFPDKFGPLKRMIKDPIGGMVWIYTERAVFRYHIQRESRDVWQMYMNMNKFDLAKEYCRDRPECMDMVLAKEAEYCFQNKRYLESAKCYALTQNYFEEIALKFIEAKQEEALKEFLLKKLNNLKQSERTQITLLVTWLTELYLNRLGQLESDDNTLIFQETRDEFRQFLSSSKHRDCLFNNRGTIYDLLASHGNVDDMVYFSVVMQDYERVISHYCQHDNFSAALDVLAKHCDEKLFYKFSPVLMQHIPKNVVNAWIQMGKRLDPKKLIPALMNYSQMGSTQQINETIRYMEFCVYELNVTEEAIHNYLLSLYAKYKPDSLLQYLRQAGTHPSEIHYDLKYALRLCAEHGFLQACVLVYRIMELHEEAVDLALQVDVDLAKSCADLPEDDEEMRKKLWLKIARHVVQEEKDVKKAMNCLSSCNLLKIEDILPFFPDFVTIDHFKEAICSSLEEYNKHIEELKQEMEEATESAKRIREDIQEMRNKYGVVDSQEKCAACDFPLLNRPFYLFLCGHMFHNDCLFQEVTPHLSAFKQNRLEELQKKLAATTQSSKSRHRPTQKEEGDTASLGKGVGATSREQIVSDIDDIVASECVYCGELMIKSIDKPFIDPQKFEQDKSSWL
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.1	Very low	36	Very low	252 Å²	252	134.6 Å²	134.6	100%	1.241	71%	0.713	S	S	*	*				0	91.6	0	-74.9	-150.9	-74.2	0	0	108.1
2	A	26.9	Very low	36.1	Very low	100 Å²	100	136.5 Å²	136.5	83%	0.826	72%	0.715	S	S	*	*			trans	-145.6	129.6	161.7	0	0	0	0	0	103.6
3	S	32.9	Very low	35.7	Very low	72 Å²	72	137.2 Å²	137.2	50%	0.503	72%	0.719	S	S	.	*			trans	-83.9	138.4	-163.7	-175.3	0	0	0	0	110.8	L5 D6	S3-L5 PolarHBondContact O-N 3.08Å; S3-D6 PolarHBondContact O-N 2.9Å
4	I	33.6	Very low	35.6	Very low	143 Å²	143	138 Å²	138	73%	0.733	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.3	-7.1	176.5	-98.9	163.8	0	0	0	114.4
5	L	35.6	Very low	35.5	Very low	122 Å²	122	144.3 Å²	144.3	64%	0.639	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-26.7	179.2	-73.9	159.7	0	0	0	113.3	S3 E7 Y8	S3-L5 PolarHBondContact O-N 3.08Å; L5-E7 PolarHBondContact O-N 2.89Å; L5-Y8 PolarHBondContact O-N 3.07Å
6	D	38.1	Very low	35.2	Very low	109 Å²	109	147.4 Å²	147.4	58%	0.583	74%	0.744	S	S	*	*	H	α-helix	trans	-75.3	-25.1	-178	-67.5	-20.2	0	0	0	112.4	S3 Y8	S3-D6 PolarHBondContact O-N 2.9Å; D6-Y8 VanDerWaalsContact C-N 3.29Å; D6-Y8 PolarHBondContact O-N 2.8Å
7	E	39	Very low	34.8	Very low	163 Å²	163	145.2 Å²	145.2	76%	0.762	75%	0.745	S	S	*	*	H	α-helix	trans	-77.3	-14.2	174.9	-76.7	-175.1	160.4	0	0	113.2	L5	L5-E7 PolarHBondContact O-N 2.89Å
8	Y	37.2	Very low	34.4	Very low	173 Å²	173	143.8 Å²	143.8	68%	0.678	75%	0.751	S	S	*	*	H	α-helix	trans	-85.7	-32.8	179.5	-115.7	-96.4	0	0	0	112.7	L5 D6 S11	L5-Y8 PolarHBondContact O-N 3.07Å; D6-Y8 VanDerWaalsContact C-N 3.29Å; D6-Y8 PolarHBondContact O-N 2.8Å; Y8-S11 PolarHBondContact O-OG 3.41Å
9	E	39.1	Very low	34.1	Very low	145 Å²	145	146.3 Å²	146.3	68%	0.678	76%	0.758	S	S	*	*	H	α-helix	trans	-73.4	-33.9	-179.1	-72.1	-169.3	156.7	0	0	113.1	S11 Q12	E9-S11 PolarHBondContact O-N 3.45Å; E9-Q12 PolarHBondContact O-N 3.07Å
10	D	35.1	Very low	33.7	Very low	129 Å²	129	148.7 Å²	148.7	69%	0.69	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-17.6	178.4	-84.9	-17.5	0	0	0	113.6
11	S	33.6	Very low	33.5	Very low	73 Å²	73	150.3 Å²	150.3	51%	0.51	77%	0.769	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.1	-15.7	-179.9	74	0	0	0	0	114.2	Y8 E9	Y8-S11 PolarHBondContact O-OG 3.41Å; E9-S11 PolarHBondContact O-N 3.45Å
12	Q	36.5	Very low	32.5	Very low	157 Å²	157	144.2 Å²	144.2	73%	0.734	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-18	-178.3	-67.7	-155.1	-7.8	0	0	114.4	E9 I14	E9-Q12 PolarHBondContact O-N 3.07Å; Q12-I14 PolarHBondContact O-N 3.28Å
13	N	31.8	Very low	32.5	Very low	145 Å²	145	150.6 Å²	150.6	78%	0.775	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	1	-174.3	-84.1	-31.5	0	0	0	116
14	I	33.9	Very low	32.1	Very low	149 Å²	149	154.9 Å²	154.9	76%	0.764	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	1	-177.8	-63.7	176.2	0	0	0	113.3	Q12	Q12-I14 PolarHBondContact O-N 3.28Å
15	R	33.6	Very low	31.7	Very low	233 Å²	233	152.9 Å²	152.9	88%	0.879	77%	0.769	S	S	*	*			trans	-112.1	33.1	-176	-72.3	-171.4	178.6	-177.8	2	116
16	Q	31.2	Very low	31.6	Very low	194 Å²	194	152.6 Å²	152.6	91%	0.907	78%	0.777	S	S	*	*			trans	-121.2	79.2	165.9	-76.8	-171.1	-3.3	0	0	111.9
17	S	28.2	Very low	31	Very low	109 Å²	109	152 Å²	152	76%	0.762	79%	0.788	S	S	*	*			trans	-160.4	134.5	148.9	63.3	0	0	0	0	111.1
18	S	27.4	Very low	30.5	Very low	121 Å²	121	152.2 Å²	152.2	85%	0.846	79%	0.794	S	S	*	*			trans	99.1	97	169.3	76	0	0	0	0	117.6
19	Q	30	Very low	30.2	Very low	191 Å²	191	152 Å²	152	89%	0.893	80%	0.803	S	S	*	*			trans	-73.2	136.8	151.7	-73.8	176.9	-25.6	0	0	109.3
20	Q	26.2	Very low	29.6	Very low	193 Å²	193	148.3 Å²	148.3	90%	0.902	80%	0.804	S	S	*	*				-178.1	149.2	130	-101.5	175.6	8.9	0	0	112.4
21	H	28	Very low	29.2	Very low	183 Å²	183	150.8 Å²	150.8	85%	0.847	82%	0.816	S	S	*	*			trans	-33.8	137.8	179.2	-72.3	-80.4	0	0	0	118.1
22	S	23.7	Very low	29	Very low	124 Å²	124	153.4 Å²	153.4	87%	0.867	83%	0.829	S	S	*	*				174.4	157.6	117.8	58.2	0	0	0	0	112.2
23	R	27.2	Very low	28.6	Very low	234 Å²	234	154.8 Å²	154.8	88%	0.883	84%	0.835	S	S	*	*			trans	-74	155.5	-179.7	-66.4	172.8	170.4	171.3	-4.2	112.1
24	L	25.7	Very low	28.6	Very low	163 Å²	163	153.5 Å²	153.5	85%	0.853	84%	0.838	S	S	*	*			trans	108.3	130.8	151.3	-70.1	147.7	0	0	0	119.4
25	S	24.3	Very low	28.5	Very low	100 Å²	100	150 Å²	150	70%	0.699	84%	0.838	S	S	*	*			trans	67.5	110.7	146.5	66.4	0	0	0	0	120.9
26	S	32.8	Very low	28.5	Very low	116 Å²	116	146.5 Å²	146.5	81%	0.811	83%	0.829	S	S	*	*			trans	32.4	115.3	134	61.4	0	0	0	0	119.5
27	A	26.6	Very low	28.4	Very low	97 Å²	97	142.9 Å²	142.9	80%	0.802	82%	0.82	S	S	*	*			trans	-145.5	114.8	144.9	0	0	0	0	0	110.1
28	N	28.9	Very low	28.6	Very low	168 Å²	168	144.7 Å²	144.7	90%	0.898	82%	0.821	S	S	*	*			trans	-61.2	131.6	164.7	-81.1	-30.1	0	0	0	110.1
29	I	29.5	Very low	29	Very low	169 Å²	169	143.1 Å²	143.1	87%	0.867	81%	0.806	S	S	*	*			trans	-131.7	112.7	151.3	-61.7	179	0	0	0	106.6
30	G	27.6	Very low	29.2	Very low	67 Å²	67	144.9 Å²	144.9	69%	0.691	81%	0.805	S	S	*	*			trans	-78.9	140.1	-175.4	0	0	0	0	0	112.9
31	L	26.3	Very low	30	Very low	180 Å²	180	142.6 Å²	142.6	94%	0.942	80%	0.798	S	S	*	*			trans	-127	115.7	149.3	-88.4	155.6	0	0	0	106.1
32	T	29.8	Very low	30.8	Very low	128 Å²	128	141 Å²	141	79%	0.785	79%	0.791	S	S	*	*			trans	-82.2	116.6	-171.8	46.7	0	0	0	0	110.6
33	H	27.2	Very low	31.8	Very low	186 Å²	186	144.3 Å²	144.3	86%	0.861	79%	0.793	S	S	*	*			trans	-147.6	128.6	142.7	-97.7	-74.9	0	0	0	109.8
34	S	33.3	Very low	33.4	Very low	119 Å²	119	137.5 Å²	137.5	83%	0.832	77%	0.771	S	S	*	*	S	Bend	trans	-21.8	123.8	179.4	49.7	0	0	0	0	118.5
35	G	30.8	Very low	35.4	Very low	74 Å²	74	136.7 Å²	136.7	76%	0.763	76%	0.76	S	S	*	*			trans	153.3	-14.1	152.8	0	0	0	0	0	118.9	V37	G35-V37 PolarHBondContact O-N 3.13Å
36	F	33.2	Very low	37.9	Very low	161 Å²	161	135.5 Å²	135.5	71%	0.706	75%	0.75	S	S	*	*			trans	-86.7	108.1	-177.7	-84.4	-88	0	0	0	112.4	N38	F36-N38 VanDerWaalsContact C-N 3.28Å; F36-N38 PolarHBondContact O-N 3.39Å
37	V	30.1	Very low	40.2	Very low	118 Å²	118	130.8 Å²	130.8	72%	0.715	72%	0.716	S	S	*	*			trans	-67.4	97	150.1	-172.8	0	0	0	0	105.7	G35 V39	G35-V37 PolarHBondContact O-N 3.13Å; V37-V39 HydrophobicContact CB-CG2 4.18Å; V37-V39 HydrophobicContact CG1-CG2 3.38Å; V37-V39 PolarHBondContact O-N 2.82Å
38	N	32.3	Very low	43	Very low	147 Å²	147	126.3 Å²	126.3	79%	0.786	68%	0.679	S	S	*	*			trans	-65.7	81.3	160.5	-87.5	-35.4	0	0	0	107.4	F36 R40	F36-N38 VanDerWaalsContact C-N 3.28Å; F36-N38 PolarHBondContact O-N 3.39Å; N38-R40 PolarHBondContact O-N 2.78Å
39	V	36.1	Very low	45.6	Very low	87 Å²	87	122.1 Å²	122.1	53%	0.527	66%	0.656	S	S	.	*			trans	-67	115.2	168.3	-178.1	0	0	0	0	105.7	V37 L41	V37-V39 HydrophobicContact CB-CG2 4.18Å; V37-V39 HydrophobicContact CG1-CG2 3.38Å; V37-V39 PolarHBondContact O-N 2.82Å; V39-L41 PolarHBondContact O-N 2.85Å
40	R	33.3	Very low	48.4	Very low	228 Å²	228	116.7 Å²	116.7	86%	0.86	63%	0.626	S	S	*	*			trans	-50.3	116.6	171.1	-72	175.1	171.6	173.3	-3.3	107.7	N38 E42	N38-R40 PolarHBondContact O-N 2.78Å; R40-E42 PolarHBondContact O-N 3.39Å
41	L	43.3	Very low	51.3	Low	145 Å²	145	118.2 Å²	118.2	76%	0.759	62%	0.615	S	S	*	*			trans	-49.3	107.1	163.2	-71	160.3	0	0	0	106.4	V39 E43	V39-L41 PolarHBondContact O-N 2.85Å; L41-E43 PolarHBondContact O-N 3.04Å
42	E	45.2	Very low	54.1	Low	149 Å²	149	114.8 Å²	114.8	70%	0.696	59%	0.59	S	S	*	*			trans	-48.8	137.6	171.6	-69.3	-176.9	147.2	0	0	107.7	R40 E44	R40-E42 PolarHBondContact O-N 3.39Å; E42-E44 WeakPolarHBondContact O-CG 3.24Å; E42-E44 PolarHBondContact O-N 2.78Å
43	E	45	Very low	56.7	Low	195 Å²	195	110.9 Å²	110.9	91%	0.911	56%	0.564	S	S	*	*			trans	-55.4	104.6	176.7	-76.4	-176.4	163.7	0	0	109.6	L41 K45	L41-E43 PolarHBondContact O-N 3.04Å; E43-K45 PolarHBondContact O-N 3.07Å; E43-K45 VanDerWaalsContact O-N 3.09Å
44	E	60.3	Low	58.9	Low	90 Å²	90	109.7 Å²	109.7	42%	0.421	56%	0.564	S	S	.	*			trans	-77.5	100.9	-164.4	-81.4	-145.3	-81.1	0	0	108.7	E42 R400 R422	E42-E44 WeakPolarHBondContact O-CG 3.24Å; E42-E44 PolarHBondContact O-N 2.78Å; E44-R400 VanDerWaalsContact CA-NH2 3.34Å; E44-R400 IonicContact OE1-NE 3.51Å; E44-R400 IonicContact OE2-CZ 3.77Å; E44-R400 IonicContact OE2-NE 3.87Å; E44-R400 PolarHBondContact OE2-NE 3.32Å; E44-R400 IonicContact OE2-NH2 3.71Å; E44-R400 PolarHBondContact OE2-NH2 2.98Å; E44-R422 IonicContact OE2-CZ 3.02Å; E44-R422 IonicContact OE2-NH1 3.83Å; E44-R422 PolarHBondContact OE2-NH1 3.18Å; E44-R422 VanDerWaalsContact OE2-NH1 3.14Å; E44-R422 IonicContact OE2-NH2 3.57Å
45	K	68.1	Low	60.8	Low	146 Å²	146	106.2 Å²	106.2	64%	0.635	53%	0.534	S	S	*	.			trans	-53.1	142.6	177.9	-69.3	-178.8	-178.4	175.3	0	111.4	E43 R400	E43-K45 PolarHBondContact O-N 3.07Å; E43-K45 VanDerWaalsContact O-N 3.09Å; K45-R400 PolarHBondContact O-NH1 2.99Å
46	P	76.1	Confident	62.8	Low	75 Å²	75	108 Å²	108	49%	0.487	53%	0.53	S	S	.	.			trans	-66.8	145.6	178.3	27.7	-34.4	0	0	0	111.4	F48	P46-F48 VanDerWaalsContact C-N 3.27Å; P46-F48 PolarHBondContact O-N 3.08Å
47	I	81.3	Confident	64.6	Low	18 Å²	18	101.3 Å²	101.3	9%	0.092	50%	0.503	C	S	.	.	S	Bend	trans	-58.3	-42.2	179.8	-63.1	172.2	0	0	0	110.8	V358 I395 Q396	I47-V358 HydrophobicContact CD1-CG1 4.31Å; I47-I395 HydrophobicContact CG2-CG2 4.38Å; I47-I395 CarbonylContact O-C 3.54Å; I47-I395 WeakPolarHBondContact O-CA 3.25Å; I47-Q396 PolarHBondContact O-N 3.48Å
48	F	84.5	Confident	66.6	Low	3 Å²	3	100.6 Å²	100.6	1%	0.013	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	115.4	178.7	-60.4	-78.5	0	0	0	109.4	P46 H338 L340 A349 Y359 Y393 I395	P46-F48 VanDerWaalsContact C-N 3.27Å; P46-F48 PolarHBondContact O-N 3.08Å; F48-H338 HydrophobicContact CZ-CB 4.26Å; F48-L340 HydrophobicContact CD1-CD2 4.22Å; F48-L340 HydrophobicContact CE1-CD1 4.2Å; F48-L340 HydrophobicContact CE1-CD2 4.03Å; F48-L340 HydrophobicContact CE1-CG 4.41Å; F48-A349 HydrophobicContact CD2-CB 4.27Å; F48-A349 HydrophobicContact CE2-CB 3.67Å; F48-A349 HydrophobicContact CZ-CB 3.91Å; F48-Y359 HydrophobicContact CB-CD1 3.9Å; F48-Y359 HydrophobicContact CB-CD2 4.47Å; F48-Y359 HydrophobicContact CB-CE1 3.91Å; F48-Y359 HydrophobicContact CB-CE2 4.49Å; F48-Y359 HydrophobicContact CB-CG 4.2Å; F48-Y359 HydrophobicContact CD2-CD1 4.03Å; F48-Y359 AromaticContact CD2-CG 3.87Å; F48-Y359 HydrophobicContact CD2-CG 3.87Å; F48-Y359 HydrophobicContact CG-CD1 4.16Å; F48-Y359 HydrophobicContact CG-CG 4.38Å; F48-Y393 HydrophobicContact CB-CD1 4.3Å; F48-I395 HydrophobicContact CD1-CG1 3.95Å; F48-I395 HydrophobicContact CE1-CD1 4.31Å; F48-I395 HydrophobicContact CE1-CG1 3.91Å; F48-I395 HydrophobicContact CE1-CG2 4.45Å
49	N	85.4	Confident	69	Low	79 Å²	79	98.2 Å²	98.2	42%	0.422	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	117.8	175.2	-169.6	-2.6	0	0	0	110.5	Y393 H394	N49-Y393 WeakPolarHBondContact O-CA 3.33Å; N49-H394 PolarHBondContact N-O 2.93Å; N49-H394 PolarHBondContact O-N 3.29Å
50	K	88.1	Confident	71.2	Confident	56 Å²	56	100.6 Å²	100.6	24%	0.243	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	119.8	178.6	-176.6	-168.1	-153.1	153.4	0	110.2	D361 F363 F391 Y393	K50-D361 WeakPolarHBondContact CD-OD2 3.04Å; K50-D361 IonicContact NZ-OD1 2.78Å; K50-D361 PolarHBondContact NZ-OD1 2.85Å; K50-D361 IonicContact NZ-OD2 3.93Å; K50-D361 PolarHBondContact NZ-OD2 3.26Å; K50-F363 VanDerWaalsContact CE-CE1 3.4Å; K50-F391 HydrophobicContact CG-CD1 4.43Å; K50-Y393 HydrophobicContact CB-CD1 4.34Å; K50-Y393 HydrophobicContact CB-CE1 3.75Å; K50-Y393 WeakPolarHBondContact CE-OH 3.22Å; K50-Y393 HydrophobicContact CG-CE1 4.16Å; K50-Y393 HydrophobicContact CG-CE2 4.16Å
51	Q	87.8	Confident	73.7	Confident	99 Å²	99	89.8 Å²	89.8	46%	0.463	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	125.3	170.3	-172.1	175.1	8.8	0	0	110.1	R392	Q51-R392 PolarHBondContact N-O 3.42Å; Q51-R392 PolarHBondContact O-N 2.88Å
52	R	85.6	Confident	75.7	Confident	107 Å²	107	85.5 Å²	85.5	40%	0.404	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	138.1	167.4	-177.9	179.4	172.6	-167.2	-2.6	108.9	F391	R52-F391 HydrophobicContact CB-CD1 3.99Å; R52-F391 HydrophobicContact CB-CE1 4.03Å; R52-F391 HydrophobicContact CG-CD1 4.26Å; R52-F391 HydrophobicContact CG-CE1 4.05Å
53	I	83.7	Confident	77.6	Confident	46 Å²	46	80.3 Å²	80.3	24%	0.236	40%	0.397	C	S	.	.			trans	-86.2	131.6	172.8	-58	179.2	0	0	0	108	F55 W383 V390 R392	I53-F55 HydrophobicContact CG2-CB 3.9Å; I53-F55 PolarHBondContact O-N 3.41Å; I53-W383 HydrophobicContact CD1-CE3 3.79Å; I53-W383 HydrophobicContact CD1-CH2 3.84Å; I53-W383 HydrophobicContact CD1-CZ3 3.08Å; I53-W383 HydrophobicContact CG1-CZ3 4.5Å; I53-V390 HydrophobicContact CD1-CB 4.45Å; I53-V390 HydrophobicContact CD1-CG1 4Å; I53-V390 PolarHBondContact N-O 3.27Å; I53-V390 VanDerWaalsContact N-O 3.1Å; I53-R392 HydrophobicContact CD1-CB 4.24Å; I53-R392 HydrophobicContact CG1-CB 4.35Å
54	D	74.5	Confident	79.7	Confident	161 Å²	161	71.4 Å²	71.4	86%	0.861	36%	0.355	S	S	*	.	S	Bend	trans	-75.3	60.8	175.7	-64	-34.9	0	0	0	110.4
55	F	73.1	Confident	81.1	Confident	47 Å²	47	67.6 Å²	67.6	21%	0.206	34%	0.339	C	S	.	.			trans	-131.1	114.8	175.3	-179.9	-102.9	0	0	0	108.2	I53 P57 M73 L81 I83 L91	I53-F55 HydrophobicContact CG2-CB 3.9Å; I53-F55 PolarHBondContact O-N 3.41Å; F55-P57 HydrophobicContact CD1-CB 4.47Å; F55-P57 HydrophobicContact CE1-CB 3.89Å; F55-P57 WeakPolarHBondContact O-CD 3.34Å; F55-M73 HydrophobicContact CD1-CE 4.09Å; F55-M73 HydrophobicContact CE1-CE 3.61Å; F55-M73 HydrophobicContact CE1-SD 3.65Å; F55-M73 HydrophobicContact CZ-CE 4.31Å; F55-M73 HydrophobicContact CZ-SD 4.23Å; F55-L81 HydrophobicContact CZ-CD1 3.96Å; F55-I83 HydrophobicContact CE2-CD1 4.41Å; F55-I83 HydrophobicContact CZ-CD1 4.37Å; F55-L91 HydrophobicContact CE2-CD2 4.48Å
56	T	71.1	Confident	82	Confident	111 Å²	111	61 Å²	61	68%	0.681	31%	0.311	S	S	*	.			trans	-97.5	105.6	172.6	45.7	0	0	0	0	108.5
57	P	72.4	Confident	82.4	Confident	21 Å²	21	57.8 Å²	57.8	14%	0.136	29%	0.29	C	S	.	.			trans	-64.2	139.8	-178.8	29.5	-35.9	0	0	0	109.8	F55 E59 I61 L75 R388	F55-P57 HydrophobicContact CD1-CB 4.47Å; F55-P57 HydrophobicContact CE1-CB 3.89Å; F55-P57 WeakPolarHBondContact O-CD 3.34Å; P57-E59 VanDerWaalsContact C-N 3.28Å; P57-E59 WeakPolarHBondContact CB-O 3.38Å; P57-E59 PolarHBondContact O-N 2.8Å; P57-I61 HydrophobicContact CB-CD1 4.2Å; P57-I61 HydrophobicContact CB-CG1 3.96Å; P57-I61 HydrophobicContact CG-CD1 3.93Å; P57-I61 HydrophobicContact CG-CG1 3.95Å; P57-L75 HydrophobicContact CB-CD2 3.85Å; P57-R388 VanDerWaalsContact CD-O 3.24Å; P57-R388 WeakPolarHBondContact CD-O 3.43Å
58	P	72.4	Confident	82.4	Confident	103 Å²	103	59.5 Å²	59.5	67%	0.669	30%	0.3	S	S	*	.	S	Bend	trans	-68	-28.6	-178.5	25.4	-33.1	0	0	0	112.6	L75	P58-L75 HydrophobicContact CG-CD1 3.75Å
59	E	81.3	Confident	82.3	Confident	96 Å²	96	63 Å²	63	45%	0.449	32%	0.319	S	S	.	.	S	Bend	trans	-129.6	176.5	174.5	-59.3	-168.8	155	0	0	111	P57 I61 L75 G76	P57-E59 VanDerWaalsContact C-N 3.28Å; P57-E59 WeakPolarHBondContact CB-O 3.38Å; P57-E59 PolarHBondContact O-N 2.8Å; E59-I61 PolarHBondContact O-N 2.91Å; E59-L75 HydrophobicContact CB-CB 4.28Å; E59-G76 WeakPolarHBondContact OE2-CA 3.19Å
60	R	83.3	Confident	82.3	Confident	138 Å²	138	59.5 Å²	59.5	52%	0.521	30%	0.3	S	S	.	.			trans	-66.5	134	178.2	-60.7	-173.3	-169.7	-159.9	10.2	110.8	N62 G76 E387	R60-N62 PolarHBondContact O-N 3.47Å; R60-G76 PolarHBondContact O-N 2.55Å; R60-E387 WeakPolarHBondContact CA-O 3.35Å; R60-E387 IonicContact CZ-OE2 3.77Å; R60-E387 IonicContact NE-OE2 3.99Å; R60-E387 IonicContact NH1-OE2 2.9Å; R60-E387 PolarHBondContact NH1-OE2 3Å
61	I	85.3	Confident	82.2	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	123.1	174.3	-55	171.3	0	0	0	108.7	P57 E59 L75 Y385 E387 V390	P57-I61 HydrophobicContact CB-CD1 4.2Å; P57-I61 HydrophobicContact CB-CG1 3.96Å; P57-I61 HydrophobicContact CG-CD1 3.93Å; P57-I61 HydrophobicContact CG-CG1 3.95Å; E59-I61 PolarHBondContact O-N 2.91Å; I61-L75 HydrophobicContact CB-CD2 4.44Å; I61-L75 HydrophobicContact CG1-CD2 3.75Å; I61-Y385 HydrophobicContact CB-CD2 4.18Å; I61-Y385 HydrophobicContact CG2-CD2 3.52Å; I61-Y385 HydrophobicContact CG2-CE2 3.79Å; I61-Y385 HydrophobicContact CG2-CG 4.37Å; I61-E387 PolarHBondContact N-O 3.49Å; I61-V390 HydrophobicContact CD1-CG2 3.64Å
62	N	85.9	Confident	82.2	Confident	54 Å²	54	52.4 Å²	52.4	29%	0.289	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	-56.1	173.7	-63.6	-27.8	0	0	0	110.7	R60 S74 G76 Y385	R60-N62 PolarHBondContact O-N 3.47Å; N62-S74 PolarHBondContact N-O 2.91Å; N62-G76 PolarHBondContact ND2-O 3.49Å; N62-Y385 PolarHBondContact O-OH 2.73Å
63	H	85.7	Confident	82.3	Confident	41 Å²	41	47.5 Å²	47.5	19%	0.19	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	147.6	-179.2	-60	-80.9	0	0	0	110.6	M73 S74 V104 Y105 L107	H63-M73 CarbonylContact O-C 3.52Å; H63-M73 VanDerWaalsContact O-CA 3.29Å; H63-M73 WeakPolarHBondContact O-CA 3.45Å; H63-S74 WeakPolarHBondContact CB-OG 3.43Å; H63-S74 PolarHBondContact N-OG 3.21Å; H63-S74 VanDerWaalsContact N-OG 3.11Å; H63-S74 PolarHBondContact O-N 2.84Å; H63-S74 PolarHBondContact O-OG 2.85Å; H63-V104 PolarHBondContact NE2-O 3.2Å; H63-Y105 PolarHBondContact CE1-O 2.61Å; H63-Y105 PolarHBondContact NE2-O 2.95Å; H63-Y105 VanDerWaalsContact NE2-O 3.14Å; H63-L107 HydrophobicContact CB-CD1 3.66Å; H63-L107 HydrophobicContact CB-CG 3.84Å
64	L	88.9	Confident	82.5	Confident	8 Å²	8	45.3 Å²	45.3	4%	0.042	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	146.2	174	-170.1	140.4	0	0	0	107.3	V66 L71 C72 M73 I374 Y385 V390	L64-V66 HydrophobicContact CD2-CG2 3.42Å; L64-V66 VanDerWaalsContact CD2-CG2 3.42Å; L64-L71 HydrophobicContact CD1-CD1 4.4Å; L64-L71 HydrophobicContact CD1-CD2 4.09Å; L64-L71 HydrophobicContact CD1-CG 4.4Å; L64-L71 HydrophobicContact CG-CD2 4.37Å; L64-L71 HydrophobicContact CG-CG 4.43Å; L64-C72 CarbonylContact C-O 3.4Å; L64-C72 WeakPolarHBondContact CA-O 3.18Å; L64-M73 HydrophobicContact CD1-CB 4.24Å; L64-M73 HydrophobicContact CD1-CE 4.47Å; L64-M73 HydrophobicContact CG-CB 4.39Å; L64-I374 HydrophobicContact CB-CD1 4.38Å; L64-I374 HydrophobicContact CD2-CD1 3.91Å; L64-I374 WeakPolarHBondContact O-CD1 2.98Å; L64-Y385 HydrophobicContact CB-CD1 3.52Å; L64-Y385 HydrophobicContact CB-CD2 4.32Å; L64-Y385 HydrophobicContact CB-CE1 3.51Å; L64-Y385 HydrophobicContact CB-CE2 4.32Å; L64-Y385 HydrophobicContact CB-CG 3.94Å; L64-Y385 HydrophobicContact CD1-CD1 4.36Å; L64-Y385 HydrophobicContact CD1-CG 4.28Å; L64-Y385 HydrophobicContact CD2-CD1 4.21Å; L64-Y385 HydrophobicContact CG-CD1 4.25Å; L64-V390 HydrophobicContact CD1-CG1 4.27Å; L64-V390 HydrophobicContact CD1-CG2 3.91Å
65	A	87.9	Confident	82.9	Confident	10 Å²	10	37.8 Å²	37.8	8%	0.083	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	133.8	173.9	0	0	0	0	0	107.7	C72 L107 L109	A65-C72 PolarHBondContact N-O 2.89Å; A65-C72 PolarHBondContact O-N 3.05Å; A65-L107 HydrophobicContact CB-CB 4.28Å; A65-L109 HydrophobicContact CB-CB 4.06Å
66	V	88.1	Confident	83.2	Confident	8 Å²	8	36.4 Å²	36.4	5%	0.048	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	127.5	178.8	-169.8	0	0	0	0	109.1	L64 Q70 L71 L85 D376 W383	L64-V66 HydrophobicContact CD2-CG2 3.42Å; L64-V66 VanDerWaalsContact CD2-CG2 3.42Å; V66-Q70 VanDerWaalsContact CA-O 3.31Å; V66-Q70 WeakPolarHBondContact CA-O 3.43Å; V66-L71 HydrophobicContact CG2-CB 4.39Å; V66-L71 HydrophobicContact CG2-CD1 4.1Å; V66-L71 HydrophobicContact CG2-CG 3.97Å; V66-L85 HydrophobicContact CG1-CD1 4.37Å; V66-D376 HydrophobicContact CG1-CB 4.32Å; V66-W383 HydrophobicContact CB-CG 4.48Å; V66-W383 HydrophobicContact CG2-CB 4.24Å; V66-W383 HydrophobicContact CG2-CD2 4.16Å; V66-W383 HydrophobicContact CG2-CG 3.94Å
67	C	84.9	Confident	83.2	Confident	7 Å²	7	37.8 Å²	37.8	5%	0.047	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	140.6	170.4	-157.6	0	0	0	0	109.9	N69 Q70 L109 P111	C67-N69 PolarHBondContact O-N 2.69Å; C67-Q70 PolarHBondContact N-O 2.9Å; C67-Q70 WeakPolarHBondContact O-CA 2.81Å; C67-Q70 WeakPolarHBondContact O-CB 3.03Å; C67-Q70 PolarHBondContact O-N 2.83Å; C67-L109 HydrophobicContact CB-CD2 3.61Å; C67-L109 HydrophobicContact CB-CG 4.06Å; C67-P111 WeakPolarHBondContact SG-CA 3.31Å; C67-P111 PolarHBondContact SG-O 2.74Å; C67-P111 VanDerWaalsContact SG-O 3.33Å
68	N	81.6	Confident	83.4	Confident	54 Å²	54	39.2 Å²	39.2	29%	0.289	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	50.5	174.6	-163.2	21.3	0	0	0	114.1	Q70 T112 D376 I378	N68-Q70 PolarHBondContact O-N 2.87Å; N68-T112 PolarHBondContact ND2-O 3.34Å; N68-D376 PolarHBondContact N-OD1 3.49Å; N68-I378 HydrophobicContact CB-CD1 3.51Å; N68-I378 WeakPolarHBondContact OD1-CD1 3.47Å
69	N	81.5	Confident	83.9	Confident	76 Å²	76	35.3 Å²	35.3	41%	0.406	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	10.6	-174.3	-70.5	-19.5	0	0	0	115.5	C67 L85	C67-N69 PolarHBondContact O-N 2.69Å; N69-L85 HydrophobicContact CB-CB 4.24Å; N69-L85 WeakPolarHBondContact O-CB 3.13Å; N69-L85 WeakPolarHBondContact O-CG 3.4Å; N69-L85 PolarHBondContact O-N 3.49Å
70	Q	85.3	Confident	84.1	Confident	6 Å²	6	30.8 Å²	30.8	3%	0.028	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	123.4	172.5	-60.7	-65	-56.9	0	0	109	V66 C67 N68 D84 L109 R130	V66-Q70 VanDerWaalsContact CA-O 3.31Å; V66-Q70 WeakPolarHBondContact CA-O 3.43Å; C67-Q70 PolarHBondContact N-O 2.9Å; C67-Q70 WeakPolarHBondContact O-CA 2.81Å; C67-Q70 WeakPolarHBondContact O-CB 3.03Å; C67-Q70 PolarHBondContact O-N 2.83Å; N68-Q70 PolarHBondContact O-N 2.87Å; Q70-D84 PolarHBondContact NE2-OD2 3.31Å; Q70-L109 HydrophobicContact CB-CD2 4.41Å; Q70-R130 VanDerWaalsContact NE2-NH2 3.15Å
71	L	86.9	Confident	84.3	Confident	6 Å²	6	24.5 Å²	24.5	3%	0.031	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	114.1	174.1	-173.4	154.9	0	0	0	108.5	L64 V66 M73 R82 I83 L85 W383	L64-L71 HydrophobicContact CD1-CD1 4.4Å; L64-L71 HydrophobicContact CD1-CD2 4.09Å; L64-L71 HydrophobicContact CD1-CG 4.4Å; L64-L71 HydrophobicContact CG-CD2 4.37Å; L64-L71 HydrophobicContact CG-CG 4.43Å; V66-L71 HydrophobicContact CG2-CB 4.39Å; V66-L71 HydrophobicContact CG2-CD1 4.1Å; V66-L71 HydrophobicContact CG2-CG 3.97Å; L71-M73 HydrophobicContact CD2-CB 4.28Å; L71-M73 HydrophobicContact CD2-CE 3.25Å; L71-M73 HydrophobicContact CD2-CG 4.37Å; L71-R82 CarbonylContact O-C 3.51Å; L71-R82 WeakPolarHBondContact O-CA 3.4Å; L71-I83 HydrophobicContact CB-CB 4.42Å; L71-I83 HydrophobicContact CD2-CD1 4.41Å; L71-I83 PolarHBondContact N-O 3.48Å; L71-I83 PolarHBondContact O-N 2.84Å; L71-L85 HydrophobicContact CB-CD2 4.17Å; L71-L85 HydrophobicContact CB-CG 4.36Å; L71-L85 HydrophobicContact CD1-CD2 4.24Å; L71-W383 HydrophobicContact CD1-CE3 3.88Å; L71-W383 HydrophobicContact CD1-CH2 4.37Å; L71-W383 HydrophobicContact CD1-CZ3 3.6Å
72	C	87.7	Confident	84.2	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	125.4	174.1	-65.4	0	0	0	0	108.9	L64 A65 L81 L116	L64-C72 CarbonylContact C-O 3.4Å; L64-C72 WeakPolarHBondContact CA-O 3.18Å; A65-C72 PolarHBondContact N-O 2.89Å; A65-C72 PolarHBondContact O-N 3.05Å; C72-L81 CarbonylContact C-O 3.57Å; C72-L81 WeakPolarHBondContact CA-O 3.37Å; C72-L116 HydrophobicContact CB-CD1 4.33Å; C72-L116 HydrophobicContact CB-CD2 4.34Å
73	M	87.4	Confident	84.2	Confident	3 Å²	3	23 Å²	23	2%	0.015	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	140.7	174.9	66	174.7	76	0	0	110.9	F55 H63 L64 L71 L75 L80 L81 I83	F55-M73 HydrophobicContact CD1-CE 4.09Å; F55-M73 HydrophobicContact CE1-CE 3.61Å; F55-M73 HydrophobicContact CE1-SD 3.65Å; F55-M73 HydrophobicContact CZ-CE 4.31Å; F55-M73 HydrophobicContact CZ-SD 4.23Å; H63-M73 CarbonylContact O-C 3.52Å; H63-M73 VanDerWaalsContact O-CA 3.29Å; H63-M73 WeakPolarHBondContact O-CA 3.45Å; L64-M73 HydrophobicContact CD1-CB 4.24Å; L64-M73 HydrophobicContact CD1-CE 4.47Å; L64-M73 HydrophobicContact CG-CB 4.39Å; L71-M73 HydrophobicContact CD2-CB 4.28Å; L71-M73 HydrophobicContact CD2-CE 3.25Å; L71-M73 HydrophobicContact CD2-CG 4.37Å; M73-L75 HydrophobicContact CG-CG 4.39Å; M73-L75 HydrophobicContact SD-CD1 4.49Å; M73-L75 HydrophobicContact SD-CD2 3.99Å; M73-L75 HydrophobicContact SD-CG 4.29Å; M73-L80 WeakPolarHBondContact O-CA 3.45Å; M73-L81 HydrophobicContact CG-CB 3.66Å; M73-L81 HydrophobicContact CG-CD1 4.28Å; M73-L81 HydrophobicContact CG-CG 4.48Å; M73-L81 PolarHBondContact N-O 2.6Å; M73-L81 PolarHBondContact O-N 3.47Å; M73-L81 HydrophobicContact SD-CB 4.36Å; M73-L81 HydrophobicContact SD-CD1 3.96Å; M73-I83 HydrophobicContact CE-CD1 3.88Å
74	S	87.3	Confident	84.1	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.007	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	129.2	168.8	62.4	0	0	0	0	110	N62 H63 T79	N62-S74 PolarHBondContact N-O 2.91Å; H63-S74 WeakPolarHBondContact CB-OG 3.43Å; H63-S74 PolarHBondContact N-OG 3.21Å; H63-S74 VanDerWaalsContact N-OG 3.11Å; H63-S74 PolarHBondContact O-N 2.84Å; H63-S74 PolarHBondContact O-OG 2.85Å; S74-T79 WeakPolarHBondContact CA-O 3.42Å
75	L	83.6	Confident	83.6	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.01	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	130	-177.3	-67.8	-177.7	0	0	0	109.9	P57 P58 E59 I61 M73 K77 T79 L81	P57-L75 HydrophobicContact CB-CD2 3.85Å; P58-L75 HydrophobicContact CG-CD1 3.75Å; E59-L75 HydrophobicContact CB-CB 4.28Å; I61-L75 HydrophobicContact CB-CD2 4.44Å; I61-L75 HydrophobicContact CG1-CD2 3.75Å; M73-L75 HydrophobicContact CG-CG 4.39Å; M73-L75 HydrophobicContact SD-CD1 4.49Å; M73-L75 HydrophobicContact SD-CD2 3.99Å; M73-L75 HydrophobicContact SD-CG 4.29Å; L75-K77 PolarHBondContact O-N 2.94Å; L75-T79 HydrophobicContact CB-CG2 4.42Å; L75-T79 PolarHBondContact N-O 2.99Å; L75-T79 PolarHBondContact O-N 2.84Å; L75-L81 HydrophobicContact CD1-CD1 3.22Å; L75-L81 HydrophobicContact CD1-CG 3.78Å; L75-L81 HydrophobicContact CG-CD1 4.19Å
76	G	79.3	Confident	83.1	Confident	18 Å²	18	27.9 Å²	27.9	19%	0.186	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.4	-122.9	176.1	0	0	0	0	0	114.4	E59 R60 N62	E59-G76 WeakPolarHBondContact OE2-CA 3.19Å; R60-G76 PolarHBondContact O-N 2.55Å; N62-G76 PolarHBondContact ND2-O 3.49Å
77	K	70.1	Confident	82.6	Confident	140 Å²	140	33.4 Å²	33.4	61%	0.609	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-65.5	-178	-69.7	-172	-177.4	-175	0	110.8	L75 R98	L75-K77 PolarHBondContact O-N 2.94Å; K77-R98 PolarHBondContact O-NH1 2.81Å; K77-R98 PolarHBondContact O-NH2 3.04Å
78	D	76.5	Confident	81.9	Confident	52 Å²	52	36.6 Å²	36.6	28%	0.278	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	0.2	-161.2	-90.3	22.1	0	0	0	116.7	L96 R98	D78-L96 PolarHBondContact O-N 3Å; D78-R98 VanDerWaalsContact OD1-CB 3.26Å; D78-R98 WeakPolarHBondContact OD1-CB 3.19Å; D78-R98 WeakPolarHBondContact OD1-CD 3.19Å; D78-R98 WeakPolarHBondContact OD1-CG 3.08Å; D78-R98 IonicContact OD1-CZ 2.72Å; D78-R98 IonicContact OD1-NE 2.76Å; D78-R98 IonicContact OD1-NH1 3.82Å; D78-R98 VanDerWaalsContact OD2-CB 3.25Å; D78-R98 WeakPolarHBondContact OD2-CB 3.26Å; D78-R98 PolarHBondContact OD2-N 2.88Å; D78-R98 VanDerWaalsContact OD2-N 3.15Å
79	T	83.8	Confident	81.3	Confident	21 Å²	21	41.5 Å²	41.5	13%	0.129	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	132.6	-170.9	-55.7	0	0	0	0	112.2	S74 L75 Q93	S74-T79 WeakPolarHBondContact CA-O 3.42Å; L75-T79 HydrophobicContact CB-CG2 4.42Å; L75-T79 PolarHBondContact N-O 2.99Å; L75-T79 PolarHBondContact O-N 2.84Å; T79-Q93 HydrophobicContact CG2-CG 3.59Å
80	L	85.9	Confident	80.7	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	129.5	166.1	-172.6	82.4	0	0	0	108.8	M73 Q93 T94 L96 L107 L116 I118 L128	M73-L80 WeakPolarHBondContact O-CA 3.45Å; L80-Q93 WeakPolarHBondContact O-CA 3.38Å; L80-T94 PolarHBondContact N-O 2.78Å; L80-T94 PolarHBondContact O-N 2.8Å; L80-L96 HydrophobicContact CB-CD1 4.16Å; L80-L96 HydrophobicContact CB-CG 4.43Å; L80-L107 HydrophobicContact CD1-CD1 4.29Å; L80-L107 HydrophobicContact CD1-CD2 4.15Å; L80-L116 HydrophobicContact CD1-CD2 4.29Å; L80-L116 HydrophobicContact CD2-CD2 3.56Å; L80-L116 HydrophobicContact CG-CD2 4.49Å; L80-I118 HydrophobicContact CD1-CD1 4.32Å; L80-I118 HydrophobicContact CD2-CD1 3.96Å; L80-L128 HydrophobicContact CD2-CD2 3.46Å; L80-L128 VanDerWaalsContact CD2-CD2 3.46Å
81	L	86	Confident	80.1	Confident	6 Å²	6	47.9 Å²	47.9	3%	0.031	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	132.8	170.4	-72.3	178	0	0	0	109.8	F55 C72 M73 L75 Q93	F55-L81 HydrophobicContact CZ-CD1 3.96Å; C72-L81 CarbonylContact C-O 3.57Å; C72-L81 WeakPolarHBondContact CA-O 3.37Å; M73-L81 HydrophobicContact CG-CB 3.66Å; M73-L81 HydrophobicContact CG-CD1 4.28Å; M73-L81 HydrophobicContact CG-CG 4.48Å; M73-L81 PolarHBondContact N-O 2.6Å; M73-L81 PolarHBondContact O-N 3.47Å; M73-L81 HydrophobicContact SD-CB 4.36Å; M73-L81 HydrophobicContact SD-CD1 3.96Å; L75-L81 HydrophobicContact CD1-CD1 3.22Å; L75-L81 HydrophobicContact CD1-CG 3.78Å; L75-L81 HydrophobicContact CG-CD1 4.19Å; L81-Q93 HydrophobicContact CD2-CB 3.62Å; L81-Q93 HydrophobicContact CD2-CG 3.73Å
82	R	84.4	Confident	79.6	Confident	10 Å²	10	51.1 Å²	51.1	4%	0.038	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	122.1	169.7	-171.4	171.3	-168.5	160	3.9	108.8	L71 N92 G113 F114 R130	L71-R82 CarbonylContact O-C 3.51Å; L71-R82 WeakPolarHBondContact O-CA 3.4Å; R82-N92 HydrophobicContact CB-CB 4.33Å; R82-N92 PolarHBondContact N-O 3.27Å; R82-N92 WeakPolarHBondContact O-CB 3.38Å; R82-N92 PolarHBondContact O-N 2.85Å; R82-N92 VanDerWaalsContact O-N 3.15Å; R82-G113 PolarHBondContact NH2-O 3.14Å; R82-F114 PolarHBondContact NH2-O 3.14Å; R82-R130 VanDerWaalsContact NH1-CA 3.26Å
83	I	85.7	Confident	79.3	Confident	14 Å²	14	56.5 Å²	56.5	7%	0.072	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	125.3	-176.2	-51.6	-177.3	0	0	0	107.7	F55 L71 M73 L91	F55-I83 HydrophobicContact CE2-CD1 4.41Å; F55-I83 HydrophobicContact CZ-CD1 4.37Å; L71-I83 HydrophobicContact CB-CB 4.42Å; L71-I83 HydrophobicContact CD2-CD1 4.41Å; L71-I83 PolarHBondContact N-O 3.48Å; L71-I83 PolarHBondContact O-N 2.84Å; M73-I83 HydrophobicContact CE-CD1 3.88Å; I83-L91 HydrophobicContact CD1-CD2 3.65Å; I83-L91 HydrophobicContact CG1-CD2 3.72Å
84	D	82.4	Confident	79	Confident	34 Å²	34	56.9 Å²	56.9	18%	0.182	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	115.1	167.7	-164.6	-35.3	0	0	0	108.3	Q70 A86 K87 R130	Q70-D84 PolarHBondContact NE2-OD2 3.31Å; D84-A86 PolarHBondContact O-N 2.81Å; D84-A86 VanDerWaalsContact O-N 3.16Å; D84-A86 WeakPolarHBondContact OD1-CB 3.18Å; D84-A86 PolarHBondContact OD1-N 2.92Å; D84-K87 CarbonylContact O-C 3.54Å; D84-K87 PolarHBondContact O-N 3.37Å; D84-R130 IonicContact OD2-NH2 2.6Å; D84-R130 PolarHBondContact OD2-NH2 2.85Å
85	L	79.4	Confident	78.6	Confident	55 Å²	55	63.9 Å²	63.9	29%	0.288	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.8	-177.6	-64.6	178.1	0	0	0	112.7	V66 N69 L71 W383	V66-L85 HydrophobicContact CG1-CD1 4.37Å; N69-L85 HydrophobicContact CB-CB 4.24Å; N69-L85 WeakPolarHBondContact O-CB 3.13Å; N69-L85 WeakPolarHBondContact O-CG 3.4Å; N69-L85 PolarHBondContact O-N 3.49Å; L71-L85 HydrophobicContact CB-CD2 4.17Å; L71-L85 HydrophobicContact CB-CG 4.36Å; L71-L85 HydrophobicContact CD1-CD2 4.24Å; L85-W383 HydrophobicContact CD1-CH2 3.5Å; L85-W383 VanDerWaalsContact CD1-CH2 3.5Å; L85-W383 HydrophobicContact CD1-CZ2 3.42Å; L85-W383 VanDerWaalsContact CD1-CZ2 3.42Å; L85-W383 HydrophobicContact CD1-CZ3 4.48Å; L85-W383 HydrophobicContact CD2-CH2 3.75Å; L85-W383 HydrophobicContact CD2-CZ3 4.32Å; L85-W383 HydrophobicContact CG-CH2 4.3Å
86	A	77.8	Confident	78.1	Confident	73 Å²	73	64.3 Å²	64.3	60%	0.603	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-22.5	171.8	0	0	0	0	0	112.9	D84	D84-A86 PolarHBondContact O-N 2.81Å; D84-A86 VanDerWaalsContact O-N 3.16Å; D84-A86 WeakPolarHBondContact OD1-CB 3.18Å; D84-A86 PolarHBondContact OD1-N 2.92Å
87	K	76.5	Confident	77.3	Confident	123 Å²	123	66.9 Å²	66.9	54%	0.535	36%	0.364	S	S	.	.			trans	-137.1	71.5	-179.8	-66.4	-178.3	-177.7	176.3	0	110	D84 D89 Q90	D84-K87 CarbonylContact O-C 3.54Å; D84-K87 PolarHBondContact O-N 3.37Å; K87-D89 PolarHBondContact O-N 2.97Å; K87-D89 VanDerWaalsContact O-N 3.11Å; K87-Q90 PolarHBondContact O-N 3.15Å
88	P	70.7	Confident	77.1	Confident	75 Å²	75	62 Å²	62	49%	0.487	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-21.8	-173.6	25.6	-34.6	0	0	0	113.6	Q90	P88-Q90 VanDerWaalsContact C-N 3.3Å; P88-Q90 PolarHBondContact O-N 3.1Å
89	D	68.1	Low	76.4	Confident	156 Å²	156	67.9 Å²	67.9	83%	0.834	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-14.6	-177	-55.7	-34.4	0	0	0	113.8	K87	K87-D89 PolarHBondContact O-N 2.97Å; K87-D89 VanDerWaalsContact O-N 3.11Å
90	Q	69.7	Low	75.2	Confident	123 Å²	123	75.9 Å²	75.9	58%	0.575	40%	0.4	S	S	*	.			trans	-100	84.8	178.4	-67.8	-176.8	-3	0	0	110.4	K87 P88 N92	K87-Q90 PolarHBondContact O-N 3.15Å; P88-Q90 VanDerWaalsContact C-N 3.3Å; P88-Q90 PolarHBondContact O-N 3.1Å; Q90-N92 PolarHBondContact O-N 2.98Å
91	L	71.9	Confident	74.2	Confident	94 Å²	94	82.6 Å²	82.6	49%	0.492	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	114	176.2	-63.8	172.6	0	0	0	110.4	F55 I83	F55-L91 HydrophobicContact CE2-CD2 4.48Å; I83-L91 HydrophobicContact CD1-CD2 3.65Å; I83-L91 HydrophobicContact CG1-CD2 3.72Å
92	N	77.6	Confident	73.5	Confident	73 Å²	73	82.9 Å²	82.9	39%	0.39	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	101.2	171	-74.3	-42.2	0	0	0	109.4	R82 Q90 Q133	R82-N92 HydrophobicContact CB-CB 4.33Å; R82-N92 PolarHBondContact N-O 3.27Å; R82-N92 WeakPolarHBondContact O-CB 3.38Å; R82-N92 PolarHBondContact O-N 2.85Å; R82-N92 VanDerWaalsContact O-N 3.15Å; Q90-N92 PolarHBondContact O-N 2.98Å; N92-Q133 PolarHBondContact OD1-NE2 2.82Å
93	Q	80.4	Confident	73.3	Confident	114 Å²	114	88.5 Å²	88.5	53%	0.533	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	126.9	175.5	-170.3	173.4	-9.9	0	0	110.4	T79 L80 L81	T79-Q93 HydrophobicContact CG2-CG 3.59Å; L80-Q93 WeakPolarHBondContact O-CA 3.38Å; L81-Q93 HydrophobicContact CD2-CB 3.62Å; L81-Q93 HydrophobicContact CD2-CG 3.73Å
94	T	81.6	Confident	73.3	Confident	10 Å²	10	88.2 Å²	88.2	6%	0.061	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	130.4	178.2	-42.8	0	0	0	0	109.5	L80 L128 Q133 V135	L80-T94 PolarHBondContact N-O 2.78Å; L80-T94 PolarHBondContact O-N 2.8Å; T94-L128 HydrophobicContact CG2-CD1 4.48Å; T94-Q133 VanDerWaalsContact CG2-O 3.27Å; T94-Q133 WeakPolarHBondContact CG2-O 3.45Å; T94-Q133 PolarHBondContact OG1-OE1 3.26Å; T94-V135 HydrophobicContact CG2-CG2 3.62Å
95	E	78.2	Confident	73.5	Confident	148 Å²	148	90.2 Å²	90.2	69%	0.692	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	137.5	174.2	-66.7	-178.2	174.2	0	0	110.5
96	L	74.8	Confident	73.9	Confident	12 Å²	12	89.2 Å²	89.2	6%	0.063	46%	0.461	C	S	.	.			trans	-88.8	-5.5	-174.2	-69.1	162.3	0	0	0	113.6	D78 L80 R98 V104 I118 L126 V135	D78-L96 PolarHBondContact O-N 3Å; L80-L96 HydrophobicContact CB-CD1 4.16Å; L80-L96 HydrophobicContact CB-CG 4.43Å; L96-R98 HydrophobicContact CB-CG 4.03Å; L96-V104 HydrophobicContact CD1-CG2 4.29Å; L96-I118 HydrophobicContact CD1-CD1 4.5Å; L96-I118 HydrophobicContact CD2-CD1 3.57Å; L96-L126 HydrophobicContact CB-CD1 4.43Å; L96-L126 HydrophobicContact CD2-CD1 3.87Å; L96-V135 HydrophobicContact CD2-CG1 3.96Å; L96-V135 HydrophobicContact CD2-CG2 3.95Å
97	G	61	Low	74.5	Confident	72 Å²	72	86.5 Å²	86.5	74%	0.742	44%	0.437	S	S	*	.			trans	58.6	57.9	170.5	0	0	0	0	0	114.3
98	R	66.4	Low	75.1	Confident	37 Å²	37	81.9 Å²	81.9	14%	0.14	42%	0.417	C	S	.	.			trans	-97.7	164.6	-163.8	-61.8	-160	-161.4	148.2	20.1	115.7	K77 D78 L96 S102	K77-R98 PolarHBondContact O-NH1 2.81Å; K77-R98 PolarHBondContact O-NH2 3.04Å; D78-R98 VanDerWaalsContact OD1-CB 3.26Å; D78-R98 WeakPolarHBondContact OD1-CB 3.19Å; D78-R98 WeakPolarHBondContact OD1-CD 3.19Å; D78-R98 WeakPolarHBondContact OD1-CG 3.08Å; D78-R98 IonicContact OD1-CZ 2.72Å; D78-R98 IonicContact OD1-NE 2.76Å; D78-R98 IonicContact OD1-NH1 3.82Å; D78-R98 VanDerWaalsContact OD2-CB 3.25Å; D78-R98 WeakPolarHBondContact OD2-CB 3.26Å; D78-R98 PolarHBondContact OD2-N 2.88Å; D78-R98 VanDerWaalsContact OD2-N 3.15Å; L96-R98 HydrophobicContact CB-CG 4.03Å; R98-S102 VanDerWaalsContact CB-OG 3.31Å; R98-S102 WeakPolarHBondContact CB-OG 3.44Å; R98-S102 WeakPolarHBondContact CD-O 3.11Å; R98-S102 WeakPolarHBondContact CD-OG 3.45Å; R98-S102 PolarHBondContact NH1-O 3.49Å
99	K	62.1	Low	76	Confident	176 Å²	176	79.2 Å²	79.2	77%	0.765	40%	0.398	S	S	*	.			trans	-85.6	147.8	160.5	-64.6	-179.9	-179.3	175.7	0	109.3	D101 S102	K99-D101 PolarHBondContact O-N 2.74Å; K99-S102 PolarHBondContact O-N 2.78Å; K99-S102 PolarHBondContact O-OG 2.86Å
100	E	57.8	Low	77	Confident	188 Å²	188	71.9 Å²	71.9	88%	0.879	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-22	-164.3	-66	-170.6	152.6	0	0	116.9
101	D	64.9	Low	77.6	Confident	141 Å²	141	66.7 Å²	66.7	75%	0.754	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-4.7	-177.2	-71.9	-32.2	0	0	0	115.9	K99 N121	K99-D101 PolarHBondContact O-N 2.74Å; D101-N121 PolarHBondContact O-ND2 3.38Å
102	S	72.5	Confident	78	Confident	13 Å²	13	63.4 Å²	63.4	9%	0.091	32%	0.319	C	S	.	.			trans	-90	117.1	-172.6	56.6	0	0	0	0	113.2	R98 K99 N121	R98-S102 VanDerWaalsContact CB-OG 3.31Å; R98-S102 WeakPolarHBondContact CB-OG 3.44Å; R98-S102 WeakPolarHBondContact CD-O 3.11Å; R98-S102 WeakPolarHBondContact CD-OG 3.45Å; R98-S102 PolarHBondContact NH1-O 3.49Å; K99-S102 PolarHBondContact O-N 2.78Å; K99-S102 PolarHBondContact O-OG 2.86Å; S102-N121 WeakPolarHBondContact CA-OD1 3.44Å
103	K	80.4	Confident	78.2	Confident	127 Å²	127	59.9 Å²	59.9	55%	0.552	30%	0.301	S	S	*	.			trans	-111.2	147.3	176	-68.2	-177.5	-177.7	175.5	0	110.5	Y105 L120 N121	K103-Y105 PolarHBondContact O-N 3.29Å; K103-L120 WeakPolarHBondContact O-CA 3.29Å; K103-N121 PolarHBondContact N-OD1 3.11Å; K103-N121 PolarHBondContact O-N 3.23Å; K103-N121 PolarHBondContact O-OD1 2.96Å
104	V	85.6	Confident	78.4	Confident	9 Å²	9	55.9 Å²	55.9	6%	0.055	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	126.7	170.2	-175.8	0	0	0	0	108.8	H63 L96 L107 I118 L120	H63-V104 PolarHBondContact NE2-O 3.2Å; L96-V104 HydrophobicContact CD1-CG2 4.29Å; V104-L107 HydrophobicContact CG1-CD2 3.89Å; V104-L107 HydrophobicContact CG1-CG 4.11Å; V104-I118 HydrophobicContact CG1-CG2 3.92Å; V104-I118 HydrophobicContact CG2-CG2 4.12Å; V104-L120 HydrophobicContact CG2-CD2 4.31Å
105	Y	86	Confident	78.7	Confident	75 Å²	75	55.4 Å²	55.4	29%	0.294	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-49.3	174.5	177.3	-111	0	0	0	111.4	H63 K103 S119 L145 E147	H63-Y105 PolarHBondContact CE1-O 2.61Å; H63-Y105 PolarHBondContact NE2-O 2.95Å; H63-Y105 VanDerWaalsContact NE2-O 3.14Å; K103-Y105 PolarHBondContact O-N 3.29Å; Y105-S119 WeakPolarHBondContact CA-O 3.49Å; Y105-S119 WeakPolarHBondContact CB-O 3.25Å; Y105-S119 PolarHBondContact N-O 2.81Å; Y105-L145 HydrophobicContact CD1-CD1 3.76Å; Y105-L145 HydrophobicContact CD1-CD2 4.5Å; Y105-L145 HydrophobicContact CD1-CG 4.16Å; Y105-L145 HydrophobicContact CE1-CD1 4.2Å; Y105-L145 HydrophobicContact CE1-CD2 4.17Å; Y105-L145 HydrophobicContact CE1-CG 4.09Å; Y105-L145 HydrophobicContact CG-CD1 4.07Å; Y105-E147 VanDerWaalsContact CE1-OE2 3.3Å; Y105-E147 WeakPolarHBondContact CE1-OE2 3.12Å; Y105-E147 PolarHBondContact OH-OE2 3.33Å
106	K	86.9	Confident	79.2	Confident	34 Å²	34	48.4 Å²	48.4	15%	0.148	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	152.2	177.4	-74	-172.2	-176.7	-174.4	0	111.9	F108 S119 E147	K106-F108 HydrophobicContact CB-CE1 4.38Å; K106-F108 HydrophobicContact CB-CE2 3.76Å; K106-F108 HydrophobicContact CB-CZ 3.65Å; K106-F108 HydrophobicContact CD-CE1 4.19Å; K106-F108 HydrophobicContact CD-CZ 3.73Å; K106-F108 HydrophobicContact CG-CZ 4.33Å; K106-S119 PolarHBondContact N-O 2.87Å; K106-S119 PolarHBondContact O-N 3.43Å; K106-E147 WeakPolarHBondContact CD-O 3.36Å; K106-E147 PolarHBondContact NZ-O 2.88Å; K106-E147 IonicContact NZ-OE1 2.96Å; K106-E147 PolarHBondContact NZ-OE1 3.29Å; K106-E147 IonicContact NZ-OE2 3.06Å
107	L	90.5	Very high	80	Confident	17 Å²	17	47.8 Å²	47.8	9%	0.089	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	131.4	171.5	-64	177	0	0	0	109	H63 A65 L80 V104 L116 I118	H63-L107 HydrophobicContact CB-CD1 3.66Å; H63-L107 HydrophobicContact CB-CG 3.84Å; A65-L107 HydrophobicContact CB-CB 4.28Å; L80-L107 HydrophobicContact CD1-CD1 4.29Å; L80-L107 HydrophobicContact CD1-CD2 4.15Å; V104-L107 HydrophobicContact CG1-CD2 3.89Å; V104-L107 HydrophobicContact CG1-CG 4.11Å; L107-L116 HydrophobicContact CB-CD1 4.5Å; L107-I118 HydrophobicContact CD2-CB 4.09Å; L107-I118 HydrophobicContact CD2-CD1 4.33Å; L107-I118 HydrophobicContact CD2-CG1 3.68Å; L107-I118 HydrophobicContact CD2-CG2 3.82Å
108	F	90.8	Very high	81.4	Confident	26 Å²	26	44.4 Å²	44.4	11%	0.114	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	112.1	175	-50.9	-83.4	0	0	0	108.8	K106 L117 I146 V149 W151	K106-F108 HydrophobicContact CB-CE1 4.38Å; K106-F108 HydrophobicContact CB-CE2 3.76Å; K106-F108 HydrophobicContact CB-CZ 3.65Å; K106-F108 HydrophobicContact CD-CE1 4.19Å; K106-F108 HydrophobicContact CD-CZ 3.73Å; K106-F108 HydrophobicContact CG-CZ 4.33Å; F108-L117 HydrophobicContact CB-CB 4.23Å; F108-L117 HydrophobicContact CD2-CB 4.38Å; F108-L117 PolarHBondContact N-O 3.4Å; F108-L117 PolarHBondContact O-N 3.09Å; F108-I146 HydrophobicContact CD2-CG2 4.46Å; F108-I146 HydrophobicContact CE2-CB 4.16Å; F108-I146 HydrophobicContact CE2-CG2 3.67Å; F108-I146 HydrophobicContact CZ-CG2 3.86Å; F108-V149 HydrophobicContact CB-CB 4.35Å; F108-V149 HydrophobicContact CB-CG2 4.12Å; F108-V149 HydrophobicContact CD1-CB 4.17Å; F108-V149 HydrophobicContact CD1-CG2 3.95Å; F108-V149 HydrophobicContact CD2-CG2 3.89Å; F108-V149 HydrophobicContact CE1-CG2 4.31Å; F108-V149 HydrophobicContact CE2-CG2 4.25Å; F108-V149 HydrophobicContact CG-CB 4.23Å; F108-V149 HydrophobicContact CG-CG2 3.72Å; F108-V149 HydrophobicContact CZ-CG2 4.44Å; F108-W151 HydrophobicContact CB-CZ2 4.14Å
109	L	89.4	Confident	82.5	Confident	19 Å²	19	42.6 Å²	42.6	10%	0.099	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	133.4	176.5	-175.2	65.8	0	0	0	108.5	A65 C67 Q70 L116 W151	A65-L109 HydrophobicContact CB-CB 4.06Å; C67-L109 HydrophobicContact CB-CD2 3.61Å; C67-L109 HydrophobicContact CB-CG 4.06Å; Q70-L109 HydrophobicContact CB-CD2 4.41Å; L109-L116 HydrophobicContact CB-CD1 4.13Å; L109-L116 HydrophobicContact CD1-CB 4.22Å; L109-L116 HydrophobicContact CD1-CD1 4.08Å; L109-W151 PolarHBondContact O-NE1 2.94Å
110	D	87.6	Confident	83.7	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.011	17%	0.165	C	C	.	.			trans	-64.8	141.1	175.2	171.6	14.1	0	0	0	111	T112 G113 H115 W151	D110-T112 VanDerWaalsContact CG-OG1 3.29Å; D110-T112 PolarHBondContact O-N 2.91Å; D110-T112 PolarHBondContact OD1-N 3.33Å; D110-T112 PolarHBondContact OD2-OG1 2.79Å; D110-G113 WeakPolarHBondContact O-CA 3.49Å; D110-G113 PolarHBondContact O-N 2.9Å; D110-H115 HydrophobicContact CB-CB 3.93Å; D110-H115 WeakPolarHBondContact CB-O 3.23Å; D110-H115 PolarHBondContact N-O 3.38Å; D110-H115 IonicContact OD2-CD2 2.79Å; D110-H115 PolarHBondContact OD2-CD2 2.77Å; D110-W151 HydrophobicContact CB-CD2 3.98Å; D110-W151 HydrophobicContact CB-CE3 3.86Å; D110-W151 HydrophobicContact CB-CH2 4.14Å; D110-W151 HydrophobicContact CB-CZ2 4.22Å; D110-W151 HydrophobicContact CB-CZ3 3.96Å
111	P	82.4	Confident	85.1	Confident	14 Å²	14	29 Å²	29	9%	0.091	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-35	-36.1	164.1	-36.3	33.4	0	0	0	117.2	C67 G113 W151 K153 L281	C67-P111 WeakPolarHBondContact SG-CA 3.31Å; C67-P111 PolarHBondContact SG-O 2.74Å; C67-P111 VanDerWaalsContact SG-O 3.33Å; P111-G113 VanDerWaalsContact C-N 3.31Å; P111-W151 VanDerWaalsContact CD-CG 3.49Å; P111-W151 HydrophobicContact CG-CB 3.91Å; P111-W151 HydrophobicContact CG-CG 4.35Å; P111-K153 HydrophobicContact CG-CG 4.2Å; P111-L281 HydrophobicContact CB-CD1 4.06Å; P111-L281 HydrophobicContact CB-CD2 4.23Å; P111-L281 HydrophobicContact CB-CG 4.43Å
112	T	80.7	Confident	86	Confident	24 Å²	24	25.4 Å²	25.4	15%	0.147	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-17.5	178.8	71.4	0	0	0	0	113.4	N68 D110 F114	N68-T112 PolarHBondContact ND2-O 3.34Å; D110-T112 VanDerWaalsContact CG-OG1 3.29Å; D110-T112 PolarHBondContact O-N 2.91Å; D110-T112 PolarHBondContact OD1-N 3.33Å; D110-T112 PolarHBondContact OD2-OG1 2.79Å; T112-F114 VanDerWaalsContact C-N 3.31Å; T112-F114 WeakPolarHBondContact OG1-CD2 3.49Å; T112-F114 PolarHBondContact OG1-N 3.09Å
113	G	82.1	Confident	86.5	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.132	C	C	.	.	S	Bend	trans	74.6	13.1	-175.8	0	0	0	0	0	114.2	R82 D110 P111	R82-G113 PolarHBondContact NH2-O 3.14Å; D110-G113 WeakPolarHBondContact O-CA 3.49Å; D110-G113 PolarHBondContact O-N 2.9Å; P111-G113 VanDerWaalsContact C-N 3.31Å
114	F	84.6	Confident	86.8	Confident	30 Å²	30	23.4 Å²	23.4	13%	0.132	12%	0.12	C	C	.	.	S	Bend	trans	-91.1	-50.7	176.9	-69	-73	0	0	0	112.8	R82 T112 N129 R130 E158	R82-F114 PolarHBondContact NH2-O 3.14Å; T112-F114 VanDerWaalsContact C-N 3.31Å; T112-F114 WeakPolarHBondContact OG1-CD2 3.49Å; T112-F114 PolarHBondContact OG1-N 3.09Å; F114-N129 PolarHBondContact O-OD1 2.82Å; F114-R130 HydrophobicContact CD1-CB 3.91Å; F114-R130 HydrophobicContact CD1-CG 4.42Å; F114-R130 PolarHBondContact O-N 3.47Å; F114-E158 HydrophobicContact CD1-CB 4.4Å; F114-E158 HydrophobicContact CD1-CG 4.09Å; F114-E158 HydrophobicContact CD2-CB 4.49Å; F114-E158 HydrophobicContact CD2-CG 3.91Å; F114-E158 HydrophobicContact CE1-CG 3.82Å; F114-E158 HydrophobicContact CE2-CG 3.66Å; F114-E158 HydrophobicContact CG-CB 4.38Å; F114-E158 HydrophobicContact CG-CG 4.15Å; F114-E158 HydrophobicContact CZ-CG 3.61Å; F114-E158 WeakPolarHBondContact CZ-OE1 3.48Å
115	H	88.2	Confident	86.9	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	129.8	-174.1	-58.5	-63.8	0	0	0	112.5	D110 Y127 W151 N157 E158 T161	D110-H115 HydrophobicContact CB-CB 3.93Å; D110-H115 WeakPolarHBondContact CB-O 3.23Å; D110-H115 PolarHBondContact N-O 3.38Å; D110-H115 IonicContact OD2-CD2 2.79Å; D110-H115 PolarHBondContact OD2-CD2 2.77Å; H115-Y127 HydrophobicContact CB-CE2 4.08Å; H115-Y127 PolarHBondContact CE1-OH 2.98Å; H115-Y127 VanDerWaalsContact CE1-OH 3.29Å; H115-Y127 AromaticContact ND1-CE2 3.72Å; H115-Y127 AromaticContact ND1-CZ 3.65Å; H115-Y127 PolarHBondContact ND1-OH 2.8Å; H115-W151 HydrophobicContact CB-CH2 4.32Å; H115-W151 HydrophobicContact CB-CZ3 4.36Å; H115-N157 PolarHBondContact NE2-O 3.19Å; H115-E158 PolarHBondContact CE1-O 2.88Å; H115-T161 HydrophobicContact CB-CG2 3.96Å
116	L	89	Confident	87	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	126.6	175.5	179.3	72.2	0	0	0	110.5	C72 L80 L107 L109 I118 L128	C72-L116 HydrophobicContact CB-CD1 4.33Å; C72-L116 HydrophobicContact CB-CD2 4.34Å; L80-L116 HydrophobicContact CD1-CD2 4.29Å; L80-L116 HydrophobicContact CD2-CD2 3.56Å; L80-L116 HydrophobicContact CG-CD2 4.49Å; L107-L116 HydrophobicContact CB-CD1 4.5Å; L109-L116 HydrophobicContact CB-CD1 4.13Å; L109-L116 HydrophobicContact CD1-CB 4.22Å; L109-L116 HydrophobicContact CD1-CD1 4.08Å; L116-I118 HydrophobicContact CD2-CD1 4.13Å; L116-I118 HydrophobicContact CD2-CG1 4.19Å; L116-I118 HydrophobicContact CG-CG1 4.13Å; L116-L128 HydrophobicContact CB-CB 4.42Å; L116-L128 HydrophobicContact CD2-CD2 4.27Å; L116-L128 PolarHBondContact N-O 2.73Å; L116-L128 PolarHBondContact O-N 3Å
117	L	90.4	Very high	87.1	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	137.3	171.3	-63.5	171.6	0	0	0	110.5	F108 L126 Y127 L138 W141 V149 W151 I164 I178	F108-L117 HydrophobicContact CB-CB 4.23Å; F108-L117 HydrophobicContact CD2-CB 4.38Å; F108-L117 PolarHBondContact N-O 3.4Å; F108-L117 PolarHBondContact O-N 3.09Å; L117-L126 WeakPolarHBondContact CA-O 3.05Å; L117-Y127 HydrophobicContact CD2-CD2 3.78Å; L117-Y127 HydrophobicContact CD2-CG 4.4Å; L117-L138 HydrophobicContact CD2-CD1 3.84Å; L117-W141 HydrophobicContact CD1-CH2 4.09Å; L117-W141 HydrophobicContact CD1-CZ3 4.41Å; L117-V149 HydrophobicContact CD1-CG1 4.46Å; L117-V149 HydrophobicContact CD1-CG2 4.34Å; L117-W151 HydrophobicContact CD1-CH2 3.59Å; L117-W151 HydrophobicContact CD1-CZ2 3.95Å; L117-W151 HydrophobicContact CG-CH2 3.93Å; L117-W151 HydrophobicContact CG-CZ2 4.32Å; L117-I164 HydrophobicContact CD1-CD1 4.26Å; L117-I178 HydrophobicContact CD1-CD1 4.21Å; L117-I178 HydrophobicContact CD2-CD1 3.57Å; L117-I178 HydrophobicContact CG-CD1 4.41Å
118	I	90.2	Very high	86.9	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	110.6	-175.7	-50.8	176.5	0	0	0	106.7	L80 L96 V104 L107 L116 L120 C125 L126	L80-I118 HydrophobicContact CD1-CD1 4.32Å; L80-I118 HydrophobicContact CD2-CD1 3.96Å; L96-I118 HydrophobicContact CD1-CD1 4.5Å; L96-I118 HydrophobicContact CD2-CD1 3.57Å; V104-I118 HydrophobicContact CG1-CG2 3.92Å; V104-I118 HydrophobicContact CG2-CG2 4.12Å; L107-I118 HydrophobicContact CD2-CB 4.09Å; L107-I118 HydrophobicContact CD2-CD1 4.33Å; L107-I118 HydrophobicContact CD2-CG1 3.68Å; L107-I118 HydrophobicContact CD2-CG2 3.82Å; L116-I118 HydrophobicContact CD2-CD1 4.13Å; L116-I118 HydrophobicContact CD2-CG1 4.19Å; L116-I118 HydrophobicContact CG-CG1 4.13Å; I118-L120 HydrophobicContact CG2-CD2 4.28Å; I118-C125 CarbonylContact O-C 3.46Å; I118-C125 WeakPolarHBondContact O-CA 3.49Å; I118-L126 HydrophobicContact CB-CB 4.18Å; I118-L126 PolarHBondContact N-O 3.26Å; I118-L126 PolarHBondContact O-N 2.61Å
119	S	89.9	Confident	86.7	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	133.2	174.3	-169.9	0	0	0	0	109.5	Y105 K106	Y105-S119 WeakPolarHBondContact CA-O 3.49Å; Y105-S119 WeakPolarHBondContact CB-O 3.25Å; Y105-S119 PolarHBondContact N-O 2.81Å; K106-S119 PolarHBondContact N-O 2.87Å; K106-S119 PolarHBondContact O-N 3.43Å
120	L	88.1	Confident	86.3	Confident	3 Å²	3	20.1 Å²	20.1	2%	0.016	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	154.2	177	-57.5	179.7	0	0	0	110.8	K103 V104 I118 T122 S123 E124 L126 L145	K103-L120 WeakPolarHBondContact O-CA 3.29Å; V104-L120 HydrophobicContact CG2-CD2 4.31Å; I118-L120 HydrophobicContact CG2-CD2 4.28Å; L120-T122 PolarHBondContact O-N 2.84Å; L120-T122 VanDerWaalsContact O-N 3.14Å; L120-S123 PolarHBondContact O-N 2.8Å; L120-S123 VanDerWaalsContact O-N 3.09Å; L120-E124 WeakPolarHBondContact CB-O 3.49Å; L120-E124 HydrophobicContact CD1-CB 4.19Å; L120-E124 PolarHBondContact N-O 3.06Å; L120-L126 HydrophobicContact CD1-CD1 3.97Å; L120-L126 HydrophobicContact CD1-CG 4.21Å; L120-L126 HydrophobicContact CD2-CD1 4.44Å; L120-L126 HydrophobicContact CG-CD1 4.41Å; L120-L145 WeakPolarHBondContact O-CD1 3.34Å
121	N	86.6	Confident	85.9	Confident	76 Å²	76	25.2 Å²	25.2	41%	0.406	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-19.8	173.3	65.3	-21.6	0	0	0	113.8	D101 S102 K103 S123	D101-N121 PolarHBondContact O-ND2 3.38Å; S102-N121 WeakPolarHBondContact CA-OD1 3.44Å; K103-N121 PolarHBondContact N-OD1 3.11Å; K103-N121 PolarHBondContact O-N 3.23Å; K103-N121 PolarHBondContact O-OD1 2.96Å; N121-S123 PolarHBondContact O-N 2.85Å
122	T	83.4	Confident	85.5	Confident	65 Å²	65	25.8 Å²	25.8	40%	0.399	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	7.6	175.6	51.9	0	0	0	0	113.7	L120 E124	L120-T122 PolarHBondContact O-N 2.84Å; L120-T122 VanDerWaalsContact O-N 3.14Å; T122-E124 PolarHBondContact O-N 2.78Å
123	S	83.8	Confident	85.1	Confident	32 Å²	32	29.3 Å²	29.3	22%	0.224	15%	0.149	C	C	.	.	S	Bend	trans	60.5	26.8	-173.9	-52.3	0	0	0	0	113.5	L120 N121 G143	L120-S123 PolarHBondContact O-N 2.8Å; L120-S123 VanDerWaalsContact O-N 3.09Å; N121-S123 PolarHBondContact O-N 2.85Å; S123-G143 PolarHBondContact O-N 3.21Å
124	E	86.8	Confident	85	Confident	65 Å²	65	36.8 Å²	36.8	30%	0.304	18%	0.182	S	C	.	.			trans	-100.7	145.6	167.8	-68.8	-172.5	166.9	0	0	109.8	L120 T122	L120-E124 WeakPolarHBondContact CB-O 3.49Å; L120-E124 HydrophobicContact CD1-CB 4.19Å; L120-E124 PolarHBondContact N-O 3.06Å; T122-E124 PolarHBondContact O-N 2.78Å
125	C	87.3	Confident	84.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	129.8	-179.9	-61.7	0	0	0	0	110.4	I118 L138 W141 I146	I118-C125 CarbonylContact O-C 3.46Å; I118-C125 WeakPolarHBondContact O-CA 3.49Å; C125-L138 HydrophobicContact CB-CD1 4.33Å; C125-L138 PolarHBondContact O-N 2.88Å; C125-W141 HydrophobicContact CB-CB 4.31Å; C125-I146 HydrophobicContact CB-CD1 3.87Å; C125-I146 WeakPolarHBondContact SG-CD1 3.4Å; C125-I146 VanDerWaalsContact SG-CG1 3.51Å
126	L	88.4	Confident	84.7	Confident	13 Å²	13	40.5 Å²	40.5	7%	0.068	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	147.2	-179.5	-51.1	173.7	0	0	0	109.7	L96 L117 I118 L120 V135 R136	L96-L126 HydrophobicContact CB-CD1 4.43Å; L96-L126 HydrophobicContact CD2-CD1 3.87Å; L117-L126 WeakPolarHBondContact CA-O 3.05Å; I118-L126 HydrophobicContact CB-CB 4.18Å; I118-L126 PolarHBondContact N-O 3.26Å; I118-L126 PolarHBondContact O-N 2.61Å; L120-L126 HydrophobicContact CD1-CD1 3.97Å; L120-L126 HydrophobicContact CD1-CG 4.21Å; L120-L126 HydrophobicContact CD2-CD1 4.44Å; L120-L126 HydrophobicContact CG-CD1 4.41Å; L126-V135 HydrophobicContact CB-CG1 3.78Å; L126-V135 HydrophobicContact CD1-CG1 3.97Å; L126-V135 HydrophobicContact CD2-CG1 4.33Å; L126-V135 HydrophobicContact CG-CG1 4.25Å; L126-R136 CarbonylContact C-O 3.59Å; L126-R136 WeakPolarHBondContact CA-O 3.43Å
127	Y	89.1	Confident	84.4	Confident	4 Å²	4	42.5 Å²	42.5	2%	0.016	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	136.7	-179.8	170	-107.7	0	0	0	110.5	H115 L117 N129 R136 I178 P190	H115-Y127 HydrophobicContact CB-CE2 4.08Å; H115-Y127 PolarHBondContact CE1-OH 2.98Å; H115-Y127 VanDerWaalsContact CE1-OH 3.29Å; H115-Y127 AromaticContact ND1-CE2 3.72Å; H115-Y127 AromaticContact ND1-CZ 3.65Å; H115-Y127 PolarHBondContact ND1-OH 2.8Å; L117-Y127 HydrophobicContact CD2-CD2 3.78Å; L117-Y127 HydrophobicContact CD2-CG 4.4Å; Y127-N129 HydrophobicContact CE1-CB 4.4Å; Y127-R136 PolarHBondContact N-O 3.39Å; Y127-R136 PolarHBondContact O-N 3.11Å; Y127-I178 HydrophobicContact CD1-CG2 4.15Å; Y127-I178 HydrophobicContact CD2-CD1 4.47Å; Y127-I178 HydrophobicContact CD2-CG2 4.01Å; Y127-I178 HydrophobicContact CE1-CG2 3.96Å; Y127-I178 HydrophobicContact CE2-CG2 3.82Å; Y127-I178 HydrophobicContact CG-CG2 4.16Å; Y127-P190 HydrophobicContact CD1-CB 3.99Å; Y127-P190 HydrophobicContact CD1-CG 4.29Å; Y127-P190 HydrophobicContact CE1-CB 4.24Å
128	L	87.3	Confident	84.2	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.016	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	126	177.5	-175.3	67.8	0	0	0	109.7	L80 T94 L116 T132 V135	L80-L128 HydrophobicContact CD2-CD2 3.46Å; L80-L128 VanDerWaalsContact CD2-CD2 3.46Å; T94-L128 HydrophobicContact CG2-CD1 4.48Å; L116-L128 HydrophobicContact CB-CB 4.42Å; L116-L128 HydrophobicContact CD2-CD2 4.27Å; L116-L128 PolarHBondContact N-O 2.73Å; L116-L128 PolarHBondContact O-N 3Å; L128-T132 VanDerWaalsContact CD1-O 3.24Å; L128-T132 WeakPolarHBondContact CD1-O 3.31Å; L128-V135 HydrophobicContact CD1-CG2 4.21Å
129	N	85.8	Confident	83.8	Confident	5 Å²	5	44.9 Å²	44.9	3%	0.027	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	153.6	170.7	-163.8	-17.1	0	0	0	109.7	F114 Y127 N131 T132 E158 A180	F114-N129 PolarHBondContact O-OD1 2.82Å; Y127-N129 HydrophobicContact CE1-CB 4.4Å; N129-N131 VanDerWaalsContact C-N 3.26Å; N129-N131 PolarHBondContact O-N 3.2Å; N129-T132 PolarHBondContact O-N 2.88Å; N129-E158 PolarHBondContact ND2-O 3.31Å; N129-A180 HydrophobicContact CB-CB 4.4Å; N129-A180 WeakPolarHBondContact ND2-CB 3.42Å
130	R	81.4	Confident	83.5	Confident	87 Å²	87	50.6 Å²	50.6	33%	0.328	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-39.9	173.1	-167.4	178	-179.2	-178.8	-0.5	113.1	Q70 R82 D84 F114 T132	Q70-R130 VanDerWaalsContact NE2-NH2 3.15Å; R82-R130 VanDerWaalsContact NH1-CA 3.26Å; D84-R130 IonicContact OD2-NH2 2.6Å; D84-R130 PolarHBondContact OD2-NH2 2.85Å; F114-R130 HydrophobicContact CD1-CB 3.91Å; F114-R130 HydrophobicContact CD1-CG 4.42Å; F114-R130 PolarHBondContact O-N 3.47Å; R130-T132 VanDerWaalsContact C-N 3.29Å; R130-T132 PolarHBondContact O-N 3.41Å
131	N	78	Confident	83.4	Confident	108 Å²	108	50.6 Å²	50.6	58%	0.578	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-14	-174.4	-64.9	-11.6	0	0	0	112.7	N129	N129-N131 VanDerWaalsContact C-N 3.26Å; N129-N131 PolarHBondContact O-N 3.2Å
132	T	75.1	Confident	83.3	Confident	27 Å²	27	53.5 Å²	53.5	17%	0.166	26%	0.257	C	S	.	.			trans	-122.8	133.2	-174.9	60.8	0	0	0	0	111.4	L128 N129 R130 K134	L128-T132 VanDerWaalsContact CD1-O 3.24Å; L128-T132 WeakPolarHBondContact CD1-O 3.31Å; N129-T132 PolarHBondContact O-N 2.88Å; R130-T132 VanDerWaalsContact C-N 3.29Å; R130-T132 PolarHBondContact O-N 3.41Å; T132-K134 VanDerWaalsContact C-N 3.32Å
133	Q	72.4	Confident	83.3	Confident	97 Å²	97	52.9 Å²	52.9	45%	0.453	26%	0.263	S	S	.	.			trans	-86.7	-4.6	174.3	-67.2	-71.7	-10.5	0	0	112.5	N92 T94	N92-Q133 PolarHBondContact OD1-NE2 2.82Å; T94-Q133 VanDerWaalsContact CG2-O 3.27Å; T94-Q133 WeakPolarHBondContact CG2-O 3.45Å; T94-Q133 PolarHBondContact OG1-OE1 3.26Å
134	K	78.8	Confident	83.5	Confident	158 Å²	158	53.6 Å²	53.6	69%	0.687	26%	0.263	S	S	*	.			trans	-87.8	115.7	-179.6	-70.4	-174.9	-179.7	178	0	110.6	T132	T132-K134 VanDerWaalsContact C-N 3.32Å
135	V	81.8	Confident	83.6	Confident	40 Å²	40	52 Å²	52	24%	0.242	26%	0.256	C	S	.	.			trans	-71.7	128.8	171.9	-177.2	0	0	0	0	109.3	T94 L96 L126 L128	T94-V135 HydrophobicContact CG2-CG2 3.62Å; L96-V135 HydrophobicContact CD2-CG1 3.96Å; L96-V135 HydrophobicContact CD2-CG2 3.95Å; L126-V135 HydrophobicContact CB-CG1 3.78Å; L126-V135 HydrophobicContact CD1-CG1 3.97Å; L126-V135 HydrophobicContact CD2-CG1 4.33Å; L126-V135 HydrophobicContact CG-CG1 4.25Å; L128-V135 HydrophobicContact CD1-CG2 4.21Å
136	R	84.6	Confident	83.8	Confident	68 Å²	68	52.1 Å²	52.1	26%	0.257	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	139.5	178.5	-60.5	-172.2	-174.6	-157.5	5.8	110.7	L126 Y127 E182 P190	L126-R136 CarbonylContact C-O 3.59Å; L126-R136 WeakPolarHBondContact CA-O 3.43Å; Y127-R136 PolarHBondContact N-O 3.39Å; Y127-R136 PolarHBondContact O-N 3.11Å; R136-E182 IonicContact NH2-OE1 3.38Å; R136-E182 PolarHBondContact NH2-OE1 3.03Å; R136-P190 HydrophobicContact CB-CG 4.08Å
137	S	83.9	Confident	83.8	Confident	41 Å²	41	52.5 Å²	52.5	29%	0.287	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	133.5	175.3	-177.2	0	0	0	0	110.3	S139 R142	S137-S139 PolarHBondContact O-N 3.15Å; S137-R142 PolarHBondContact OG-NH2 2.79Å
138	L	84.7	Confident	83.8	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.259	C	S	.	.			trans	-86.1	103.1	177.4	-59.6	-178.9	0	0	0	109.7	L117 C125 R140 W141 I178 P190 D191	L117-L138 HydrophobicContact CD2-CD1 3.84Å; C125-L138 HydrophobicContact CB-CD1 4.33Å; C125-L138 PolarHBondContact O-N 2.88Å; L138-R140 PolarHBondContact O-N 2.86Å; L138-W141 HydrophobicContact CB-CB 3.99Å; L138-W141 HydrophobicContact CB-CD2 4.49Å; L138-W141 HydrophobicContact CB-CG 3.86Å; L138-W141 HydrophobicContact CD1-CD2 3.82Å; L138-W141 HydrophobicContact CD1-CE3 4.26Å; L138-W141 HydrophobicContact CD1-CG 4.08Å; L138-W141 HydrophobicContact CD1-CH2 4.5Å; L138-W141 HydrophobicContact CD1-CZ2 4.18Å; L138-W141 PolarHBondContact O-N 2.81Å; L138-I178 HydrophobicContact CD1-CD1 4.07Å; L138-P190 HydrophobicContact CD2-CB 4.5Å; L138-P190 HydrophobicContact CD2-CG 3.64Å; L138-D191 HydrophobicContact CD2-CB 4.22Å
139	S	82.3	Confident	84	Confident	51 Å²	51	53 Å²	53	36%	0.357	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-66.5	-38.6	-172.6	64.7	0	0	0	0	113.3	S137 W141 N189	S137-S139 PolarHBondContact O-N 3.15Å; S139-W141 VanDerWaalsContact C-N 3.28Å; S139-W141 PolarHBondContact O-N 2.78Å; S139-N189 PolarHBondContact OG-ND2 2.83Å
140	R	84.3	Confident	84.2	Confident	120 Å²	120	52.8 Å²	52.8	45%	0.453	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-75.9	-13.8	-177.8	-63.7	170.5	-179.4	177.4	-3.7	114.2	L138 D191 Q192 F194	L138-R140 PolarHBondContact O-N 2.86Å; R140-D191 WeakPolarHBondContact CB-OD2 2.9Å; R140-D191 VanDerWaalsContact CD-OD2 3.24Å; R140-D191 WeakPolarHBondContact CD-OD2 3.5Å; R140-D191 WeakPolarHBondContact CG-OD2 3.43Å; R140-D191 PolarHBondContact N-OD2 3.06Å; R140-D191 VanDerWaalsContact N-OD2 3.12Å; R140-D191 IonicContact NE-OD2 3.04Å; R140-D191 PolarHBondContact NH1-O 2.92Å; R140-Q192 PolarHBondContact NH1-O 2.82Å; R140-F194 HydrophobicContact CB-CB 4.12Å
141	W	86.6	Confident	84.5	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.008	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-95.4	-5.6	-176.3	-64	49.3	0	0	0	112.2	L117 C125 L138 S139 H144 I146 I164 V166 A176 I178 F194	L117-W141 HydrophobicContact CD1-CH2 4.09Å; L117-W141 HydrophobicContact CD1-CZ3 4.41Å; C125-W141 HydrophobicContact CB-CB 4.31Å; L138-W141 HydrophobicContact CB-CB 3.99Å; L138-W141 HydrophobicContact CB-CD2 4.49Å; L138-W141 HydrophobicContact CB-CG 3.86Å; L138-W141 HydrophobicContact CD1-CD2 3.82Å; L138-W141 HydrophobicContact CD1-CE3 4.26Å; L138-W141 HydrophobicContact CD1-CG 4.08Å; L138-W141 HydrophobicContact CD1-CH2 4.5Å; L138-W141 HydrophobicContact CD1-CZ2 4.18Å; L138-W141 PolarHBondContact O-N 2.81Å; S139-W141 VanDerWaalsContact C-N 3.28Å; S139-W141 PolarHBondContact O-N 2.78Å; W141-H144 PolarHBondContact O-N 3.05Å; W141-I146 HydrophobicContact CE3-CD1 3.44Å; W141-I146 VanDerWaalsContact CE3-CD1 3.44Å; W141-I146 HydrophobicContact CE3-CG1 4.04Å; W141-I146 HydrophobicContact CZ3-CD1 3.43Å; W141-I146 VanDerWaalsContact CZ3-CD1 3.43Å; W141-I146 HydrophobicContact CZ3-CG1 4.21Å; W141-I164 HydrophobicContact CH2-CD1 4.05Å; W141-V166 HydrophobicContact CE3-CG1 4.1Å; W141-V166 HydrophobicContact CE3-CG2 4.5Å; W141-V166 HydrophobicContact CH2-CB 4.42Å; W141-V166 HydrophobicContact CH2-CG1 4.29Å; W141-V166 HydrophobicContact CH2-CG2 3.32Å; W141-V166 HydrophobicContact CZ2-CG2 4.14Å; W141-V166 HydrophobicContact CZ3-CB 4.17Å; W141-V166 HydrophobicContact CZ3-CG1 3.57Å; W141-V166 HydrophobicContact CZ3-CG2 3.52Å; W141-A176 HydrophobicContact CH2-CB 4.16Å; W141-A176 HydrophobicContact CZ2-CB 3.48Å; W141-A176 VanDerWaalsContact CZ2-CB 3.48Å; W141-I178 HydrophobicContact CH2-CD1 4.14Å; W141-I178 HydrophobicContact CZ2-CD1 3.81Å; W141-I178 HydrophobicContact CZ2-CG1 4.19Å; W141-F194 AromaticContact CD1-CD2 3.78Å; W141-F194 AromaticContact CD2-CD2 3.78Å; W141-F194 HydrophobicContact CD2-CD2 3.78Å; W141-F194 AromaticContact CD2-CE2 3.58Å; W141-F194 HydrophobicContact CD2-CE2 3.58Å; W141-F194 HydrophobicContact CD2-CZ 4.31Å; W141-F194 AromaticContact CE2-CD2 3.51Å; W141-F194 AromaticContact CE2-CE2 3.73Å; W141-F194 HydrophobicContact CE3-CD2 4.44Å; W141-F194 AromaticContact CE3-CE2 3.83Å; W141-F194 HydrophobicContact CE3-CE2 3.83Å; W141-F194 HydrophobicContact CE3-CZ 4.48Å; W141-F194 HydrophobicContact CG-CD2 4.01Å; W141-F194 AromaticContact CG-CE2 3.99Å; W141-F194 HydrophobicContact CG-CE2 3.99Å; W141-F194 HydrophobicContact CG-CG 4.45Å; W141-F194 HydrophobicContact CG-CZ 4.41Å; W141-F194 HydrophobicContact CZ2-CD2 4.06Å; W141-F194 HydrophobicContact CZ2-CE2 4.22Å; W141-F194 HydrophobicContact CZ3-CE2 4.31Å; W141-F194 AromaticContact NE1-CD2 3.43Å; W141-F194 AromaticContact NE1-CG 3.97Å
142	R	84.1	Confident	84.7	Confident	138 Å²	138	44.9 Å²	44.9	52%	0.521	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	137.3	-177.5	-71.1	-174.3	179.1	178.4	-1.3	111.6	S137 H144	S137-R142 PolarHBondContact OG-NH2 2.79Å; R142-H144 VanDerWaalsContact C-N 3.33Å
143	G	83.1	Confident	84.8	Confident	51 Å²	51	45.4 Å²	45.4	53%	0.526	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.7	-9.1	-179.7	0	0	0	0	0	113.6	S123	S123-G143 PolarHBondContact O-N 3.21Å
144	H	87.2	Confident	84.9	Confident	48 Å²	48	44.7 Å²	44.7	22%	0.222	22%	0.222	C	C	.	.			trans	-109.1	120	174.2	-61.1	-66	0	0	0	110.4	W141 R142 I146 T168 F174 F194	W141-H144 PolarHBondContact O-N 3.05Å; R142-H144 VanDerWaalsContact C-N 3.33Å; H144-I146 PolarHBondContact O-N 3.02Å; H144-T168 HydrophobicContact CB-CG2 3.92Å; H144-F174 AromaticContact CE1-CZ 3.82Å; H144-F174 AromaticContact NE2-CZ 3.82Å; H144-F194 AromaticContact CD2-CE1 3.95Å
145	L	89.1	Confident	84.7	Confident	32 Å²	32	39.7 Å²	39.7	17%	0.168	20%	0.202	C	C	.	.			trans	-80.5	115.3	172.1	-175.3	68.1	0	0	0	108.9	Y105 L120 T168 S169	Y105-L145 HydrophobicContact CD1-CD1 3.76Å; Y105-L145 HydrophobicContact CD1-CD2 4.5Å; Y105-L145 HydrophobicContact CD1-CG 4.16Å; Y105-L145 HydrophobicContact CE1-CD1 4.2Å; Y105-L145 HydrophobicContact CE1-CD2 4.17Å; Y105-L145 HydrophobicContact CE1-CG 4.09Å; Y105-L145 HydrophobicContact CG-CD1 4.07Å; L120-L145 WeakPolarHBondContact O-CD1 3.34Å; L145-T168 CarbonylContact O-C 3.57Å; L145-T168 VanDerWaalsContact O-CA 3.32Å; L145-T168 WeakPolarHBondContact O-CA 3.41Å; L145-S169 PolarHBondContact O-N 2.76Å
146	I	91	Very high	84.4	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	126.2	-179.7	-54	167.1	0	0	0	109.4	F108 C125 W141 H144 V149 V166	F108-I146 HydrophobicContact CD2-CG2 4.46Å; F108-I146 HydrophobicContact CE2-CB 4.16Å; F108-I146 HydrophobicContact CE2-CG2 3.67Å; F108-I146 HydrophobicContact CZ-CG2 3.86Å; C125-I146 HydrophobicContact CB-CD1 3.87Å; C125-I146 WeakPolarHBondContact SG-CD1 3.4Å; C125-I146 VanDerWaalsContact SG-CG1 3.51Å; W141-I146 HydrophobicContact CE3-CD1 3.44Å; W141-I146 VanDerWaalsContact CE3-CD1 3.44Å; W141-I146 HydrophobicContact CE3-CG1 4.04Å; W141-I146 HydrophobicContact CZ3-CD1 3.43Å; W141-I146 VanDerWaalsContact CZ3-CD1 3.43Å; W141-I146 HydrophobicContact CZ3-CG1 4.21Å; H144-I146 PolarHBondContact O-N 3.02Å; I146-V149 HydrophobicContact CG2-CG2 3.83Å; I146-V166 HydrophobicContact CB-CG1 4.46Å; I146-V166 HydrophobicContact CD1-CG1 4.37Å; I146-V166 HydrophobicContact CG1-CG1 3.96Å; I146-V166 HydrophobicContact CG2-CG1 3.81Å
147	E	89.1	Confident	84.2	Confident	21 Å²	21	39.8 Å²	39.8	10%	0.098	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-37.8	177.6	-169.6	63.8	-157.8	0	0	112	Y105 K106 G167 P208 V209	Y105-E147 VanDerWaalsContact CE1-OE2 3.3Å; Y105-E147 WeakPolarHBondContact CE1-OE2 3.12Å; Y105-E147 PolarHBondContact OH-OE2 3.33Å; K106-E147 WeakPolarHBondContact CD-O 3.36Å; K106-E147 PolarHBondContact NZ-O 2.88Å; K106-E147 IonicContact NZ-OE1 2.96Å; K106-E147 PolarHBondContact NZ-OE1 3.29Å; K106-E147 IonicContact NZ-OE2 3.06Å; E147-G167 PolarHBondContact N-O 2.94Å; E147-P208 HydrophobicContact CG-CB 4.29Å; E147-V209 VanDerWaalsContact CB-O 3.32Å; E147-V209 WeakPolarHBondContact CB-O 3.4Å; E147-V209 VanDerWaalsContact CG-O 3.24Å; E147-V209 WeakPolarHBondContact CG-O 3.34Å
148	S	89.6	Confident	84	Confident	5 Å²	5	42.5 Å²	42.5	4%	0.035	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	154.6	-178.6	55.9	0	0	0	0	112.5	G167 V209	S148-G167 PolarHBondContact N-O 2.78Å; S148-G167 PolarHBondContact O-N 2.83Å; S148-V209 WeakPolarHBondContact CB-O 3.45Å; S148-V209 PolarHBondContact OG-O 3.3Å
149	V	91.1	Very high	83.8	Confident	14 Å²	14	45.8 Å²	45.8	9%	0.085	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	122.5	174.8	-179.4	0	0	0	0	108.3	F108 L117 I146 W151 I164 L165	F108-V149 HydrophobicContact CB-CB 4.35Å; F108-V149 HydrophobicContact CB-CG2 4.12Å; F108-V149 HydrophobicContact CD1-CB 4.17Å; F108-V149 HydrophobicContact CD1-CG2 3.95Å; F108-V149 HydrophobicContact CD2-CG2 3.89Å; F108-V149 HydrophobicContact CE1-CG2 4.31Å; F108-V149 HydrophobicContact CE2-CG2 4.25Å; F108-V149 HydrophobicContact CG-CB 4.23Å; F108-V149 HydrophobicContact CG-CG2 3.72Å; F108-V149 HydrophobicContact CZ-CG2 4.44Å; L117-V149 HydrophobicContact CD1-CG1 4.46Å; L117-V149 HydrophobicContact CD1-CG2 4.34Å; I146-V149 HydrophobicContact CG2-CG2 3.83Å; V149-W151 HydrophobicContact CG1-CD2 4.02Å; V149-W151 HydrophobicContact CG1-CG 4.41Å; V149-W151 HydrophobicContact CG1-CH2 4.49Å; V149-W151 HydrophobicContact CG1-CZ2 4Å; V149-I164 HydrophobicContact CG1-CD1 4.17Å; V149-L165 CarbonylContact C-O 3.46Å; V149-L165 WeakPolarHBondContact CA-O 3.46Å
150	G	89.2	Confident	83.8	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	108.2	170.2	0	0	0	0	0	109.7	L165 L212 I214	G150-L165 PolarHBondContact N-O 2.93Å; G150-L165 PolarHBondContact O-N 2.86Å; G150-L212 VanDerWaalsContact CA-O 3.26Å; G150-L212 WeakPolarHBondContact CA-O 3.3Å; G150-I214 WeakPolarHBondContact O-CD1 3.45Å
151	W	88.1	Confident	83.7	Confident	21 Å²	21	38.7 Å²	38.7	8%	0.08	21%	0.206	C	C	.	.			trans	-82.5	141.9	179.6	-63.4	101.5	0	0	0	111.5	F108 L109 D110 P111 H115 L117 V149 K153 T161 I164	F108-W151 HydrophobicContact CB-CZ2 4.14Å; L109-W151 PolarHBondContact O-NE1 2.94Å; D110-W151 HydrophobicContact CB-CD2 3.98Å; D110-W151 HydrophobicContact CB-CE3 3.86Å; D110-W151 HydrophobicContact CB-CH2 4.14Å; D110-W151 HydrophobicContact CB-CZ2 4.22Å; D110-W151 HydrophobicContact CB-CZ3 3.96Å; P111-W151 VanDerWaalsContact CD-CG 3.49Å; P111-W151 HydrophobicContact CG-CB 3.91Å; P111-W151 HydrophobicContact CG-CG 4.35Å; H115-W151 HydrophobicContact CB-CH2 4.32Å; H115-W151 HydrophobicContact CB-CZ3 4.36Å; L117-W151 HydrophobicContact CD1-CH2 3.59Å; L117-W151 HydrophobicContact CD1-CZ2 3.95Å; L117-W151 HydrophobicContact CG-CH2 3.93Å; L117-W151 HydrophobicContact CG-CZ2 4.32Å; V149-W151 HydrophobicContact CG1-CD2 4.02Å; V149-W151 HydrophobicContact CG1-CG 4.41Å; V149-W151 HydrophobicContact CG1-CH2 4.49Å; V149-W151 HydrophobicContact CG1-CZ2 4Å; W151-K153 PolarHBondContact O-N 3.36Å; W151-T161 HydrophobicContact CZ3-CG2 3.74Å; W151-I164 HydrophobicContact CE3-CG2 3.73Å; W151-I164 HydrophobicContact CZ3-CD1 4.23Å; W151-I164 HydrophobicContact CZ3-CG2 4.16Å
152	N	82.4	Confident	83.6	Confident	8 Å²	8	38.8 Å²	38.8	4%	0.043	21%	0.208	C	C	.	.			trans	-87.2	105.7	172.2	-172.7	-27.8	0	0	0	110.5	L154 L155 G156 P163	N152-L154 PolarHBondContact O-N 2.88Å; N152-L154 PolarHBondContact OD1-N 3.19Å; N152-L154 VanDerWaalsContact OD1-N 3.12Å; N152-L155 PolarHBondContact OD1-N 2.73Å; N152-G156 PolarHBondContact O-N 3.45Å; N152-P163 VanDerWaalsContact CB-O 3.3Å; N152-P163 WeakPolarHBondContact CB-O 3.33Å
153	K	77.1	Confident	83.7	Confident	37 Å²	37	32.6 Å²	32.6	16%	0.161	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-15	-174.6	-61.6	173.5	-174.6	168.6	0	114.6	P111 W151 E213 E215	P111-K153 HydrophobicContact CG-CG 4.2Å; W151-K153 PolarHBondContact O-N 3.36Å; K153-E213 WeakPolarHBondContact CE-OE1 3.24Å; K153-E213 IonicContact NZ-OE1 2.77Å; K153-E213 PolarHBondContact NZ-OE1 3.23Å; K153-E215 IonicContact NZ-OE1 2.67Å; K153-E215 PolarHBondContact NZ-OE1 3.17Å
154	L	74.4	Confident	84	Confident	83 Å²	83	30.1 Å²	30.1	44%	0.435	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-39	-173.3	-67.2	171.1	0	0	0	113.3	N152 R216	N152-L154 PolarHBondContact O-N 2.88Å; N152-L154 PolarHBondContact OD1-N 3.19Å; N152-L154 VanDerWaalsContact OD1-N 3.12Å; L154-R216 HydrophobicContact CD1-CB 3.9Å; L154-R216 VanDerWaalsContact CD1-CD 3.44Å; L154-R216 HydrophobicContact CD1-CG 4.3Å
155	L	75.6	Confident	84.2	Confident	52 Å²	52	27.9 Å²	27.9	27%	0.272	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-11.1	-175.1	-62.6	178.6	0	0	0	113.6	N152 N157 P163 E244	N152-L155 PolarHBondContact OD1-N 2.73Å; L155-N157 PolarHBondContact O-N 3.04Å; L155-P163 HydrophobicContact CD1-CG 4.07Å; L155-E244 HydrophobicContact CD1-CB 4.41Å
156	G	74.9	Confident	84.3	Confident	9 Å²	9	26.3 Å²	26.3	9%	0.093	14%	0.142	C	C	.	.			trans	-70.6	123.1	176.8	0	0	0	0	0	112.4	N152	N152-G156 PolarHBondContact O-N 3.45Å
157	N	79.8	Confident	84.3	Confident	102 Å²	102	26.3 Å²	26.3	55%	0.545	14%	0.142	S	C	.	.			trans	-124.8	-174.7	176.8	-71.6	-14.4	0	0	0	110	H115 L155 T159 S160	H115-N157 PolarHBondContact NE2-O 3.19Å; L155-N157 PolarHBondContact O-N 3.04Å; N157-T159 VanDerWaalsContact C-N 3.26Å; N157-T159 PolarHBondContact O-N 3.06Å; N157-S160 PolarHBondContact N-O 2.82Å
158	E	79.5	Confident	84.4	Confident	97 Å²	97	25.3 Å²	25.3	45%	0.453	14%	0.137	S	C	.	.	S	Bend	trans	-66.6	-25.7	179.1	-55.5	-170.7	166.9	0	0	114.1	F114 H115 N129	F114-E158 HydrophobicContact CD1-CB 4.4Å; F114-E158 HydrophobicContact CD1-CG 4.09Å; F114-E158 HydrophobicContact CD2-CB 4.49Å; F114-E158 HydrophobicContact CD2-CG 3.91Å; F114-E158 HydrophobicContact CE1-CG 3.82Å; F114-E158 HydrophobicContact CE2-CG 3.66Å; F114-E158 HydrophobicContact CG-CB 4.38Å; F114-E158 HydrophobicContact CG-CG 4.15Å; F114-E158 HydrophobicContact CZ-CG 3.61Å; F114-E158 WeakPolarHBondContact CZ-OE1 3.48Å; H115-E158 PolarHBondContact CE1-O 2.88Å; N129-E158 PolarHBondContact ND2-O 3.31Å
159	T	80.9	Confident	84.4	Confident	70 Å²	70	27 Å²	27	43%	0.429	15%	0.149	S	C	.	.	S	Bend	trans	-107.2	-19.2	-170.9	56.1	0	0	0	0	114.1	N157 S179 A180	N157-T159 VanDerWaalsContact C-N 3.26Å; N157-T159 PolarHBondContact O-N 3.06Å; T159-S179 CarbonylContact O-C 3.47Å; T159-S179 WeakPolarHBondContact O-CA 3.49Å; T159-S179 PolarHBondContact O-OG 2.6Å; T159-A180 PolarHBondContact O-N 3.05Å
160	S	83.2	Confident	84.2	Confident	20 Å²	20	30.9 Å²	30.9	14%	0.14	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	140.9	175.3	-177	0	0	0	0	109.8	N157 G162 E177 I178	N157-S160 PolarHBondContact N-O 2.82Å; S160-G162 PolarHBondContact O-N 2.97Å; S160-G162 PolarHBondContact OG-N 3.47Å; S160-G162 VanDerWaalsContact OG-N 3.16Å; S160-E177 PolarHBondContact OG-OE1 2.79Å; S160-I178 WeakPolarHBondContact CA-O 3.4Å; S160-I178 PolarHBondContact OG-O 3.25Å
161	T	81.8	Confident	84	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.006	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	-13.6	172.9	59.7	0	0	0	0	112.7	H115 W151 I178	H115-T161 HydrophobicContact CB-CG2 3.96Å; W151-T161 HydrophobicContact CZ3-CG2 3.74Å; T161-I178 HydrophobicContact CG2-CB 3.93Å; T161-I178 PolarHBondContact N-O 2.97Å; T161-I178 PolarHBondContact OG1-N 3.14Å; T161-I178 PolarHBondContact OG1-O 2.86Å
162	G	84.1	Confident	84.1	Confident	5 Å²	5	31 Å²	31	5%	0.052	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	63.2	-171.7	-161.5	0	0	0	0	0	111.9	S160 I164	S160-G162 PolarHBondContact O-N 2.97Å; S160-G162 PolarHBondContact OG-N 3.47Å; S160-G162 VanDerWaalsContact OG-N 3.16Å; G162-I164 PolarHBondContact O-N 2.7Å
163	P	85.9	Confident	84.4	Confident	7 Å²	7	30.7 Å²	30.7	5%	0.045	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	116.9	176.5	27.9	-32.4	0	0	0	110.1	N152 L155 L248	N152-P163 VanDerWaalsContact CB-O 3.3Å; N152-P163 WeakPolarHBondContact CB-O 3.33Å; L155-P163 HydrophobicContact CD1-CG 4.07Å; P163-L248 HydrophobicContact CB-CD1 4.43Å; P163-L248 HydrophobicContact CB-CG 4.49Å
164	I	90.2	Very high	85.1	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	153.9	176.7	59.8	165.9	0	0	0	110.4	L117 W141 V149 W151 G162 V166 E175 A176 I178	L117-I164 HydrophobicContact CD1-CD1 4.26Å; W141-I164 HydrophobicContact CH2-CD1 4.05Å; V149-I164 HydrophobicContact CG1-CD1 4.17Å; W151-I164 HydrophobicContact CE3-CG2 3.73Å; W151-I164 HydrophobicContact CZ3-CD1 4.23Å; W151-I164 HydrophobicContact CZ3-CG2 4.16Å; G162-I164 PolarHBondContact O-N 2.7Å; I164-V166 HydrophobicContact CD1-CG2 4.26Å; I164-V166 HydrophobicContact CG1-CG2 4.46Å; I164-E175 WeakPolarHBondContact O-CA 3.01Å; I164-A176 HydrophobicContact CG1-CB 4.14Å; I164-A176 WeakPolarHBondContact CG1-O 3.13Å; I164-A176 PolarHBondContact N-O 2.66Å; I164-A176 PolarHBondContact O-N 3.33Å; I164-I178 HydrophobicContact CD1-CD1 4.4Å
165	L	90.8	Very high	85.8	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	139.6	172.4	-63.9	176.2	0	0	0	110.5	V149 G150 I173 F174 E175 L212 I214 I224 L248 F252	V149-L165 CarbonylContact C-O 3.46Å; V149-L165 WeakPolarHBondContact CA-O 3.46Å; G150-L165 PolarHBondContact N-O 2.93Å; G150-L165 PolarHBondContact O-N 2.86Å; L165-I173 HydrophobicContact CB-CG2 4.39Å; L165-I173 HydrophobicContact CD2-CG2 4.24Å; L165-F174 CarbonylContact C-O 3.51Å; L165-F174 WeakPolarHBondContact CA-O 3.4Å; L165-E175 HydrophobicContact CD2-CB 4.09Å; L165-E175 HydrophobicContact CD2-CG 4.25Å; L165-L212 HydrophobicContact CB-CD1 4.21Å; L165-I214 HydrophobicContact CB-CD1 3.98Å; L165-I214 HydrophobicContact CD1-CD1 3.74Å; L165-I214 HydrophobicContact CD1-CG1 3.82Å; L165-I214 HydrophobicContact CG-CD1 3.64Å; L165-I214 HydrophobicContact CG-CG1 4.28Å; L165-I224 HydrophobicContact CD1-CD1 3.79Å; L165-I224 HydrophobicContact CD1-CG1 4.17Å; L165-I224 HydrophobicContact CD1-CG2 3.82Å; L165-L248 HydrophobicContact CD1-CD1 4.19Å; L165-L248 HydrophobicContact CD2-CB 4.32Å; L165-L248 HydrophobicContact CD2-CD1 4.03Å; L165-L248 HydrophobicContact CG-CD1 3.81Å; L165-F252 HydrophobicContact CD1-CE2 3.96Å; L165-F252 HydrophobicContact CD1-CZ 3.92Å; L165-F252 HydrophobicContact CD2-CE2 4.08Å
166	V	91.2	Very high	86.4	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	118.5	-174.9	-176.2	0	0	0	0	108.4	W141 I146 I164 I173 F174 A176 F194	W141-V166 HydrophobicContact CE3-CG1 4.1Å; W141-V166 HydrophobicContact CE3-CG2 4.5Å; W141-V166 HydrophobicContact CH2-CB 4.42Å; W141-V166 HydrophobicContact CH2-CG1 4.29Å; W141-V166 HydrophobicContact CH2-CG2 3.32Å; W141-V166 HydrophobicContact CZ2-CG2 4.14Å; W141-V166 HydrophobicContact CZ3-CB 4.17Å; W141-V166 HydrophobicContact CZ3-CG1 3.57Å; W141-V166 HydrophobicContact CZ3-CG2 3.52Å; I146-V166 HydrophobicContact CB-CG1 4.46Å; I146-V166 HydrophobicContact CD1-CG1 4.37Å; I146-V166 HydrophobicContact CG1-CG1 3.96Å; I146-V166 HydrophobicContact CG2-CG1 3.81Å; I164-V166 HydrophobicContact CD1-CG2 4.26Å; I164-V166 HydrophobicContact CG1-CG2 4.46Å; V166-I173 CarbonylContact O-C 3.59Å; V166-I173 WeakPolarHBondContact O-CA 3.31Å; V166-F174 HydrophobicContact CB-CB 4.29Å; V166-F174 PolarHBondContact N-O 2.83Å; V166-F174 PolarHBondContact O-N 3.38Å; V166-A176 HydrophobicContact CG2-CB 4.21Å; V166-F194 HydrophobicContact CB-CE2 4.29Å; V166-F194 HydrophobicContact CG1-CE2 4.36Å; V166-F194 HydrophobicContact CG2-CE2 4.38Å
167	G	91.2	Very high	87	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	132.2	178.7	0	0	0	0	0	110.4	E147 S148	E147-G167 PolarHBondContact N-O 2.94Å; S148-G167 PolarHBondContact N-O 2.78Å; S148-G167 PolarHBondContact O-N 2.83Å
168	T	91.8	Very high	87.4	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	162.3	-178.6	63.3	0	0	0	0	112.6	H144 L145 Q170 G171 I172 F174 V209	H144-T168 HydrophobicContact CB-CG2 3.92Å; L145-T168 CarbonylContact O-C 3.57Å; L145-T168 VanDerWaalsContact O-CA 3.32Å; L145-T168 WeakPolarHBondContact O-CA 3.41Å; T168-Q170 PolarHBondContact O-N 2.86Å; T168-G171 PolarHBondContact O-N 2.94Å; T168-G171 VanDerWaalsContact O-N 3.1Å; T168-I172 PolarHBondContact N-O 3.06Å; T168-I172 WeakPolarHBondContact OG1-CB 3.42Å; T168-I172 PolarHBondContact OG1-N 3.19Å; T168-I172 VanDerWaalsContact OG1-N 3.09Å; T168-I172 PolarHBondContact OG1-O 2.82Å; T168-F174 HydrophobicContact CG2-CD2 3.77Å; T168-F174 HydrophobicContact CG2-CE2 3.72Å; T168-V209 PolarHBondContact O-N 2.8Å; T168-V209 VanDerWaalsContact O-N 3.14Å
169	S	88.3	Confident	87.6	Confident	42 Å²	42	16.7 Å²	16.7	29%	0.294	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-16.3	173.9	71.1	0	0	0	0	113.6	L145 G171 P208	L145-S169 PolarHBondContact O-N 2.76Å; S169-G171 VanDerWaalsContact C-N 3.34Å; S169-P208 WeakPolarHBondContact O-CA 3.49Å
170	Q	87.3	Confident	87.3	Confident	94 Å²	94	14.2 Å²	14.2	44%	0.439	8%	0.081	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	3.7	176.5	-64.5	175.4	-10.9	0	0	112.7	T168 I172 P206	T168-Q170 PolarHBondContact O-N 2.86Å; Q170-I172 VanDerWaalsContact C-N 3.3Å; Q170-I172 HydrophobicContact CB-CD1 4.34Å; Q170-I172 HydrophobicContact CB-CG1 4.34Å; Q170-I172 PolarHBondContact O-N 3.35Å; Q170-P206 WeakPolarHBondContact O-CB 3.42Å
171	G	85.1	Confident	86.5	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.102	C	C	.	.	S	Bend	trans	80.9	5.8	-179.4	0	0	0	0	0	115.5	T168 S169 L200 A207	T168-G171 PolarHBondContact O-N 2.94Å; T168-G171 VanDerWaalsContact O-N 3.1Å; S169-G171 VanDerWaalsContact C-N 3.34Å; G171-L200 PolarHBondContact O-N 2.82Å; G171-A207 WeakPolarHBondContact CA-O 3.41Å; G171-A207 PolarHBondContact N-O 3.2Å
172	I	89.6	Confident	85.1	Confident	25 Å²	25	24.8 Å²	24.8	13%	0.128	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	133.9	179	-51.1	171.7	0	0	0	109.3	T168 Q170 F174 Q196	T168-I172 PolarHBondContact N-O 3.06Å; T168-I172 WeakPolarHBondContact OG1-CB 3.42Å; T168-I172 PolarHBondContact OG1-N 3.19Å; T168-I172 VanDerWaalsContact OG1-N 3.09Å; T168-I172 PolarHBondContact OG1-O 2.82Å; Q170-I172 VanDerWaalsContact C-N 3.3Å; Q170-I172 HydrophobicContact CB-CD1 4.34Å; Q170-I172 HydrophobicContact CB-CG1 4.34Å; Q170-I172 PolarHBondContact O-N 3.35Å; I172-F174 HydrophobicContact CB-CD2 4.39Å; I172-F174 HydrophobicContact CB-CE2 3.77Å; I172-F174 HydrophobicContact CB-CZ 4.39Å; I172-F174 HydrophobicContact CG2-CD2 3.9Å; I172-F174 HydrophobicContact CG2-CE1 4.41Å; I172-F174 HydrophobicContact CG2-CE2 3.38Å; I172-F174 HydrophobicContact CG2-CZ 3.67Å; I172-Q196 HydrophobicContact CG2-CB 4.47Å; I172-Q196 HydrophobicContact CG2-CG 3.58Å
173	I	90.6	Very high	83.3	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	121.8	171.5	-58	174.6	0	0	0	108.7	L165 V166 V197 H198 L200 V209 L212 A226 F252	L165-I173 HydrophobicContact CB-CG2 4.39Å; L165-I173 HydrophobicContact CD2-CG2 4.24Å; V166-I173 CarbonylContact O-C 3.59Å; V166-I173 WeakPolarHBondContact O-CA 3.31Å; I173-V197 PolarHBondContact O-N 2.84Å; I173-H198 HydrophobicContact CB-CB 4.33Å; I173-H198 HydrophobicContact CD1-CB 4.42Å; I173-H198 PolarHBondContact N-O 2.94Å; I173-H198 PolarHBondContact O-N 2.83Å; I173-L200 HydrophobicContact CD1-CD1 4Å; I173-L200 HydrophobicContact CD1-CG 4.13Å; I173-V209 HydrophobicContact CG1-CG2 4.14Å; I173-L212 HydrophobicContact CD1-CD2 3.95Å; I173-L212 HydrophobicContact CG1-CD2 4.38Å; I173-L212 HydrophobicContact CG2-CD1 4.37Å; I173-A226 HydrophobicContact CD1-CB 4.32Å; I173-F252 HydrophobicContact CD1-CE1 4.11Å; I173-F252 HydrophobicContact CD1-CZ 4.42Å; I173-F252 HydrophobicContact CG2-CZ 4.16Å
174	F	90.4	Very high	81.5	Confident	12 Å²	12	31.2 Å²	31.2	5%	0.053	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	149.6	173.5	-68.1	-92.1	0	0	0	110.9	H144 L165 V166 T168 I172 F194 R195 Q196	H144-F174 AromaticContact CE1-CZ 3.82Å; H144-F174 AromaticContact NE2-CZ 3.82Å; L165-F174 CarbonylContact C-O 3.51Å; L165-F174 WeakPolarHBondContact CA-O 3.4Å; V166-F174 HydrophobicContact CB-CB 4.29Å; V166-F174 PolarHBondContact N-O 2.83Å; V166-F174 PolarHBondContact O-N 3.38Å; T168-F174 HydrophobicContact CG2-CD2 3.77Å; T168-F174 HydrophobicContact CG2-CE2 3.72Å; I172-F174 HydrophobicContact CB-CD2 4.39Å; I172-F174 HydrophobicContact CB-CE2 3.77Å; I172-F174 HydrophobicContact CB-CZ 4.39Å; I172-F174 HydrophobicContact CG2-CD2 3.9Å; I172-F174 HydrophobicContact CG2-CE1 4.41Å; I172-F174 HydrophobicContact CG2-CE2 3.38Å; I172-F174 HydrophobicContact CG2-CZ 3.67Å; F174-F194 HydrophobicContact CB-CD2 4.1Å; F174-F194 HydrophobicContact CB-CE1 4.1Å; F174-F194 HydrophobicContact CB-CE2 3.52Å; F174-F194 HydrophobicContact CB-CZ 3.52Å; F174-F194 AromaticContact CD1-CD1 3.67Å; F174-F194 HydrophobicContact CD1-CD1 3.67Å; F174-F194 AromaticContact CD1-CE1 3.27Å; F174-F194 HydrophobicContact CD1-CE1 3.27Å; F174-F194 HydrophobicContact CD1-CE2 4.27Å; F174-F194 HydrophobicContact CD1-CG 4.32Å; F174-F194 AromaticContact CD1-CZ 3.62Å; F174-F194 HydrophobicContact CD1-CZ 3.62Å; F174-F194 AromaticContact CD2-CE1 3.86Å; F174-F194 HydrophobicContact CD2-CE1 3.86Å; F174-F194 HydrophobicContact CD2-CE2 4.36Å; F174-F194 AromaticContact CD2-CZ 3.51Å; F174-F194 HydrophobicContact CD2-CZ 3.51Å; F174-F194 HydrophobicContact CE1-CD1 4.02Å; F174-F194 AromaticContact CE1-CE1 3.51Å; F174-F194 HydrophobicContact CE1-CE1 3.51Å; F174-F194 HydrophobicContact CE1-CZ 4.18Å; F174-F194 HydrophobicContact CE2-CE1 4.05Å; F174-F194 HydrophobicContact CE2-CZ 4.07Å; F174-F194 HydrophobicContact CG-CD1 4.19Å; F174-F194 HydrophobicContact CG-CD2 4.49Å; F174-F194 AromaticContact CG-CE1 3.47Å; F174-F194 HydrophobicContact CG-CE1 3.47Å; F174-F194 VanDerWaalsContact CG-CE1 3.47Å; F174-F194 AromaticContact CG-CE2 3.83Å; F174-F194 HydrophobicContact CG-CE2 3.83Å; F174-F194 AromaticContact CG-CZ 3.26Å; F174-F194 HydrophobicContact CG-CZ 3.26Å; F174-F194 AromaticContact CZ-CE1 3.89Å; F174-F194 HydrophobicContact CZ-CE1 3.89Å; F174-F194 HydrophobicContact CZ-CZ 4.38Å; F174-R195 CarbonylContact C-O 3.54Å; F174-R195 VanDerWaalsContact CA-O 3.26Å; F174-R195 WeakPolarHBondContact CA-O 3.47Å; F174-Q196 HydrophobicContact CD1-CB 3.94Å; F174-Q196 HydrophobicContact CE1-CB 3.68Å; F174-Q196 HydrophobicContact CE1-CG 4.46Å; F174-Q196 HydrophobicContact CZ-CB 4.39Å
175	E	89.7	Confident	79.6	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.019	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	133.3	165.9	-171	-172.6	179.5	0	0	108.9	I164 L165 Y193 F194 R195 V197 G247 L248 S249	I164-E175 WeakPolarHBondContact O-CA 3.01Å; L165-E175 HydrophobicContact CD2-CB 4.09Å; L165-E175 HydrophobicContact CD2-CG 4.25Å; E175-Y193 HydrophobicContact CB-CE2 4.33Å; E175-Y193 HydrophobicContact CG-CE2 3.87Å; E175-Y193 PolarHBondContact OE1-OH 2.83Å; E175-F194 CarbonylContact O-C 3.55Å; E175-F194 WeakPolarHBondContact O-CA 3.22Å; E175-R195 PolarHBondContact N-O 2.64Å; E175-R195 PolarHBondContact O-N 2.87Å; E175-V197 HydrophobicContact CB-CG2 3.52Å; E175-G247 VanDerWaalsContact OE1-C 3.24Å; E175-G247 WeakPolarHBondContact OE1-CA 3.32Å; E175-L248 VanDerWaalsContact CD-N 3.32Å; E175-L248 PolarHBondContact OE1-N 3.26Å; E175-L248 PolarHBondContact OE2-N 3.45Å; E175-S249 PolarHBondContact OE2-N 3.45Å; E175-S249 VanDerWaalsContact OE2-N 3.16Å
176	A	88.8	Confident	77.7	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	156.2	-176.8	0	0	0	0	0	111.6	W141 I164 V166 Y193 F194	W141-A176 HydrophobicContact CH2-CB 4.16Å; W141-A176 HydrophobicContact CZ2-CB 3.48Å; W141-A176 VanDerWaalsContact CZ2-CB 3.48Å; I164-A176 HydrophobicContact CG1-CB 4.14Å; I164-A176 WeakPolarHBondContact CG1-O 3.13Å; I164-A176 PolarHBondContact N-O 2.66Å; I164-A176 PolarHBondContact O-N 3.33Å; V166-A176 HydrophobicContact CG2-CB 4.21Å; A176-Y193 WeakPolarHBondContact CA-O 3.35Å; A176-F194 HydrophobicContact CB-CD2 3.76Å; A176-F194 HydrophobicContact CB-CE2 4.43Å
177	E	87.9	Confident	75.9	Confident	52 Å²	52	51.9 Å²	51.9	24%	0.243	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	136.1	167.5	-179.2	175	-177.6	0	0	109.3	S160 Q192 Y193	S160-E177 PolarHBondContact OG-OE1 2.79Å; E177-Q192 HydrophobicContact CB-CB 4.3Å; E177-Q192 WeakPolarHBondContact O-CB 3.48Å; E177-Q192 PolarHBondContact O-N 2.95Å; E177-Y193 HydrophobicContact CB-CD1 3.89Å; E177-Y193 HydrophobicContact CB-CE1 3.3Å; E177-Y193 HydrophobicContact CG-CE1 4.43Å; E177-Y193 PolarHBondContact N-O 3.27Å
178	I	86.9	Confident	74.4	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	128.7	179.9	-56.2	176.5	0	0	0	108.3	L117 Y127 L138 W141 S160 T161 I164 P190	L117-I178 HydrophobicContact CD1-CD1 4.21Å; L117-I178 HydrophobicContact CD2-CD1 3.57Å; L117-I178 HydrophobicContact CG-CD1 4.41Å; Y127-I178 HydrophobicContact CD1-CG2 4.15Å; Y127-I178 HydrophobicContact CD2-CD1 4.47Å; Y127-I178 HydrophobicContact CD2-CG2 4.01Å; Y127-I178 HydrophobicContact CE1-CG2 3.96Å; Y127-I178 HydrophobicContact CE2-CG2 3.82Å; Y127-I178 HydrophobicContact CG-CG2 4.16Å; L138-I178 HydrophobicContact CD1-CD1 4.07Å; W141-I178 HydrophobicContact CH2-CD1 4.14Å; W141-I178 HydrophobicContact CZ2-CD1 3.81Å; W141-I178 HydrophobicContact CZ2-CG1 4.19Å; S160-I178 WeakPolarHBondContact CA-O 3.4Å; S160-I178 PolarHBondContact OG-O 3.25Å; T161-I178 HydrophobicContact CG2-CB 3.93Å; T161-I178 PolarHBondContact N-O 2.97Å; T161-I178 PolarHBondContact OG1-N 3.14Å; T161-I178 PolarHBondContact OG1-O 2.86Å; I164-I178 HydrophobicContact CD1-CD1 4.4Å; I178-P190 WeakPolarHBondContact CA-O 3.34Å; I178-P190 HydrophobicContact CG2-CB 4.18Å; I178-P190 WeakPolarHBondContact CG2-O 3.32Å
179	S	83.4	Confident	73.4	Confident	18 Å²	18	60.6 Å²	60.6	13%	0.126	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	138.5	175.4	-175.6	0	0	0	0	110.9	T159 P190	T159-S179 CarbonylContact O-C 3.47Å; T159-S179 WeakPolarHBondContact O-CA 3.49Å; T159-S179 PolarHBondContact O-OG 2.6Å; S179-P190 PolarHBondContact N-O 2.93Å
180	A	74.4	Confident	72.7	Confident	18 Å²	18	58.9 Å²	58.9	15%	0.149	33%	0.327	C	S	.	.			trans	-95.4	4.8	-179.7	0	0	0	0	0	114.1	N129 T159 E182	N129-A180 HydrophobicContact CB-CB 4.4Å; N129-A180 WeakPolarHBondContact ND2-CB 3.42Å; T159-A180 PolarHBondContact O-N 3.05Å; A180-E182 PolarHBondContact O-N 2.79Å; A180-E182 VanDerWaalsContact O-N 3.16Å
181	N	66.8	Low	72.3	Confident	110 Å²	110	54.4 Å²	54.4	59%	0.588	31%	0.306	S	S	*	.			trans	-61.4	117.2	-176.3	-88	2.2	0	0	0	111.8	G183	N181-G183 VanDerWaalsContact C-N 3.27Å; N181-G183 PolarHBondContact O-N 2.88Å
182	E	53.3	Low	72.1	Confident	133 Å²	133	58 Å²	58	62%	0.621	32%	0.323	S	S	*	.			trans	-85.4	15.9	179.8	-60.1	-158.8	133.3	0	0	114.1	R136 A180	R136-E182 IonicContact NH2-OE1 3.38Å; R136-E182 PolarHBondContact NH2-OE1 3.03Å; A180-E182 PolarHBondContact O-N 2.79Å; A180-E182 VanDerWaalsContact O-N 3.16Å
183	G	46.8	Very low	71.8	Confident	75 Å²	75	59.8 Å²	59.8	77%	0.773	33%	0.329	S	S	*	.			trans	-113.4	-1.6	-160.1	0	0	0	0	0	119.1	N181	N181-G183 VanDerWaalsContact C-N 3.27Å; N181-G183 PolarHBondContact O-N 2.88Å
184	S	46.1	Very low	71.6	Confident	73 Å²	73	61.5 Å²	61.5	51%	0.51	34%	0.336	S	S	.	.			trans	-111.7	119.7	-177.9	-166.4	0	0	0	0	112.2	F186 N187	S184-F186 PolarHBondContact O-N 2.92Å; S184-N187 PolarHBondContact O-N 3.46Å; S184-N187 VanDerWaalsContact O-N 3.15Å
185	L	50.8	Low	71.4	Confident	172 Å²	172	68.2 Å²	68.2	90%	0.901	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-13.5	175.4	-72.2	162.8	0	0	0	114
186	F	51.7	Low	71.4	Confident	191 Å²	191	73.2 Å²	73.2	84%	0.838	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	-2.6	-175.9	-69.5	-79.8	0	0	0	115.2	S184	S184-F186 PolarHBondContact O-N 2.92Å
187	N	53.5	Low	71.2	Confident	70 Å²	70	74.3 Å²	74.3	37%	0.374	39%	0.391	S	S	.	.			trans	-134.1	83.7	179.8	-144.9	4.9	0	0	0	111.2	S184 N189 Q192	S184-N187 PolarHBondContact O-N 3.46Å; S184-N187 VanDerWaalsContact O-N 3.15Å; N187-N189 VanDerWaalsContact C-N 3.32Å; N187-Q192 PolarHBondContact ND2-OE1 3.16Å; N187-Q192 VanDerWaalsContact ND2-OE1 3.17Å
188	T	60.1	Low	71.1	Confident	116 Å²	116	73.4 Å²	73.4	71%	0.712	39%	0.387	S	S	*	.			trans	-76.6	-17.4	180	35.4	0	0	0	0	113.8
189	N	69.3	Low	71.1	Confident	67 Å²	67	75.7 Å²	75.7	36%	0.358	40%	0.403	S	S	.	.			trans	-98	132.4	-173.8	-75.6	-6.1	0	0	0	110.8	S139 N187 D191	S139-N189 PolarHBondContact OG-ND2 2.83Å; N187-N189 VanDerWaalsContact C-N 3.32Å; N189-D191 VanDerWaalsContact C-N 3.28Å; N189-D191 WeakPolarHBondContact CB-OD1 3.32Å; N189-D191 PolarHBondContact O-N 2.97Å
190	P	73.6	Confident	71.1	Confident	6 Å²	6	74.9 Å²	74.9	4%	0.039	40%	0.397	C	S	.	.	S	Bend	trans	-72.1	-19.3	-179.8	30.8	-36.2	0	0	0	113.3	Y127 R136 L138 I178 S179 Q192	Y127-P190 HydrophobicContact CD1-CB 3.99Å; Y127-P190 HydrophobicContact CD1-CG 4.29Å; Y127-P190 HydrophobicContact CE1-CB 4.24Å; R136-P190 HydrophobicContact CB-CG 4.08Å; L138-P190 HydrophobicContact CD2-CB 4.5Å; L138-P190 HydrophobicContact CD2-CG 3.64Å; I178-P190 WeakPolarHBondContact CA-O 3.34Å; I178-P190 HydrophobicContact CG2-CB 4.18Å; I178-P190 WeakPolarHBondContact CG2-O 3.32Å; S179-P190 PolarHBondContact N-O 2.93Å; P190-Q192 PolarHBondContact O-N 3.45Å
191	D	79.3	Confident	71.3	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	103.5	178.3	45.8	-38.2	0	0	0	112.7	L138 R140 N189	L138-D191 HydrophobicContact CD2-CB 4.22Å; R140-D191 WeakPolarHBondContact CB-OD2 2.9Å; R140-D191 VanDerWaalsContact CD-OD2 3.24Å; R140-D191 WeakPolarHBondContact CD-OD2 3.5Å; R140-D191 WeakPolarHBondContact CG-OD2 3.43Å; R140-D191 PolarHBondContact N-OD2 3.06Å; R140-D191 VanDerWaalsContact N-OD2 3.12Å; R140-D191 IonicContact NE-OD2 3.04Å; R140-D191 PolarHBondContact NH1-O 2.92Å; N189-D191 VanDerWaalsContact C-N 3.28Å; N189-D191 WeakPolarHBondContact CB-OD1 3.32Å; N189-D191 PolarHBondContact O-N 2.97Å
192	Q	80.6	Confident	71.7	Confident	76 Å²	76	74.9 Å²	74.9	36%	0.355	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	-43.1	-178.9	-67.7	-70.4	3.9	0	0	112.5	R140 E177 N187 P190	R140-Q192 PolarHBondContact NH1-O 2.82Å; E177-Q192 HydrophobicContact CB-CB 4.3Å; E177-Q192 WeakPolarHBondContact O-CB 3.48Å; E177-Q192 PolarHBondContact O-N 2.95Å; N187-Q192 PolarHBondContact ND2-OE1 3.16Å; N187-Q192 VanDerWaalsContact ND2-OE1 3.17Å; P190-Q192 PolarHBondContact O-N 3.45Å
193	Y	83.9	Confident	72.6	Confident	63 Å²	63	73.4 Å²	73.4	25%	0.247	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	162.2	170.9	68	-91.5	0	0	0	111.7	E175 A176 E177 R195	E175-Y193 HydrophobicContact CB-CE2 4.33Å; E175-Y193 HydrophobicContact CG-CE2 3.87Å; E175-Y193 PolarHBondContact OE1-OH 2.83Å; A176-Y193 WeakPolarHBondContact CA-O 3.35Å; E177-Y193 HydrophobicContact CB-CD1 3.89Å; E177-Y193 HydrophobicContact CB-CE1 3.3Å; E177-Y193 HydrophobicContact CG-CE1 4.43Å; E177-Y193 PolarHBondContact N-O 3.27Å; Y193-R195 HydrophobicContact CD2-CB 4.49Å
194	F	86	Confident	73.6	Confident	36 Å²	36	73 Å²	73	16%	0.158	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	100.8	175.8	-170.5	-107.9	0	0	0	108.2	R140 W141 H144 V166 F174 E175 A176	R140-F194 HydrophobicContact CB-CB 4.12Å; W141-F194 AromaticContact CD1-CD2 3.78Å; W141-F194 AromaticContact CD2-CD2 3.78Å; W141-F194 HydrophobicContact CD2-CD2 3.78Å; W141-F194 AromaticContact CD2-CE2 3.58Å; W141-F194 HydrophobicContact CD2-CE2 3.58Å; W141-F194 HydrophobicContact CD2-CZ 4.31Å; W141-F194 AromaticContact CE2-CD2 3.51Å; W141-F194 AromaticContact CE2-CE2 3.73Å; W141-F194 HydrophobicContact CE3-CD2 4.44Å; W141-F194 AromaticContact CE3-CE2 3.83Å; W141-F194 HydrophobicContact CE3-CE2 3.83Å; W141-F194 HydrophobicContact CE3-CZ 4.48Å; W141-F194 HydrophobicContact CG-CD2 4.01Å; W141-F194 AromaticContact CG-CE2 3.99Å; W141-F194 HydrophobicContact CG-CE2 3.99Å; W141-F194 HydrophobicContact CG-CG 4.45Å; W141-F194 HydrophobicContact CG-CZ 4.41Å; W141-F194 HydrophobicContact CZ2-CD2 4.06Å; W141-F194 HydrophobicContact CZ2-CE2 4.22Å; W141-F194 HydrophobicContact CZ3-CE2 4.31Å; W141-F194 AromaticContact NE1-CD2 3.43Å; W141-F194 AromaticContact NE1-CG 3.97Å; H144-F194 AromaticContact CD2-CE1 3.95Å; V166-F194 HydrophobicContact CB-CE2 4.29Å; V166-F194 HydrophobicContact CG1-CE2 4.36Å; V166-F194 HydrophobicContact CG2-CE2 4.38Å; F174-F194 HydrophobicContact CB-CD2 4.1Å; F174-F194 HydrophobicContact CB-CE1 4.1Å; F174-F194 HydrophobicContact CB-CE2 3.52Å; F174-F194 HydrophobicContact CB-CZ 3.52Å; F174-F194 AromaticContact CD1-CD1 3.67Å; F174-F194 HydrophobicContact CD1-CD1 3.67Å; F174-F194 AromaticContact CD1-CE1 3.27Å; F174-F194 HydrophobicContact CD1-CE1 3.27Å; F174-F194 HydrophobicContact CD1-CE2 4.27Å; F174-F194 HydrophobicContact CD1-CG 4.32Å; F174-F194 AromaticContact CD1-CZ 3.62Å; F174-F194 HydrophobicContact CD1-CZ 3.62Å; F174-F194 AromaticContact CD2-CE1 3.86Å; F174-F194 HydrophobicContact CD2-CE1 3.86Å; F174-F194 HydrophobicContact CD2-CE2 4.36Å; F174-F194 AromaticContact CD2-CZ 3.51Å; F174-F194 HydrophobicContact CD2-CZ 3.51Å; F174-F194 HydrophobicContact CE1-CD1 4.02Å; F174-F194 AromaticContact CE1-CE1 3.51Å; F174-F194 HydrophobicContact CE1-CE1 3.51Å; F174-F194 HydrophobicContact CE1-CZ 4.18Å; F174-F194 HydrophobicContact CE2-CE1 4.05Å; F174-F194 HydrophobicContact CE2-CZ 4.07Å; F174-F194 HydrophobicContact CG-CD1 4.19Å; F174-F194 HydrophobicContact CG-CD2 4.49Å; F174-F194 AromaticContact CG-CE1 3.47Å; F174-F194 HydrophobicContact CG-CE1 3.47Å; F174-F194 VanDerWaalsContact CG-CE1 3.47Å; F174-F194 AromaticContact CG-CE2 3.83Å; F174-F194 HydrophobicContact CG-CE2 3.83Å; F174-F194 AromaticContact CG-CZ 3.26Å; F174-F194 HydrophobicContact CG-CZ 3.26Å; F174-F194 AromaticContact CZ-CE1 3.89Å; F174-F194 HydrophobicContact CZ-CE1 3.89Å; F174-F194 HydrophobicContact CZ-CZ 4.38Å; E175-F194 CarbonylContact O-C 3.55Å; E175-F194 WeakPolarHBondContact O-CA 3.22Å; A176-F194 HydrophobicContact CB-CD2 3.76Å; A176-F194 HydrophobicContact CB-CE2 4.43Å
195	R	87.2	Confident	75.1	Confident	153 Å²	153	76.9 Å²	76.9	58%	0.577	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	131.3	-170.8	-179.8	179.9	176	-177.8	-1.1	110.6	F174 E175 Y193	F174-R195 CarbonylContact C-O 3.54Å; F174-R195 VanDerWaalsContact CA-O 3.26Å; F174-R195 WeakPolarHBondContact CA-O 3.47Å; E175-R195 PolarHBondContact N-O 2.64Å; E175-R195 PolarHBondContact O-N 2.87Å; Y193-R195 HydrophobicContact CD2-CB 4.49Å
196	Q	88.5	Confident	76.3	Confident	109 Å²	109	73 Å²	73	51%	0.509	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	131.8	172.5	179.4	173.3	-9.3	0	0	110.3	I172 F174	I172-Q196 HydrophobicContact CG2-CB 4.47Å; I172-Q196 HydrophobicContact CG2-CG 3.58Å; F174-Q196 HydrophobicContact CD1-CB 3.94Å; F174-Q196 HydrophobicContact CE1-CB 3.68Å; F174-Q196 HydrophobicContact CE1-CG 4.46Å; F174-Q196 HydrophobicContact CZ-CB 4.39Å
197	V	85.8	Confident	77.8	Confident	22 Å²	22	64.1 Å²	64.1	13%	0.133	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	-39.4	-177.8	-178	0	0	0	0	112.3	I173 E175 F252	I173-V197 PolarHBondContact O-N 2.84Å; E175-V197 HydrophobicContact CB-CG2 3.52Å; V197-F252 HydrophobicContact CB-CD2 4.32Å; V197-F252 HydrophobicContact CG1-CB 3.59Å; V197-F252 HydrophobicContact CG1-CD1 4.42Å; V197-F252 HydrophobicContact CG1-CD2 3.16Å; V197-F252 HydrophobicContact CG1-CE2 3.84Å; V197-F252 HydrophobicContact CG1-CG 3.48Å; V197-F252 VanDerWaalsContact CG1-CG 3.48Å
198	H	85.3	Confident	79.3	Confident	33 Å²	33	61.2 Å²	61.2	15%	0.153	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	161.7	-178.3	-161.9	69.2	0	0	0	112.2	I173 F235 F252	I173-H198 HydrophobicContact CB-CB 4.33Å; I173-H198 HydrophobicContact CD1-CB 4.42Å; I173-H198 PolarHBondContact N-O 2.94Å; I173-H198 PolarHBondContact O-N 2.83Å; H198-F235 AromaticContact CD2-CZ 3.74Å; H198-F235 AromaticContact NE2-CE1 3.82Å; H198-F235 AromaticContact NE2-CZ 3.75Å; H198-F252 HydrophobicContact CB-CD1 3.59Å; H198-F252 HydrophobicContact CB-CE1 3.96Å; H198-F252 HydrophobicContact CB-CG 4.22Å; H198-F252 AromaticContact CG-CD1 3.85Å
199	S	85.8	Confident	80.6	Confident	48 Å²	48	55.7 Å²	55.7	34%	0.336	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	125.8	175.4	-172.3	0	0	0	0	109.4
200	L	83.7	Confident	81.4	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.01	28%	0.276	C	S	.	.			trans	-98.1	131.2	178	-62.7	-179.6	0	0	0	110.2	G171 I173 V209 A226 T228 F233 F235	G171-L200 PolarHBondContact O-N 2.82Å; I173-L200 HydrophobicContact CD1-CD1 4Å; I173-L200 HydrophobicContact CD1-CG 4.13Å; L200-V209 HydrophobicContact CD1-CG1 4.24Å; L200-V209 HydrophobicContact CD1-CG2 4.07Å; L200-A226 HydrophobicContact CD1-CB 3.91Å; L200-T228 HydrophobicContact CB-CG2 3.98Å; L200-T228 HydrophobicContact CD1-CG2 3.77Å; L200-F233 HydrophobicContact CB-CE2 4.44Å; L200-F233 HydrophobicContact CD1-CD2 3.97Å; L200-F233 HydrophobicContact CD1-CE2 4.22Å; L200-F233 HydrophobicContact CD2-CD1 4.16Å; L200-F233 HydrophobicContact CD2-CD2 3.79Å; L200-F233 HydrophobicContact CD2-CE1 4.28Å; L200-F233 HydrophobicContact CD2-CE2 3.91Å; L200-F233 HydrophobicContact CD2-CG 3.92Å; L200-F233 HydrophobicContact CD2-CZ 4.15Å; L200-F233 HydrophobicContact CG-CD2 4.45Å; L200-F233 HydrophobicContact CG-CE2 4.43Å; L200-F235 HydrophobicContact CD2-CZ 4.05Å
201	E	79.9	Confident	81.9	Confident	112 Å²	112	54.2 Å²	54.2	52%	0.523	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.3	178	-63.6	-177.1	-179.5	0	0	110.7	K205 R231	E201-K205 WeakPolarHBondContact CA-O 3.39Å; E201-R231 PolarHBondContact O-NH1 2.85Å
202	E	75.2	Confident	82.4	Confident	15 Å²	15	54.3 Å²	54.3	7%	0.07	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	128.2	169.2	-68.6	-179.2	154.8	0	0	108.6	G204 K205 A207 T228 R229 K230	E202-G204 PolarHBondContact O-N 2.97Å; E202-K205 PolarHBondContact N-O 3.01Å; E202-K205 PolarHBondContact O-N 2.99Å; E202-K205 VanDerWaalsContact O-O 3.09Å; E202-A207 HydrophobicContact CB-CB 3.73Å; E202-A207 HydrophobicContact CG-CB 3.39Å; E202-A207 VanDerWaalsContact OE2-CB 3.24Å; E202-A207 WeakPolarHBondContact OE2-CB 3.37Å; E202-T228 WeakPolarHBondContact OE1-CB 3.47Å; E202-T228 PolarHBondContact OE1-OG1 2.95Å; E202-R229 PolarHBondContact OE1-N 3.35Å; E202-K230 PolarHBondContact OE1-N 3.34Å
203	D	71.1	Confident	82.7	Confident	103 Å²	103	52.4 Å²	52.4	55%	0.551	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	34.6	176	-57.2	-35.6	0	0	0	113.6	K205 K230 R231	D203-K205 VanDerWaalsContact C-N 3.33Å; D203-K205 PolarHBondContact O-N 2.88Å; D203-K230 IonicContact OD2-NZ 2.85Å; D203-K230 PolarHBondContact OD2-NZ 2.78Å; D203-R231 IonicContact OD1-NH2 2.65Å
204	G	67.5	Low	82.7	Confident	65 Å²	65	49.7 Å²	49.7	67%	0.67	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.2	15	-178.6	0	0	0	0	0	115.2	E202	E202-G204 PolarHBondContact O-N 2.97Å
205	K	77.5	Confident	82.4	Confident	156 Å²	156	48.7 Å²	48.7	68%	0.678	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.8	149.8	175.1	-68.3	179.7	-177.6	174.3	0	111.2	E201 E202 D203 A207	E201-K205 WeakPolarHBondContact CA-O 3.39Å; E202-K205 PolarHBondContact N-O 3.01Å; E202-K205 PolarHBondContact O-N 2.99Å; E202-K205 VanDerWaalsContact O-O 3.09Å; D203-K205 VanDerWaalsContact C-N 3.33Å; D203-K205 PolarHBondContact O-N 2.88Å; K205-A207 PolarHBondContact O-N 2.95Å
206	P	77.3	Confident	82	Confident	91 Å²	91	43.7 Å²	43.7	59%	0.591	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-64.7	127.7	173.5	-8.3	20.9	0	0	0	110	Q170	Q170-P206 WeakPolarHBondContact O-CB 3.42Å
207	A	83.1	Confident	81.1	Confident	3 Å²	3	38.8 Å²	38.8	3%	0.025	22%	0.218	C	C	.	.			trans	-118.7	139.3	-178.2	0	0	0	0	0	110.8	G171 E202 K205 V209 T228	G171-A207 WeakPolarHBondContact CA-O 3.41Å; G171-A207 PolarHBondContact N-O 3.2Å; E202-A207 HydrophobicContact CB-CB 3.73Å; E202-A207 HydrophobicContact CG-CB 3.39Å; E202-A207 VanDerWaalsContact OE2-CB 3.24Å; E202-A207 WeakPolarHBondContact OE2-CB 3.37Å; K205-A207 PolarHBondContact O-N 2.95Å; A207-V209 PolarHBondContact O-N 2.94Å; A207-T228 HydrophobicContact CB-CG2 4.38Å
208	P	85.1	Confident	80.2	Confident	10 Å²	10	42.6 Å²	42.6	7%	0.065	24%	0.244	C	C	.	.			trans	-62.3	140.1	-176.2	28.1	-36.2	0	0	0	111.6	E147 S169 C210 R229	E147-P208 HydrophobicContact CG-CB 4.29Å; S169-P208 WeakPolarHBondContact O-CA 3.49Å; P208-C210 PolarHBondContact O-N 3.31Å; P208-C210 VanDerWaalsContact O-N 3.17Å; P208-R229 HydrophobicContact CG-CG 4.02Å; P208-R229 VanDerWaalsContact CG-NE 3.32Å
209	V	87.7	Confident	79.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.265	C	S	.	.			trans	-81.7	93.8	174.6	-168	0	0	0	0	108.8	E147 S148 T168 I173 L200 A207 L212 T227	E147-V209 VanDerWaalsContact CB-O 3.32Å; E147-V209 WeakPolarHBondContact CB-O 3.4Å; E147-V209 VanDerWaalsContact CG-O 3.24Å; E147-V209 WeakPolarHBondContact CG-O 3.34Å; S148-V209 WeakPolarHBondContact CB-O 3.45Å; S148-V209 PolarHBondContact OG-O 3.3Å; T168-V209 PolarHBondContact O-N 2.8Å; T168-V209 VanDerWaalsContact O-N 3.14Å; I173-V209 HydrophobicContact CG1-CG2 4.14Å; L200-V209 HydrophobicContact CD1-CG1 4.24Å; L200-V209 HydrophobicContact CD1-CG2 4.07Å; A207-V209 PolarHBondContact O-N 2.94Å; V209-L212 HydrophobicContact CG1-CD1 4.01Å; V209-L212 HydrophobicContact CG1-CD2 3.83Å; V209-L212 HydrophobicContact CG1-CG 3.62Å; V209-T227 CarbonylContact C-O 3.49Å
210	C	84.9	Confident	78.7	Confident	16 Å²	16	46 Å²	46	11%	0.108	26%	0.255	C	S	.	.			trans	-67.4	-37.4	-172.6	-67.7	0	0	0	0	113.3	P208 T227 S272	P208-C210 PolarHBondContact O-N 3.31Å; P208-C210 VanDerWaalsContact O-N 3.17Å; C210-T227 PolarHBondContact N-O 3.41Å; C210-S272 WeakPolarHBondContact CB-O 3.24Å
211	C	85.6	Confident	78.4	Confident	26 Å²	26	47.1 Å²	47.1	18%	0.176	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	146.7	175.7	-173.4	0	0	0	0	111.2	A226 T227 I274	C211-A226 WeakPolarHBondContact O-CA 3.15Å; C211-T227 VanDerWaalsContact CB-OG1 3.26Å; C211-T227 WeakPolarHBondContact CB-OG1 3.08Å; C211-T227 PolarHBondContact N-O 3.24Å; C211-T227 PolarHBondContact N-OG1 3.02Å; C211-T227 PolarHBondContact O-N 3.1Å; C211-I274 HydrophobicContact CB-CG2 3.56Å; C211-I274 WeakPolarHBondContact SG-CG2 3.48Å
212	L	88.3	Confident	78.3	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	126.3	173.5	-76.5	169.3	0	0	0	108.4	G150 L165 I173 V209 I225 A226	G150-L212 VanDerWaalsContact CA-O 3.26Å; G150-L212 WeakPolarHBondContact CA-O 3.3Å; L165-L212 HydrophobicContact CB-CD1 4.21Å; I173-L212 HydrophobicContact CD1-CD2 3.95Å; I173-L212 HydrophobicContact CG1-CD2 4.38Å; I173-L212 HydrophobicContact CG2-CD1 4.37Å; V209-L212 HydrophobicContact CG1-CD1 4.01Å; V209-L212 HydrophobicContact CG1-CD2 3.83Å; V209-L212 HydrophobicContact CG1-CG 3.62Å; L212-I225 WeakPolarHBondContact CA-O 3.38Å; L212-A226 HydrophobicContact CD2-CB 3.54Å
213	E	86.6	Confident	78.6	Confident	35 Å²	35	41.5 Å²	41.5	16%	0.164	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	137.8	173.5	-169.2	71.9	170.3	0	0	109.8	K153 E215 I224 I225 F276	K153-E213 WeakPolarHBondContact CE-OE1 3.24Å; K153-E213 IonicContact NZ-OE1 2.77Å; K153-E213 PolarHBondContact NZ-OE1 3.23Å; E213-E215 HydrophobicContact CG-CG 4.43Å; E213-I224 WeakPolarHBondContact O-CA 3.48Å; E213-I225 PolarHBondContact N-O 3.24Å; E213-I225 PolarHBondContact O-N 2.84Å; E213-F276 HydrophobicContact CB-CD2 4.15Å; E213-F276 HydrophobicContact CB-CE2 3.59Å; E213-F276 HydrophobicContact CB-CZ 4.22Å; E213-F276 HydrophobicContact CG-CD2 3.85Å; E213-F276 HydrophobicContact CG-CE2 3.79Å; E213-F276 HydrophobicContact CG-CZ 4.48Å
214	I	85.3	Confident	79.3	Confident	6 Å²	6	36.6 Å²	36.6	3%	0.031	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	124	-179.7	-53.4	169.1	0	0	0	108.3	G150 L165 Y222 L248	G150-I214 WeakPolarHBondContact O-CD1 3.45Å; L165-I214 HydrophobicContact CB-CD1 3.98Å; L165-I214 HydrophobicContact CD1-CD1 3.74Å; L165-I214 HydrophobicContact CD1-CG1 3.82Å; L165-I214 HydrophobicContact CG-CD1 3.64Å; L165-I214 HydrophobicContact CG-CG1 4.28Å; I214-Y222 HydrophobicContact CG2-CD1 4.34Å; I214-L248 HydrophobicContact CD1-CD1 3.82Å
215	E	79.3	Confident	80.2	Confident	15 Å²	15	33.8 Å²	33.8	7%	0.07	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	145.5	176.8	-69.1	-61.1	160.7	0	0	110.8	K153 E213 Y222 F223 P285 Y303	K153-E215 IonicContact NZ-OE1 2.67Å; K153-E215 PolarHBondContact NZ-OE1 3.17Å; E213-E215 HydrophobicContact CG-CG 4.43Å; E215-Y222 CarbonylContact O-C 3.46Å; E215-Y222 WeakPolarHBondContact O-CA 3.34Å; E215-F223 HydrophobicContact CB-CB 4.32Å; E215-F223 PolarHBondContact N-O 2.79Å; E215-F223 PolarHBondContact O-N 3.06Å; E215-P285 VanDerWaalsContact CD-CG 3.47Å; E215-P285 HydrophobicContact CG-CG 3.92Å; E215-P285 WeakPolarHBondContact OE1-CD 3.32Å; E215-P285 WeakPolarHBondContact OE1-CG 3.32Å; E215-P285 VanDerWaalsContact OE2-CD 3.26Å; E215-P285 WeakPolarHBondContact OE2-CD 3.42Å; E215-Y303 HydrophobicContact CB-CE1 4.41Å
216	R	77.6	Confident	80.7	Confident	49 Å²	49	26.3 Å²	26.3	19%	0.185	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	139.8	173.5	180	-176.8	174.6	164.2	-2.9	108.2	L154 N220 K221 Y222 E244 F284	L154-R216 HydrophobicContact CD1-CB 3.9Å; L154-R216 VanDerWaalsContact CD1-CD 3.44Å; L154-R216 HydrophobicContact CD1-CG 4.3Å; R216-N220 PolarHBondContact NE-OD1 2.83Å; R216-N220 PolarHBondContact NH2-OD1 3.2Å; R216-K221 CarbonylContact C-O 3.4Å; R216-K221 WeakPolarHBondContact CA-O 3.38Å; R216-Y222 HydrophobicContact CB-CD1 4.19Å; R216-Y222 HydrophobicContact CB-CE1 3.98Å; R216-Y222 HydrophobicContact CG-CE1 4.2Å; R216-Y222 HydrophobicContact CG-CE2 4.33Å; R216-Y222 PolarHBondContact NH1-OH 3.34Å; R216-E244 IonicContact CZ-OE1 3.55Å; R216-E244 IonicContact CZ-OE2 2.77Å; R216-E244 IonicContact NH1-OE1 3.14Å; R216-E244 PolarHBondContact NH1-OE1 2.84Å; R216-E244 IonicContact NH1-OE2 2.96Å; R216-E244 PolarHBondContact NH1-OE2 3.17Å; R216-E244 IonicContact NH2-OE1 3.39Å; R216-E244 PolarHBondContact NH2-OE1 2.82Å; R216-E244 IonicContact NH2-OE2 2.73Å; R216-F284 WeakPolarHBondContact O-CD1 3.41Å; R216-F284 WeakPolarHBondContact O-CE1 3.49Å
217	S	71.6	Confident	81.2	Confident	5 Å²	5	22 Å²	22	4%	0.035	12%	0.116	C	C	.	.			trans	-93.8	166.4	175.9	89.8	0	0	0	0	111.8	E219 N220 K221	S217-E219 PolarHBondContact O-N 3.43Å; S217-E219 VanDerWaalsContact O-N 3.13Å; S217-E219 PolarHBondContact OG-N 3.39Å; S217-N220 PolarHBondContact O-N 3.49Å; S217-N220 VanDerWaalsContact O-N 3.16Å; S217-K221 PolarHBondContact N-O 2.84Å; S217-K221 WeakPolarHBondContact OG-CB 3.34Å; S217-K221 PolarHBondContact OG-N 2.91Å
218	P	66.4	Low	81.3	Confident	103 Å²	103	21.9 Å²	21.9	67%	0.669	12%	0.115	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-23.4	174.6	-20.5	30.9	0	0	0	114.1	F284	P218-F284 HydrophobicContact CG-CE2 3.77Å; P218-F284 HydrophobicContact CG-CZ 4.04Å
219	E	68.1	Low	81.2	Confident	130 Å²	130	26.2 Å²	26.2	61%	0.607	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95	20.8	-179.9	-61	-176	174.6	0	0	113.2	S217 K221	S217-E219 PolarHBondContact O-N 3.43Å; S217-E219 VanDerWaalsContact O-N 3.13Å; S217-E219 PolarHBondContact OG-N 3.39Å; E219-K221 HydrophobicContact CB-CG 4.44Å; E219-K221 PolarHBondContact O-N 3.34Å; E219-K221 WeakPolarHBondContact OE2-CE 3.27Å; E219-K221 IonicContact OE2-NZ 3.47Å; E219-K221 PolarHBondContact OE2-NZ 3.03Å
220	N	71.3	Confident	80.9	Confident	21 Å²	21	28.2 Å²	28.2	11%	0.112	14%	0.139	C	C	.	.	S	Bend	trans	55.5	28.3	-173.6	-67.6	-18.1	0	0	0	114.9	R216 S217 E241	R216-N220 PolarHBondContact NE-OD1 2.83Å; R216-N220 PolarHBondContact NH2-OD1 3.2Å; S217-N220 PolarHBondContact O-N 3.49Å; S217-N220 VanDerWaalsContact O-N 3.16Å; N220-E241 WeakPolarHBondContact ND2-CG 3.48Å; N220-E241 PolarHBondContact ND2-OE1 2.91Å
221	K	76.4	Confident	80.8	Confident	27 Å²	27	29.4 Å²	29.4	12%	0.117	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	133.2	166.6	-58.7	174.3	-175.8	157.9	0	108.6	R216 S217 E219 F223 G237 K238	R216-K221 CarbonylContact C-O 3.4Å; R216-K221 WeakPolarHBondContact CA-O 3.38Å; S217-K221 PolarHBondContact N-O 2.84Å; S217-K221 WeakPolarHBondContact OG-CB 3.34Å; S217-K221 PolarHBondContact OG-N 2.91Å; E219-K221 HydrophobicContact CB-CG 4.44Å; E219-K221 PolarHBondContact O-N 3.34Å; E219-K221 WeakPolarHBondContact OE2-CE 3.27Å; E219-K221 IonicContact OE2-NZ 3.47Å; E219-K221 PolarHBondContact OE2-NZ 3.03Å; K221-F223 HydrophobicContact CB-CE2 4.05Å; K221-F223 HydrophobicContact CB-CZ 4.47Å; K221-G237 CarbonylContact C-O 3.57Å; K221-G237 WeakPolarHBondContact CA-O 3.11Å; K221-K238 HydrophobicContact CG-CD 4.48Å; K221-K238 HydrophobicContact CG-CG 3.8Å
222	Y	79.5	Confident	80.8	Confident	6 Å²	6	28.3 Å²	28.3	2%	0.024	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	132.7	170.8	-74.5	-95.9	0	0	0	109.3	I214 E215 R216 V236 G237 V239 L248 I251	I214-Y222 HydrophobicContact CG2-CD1 4.34Å; E215-Y222 CarbonylContact O-C 3.46Å; E215-Y222 WeakPolarHBondContact O-CA 3.34Å; R216-Y222 HydrophobicContact CB-CD1 4.19Å; R216-Y222 HydrophobicContact CB-CE1 3.98Å; R216-Y222 HydrophobicContact CG-CE1 4.2Å; R216-Y222 HydrophobicContact CG-CE2 4.33Å; R216-Y222 PolarHBondContact NH1-OH 3.34Å; Y222-V236 WeakPolarHBondContact O-CA 3.41Å; Y222-G237 PolarHBondContact N-O 3.12Å; Y222-G237 PolarHBondContact O-N 2.84Å; Y222-V239 HydrophobicContact CD2-CB 4.03Å; Y222-V239 HydrophobicContact CD2-CG2 3.64Å; Y222-V239 HydrophobicContact CE2-CB 3.87Å; Y222-V239 HydrophobicContact CE2-CG2 3.87Å; Y222-L248 HydrophobicContact CD1-CD2 4.04Å; Y222-L248 HydrophobicContact CE1-CD2 4.22Å; Y222-I251 HydrophobicContact CD1-CD1 4.46Å; Y222-I251 HydrophobicContact CD2-CD1 4.26Å; Y222-I251 HydrophobicContact CG-CD1 3.8Å
223	F	80.9	Confident	80.6	Confident	2 Å²	2	28.9 Å²	28.9	1%	0.009	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.9	174.1	-68.4	-83.2	0	0	0	107.8	E215 K221 F235 V236 Y303 L309	E215-F223 HydrophobicContact CB-CB 4.32Å; E215-F223 PolarHBondContact N-O 2.79Å; E215-F223 PolarHBondContact O-N 3.06Å; K221-F223 HydrophobicContact CB-CE2 4.05Å; K221-F223 HydrophobicContact CB-CZ 4.47Å; F223-F235 WeakPolarHBondContact CA-O 3.28Å; F223-V236 HydrophobicContact CD1-CB 4.36Å; F223-V236 HydrophobicContact CD1-CG1 4.08Å; F223-V236 HydrophobicContact CD1-CG2 3.66Å; F223-V236 HydrophobicContact CE1-CB 4.25Å; F223-V236 HydrophobicContact CE1-CG1 3.62Å; F223-V236 HydrophobicContact CE1-CG2 3.65Å; F223-V236 HydrophobicContact CZ-CG1 4.14Å; F223-Y303 AromaticContact CD2-CD1 3.76Å; F223-Y303 HydrophobicContact CD2-CD1 3.76Å; F223-Y303 HydrophobicContact CD2-CE1 4.15Å; F223-Y303 AromaticContact CE2-CD1 3.75Å; F223-Y303 HydrophobicContact CE2-CD1 3.75Å; F223-Y303 HydrophobicContact CG-CD1 4.5Å; F223-L309 HydrophobicContact CB-CD2 4.4Å; F223-L309 HydrophobicContact CD1-CB 4.48Å; F223-L309 HydrophobicContact CD1-CD1 3.88Å; F223-L309 HydrophobicContact CD1-CD2 4.39Å; F223-L309 HydrophobicContact CD1-CG 4.49Å; F223-L309 HydrophobicContact CD2-CD1 4.43Å; F223-L309 HydrophobicContact CE1-CD1 3.99Å; F223-L309 HydrophobicContact CG-CD1 4.11Å; F223-L309 HydrophobicContact CZ-CD1 4.3Å
224	I	85.6	Confident	80.5	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122.4	174.7	-57.2	162.4	0	0	0	107.3	L165 E213 F235 I251 F252	L165-I224 HydrophobicContact CD1-CD1 3.79Å; L165-I224 HydrophobicContact CD1-CG1 4.17Å; L165-I224 HydrophobicContact CD1-CG2 3.82Å; E213-I224 WeakPolarHBondContact O-CA 3.48Å; I224-F235 HydrophobicContact CB-CB 4.18Å; I224-F235 HydrophobicContact CB-CD2 4.38Å; I224-F235 HydrophobicContact CG2-CD2 4.35Å; I224-F235 PolarHBondContact N-O 2.72Å; I224-F235 PolarHBondContact O-N 2.77Å; I224-I251 HydrophobicContact CD1-CB 4.33Å; I224-I251 HydrophobicContact CD1-CD1 4.12Å; I224-I251 HydrophobicContact CD1-CG2 3.91Å; I224-F252 HydrophobicContact CD1-CD2 4.3Å; I224-F252 HydrophobicContact CD1-CE2 3.54Å; I224-F252 HydrophobicContact CD1-CZ 3.72Å; I224-F252 HydrophobicContact CG2-CZ 4.16Å
225	I	86.9	Confident	80.3	Confident	6 Å²	6	27.5 Å²	27.5	3%	0.031	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	121.4	174.9	-56.9	169.7	0	0	0	107.2	L212 E213 L232 I274 F276 L309	L212-I225 WeakPolarHBondContact CA-O 3.38Å; E213-I225 PolarHBondContact N-O 3.24Å; E213-I225 PolarHBondContact O-N 2.84Å; I225-L232 HydrophobicContact CG2-CD1 4.39Å; I225-L232 HydrophobicContact CG2-CD2 4.26Å; I225-L232 HydrophobicContact CG2-CG 4.14Å; I225-I274 HydrophobicContact CG2-CD1 4.38Å; I225-F276 HydrophobicContact CB-CZ 4.26Å; I225-F276 HydrophobicContact CD1-CE1 3.52Å; I225-F276 HydrophobicContact CD1-CZ 3.52Å; I225-F276 HydrophobicContact CG2-CZ 4.13Å; I225-L309 HydrophobicContact CD1-CD2 3.66Å; I225-L309 HydrophobicContact CG1-CD2 4.15Å
226	A	87.8	Confident	80.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	133	174.7	0	0	0	0	0	109.3	I173 L200 C211 L212 F233 F235	I173-A226 HydrophobicContact CD1-CB 4.32Å; L200-A226 HydrophobicContact CD1-CB 3.91Å; C211-A226 WeakPolarHBondContact O-CA 3.15Å; L212-A226 HydrophobicContact CD2-CB 3.54Å; A226-F233 HydrophobicContact CB-CB 4.37Å; A226-F233 PolarHBondContact N-O 2.84Å; A226-F233 PolarHBondContact O-N 2.97Å; A226-F235 HydrophobicContact CB-CE2 4.11Å
227	T	87	Confident	80.2	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	136.7	175.4	56.2	0	0	0	0	110.3	V209 C210 C211 R231 L232 I274	V209-T227 CarbonylContact C-O 3.49Å; C210-T227 PolarHBondContact N-O 3.41Å; C211-T227 VanDerWaalsContact CB-OG1 3.26Å; C211-T227 WeakPolarHBondContact CB-OG1 3.08Å; C211-T227 PolarHBondContact N-O 3.24Å; C211-T227 PolarHBondContact N-OG1 3.02Å; C211-T227 PolarHBondContact O-N 3.1Å; T227-R231 WeakPolarHBondContact CA-O 2.99Å; T227-L232 HydrophobicContact CG2-CB 4.19Å; T227-L232 HydrophobicContact CG2-CD1 4.17Å; T227-L232 HydrophobicContact CG2-CG 3.99Å; T227-I274 HydrophobicContact CG2-CB 4.25Å; T227-I274 HydrophobicContact CG2-CD1 4.22Å; T227-I274 HydrophobicContact CG2-CG2 3.89Å
228	T	86.1	Confident	80.3	Confident	0 Å²	0	32 Å²	32	0%	0	15%	0.153	C	C	.	.			trans	-104	-164.2	166.5	59.4	0	0	0	0	108.6	L200 E202 A207 K230 R231 F233 S272	L200-T228 HydrophobicContact CB-CG2 3.98Å; L200-T228 HydrophobicContact CD1-CG2 3.77Å; E202-T228 WeakPolarHBondContact OE1-CB 3.47Å; E202-T228 PolarHBondContact OE1-OG1 2.95Å; A207-T228 HydrophobicContact CB-CG2 4.38Å; T228-K230 VanDerWaalsContact C-N 3.32Å; T228-K230 PolarHBondContact O-N 3.34Å; T228-R231 PolarHBondContact N-O 3.24Å; T228-R231 WeakPolarHBondContact OG1-CB 3.4Å; T228-R231 PolarHBondContact OG1-N 3.35Å; T228-R231 PolarHBondContact OG1-O 2.57Å; T228-F233 HydrophobicContact CG2-CD2 4.28Å; T228-F233 HydrophobicContact CG2-CE2 3.72Å; T228-S272 WeakPolarHBondContact O-CB 3.41Å; T228-S272 PolarHBondContact O-OG 3.13Å
229	R	82.9	Confident	80.5	Confident	101 Å²	101	27.9 Å²	27.9	38%	0.381	13%	0.126	S	C	.	.	S	Bend	trans	-68.5	-32.3	-177.2	-63.8	176.8	171.5	161.4	1.8	112.8	E202 P208 G270	E202-R229 PolarHBondContact OE1-N 3.35Å; P208-R229 HydrophobicContact CG-CG 4.02Å; P208-R229 VanDerWaalsContact CG-NE 3.32Å; R229-G270 PolarHBondContact NE-O 3.09Å
230	K	80	Confident	80.3	Confident	42 Å²	42	25 Å²	25	18%	0.183	12%	0.124	C	C	.	.	S	Bend	trans	-123.4	-21.2	-176.2	-64.6	-178.1	-178.8	175.4	0	114.5	E202 D203 T228 F265 N268 W290	E202-K230 PolarHBondContact OE1-N 3.34Å; D203-K230 IonicContact OD2-NZ 2.85Å; D203-K230 PolarHBondContact OD2-NZ 2.78Å; T228-K230 VanDerWaalsContact C-N 3.32Å; T228-K230 PolarHBondContact O-N 3.34Å; K230-F265 PolarHBondContact O-N 3.12Å; K230-N268 HydrophobicContact CG-CB 4.09Å; K230-W290 WeakPolarHBondContact O-CH2 3.16Å
231	R	84.4	Confident	79.7	Confident	41 Å²	41	31.9 Å²	31.9	16%	0.155	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	140	-170.9	-60	179.3	-179.9	179.1	-10.6	111.7	E201 D203 T227 T228 F233 F262 Q263 E264	E201-R231 PolarHBondContact O-NH1 2.85Å; D203-R231 IonicContact OD1-NH2 2.65Å; T227-R231 WeakPolarHBondContact CA-O 2.99Å; T228-R231 PolarHBondContact N-O 3.24Å; T228-R231 WeakPolarHBondContact OG1-CB 3.4Å; T228-R231 PolarHBondContact OG1-N 3.35Å; T228-R231 PolarHBondContact OG1-O 2.57Å; R231-F233 HydrophobicContact CB-CD2 4.24Å; R231-F233 HydrophobicContact CB-CE2 3.59Å; R231-F233 HydrophobicContact CB-CZ 3.86Å; R231-F233 HydrophobicContact CG-CZ 4.45Å; R231-F262 HydrophobicContact CG-CD2 4.29Å; R231-Q263 CarbonylContact C-O 3.49Å; R231-Q263 VanDerWaalsContact CA-O 3.28Å; R231-Q263 WeakPolarHBondContact CA-O 3.48Å; R231-E264 HydrophobicContact CG-CB 4.02Å; R231-E264 HydrophobicContact CG-CG 3.95Å; R231-E264 IonicContact CZ-OE1 3.96Å; R231-E264 IonicContact CZ-OE2 3.96Å; R231-E264 IonicContact NE-OE1 2.69Å; R231-E264 PolarHBondContact NE-OE1 3.19Å; R231-E264 IonicContact NE-OE2 2.6Å; R231-E264 PolarHBondContact NE-OE2 3.23Å; R231-E264 IonicContact NH2-OE1 3.35Å; R231-E264 PolarHBondContact NH2-OE1 2.84Å; R231-E264 IonicContact NH2-OE2 2.82Å; R231-E264 PolarHBondContact NH2-OE2 2.51Å; R231-E264 VanDerWaalsContact NH2-OE2 3.09Å
232	L	85.6	Confident	78.8	Confident	4 Å²	4	34.2 Å²	34.2	2%	0.021	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	119.8	166.3	-178.6	157.2	0	0	0	107.4	I225 T227 F262 Q263 I274 W290 L310	I225-L232 HydrophobicContact CG2-CD1 4.39Å; I225-L232 HydrophobicContact CG2-CD2 4.26Å; I225-L232 HydrophobicContact CG2-CG 4.14Å; T227-L232 HydrophobicContact CG2-CB 4.19Å; T227-L232 HydrophobicContact CG2-CD1 4.17Å; T227-L232 HydrophobicContact CG2-CG 3.99Å; L232-F262 CarbonylContact O-C 3.59Å; L232-F262 WeakPolarHBondContact O-CA 3.47Å; L232-Q263 PolarHBondContact N-O 3.07Å; L232-Q263 PolarHBondContact O-N 3.23Å; L232-I274 HydrophobicContact CD1-CD1 3.77Å; L232-W290 HydrophobicContact CB-CE3 4.08Å; L232-W290 HydrophobicContact CB-CH2 3.84Å; L232-W290 HydrophobicContact CB-CZ2 4.38Å; L232-W290 HydrophobicContact CB-CZ3 3.64Å; L232-W290 HydrophobicContact CD1-CD2 4.33Å; L232-W290 HydrophobicContact CD1-CE3 4Å; L232-W290 HydrophobicContact CD1-CZ3 4.4Å; L232-L310 HydrophobicContact CD2-CD1 4.21Å
233	F	84.5	Confident	77.9	Confident	14 Å²	14	35.3 Å²	35.3	6%	0.061	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	135	177.1	-62.6	-87.9	0	0	0	110.1	L200 A226 T228 R231 F235 P260 F262	L200-F233 HydrophobicContact CB-CE2 4.44Å; L200-F233 HydrophobicContact CD1-CD2 3.97Å; L200-F233 HydrophobicContact CD1-CE2 4.22Å; L200-F233 HydrophobicContact CD2-CD1 4.16Å; L200-F233 HydrophobicContact CD2-CD2 3.79Å; L200-F233 HydrophobicContact CD2-CE1 4.28Å; L200-F233 HydrophobicContact CD2-CE2 3.91Å; L200-F233 HydrophobicContact CD2-CG 3.92Å; L200-F233 HydrophobicContact CD2-CZ 4.15Å; L200-F233 HydrophobicContact CG-CD2 4.45Å; L200-F233 HydrophobicContact CG-CE2 4.43Å; A226-F233 HydrophobicContact CB-CB 4.37Å; A226-F233 PolarHBondContact N-O 2.84Å; A226-F233 PolarHBondContact O-N 2.97Å; T228-F233 HydrophobicContact CG2-CD2 4.28Å; T228-F233 HydrophobicContact CG2-CE2 3.72Å; R231-F233 HydrophobicContact CB-CD2 4.24Å; R231-F233 HydrophobicContact CB-CE2 3.59Å; R231-F233 HydrophobicContact CB-CZ 3.86Å; R231-F233 HydrophobicContact CG-CZ 4.45Å; F233-F235 HydrophobicContact CB-CE2 3.8Å; F233-F235 HydrophobicContact CB-CZ 4.11Å; F233-P260 HydrophobicContact CD1-CG 4.39Å; F233-F262 HydrophobicContact CD1-CB 3.8Å; F233-F262 HydrophobicContact CE1-CB 3.99Å; F233-F262 HydrophobicContact CE1-CG 4.42Å; F233-F262 HydrophobicContact CG-CB 4.46Å
234	Q	82.8	Confident	76.7	Confident	11 Å²	11	37 Å²	37	5%	0.051	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.9	173	-176	-174.1	-24.7	0	0	109.8	V236 S261 L309	Q234-V236 HydrophobicContact CG-CG2 4.02Å; Q234-S261 PolarHBondContact N-O 2.87Å; Q234-L309 VanDerWaalsContact NE2-N 3.19Å; Q234-L309 VanDerWaalsContact OE1-N 3.09Å
235	F	82.1	Confident	75.2	Confident	1 Å²	1	45.3 Å²	45.3	0%	0.004	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.5	171.2	-53.9	-87.4	0	0	0	109.5	H198 L200 F223 I224 A226 F233 I251 F252 N255 P260	H198-F235 AromaticContact CD2-CZ 3.74Å; H198-F235 AromaticContact NE2-CE1 3.82Å; H198-F235 AromaticContact NE2-CZ 3.75Å; L200-F235 HydrophobicContact CD2-CZ 4.05Å; F223-F235 WeakPolarHBondContact CA-O 3.28Å; I224-F235 HydrophobicContact CB-CB 4.18Å; I224-F235 HydrophobicContact CB-CD2 4.38Å; I224-F235 HydrophobicContact CG2-CD2 4.35Å; I224-F235 PolarHBondContact N-O 2.72Å; I224-F235 PolarHBondContact O-N 2.77Å; A226-F235 HydrophobicContact CB-CE2 4.11Å; F233-F235 HydrophobicContact CB-CE2 3.8Å; F233-F235 HydrophobicContact CB-CZ 4.11Å; F235-I251 HydrophobicContact CB-CG2 4.42Å; F235-F252 AromaticContact CD1-CD1 3.94Å; F235-F252 HydrophobicContact CD1-CD1 3.94Å; F235-F252 HydrophobicContact CD1-CE1 4.19Å; F235-F252 HydrophobicContact CD2-CD1 4.44Å; F235-F252 AromaticContact CD2-CE1 3.86Å; F235-F252 HydrophobicContact CD2-CE1 3.86Å; F235-F252 HydrophobicContact CE1-CD1 4.01Å; F235-F252 HydrophobicContact CE1-CE1 4.24Å; F235-F252 AromaticContact CE2-CE1 3.93Å; F235-F252 HydrophobicContact CE2-CE1 3.93Å; F235-F252 HydrophobicContact CG-CD1 4.16Å; F235-F252 HydrophobicContact CG-CE1 4.01Å; F235-F252 HydrophobicContact CZ-CD1 4.3Å; F235-F252 HydrophobicContact CZ-CE1 4.12Å; F235-N255 HydrophobicContact CD1-CB 3.95Å; F235-P260 HydrophobicContact CD1-CB 4.17Å; F235-P260 HydrophobicContact CE1-CB 3.89Å; F235-P260 HydrophobicContact CE1-CG 4.12Å; F235-P260 HydrophobicContact CZ-CB 4.49Å
236	V	79.1	Confident	73.8	Confident	35 Å²	35	53.1 Å²	53.1	21%	0.212	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	123	-179.7	-173.3	0	0	0	0	109.2	Y222 F223 Q234 N255	Y222-V236 WeakPolarHBondContact O-CA 3.41Å; F223-V236 HydrophobicContact CD1-CB 4.36Å; F223-V236 HydrophobicContact CD1-CG1 4.08Å; F223-V236 HydrophobicContact CD1-CG2 3.66Å; F223-V236 HydrophobicContact CE1-CB 4.25Å; F223-V236 HydrophobicContact CE1-CG1 3.62Å; F223-V236 HydrophobicContact CE1-CG2 3.65Å; F223-V236 HydrophobicContact CZ-CG1 4.14Å; Q234-V236 HydrophobicContact CG-CG2 4.02Å; V236-N255 PolarHBondContact N-ND2 3.41Å; V236-N255 PolarHBondContact N-OD1 3.49Å; V236-N255 PolarHBondContact O-ND2 3.4Å; V236-N255 PolarHBondContact O-OD1 2.87Å
237	G	75.9	Confident	72.5	Confident	3 Å²	3	53.4 Å²	53.4	3%	0.031	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	155.3	179	0	0	0	0	0	113	K221 Y222 Q254	K221-G237 CarbonylContact C-O 3.57Å; K221-G237 WeakPolarHBondContact CA-O 3.11Å; Y222-G237 PolarHBondContact N-O 3.12Å; Y222-G237 PolarHBondContact O-N 2.84Å; G237-Q254 VanDerWaalsContact CA-OE1 3.23Å
238	K	74.1	Confident	71.9	Confident	125 Å²	125	53.7 Å²	53.7	54%	0.543	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	130.5	171.8	-74.3	-177	-177.1	-173.4	0	109.3	K221 Q254	K221-K238 HydrophobicContact CG-CD 4.48Å; K221-K238 HydrophobicContact CG-CG 3.8Å; K238-Q254 PolarHBondContact O-NE2 3.19Å
239	V	70.4	Confident	71.2	Confident	16 Å²	16	54.8 Å²	54.8	10%	0.097	29%	0.292	C	S	.	.			trans	-109.6	132.7	172.3	-179.2	0	0	0	0	107.8	Y222 S243 I251	Y222-V239 HydrophobicContact CD2-CB 4.03Å; Y222-V239 HydrophobicContact CD2-CG2 3.64Å; Y222-V239 HydrophobicContact CE2-CB 3.87Å; Y222-V239 HydrophobicContact CE2-CG2 3.87Å; V239-S243 VanDerWaalsContact CG1-OG 3.31Å; V239-S243 WeakPolarHBondContact CG1-OG 3.42Å; V239-I251 HydrophobicContact CG2-CD1 4.01Å; V239-I251 HydrophobicContact CG2-CG1 3.9Å
240	A	63	Low	70.7	Confident	70 Å²	70	53.1 Å²	53.1	58%	0.579	29%	0.293	S	S	*	.			trans	-66.3	140.7	179.3	0	0	0	0	0	111.3	G242 S243	A240-G242 PolarHBondContact O-N 2.94Å; A240-S243 PolarHBondContact O-N 3.29Å; A240-S243 VanDerWaalsContact O-N 3.08Å; A240-S243 PolarHBondContact O-OG 3.47Å
241	E	58.4	Low	70.6	Confident	165 Å²	165	51.1 Å²	51.1	77%	0.771	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	128.5	177.7	-79.9	-177.6	165.5	0	0	111.3	N220	N220-E241 WeakPolarHBondContact ND2-CG 3.48Å; N220-E241 PolarHBondContact ND2-OE1 2.91Å
242	G	58	Low	70.2	Confident	77 Å²	77	49.2 Å²	49.2	79%	0.794	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.3	-11.2	-178	0	0	0	0	0	115.9	A240	A240-G242 PolarHBondContact O-N 2.94Å
243	S	60	Low	69.5	Low	29 Å²	29	51.7 Å²	51.7	20%	0.203	30%	0.295	C	S	.	.			trans	-94.8	7.1	175.6	66.5	0	0	0	0	114.3	V239 A240 Q245 Q246	V239-S243 VanDerWaalsContact CG1-OG 3.31Å; V239-S243 WeakPolarHBondContact CG1-OG 3.42Å; A240-S243 PolarHBondContact O-N 3.29Å; A240-S243 VanDerWaalsContact O-N 3.08Å; A240-S243 PolarHBondContact O-OG 3.47Å; S243-Q245 PolarHBondContact O-N 3.14Å; S243-Q245 VanDerWaalsContact O-N 3.13Å; S243-Q246 WeakPolarHBondContact O-CB 3.34Å; S243-Q246 PolarHBondContact O-N 3.49Å
244	E	56.3	Low	68.7	Low	38 Å²	38	54.7 Å²	54.7	18%	0.178	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-62.4	-23.4	-175.5	-62.8	175.7	-167.1	0	0	114	L155 R216	L155-E244 HydrophobicContact CD1-CB 4.41Å; R216-E244 IonicContact CZ-OE1 3.55Å; R216-E244 IonicContact CZ-OE2 2.77Å; R216-E244 IonicContact NH1-OE1 3.14Å; R216-E244 PolarHBondContact NH1-OE1 2.84Å; R216-E244 IonicContact NH1-OE2 2.96Å; R216-E244 PolarHBondContact NH1-OE2 3.17Å; R216-E244 IonicContact NH2-OE1 3.39Å; R216-E244 PolarHBondContact NH2-OE1 2.82Å; R216-E244 IonicContact NH2-OE2 2.73Å
245	Q	54.9	Low	67.8	Low	174 Å²	174	55.1 Å²	55.1	81%	0.813	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-81	-12.6	173.8	-66.1	-177.2	-13.7	0	0	113.3	S243	S243-Q245 PolarHBondContact O-N 3.14Å; S243-Q245 VanDerWaalsContact O-N 3.13Å
246	Q	55.8	Low	66.7	Low	169 Å²	169	61 Å²	61	79%	0.79	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-88.6	-2.2	-178.1	-62.6	-175.2	-10.5	0	0	113.7	S243	S243-Q246 WeakPolarHBondContact O-CB 3.34Å; S243-Q246 PolarHBondContact O-N 3.49Å
247	G	62	Low	65.4	Low	7 Å²	7	66.4 Å²	66.4	7%	0.072	37%	0.367	C	S	.	.			trans	108.2	159.9	163.5	0	0	0	0	0	116.6	E175 S249	E175-G247 VanDerWaalsContact OE1-C 3.24Å; E175-G247 WeakPolarHBondContact OE1-CA 3.32Å; G247-S249 VanDerWaalsContact C-N 3.28Å; G247-S249 PolarHBondContact O-N 3.1Å
248	L	72.8	Confident	64.3	Low	6 Å²	6	72.5 Å²	72.5	3%	0.031	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-7.9	-178.9	-63.5	168.9	0	0	0	113.1	P163 L165 E175 I214 Y222 T250 I251	P163-L248 HydrophobicContact CB-CD1 4.43Å; P163-L248 HydrophobicContact CB-CG 4.49Å; L165-L248 HydrophobicContact CD1-CD1 4.19Å; L165-L248 HydrophobicContact CD2-CB 4.32Å; L165-L248 HydrophobicContact CD2-CD1 4.03Å; L165-L248 HydrophobicContact CG-CD1 3.81Å; E175-L248 VanDerWaalsContact CD-N 3.32Å; E175-L248 PolarHBondContact OE1-N 3.26Å; E175-L248 PolarHBondContact OE2-N 3.45Å; I214-L248 HydrophobicContact CD1-CD1 3.82Å; Y222-L248 HydrophobicContact CD1-CD2 4.04Å; Y222-L248 HydrophobicContact CE1-CD2 4.22Å; L248-T250 PolarHBondContact O-N 3.19Å; L248-I251 HydrophobicContact CB-CD1 4.28Å; L248-I251 HydrophobicContact CD2-CD1 3.62Å; L248-I251 WeakPolarHBondContact O-CB 3.24Å; L248-I251 PolarHBondContact O-N 3.34Å; L248-I251 VanDerWaalsContact O-N 3.13Å
249	S	72.3	Confident	63.1	Low	23 Å²	23	74.5 Å²	74.5	16%	0.161	41%	0.414	C	S	.	.	H	α-helix	trans	-54.2	-33.8	179.7	63.1	0	0	0	0	115	E175 G247 I251 F252 S253	E175-S249 PolarHBondContact OE2-N 3.45Å; E175-S249 VanDerWaalsContact OE2-N 3.16Å; G247-S249 VanDerWaalsContact C-N 3.28Å; G247-S249 PolarHBondContact O-N 3.1Å; S249-I251 VanDerWaalsContact C-N 3.27Å; S249-I251 PolarHBondContact O-N 3.47Å; S249-F252 PolarHBondContact O-N 3.09Å; S249-S253 PolarHBondContact O-N 2.92Å
250	T	73.2	Confident	62.5	Low	66 Å²	66	75 Å²	75	41%	0.405	42%	0.417	S	S	.	.	H	α-helix	trans	-64.1	-29.8	179.8	-49.2	0	0	0	0	113.1	L248 S253 Q254	L248-T250 PolarHBondContact O-N 3.19Å; T250-S253 WeakPolarHBondContact CA-OG 3.47Å; T250-S253 PolarHBondContact O-N 3Å; T250-S253 PolarHBondContact O-OG 2.88Å; T250-Q254 WeakPolarHBondContact O-CG 3.38Å; T250-Q254 PolarHBondContact O-N 3.44Å; T250-Q254 VanDerWaalsContact O-N 3.13Å
251	I	76.3	Confident	62.6	Low	0 Å²	0	74.7 Å²	74.7	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-66.8	-43.1	179.7	-63	155.8	0	0	0	110	Y222 I224 F235 V239 L248 S249 Q254 N255	Y222-I251 HydrophobicContact CD1-CD1 4.46Å; Y222-I251 HydrophobicContact CD2-CD1 4.26Å; Y222-I251 HydrophobicContact CG-CD1 3.8Å; I224-I251 HydrophobicContact CD1-CB 4.33Å; I224-I251 HydrophobicContact CD1-CD1 4.12Å; I224-I251 HydrophobicContact CD1-CG2 3.91Å; F235-I251 HydrophobicContact CB-CG2 4.42Å; V239-I251 HydrophobicContact CG2-CD1 4.01Å; V239-I251 HydrophobicContact CG2-CG1 3.9Å; L248-I251 HydrophobicContact CB-CD1 4.28Å; L248-I251 HydrophobicContact CD2-CD1 3.62Å; L248-I251 WeakPolarHBondContact O-CB 3.24Å; L248-I251 PolarHBondContact O-N 3.34Å; L248-I251 VanDerWaalsContact O-N 3.13Å; S249-I251 VanDerWaalsContact C-N 3.27Å; S249-I251 PolarHBondContact O-N 3.47Å; I251-Q254 PolarHBondContact O-N 3.41Å; I251-N255 PolarHBondContact O-N 3.2Å; I251-N255 PolarHBondContact O-ND2 3.33Å
252	F	76.6	Confident	62.9	Low	1 Å²	1	71.5 Å²	71.5	0%	0.004	40%	0.395	C	S	.	.	H	α-helix	trans	-69.6	-33.7	179.7	-69	-87.8	0	0	0	112.5	L165 I173 V197 H198 I224 F235 S249 N255 Q256	L165-F252 HydrophobicContact CD1-CE2 3.96Å; L165-F252 HydrophobicContact CD1-CZ 3.92Å; L165-F252 HydrophobicContact CD2-CE2 4.08Å; I173-F252 HydrophobicContact CD1-CE1 4.11Å; I173-F252 HydrophobicContact CD1-CZ 4.42Å; I173-F252 HydrophobicContact CG2-CZ 4.16Å; V197-F252 HydrophobicContact CB-CD2 4.32Å; V197-F252 HydrophobicContact CG1-CB 3.59Å; V197-F252 HydrophobicContact CG1-CD1 4.42Å; V197-F252 HydrophobicContact CG1-CD2 3.16Å; V197-F252 HydrophobicContact CG1-CE2 3.84Å; V197-F252 HydrophobicContact CG1-CG 3.48Å; V197-F252 VanDerWaalsContact CG1-CG 3.48Å; H198-F252 HydrophobicContact CB-CD1 3.59Å; H198-F252 HydrophobicContact CB-CE1 3.96Å; H198-F252 HydrophobicContact CB-CG 4.22Å; H198-F252 AromaticContact CG-CD1 3.85Å; I224-F252 HydrophobicContact CD1-CD2 4.3Å; I224-F252 HydrophobicContact CD1-CE2 3.54Å; I224-F252 HydrophobicContact CD1-CZ 3.72Å; I224-F252 HydrophobicContact CG2-CZ 4.16Å; F235-F252 AromaticContact CD1-CD1 3.94Å; F235-F252 HydrophobicContact CD1-CD1 3.94Å; F235-F252 HydrophobicContact CD1-CE1 4.19Å; F235-F252 HydrophobicContact CD2-CD1 4.44Å; F235-F252 AromaticContact CD2-CE1 3.86Å; F235-F252 HydrophobicContact CD2-CE1 3.86Å; F235-F252 HydrophobicContact CE1-CD1 4.01Å; F235-F252 HydrophobicContact CE1-CE1 4.24Å; F235-F252 AromaticContact CE2-CE1 3.93Å; F235-F252 HydrophobicContact CE2-CE1 3.93Å; F235-F252 HydrophobicContact CG-CD1 4.16Å; F235-F252 HydrophobicContact CG-CE1 4.01Å; F235-F252 HydrophobicContact CZ-CD1 4.3Å; F235-F252 HydrophobicContact CZ-CE1 4.12Å; S249-F252 PolarHBondContact O-N 3.09Å; F252-N255 PolarHBondContact O-N 3.36Å; F252-Q256 WeakPolarHBondContact O-CG 3.31Å; F252-Q256 PolarHBondContact O-N 3.46Å
253	S	71	Confident	63.5	Low	56 Å²	56	70.7 Å²	70.7	39%	0.392	37%	0.37	S	S	.	.	H	α-helix	trans	-66.8	-37.6	173.1	51.8	0	0	0	0	112.7	S249 T250 N255 Q256	S249-S253 PolarHBondContact O-N 2.92Å; T250-S253 WeakPolarHBondContact CA-OG 3.47Å; T250-S253 PolarHBondContact O-N 3Å; T250-S253 PolarHBondContact O-OG 2.88Å; S253-N255 VanDerWaalsContact C-N 3.25Å; S253-N255 PolarHBondContact O-N 2.97Å; S253-Q256 PolarHBondContact O-N 3.32Å
254	Q	67.7	Low	64.1	Low	77 Å²	77	73.1 Å²	73.1	36%	0.36	38%	0.378	S	S	.	.	H	α-helix	trans	-64.9	-28.9	177.4	-72.6	171.5	9.2	0	0	112.8	G237 K238 T250 I251	G237-Q254 VanDerWaalsContact CA-OE1 3.23Å; K238-Q254 PolarHBondContact O-NE2 3.19Å; T250-Q254 WeakPolarHBondContact O-CG 3.38Å; T250-Q254 PolarHBondContact O-N 3.44Å; T250-Q254 VanDerWaalsContact O-N 3.13Å; I251-Q254 PolarHBondContact O-N 3.41Å
255	N	65.1	Low	64.7	Low	19 Å²	19	73 Å²	73	10%	0.102	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	3.2	179.1	-68	-87.1	0	0	0	113.3	F235 V236 I251 F252 S253 L258	F235-N255 HydrophobicContact CD1-CB 3.95Å; V236-N255 PolarHBondContact N-ND2 3.41Å; V236-N255 PolarHBondContact N-OD1 3.49Å; V236-N255 PolarHBondContact O-ND2 3.4Å; V236-N255 PolarHBondContact O-OD1 2.87Å; I251-N255 PolarHBondContact O-N 3.2Å; I251-N255 PolarHBondContact O-ND2 3.33Å; F252-N255 PolarHBondContact O-N 3.36Å; S253-N255 VanDerWaalsContact C-N 3.25Å; S253-N255 PolarHBondContact O-N 2.97Å; N255-L258 CarbonylContact C-O 3.59Å
256	Q	58.9	Low	65.1	Low	124 Å²	124	70.2 Å²	70.2	58%	0.579	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-31.3	171.1	-85.2	174.4	-11.8	0	0	111.8	F252 S253	F252-Q256 WeakPolarHBondContact O-CG 3.31Å; F252-Q256 PolarHBondContact O-N 3.46Å; S253-Q256 PolarHBondContact O-N 3.32Å
257	D	50.2	Low	65.6	Low	149 Å²	149	63.6 Å²	63.6	80%	0.797	35%	0.349	S	S	*	.	S	Bend	trans	-80.1	-24.8	-179.9	-64.8	-34.5	0	0	0	113
258	L	52.6	Low	65.9	Low	132 Å²	132	66.6 Å²	66.6	69%	0.691	36%	0.363	S	S	*	.	S	Bend	trans	-117.5	98.2	175.5	-68.7	159.8	0	0	0	106.7	N255	N255-L258 CarbonylContact C-O 3.59Å
259	L	49.1	Very low	65.7	Low	166 Å²	166	66.9 Å²	66.9	87%	0.869	36%	0.364	S	S	*	.			trans	-35	123.6	179.3	-76.8	157.8	0	0	0	111.1	S261	L259-S261 PolarHBondContact O-N 3.04Å
260	P	58.9	Low	65.5	Low	26 Å²	26	67.7 Å²	67.7	17%	0.169	38%	0.376	C	S	.	.			trans	-60	134.3	-175.1	22.8	-32.1	0	0	0	109.6	F233 F235 F262	F233-P260 HydrophobicContact CD1-CG 4.39Å; F235-P260 HydrophobicContact CD1-CB 4.17Å; F235-P260 HydrophobicContact CE1-CB 3.89Å; F235-P260 HydrophobicContact CE1-CG 4.12Å; F235-P260 HydrophobicContact CZ-CB 4.49Å; P260-F262 PolarHBondContact O-N 2.72Å; P260-F262 VanDerWaalsContact O-N 3.1Å
261	S	64	Low	65.6	Low	65 Å²	65	68.4 Å²	68.4	46%	0.455	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	117.6	173.5	-170.8	0	0	0	0	108	Q234 L259	Q234-S261 PolarHBondContact N-O 2.87Å; L259-S261 PolarHBondContact O-N 3.04Å
262	F	65.6	Low	65.9	Low	97 Å²	97	68.8 Å²	68.8	43%	0.425	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	141.5	177.2	75	-89.4	0	0	0	111	R231 L232 F233 P260 E264	R231-F262 HydrophobicContact CG-CD2 4.29Å; L232-F262 CarbonylContact O-C 3.59Å; L232-F262 WeakPolarHBondContact O-CA 3.47Å; F233-F262 HydrophobicContact CD1-CB 3.8Å; F233-F262 HydrophobicContact CE1-CB 3.99Å; F233-F262 HydrophobicContact CE1-CG 4.42Å; F233-F262 HydrophobicContact CG-CB 4.46Å; P260-F262 PolarHBondContact O-N 2.72Å; P260-F262 VanDerWaalsContact O-N 3.1Å; F262-E264 HydrophobicContact CD2-CB 4.06Å; F262-E264 HydrophobicContact CE2-CB 3.94Å
263	Q	70.8	Confident	66.2	Low	61 Å²	61	70.1 Å²	70.1	29%	0.285	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	127.1	168.5	-70.1	-172.9	-5.2	0	0	108.8	R231 L232 F265	R231-Q263 CarbonylContact C-O 3.49Å; R231-Q263 VanDerWaalsContact CA-O 3.28Å; R231-Q263 WeakPolarHBondContact CA-O 3.48Å; L232-Q263 PolarHBondContact N-O 3.07Å; L232-Q263 PolarHBondContact O-N 3.23Å; Q263-F265 HydrophobicContact CB-CE2 4.35Å
264	E	72.5	Confident	67	Low	79 Å²	79	67.9 Å²	67.9	37%	0.369	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	138.1	-177.7	-178.9	163.1	-143.6	0	0	111.2	R231 F262	R231-E264 HydrophobicContact CG-CB 4.02Å; R231-E264 HydrophobicContact CG-CG 3.95Å; R231-E264 IonicContact CZ-OE1 3.96Å; R231-E264 IonicContact CZ-OE2 3.96Å; R231-E264 IonicContact NE-OE1 2.69Å; R231-E264 PolarHBondContact NE-OE1 3.19Å; R231-E264 IonicContact NE-OE2 2.6Å; R231-E264 PolarHBondContact NE-OE2 3.23Å; R231-E264 IonicContact NH2-OE1 3.35Å; R231-E264 PolarHBondContact NH2-OE1 2.84Å; R231-E264 IonicContact NH2-OE2 2.82Å; R231-E264 PolarHBondContact NH2-OE2 2.51Å; R231-E264 VanDerWaalsContact NH2-OE2 3.09Å; F262-E264 HydrophobicContact CD2-CB 4.06Å; F262-E264 HydrophobicContact CE2-CB 3.94Å
265	F	68.8	Low	68	Low	36 Å²	36	65.4 Å²	65.4	16%	0.158	35%	0.354	C	S	.	.			trans	-118.6	143.1	176.1	-71	-89.7	0	0	0	111.9	K230 Q263 A267 W290 M292 L297	K230-F265 PolarHBondContact O-N 3.12Å; Q263-F265 HydrophobicContact CB-CE2 4.35Å; F265-A267 PolarHBondContact O-N 2.78Å; F265-W290 HydrophobicContact CD2-CE3 4.33Å; F265-W290 AromaticContact CD2-CH2 3.88Å; F265-W290 HydrophobicContact CD2-CH2 3.88Å; F265-W290 AromaticContact CD2-CZ3 3.45Å; F265-W290 HydrophobicContact CD2-CZ3 3.45Å; F265-W290 VanDerWaalsContact CD2-CZ3 3.45Å; F265-W290 HydrophobicContact CE2-CE3 4.14Å; F265-W290 HydrophobicContact CE2-CH2 4.37Å; F265-W290 AromaticContact CE2-CZ3 3.51Å; F265-W290 HydrophobicContact CE2-CZ3 3.51Å; F265-M292 HydrophobicContact CB-SD 4.31Å; F265-M292 HydrophobicContact CD1-CE 3.99Å; F265-M292 HydrophobicContact CD1-SD 3.7Å; F265-M292 HydrophobicContact CD2-SD 3.31Å; F265-M292 WeakPolarHBondContact CD2-SD 3.34Å; F265-M292 HydrophobicContact CE1-CE 3.83Å; F265-M292 HydrophobicContact CE1-SD 3.75Å; F265-M292 HydrophobicContact CE2-CE 4.45Å; F265-M292 HydrophobicContact CE2-SD 3.38Å; F265-M292 WeakPolarHBondContact CE2-SD 3.32Å; F265-M292 HydrophobicContact CG-CE 4.37Å; F265-M292 HydrophobicContact CG-SD 3.47Å; F265-M292 WeakPolarHBondContact CG-SD 3.48Å; F265-M292 HydrophobicContact CZ-CE 4.07Å; F265-M292 HydrophobicContact CZ-SD 3.6Å; F265-M292 VanDerWaalsContact CZ-SD 3.6Å; F265-L297 HydrophobicContact CE2-CD2 3.98Å; F265-L297 HydrophobicContact CZ-CD1 3.82Å; F265-L297 HydrophobicContact CZ-CD2 3.98Å; F265-L297 HydrophobicContact CZ-CG 4.41Å
266	P	62.6	Low	69	Low	115 Å²	115	65.9 Å²	65.9	75%	0.747	36%	0.356	S	S	*	.	S	Bend	trans	-74.2	-25.8	-171.7	25.6	-32.2	0	0	0	114.1
267	A	67.2	Low	70.2	Confident	30 Å²	30	61.5 Å²	61.5	25%	0.248	33%	0.334	C	S	.	.			trans	-97.3	132.7	-174.6	0	0	0	0	0	112.4	F265 N294	F265-A267 PolarHBondContact O-N 2.78Å; A267-N294 HydrophobicContact CB-CB 4.02Å
268	N	69	Low	71.5	Confident	70 Å²	70	55.3 Å²	55.3	37%	0.374	30%	0.301	S	S	.	.			trans	-120.4	124.3	-176.7	-174	0.1	0	0	0	111.6	K230 G270	K230-N268 HydrophobicContact CG-CB 4.09Å; N268-G270 WeakPolarHBondContact OD1-CA 3.27Å; N268-G270 PolarHBondContact OD1-N 3.45Å
269	M	67.6	Low	72.1	Confident	13 Å²	13	51.4 Å²	51.4	6%	0.064	29%	0.288	C	S	.	.			trans	-90.9	-6.5	174.8	-90.7	177.2	-174.2	0	0	114.3	G293 Y318 I324 P329	M269-G293 VanDerWaalsContact CE-O 3.23Å; M269-G293 WeakPolarHBondContact CE-O 3.44Å; M269-Y318 HydrophobicContact CE-CD2 4.03Å; M269-Y318 HydrophobicContact CE-CE2 3.37Å; M269-I324 HydrophobicContact CE-CB 4.39Å; M269-I324 HydrophobicContact CE-CG1 3.88Å; M269-I324 HydrophobicContact CE-CG2 4.05Å; M269-I324 HydrophobicContact CG-CG2 4Å; M269-P329 HydrophobicContact CE-CG 3.96Å; M269-P329 HydrophobicContact SD-CG 3.9Å
270	G	68.5	Low	72.8	Confident	39 Å²	39	50.4 Å²	50.4	40%	0.402	28%	0.277	S	S	.	.	S	Bend	trans	96.5	-19.4	-174.7	0	0	0	0	0	113.8	R229 N268	R229-G270 PolarHBondContact NE-O 3.09Å; N268-G270 WeakPolarHBondContact OD1-CA 3.27Å; N268-G270 PolarHBondContact OD1-N 3.45Å
271	Y	74.1	Confident	72.7	Confident	82 Å²	82	50.9 Å²	50.9	32%	0.322	28%	0.278	S	S	.	.			trans	-148.1	161	173.6	61.6	-82.2	0	0	0	109.4	M291 P329	Y271-M291 HydrophobicContact CD2-CE 4.14Å; Y271-M291 HydrophobicContact CE2-CE 3.58Å; Y271-P329 PolarHBondContact OH-O 2.72Å
272	S	82.4	Confident	72.5	Confident	8 Å²	8	57.2 Å²	57.2	6%	0.056	29%	0.292	C	S	.	.			trans	-134.7	150.1	172.5	78.9	0	0	0	0	109.3	C210 T228 W290	C210-S272 WeakPolarHBondContact CB-O 3.24Å; T228-S272 WeakPolarHBondContact O-CB 3.41Å; T228-S272 PolarHBondContact O-OG 3.13Å; S272-W290 PolarHBondContact OG-NE1 3.09Å
273	E	84.8	Confident	72.6	Confident	28 Å²	28	56.2 Å²	56.2	13%	0.131	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	128.3	175.6	-173	169.1	-138.6	0	0	109	M291 S331 I332 R372	E273-M291 HydrophobicContact CB-CE 4.02Å; E273-M291 WeakPolarHBondContact O-CB 3.39Å; E273-M291 PolarHBondContact O-N 2.9Å; E273-S331 WeakPolarHBondContact OE2-CA 3.3Å; E273-S331 WeakPolarHBondContact OE2-CB 3.44Å; E273-S331 PolarHBondContact OE2-OG 2.77Å; E273-I332 HydrophobicContact CB-CG2 4.19Å; E273-I332 HydrophobicContact CG-CG2 4.11Å; E273-I332 PolarHBondContact OE2-N 3.26Å; E273-R372 IonicContact OE1-CZ 3.66Å; E273-R372 IonicContact OE1-NE 3.49Å; E273-R372 PolarHBondContact OE1-NE 3.44Å; E273-R372 IonicContact OE1-NH2 2.74Å; E273-R372 PolarHBondContact OE1-NH2 3.37Å
274	I	87.8	Confident	72.6	Confident	10 Å²	10	57.1 Å²	57.1	5%	0.051	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139.4	173.8	-171.1	166.4	0	0	0	108.9	C211 I225 T227 L232 F276 F288 A289 W290	C211-I274 HydrophobicContact CB-CG2 3.56Å; C211-I274 WeakPolarHBondContact SG-CG2 3.48Å; I225-I274 HydrophobicContact CG2-CD1 4.38Å; T227-I274 HydrophobicContact CG2-CB 4.25Å; T227-I274 HydrophobicContact CG2-CD1 4.22Å; T227-I274 HydrophobicContact CG2-CG2 3.89Å; L232-I274 HydrophobicContact CD1-CD1 3.77Å; I274-F276 HydrophobicContact CD1-CE1 4.01Å; I274-F276 HydrophobicContact CD1-CE2 4.25Å; I274-F276 HydrophobicContact CD1-CZ 3.54Å; I274-F276 HydrophobicContact CG1-CE1 4.28Å; I274-F276 HydrophobicContact CG1-CE2 4.04Å; I274-F276 HydrophobicContact CG1-CZ 3.79Å; I274-F276 HydrophobicContact CG2-CE2 3.96Å; I274-F276 HydrophobicContact CG2-CZ 4.27Å; I274-F288 HydrophobicContact CD1-CD2 4.2Å; I274-A289 CarbonylContact C-O 3.58Å; I274-A289 WeakPolarHBondContact CA-O 3.42Å; I274-W290 HydrophobicContact CB-CB 4.22Å; I274-W290 HydrophobicContact CB-CG 4.24Å; I274-W290 HydrophobicContact CD1-CB 4.04Å; I274-W290 HydrophobicContact CD1-CG 4.38Å; I274-W290 HydrophobicContact CG1-CB 3.96Å; I274-W290 HydrophobicContact CG1-CG 4.43Å
275	T	87.5	Confident	72.8	Confident	24 Å²	24	53.4 Å²	53.4	15%	0.147	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	151.8	174.5	56.2	0	0	0	0	110.9	F288 A289 I332 L334	T275-F288 CarbonylContact O-C 3.56Å; T275-F288 WeakPolarHBondContact O-CA 3.31Å; T275-A289 PolarHBondContact N-O 2.99Å; T275-A289 PolarHBondContact O-N 3.49Å; T275-A289 PolarHBondContact OG1-O 2.92Å; T275-I332 HydrophobicContact CG2-CG2 4.08Å; T275-I332 WeakPolarHBondContact CG2-O 3.44Å; T275-L334 PolarHBondContact OG1-N 3.16Å
276	F	86.2	Confident	73.5	Confident	30 Å²	30	58 Å²	58	13%	0.132	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	141.9	-174.7	-65	-76	0	0	0	110.2	E213 I225 I274 P285 A287 F288 L301	E213-F276 HydrophobicContact CB-CD2 4.15Å; E213-F276 HydrophobicContact CB-CE2 3.59Å; E213-F276 HydrophobicContact CB-CZ 4.22Å; E213-F276 HydrophobicContact CG-CD2 3.85Å; E213-F276 HydrophobicContact CG-CE2 3.79Å; E213-F276 HydrophobicContact CG-CZ 4.48Å; I225-F276 HydrophobicContact CB-CZ 4.26Å; I225-F276 HydrophobicContact CD1-CE1 3.52Å; I225-F276 HydrophobicContact CD1-CZ 3.52Å; I225-F276 HydrophobicContact CG2-CZ 4.13Å; I274-F276 HydrophobicContact CD1-CE1 4.01Å; I274-F276 HydrophobicContact CD1-CE2 4.25Å; I274-F276 HydrophobicContact CD1-CZ 3.54Å; I274-F276 HydrophobicContact CG1-CE1 4.28Å; I274-F276 HydrophobicContact CG1-CE2 4.04Å; I274-F276 HydrophobicContact CG1-CZ 3.79Å; I274-F276 HydrophobicContact CG2-CE2 3.96Å; I274-F276 HydrophobicContact CG2-CZ 4.27Å; F276-P285 HydrophobicContact CB-CB 4.03Å; F276-P285 HydrophobicContact CB-CG 4.29Å; F276-P285 HydrophobicContact CD1-CB 4.37Å; F276-A287 WeakPolarHBondContact CA-O 3.28Å; F276-F288 HydrophobicContact CD1-CB 3.6Å; F276-F288 HydrophobicContact CE1-CB 3.58Å; F276-L301 HydrophobicContact CD1-CD1 3.82Å; F276-L301 HydrophobicContact CE1-CD1 4.13Å
277	Y	83.6	Confident	74.6	Confident	32 Å²	32	53.4 Å²	53.4	13%	0.125	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	110	174	177.3	-102.9	0	0	0	110.3	A279 P285 K286 A287 T335 Q336	Y277-A279 HydrophobicContact CE1-CB 4.49Å; Y277-P285 CarbonylContact O-C 3.53Å; Y277-P285 VanDerWaalsContact O-CA 3.29Å; Y277-P285 WeakPolarHBondContact O-CA 3.32Å; Y277-K286 HydrophobicContact CD1-CB 4.42Å; Y277-K286 PolarHBondContact O-N 2.81Å; Y277-A287 PolarHBondContact N-O 3.44Å; Y277-T335 VanDerWaalsContact CD2-O 3.26Å; Y277-T335 WeakPolarHBondContact CD2-O 3.37Å; Y277-Q336 HydrophobicContact CE1-CB 4.12Å; Y277-Q336 HydrophobicContact CE1-CG 3.91Å; Y277-Q336 HydrophobicContact CE2-CB 3.8Å; Y277-Q336 HydrophobicContact CE2-CG 4.47Å; Y277-Q336 WeakPolarHBondContact OH-CB 3.38Å; Y277-Q336 WeakPolarHBondContact OH-CG 3.24Å
278	T	77.2	Confident	75.7	Confident	18 Å²	18	52 Å²	52	11%	0.11	26%	0.257	C	S	.	.			trans	-107.7	131.6	168.9	46.6	0	0	0	0	109.5	K280 P285	T278-K280 VanDerWaalsContact C-N 3.35Å; T278-P285 HydrophobicContact CG2-CB 3.91Å; T278-P285 HydrophobicContact CG2-CG 3.56Å
279	A	66.8	Low	76.7	Confident	50 Å²	50	48.7 Å²	48.7	41%	0.413	24%	0.239	S	C	.	.	S	Bend	trans	-74	-28.7	176.5	0	0	0	0	0	112.4	Y277	Y277-A279 HydrophobicContact CE1-CB 4.49Å
280	K	64.1	Low	77.7	Confident	145 Å²	145	48.2 Å²	48.2	63%	0.63	24%	0.237	S	C	*	.	S	Bend	trans	-148.2	152.7	175.4	-63.7	-174.7	179.2	179.6	0	108.7	T278 R282 N283	T278-K280 VanDerWaalsContact C-N 3.35Å; K280-R282 PolarHBondContact O-N 3.48Å; K280-R282 VanDerWaalsContact O-N 3.1Å; K280-N283 HydrophobicContact CB-CB 4.32Å; K280-N283 PolarHBondContact O-N 2.92Å
281	L	56.6	Low	78.6	Confident	37 Å²	37	46.4 Å²	46.4	19%	0.194	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-32.6	-174.7	-159.9	85.5	0	0	0	114.7	P111 P377 I378	P111-L281 HydrophobicContact CB-CD1 4.06Å; P111-L281 HydrophobicContact CB-CD2 4.23Å; P111-L281 HydrophobicContact CB-CG 4.43Å; L281-P377 HydrophobicContact CD1-CB 3.94Å; L281-I378 HydrophobicContact CB-CG1 4.09Å; L281-I378 HydrophobicContact CD1-CD1 3.84Å; L281-I378 HydrophobicContact CD1-CG1 3.55Å; L281-I378 HydrophobicContact CD2-CD1 4.15Å; L281-I378 HydrophobicContact CD2-CG1 4.5Å; L281-I378 HydrophobicContact CG-CD1 4.4Å; L281-I378 HydrophobicContact CG-CG1 4.24Å
282	R	59.2	Low	78.8	Confident	197 Å²	197	42.8 Å²	42.8	74%	0.743	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.8	2.2	-179.1	-64.5	-174.3	-179.8	178	-0.5	114.1	K280	K280-R282 PolarHBondContact O-N 3.48Å; K280-R282 VanDerWaalsContact O-N 3.1Å
283	N	68.4	Low	78.4	Confident	76 Å²	76	42.6 Å²	42.6	41%	0.406	20%	0.203	S	C	.	.	S	Bend	trans	-91.4	148	173.7	-73	7.9	0	0	0	109.2	K280	K280-N283 HydrophobicContact CB-CB 4.32Å; K280-N283 PolarHBondContact O-N 2.92Å
284	F	69.8	Low	78.1	Confident	80 Å²	80	44.1 Å²	44.1	35%	0.351	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-63.9	140.2	175.7	-40.1	-62	0	0	0	110.5	R216 P218 K286 Y303	R216-F284 WeakPolarHBondContact O-CD1 3.41Å; R216-F284 WeakPolarHBondContact O-CE1 3.49Å; P218-F284 HydrophobicContact CG-CE2 3.77Å; P218-F284 HydrophobicContact CG-CZ 4.04Å; F284-K286 PolarHBondContact O-N 3.3Å; F284-Y303 HydrophobicContact CB-CD2 4.25Å; F284-Y303 HydrophobicContact CB-CE1 4.38Å; F284-Y303 HydrophobicContact CB-CE2 3.63Å
285	P	77.8	Confident	78	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.006	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-54.2	133	172.2	-24.6	28.7	0	0	0	112.3	E215 F276 Y277 T278 L301 Y303	E215-P285 VanDerWaalsContact CD-CG 3.47Å; E215-P285 HydrophobicContact CG-CG 3.92Å; E215-P285 WeakPolarHBondContact OE1-CD 3.32Å; E215-P285 WeakPolarHBondContact OE1-CG 3.32Å; E215-P285 VanDerWaalsContact OE2-CD 3.26Å; E215-P285 WeakPolarHBondContact OE2-CD 3.42Å; F276-P285 HydrophobicContact CB-CB 4.03Å; F276-P285 HydrophobicContact CB-CG 4.29Å; F276-P285 HydrophobicContact CD1-CB 4.37Å; Y277-P285 CarbonylContact O-C 3.53Å; Y277-P285 VanDerWaalsContact O-CA 3.29Å; Y277-P285 WeakPolarHBondContact O-CA 3.32Å; T278-P285 HydrophobicContact CG2-CB 3.91Å; T278-P285 HydrophobicContact CG2-CG 3.56Å; P285-L301 HydrophobicContact CB-CD1 3.61Å; P285-Y303 VanDerWaalsContact CD-OH 3.27Å; P285-Y303 WeakPolarHBondContact CD-OH 3.26Å; P285-Y303 WeakPolarHBondContact O-CE2 3.34Å; P285-Y303 PolarHBondContact O-OH 2.82Å
286	K	81.9	Confident	78	Confident	133 Å²	133	42.5 Å²	42.5	58%	0.578	20%	0.202	S	C	*	.			trans	-94.8	-26.5	179.9	-67.6	-171.5	173.7	-170.3	0	113.4	Y277 F284 Q300 L301	Y277-K286 HydrophobicContact CD1-CB 4.42Å; Y277-K286 PolarHBondContact O-N 2.81Å; F284-K286 PolarHBondContact O-N 3.3Å; K286-Q300 WeakPolarHBondContact O-CA 3.5Å; K286-L301 PolarHBondContact O-N 3.43Å
287	A	86.6	Confident	78.1	Confident	19 Å²	19	41.2 Å²	41.2	16%	0.157	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	156.6	-175.9	0	0	0	0	0	110.6	F276 Y277 G299 L334	F276-A287 WeakPolarHBondContact CA-O 3.28Å; Y277-A287 PolarHBondContact N-O 3.44Å; A287-G299 CarbonylContact C-O 3.01Å; A287-G299 WeakPolarHBondContact CA-O 3.49Å; A287-G299 WeakPolarHBondContact CB-O 3.46Å; A287-L334 HydrophobicContact CB-CD2 3.9Å; A287-L334 WeakPolarHBondContact O-CD2 3.35Å
288	F	89.6	Confident	78.4	Confident	1 Å²	1	40.3 Å²	40.3	0%	0.004	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	153.4	176.4	74.4	-81.4	0	0	0	110.1	I274 T275 F276 L297 Y298 G299 L301 L310 V313	I274-F288 HydrophobicContact CD1-CD2 4.2Å; T275-F288 CarbonylContact O-C 3.56Å; T275-F288 WeakPolarHBondContact O-CA 3.31Å; F276-F288 HydrophobicContact CD1-CB 3.6Å; F276-F288 HydrophobicContact CE1-CB 3.58Å; F288-L297 HydrophobicContact CE2-CD2 4.02Å; F288-L297 HydrophobicContact CE2-CG 4.18Å; F288-L297 HydrophobicContact CZ-CD2 4.46Å; F288-Y298 WeakPolarHBondContact O-CA 3.13Å; F288-Y298 WeakPolarHBondContact O-CB 3.48Å; F288-G299 WeakPolarHBondContact CD1-O 3.5Å; F288-G299 PolarHBondContact N-O 2.87Å; F288-G299 PolarHBondContact O-N 3.24Å; F288-G299 VanDerWaalsContact O-N 3.07Å; F288-L301 HydrophobicContact CB-CD1 4.41Å; F288-L301 HydrophobicContact CB-CD2 4.45Å; F288-L301 HydrophobicContact CD1-CD2 3.71Å; F288-L301 HydrophobicContact CD1-CG 4.03Å; F288-L301 HydrophobicContact CE1-CD2 4.4Å; F288-L301 HydrophobicContact CG-CD2 4.34Å; F288-L310 HydrophobicContact CD1-CD2 3.81Å; F288-L310 HydrophobicContact CD2-CD2 4.5Å; F288-L310 HydrophobicContact CE1-CB 4.06Å; F288-L310 HydrophobicContact CE1-CD2 3.44Å; F288-L310 VanDerWaalsContact CE1-CD2 3.44Å; F288-L310 HydrophobicContact CE1-CG 4.22Å; F288-L310 HydrophobicContact CE2-CD2 4.19Å; F288-L310 HydrophobicContact CG-CD2 4.33Å; F288-L310 HydrophobicContact CZ-CB 4.19Å; F288-L310 HydrophobicContact CZ-CD1 4.15Å; F288-L310 HydrophobicContact CZ-CD2 3.66Å; F288-L310 HydrophobicContact CZ-CG 4.2Å; F288-V313 HydrophobicContact CE1-CG2 4.43Å; F288-V313 HydrophobicContact CZ-CG1 4.3Å; F288-V313 HydrophobicContact CZ-CG2 4.08Å
289	A	89.9	Confident	78.8	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	121	169.6	0	0	0	0	0	109.2	I274 T275 V296 L297 I332 L334 F339	I274-A289 CarbonylContact C-O 3.58Å; I274-A289 WeakPolarHBondContact CA-O 3.42Å; T275-A289 PolarHBondContact N-O 2.99Å; T275-A289 PolarHBondContact O-N 3.49Å; T275-A289 PolarHBondContact OG1-O 2.92Å; A289-V296 HydrophobicContact CB-CG1 4.19Å; A289-L297 CarbonylContact C-O 3.58Å; A289-L297 VanDerWaalsContact CA-O 3.32Å; A289-L297 WeakPolarHBondContact CA-O 3.38Å; A289-I332 HydrophobicContact CB-CD1 3.83Å; A289-L334 HydrophobicContact CB-CB 4.36Å; A289-L334 HydrophobicContact CB-CD1 3.92Å; A289-L334 HydrophobicContact CB-CD2 4.17Å; A289-L334 HydrophobicContact CB-CG 4.39Å; A289-F339 HydrophobicContact CB-CB 4.39Å
290	W	89.3	Confident	79.8	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.008	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	117.6	-177.6	-177.3	33.2	0	0	0	109.8	K230 L232 F265 S272 I274 M292 V296 L297	K230-W290 WeakPolarHBondContact O-CH2 3.16Å; L232-W290 HydrophobicContact CB-CE3 4.08Å; L232-W290 HydrophobicContact CB-CH2 3.84Å; L232-W290 HydrophobicContact CB-CZ2 4.38Å; L232-W290 HydrophobicContact CB-CZ3 3.64Å; L232-W290 HydrophobicContact CD1-CD2 4.33Å; L232-W290 HydrophobicContact CD1-CE3 4Å; L232-W290 HydrophobicContact CD1-CZ3 4.4Å; F265-W290 HydrophobicContact CD2-CE3 4.33Å; F265-W290 AromaticContact CD2-CH2 3.88Å; F265-W290 HydrophobicContact CD2-CH2 3.88Å; F265-W290 AromaticContact CD2-CZ3 3.45Å; F265-W290 HydrophobicContact CD2-CZ3 3.45Å; F265-W290 VanDerWaalsContact CD2-CZ3 3.45Å; F265-W290 HydrophobicContact CE2-CE3 4.14Å; F265-W290 HydrophobicContact CE2-CH2 4.37Å; F265-W290 AromaticContact CE2-CZ3 3.51Å; F265-W290 HydrophobicContact CE2-CZ3 3.51Å; S272-W290 PolarHBondContact OG-NE1 3.09Å; I274-W290 HydrophobicContact CB-CB 4.22Å; I274-W290 HydrophobicContact CB-CG 4.24Å; I274-W290 HydrophobicContact CD1-CB 4.04Å; I274-W290 HydrophobicContact CD1-CG 4.38Å; I274-W290 HydrophobicContact CG1-CB 3.96Å; I274-W290 HydrophobicContact CG1-CG 4.43Å; W290-M292 HydrophobicContact CD2-CG 3.83Å; W290-M292 HydrophobicContact CD2-SD 4.26Å; W290-M292 HydrophobicContact CE3-CG 3.92Å; W290-M292 HydrophobicContact CE3-SD 3.73Å; W290-M292 HydrophobicContact CG-CG 4.23Å; W290-M292 HydrophobicContact CZ3-CG 4.35Å; W290-M292 HydrophobicContact CZ3-SD 3.94Å; W290-V296 CarbonylContact O-C 3.47Å; W290-V296 WeakPolarHBondContact O-CA 3.23Å; W290-L297 HydrophobicContact CB-CB 4.33Å; W290-L297 HydrophobicContact CE3-CB 4.45Å; W290-L297 HydrophobicContact CE3-CD2 3.93Å; W290-L297 PolarHBondContact N-O 3.46Å; W290-L297 PolarHBondContact O-N 3.36Å
291	M	86.9	Confident	80.7	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	120.2	176.7	-175.2	179.9	71.9	0	0	109.8	Y271 E273 Y318 P329 I332 L341	Y271-M291 HydrophobicContact CD2-CE 4.14Å; Y271-M291 HydrophobicContact CE2-CE 3.58Å; E273-M291 HydrophobicContact CB-CE 4.02Å; E273-M291 WeakPolarHBondContact O-CB 3.39Å; E273-M291 PolarHBondContact O-N 2.9Å; M291-Y318 VanDerWaalsContact CG-OH 3.31Å; M291-Y318 WeakPolarHBondContact CG-OH 3.47Å; M291-P329 HydrophobicContact CG-CG 4.14Å; M291-P329 HydrophobicContact SD-CB 3.61Å; M291-P329 HydrophobicContact SD-CG 3.72Å; M291-I332 HydrophobicContact CB-CB 4.24Å; M291-I332 HydrophobicContact CB-CD1 4.39Å; M291-I332 HydrophobicContact CB-CG2 3.89Å; M291-I332 HydrophobicContact SD-CB 4.44Å; M291-L341 HydrophobicContact CG-CD1 4.45Å; M291-L341 HydrophobicContact SD-CD1 4.04Å
292	M	79.5	Confident	81.7	Confident	7 Å²	7	36.6 Å²	36.6	3%	0.034	17%	0.171	C	C	.	.			trans	-120.3	179.4	-175.4	-50.2	178.2	-61.2	0	0	110.8	F265 W290 G295 L297 V315 Y318	F265-M292 HydrophobicContact CB-SD 4.31Å; F265-M292 HydrophobicContact CD1-CE 3.99Å; F265-M292 HydrophobicContact CD1-SD 3.7Å; F265-M292 HydrophobicContact CD2-SD 3.31Å; F265-M292 WeakPolarHBondContact CD2-SD 3.34Å; F265-M292 HydrophobicContact CE1-CE 3.83Å; F265-M292 HydrophobicContact CE1-SD 3.75Å; F265-M292 HydrophobicContact CE2-CE 4.45Å; F265-M292 HydrophobicContact CE2-SD 3.38Å; F265-M292 WeakPolarHBondContact CE2-SD 3.32Å; F265-M292 HydrophobicContact CG-CE 4.37Å; F265-M292 HydrophobicContact CG-SD 3.47Å; F265-M292 WeakPolarHBondContact CG-SD 3.48Å; F265-M292 HydrophobicContact CZ-CE 4.07Å; F265-M292 HydrophobicContact CZ-SD 3.6Å; F265-M292 VanDerWaalsContact CZ-SD 3.6Å; W290-M292 HydrophobicContact CD2-CG 3.83Å; W290-M292 HydrophobicContact CD2-SD 4.26Å; W290-M292 HydrophobicContact CE3-CG 3.92Å; W290-M292 HydrophobicContact CE3-SD 3.73Å; W290-M292 HydrophobicContact CG-CG 4.23Å; W290-M292 HydrophobicContact CZ3-CG 4.35Å; W290-M292 HydrophobicContact CZ3-SD 3.94Å; M292-G295 CarbonylContact C-O 3.59Å; M292-G295 WeakPolarHBondContact CA-O 3.34Å; M292-G295 WeakPolarHBondContact CB-O 3.48Å; M292-G295 PolarHBondContact N-O 3Å; M292-L297 HydrophobicContact CE-CB 3.6Å; M292-L297 HydrophobicContact CE-CD1 4.48Å; M292-L297 HydrophobicContact SD-CB 3.71Å; M292-V315 HydrophobicContact CE-CG1 4.32Å; M292-Y318 VanDerWaalsContact O-CE2 3.22Å; M292-Y318 WeakPolarHBondContact O-CE2 3.36Å; M292-Y318 PolarHBondContact O-OH 3.29Å
293	G	73.5	Confident	82.4	Confident	3 Å²	3	28.9 Å²	28.9	3%	0.031	14%	0.142	C	C	.	.	S	Bend	trans	-72.6	-25.9	-176.6	0	0	0	0	0	116	M269 I324	M269-G293 VanDerWaalsContact CE-O 3.23Å; M269-G293 WeakPolarHBondContact CE-O 3.44Å; G293-I324 WeakPolarHBondContact O-CD1 3.2Å; G293-I324 WeakPolarHBondContact O-CG1 3.32Å
294	N	78.1	Confident	82.6	Confident	60 Å²	60	31 Å²	31	32%	0.321	16%	0.158	S	C	.	.	S	Bend	trans	-114.5	-6.1	-179.3	60.9	-22.9	0	0	0	113.6	A267 Y318	A267-N294 HydrophobicContact CB-CB 4.02Å; N294-Y318 WeakPolarHBondContact O-CD2 3.11Å; N294-Y318 PolarHBondContact O-N 2.98Å
295	G	84.9	Confident	82.5	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.3	-164.2	178.5	0	0	0	0	0	112.9	M292 W316 Y318	M292-G295 CarbonylContact C-O 3.59Å; M292-G295 WeakPolarHBondContact CA-O 3.34Å; M292-G295 WeakPolarHBondContact CB-O 3.48Å; M292-G295 PolarHBondContact N-O 3Å; G295-W316 CarbonylContact C-O 3.53Å; G295-W316 WeakPolarHBondContact CA-O 3.4Å; G295-Y318 VanDerWaalsContact CA-CE2 3.41Å; G295-Y318 PolarHBondContact O-OH 2.74Å
296	V	88.1	Confident	81.7	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	123.1	172.6	178.3	0	0	0	0	108.7	A289 W290 W316 Y318 I332 F339 L341	A289-V296 HydrophobicContact CB-CG1 4.19Å; W290-V296 CarbonylContact O-C 3.47Å; W290-V296 WeakPolarHBondContact O-CA 3.23Å; V296-W316 PolarHBondContact N-O 2.91Å; V296-W316 PolarHBondContact O-N 2.63Å; V296-Y318 HydrophobicContact CG2-CE1 4.26Å; V296-I332 HydrophobicContact CB-CD1 4.36Å; V296-I332 HydrophobicContact CG1-CD1 3.4Å; V296-I332 HydrophobicContact CG2-CD1 3.98Å; V296-F339 HydrophobicContact CB-CE2 4.03Å; V296-F339 HydrophobicContact CB-CZ 4.29Å; V296-F339 HydrophobicContact CG1-CD2 4.2Å; V296-F339 HydrophobicContact CG1-CE2 4.05Å; V296-F339 HydrophobicContact CG1-CZ 4.35Å; V296-F339 HydrophobicContact CG2-CD2 4.5Å; V296-F339 HydrophobicContact CG2-CE2 3.97Å; V296-L341 HydrophobicContact CG2-CD1 4.25Å
297	L	88.1	Confident	80.7	Confident	4 Å²	4	37.5 Å²	37.5	2%	0.021	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	123.1	170.5	-170.3	75.9	0	0	0	108.2	F265 F288 A289 W290 M292 V313 Q314 V315	F265-L297 HydrophobicContact CE2-CD2 3.98Å; F265-L297 HydrophobicContact CZ-CD1 3.82Å; F265-L297 HydrophobicContact CZ-CD2 3.98Å; F265-L297 HydrophobicContact CZ-CG 4.41Å; F288-L297 HydrophobicContact CE2-CD2 4.02Å; F288-L297 HydrophobicContact CE2-CG 4.18Å; F288-L297 HydrophobicContact CZ-CD2 4.46Å; A289-L297 CarbonylContact C-O 3.58Å; A289-L297 VanDerWaalsContact CA-O 3.32Å; A289-L297 WeakPolarHBondContact CA-O 3.38Å; W290-L297 HydrophobicContact CB-CB 4.33Å; W290-L297 HydrophobicContact CE3-CB 4.45Å; W290-L297 HydrophobicContact CE3-CD2 3.93Å; W290-L297 PolarHBondContact N-O 3.46Å; W290-L297 PolarHBondContact O-N 3.36Å; M292-L297 HydrophobicContact CE-CB 3.6Å; M292-L297 HydrophobicContact CE-CD1 4.48Å; M292-L297 HydrophobicContact SD-CB 3.71Å; L297-V313 HydrophobicContact CD1-CG1 3.26Å; L297-V313 HydrophobicContact CD2-CG1 3.97Å; L297-V313 HydrophobicContact CG-CG1 3.58Å; L297-Q314 WeakPolarHBondContact CA-O 3.47Å; L297-V315 HydrophobicContact CD1-CG2 3.55Å
298	Y	89.8	Confident	79.9	Confident	13 Å²	13	38.4 Å²	38.4	5%	0.051	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	155.3	176	63.3	-82.3	0	0	0	110.5	F288 Q314 W316 F339 T352	F288-Y298 WeakPolarHBondContact O-CA 3.13Å; F288-Y298 WeakPolarHBondContact O-CB 3.48Å; Y298-Q314 HydrophobicContact CE1-CB 4.05Å; Y298-Q314 HydrophobicContact CE2-CB 3.91Å; Y298-Q314 PolarHBondContact N-O 3.32Å; Y298-Q314 PolarHBondContact O-N 3.34Å; Y298-Q314 PolarHBondContact OH-OE1 2.91Å; Y298-W316 HydrophobicContact CD1-CB 4.41Å; Y298-W316 HydrophobicContact CE1-CB 3.8Å; Y298-F339 AromaticContact CD1-CE1 3.96Å; Y298-F339 HydrophobicContact CD1-CE1 3.96Å; Y298-F339 HydrophobicContact CE1-CE1 4.1Å; Y298-F339 HydrophobicContact CG-CE1 4.39Å; Y298-T352 HydrophobicContact CD2-CG2 4.08Å; Y298-T352 WeakPolarHBondContact CE2-O 3.26Å
299	G	87.1	Confident	79.2	Confident	7 Å²	7	38.4 Å²	38.4	7%	0.072	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.5	-173.1	-176.8	0	0	0	0	0	112	A287 F288	A287-G299 CarbonylContact C-O 3.01Å; A287-G299 WeakPolarHBondContact CA-O 3.49Å; A287-G299 WeakPolarHBondContact CB-O 3.46Å; F288-G299 WeakPolarHBondContact CD1-O 3.5Å; F288-G299 PolarHBondContact N-O 2.87Å; F288-G299 PolarHBondContact O-N 3.24Å; F288-G299 VanDerWaalsContact O-N 3.07Å
300	Q	86	Confident	78.8	Confident	107 Å²	107	39 Å²	39	50%	0.5	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	159.2	176.5	-65.2	-170.5	4.4	0	0	111.2	K286 S311	K286-Q300 WeakPolarHBondContact O-CA 3.5Å; Q300-S311 WeakPolarHBondContact CB-OG 3.32Å; Q300-S311 PolarHBondContact N-O 2.97Å; Q300-S311 PolarHBondContact O-N 3.36Å; Q300-S311 PolarHBondContact O-OG 3.33Å
301	L	82.8	Confident	78.2	Confident	15 Å²	15	39.5 Å²	39.5	8%	0.079	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	114.7	176.1	-63.5	168.1	0	0	0	109.2	F276 P285 K286 F288 Y303 L309 L310	F276-L301 HydrophobicContact CD1-CD1 3.82Å; F276-L301 HydrophobicContact CE1-CD1 4.13Å; P285-L301 HydrophobicContact CB-CD1 3.61Å; K286-L301 PolarHBondContact O-N 3.43Å; F288-L301 HydrophobicContact CB-CD1 4.41Å; F288-L301 HydrophobicContact CB-CD2 4.45Å; F288-L301 HydrophobicContact CD1-CD2 3.71Å; F288-L301 HydrophobicContact CD1-CG 4.03Å; F288-L301 HydrophobicContact CE1-CD2 4.4Å; F288-L301 HydrophobicContact CG-CD2 4.34Å; L301-Y303 HydrophobicContact CB-CE2 3.96Å; L301-L309 CarbonylContact C-O 3.59Å; L301-L309 VanDerWaalsContact CA-O 3.29Å; L301-L309 WeakPolarHBondContact CA-O 3.44Å; L301-L309 HydrophobicContact CB-CG 4.34Å; L301-L309 HydrophobicContact CD2-CD2 3.66Å; L301-L309 HydrophobicContact CD2-CG 3.69Å; L301-L310 HydrophobicContact CD2-CD2 3.65Å
302	D	78.4	Confident	77.8	Confident	42 Å²	42	44.8 Å²	44.8	23%	0.225	24%	0.237	C	C	.	.			trans	-106.5	104.6	178.3	-175	0.8	0	0	0	110.2	V304 R305 L309	D302-V304 VanDerWaalsContact C-N 3.27Å; D302-V304 PolarHBondContact O-N 2.92Å; D302-V304 VanDerWaalsContact OD1-CB 3.31Å; D302-V304 WeakPolarHBondContact OD1-CB 3.41Å; D302-V304 WeakPolarHBondContact OD1-CG2 3.41Å; D302-V304 PolarHBondContact OD1-N 2.95Å; D302-R305 WeakPolarHBondContact OD2-CG 3.06Å; D302-R305 IonicContact OD2-CZ 3.68Å; D302-R305 IonicContact OD2-NE 2.76Å; D302-R305 PolarHBondContact OD2-NE 3.31Å; D302-L309 PolarHBondContact N-O 3.45Å
303	Y	74.6	Confident	78.1	Confident	35 Å²	35	47 Å²	47	14%	0.137	25%	0.252	C	S	.	.	S	Bend	trans	-80.4	-4.9	-179.1	-61.3	-87.8	0	0	0	113.7	E215 F223 F284 P285 L301 L309	E215-Y303 HydrophobicContact CB-CE1 4.41Å; F223-Y303 AromaticContact CD2-CD1 3.76Å; F223-Y303 HydrophobicContact CD2-CD1 3.76Å; F223-Y303 HydrophobicContact CD2-CE1 4.15Å; F223-Y303 AromaticContact CE2-CD1 3.75Å; F223-Y303 HydrophobicContact CE2-CD1 3.75Å; F223-Y303 HydrophobicContact CG-CD1 4.5Å; F284-Y303 HydrophobicContact CB-CD2 4.25Å; F284-Y303 HydrophobicContact CB-CE1 4.38Å; F284-Y303 HydrophobicContact CB-CE2 3.63Å; P285-Y303 VanDerWaalsContact CD-OH 3.27Å; P285-Y303 WeakPolarHBondContact CD-OH 3.26Å; P285-Y303 WeakPolarHBondContact O-CE2 3.34Å; P285-Y303 PolarHBondContact O-OH 2.82Å; L301-Y303 HydrophobicContact CB-CE2 3.96Å; Y303-L309 HydrophobicContact CD1-CD1 3.49Å; Y303-L309 VanDerWaalsContact CD1-CD1 3.49Å; Y303-L309 HydrophobicContact CE1-CD1 3.58Å; Y303-L309 HydrophobicContact CG-CD1 4.04Å
304	V	71.9	Confident	78.6	Confident	122 Å²	122	51.3 Å²	51.3	74%	0.739	27%	0.271	S	S	*	.	S	Bend	trans	-78.8	-33.5	178.5	-176.8	0	0	0	0	110.7	D302	D302-V304 VanDerWaalsContact C-N 3.27Å; D302-V304 PolarHBondContact O-N 2.92Å; D302-V304 VanDerWaalsContact OD1-CB 3.31Å; D302-V304 WeakPolarHBondContact OD1-CB 3.41Å; D302-V304 WeakPolarHBondContact OD1-CG2 3.41Å; D302-V304 PolarHBondContact OD1-N 2.95Å
305	R	67.4	Low	79	Confident	132 Å²	132	51.8 Å²	51.8	50%	0.498	28%	0.275	S	S	.	.			trans	-74.5	131.3	-177.2	-67.8	178.9	-169.4	-159.2	-5.3	111.2	D302 S308	D302-R305 WeakPolarHBondContact OD2-CG 3.06Å; D302-R305 IonicContact OD2-CZ 3.68Å; D302-R305 IonicContact OD2-NE 2.76Å; D302-R305 PolarHBondContact OD2-NE 3.31Å; R305-S308 VanDerWaalsContact CB-O 3.29Å; R305-S308 WeakPolarHBondContact CB-O 2.83Å
306	P	60.5	Low	79.1	Confident	83 Å²	83	52.9 Å²	52.9	54%	0.539	28%	0.28	S	S	.	.	S	Bend	trans	-75.3	-33	-179.3	27.2	-31.8	0	0	0	113.5
307	D	62.2	Low	78.9	Confident	135 Å²	135	59.9 Å²	59.9	72%	0.722	31%	0.312	S	S	*	.	S	Bend	trans	-100.4	-22.1	-166.5	-57.1	-25.5	0	0	0	114.2
308	S	68.6	Low	78.7	Confident	37 Å²	37	61 Å²	61	26%	0.259	32%	0.317	S	S	.	.			trans	-149.9	127.5	179.9	-171.1	0	0	0	0	110.9	R305	R305-S308 VanDerWaalsContact CB-O 3.29Å; R305-S308 WeakPolarHBondContact CB-O 2.83Å
309	L	75.4	Confident	78.2	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.005	33%	0.325	C	S	.	.			trans	-80.9	-22.9	179.3	-175.3	73.9	0	0	0	111.7	F223 I225 Q234 L301 D302 Y303	F223-L309 HydrophobicContact CB-CD2 4.4Å; F223-L309 HydrophobicContact CD1-CB 4.48Å; F223-L309 HydrophobicContact CD1-CD1 3.88Å; F223-L309 HydrophobicContact CD1-CD2 4.39Å; F223-L309 HydrophobicContact CD1-CG 4.49Å; F223-L309 HydrophobicContact CD2-CD1 4.43Å; F223-L309 HydrophobicContact CE1-CD1 3.99Å; F223-L309 HydrophobicContact CG-CD1 4.11Å; F223-L309 HydrophobicContact CZ-CD1 4.3Å; I225-L309 HydrophobicContact CD1-CD2 3.66Å; I225-L309 HydrophobicContact CG1-CD2 4.15Å; Q234-L309 VanDerWaalsContact NE2-N 3.19Å; Q234-L309 VanDerWaalsContact OE1-N 3.09Å; L301-L309 CarbonylContact C-O 3.59Å; L301-L309 VanDerWaalsContact CA-O 3.29Å; L301-L309 WeakPolarHBondContact CA-O 3.44Å; L301-L309 HydrophobicContact CB-CG 4.34Å; L301-L309 HydrophobicContact CD2-CD2 3.66Å; L301-L309 HydrophobicContact CD2-CG 3.69Å; D302-L309 PolarHBondContact N-O 3.45Å; Y303-L309 HydrophobicContact CD1-CD1 3.49Å; Y303-L309 VanDerWaalsContact CD1-CD1 3.49Å; Y303-L309 HydrophobicContact CE1-CD1 3.58Å; Y303-L309 HydrophobicContact CG-CD1 4.04Å
310	L	81	Confident	77.2	Confident	13 Å²	13	67.8 Å²	67.8	7%	0.068	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	124	-172.3	-47.6	176.8	0	0	0	110	L232 F288 L301 V313	L232-L310 HydrophobicContact CD2-CD1 4.21Å; F288-L310 HydrophobicContact CD1-CD2 3.81Å; F288-L310 HydrophobicContact CD2-CD2 4.5Å; F288-L310 HydrophobicContact CE1-CB 4.06Å; F288-L310 HydrophobicContact CE1-CD2 3.44Å; F288-L310 VanDerWaalsContact CE1-CD2 3.44Å; F288-L310 HydrophobicContact CE1-CG 4.22Å; F288-L310 HydrophobicContact CE2-CD2 4.19Å; F288-L310 HydrophobicContact CG-CD2 4.33Å; F288-L310 HydrophobicContact CZ-CB 4.19Å; F288-L310 HydrophobicContact CZ-CD1 4.15Å; F288-L310 HydrophobicContact CZ-CD2 3.66Å; F288-L310 HydrophobicContact CZ-CG 4.2Å; L301-L310 HydrophobicContact CD2-CD2 3.65Å; L310-V313 HydrophobicContact CB-CG2 3.7Å
311	S	77.9	Confident	76.3	Confident	12 Å²	12	67.7 Å²	67.7	8%	0.084	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	155.4	175.2	60.6	0	0	0	0	110.8	Q300 V313	Q300-S311 WeakPolarHBondContact CB-OG 3.32Å; Q300-S311 PolarHBondContact N-O 2.97Å; Q300-S311 PolarHBondContact O-N 3.36Å; Q300-S311 PolarHBondContact O-OG 3.33Å; S311-V313 PolarHBondContact O-N 2.96Å; S311-V313 VanDerWaalsContact O-N 3.14Å
312	D	78.5	Confident	75.7	Confident	112 Å²	112	67.3 Å²	67.3	60%	0.599	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	47.9	43.5	179.2	-65.1	-15.5	0	0	0	114.1	Q314	D312-Q314 PolarHBondContact O-N 2.84Å
313	V	84.4	Confident	75.1	Confident	55 Å²	55	68.8 Å²	68.8	33%	0.333	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	127.7	-175.4	-174.4	0	0	0	0	110.7	F288 L297 L310 S311	F288-V313 HydrophobicContact CE1-CG2 4.43Å; F288-V313 HydrophobicContact CZ-CG1 4.3Å; F288-V313 HydrophobicContact CZ-CG2 4.08Å; L297-V313 HydrophobicContact CD1-CG1 3.26Å; L297-V313 HydrophobicContact CD2-CG1 3.97Å; L297-V313 HydrophobicContact CG-CG1 3.58Å; L310-V313 HydrophobicContact CB-CG2 3.7Å; S311-V313 PolarHBondContact O-N 2.96Å; S311-V313 VanDerWaalsContact O-N 3.14Å
314	Q	84.6	Confident	74.7	Confident	93 Å²	93	70.5 Å²	70.5	44%	0.435	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	151.9	178	-63.5	-173.9	3.3	0	0	110.8	L297 Y298 D312	L297-Q314 WeakPolarHBondContact CA-O 3.47Å; Y298-Q314 HydrophobicContact CE1-CB 4.05Å; Y298-Q314 HydrophobicContact CE2-CB 3.91Å; Y298-Q314 PolarHBondContact N-O 3.32Å; Y298-Q314 PolarHBondContact O-N 3.34Å; Y298-Q314 PolarHBondContact OH-OE1 2.91Å; D312-Q314 PolarHBondContact O-N 2.84Å
315	V	86.9	Confident	74.3	Confident	69 Å²	69	68.8 Å²	68.8	42%	0.418	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	122.6	176.3	-178.2	0	0	0	0	108.5	M292 L297 E317	M292-V315 HydrophobicContact CE-CG1 4.32Å; L297-V315 HydrophobicContact CD1-CG2 3.55Å; V315-E317 HydrophobicContact CG1-CG 4.43Å
316	W	86.2	Confident	74.2	Confident	23 Å²	23	69.7 Å²	69.7	9%	0.087	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	111.8	165.5	-173.5	84.3	0	0	0	109	G295 V296 Y298 Y318 T319 I322 F339 L341 I350 G355	G295-W316 CarbonylContact C-O 3.53Å; G295-W316 WeakPolarHBondContact CA-O 3.4Å; V296-W316 PolarHBondContact N-O 2.91Å; V296-W316 PolarHBondContact O-N 2.63Å; Y298-W316 HydrophobicContact CD1-CB 4.41Å; Y298-W316 HydrophobicContact CE1-CB 3.8Å; W316-Y318 HydrophobicContact CE3-CD1 4.36Å; W316-Y318 AromaticContact CZ3-CD1 3.72Å; W316-Y318 HydrophobicContact CZ3-CD1 3.72Å; W316-Y318 HydrophobicContact CZ3-CE1 4.26Å; W316-T319 HydrophobicContact CH2-CG2 4.18Å; W316-T319 HydrophobicContact CZ2-CG2 3.87Å; W316-I322 HydrophobicContact CH2-CD1 4.02Å; W316-I322 HydrophobicContact CZ3-CD1 4.3Å; W316-F339 HydrophobicContact CB-CZ 3.93Å; W316-F339 HydrophobicContact CD2-CZ 4.09Å; W316-F339 HydrophobicContact CE3-CE2 4.37Å; W316-F339 HydrophobicContact CE3-CZ 4.32Å; W316-F339 AromaticContact CG-CZ 3.93Å; W316-F339 HydrophobicContact CG-CZ 3.93Å; W316-L341 HydrophobicContact CZ3-CD2 4.31Å; W316-I350 HydrophobicContact CG-CG2 4.48Å; W316-I350 HydrophobicContact CH2-CD1 4.45Å; W316-I350 HydrophobicContact CH2-CG1 4.44Å; W316-I350 HydrophobicContact CZ2-CG1 4.07Å; W316-G355 PolarHBondContact NE1-O 2.7Å
317	E	85.4	Confident	74.8	Confident	147 Å²	147	68.3 Å²	68.3	69%	0.687	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	142.9	176.8	-63.1	-177.3	173	0	0	110.6	V315 T319	V315-E317 HydrophobicContact CG1-CG 4.43Å; E317-T319 PolarHBondContact O-N 3.4Å
318	Y	82.9	Confident	75.6	Confident	29 Å²	29	65.6 Å²	65.6	11%	0.114	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-61.9	127.6	175.5	-68.8	-57.1	0	0	0	110.4	M269 M291 M292 N294 G295 V296 W316 I322 P329 L341	M269-Y318 HydrophobicContact CE-CD2 4.03Å; M269-Y318 HydrophobicContact CE-CE2 3.37Å; M291-Y318 VanDerWaalsContact CG-OH 3.31Å; M291-Y318 WeakPolarHBondContact CG-OH 3.47Å; M292-Y318 VanDerWaalsContact O-CE2 3.22Å; M292-Y318 WeakPolarHBondContact O-CE2 3.36Å; M292-Y318 PolarHBondContact O-OH 3.29Å; N294-Y318 WeakPolarHBondContact O-CD2 3.11Å; N294-Y318 PolarHBondContact O-N 2.98Å; G295-Y318 VanDerWaalsContact CA-CE2 3.41Å; G295-Y318 PolarHBondContact O-OH 2.74Å; V296-Y318 HydrophobicContact CG2-CE1 4.26Å; W316-Y318 HydrophobicContact CE3-CD1 4.36Å; W316-Y318 AromaticContact CZ3-CD1 3.72Å; W316-Y318 HydrophobicContact CZ3-CD1 3.72Å; W316-Y318 HydrophobicContact CZ3-CE1 4.26Å; Y318-I322 HydrophobicContact CD1-CB 4.37Å; Y318-I322 HydrophobicContact CD1-CD1 4.02Å; Y318-I322 HydrophobicContact CD1-CG2 3.83Å; Y318-I322 HydrophobicContact CG-CB 4.45Å; Y318-I322 HydrophobicContact CG-CG2 4.03Å; Y318-P329 HydrophobicContact CE1-CG 3.93Å; Y318-P329 WeakPolarHBondContact OH-CG 3.39Å; Y318-L341 HydrophobicContact CD1-CD2 4.31Å; Y318-L341 HydrophobicContact CE1-CD2 3.92Å
319	T	78.5	Confident	76.5	Confident	38 Å²	38	63.9 Å²	63.9	23%	0.233	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-56.5	149.6	169.4	52.9	0	0	0	0	110.2	W316 E317 D321 I322	W316-T319 HydrophobicContact CH2-CG2 4.18Å; W316-T319 HydrophobicContact CZ2-CG2 3.87Å; E317-T319 PolarHBondContact O-N 3.4Å; T319-D321 PolarHBondContact O-N 3.37Å; T319-I322 PolarHBondContact O-N 2.79Å
320	P	66.6	Low	77	Confident	123 Å²	123	65.3 Å²	65.3	80%	0.799	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-21	-178.2	20.8	-32.7	0	0	0	114.4	I322	P320-I322 PolarHBondContact O-N 3.33Å
321	D	66.8	Low	77.3	Confident	105 Å²	105	64.7 Å²	64.7	56%	0.561	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-18.3	174.1	-43.1	-31	0	0	0	113.8	T319 K348	T319-D321 PolarHBondContact O-N 3.37Å; D321-K348 IonicContact OD2-NZ 3.72Å
322	I	70.8	Confident	78	Confident	7 Å²	7	64.1 Å²	64.1	4%	0.036	34%	0.341	C	S	.	.	S	Bend	trans	-105.2	81.1	-178.6	-56.7	171.4	0	0	0	107.1	W316 Y318 T319 P320 N327 L341 L343	W316-I322 HydrophobicContact CH2-CD1 4.02Å; W316-I322 HydrophobicContact CZ3-CD1 4.3Å; Y318-I322 HydrophobicContact CD1-CB 4.37Å; Y318-I322 HydrophobicContact CD1-CD1 4.02Å; Y318-I322 HydrophobicContact CD1-CG2 3.83Å; Y318-I322 HydrophobicContact CG-CB 4.45Å; Y318-I322 HydrophobicContact CG-CG2 4.03Å; T319-I322 PolarHBondContact O-N 2.79Å; P320-I322 PolarHBondContact O-N 3.33Å; I322-N327 WeakPolarHBondContact CG2-O 3.43Å; I322-L341 HydrophobicContact CD1-CD2 3.95Å; I322-L343 HydrophobicContact CD1-CD1 4.17Å; I322-L343 HydrophobicContact CD1-CD2 4.33Å; I322-L343 HydrophobicContact CG1-CD1 4.03Å; I322-L343 HydrophobicContact CG1-CD2 4.21Å; I322-L343 HydrophobicContact CG2-CD2 3.99Å
323	D	66.5	Low	78.6	Confident	73 Å²	73	59 Å²	59	39%	0.39	31%	0.314	S	S	.	.			trans	-78	123.2	174.6	-168.8	-23	0	0	0	109.9	S325 Q326 N327	D323-S325 PolarHBondContact O-N 3.02Å; D323-S325 VanDerWaalsContact O-N 3.08Å; D323-S325 WeakPolarHBondContact OD1-CB 3.39Å; D323-S325 PolarHBondContact OD1-N 2.97Å; D323-S325 PolarHBondContact OD1-OG 3.36Å; D323-S325 PolarHBondContact OD2-OG 3.12Å; D323-S325 VanDerWaalsContact OD2-OG 3.07Å; D323-Q326 PolarHBondContact O-N 2.66Å; D323-N327 CarbonylContact O-C 3.54Å; D323-N327 WeakPolarHBondContact O-CA 3.42Å; D323-N327 PolarHBondContact O-N 2.8Å
324	I	66.1	Low	78.8	Confident	72 Å²	72	56.6 Å²	56.6	37%	0.369	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-24.1	177.1	-53.5	164.4	0	0	0	111.1	M269 G293 K328	M269-I324 HydrophobicContact CE-CB 4.39Å; M269-I324 HydrophobicContact CE-CG1 3.88Å; M269-I324 HydrophobicContact CE-CG2 4.05Å; M269-I324 HydrophobicContact CG-CG2 4Å; G293-I324 WeakPolarHBondContact O-CD1 3.2Å; G293-I324 WeakPolarHBondContact O-CG1 3.32Å; I324-K328 WeakPolarHBondContact O-CE 2.98Å; I324-K328 WeakPolarHBondContact O-CG 3.37Å
325	S	63.7	Low	79	Confident	85 Å²	85	52.3 Å²	52.3	59%	0.594	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-35.1	-179.9	70.4	0	0	0	0	113.7	D323	D323-S325 PolarHBondContact O-N 3.02Å; D323-S325 VanDerWaalsContact O-N 3.08Å; D323-S325 WeakPolarHBondContact OD1-CB 3.39Å; D323-S325 PolarHBondContact OD1-N 2.97Å; D323-S325 PolarHBondContact OD1-OG 3.36Å; D323-S325 PolarHBondContact OD2-OG 3.12Å; D323-S325 VanDerWaalsContact OD2-OG 3.07Å
326	Q	65.4	Low	78.9	Confident	151 Å²	151	53 Å²	53	71%	0.706	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	-40.1	-172.7	-64.8	-175.5	4.6	0	0	113.8	D323	D323-Q326 PolarHBondContact O-N 2.66Å
327	N	72.6	Confident	78.9	Confident	54 Å²	54	52.4 Å²	52.4	29%	0.289	28%	0.276	S	S	.	.	S	Bend	trans	-124.8	60.1	-170.9	-76.5	-19	0	0	0	111.8	I322 D323	I322-N327 WeakPolarHBondContact CG2-O 3.43Å; D323-N327 CarbonylContact O-C 3.54Å; D323-N327 WeakPolarHBondContact O-CA 3.42Å; D323-N327 PolarHBondContact O-N 2.8Å
328	K	79.8	Confident	79.1	Confident	79 Å²	79	45.7 Å²	45.7	34%	0.343	24%	0.244	S	C	.	.			trans	-62.8	139.7	177.6	-63.6	178.1	-178	-179.1	0	111.6	I324 I330 H344	I324-K328 WeakPolarHBondContact O-CE 2.98Å; I324-K328 WeakPolarHBondContact O-CG 3.37Å; K328-I330 PolarHBondContact O-N 2.82Å; K328-H344 PolarHBondContact O-CE1 2.78Å; K328-H344 PolarHBondContact O-ND1 2.83Å; K328-H344 VanDerWaalsContact O-ND1 3.07Å
329	P	85.6	Confident	79.4	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.239	C	C	.	.			trans	-70.7	128.1	171.6	29.9	-33.1	0	0	0	110.6	M269 Y271 M291 Y318 L341 L342 L343	M269-P329 HydrophobicContact CE-CG 3.96Å; M269-P329 HydrophobicContact SD-CG 3.9Å; Y271-P329 PolarHBondContact OH-O 2.72Å; M291-P329 HydrophobicContact CG-CG 4.14Å; M291-P329 HydrophobicContact SD-CB 3.61Å; M291-P329 HydrophobicContact SD-CG 3.72Å; Y318-P329 HydrophobicContact CE1-CG 3.93Å; Y318-P329 WeakPolarHBondContact OH-CG 3.39Å; P329-L341 HydrophobicContact CB-CD1 3.63Å; P329-L341 HydrophobicContact CB-CD2 4.07Å; P329-L341 HydrophobicContact CB-CG 3.87Å; P329-L341 HydrophobicContact CG-CD1 4.49Å; P329-L342 CarbonylContact C-O 3.5Å; P329-L342 WeakPolarHBondContact CA-O 3.39Å; P329-L343 HydrophobicContact CB-CD2 4.11Å
330	I	86.5	Confident	80	Confident	31 Å²	31	42.5 Å²	42.5	16%	0.159	23%	0.228	C	C	.	.			trans	-83.9	-42.8	-172.5	-60.3	173.7	0	0	0	110.3	K328 L342 K371	K328-I330 PolarHBondContact O-N 2.82Å; I330-L342 HydrophobicContact CB-CD2 4.2Å; I330-L342 HydrophobicContact CB-CG 4.37Å; I330-L342 HydrophobicContact CG2-CD2 4.22Å; I330-L342 PolarHBondContact N-O 2.92Å; I330-K371 WeakPolarHBondContact CG2-O 3.41Å
331	S	88.6	Confident	81.2	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	154.5	-174.9	-171.1	0	0	0	0	112.3	E273 L342 M373	E273-S331 WeakPolarHBondContact OE2-CA 3.3Å; E273-S331 WeakPolarHBondContact OE2-CB 3.44Å; E273-S331 PolarHBondContact OE2-OG 2.77Å; S331-L342 WeakPolarHBondContact O-CB 3.43Å; S331-L342 PolarHBondContact O-N 3.26Å; S331-M373 PolarHBondContact OG-O 3.2Å
332	I	91.6	Very high	82.3	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	146.6	177.7	-172.1	167.7	0	0	0	110.7	E273 T275 A289 M291 V296 F339 L340	E273-I332 HydrophobicContact CB-CG2 4.19Å; E273-I332 HydrophobicContact CG-CG2 4.11Å; E273-I332 PolarHBondContact OE2-N 3.26Å; T275-I332 HydrophobicContact CG2-CG2 4.08Å; T275-I332 WeakPolarHBondContact CG2-O 3.44Å; A289-I332 HydrophobicContact CB-CD1 3.83Å; M291-I332 HydrophobicContact CB-CB 4.24Å; M291-I332 HydrophobicContact CB-CD1 4.39Å; M291-I332 HydrophobicContact CB-CG2 3.89Å; M291-I332 HydrophobicContact SD-CB 4.44Å; V296-I332 HydrophobicContact CB-CD1 4.36Å; V296-I332 HydrophobicContact CG1-CD1 3.4Å; V296-I332 HydrophobicContact CG2-CD1 3.98Å; I332-F339 HydrophobicContact CD1-CB 4.37Å; I332-F339 HydrophobicContact CD1-CD2 4.04Å; I332-F339 HydrophobicContact CD1-CG 4.48Å; I332-F339 HydrophobicContact CG1-CB 4.45Å; I332-L340 CarbonylContact C-O 3.52Å; I332-L340 WeakPolarHBondContact CA-O 3.35Å
333	V	91.3	Very high	83.1	Confident	5 Å²	5	31.5 Å²	31.5	3%	0.03	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	135.8	170.5	160.7	0	0	0	0	110.1	F339 L340 M373 K375 V382	V333-F339 CarbonylContact O-C 3.59Å; V333-F339 VanDerWaalsContact O-CA 3.27Å; V333-F339 WeakPolarHBondContact O-CA 3.48Å; V333-L340 HydrophobicContact CG1-CD1 4.23Å; V333-L340 PolarHBondContact N-O 2.95Å; V333-L340 PolarHBondContact O-N 2.85Å; V333-M373 HydrophobicContact CB-CE 3.85Å; V333-M373 HydrophobicContact CB-CG 4.27Å; V333-M373 HydrophobicContact CB-SD 4.23Å; V333-M373 HydrophobicContact CG2-CB 4.43Å; V333-M373 HydrophobicContact CG2-CE 4.02Å; V333-M373 HydrophobicContact CG2-CG 3.67Å; V333-M373 HydrophobicContact CG2-SD 4.27Å; V333-K375 HydrophobicContact CG1-CB 3.66Å; V333-K375 HydrophobicContact CG1-CD 3.88Å; V333-K375 HydrophobicContact CG1-CG 4.14Å; V333-K375 HydrophobicContact CG2-CB 4.16Å; V333-V382 HydrophobicContact CG1-CG1 4.5Å; V333-V382 HydrophobicContact CG1-CG2 3.92Å
334	L	89.6	Confident	83.9	Confident	4 Å²	4	32.3 Å²	32.3	2%	0.021	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	128	176.6	-169.4	64	0	0	0	112.4	T275 A287 A289 H338 F339 T352 K375	T275-L334 PolarHBondContact OG1-N 3.16Å; A287-L334 HydrophobicContact CB-CD2 3.9Å; A287-L334 WeakPolarHBondContact O-CD2 3.35Å; A289-L334 HydrophobicContact CB-CB 4.36Å; A289-L334 HydrophobicContact CB-CD1 3.92Å; A289-L334 HydrophobicContact CB-CD2 4.17Å; A289-L334 HydrophobicContact CB-CG 4.39Å; L334-H338 WeakPolarHBondContact CD1-O 3.39Å; L334-F339 HydrophobicContact CD1-CB 3.85Å; L334-T352 HydrophobicContact CD1-CG2 3.99Å; L334-K375 WeakPolarHBondContact O-CD 3.15Å; L334-K375 PolarHBondContact O-NZ 3.39Å
335	T	88	Confident	84.8	Confident	2 Å²	2	31 Å²	31	1%	0.012	16%	0.157	C	C	.	.			trans	-103.6	-167.8	169.3	64.9	0	0	0	0	109.6	Y277 H338 L340 I395 E398	Y277-T335 VanDerWaalsContact CD2-O 3.26Å; Y277-T335 WeakPolarHBondContact CD2-O 3.37Å; T335-H338 WeakPolarHBondContact CA-O 2.89Å; T335-H338 PolarHBondContact N-O 3.26Å; T335-H338 WeakPolarHBondContact OG1-CA 3.44Å; T335-H338 WeakPolarHBondContact OG1-CB 3.2Å; T335-H338 PolarHBondContact OG1-N 3.06Å; T335-H338 PolarHBondContact OG1-O 2.99Å; T335-L340 HydrophobicContact CG2-CD1 3.48Å; T335-L340 VanDerWaalsContact CG2-CD1 3.48Å; T335-I395 HydrophobicContact CG2-CD1 3.39Å; T335-E398 WeakPolarHBondContact CB-OE1 3.15Å; T335-E398 WeakPolarHBondContact CB-OE2 3.44Å; T335-E398 PolarHBondContact OG1-OE1 3.5Å
336	Q	84.6	Confident	85.9	Confident	83 Å²	83	30 Å²	30	39%	0.388	14%	0.14	S	C	.	.	S	Bend	trans	-68.1	-38.9	-173.5	-172.4	173.9	-10.3	0	0	112.4	Y277 E398	Y277-Q336 HydrophobicContact CE1-CB 4.12Å; Y277-Q336 HydrophobicContact CE1-CG 3.91Å; Y277-Q336 HydrophobicContact CE2-CB 3.8Å; Y277-Q336 HydrophobicContact CE2-CG 4.47Å; Y277-Q336 WeakPolarHBondContact OH-CB 3.38Å; Y277-Q336 WeakPolarHBondContact OH-CG 3.24Å; Q336-E398 WeakPolarHBondContact CB-OE2 3.21Å; Q336-E398 PolarHBondContact N-OE1 2.85Å; Q336-E398 PolarHBondContact N-OE2 3.18Å
337	F	86.2	Confident	87.1	Confident	12 Å²	12	22.8 Å²	22.8	5%	0.053	11%	0.107	C	C	.	.	S	Bend	trans	-131.4	0.6	-174	-58.4	-70.8	0	0	0	113.1	C351 T352 L353 E398 V402 Y418	F337-C351 WeakPolarHBondContact O-CA 3.17Å; F337-C351 PolarHBondContact O-SG 3.42Å; F337-C351 VanDerWaalsContact O-SG 3.32Å; F337-T352 PolarHBondContact O-N 2.97Å; F337-T352 PolarHBondContact O-OG1 2.76Å; F337-L353 HydrophobicContact CD1-CD1 4.28Å; F337-E398 WeakPolarHBondContact CA-OE1 3.25Å; F337-E398 HydrophobicContact CB-CG 4.38Å; F337-E398 HydrophobicContact CD2-CB 4.45Å; F337-E398 HydrophobicContact CD2-CG 4.07Å; F337-E398 PolarHBondContact N-OE1 3.14Å; F337-V402 HydrophobicContact CB-CG2 4.24Å; F337-V402 HydrophobicContact CD1-CG1 4.36Å; F337-V402 HydrophobicContact CD1-CG2 4.12Å; F337-V402 HydrophobicContact CD2-CG2 3.71Å; F337-V402 HydrophobicContact CE1-CG1 4.06Å; F337-V402 HydrophobicContact CE1-CG2 4.38Å; F337-V402 HydrophobicContact CE2-CG2 3.99Å; F337-V402 HydrophobicContact CG-CG2 3.77Å; F337-V402 HydrophobicContact CZ-CG1 4.22Å; F337-V402 HydrophobicContact CZ-CG2 4.31Å; F337-Y418 AromaticContact CZ-CE1 3.93Å; F337-Y418 HydrophobicContact CZ-CE1 3.93Å; F337-Y418 AromaticContact CZ-CZ 3.94Å
338	H	88.8	Confident	87.9	Confident	5 Å²	5	20.5 Å²	20.5	2%	0.023	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	153.9	179.6	-52.4	80.2	0	0	0	111.1	F48 L334 T335 I350 E398	F48-H338 HydrophobicContact CZ-CB 4.26Å; L334-H338 WeakPolarHBondContact CD1-O 3.39Å; T335-H338 WeakPolarHBondContact CA-O 2.89Å; T335-H338 PolarHBondContact N-O 3.26Å; T335-H338 WeakPolarHBondContact OG1-CA 3.44Å; T335-H338 WeakPolarHBondContact OG1-CB 3.2Å; T335-H338 PolarHBondContact OG1-N 3.06Å; T335-H338 PolarHBondContact OG1-O 2.99Å; H338-I350 CarbonylContact C-O 3.52Å; H338-I350 WeakPolarHBondContact CA-O 3.28Å; H338-I350 WeakPolarHBondContact CB-O 3.33Å; H338-E398 IonicContact CE1-OE1 2.81Å; H338-E398 IonicContact CG-OE1 2.85Å; H338-E398 PolarHBondContact N-OE1 3.29Å; H338-E398 VanDerWaalsContact N-OE1 3.12Å; H338-E398 WeakPolarHBondContact ND1-CG 3.39Å; H338-E398 IonicContact ND1-OE1 3.51Å; H338-E398 PolarHBondContact ND1-OE1 3.13Å
339	F	90.5	Very high	88.4	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	136.3	159.3	62.3	-87.6	0	0	0	109.1	A289 V296 Y298 W316 I332 V333 L334 I350 T352	A289-F339 HydrophobicContact CB-CB 4.39Å; V296-F339 HydrophobicContact CB-CE2 4.03Å; V296-F339 HydrophobicContact CB-CZ 4.29Å; V296-F339 HydrophobicContact CG1-CD2 4.2Å; V296-F339 HydrophobicContact CG1-CE2 4.05Å; V296-F339 HydrophobicContact CG1-CZ 4.35Å; V296-F339 HydrophobicContact CG2-CD2 4.5Å; V296-F339 HydrophobicContact CG2-CE2 3.97Å; Y298-F339 AromaticContact CD1-CE1 3.96Å; Y298-F339 HydrophobicContact CD1-CE1 3.96Å; Y298-F339 HydrophobicContact CE1-CE1 4.1Å; Y298-F339 HydrophobicContact CG-CE1 4.39Å; W316-F339 HydrophobicContact CB-CZ 3.93Å; W316-F339 HydrophobicContact CD2-CZ 4.09Å; W316-F339 HydrophobicContact CE3-CE2 4.37Å; W316-F339 HydrophobicContact CE3-CZ 4.32Å; W316-F339 AromaticContact CG-CZ 3.93Å; W316-F339 HydrophobicContact CG-CZ 3.93Å; I332-F339 HydrophobicContact CD1-CB 4.37Å; I332-F339 HydrophobicContact CD1-CD2 4.04Å; I332-F339 HydrophobicContact CD1-CG 4.48Å; I332-F339 HydrophobicContact CG1-CB 4.45Å; V333-F339 CarbonylContact O-C 3.59Å; V333-F339 VanDerWaalsContact O-CA 3.27Å; V333-F339 WeakPolarHBondContact O-CA 3.48Å; L334-F339 HydrophobicContact CD1-CB 3.85Å; F339-I350 HydrophobicContact CD1-CB 4.28Å; F339-I350 HydrophobicContact CD2-CB 4.27Å; F339-I350 HydrophobicContact CD2-CD1 4.08Å; F339-I350 HydrophobicContact CE1-CB 3.79Å; F339-I350 HydrophobicContact CE1-CG2 3.67Å; F339-I350 HydrophobicContact CE2-CB 3.77Å; F339-I350 HydrophobicContact CE2-CD1 3.64Å; F339-I350 HydrophobicContact CE2-CG1 4.07Å; F339-I350 HydrophobicContact CE2-CG2 4.27Å; F339-I350 HydrophobicContact CZ-CB 3.51Å; F339-I350 HydrophobicContact CZ-CD1 4.23Å; F339-I350 HydrophobicContact CZ-CG1 4.14Å; F339-I350 HydrophobicContact CZ-CG2 3.51Å; F339-I350 PolarHBondContact N-O 2.83Å; F339-I350 PolarHBondContact O-N 3.3Å; F339-T352 HydrophobicContact CD1-CG2 3.86Å
340	L	91.3	Very high	88.6	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	131.1	174.3	-61.4	96.9	0	0	0	108.4	F48 I332 V333 T335 I347 K348 A349 M373	F48-L340 HydrophobicContact CD1-CD2 4.22Å; F48-L340 HydrophobicContact CE1-CD1 4.2Å; F48-L340 HydrophobicContact CE1-CD2 4.03Å; F48-L340 HydrophobicContact CE1-CG 4.41Å; I332-L340 CarbonylContact C-O 3.52Å; I332-L340 WeakPolarHBondContact CA-O 3.35Å; V333-L340 HydrophobicContact CG1-CD1 4.23Å; V333-L340 PolarHBondContact N-O 2.95Å; V333-L340 PolarHBondContact O-N 2.85Å; T335-L340 HydrophobicContact CG2-CD1 3.48Å; T335-L340 VanDerWaalsContact CG2-CD1 3.48Å; L340-I347 HydrophobicContact CB-CG2 4.24Å; L340-I347 HydrophobicContact CD2-CG2 4.08Å; L340-K348 CarbonylContact C-O 3.58Å; L340-K348 WeakPolarHBondContact CA-O 3.09Å; L340-A349 HydrophobicContact CD2-CB 4.38Å; L340-A349 HydrophobicContact CG-CB 4.13Å; L340-M373 HydrophobicContact CB-CE 3.56Å; L340-M373 HydrophobicContact CB-SD 3.76Å; L340-M373 HydrophobicContact CD2-SD 4.42Å; L340-M373 WeakPolarHBondContact O-CE 3.33Å
341	L	90.5	Very high	88.6	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	121.4	174.8	-166.5	73.2	0	0	0	108.8	M291 V296 W316 Y318 I322 P329 L343 I347 K348 I350	M291-L341 HydrophobicContact CG-CD1 4.45Å; M291-L341 HydrophobicContact SD-CD1 4.04Å; V296-L341 HydrophobicContact CG2-CD1 4.25Å; W316-L341 HydrophobicContact CZ3-CD2 4.31Å; Y318-L341 HydrophobicContact CD1-CD2 4.31Å; Y318-L341 HydrophobicContact CE1-CD2 3.92Å; I322-L341 HydrophobicContact CD1-CD2 3.95Å; P329-L341 HydrophobicContact CB-CD1 3.63Å; P329-L341 HydrophobicContact CB-CD2 4.07Å; P329-L341 HydrophobicContact CB-CG 3.87Å; P329-L341 HydrophobicContact CG-CD1 4.49Å; L341-L343 HydrophobicContact CD2-CD2 4.29Å; L341-I347 WeakPolarHBondContact O-CA 3.24Å; L341-K348 PolarHBondContact N-O 2.97Å; L341-K348 PolarHBondContact O-N 2.96Å; L341-I350 HydrophobicContact CB-CD1 4.16Å
342	L	90.1	Very high	88.5	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	118.9	175.1	-176.7	70.4	0	0	0	109.7	P329 I330 S331 I347 L370 R372 M373 I384	P329-L342 CarbonylContact C-O 3.5Å; P329-L342 WeakPolarHBondContact CA-O 3.39Å; I330-L342 HydrophobicContact CB-CD2 4.2Å; I330-L342 HydrophobicContact CB-CG 4.37Å; I330-L342 HydrophobicContact CG2-CD2 4.22Å; I330-L342 PolarHBondContact N-O 2.92Å; S331-L342 WeakPolarHBondContact O-CB 3.43Å; S331-L342 PolarHBondContact O-N 3.26Å; L342-I347 HydrophobicContact CD1-CD1 4.35Å; L342-I347 HydrophobicContact CD1-CG1 3.6Å; L342-L370 HydrophobicContact CD1-CB 4.3Å; L342-L370 HydrophobicContact CD1-CD1 3.89Å; L342-L370 HydrophobicContact CD1-CD2 4.32Å; L342-L370 HydrophobicContact CD1-CG 4.4Å; L342-L370 HydrophobicContact CD2-CB 4.47Å; L342-R372 VanDerWaalsContact CD2-C 3.49Å; L342-M373 HydrophobicContact CB-CB 4.24Å; L342-M373 HydrophobicContact CB-CE 4.06Å; L342-M373 HydrophobicContact CD2-CB 4.03Å; L342-I384 HydrophobicContact CD1-CG2 4.19Å
343	L	88.1	Confident	88	Confident	5 Å²	5	18.1 Å²	18.1	3%	0.026	9%	0.086	C	C	.	.			trans	-102.9	178.5	170.8	-60.6	168.8	0	0	0	109.5	I322 P329 L341 D345 R346 K348 L370	I322-L343 HydrophobicContact CD1-CD1 4.17Å; I322-L343 HydrophobicContact CD1-CD2 4.33Å; I322-L343 HydrophobicContact CG1-CD1 4.03Å; I322-L343 HydrophobicContact CG1-CD2 4.21Å; I322-L343 HydrophobicContact CG2-CD2 3.99Å; P329-L343 HydrophobicContact CB-CD2 4.11Å; L341-L343 HydrophobicContact CD2-CD2 4.29Å; L343-D345 VanDerWaalsContact C-N 3.3Å; L343-D345 PolarHBondContact O-N 3.5Å; L343-R346 WeakPolarHBondContact CA-O 3.49Å; L343-R346 HydrophobicContact CB-CG 4.05Å; L343-R346 WeakPolarHBondContact CB-O 3.48Å; L343-R346 HydrophobicContact CD1-CG 3.74Å; L343-R346 HydrophobicContact CG-CG 4.41Å; L343-R346 PolarHBondContact N-O 3.47Å; L343-K348 HydrophobicContact CD1-CD 4.34Å; L343-L370 WeakPolarHBondContact O-CD1 3.35Å
344	H	84	Confident	87.5	Confident	90 Å²	90	20.9 Å²	20.9	42%	0.417	10%	0.101	S	C	.	.	S	Bend	trans	-65.8	-31.8	-176.6	-70.1	77.7	0	0	0	113.5	K328	K328-H344 PolarHBondContact O-CE1 2.78Å; K328-H344 PolarHBondContact O-ND1 2.83Å; K328-H344 VanDerWaalsContact O-ND1 3.07Å
345	D	84.6	Confident	87.1	Confident	43 Å²	43	21.6 Å²	21.6	23%	0.23	11%	0.109	C	C	.	.	S	Bend	trans	-117.5	-15.6	-174.5	64.5	-19.3	0	0	0	113.6	L343 F363	L343-D345 VanDerWaalsContact C-N 3.3Å; L343-D345 PolarHBondContact O-N 3.5Å; D345-F363 PolarHBondContact O-N 2.85Å
346	R	87.1	Confident	86.9	Confident	65 Å²	65	27.5 Å²	27.5	25%	0.245	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	168.7	-170	75.6	-169.5	85.9	-163.3	1.1	113.7	L343 E360 D361 V362	L343-R346 WeakPolarHBondContact CA-O 3.49Å; L343-R346 HydrophobicContact CB-CG 4.05Å; L343-R346 WeakPolarHBondContact CB-O 3.48Å; L343-R346 HydrophobicContact CD1-CG 3.74Å; L343-R346 HydrophobicContact CG-CG 4.41Å; L343-R346 PolarHBondContact N-O 3.47Å; R346-E360 WeakPolarHBondContact CD-OE1 3.29Å; R346-E360 IonicContact CZ-OE1 2.66Å; R346-E360 IonicContact NE-OE1 2.63Å; R346-E360 IonicContact NH1-OE1 3.39Å; R346-E360 PolarHBondContact NH1-OE1 3.45Å; R346-D361 CarbonylContact C-O 3.36Å; R346-D361 WeakPolarHBondContact CA-O 3.41Å; R346-D361 WeakPolarHBondContact CB-O 3.29Å; R346-V362 HydrophobicContact CB-CG2 4.17Å
347	I	90.3	Very high	87	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	137.8	167.2	-60.4	157.2	0	0	0	108.5	L340 L341 L342 E360 D361 F363 I384 Y393	L340-I347 HydrophobicContact CB-CG2 4.24Å; L340-I347 HydrophobicContact CD2-CG2 4.08Å; L341-I347 WeakPolarHBondContact O-CA 3.24Å; L342-I347 HydrophobicContact CD1-CD1 4.35Å; L342-I347 HydrophobicContact CD1-CG1 3.6Å; I347-E360 VanDerWaalsContact O-CA 3.31Å; I347-E360 WeakPolarHBondContact O-CA 3.41Å; I347-D361 PolarHBondContact N-O 2.9Å; I347-D361 PolarHBondContact O-N 3.42Å; I347-F363 HydrophobicContact CB-CE2 4.49Å; I347-F363 HydrophobicContact CD1-CD2 4.48Å; I347-F363 HydrophobicContact CD1-CE2 3.23Å; I347-F363 HydrophobicContact CD1-CZ 3.38Å; I347-F363 HydrophobicContact CG1-CE2 3.64Å; I347-F363 HydrophobicContact CG1-CZ 4.25Å; I347-I384 HydrophobicContact CD1-CD1 3.02Å; I347-I384 HydrophobicContact CD1-CG1 4.45Å; I347-I384 HydrophobicContact CG1-CD1 3.95Å; I347-Y393 HydrophobicContact CD1-CE2 3.81Å
348	K	89.6	Confident	86.9	Confident	6 Å²	6	29 Å²	29	3%	0.026	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.6	167.7	-69.6	-174.5	173.1	-174.2	0	108.9	D321 L340 L341 L343 I350 V357 Y359 E360	D321-K348 IonicContact OD2-NZ 3.72Å; L340-K348 CarbonylContact C-O 3.58Å; L340-K348 WeakPolarHBondContact CA-O 3.09Å; L341-K348 PolarHBondContact N-O 2.97Å; L341-K348 PolarHBondContact O-N 2.96Å; L343-K348 HydrophobicContact CD1-CD 4.34Å; K348-I350 HydrophobicContact CB-CD1 3.93Å; K348-V357 HydrophobicContact CB-CG1 4.35Å; K348-V357 HydrophobicContact CG-CG1 4.45Å; K348-Y359 CarbonylContact C-O 3.52Å; K348-Y359 WeakPolarHBondContact CA-O 3.26Å; K348-E360 WeakPolarHBondContact CE-OE1 3.44Å; K348-E360 HydrophobicContact CG-CG 4.16Å
349	A	89.5	Confident	86.7	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	121.2	168.6	0	0	0	0	0	108.9	F48 L340 V358 Y359	F48-A349 HydrophobicContact CD2-CB 4.27Å; F48-A349 HydrophobicContact CE2-CB 3.67Å; F48-A349 HydrophobicContact CZ-CB 3.91Å; L340-A349 HydrophobicContact CD2-CB 4.38Å; L340-A349 HydrophobicContact CG-CB 4.13Å; A349-V358 PolarHBondContact O-N 3.27Å; A349-Y359 PolarHBondContact N-O 3.42Å; A349-Y359 PolarHBondContact O-N 3.34Å
350	I	89.1	Confident	86.5	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	134.5	-176.5	-58.7	95.7	0	0	0	108.4	W316 H338 F339 L341 K348 Q356 V357	W316-I350 HydrophobicContact CG-CG2 4.48Å; W316-I350 HydrophobicContact CH2-CD1 4.45Å; W316-I350 HydrophobicContact CH2-CG1 4.44Å; W316-I350 HydrophobicContact CZ2-CG1 4.07Å; H338-I350 CarbonylContact C-O 3.52Å; H338-I350 WeakPolarHBondContact CA-O 3.28Å; H338-I350 WeakPolarHBondContact CB-O 3.33Å; F339-I350 HydrophobicContact CD1-CB 4.28Å; F339-I350 HydrophobicContact CD2-CB 4.27Å; F339-I350 HydrophobicContact CD2-CD1 4.08Å; F339-I350 HydrophobicContact CE1-CB 3.79Å; F339-I350 HydrophobicContact CE1-CG2 3.67Å; F339-I350 HydrophobicContact CE2-CB 3.77Å; F339-I350 HydrophobicContact CE2-CD1 3.64Å; F339-I350 HydrophobicContact CE2-CG1 4.07Å; F339-I350 HydrophobicContact CE2-CG2 4.27Å; F339-I350 HydrophobicContact CZ-CB 3.51Å; F339-I350 HydrophobicContact CZ-CD1 4.23Å; F339-I350 HydrophobicContact CZ-CG1 4.14Å; F339-I350 HydrophobicContact CZ-CG2 3.51Å; F339-I350 PolarHBondContact N-O 2.83Å; F339-I350 PolarHBondContact O-N 3.3Å; L341-I350 HydrophobicContact CB-CD1 4.16Å; K348-I350 HydrophobicContact CB-CD1 3.93Å; I350-Q356 WeakPolarHBondContact CA-O 3.26Å; I350-V357 HydrophobicContact CG1-CG2 4.17Å
351	C	87.6	Confident	86.4	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	132.6	176.3	-176.3	0	0	0	0	111.2	F337 L353 N354 G355 Q356 V358 M405	F337-C351 WeakPolarHBondContact O-CA 3.17Å; F337-C351 PolarHBondContact O-SG 3.42Å; F337-C351 VanDerWaalsContact O-SG 3.32Å; C351-L353 PolarHBondContact O-N 3.11Å; C351-L353 PolarHBondContact SG-N 2.98Å; C351-N354 WeakPolarHBondContact CB-OD1 3.49Å; C351-G355 VanDerWaalsContact O-CA 3.28Å; C351-G355 WeakPolarHBondContact O-CA 3.44Å; C351-G355 PolarHBondContact O-N 3.33Å; C351-Q356 PolarHBondContact N-O 2.87Å; C351-V358 HydrophobicContact CB-CG2 3.87Å; C351-M405 HydrophobicContact CB-CE 3.87Å; C351-M405 HydrophobicContact CB-SD 4.44Å; C351-M405 WeakPolarHBondContact SG-CE 3.43Å; C351-M405 PolarHBondContact SG-SD 3.35Å
352	T	85.4	Confident	86.2	Confident	29 Å²	29	40.8 Å²	40.8	18%	0.178	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-13.1	176.6	56.9	0	0	0	0	113.1	Y298 L334 F337 F339	Y298-T352 HydrophobicContact CD2-CG2 4.08Å; Y298-T352 WeakPolarHBondContact CE2-O 3.26Å; L334-T352 HydrophobicContact CD1-CG2 3.99Å; F337-T352 PolarHBondContact O-N 2.97Å; F337-T352 PolarHBondContact O-OG1 2.76Å; F339-T352 HydrophobicContact CD1-CG2 3.86Å
353	L	82.3	Confident	85.9	Confident	31 Å²	31	41.4 Å²	41.4	16%	0.162	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-53.7	179.3	-63.9	176	0	0	0	110.7	F337 C351 V402 M405 Y406 M409	F337-L353 HydrophobicContact CD1-CD1 4.28Å; C351-L353 PolarHBondContact O-N 3.11Å; C351-L353 PolarHBondContact SG-N 2.98Å; L353-V402 HydrophobicContact CD1-CG1 3.97Å; L353-M405 HydrophobicContact CB-SD 4.4Å; L353-M405 HydrophobicContact CD1-CB 4.21Å; L353-M405 HydrophobicContact CD1-SD 4.25Å; L353-Y406 HydrophobicContact CD1-CE1 4.34Å; L353-Y406 HydrophobicContact CD1-CE2 4.31Å; L353-Y406 HydrophobicContact CD2-CE1 4.11Å; L353-M409 HydrophobicContact CB-CE 3.65Å; L353-M409 WeakPolarHBondContact O-CE 3.34Å
354	N	81	Confident	85.5	Confident	64 Å²	64	44.1 Å²	44.1	34%	0.342	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-2.7	-173.5	75.2	-10.5	0	0	0	115.1	C351 Q356 M405	C351-N354 WeakPolarHBondContact CB-OD1 3.49Å; N354-Q356 WeakPolarHBondContact ND2-CG 3.35Å; N354-Q356 PolarHBondContact ND2-OE1 3.3Å; N354-Q356 PolarHBondContact O-N 3.49Å; N354-Q356 WeakPolarHBondContact OD1-CB 3.32Å; N354-Q356 PolarHBondContact OD1-N 3.2Å; N354-M405 HydrophobicContact CB-CE 3.75Å; N354-M405 WeakPolarHBondContact ND2-CE 3.37Å; N354-M405 WeakPolarHBondContact OD1-CE 3.49Å
355	G	80.9	Confident	85.1	Confident	18 Å²	18	46.6 Å²	46.6	19%	0.186	25%	0.248	C	C	.	.			trans	69.6	10.4	-178.8	0	0	0	0	0	115.6	W316 C351	W316-G355 PolarHBondContact NE1-O 2.7Å; C351-G355 VanDerWaalsContact O-CA 3.28Å; C351-G355 WeakPolarHBondContact O-CA 3.44Å; C351-G355 PolarHBondContact O-N 3.33Å
356	Q	84.2	Confident	84.8	Confident	127 Å²	127	53 Å²	53	59%	0.593	27%	0.274	S	S	*	.			trans	-86.4	149.4	179.3	-66.1	-178.2	-12.1	0	0	112	I350 C351 N354 V358	I350-Q356 WeakPolarHBondContact CA-O 3.26Å; C351-Q356 PolarHBondContact N-O 2.87Å; N354-Q356 WeakPolarHBondContact ND2-CG 3.35Å; N354-Q356 PolarHBondContact ND2-OE1 3.3Å; N354-Q356 PolarHBondContact O-N 3.49Å; N354-Q356 WeakPolarHBondContact OD1-CB 3.32Å; N354-Q356 PolarHBondContact OD1-N 3.2Å; Q356-V358 PolarHBondContact O-N 2.9Å
357	V	85.2	Confident	84.3	Confident	61 Å²	61	52 Å²	52	37%	0.37	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	113.1	174	-175.6	0	0	0	0	108.6	K348 I350	K348-V357 HydrophobicContact CB-CG1 4.35Å; K348-V357 HydrophobicContact CG-CG1 4.45Å; I350-V357 HydrophobicContact CG1-CG2 4.17Å
358	V	84.1	Confident	83.8	Confident	65 Å²	65	53.1 Å²	53.1	39%	0.394	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-31.4	-177.6	177.8	0	0	0	0	111.5	I47 A349 C351 Q356	I47-V358 HydrophobicContact CD1-CG1 4.31Å; A349-V358 PolarHBondContact O-N 3.27Å; C351-V358 HydrophobicContact CB-CG2 3.87Å; Q356-V358 PolarHBondContact O-N 2.9Å
359	Y	85.1	Confident	83.5	Confident	58 Å²	58	56 Å²	56	23%	0.227	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	138.4	-176.8	-177.4	-102.9	0	0	0	110.9	F48 K348 A349 D361 Y393	F48-Y359 HydrophobicContact CB-CD1 3.9Å; F48-Y359 HydrophobicContact CB-CD2 4.47Å; F48-Y359 HydrophobicContact CB-CE1 3.91Å; F48-Y359 HydrophobicContact CB-CE2 4.49Å; F48-Y359 HydrophobicContact CB-CG 4.2Å; F48-Y359 HydrophobicContact CD2-CD1 4.03Å; F48-Y359 AromaticContact CD2-CG 3.87Å; F48-Y359 HydrophobicContact CD2-CG 3.87Å; F48-Y359 HydrophobicContact CG-CD1 4.16Å; F48-Y359 HydrophobicContact CG-CG 4.38Å; K348-Y359 CarbonylContact C-O 3.52Å; K348-Y359 WeakPolarHBondContact CA-O 3.26Å; A349-Y359 PolarHBondContact N-O 3.42Å; A349-Y359 PolarHBondContact O-N 3.34Å; Y359-D361 HydrophobicContact CD1-CB 4.41Å; Y359-D361 HydrophobicContact CE1-CB 3.53Å; Y359-D361 PolarHBondContact OH-OD2 3.19Å; Y359-Y393 HydrophobicContact CE1-CE1 4.09Å
360	E	87.3	Confident	83.4	Confident	89 Å²	89	56.5 Å²	56.5	42%	0.416	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	130.4	174.6	-174	171.6	-168.2	0	0	109.4	R346 I347 K348	R346-E360 WeakPolarHBondContact CD-OE1 3.29Å; R346-E360 IonicContact CZ-OE1 2.66Å; R346-E360 IonicContact NE-OE1 2.63Å; R346-E360 IonicContact NH1-OE1 3.39Å; R346-E360 PolarHBondContact NH1-OE1 3.45Å; I347-E360 VanDerWaalsContact O-CA 3.31Å; I347-E360 WeakPolarHBondContact O-CA 3.41Å; K348-E360 WeakPolarHBondContact CE-OE1 3.44Å; K348-E360 HydrophobicContact CG-CG 4.16Å
361	D	87.8	Confident	83.2	Confident	19 Å²	19	60.1 Å²	60.1	10%	0.102	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	118.8	-176.8	-169.4	-20.4	0	0	0	110.2	K50 R346 I347 Y359 Y393	K50-D361 WeakPolarHBondContact CD-OD2 3.04Å; K50-D361 IonicContact NZ-OD1 2.78Å; K50-D361 PolarHBondContact NZ-OD1 2.85Å; K50-D361 IonicContact NZ-OD2 3.93Å; K50-D361 PolarHBondContact NZ-OD2 3.26Å; R346-D361 CarbonylContact C-O 3.36Å; R346-D361 WeakPolarHBondContact CA-O 3.41Å; R346-D361 WeakPolarHBondContact CB-O 3.29Å; I347-D361 PolarHBondContact N-O 2.9Å; I347-D361 PolarHBondContact O-N 3.42Å; Y359-D361 HydrophobicContact CD1-CB 4.41Å; Y359-D361 HydrophobicContact CE1-CB 3.53Å; Y359-D361 PolarHBondContact OH-OD2 3.19Å; D361-Y393 VanDerWaalsContact CG-OH 3.27Å; D361-Y393 PolarHBondContact OD2-OH 3.21Å
362	V	86.8	Confident	83.3	Confident	87 Å²	87	64 Å²	64	53%	0.527	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	133.3	-177.7	-178	0	0	0	0	109.7	R346	R346-V362 HydrophobicContact CB-CG2 4.17Å
363	F	83.5	Confident	83.5	Confident	13 Å²	13	62.8 Å²	62.8	6%	0.057	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-95.5	133.3	178.6	-72.2	-101.6	0	0	0	110.4	K50 D345 I347 L370 I384 F391 Y393	K50-F363 VanDerWaalsContact CE-CE1 3.4Å; D345-F363 PolarHBondContact O-N 2.85Å; I347-F363 HydrophobicContact CB-CE2 4.49Å; I347-F363 HydrophobicContact CD1-CD2 4.48Å; I347-F363 HydrophobicContact CD1-CE2 3.23Å; I347-F363 HydrophobicContact CD1-CZ 3.38Å; I347-F363 HydrophobicContact CG1-CE2 3.64Å; I347-F363 HydrophobicContact CG1-CZ 4.25Å; F363-L370 HydrophobicContact CB-CD1 4.1Å; F363-L370 HydrophobicContact CB-CD2 4.49Å; F363-L370 HydrophobicContact CB-CG 4.49Å; F363-L370 HydrophobicContact CD1-CD2 3.89Å; F363-L370 HydrophobicContact CD2-CD1 3.76Å; F363-L370 HydrophobicContact CD2-CD2 4.26Å; F363-L370 HydrophobicContact CE1-CD2 4.15Å; F363-L370 HydrophobicContact CE2-CD1 4.42Å; F363-L370 HydrophobicContact CG-CD1 3.93Å; F363-L370 HydrophobicContact CG-CD2 3.93Å; F363-L370 HydrophobicContact CG-CG 4.35Å; F363-L370 HydrophobicContact CZ-CD2 4.46Å; F363-I384 HydrophobicContact CZ-CG2 4.46Å; F363-F391 HydrophobicContact CD1-CD2 4.18Å; F363-F391 AromaticContact CD1-CE2 3.9Å; F363-F391 HydrophobicContact CD1-CE2 3.9Å; F363-F391 HydrophobicContact CD1-CZ 4.25Å; F363-F391 HydrophobicContact CE1-CD1 4.42Å; F363-F391 AromaticContact CE1-CD2 3.67Å; F363-F391 HydrophobicContact CE1-CD2 3.67Å; F363-F391 AromaticContact CE1-CE2 3.88Å; F363-F391 HydrophobicContact CE1-CE2 3.88Å; F363-F391 AromaticContact CE1-CG 3.96Å; F363-F391 HydrophobicContact CE1-CG 3.96Å; F363-F391 HydrophobicContact CE1-CZ 4.35Å; F363-Y393 HydrophobicContact CZ-CE2 4.08Å; F363-Y393 WeakPolarHBondContact CZ-OH 3.49Å
364	P	79.3	Confident	83.8	Confident	62 Å²	62	62.7 Å²	62.7	40%	0.403	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-72	137	172.4	28.6	-32.3	0	0	0	110.5	K366 F367	P364-K366 HydrophobicContact CB-CG 4.45Å; P364-K366 PolarHBondContact O-N 3.14Å; P364-F367 HydrophobicContact CG-CD2 3.99Å; P364-F367 HydrophobicContact CG-CE2 3.83Å
365	D	75.9	Confident	84.1	Confident	142 Å²	142	61.5 Å²	61.5	76%	0.759	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-58.6	-11.6	179	-64.1	-27.6	0	0	0	114.6	F367 G368	D365-F367 PolarHBondContact O-N 3.06Å; D365-F367 VanDerWaalsContact O-N 3.08Å; D365-G368 PolarHBondContact O-N 2.94Å; D365-G368 VanDerWaalsContact O-N 3.07Å
366	K	78.4	Confident	84.3	Confident	176 Å²	176	60.7 Å²	60.7	77%	0.765	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-55.6	-27.7	-178.6	-62.5	-174.9	-177.8	-179.5	0	113.6	P364	P364-K366 HydrophobicContact CB-CG 4.45Å; P364-K366 PolarHBondContact O-N 3.14Å
367	F	76.4	Confident	83.9	Confident	44 Å²	44	56.8 Å²	56.8	19%	0.193	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-96.6	2.1	-176.3	-56.9	-68.1	0	0	0	113.7	P364 D365 T386 R388 A389 F391	P364-F367 HydrophobicContact CG-CD2 3.99Å; P364-F367 HydrophobicContact CG-CE2 3.83Å; D365-F367 PolarHBondContact O-N 3.06Å; D365-F367 VanDerWaalsContact O-N 3.08Å; F367-T386 HydrophobicContact CB-CG2 4.19Å; F367-T386 WeakPolarHBondContact O-CB 3.38Å; F367-T386 PolarHBondContact O-OG1 2.96Å; F367-R388 PolarHBondContact O-N 3.41Å; F367-A389 HydrophobicContact CB-CB 4.13Å; F367-A389 HydrophobicContact CD1-CB 3.81Å; F367-A389 HydrophobicContact CG-CB 4.06Å; F367-F391 AromaticContact CD2-CZ 3.9Å; F367-F391 HydrophobicContact CD2-CZ 3.9Å; F367-F391 HydrophobicContact CE2-CZ 4.19Å; F367-F391 HydrophobicContact CG-CZ 4.32Å
368	G	79.9	Confident	83.4	Confident	25 Å²	25	57.6 Å²	57.6	26%	0.258	30%	0.298	S	S	.	.			trans	83.1	178.6	-174	0	0	0	0	0	112.7	D365	D365-G368 PolarHBondContact O-N 2.94Å; D365-G368 VanDerWaalsContact O-N 3.07Å
369	P	83.9	Confident	82.7	Confident	66 Å²	66	56.1 Å²	56.1	43%	0.429	30%	0.296	S	S	.	.			trans	-65	143.3	-176.1	26.8	-34.4	0	0	0	111.7	E387	P369-E387 HydrophobicContact CG-CG 4.09Å
370	L	86.6	Confident	82.4	Confident	11 Å²	11	54.8 Å²	54.8	6%	0.058	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	133	170.1	-70	163.4	0	0	0	109.4	L342 L343 F363 I384 T386	L342-L370 HydrophobicContact CD1-CB 4.3Å; L342-L370 HydrophobicContact CD1-CD1 3.89Å; L342-L370 HydrophobicContact CD1-CD2 4.32Å; L342-L370 HydrophobicContact CD1-CG 4.4Å; L342-L370 HydrophobicContact CD2-CB 4.47Å; L343-L370 WeakPolarHBondContact O-CD1 3.35Å; F363-L370 HydrophobicContact CB-CD1 4.1Å; F363-L370 HydrophobicContact CB-CD2 4.49Å; F363-L370 HydrophobicContact CB-CG 4.49Å; F363-L370 HydrophobicContact CD1-CD2 3.89Å; F363-L370 HydrophobicContact CD2-CD1 3.76Å; F363-L370 HydrophobicContact CD2-CD2 4.26Å; F363-L370 HydrophobicContact CE1-CD2 4.15Å; F363-L370 HydrophobicContact CE2-CD1 4.42Å; F363-L370 HydrophobicContact CG-CD1 3.93Å; F363-L370 HydrophobicContact CG-CD2 3.93Å; F363-L370 HydrophobicContact CG-CG 4.35Å; F363-L370 HydrophobicContact CZ-CD2 4.46Å; L370-I384 HydrophobicContact CD2-CG2 3.71Å; L370-T386 HydrophobicContact CD2-CG2 3.65Å; L370-T386 HydrophobicContact CG-CG2 4.32Å
371	K	86.3	Confident	82.4	Confident	75 Å²	75	52.8 Å²	52.8	33%	0.326	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-50.7	-176.5	-68.7	-65.6	-177	-173.3	0	112.7	I330 Y385 E387	I330-K371 WeakPolarHBondContact CG2-O 3.41Å; K371-Y385 HydrophobicContact CB-CD2 3.9Å; K371-Y385 HydrophobicContact CB-CE2 3.37Å; K371-Y385 HydrophobicContact CG-CD2 4.36Å; K371-Y385 HydrophobicContact CG-CE2 3.96Å; K371-Y385 PolarHBondContact N-O 2.89Å; K371-E387 WeakPolarHBondContact CE-OE1 3.35Å; K371-E387 IonicContact NZ-OE1 4Å; K371-E387 PolarHBondContact NZ-OE1 3.19Å
372	R	88.1	Confident	82.5	Confident	82 Å²	82	51.9 Å²	51.9	31%	0.309	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	160.7	-179.2	-151.4	173.3	179.4	177.8	-0.9	112.2	E273 L342 Y385	E273-R372 IonicContact OE1-CZ 3.66Å; E273-R372 IonicContact OE1-NE 3.49Å; E273-R372 PolarHBondContact OE1-NE 3.44Å; E273-R372 IonicContact OE1-NH2 2.74Å; E273-R372 PolarHBondContact OE1-NH2 3.37Å; L342-R372 VanDerWaalsContact CD2-C 3.49Å; R372-Y385 HydrophobicContact CB-CE1 3.62Å; R372-Y385 PolarHBondContact O-N 3.47Å
373	M	90.8	Very high	82.6	Confident	3 Å²	3	48 Å²	48	2%	0.015	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	138.9	172.4	178.4	168.3	56.8	0	0	109.4	S331 V333 L340 L342 V382 W383 I384	S331-M373 PolarHBondContact OG-O 3.2Å; V333-M373 HydrophobicContact CB-CE 3.85Å; V333-M373 HydrophobicContact CB-CG 4.27Å; V333-M373 HydrophobicContact CB-SD 4.23Å; V333-M373 HydrophobicContact CG2-CB 4.43Å; V333-M373 HydrophobicContact CG2-CE 4.02Å; V333-M373 HydrophobicContact CG2-CG 3.67Å; V333-M373 HydrophobicContact CG2-SD 4.27Å; L340-M373 HydrophobicContact CB-CE 3.56Å; L340-M373 HydrophobicContact CB-SD 3.76Å; L340-M373 HydrophobicContact CD2-SD 4.42Å; L340-M373 WeakPolarHBondContact O-CE 3.33Å; L342-M373 HydrophobicContact CB-CB 4.24Å; L342-M373 HydrophobicContact CB-CE 4.06Å; L342-M373 HydrophobicContact CD2-CB 4.03Å; M373-V382 HydrophobicContact CG-CG1 3.44Å; M373-V382 VanDerWaalsContact CG-CG1 3.44Å; M373-V382 HydrophobicContact SD-CG1 3.63Å; M373-W383 CarbonylContact C-O 3.57Å; M373-W383 WeakPolarHBondContact CA-O 3.45Å; M373-I384 HydrophobicContact CB-CD1 4.27Å; M373-I384 HydrophobicContact CB-CG1 3.92Å; M373-I384 HydrophobicContact CG-CD1 3.86Å; M373-I384 HydrophobicContact CG-CG1 3.66Å; M373-I384 HydrophobicContact SD-CD1 3.65Å; M373-I384 HydrophobicContact SD-CG1 4.16Å
374	I	88.6	Confident	83	Confident	29 Å²	29	47.4 Å²	47.4	15%	0.149	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	132.2	-172.5	-58.4	171.1	0	0	0	108.3	L64 V382 W383 Y385	L64-I374 HydrophobicContact CB-CD1 4.38Å; L64-I374 HydrophobicContact CD2-CD1 3.91Å; L64-I374 WeakPolarHBondContact O-CD1 2.98Å; I374-V382 CarbonylContact O-C 3.5Å; I374-V382 WeakPolarHBondContact O-CA 3.2Å; I374-W383 PolarHBondContact N-O 3.28Å; I374-W383 PolarHBondContact O-N 2.86Å; I374-Y385 HydrophobicContact CD1-CE1 4.1Å
375	K	87.3	Confident	83.5	Confident	39 Å²	39	44.7 Å²	44.7	17%	0.17	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	132.7	172.6	-172	-178.2	175.6	-169.3	0	109.7	V333 L334 P377 V382	V333-K375 HydrophobicContact CG1-CB 3.66Å; V333-K375 HydrophobicContact CG1-CD 3.88Å; V333-K375 HydrophobicContact CG1-CG 4.14Å; V333-K375 HydrophobicContact CG2-CB 4.16Å; L334-K375 WeakPolarHBondContact O-CD 3.15Å; L334-K375 PolarHBondContact O-NZ 3.39Å; K375-P377 VanDerWaalsContact O-CD 3.28Å; K375-P377 WeakPolarHBondContact O-CD 3.35Å; K375-V382 HydrophobicContact CG-CG2 4.3Å
376	D	84.4	Confident	84	Confident	2 Å²	2	38 Å²	38	1%	0.011	21%	0.206	C	C	.	.			trans	-75.1	115.7	165.6	-178.4	6.6	0	0	0	109.1	V66 N68 I378 G379 G380 M381	V66-D376 HydrophobicContact CG1-CB 4.32Å; N68-D376 PolarHBondContact N-OD1 3.49Å; D376-I378 PolarHBondContact O-N 3.5Å; D376-I378 PolarHBondContact OD1-N 3.47Å; D376-G379 VanDerWaalsContact CG-N 3.31Å; D376-G379 WeakPolarHBondContact OD2-CA 3.34Å; D376-G379 PolarHBondContact OD2-N 3Å; D376-G379 VanDerWaalsContact OD2-N 3.1Å; D376-G380 WeakPolarHBondContact O-CA 3.34Å; D376-G380 PolarHBondContact O-N 2.86Å; D376-M381 PolarHBondContact N-O 3.45Å
377	P	75.8	Confident	84.4	Confident	45 Å²	45	31.1 Å²	31.1	29%	0.292	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-24.5	-178.6	-21.7	34	0	0	0	113.7	L281 K375	L281-P377 HydrophobicContact CD1-CB 3.94Å; K375-P377 VanDerWaalsContact O-CD 3.28Å; K375-P377 WeakPolarHBondContact O-CD 3.35Å
378	I	74.3	Confident	84.8	Confident	77 Å²	77	35.9 Å²	35.9	40%	0.395	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-53.3	-178.4	-65.4	165.4	0	0	0	110.5	N68 L281 D376 G380	N68-I378 HydrophobicContact CB-CD1 3.51Å; N68-I378 WeakPolarHBondContact OD1-CD1 3.47Å; L281-I378 HydrophobicContact CB-CG1 4.09Å; L281-I378 HydrophobicContact CD1-CD1 3.84Å; L281-I378 HydrophobicContact CD1-CG1 3.55Å; L281-I378 HydrophobicContact CD2-CD1 4.15Å; L281-I378 HydrophobicContact CD2-CG1 4.5Å; L281-I378 HydrophobicContact CG-CD1 4.4Å; L281-I378 HydrophobicContact CG-CG1 4.24Å; D376-I378 PolarHBondContact O-N 3.5Å; D376-I378 PolarHBondContact OD1-N 3.47Å; I378-G380 PolarHBondContact O-N 3.48Å
379	G	71	Confident	85.1	Confident	34 Å²	34	34.7 Å²	34.7	35%	0.351	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-17.1	-178.4	0	0	0	0	0	113.9	D376 M381	D376-G379 VanDerWaalsContact CG-N 3.31Å; D376-G379 WeakPolarHBondContact OD2-CA 3.34Å; D376-G379 PolarHBondContact OD2-N 3Å; D376-G379 VanDerWaalsContact OD2-N 3.1Å; G379-M381 PolarHBondContact O-N 3.42Å
380	G	78.7	Confident	85.3	Confident	30 Å²	30	31.7 Å²	31.7	31%	0.309	16%	0.161	S	C	.	.			trans	65.9	1.3	-176.1	0	0	0	0	0	114.1	D376 I378	D376-G380 WeakPolarHBondContact O-CA 3.34Å; D376-G380 PolarHBondContact O-N 2.86Å; I378-G380 PolarHBondContact O-N 3.48Å
381	M	86.6	Confident	85.4	Confident	48 Å²	48	31.6 Å²	31.6	24%	0.236	16%	0.16	C	C	.	.			trans	-78.7	142.9	-179.3	-58.4	-67.1	173.7	0	0	110.2	D376 G379 R392 H394	D376-M381 PolarHBondContact N-O 3.45Å; G379-M381 PolarHBondContact O-N 3.42Å; M381-R392 HydrophobicContact CB-CG 4.49Å; M381-H394 WeakPolarHBondContact CE-ND1 3.48Å; M381-H394 HydrophobicContact SD-CB 4.26Å; M381-H394 PolarHBondContact SD-ND1 2.9Å
382	V	89.5	Confident	85.5	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	131	176.1	179.8	0	0	0	0	109	V333 M373 I374 K375 I384 R392 Y393 I395	V333-V382 HydrophobicContact CG1-CG1 4.5Å; V333-V382 HydrophobicContact CG1-CG2 3.92Å; M373-V382 HydrophobicContact CG-CG1 3.44Å; M373-V382 VanDerWaalsContact CG-CG1 3.44Å; M373-V382 HydrophobicContact SD-CG1 3.63Å; I374-V382 CarbonylContact O-C 3.5Å; I374-V382 WeakPolarHBondContact O-CA 3.2Å; K375-V382 HydrophobicContact CG-CG2 4.3Å; V382-I384 HydrophobicContact CG1-CD1 4.47Å; V382-I384 HydrophobicContact CG1-CG1 4.35Å; V382-R392 CarbonylContact O-C 3.6Å; V382-Y393 PolarHBondContact N-O 3.18Å; V382-Y393 PolarHBondContact O-N 3.28Å; V382-I395 HydrophobicContact CG2-CD1 4.01Å
383	W	90.1	Very high	85.6	Confident	5 Å²	5	28 Å²	28	2%	0.019	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	131.5	-174.5	-63.1	81.7	0	0	0	109.2	I53 V66 L71 L85 M373 I374 V390 F391 R392	I53-W383 HydrophobicContact CD1-CE3 3.79Å; I53-W383 HydrophobicContact CD1-CH2 3.84Å; I53-W383 HydrophobicContact CD1-CZ3 3.08Å; I53-W383 HydrophobicContact CG1-CZ3 4.5Å; V66-W383 HydrophobicContact CB-CG 4.48Å; V66-W383 HydrophobicContact CG2-CB 4.24Å; V66-W383 HydrophobicContact CG2-CD2 4.16Å; V66-W383 HydrophobicContact CG2-CG 3.94Å; L71-W383 HydrophobicContact CD1-CE3 3.88Å; L71-W383 HydrophobicContact CD1-CH2 4.37Å; L71-W383 HydrophobicContact CD1-CZ3 3.6Å; L85-W383 HydrophobicContact CD1-CH2 3.5Å; L85-W383 VanDerWaalsContact CD1-CH2 3.5Å; L85-W383 HydrophobicContact CD1-CZ2 3.42Å; L85-W383 VanDerWaalsContact CD1-CZ2 3.42Å; L85-W383 HydrophobicContact CD1-CZ3 4.48Å; L85-W383 HydrophobicContact CD2-CH2 3.75Å; L85-W383 HydrophobicContact CD2-CZ3 4.32Å; L85-W383 HydrophobicContact CG-CH2 4.3Å; M373-W383 CarbonylContact C-O 3.57Å; M373-W383 WeakPolarHBondContact CA-O 3.45Å; I374-W383 PolarHBondContact N-O 3.28Å; I374-W383 PolarHBondContact O-N 2.86Å; W383-V390 HydrophobicContact CE3-CG1 4.01Å; W383-F391 WeakPolarHBondContact CA-O 3.4Å; W383-R392 HydrophobicContact CD2-CG 4.46Å; W383-R392 HydrophobicContact CE3-CB 4.42Å; W383-R392 HydrophobicContact CH2-CG 4.37Å; W383-R392 HydrophobicContact CZ2-CG 4.13Å; W383-R392 HydrophobicContact CZ3-CB 4.5Å
384	I	90.9	Very high	85.4	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	130.4	-176.9	-59.9	-177.8	0	0	0	107.4	L342 I347 F363 L370 M373 V382 F391 Y393	L342-I384 HydrophobicContact CD1-CG2 4.19Å; I347-I384 HydrophobicContact CD1-CD1 3.02Å; I347-I384 HydrophobicContact CD1-CG1 4.45Å; I347-I384 HydrophobicContact CG1-CD1 3.95Å; F363-I384 HydrophobicContact CZ-CG2 4.46Å; L370-I384 HydrophobicContact CD2-CG2 3.71Å; M373-I384 HydrophobicContact CB-CD1 4.27Å; M373-I384 HydrophobicContact CB-CG1 3.92Å; M373-I384 HydrophobicContact CG-CD1 3.86Å; M373-I384 HydrophobicContact CG-CG1 3.66Å; M373-I384 HydrophobicContact SD-CD1 3.65Å; M373-I384 HydrophobicContact SD-CG1 4.16Å; V382-I384 HydrophobicContact CG1-CD1 4.47Å; V382-I384 HydrophobicContact CG1-CG1 4.35Å; I384-F391 HydrophobicContact CB-CB 4.47Å; I384-F391 PolarHBondContact N-O 3.48Å; I384-F391 PolarHBondContact O-N 3.25Å; I384-Y393 HydrophobicContact CD1-CD2 3.78Å; I384-Y393 HydrophobicContact CD1-CE2 3.62Å; I384-Y393 HydrophobicContact CG1-CD2 4.28Å; I384-Y393 HydrophobicContact CG1-CE2 4.35Å
385	Y	89.5	Confident	85.1	Confident	5 Å²	5	30.9 Å²	30.9	2%	0.02	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	145.9	-179.3	71.7	-83.2	0	0	0	111.6	I61 N62 L64 K371 R372 I374 A389	I61-Y385 HydrophobicContact CB-CD2 4.18Å; I61-Y385 HydrophobicContact CG2-CD2 3.52Å; I61-Y385 HydrophobicContact CG2-CE2 3.79Å; I61-Y385 HydrophobicContact CG2-CG 4.37Å; N62-Y385 PolarHBondContact O-OH 2.73Å; L64-Y385 HydrophobicContact CB-CD1 3.52Å; L64-Y385 HydrophobicContact CB-CD2 4.32Å; L64-Y385 HydrophobicContact CB-CE1 3.51Å; L64-Y385 HydrophobicContact CB-CE2 4.32Å; L64-Y385 HydrophobicContact CB-CG 3.94Å; L64-Y385 HydrophobicContact CD1-CD1 4.36Å; L64-Y385 HydrophobicContact CD1-CG 4.28Å; L64-Y385 HydrophobicContact CD2-CD1 4.21Å; L64-Y385 HydrophobicContact CG-CD1 4.25Å; K371-Y385 HydrophobicContact CB-CD2 3.9Å; K371-Y385 HydrophobicContact CB-CE2 3.37Å; K371-Y385 HydrophobicContact CG-CD2 4.36Å; K371-Y385 HydrophobicContact CG-CE2 3.96Å; K371-Y385 PolarHBondContact N-O 2.89Å; R372-Y385 HydrophobicContact CB-CE1 3.62Å; R372-Y385 PolarHBondContact O-N 3.47Å; I374-Y385 HydrophobicContact CD1-CE1 4.1Å; Y385-A389 WeakPolarHBondContact CA-O 3.26Å
386	T	87.9	Confident	84.7	Confident	2 Å²	2	32 Å²	32	1%	0.012	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	179	171.4	57.9	0	0	0	0	108.1	F367 L370 R388 A389 F391	F367-T386 HydrophobicContact CB-CG2 4.19Å; F367-T386 WeakPolarHBondContact O-CB 3.38Å; F367-T386 PolarHBondContact O-OG1 2.96Å; L370-T386 HydrophobicContact CD2-CG2 3.65Å; L370-T386 HydrophobicContact CG-CG2 4.32Å; T386-R388 PolarHBondContact O-N 3.1Å; T386-R388 VanDerWaalsContact O-N 3.13Å; T386-A389 PolarHBondContact N-O 3.48Å; T386-A389 WeakPolarHBondContact OG1-CA 3.14Å; T386-A389 PolarHBondContact OG1-N 2.88Å; T386-A389 PolarHBondContact OG1-O 3.03Å; T386-F391 HydrophobicContact CG2-CE2 4.04Å
387	E	85.4	Confident	84.2	Confident	31 Å²	31	40.3 Å²	40.3	15%	0.145	20%	0.195	C	C	.	.	S	Bend	trans	-59.1	-24.5	174.7	-66.6	-167.7	175.8	0	0	113.4	R60 I61 P369 K371	R60-E387 WeakPolarHBondContact CA-O 3.35Å; R60-E387 IonicContact CZ-OE2 3.77Å; R60-E387 IonicContact NE-OE2 3.99Å; R60-E387 IonicContact NH1-OE2 2.9Å; R60-E387 PolarHBondContact NH1-OE2 3Å; I61-E387 PolarHBondContact N-O 3.49Å; P369-E387 HydrophobicContact CG-CG 4.09Å; K371-E387 WeakPolarHBondContact CE-OE1 3.35Å; K371-E387 IonicContact NZ-OE1 4Å; K371-E387 PolarHBondContact NZ-OE1 3.19Å
388	R	84.2	Confident	84.3	Confident	143 Å²	143	39.2 Å²	39.2	54%	0.54	19%	0.186	S	C	.	.	S	Bend	trans	-129.3	-5.9	-171.2	-61.8	-176.8	175.5	176.1	-2.9	115.8	P57 F367 T386	P57-R388 VanDerWaalsContact CD-O 3.24Å; P57-R388 WeakPolarHBondContact CD-O 3.43Å; F367-R388 PolarHBondContact O-N 3.41Å; T386-R388 PolarHBondContact O-N 3.1Å; T386-R388 VanDerWaalsContact O-N 3.13Å
389	A	86.4	Confident	84.4	Confident	1 Å²	1	38 Å²	38	1%	0.008	18%	0.184	C	C	.	.			trans	-148.7	150.3	-176.6	0	0	0	0	0	112.4	F367 Y385 T386 F391	F367-A389 HydrophobicContact CB-CB 4.13Å; F367-A389 HydrophobicContact CD1-CB 3.81Å; F367-A389 HydrophobicContact CG-CB 4.06Å; Y385-A389 WeakPolarHBondContact CA-O 3.26Å; T386-A389 PolarHBondContact N-O 3.48Å; T386-A389 WeakPolarHBondContact OG1-CA 3.14Å; T386-A389 PolarHBondContact OG1-N 2.88Å; T386-A389 PolarHBondContact OG1-O 3.03Å; A389-F391 HydrophobicContact CB-CE2 4.06Å; A389-F391 HydrophobicContact CB-CZ 4.19Å
390	V	88.3	Confident	84.6	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.012	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	132.5	173.8	-173.6	0	0	0	0	109.4	I53 I61 L64 W383	I53-V390 HydrophobicContact CD1-CB 4.45Å; I53-V390 HydrophobicContact CD1-CG1 4Å; I53-V390 PolarHBondContact N-O 3.27Å; I53-V390 VanDerWaalsContact N-O 3.1Å; I61-V390 HydrophobicContact CD1-CG2 3.64Å; L64-V390 HydrophobicContact CD1-CG1 4.27Å; L64-V390 HydrophobicContact CD1-CG2 3.91Å; W383-V390 HydrophobicContact CE3-CG1 4.01Å
391	F	89.1	Confident	84.4	Confident	9 Å²	9	39.7 Å²	39.7	4%	0.039	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	141	177.2	-58.8	-83.8	0	0	0	109.4	K50 R52 F363 F367 W383 I384 T386 A389 Y393	K50-F391 HydrophobicContact CG-CD1 4.43Å; R52-F391 HydrophobicContact CB-CD1 3.99Å; R52-F391 HydrophobicContact CB-CE1 4.03Å; R52-F391 HydrophobicContact CG-CD1 4.26Å; R52-F391 HydrophobicContact CG-CE1 4.05Å; F363-F391 HydrophobicContact CD1-CD2 4.18Å; F363-F391 AromaticContact CD1-CE2 3.9Å; F363-F391 HydrophobicContact CD1-CE2 3.9Å; F363-F391 HydrophobicContact CD1-CZ 4.25Å; F363-F391 HydrophobicContact CE1-CD1 4.42Å; F363-F391 AromaticContact CE1-CD2 3.67Å; F363-F391 HydrophobicContact CE1-CD2 3.67Å; F363-F391 AromaticContact CE1-CE2 3.88Å; F363-F391 HydrophobicContact CE1-CE2 3.88Å; F363-F391 AromaticContact CE1-CG 3.96Å; F363-F391 HydrophobicContact CE1-CG 3.96Å; F363-F391 HydrophobicContact CE1-CZ 4.35Å; F367-F391 AromaticContact CD2-CZ 3.9Å; F367-F391 HydrophobicContact CD2-CZ 3.9Å; F367-F391 HydrophobicContact CE2-CZ 4.19Å; F367-F391 HydrophobicContact CG-CZ 4.32Å; W383-F391 WeakPolarHBondContact CA-O 3.4Å; I384-F391 HydrophobicContact CB-CB 4.47Å; I384-F391 PolarHBondContact N-O 3.48Å; I384-F391 PolarHBondContact O-N 3.25Å; T386-F391 HydrophobicContact CG2-CE2 4.04Å; A389-F391 HydrophobicContact CB-CE2 4.06Å; A389-F391 HydrophobicContact CB-CZ 4.19Å; F391-Y393 HydrophobicContact CB-CE2 4.47Å
392	R	88.9	Confident	84.1	Confident	82 Å²	82	37.4 Å²	37.4	31%	0.309	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	126.6	174.9	-178	177.4	70.2	175.3	2.1	108.9	Q51 I53 M381 V382 W383	Q51-R392 PolarHBondContact N-O 3.42Å; Q51-R392 PolarHBondContact O-N 2.88Å; I53-R392 HydrophobicContact CD1-CB 4.24Å; I53-R392 HydrophobicContact CG1-CB 4.35Å; M381-R392 HydrophobicContact CB-CG 4.49Å; V382-R392 CarbonylContact O-C 3.6Å; W383-R392 HydrophobicContact CD2-CG 4.46Å; W383-R392 HydrophobicContact CE3-CB 4.42Å; W383-R392 HydrophobicContact CH2-CG 4.37Å; W383-R392 HydrophobicContact CZ2-CG 4.13Å; W383-R392 HydrophobicContact CZ3-CB 4.5Å
393	Y	89.5	Confident	83.8	Confident	1 Å²	1	38 Å²	38	0%	0.004	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	121.6	172	-79.5	-95.1	0	0	0	109.3	F48 N49 K50 I347 Y359 D361 F363 V382 I384 F391	F48-Y393 HydrophobicContact CB-CD1 4.3Å; N49-Y393 WeakPolarHBondContact O-CA 3.33Å; K50-Y393 HydrophobicContact CB-CD1 4.34Å; K50-Y393 HydrophobicContact CB-CE1 3.75Å; K50-Y393 WeakPolarHBondContact CE-OH 3.22Å; K50-Y393 HydrophobicContact CG-CE1 4.16Å; K50-Y393 HydrophobicContact CG-CE2 4.16Å; I347-Y393 HydrophobicContact CD1-CE2 3.81Å; Y359-Y393 HydrophobicContact CE1-CE1 4.09Å; D361-Y393 VanDerWaalsContact CG-OH 3.27Å; D361-Y393 PolarHBondContact OD2-OH 3.21Å; F363-Y393 HydrophobicContact CZ-CE2 4.08Å; F363-Y393 WeakPolarHBondContact CZ-OH 3.49Å; V382-Y393 PolarHBondContact N-O 3.18Å; V382-Y393 PolarHBondContact O-N 3.28Å; I384-Y393 HydrophobicContact CD1-CD2 3.78Å; I384-Y393 HydrophobicContact CD1-CE2 3.62Å; I384-Y393 HydrophobicContact CG1-CD2 4.28Å; I384-Y393 HydrophobicContact CG1-CE2 4.35Å; F391-Y393 HydrophobicContact CB-CE2 4.47Å
394	H	86	Confident	83.3	Confident	59 Å²	59	41.8 Å²	41.8	27%	0.273	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	122.9	172.3	-173.9	51.1	0	0	0	109.1	N49 M381 Q396	N49-H394 PolarHBondContact N-O 2.93Å; N49-H394 PolarHBondContact O-N 3.29Å; M381-H394 WeakPolarHBondContact CE-ND1 3.48Å; M381-H394 HydrophobicContact SD-CB 4.26Å; M381-H394 PolarHBondContact SD-ND1 2.9Å; H394-Q396 WeakPolarHBondContact CD2-CG 3.32Å; H394-Q396 PolarHBondContact CD2-NE2 3.41Å; H394-Q396 WeakPolarHBondContact NE2-CG 3.44Å; H394-Q396 PolarHBondContact NE2-NE2 2.93Å
395	I	84.3	Confident	82.8	Confident	33 Å²	33	42.8 Å²	42.8	17%	0.169	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	116	179.6	-57.2	165.7	0	0	0	107.7	I47 F48 T335 V382 E398	I47-I395 HydrophobicContact CG2-CG2 4.38Å; I47-I395 CarbonylContact O-C 3.54Å; I47-I395 WeakPolarHBondContact O-CA 3.25Å; F48-I395 HydrophobicContact CD1-CG1 3.95Å; F48-I395 HydrophobicContact CE1-CD1 4.31Å; F48-I395 HydrophobicContact CE1-CG1 3.91Å; F48-I395 HydrophobicContact CE1-CG2 4.45Å; T335-I395 HydrophobicContact CG2-CD1 3.39Å; V382-I395 HydrophobicContact CG2-CD1 4.01Å; I395-E398 HydrophobicContact CG2-CB 4.04Å; I395-E398 HydrophobicContact CG2-CG 4.36Å
396	Q	77.9	Confident	82.5	Confident	62 Å²	62	43.7 Å²	43.7	29%	0.29	19%	0.192	S	C	.	.			trans	-114.2	128.8	178.9	-66.5	-166.3	-18.7	0	0	110.8	I47 H394 E398	I47-Q396 PolarHBondContact O-N 3.48Å; H394-Q396 WeakPolarHBondContact CD2-CG 3.32Å; H394-Q396 PolarHBondContact CD2-NE2 3.41Å; H394-Q396 WeakPolarHBondContact NE2-CG 3.44Å; H394-Q396 PolarHBondContact NE2-NE2 2.93Å; Q396-E398 PolarHBondContact O-N 3.11Å
397	R	73.1	Confident	82.3	Confident	176 Å²	176	44.2 Å²	44.2	66%	0.664	20%	0.195	S	C	*	.			trans	46.2	56.4	173.8	-65.5	-175.8	175.8	173.5	-1.3	113.3	S399 R400	R397-S399 PolarHBondContact O-N 2.72Å; R397-S399 VanDerWaalsContact O-N 3.12Å; R397-R400 HydrophobicContact CB-CB 4.46Å; R397-R400 VanDerWaalsContact O-CB 3.23Å; R397-R400 WeakPolarHBondContact O-CB 3.49Å; R397-R400 PolarHBondContact O-N 2.95Å
398	E	78.2	Confident	82.2	Confident	22 Å²	22	47.8 Å²	47.8	10%	0.103	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-28.4	179.7	-162.5	-178.6	172.8	0	0	113.3	T335 Q336 F337 H338 I395 Q396 R400	T335-E398 WeakPolarHBondContact CB-OE1 3.15Å; T335-E398 WeakPolarHBondContact CB-OE2 3.44Å; T335-E398 PolarHBondContact OG1-OE1 3.5Å; Q336-E398 WeakPolarHBondContact CB-OE2 3.21Å; Q336-E398 PolarHBondContact N-OE1 2.85Å; Q336-E398 PolarHBondContact N-OE2 3.18Å; F337-E398 WeakPolarHBondContact CA-OE1 3.25Å; F337-E398 HydrophobicContact CB-CG 4.38Å; F337-E398 HydrophobicContact CD2-CB 4.45Å; F337-E398 HydrophobicContact CD2-CG 4.07Å; F337-E398 PolarHBondContact N-OE1 3.14Å; H338-E398 IonicContact CE1-OE1 2.81Å; H338-E398 IonicContact CG-OE1 2.85Å; H338-E398 PolarHBondContact N-OE1 3.29Å; H338-E398 VanDerWaalsContact N-OE1 3.12Å; H338-E398 WeakPolarHBondContact ND1-CG 3.39Å; H338-E398 IonicContact ND1-OE1 3.51Å; H338-E398 PolarHBondContact ND1-OE1 3.13Å; I395-E398 HydrophobicContact CG2-CB 4.04Å; I395-E398 HydrophobicContact CG2-CG 4.36Å; Q396-E398 PolarHBondContact O-N 3.11Å; E398-R400 VanDerWaalsContact C-N 3.26Å; E398-R400 PolarHBondContact O-N 3.38Å
399	S	77.8	Confident	82	Confident	51 Å²	51	44.2 Å²	44.2	36%	0.357	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-2	178.1	55.1	0	0	0	0	115	R397 D401 V402	R397-S399 PolarHBondContact O-N 2.72Å; R397-S399 VanDerWaalsContact O-N 3.12Å; S399-D401 PolarHBondContact O-N 3.39Å; S399-V402 WeakPolarHBondContact O-CB 3.41Å; S399-V402 PolarHBondContact O-N 3.3Å
400	R	74	Confident	81.9	Confident	44 Å²	44	47.8 Å²	47.8	17%	0.166	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-48.5	-172	-177.9	-146.4	-150.5	126.9	34.5	113.5	E44 K45 R397 E398 W403	E44-R400 VanDerWaalsContact CA-NH2 3.34Å; E44-R400 IonicContact OE1-NE 3.51Å; E44-R400 IonicContact OE2-CZ 3.77Å; E44-R400 IonicContact OE2-NE 3.87Å; E44-R400 PolarHBondContact OE2-NE 3.32Å; E44-R400 IonicContact OE2-NH2 3.71Å; E44-R400 PolarHBondContact OE2-NH2 2.98Å; K45-R400 PolarHBondContact O-NH1 2.99Å; R397-R400 HydrophobicContact CB-CB 4.46Å; R397-R400 VanDerWaalsContact O-CB 3.23Å; R397-R400 WeakPolarHBondContact O-CB 3.49Å; R397-R400 PolarHBondContact O-N 2.95Å; E398-R400 VanDerWaalsContact C-N 3.26Å; E398-R400 PolarHBondContact O-N 3.38Å; R400-W403 PolarHBondContact O-NE1 2.83Å
401	D	74.3	Confident	81.7	Confident	56 Å²	56	53 Å²	53	30%	0.299	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-3.4	-173.9	-59.8	-41.5	0	0	0	112.2	S399 W403 Q404 M405	S399-D401 PolarHBondContact O-N 3.39Å; D401-W403 PolarHBondContact O-N 3.04Å; D401-Q404 WeakPolarHBondContact O-CB 3.12Å; D401-Q404 PolarHBondContact O-N 3.32Å; D401-M405 WeakPolarHBondContact O-CG 3.38Å; D401-M405 PolarHBondContact O-N 2.93Å
402	V	81.1	Confident	81.4	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.006	25%	0.247	C	C	.	.	H	α-helix	trans	-59.9	-33	-176	170.6	0	0	0	0	111.9	F337 L353 S399 Q404 M405 Y406 Y418	F337-V402 HydrophobicContact CB-CG2 4.24Å; F337-V402 HydrophobicContact CD1-CG1 4.36Å; F337-V402 HydrophobicContact CD1-CG2 4.12Å; F337-V402 HydrophobicContact CD2-CG2 3.71Å; F337-V402 HydrophobicContact CE1-CG1 4.06Å; F337-V402 HydrophobicContact CE1-CG2 4.38Å; F337-V402 HydrophobicContact CE2-CG2 3.99Å; F337-V402 HydrophobicContact CG-CG2 3.77Å; F337-V402 HydrophobicContact CZ-CG1 4.22Å; F337-V402 HydrophobicContact CZ-CG2 4.31Å; L353-V402 HydrophobicContact CD1-CG1 3.97Å; S399-V402 WeakPolarHBondContact O-CB 3.41Å; S399-V402 PolarHBondContact O-N 3.3Å; V402-Q404 PolarHBondContact O-N 3.39Å; V402-M405 WeakPolarHBondContact O-CB 3.37Å; V402-M405 PolarHBondContact O-N 3.46Å; V402-Y406 HydrophobicContact CG1-CD2 3.52Å; V402-Y406 HydrophobicContact CG1-CE2 3.22Å; V402-Y406 WeakPolarHBondContact O-CD2 3.37Å; V402-Y406 PolarHBondContact O-N 3.27Å; V402-Y418 HydrophobicContact CG1-CD2 4.1Å; V402-Y418 HydrophobicContact CG1-CE2 4.22Å; V402-Y418 HydrophobicContact CG1-CG 4.3Å
403	W	81.8	Confident	81.2	Confident	13 Å²	13	54.8 Å²	54.8	5%	0.049	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-38.4	175.4	67.7	-89.7	0	0	0	112.8	R400 D401 M405 Y406 M407 A415 C419 C425 M428 V429	R400-W403 PolarHBondContact O-NE1 2.83Å; D401-W403 PolarHBondContact O-N 3.04Å; W403-M405 VanDerWaalsContact C-N 3.25Å; W403-M405 PolarHBondContact O-N 3.42Å; W403-Y406 PolarHBondContact O-N 3.16Å; W403-M407 HydrophobicContact CE3-CE 4.05Å; W403-M407 HydrophobicContact CZ3-CE 3.53Å; W403-M407 WeakPolarHBondContact O-CB 3.35Å; W403-M407 PolarHBondContact O-N 3.32Å; W403-A415 HydrophobicContact CB-CB 4.47Å; W403-C419 WeakPolarHBondContact CB-SG 3.34Å; W403-C419 VanDerWaalsContact CD2-SG 3.57Å; W403-C425 HydrophobicContact CD2-CB 4.01Å; W403-C425 HydrophobicContact CE3-CB 4.29Å; W403-C425 HydrophobicContact CH2-CB 3.94Å; W403-C425 HydrophobicContact CZ2-CB 3.66Å; W403-C425 WeakPolarHBondContact CZ2-SG 3.16Å; W403-C425 HydrophobicContact CZ3-CB 4.24Å; W403-M428 HydrophobicContact CH2-CB 4.29Å; W403-M428 HydrophobicContact CH2-CE 4.13Å; W403-M428 HydrophobicContact CH2-SD 3.82Å; W403-M428 HydrophobicContact CZ3-CB 4.06Å; W403-M428 HydrophobicContact CZ3-SD 4.49Å; W403-V429 HydrophobicContact CE3-CG2 3.54Å; W403-V429 HydrophobicContact CZ3-CG2 4.02Å
404	Q	81.1	Confident	80.9	Confident	83 Å²	83	57.7 Å²	57.7	39%	0.388	28%	0.278	S	S	.	.	H	α-helix	trans	-64.8	-36	176.5	-61.8	-177.1	-5.3	0	0	110.6	D401 V402 M407 N408	D401-Q404 WeakPolarHBondContact O-CB 3.12Å; D401-Q404 PolarHBondContact O-N 3.32Å; V402-Q404 PolarHBondContact O-N 3.39Å; Q404-M407 PolarHBondContact O-N 2.79Å; Q404-N408 WeakPolarHBondContact O-CB 3.03Å; Q404-N408 PolarHBondContact O-N 3Å; Q404-N408 PolarHBondContact O-ND2 3.1Å
405	M	80.8	Confident	80.7	Confident	23 Å²	23	54.9 Å²	54.9	11%	0.113	27%	0.265	C	S	.	.	H	α-helix	trans	-68.8	-49.1	178.7	-46.1	-169	88.8	0	0	110.9	C351 L353 N354 D401 V402 W403 M407 N408 M409	C351-M405 HydrophobicContact CB-CE 3.87Å; C351-M405 HydrophobicContact CB-SD 4.44Å; C351-M405 WeakPolarHBondContact SG-CE 3.43Å; C351-M405 PolarHBondContact SG-SD 3.35Å; L353-M405 HydrophobicContact CB-SD 4.4Å; L353-M405 HydrophobicContact CD1-CB 4.21Å; L353-M405 HydrophobicContact CD1-SD 4.25Å; N354-M405 HydrophobicContact CB-CE 3.75Å; N354-M405 WeakPolarHBondContact ND2-CE 3.37Å; N354-M405 WeakPolarHBondContact OD1-CE 3.49Å; D401-M405 WeakPolarHBondContact O-CG 3.38Å; D401-M405 PolarHBondContact O-N 2.93Å; V402-M405 WeakPolarHBondContact O-CB 3.37Å; V402-M405 PolarHBondContact O-N 3.46Å; W403-M405 VanDerWaalsContact C-N 3.25Å; W403-M405 PolarHBondContact O-N 3.42Å; M405-M407 VanDerWaalsContact C-N 3.26Å; M405-M407 PolarHBondContact O-N 2.6Å; M405-N408 PolarHBondContact O-N 2.68Å; M405-N408 VanDerWaalsContact O-N 3.13Å; M405-M409 WeakPolarHBondContact O-CG 3.44Å; M405-M409 PolarHBondContact O-N 3.21Å
406	Y	82.3	Confident	80.6	Confident	23 Å²	23	55.4 Å²	55.4	9%	0.09	27%	0.265	C	S	.	.	H	α-helix	trans	-61.6	-37.1	175.4	-77.4	-52.3	0	0	0	112.4	L353 V402 W403 M409 N410 K411 L414 Y418	L353-Y406 HydrophobicContact CD1-CE1 4.34Å; L353-Y406 HydrophobicContact CD1-CE2 4.31Å; L353-Y406 HydrophobicContact CD2-CE1 4.11Å; V402-Y406 HydrophobicContact CG1-CD2 3.52Å; V402-Y406 HydrophobicContact CG1-CE2 3.22Å; V402-Y406 WeakPolarHBondContact O-CD2 3.37Å; V402-Y406 PolarHBondContact O-N 3.27Å; W403-Y406 PolarHBondContact O-N 3.16Å; Y406-M409 CarbonylContact O-C 3.56Å; Y406-M409 PolarHBondContact O-N 2.99Å; Y406-N410 PolarHBondContact O-N 3.42Å; Y406-K411 HydrophobicContact CD1-CB 4.18Å; Y406-K411 HydrophobicContact CD1-CD 4.31Å; Y406-K411 PolarHBondContact O-N 3.06Å; Y406-L414 HydrophobicContact CD1-CB 4.11Å; Y406-L414 HydrophobicContact CD1-CD1 4.01Å; Y406-L414 HydrophobicContact CD2-CB 4.02Å; Y406-L414 HydrophobicContact CE1-CB 4.39Å; Y406-L414 HydrophobicContact CE1-CD1 3.74Å; Y406-L414 HydrophobicContact CE2-CB 4.28Å; Y406-L414 HydrophobicContact CG-CB 3.94Å; Y406-Y418 AromaticContact CD2-CD2 3.85Å; Y406-Y418 HydrophobicContact CD2-CD2 3.85Å; Y406-Y418 AromaticContact CD2-CE2 4Å; Y406-Y418 HydrophobicContact CD2-CE2 4Å; Y406-Y418 AromaticContact CE2-CD2 3.76Å; Y406-Y418 HydrophobicContact CE2-CD2 3.76Å; Y406-Y418 AromaticContact CE2-CE2 3.42Å; Y406-Y418 HydrophobicContact CE2-CE2 3.42Å; Y406-Y418 VanDerWaalsContact CE2-CE2 3.42Å
407	M	83	Confident	80.8	Confident	13 Å²	13	57.3 Å²	57.3	6%	0.064	28%	0.275	C	S	.	.	H	α-helix	trans	-63.3	-41.1	173.7	-177.8	-140.2	-102.4	0	0	111.9	W403 Q404 M405 M409 N410 F412 A415 M428 V429 K432	W403-M407 HydrophobicContact CE3-CE 4.05Å; W403-M407 HydrophobicContact CZ3-CE 3.53Å; W403-M407 WeakPolarHBondContact O-CB 3.35Å; W403-M407 PolarHBondContact O-N 3.32Å; Q404-M407 PolarHBondContact O-N 2.79Å; M405-M407 VanDerWaalsContact C-N 3.26Å; M405-M407 PolarHBondContact O-N 2.6Å; M407-M409 VanDerWaalsContact C-N 3.27Å; M407-M409 PolarHBondContact O-N 3.42Å; M407-N410 PolarHBondContact O-N 2.91Å; M407-F412 HydrophobicContact CG-CD1 4.46Å; M407-F412 HydrophobicContact CG-CE1 4.16Å; M407-A415 HydrophobicContact CB-CB 4.33Å; M407-M428 HydrophobicContact CE-CB 3.88Å; M407-M428 VanDerWaalsContact CE-O 3.3Å; M407-M428 WeakPolarHBondContact CE-O 3.47Å; M407-V429 HydrophobicContact CB-CG2 4.5Å; M407-V429 VanDerWaalsContact CE-CA 3.45Å; M407-V429 HydrophobicContact CE-CB 4.23Å; M407-V429 HydrophobicContact CE-CG2 3.75Å; M407-V429 HydrophobicContact CG-CG2 4.5Å; M407-K432 HydrophobicContact CE-CB 4.35Å; M407-K432 HydrophobicContact CG-CB 4.24Å; M407-K432 HydrophobicContact CG-CD 3.68Å; M407-K432 HydrophobicContact CG-CG 4.41Å; M407-K432 HydrophobicContact SD-CB 4.25Å; M407-K432 HydrophobicContact SD-CD 3.44Å; M407-K432 WeakPolarHBondContact SD-CD 3.21Å; M407-K432 HydrophobicContact SD-CG 4.47Å
408	N	83.1	Confident	81.1	Confident	107 Å²	107	52.8 Å²	52.8	57%	0.572	26%	0.258	S	S	*	.	H	α-helix	trans	-68.4	-25.4	173.9	-71.9	-24.1	0	0	0	113.3	Q404 M405 N410 K432	Q404-N408 WeakPolarHBondContact O-CB 3.03Å; Q404-N408 PolarHBondContact O-N 3Å; Q404-N408 PolarHBondContact O-ND2 3.1Å; M405-N408 PolarHBondContact O-N 2.68Å; M405-N408 VanDerWaalsContact O-N 3.13Å; N408-N410 VanDerWaalsContact C-N 3.29Å; N408-K432 PolarHBondContact OD1-NZ 2.98Å
409	M	81.9	Confident	81	Confident	68 Å²	68	51.8 Å²	51.8	34%	0.335	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	5.4	174.2	-66.7	179	177.7	0	0	114	L353 M405 Y406 M407 K411	L353-M409 HydrophobicContact CB-CE 3.65Å; L353-M409 WeakPolarHBondContact O-CE 3.34Å; M405-M409 WeakPolarHBondContact O-CG 3.44Å; M405-M409 PolarHBondContact O-N 3.21Å; Y406-M409 CarbonylContact O-C 3.56Å; Y406-M409 PolarHBondContact O-N 2.99Å; M407-M409 VanDerWaalsContact C-N 3.27Å; M407-M409 PolarHBondContact O-N 3.42Å; M409-K411 HydrophobicContact CB-CG 4.43Å; M409-K411 PolarHBondContact O-N 3.19Å
410	N	83.2	Confident	80.6	Confident	75 Å²	75	58.5 Å²	58.5	40%	0.401	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	59	20.5	-173.9	-53.3	-34	0	0	0	114.4	Y406 M407 N408 F412 Y436	Y406-N410 PolarHBondContact O-N 3.42Å; M407-N410 PolarHBondContact O-N 2.91Å; N408-N410 VanDerWaalsContact C-N 3.29Å; N410-F412 HydrophobicContact CB-CE2 3.98Å; N410-F412 HydrophobicContact CB-CZ 4.3Å; N410-F412 WeakPolarHBondContact O-CD2 3.45Å; N410-F412 PolarHBondContact O-N 3.42Å; N410-Y436 HydrophobicContact CB-CE2 4.31Å
411	K	83.6	Confident	80.6	Confident	112 Å²	112	63.8 Å²	63.8	49%	0.487	30%	0.303	S	S	.	.			trans	-94.2	69.1	174.1	-67.5	-173	179.8	179.9	0	109.7	Y406 M409 D413 L414 A415	Y406-K411 HydrophobicContact CD1-CB 4.18Å; Y406-K411 HydrophobicContact CD1-CD 4.31Å; Y406-K411 PolarHBondContact O-N 3.06Å; M409-K411 HydrophobicContact CB-CG 4.43Å; M409-K411 PolarHBondContact O-N 3.19Å; K411-D413 PolarHBondContact O-N 3.28Å; K411-L414 HydrophobicContact CB-CD1 4.32Å; K411-L414 HydrophobicContact CD-CD1 4.02Å; K411-L414 PolarHBondContact O-N 2.82Å; K411-A415 PolarHBondContact O-N 2.83Å
412	F	84.4	Confident	80.6	Confident	13 Å²	13	65.2 Å²	65.2	6%	0.057	30%	0.304	C	S	.	.	H	α-helix	trans	-65.1	-35.1	-171.4	-58.9	-72.6	0	0	0	113.7	M407 N410 L414 A415 K416 V429 K432 E433 Y436	M407-F412 HydrophobicContact CG-CD1 4.46Å; M407-F412 HydrophobicContact CG-CE1 4.16Å; N410-F412 HydrophobicContact CB-CE2 3.98Å; N410-F412 HydrophobicContact CB-CZ 4.3Å; N410-F412 WeakPolarHBondContact O-CD2 3.45Å; N410-F412 PolarHBondContact O-N 3.42Å; F412-L414 PolarHBondContact O-N 2.92Å; F412-A415 WeakPolarHBondContact O-CB 3.35Å; F412-A415 PolarHBondContact O-N 2.63Å; F412-A415 VanDerWaalsContact O-N 3.16Å; F412-K416 VanDerWaalsContact O-CG 3.32Å; F412-K416 WeakPolarHBondContact O-CG 3.33Å; F412-K416 PolarHBondContact O-N 3.36Å; F412-V429 HydrophobicContact CD1-CG1 4.26Å; F412-K432 HydrophobicContact CE1-CB 4.32Å; F412-K432 HydrophobicContact CE1-CG 4.31Å; F412-E433 HydrophobicContact CB-CB 4.19Å; F412-E433 HydrophobicContact CB-CG 4.01Å; F412-E433 HydrophobicContact CD1-CB 3.66Å; F412-E433 HydrophobicContact CD1-CG 4.27Å; F412-E433 HydrophobicContact CD2-CB 4.08Å; F412-E433 HydrophobicContact CD2-CG 3.86Å; F412-E433 HydrophobicContact CE1-CB 4.01Å; F412-E433 HydrophobicContact CE2-CB 4.4Å; F412-E433 HydrophobicContact CE2-CG 4.42Å; F412-E433 HydrophobicContact CG-CB 3.7Å; F412-E433 HydrophobicContact CG-CG 3.78Å; F412-E433 HydrophobicContact CZ-CB 4.37Å; F412-Y436 AromaticContact CE2-CD1 3.69Å; F412-Y436 HydrophobicContact CE2-CD1 3.69Å; F412-Y436 HydrophobicContact CE2-CE1 4.32Å; F412-Y436 AromaticContact CE2-CG 3.86Å; F412-Y436 HydrophobicContact CE2-CG 3.86Å; F412-Y436 HydrophobicContact CZ-CD1 4.39Å; F412-Y436 HydrophobicContact CZ-CG 4.1Å
413	D	83.9	Confident	80.3	Confident	116 Å²	116	70.2 Å²	70.2	62%	0.62	34%	0.336	S	S	*	.	H	α-helix	trans	-61.7	-46	179.4	-61.4	-41.9	0	0	0	112.2	K411 A415 K416 E417	K411-D413 PolarHBondContact O-N 3.28Å; D413-A415 VanDerWaalsContact C-N 3.34Å; D413-A415 PolarHBondContact O-N 3.04Å; D413-K416 PolarHBondContact O-N 3.46Å; D413-K416 IonicContact OD1-NZ 3.95Å; D413-E417 PolarHBondContact O-N 2.98Å
414	L	82.1	Confident	80.1	Confident	62 Å²	62	75.2 Å²	75.2	33%	0.325	36%	0.36	S	S	.	.	H	α-helix	trans	-63.7	-41.5	174.6	-65.4	176.1	0	0	0	110.7	Y406 K411 F412 K416 E417 Y418	Y406-L414 HydrophobicContact CD1-CB 4.11Å; Y406-L414 HydrophobicContact CD1-CD1 4.01Å; Y406-L414 HydrophobicContact CD2-CB 4.02Å; Y406-L414 HydrophobicContact CE1-CB 4.39Å; Y406-L414 HydrophobicContact CE1-CD1 3.74Å; Y406-L414 HydrophobicContact CE2-CB 4.28Å; Y406-L414 HydrophobicContact CG-CB 3.94Å; K411-L414 HydrophobicContact CB-CD1 4.32Å; K411-L414 HydrophobicContact CD-CD1 4.02Å; K411-L414 PolarHBondContact O-N 2.82Å; F412-L414 PolarHBondContact O-N 2.92Å; L414-K416 VanDerWaalsContact C-N 3.31Å; L414-K416 PolarHBondContact O-N 3.25Å; L414-E417 WeakPolarHBondContact O-CB 3.42Å; L414-E417 PolarHBondContact O-N 2.97Å; L414-Y418 WeakPolarHBondContact O-CD2 3.17Å; L414-Y418 PolarHBondContact O-N 2.91Å
415	A	82.9	Confident	80	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-58.7	-41.8	176.9	0	0	0	0	0	112.1	W403 M407 K411 F412 D413 E417 Y418 C419 V429	W403-A415 HydrophobicContact CB-CB 4.47Å; M407-A415 HydrophobicContact CB-CB 4.33Å; K411-A415 PolarHBondContact O-N 2.83Å; F412-A415 WeakPolarHBondContact O-CB 3.35Å; F412-A415 PolarHBondContact O-N 2.63Å; F412-A415 VanDerWaalsContact O-N 3.16Å; D413-A415 VanDerWaalsContact C-N 3.34Å; D413-A415 PolarHBondContact O-N 3.04Å; A415-E417 VanDerWaalsContact C-N 3.33Å; A415-E417 PolarHBondContact O-N 2.77Å; A415-Y418 PolarHBondContact O-N 2.85Å; A415-C419 PolarHBondContact O-N 3.31Å; A415-C419 VanDerWaalsContact O-N 3.13Å; A415-C419 PolarHBondContact O-SG 3.29Å; A415-C419 VanDerWaalsContact O-SG 3.33Å; A415-V429 HydrophobicContact CB-CG1 3.86Å; A415-V429 HydrophobicContact CB-CG2 3.99Å
416	K	82.2	Confident	80	Confident	43 Å²	43	73.4 Å²	73.4	19%	0.187	35%	0.353	C	S	.	.	H	α-helix	trans	-62.6	-36.3	176.8	-67.8	168.7	-169.7	163.8	0	112.6	F412 D413 L414 Y418 C419 M426 V429 E433	F412-K416 VanDerWaalsContact O-CG 3.32Å; F412-K416 WeakPolarHBondContact O-CG 3.33Å; F412-K416 PolarHBondContact O-N 3.36Å; D413-K416 PolarHBondContact O-N 3.46Å; D413-K416 IonicContact OD1-NZ 3.95Å; L414-K416 VanDerWaalsContact C-N 3.31Å; L414-K416 PolarHBondContact O-N 3.25Å; K416-Y418 VanDerWaalsContact C-N 3.31Å; K416-Y418 PolarHBondContact O-N 3.16Å; K416-C419 PolarHBondContact O-N 2.92Å; K416-M426 HydrophobicContact CB-CE 3.98Å; K416-M426 HydrophobicContact CB-SD 3.98Å; K416-M426 HydrophobicContact CD-CE 4.05Å; K416-M426 HydrophobicContact CG-CE 3.68Å; K416-M426 HydrophobicContact CG-SD 3.87Å; K416-V429 HydrophobicContact CG-CG1 3.98Å; K416-E433 WeakPolarHBondContact CE-OE2 3.44Å; K416-E433 IonicContact NZ-OE1 3.85Å; K416-E433 PolarHBondContact NZ-OE1 3.44Å; K416-E433 IonicContact NZ-OE2 2.63Å; K416-E433 PolarHBondContact NZ-OE2 3.15Å
417	E	82.8	Confident	80.1	Confident	103 Å²	103	73.8 Å²	73.8	48%	0.481	36%	0.357	S	S	.	.	H	α-helix	trans	-62.6	-39.2	176.8	-67.4	-172.7	157.7	0	0	112.4	D413 L414 A415 R420	D413-E417 PolarHBondContact O-N 2.98Å; L414-E417 WeakPolarHBondContact O-CB 3.42Å; L414-E417 PolarHBondContact O-N 2.97Å; A415-E417 VanDerWaalsContact C-N 3.33Å; A415-E417 PolarHBondContact O-N 2.77Å; E417-R420 WeakPolarHBondContact O-CG 3.43Å
418	Y	77.9	Confident	80.1	Confident	80 Å²	80	78.1 Å²	78.1	31%	0.314	38%	0.378	S	S	.	.	H	α-helix	trans	-81.3	-12.6	178	-67.7	-76.1	0	0	0	113.7	F337 V402 Y406 L414 A415 K416	F337-Y418 AromaticContact CZ-CE1 3.93Å; F337-Y418 HydrophobicContact CZ-CE1 3.93Å; F337-Y418 AromaticContact CZ-CZ 3.94Å; V402-Y418 HydrophobicContact CG1-CD2 4.1Å; V402-Y418 HydrophobicContact CG1-CE2 4.22Å; V402-Y418 HydrophobicContact CG1-CG 4.3Å; Y406-Y418 AromaticContact CD2-CD2 3.85Å; Y406-Y418 HydrophobicContact CD2-CD2 3.85Å; Y406-Y418 AromaticContact CD2-CE2 4Å; Y406-Y418 HydrophobicContact CD2-CE2 4Å; Y406-Y418 AromaticContact CE2-CD2 3.76Å; Y406-Y418 HydrophobicContact CE2-CD2 3.76Å; Y406-Y418 AromaticContact CE2-CE2 3.42Å; Y406-Y418 HydrophobicContact CE2-CE2 3.42Å; Y406-Y418 VanDerWaalsContact CE2-CE2 3.42Å; L414-Y418 WeakPolarHBondContact O-CD2 3.17Å; L414-Y418 PolarHBondContact O-N 2.91Å; A415-Y418 PolarHBondContact O-N 2.85Å; K416-Y418 VanDerWaalsContact C-N 3.31Å; K416-Y418 PolarHBondContact O-N 3.16Å
419	C	75.9	Confident	80.3	Confident	2 Å²	2	73 Å²	73	1%	0.014	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-1.3	177.4	-73.6	0	0	0	0	114.9	W403 A415 K416 D421 R422 C425 M426	W403-C419 WeakPolarHBondContact CB-SG 3.34Å; W403-C419 VanDerWaalsContact CD2-SG 3.57Å; A415-C419 PolarHBondContact O-N 3.31Å; A415-C419 VanDerWaalsContact O-N 3.13Å; A415-C419 PolarHBondContact O-SG 3.29Å; A415-C419 VanDerWaalsContact O-SG 3.33Å; K416-C419 PolarHBondContact O-N 2.92Å; C419-D421 PolarHBondContact O-N 3.37Å; C419-R422 CarbonylContact O-C 3.59Å; C419-R422 PolarHBondContact O-N 3.17Å; C419-R422 VanDerWaalsContact O-O 3.07Å; C419-C425 HydrophobicContact CB-CB 4.24Å; C419-C425 VanDerWaalsContact SG-CB 3.57Å; C419-M426 HydrophobicContact CB-CB 4.15Å; C419-M426 HydrophobicContact CB-SD 4.13Å
420	R	71.4	Confident	80.5	Confident	191 Å²	191	70.5 Å²	70.5	72%	0.721	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-31.2	-171.7	-69.8	-178	-176.4	178.3	6.4	114.3	E417	E417-R420 WeakPolarHBondContact O-CG 3.43Å
421	D	72.3	Confident	80.6	Confident	156 Å²	156	67.8 Å²	67.8	83%	0.834	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-12.2	-177.6	-59.3	-30.5	0	0	0	113.4	C419	C419-D421 PolarHBondContact O-N 3.37Å
422	R	75.9	Confident	80.8	Confident	86 Å²	86	66.2 Å²	66.2	33%	0.325	32%	0.32	S	S	.	.			trans	-131.8	102.3	-175.5	-71.2	-172.7	174.3	-169.8	-6.8	111.2	E44 C419 E424 C425 M426	E44-R422 IonicContact OE2-CZ 3.02Å; E44-R422 IonicContact OE2-NH1 3.83Å; E44-R422 PolarHBondContact OE2-NH1 3.18Å; E44-R422 VanDerWaalsContact OE2-NH1 3.14Å; E44-R422 IonicContact OE2-NH2 3.57Å; C419-R422 CarbonylContact O-C 3.59Å; C419-R422 PolarHBondContact O-N 3.17Å; C419-R422 VanDerWaalsContact O-O 3.07Å; R422-E424 VanDerWaalsContact C-N 3.25Å; R422-E424 PolarHBondContact O-N 3.48Å; R422-C425 HydrophobicContact CB-CB 4.03Å; R422-C425 PolarHBondContact O-N 2.82Å; R422-M426 PolarHBondContact O-N 3.24Å; R422-M426 VanDerWaalsContact O-N 3.16Å
423	P	74.6	Confident	81	Confident	105 Å²	105	66.7 Å²	66.7	68%	0.682	32%	0.322	S	S	*	.	H	α-helix	trans	-63.2	-30.2	-177.8	25	-33.2	0	0	0	113	M426 D427	P423-M426 WeakPolarHBondContact O-CB 3.07Å; P423-M426 PolarHBondContact O-N 3.29Å; P423-D427 PolarHBondContact O-N 3.46Å
424	E	76.4	Confident	81.2	Confident	118 Å²	118	61.2 Å²	61.2	55%	0.551	29%	0.293	S	S	*	.	H	α-helix	trans	-63.6	-44.4	176	-62.2	168.4	-167.6	0	0	112	R422 M426 D427 M428	R422-E424 VanDerWaalsContact C-N 3.25Å; R422-E424 PolarHBondContact O-N 3.48Å; E424-M426 VanDerWaalsContact C-N 3.3Å; E424-M426 PolarHBondContact O-N 3.18Å; E424-D427 PolarHBondContact O-N 3.16Å; E424-M428 PolarHBondContact O-N 2.93Å
425	C	79.6	Confident	81.4	Confident	12 Å²	12	60.7 Å²	60.7	8%	0.081	29%	0.289	C	S	.	.	H	α-helix	trans	-66.8	-35.8	176.6	-56.1	0	0	0	0	111	W403 C419 R422 M428 V429	W403-C425 HydrophobicContact CD2-CB 4.01Å; W403-C425 HydrophobicContact CE3-CB 4.29Å; W403-C425 HydrophobicContact CH2-CB 3.94Å; W403-C425 HydrophobicContact CZ2-CB 3.66Å; W403-C425 WeakPolarHBondContact CZ2-SG 3.16Å; W403-C425 HydrophobicContact CZ3-CB 4.24Å; C419-C425 HydrophobicContact CB-CB 4.24Å; C419-C425 VanDerWaalsContact SG-CB 3.57Å; R422-C425 HydrophobicContact CB-CB 4.03Å; R422-C425 PolarHBondContact O-N 2.82Å; C425-M428 PolarHBondContact O-N 3.21Å; C425-V429 WeakPolarHBondContact O-CG2 3.26Å; C425-V429 PolarHBondContact O-N 2.89Å; C425-V429 VanDerWaalsContact O-N 3.11Å
426	M	81.2	Confident	81.7	Confident	56 Å²	56	65.1 Å²	65.1	28%	0.276	31%	0.306	S	S	.	.	H	α-helix	trans	-63.5	-42.9	175.4	-172.2	69.2	178.5	0	0	111.7	K416 C419 R422 P423 E424 M428 V429 L430	K416-M426 HydrophobicContact CB-CE 3.98Å; K416-M426 HydrophobicContact CB-SD 3.98Å; K416-M426 HydrophobicContact CD-CE 4.05Å; K416-M426 HydrophobicContact CG-CE 3.68Å; K416-M426 HydrophobicContact CG-SD 3.87Å; C419-M426 HydrophobicContact CB-CB 4.15Å; C419-M426 HydrophobicContact CB-SD 4.13Å; R422-M426 PolarHBondContact O-N 3.24Å; R422-M426 VanDerWaalsContact O-N 3.16Å; P423-M426 WeakPolarHBondContact O-CB 3.07Å; P423-M426 PolarHBondContact O-N 3.29Å; E424-M426 VanDerWaalsContact C-N 3.3Å; E424-M426 PolarHBondContact O-N 3.18Å; M426-M428 PolarHBondContact O-N 3.01Å; M426-V429 PolarHBondContact O-N 2.98Å; M426-L430 HydrophobicContact CE-CD1 4.17Å; M426-L430 HydrophobicContact CE-CD2 4.4Å; M426-L430 HydrophobicContact CE-CG 4.31Å; M426-L430 HydrophobicContact CG-CD1 4.1Å; M426-L430 WeakPolarHBondContact O-CG 3.19Å; M426-L430 PolarHBondContact O-N 2.95Å
427	D	83	Confident	82	Confident	31 Å²	31	63.6 Å²	63.6	17%	0.166	30%	0.301	C	S	.	.	H	α-helix	trans	-59.7	-46	176.9	-172.2	58.7	0	0	0	111.7	P423 E424 V429 L430 A431 T453 Q454	P423-D427 PolarHBondContact O-N 3.46Å; E424-D427 PolarHBondContact O-N 3.16Å; D427-V429 PolarHBondContact O-N 3.27Å; D427-L430 PolarHBondContact O-N 3.46Å; D427-A431 WeakPolarHBondContact O-CB 3.21Å; D427-A431 PolarHBondContact O-N 3.34Å; D427-T453 WeakPolarHBondContact OD1-CA 3.33Å; D427-T453 VanDerWaalsContact OD1-CB 3.29Å; D427-T453 WeakPolarHBondContact OD1-CB 3.42Å; D427-Q454 PolarHBondContact OD1-N 3.39Å
428	M	84.1	Confident	82.3	Confident	105 Å²	105	60.4 Å²	60.4	52%	0.517	29%	0.286	S	S	.	.	H	α-helix	trans	-60.7	-42.7	175.9	-68.2	-179.7	66.4	0	0	112.6	W403 M407 E424 C425 M426 A431 K432	W403-M428 HydrophobicContact CH2-CB 4.29Å; W403-M428 HydrophobicContact CH2-CE 4.13Å; W403-M428 HydrophobicContact CH2-SD 3.82Å; W403-M428 HydrophobicContact CZ3-CB 4.06Å; W403-M428 HydrophobicContact CZ3-SD 4.49Å; M407-M428 HydrophobicContact CE-CB 3.88Å; M407-M428 VanDerWaalsContact CE-O 3.3Å; M407-M428 WeakPolarHBondContact CE-O 3.47Å; E424-M428 PolarHBondContact O-N 2.93Å; C425-M428 PolarHBondContact O-N 3.21Å; M426-M428 PolarHBondContact O-N 3.01Å; M428-A431 PolarHBondContact O-N 3.19Å; M428-K432 PolarHBondContact O-N 3.07Å; M428-K432 VanDerWaalsContact O-N 3.09Å
429	V	86.4	Confident	82.8	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.5	-47.8	177	173.8	0	0	0	0	110.7	W403 M407 F412 A415 K416 C425 M426 D427 A431 K432 E433	W403-V429 HydrophobicContact CE3-CG2 3.54Å; W403-V429 HydrophobicContact CZ3-CG2 4.02Å; M407-V429 HydrophobicContact CB-CG2 4.5Å; M407-V429 VanDerWaalsContact CE-CA 3.45Å; M407-V429 HydrophobicContact CE-CB 4.23Å; M407-V429 HydrophobicContact CE-CG2 3.75Å; M407-V429 HydrophobicContact CG-CG2 4.5Å; F412-V429 HydrophobicContact CD1-CG1 4.26Å; A415-V429 HydrophobicContact CB-CG1 3.86Å; A415-V429 HydrophobicContact CB-CG2 3.99Å; K416-V429 HydrophobicContact CG-CG1 3.98Å; C425-V429 WeakPolarHBondContact O-CG2 3.26Å; C425-V429 PolarHBondContact O-N 2.89Å; C425-V429 VanDerWaalsContact O-N 3.11Å; M426-V429 PolarHBondContact O-N 2.98Å; D427-V429 PolarHBondContact O-N 3.27Å; V429-A431 PolarHBondContact O-N 3.31Å; V429-K432 PolarHBondContact O-N 2.72Å; V429-E433 WeakPolarHBondContact O-CB 3.27Å; V429-E433 PolarHBondContact O-N 2.76Å
430	L	85.9	Confident	83.4	Confident	15 Å²	15	66.3 Å²	66.3	8%	0.079	32%	0.318	C	S	.	.	H	α-helix	trans	-64	-39.5	179.1	-71.9	170.2	0	0	0	112	M426 D427 E433 A434 L452 T453	M426-L430 HydrophobicContact CE-CD1 4.17Å; M426-L430 HydrophobicContact CE-CD2 4.4Å; M426-L430 HydrophobicContact CE-CG 4.31Å; M426-L430 HydrophobicContact CG-CD1 4.1Å; M426-L430 WeakPolarHBondContact O-CG 3.19Å; M426-L430 PolarHBondContact O-N 2.95Å; D427-L430 PolarHBondContact O-N 3.46Å; L430-E433 PolarHBondContact O-N 3.33Å; L430-A434 WeakPolarHBondContact O-CB 3.29Å; L430-A434 PolarHBondContact O-N 3.1Å; L430-L452 HydrophobicContact CD1-CB 4.01Å; L430-T453 HydrophobicContact CB-CG2 3.68Å
431	A	86.8	Confident	84.2	Confident	17 Å²	17	64.9 Å²	64.9	14%	0.14	32%	0.317	C	S	.	.	H	α-helix	trans	-61.9	-44.7	176.3	0	0	0	0	0	111.8	D427 M428 V429 A434 E435 T453 N455	D427-A431 WeakPolarHBondContact O-CB 3.21Å; D427-A431 PolarHBondContact O-N 3.34Å; M428-A431 PolarHBondContact O-N 3.19Å; V429-A431 PolarHBondContact O-N 3.31Å; A431-A434 PolarHBondContact O-N 3.35Å; A431-E435 WeakPolarHBondContact O-CB 3.38Å; A431-E435 PolarHBondContact O-N 3.31Å; A431-T453 HydrophobicContact CB-CG2 4.2Å; A431-N455 WeakPolarHBondContact CB-ND2 2.94Å
432	K	87.1	Confident	85	Confident	79 Å²	79	64.5 Å²	64.5	34%	0.343	30%	0.304	S	S	.	.	H	α-helix	trans	-73.4	-35.5	179.2	-165.5	170.5	174.7	179	0	112.9	M407 N408 F412 M428 V429 A434 E435 Y436	M407-K432 HydrophobicContact CE-CB 4.35Å; M407-K432 HydrophobicContact CG-CB 4.24Å; M407-K432 HydrophobicContact CG-CD 3.68Å; M407-K432 HydrophobicContact CG-CG 4.41Å; M407-K432 HydrophobicContact SD-CB 4.25Å; M407-K432 HydrophobicContact SD-CD 3.44Å; M407-K432 WeakPolarHBondContact SD-CD 3.21Å; M407-K432 HydrophobicContact SD-CG 4.47Å; N408-K432 PolarHBondContact OD1-NZ 2.98Å; F412-K432 HydrophobicContact CE1-CB 4.32Å; F412-K432 HydrophobicContact CE1-CG 4.31Å; M428-K432 PolarHBondContact O-N 3.07Å; M428-K432 VanDerWaalsContact O-N 3.09Å; V429-K432 PolarHBondContact O-N 2.72Å; K432-A434 VanDerWaalsContact C-N 3.33Å; K432-E435 PolarHBondContact O-N 2.87Å; K432-Y436 WeakPolarHBondContact O-CB 3.15Å; K432-Y436 PolarHBondContact O-N 2.88Å
433	E	89.1	Confident	85.5	Confident	24 Å²	24	62.9 Å²	62.9	11%	0.112	30%	0.298	C	S	.	.	H	α-helix	trans	-61.3	-44.6	170.9	-177.8	179.7	-165.2	0	0	110.9	F412 K416 V429 L430 E435 Y436 C437	F412-E433 HydrophobicContact CB-CB 4.19Å; F412-E433 HydrophobicContact CB-CG 4.01Å; F412-E433 HydrophobicContact CD1-CB 3.66Å; F412-E433 HydrophobicContact CD1-CG 4.27Å; F412-E433 HydrophobicContact CD2-CB 4.08Å; F412-E433 HydrophobicContact CD2-CG 3.86Å; F412-E433 HydrophobicContact CE1-CB 4.01Å; F412-E433 HydrophobicContact CE2-CB 4.4Å; F412-E433 HydrophobicContact CE2-CG 4.42Å; F412-E433 HydrophobicContact CG-CB 3.7Å; F412-E433 HydrophobicContact CG-CG 3.78Å; F412-E433 HydrophobicContact CZ-CB 4.37Å; K416-E433 WeakPolarHBondContact CE-OE2 3.44Å; K416-E433 IonicContact NZ-OE1 3.85Å; K416-E433 PolarHBondContact NZ-OE1 3.44Å; K416-E433 IonicContact NZ-OE2 2.63Å; K416-E433 PolarHBondContact NZ-OE2 3.15Å; V429-E433 WeakPolarHBondContact O-CB 3.27Å; V429-E433 PolarHBondContact O-N 2.76Å; L430-E433 PolarHBondContact O-N 3.33Å; E433-E435 PolarHBondContact O-N 3.45Å; E433-Y436 PolarHBondContact O-N 2.98Å; E433-C437 WeakPolarHBondContact O-CB 3.49Å; E433-C437 PolarHBondContact O-N 2.85Å; E433-C437 PolarHBondContact O-SG 3.45Å
434	A	87	Confident	86.1	Confident	0 Å²	0	62 Å²	62	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.7	-43.2	178.2	0	0	0	0	0	111.9	L430 A431 K432 C437 F438 S446 C449 Y450	L430-A434 WeakPolarHBondContact O-CB 3.29Å; L430-A434 PolarHBondContact O-N 3.1Å; A431-A434 PolarHBondContact O-N 3.35Å; K432-A434 VanDerWaalsContact C-N 3.33Å; A434-C437 PolarHBondContact O-N 3.15Å; A434-F438 WeakPolarHBondContact O-CB 3.32Å; A434-F438 PolarHBondContact O-N 3.29Å; A434-S446 WeakPolarHBondContact O-CB 3.44Å; A434-S446 PolarHBondContact O-OG 3.25Å; A434-C449 HydrophobicContact CB-CB 3.66Å; A434-Y450 HydrophobicContact CB-CD1 3.54Å; A434-Y450 HydrophobicContact CB-CD2 3.58Å; A434-Y450 HydrophobicContact CB-CE1 3.57Å; A434-Y450 HydrophobicContact CB-CE2 3.63Å; A434-Y450 HydrophobicContact CB-CG 3.53Å
435	E	87.4	Confident	86.5	Confident	52 Å²	52	60.8 Å²	60.8	24%	0.243	28%	0.282	C	S	.	.	H	α-helix	trans	-65	-41.1	175	-175.4	59.4	-139.6	0	0	111.7	A431 K432 E433 F438 Q439 Y450 K463	A431-E435 WeakPolarHBondContact O-CB 3.38Å; A431-E435 PolarHBondContact O-N 3.31Å; K432-E435 PolarHBondContact O-N 2.87Å; E433-E435 PolarHBondContact O-N 3.45Å; E435-F438 WeakPolarHBondContact O-CB 3.45Å; E435-F438 PolarHBondContact O-N 3.48Å; E435-Q439 WeakPolarHBondContact O-CG 3.4Å; E435-Q439 PolarHBondContact O-N 3.07Å; E435-Q439 PolarHBondContact OE1-NE2 3.35Å; E435-Y450 WeakPolarHBondContact CA-OH 2.87Å; E435-Y450 PolarHBondContact N-OH 3.43Å; E435-Y450 PolarHBondContact OE2-OH 3.39Å; E435-K463 IonicContact OE2-NZ 3Å; E435-K463 PolarHBondContact OE2-NZ 3.41Å
436	Y	89.6	Confident	86.9	Confident	92 Å²	92	60.2 Å²	60.2	36%	0.361	28%	0.278	S	S	.	.	H	α-helix	trans	-62.1	-44.1	174.3	178.8	-99.7	0	0	0	112.1	N410 F412 K432 E433 F438 Q439 N440	N410-Y436 HydrophobicContact CB-CE2 4.31Å; F412-Y436 AromaticContact CE2-CD1 3.69Å; F412-Y436 HydrophobicContact CE2-CD1 3.69Å; F412-Y436 HydrophobicContact CE2-CE1 4.32Å; F412-Y436 AromaticContact CE2-CG 3.86Å; F412-Y436 HydrophobicContact CE2-CG 3.86Å; F412-Y436 HydrophobicContact CZ-CD1 4.39Å; F412-Y436 HydrophobicContact CZ-CG 4.1Å; K432-Y436 WeakPolarHBondContact O-CB 3.15Å; K432-Y436 PolarHBondContact O-N 2.88Å; E433-Y436 PolarHBondContact O-N 2.98Å; Y436-F438 VanDerWaalsContact C-N 3.31Å; Y436-F438 PolarHBondContact O-N 3.25Å; Y436-Q439 PolarHBondContact O-N 3.38Å; Y436-N440 WeakPolarHBondContact CD1-ND2 3.31Å; Y436-N440 WeakPolarHBondContact CE1-ND2 3.5Å; Y436-N440 VanDerWaalsContact CE2-ND2 3.35Å; Y436-N440 WeakPolarHBondContact CE2-ND2 2.78Å; Y436-N440 WeakPolarHBondContact O-CB 3.26Å; Y436-N440 PolarHBondContact O-N 3.47Å; Y436-N440 VanDerWaalsContact O-N 3.11Å; Y436-N440 PolarHBondContact O-ND2 3.47Å
437	C	87.4	Confident	87.2	Confident	12 Å²	12	57.5 Å²	57.5	8%	0.081	27%	0.265	C	S	.	.	H	α-helix	trans	-64.5	-36.8	174.6	-73.3	0	0	0	0	111.7	E433 A434 N440 K441 R442 E445	E433-C437 WeakPolarHBondContact O-CB 3.49Å; E433-C437 PolarHBondContact O-N 2.85Å; E433-C437 PolarHBondContact O-SG 3.45Å; A434-C437 PolarHBondContact O-N 3.15Å; C437-N440 CarbonylContact O-C 3.53Å; C437-N440 PolarHBondContact O-N 3.31Å; C437-K441 PolarHBondContact O-N 3.33Å; C437-R442 HydrophobicContact CB-CB 4.31Å; C437-R442 WeakPolarHBondContact O-CA 3.43Å; C437-R442 PolarHBondContact O-N 3.15Å; C437-E445 HydrophobicContact CB-CB 4.46Å
438	F	88.6	Confident	87.3	Confident	36 Å²	36	60 Å²	60	16%	0.158	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-49.5	176.7	-166.9	-89.6	0	0	0	111.5	A434 E435 Y436 N440 K441 Y443 K463 F464 A467	A434-F438 WeakPolarHBondContact O-CB 3.32Å; A434-F438 PolarHBondContact O-N 3.29Å; E435-F438 WeakPolarHBondContact O-CB 3.45Å; E435-F438 PolarHBondContact O-N 3.48Å; Y436-F438 VanDerWaalsContact C-N 3.31Å; Y436-F438 PolarHBondContact O-N 3.25Å; F438-N440 PolarHBondContact O-N 3.46Å; F438-K441 PolarHBondContact O-N 2.86Å; F438-Y443 HydrophobicContact CD1-CE1 4.47Å; F438-Y443 AromaticContact CD2-CD1 3.77Å; F438-Y443 HydrophobicContact CD2-CD1 3.77Å; F438-Y443 HydrophobicContact CD2-CE1 4.02Å; F438-Y443 HydrophobicContact CE1-CE1 4.34Å; F438-Y443 AromaticContact CE2-CD1 3.81Å; F438-Y443 HydrophobicContact CE2-CD1 3.81Å; F438-Y443 AromaticContact CE2-CE1 3.89Å; F438-Y443 HydrophobicContact CE2-CE1 3.89Å; F438-Y443 HydrophobicContact CG-CD1 4.38Å; F438-Y443 HydrophobicContact CG-CE1 4.31Å; F438-Y443 HydrophobicContact CZ-CD1 4.44Å; F438-Y443 HydrophobicContact CZ-CE1 4.05Å; F438-K463 HydrophobicContact CE2-CB 4.27Å; F438-K463 HydrophobicContact CZ-CB 4.14Å; F438-F464 HydrophobicContact CD2-CD1 4.47Å; F438-F464 AromaticContact CD2-CE1 3.94Å; F438-F464 HydrophobicContact CD2-CE1 3.94Å; F438-F464 HydrophobicContact CD2-CZ 4.31Å; F438-F464 AromaticContact CE2-CD1 3.95Å; F438-F464 HydrophobicContact CE2-CD1 3.95Å; F438-F464 AromaticContact CE2-CE1 3.88Å; F438-F464 HydrophobicContact CE2-CE1 3.88Å; F438-F464 HydrophobicContact CE2-CZ 4.48Å; F438-A467 HydrophobicContact CZ-CB 4.05Å
439	Q	89.1	Confident	87.3	Confident	130 Å²	130	55.8 Å²	55.8	61%	0.607	26%	0.255	S	S	*	.	H	α-helix	trans	-61.2	-34	177.5	-70.3	175.2	12.9	0	0	112.4	E435 Y436 K441	E435-Q439 WeakPolarHBondContact O-CG 3.4Å; E435-Q439 PolarHBondContact O-N 3.07Å; E435-Q439 PolarHBondContact OE1-NE2 3.35Å; Y436-Q439 PolarHBondContact O-N 3.38Å; Q439-K441 PolarHBondContact O-N 3.22Å
440	N	89	Confident	87.3	Confident	76 Å²	76	56 Å²	56	41%	0.406	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	11.1	175.9	-69.9	-43	0	0	0	114.2	Y436 C437 F438 R442	Y436-N440 WeakPolarHBondContact CD1-ND2 3.31Å; Y436-N440 WeakPolarHBondContact CE1-ND2 3.5Å; Y436-N440 VanDerWaalsContact CE2-ND2 3.35Å; Y436-N440 WeakPolarHBondContact CE2-ND2 2.78Å; Y436-N440 WeakPolarHBondContact O-CB 3.26Å; Y436-N440 PolarHBondContact O-N 3.47Å; Y436-N440 VanDerWaalsContact O-N 3.11Å; Y436-N440 PolarHBondContact O-ND2 3.47Å; C437-N440 CarbonylContact O-C 3.53Å; C437-N440 PolarHBondContact O-N 3.31Å; F438-N440 PolarHBondContact O-N 3.46Å; N440-R442 PolarHBondContact O-N 2.91Å
441	K	87.5	Confident	87.2	Confident	160 Å²	160	55.5 Å²	55.5	70%	0.696	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	18.8	-179	-54.4	-179.7	177.8	-179.8	0	114.9	C437 F438 Q439 Y443	C437-K441 PolarHBondContact O-N 3.33Å; F438-K441 PolarHBondContact O-N 2.86Å; Q439-K441 PolarHBondContact O-N 3.22Å; K441-Y443 VanDerWaalsContact C-N 3.33Å; K441-Y443 HydrophobicContact CB-CE2 4Å; K441-Y443 WeakPolarHBondContact O-CD2 3.34Å; K441-Y443 PolarHBondContact O-N 3.47Å
442	R	88.8	Confident	86.9	Confident	148 Å²	148	59.1 Å²	59.1	56%	0.558	27%	0.27	S	S	*	.			trans	-91.9	68.3	173.8	-60.9	-170.7	-172.8	179.8	0.3	109.9	C437 N440 L444 E445 S446	C437-R442 HydrophobicContact CB-CB 4.31Å; C437-R442 WeakPolarHBondContact O-CA 3.43Å; C437-R442 PolarHBondContact O-N 3.15Å; N440-R442 PolarHBondContact O-N 2.91Å; R442-L444 PolarHBondContact O-N 3.2Å; R442-E445 HydrophobicContact CB-CB 4.44Å; R442-E445 WeakPolarHBondContact CD-OE2 3.47Å; R442-E445 IonicContact NH1-OE2 3.25Å; R442-E445 PolarHBondContact O-N 3.17Å; R442-S446 WeakPolarHBondContact O-CB 3.42Å; R442-S446 PolarHBondContact O-N 3.16Å
443	Y	87.5	Confident	86.7	Confident	52 Å²	52	55.8 Å²	55.8	20%	0.204	26%	0.256	C	S	.	.	H	α-helix	trans	-65.1	-34.7	-170.1	-58.1	-67.9	0	0	0	113.8	F438 K441 S446 A447 F464 A467 Q469	F438-Y443 HydrophobicContact CD1-CE1 4.47Å; F438-Y443 AromaticContact CD2-CD1 3.77Å; F438-Y443 HydrophobicContact CD2-CD1 3.77Å; F438-Y443 HydrophobicContact CD2-CE1 4.02Å; F438-Y443 HydrophobicContact CE1-CE1 4.34Å; F438-Y443 AromaticContact CE2-CD1 3.81Å; F438-Y443 HydrophobicContact CE2-CD1 3.81Å; F438-Y443 AromaticContact CE2-CE1 3.89Å; F438-Y443 HydrophobicContact CE2-CE1 3.89Å; F438-Y443 HydrophobicContact CG-CD1 4.38Å; F438-Y443 HydrophobicContact CG-CE1 4.31Å; F438-Y443 HydrophobicContact CZ-CD1 4.44Å; F438-Y443 HydrophobicContact CZ-CE1 4.05Å; K441-Y443 VanDerWaalsContact C-N 3.33Å; K441-Y443 HydrophobicContact CB-CE2 4Å; K441-Y443 WeakPolarHBondContact O-CD2 3.34Å; K441-Y443 PolarHBondContact O-N 3.47Å; Y443-S446 WeakPolarHBondContact O-CB 3.33Å; Y443-S446 PolarHBondContact O-N 2.9Å; Y443-A447 WeakPolarHBondContact O-CB 3.47Å; Y443-A447 PolarHBondContact O-N 2.84Å; Y443-F464 HydrophobicContact CD1-CE1 4.41Å; Y443-A467 HydrophobicContact CE1-CB 4.38Å; Y443-Q469 HydrophobicContact CD1-CG 4.31Å; Y443-Q469 HydrophobicContact CD2-CG 3.61Å; Y443-Q469 HydrophobicContact CE2-CG 3.85Å; Y443-Q469 HydrophobicContact CG-CB 4.46Å; Y443-Q469 HydrophobicContact CG-CG 3.85Å
444	L	86.1	Confident	86	Confident	86 Å²	86	63.1 Å²	63.1	45%	0.45	29%	0.291	S	S	.	.	H	α-helix	trans	-66.5	-44.1	177.8	-68.5	172.6	0	0	0	112.6	R442 S446 A447 K448 E475	R442-L444 PolarHBondContact O-N 3.2Å; L444-S446 VanDerWaalsContact C-N 3.33Å; L444-A447 PolarHBondContact O-N 3.12Å; L444-K448 VanDerWaalsContact O-CG 3.3Å; L444-K448 WeakPolarHBondContact O-CG 3.47Å; L444-K448 PolarHBondContact O-N 3.31Å; L444-K448 VanDerWaalsContact O-N 3.13Å; L444-E475 HydrophobicContact CD2-CB 4.41Å
445	E	84.8	Confident	85.5	Confident	93 Å²	93	66 Å²	66	44%	0.435	31%	0.306	S	S	.	.	H	α-helix	trans	-66.7	-40.1	176.8	-66.5	178.7	171.3	0	0	110.7	C437 R442 K448 C449	C437-E445 HydrophobicContact CB-CB 4.46Å; R442-E445 HydrophobicContact CB-CB 4.44Å; R442-E445 WeakPolarHBondContact CD-OE2 3.47Å; R442-E445 IonicContact NH1-OE2 3.25Å; R442-E445 PolarHBondContact O-N 3.17Å; E445-K448 PolarHBondContact O-N 3.36Å; E445-C449 PolarHBondContact O-N 3.34Å; E445-C449 VanDerWaalsContact O-N 3.1Å; E445-C449 PolarHBondContact O-SG 3.04Å
446	S	88.7	Confident	85.1	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-59	-48.4	174.3	-179.3	0	0	0	0	111.9	A434 R442 Y443 L444 K448 C449 Y450	A434-S446 WeakPolarHBondContact O-CB 3.44Å; A434-S446 PolarHBondContact O-OG 3.25Å; R442-S446 WeakPolarHBondContact O-CB 3.42Å; R442-S446 PolarHBondContact O-N 3.16Å; Y443-S446 WeakPolarHBondContact O-CB 3.33Å; Y443-S446 PolarHBondContact O-N 2.9Å; L444-S446 VanDerWaalsContact C-N 3.33Å; S446-K448 VanDerWaalsContact C-N 3.3Å; S446-K448 PolarHBondContact O-N 3.38Å; S446-C449 PolarHBondContact O-N 3.46Å; S446-C449 VanDerWaalsContact O-N 3.15Å; S446-Y450 WeakPolarHBondContact O-CB 3.49Å; S446-Y450 WeakPolarHBondContact O-CD2 3.36Å; S446-Y450 PolarHBondContact O-N 2.92Å; S446-Y450 WeakPolarHBondContact OG-CD2 3.3Å; S446-Y450 WeakPolarHBondContact OG-CE2 2.73Å
447	A	86.4	Confident	84.7	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-57.9	-42.3	177	0	0	0	0	0	112.2	Y443 L444 C449 A451 F464 A472 E475 F476	Y443-A447 WeakPolarHBondContact O-CB 3.47Å; Y443-A447 PolarHBondContact O-N 2.84Å; L444-A447 PolarHBondContact O-N 3.12Å; A447-C449 VanDerWaalsContact C-N 3.34Å; A447-C449 PolarHBondContact O-N 2.7Å; A447-A451 WeakPolarHBondContact O-CB 3.39Å; A447-A451 PolarHBondContact O-N 3.13Å; A447-F464 HydrophobicContact CB-CE1 4.36Å; A447-F464 HydrophobicContact CB-CE2 4.29Å; A447-F464 HydrophobicContact CB-CZ 3.81Å; A447-A472 HydrophobicContact CB-CB 4.31Å; A447-A472 WeakPolarHBondContact CB-O 3.45Å; A447-E475 HydrophobicContact CB-CB 4.43Å; A447-F476 HydrophobicContact CB-CB 3.89Å
448	K	86.5	Confident	84.4	Confident	82 Å²	82	73.6 Å²	73.6	36%	0.357	34%	0.337	S	S	.	.	H	α-helix	trans	-63.3	-38.9	177.5	-71	176.7	178.4	174.4	0	112.8	L444 E445 S446 E475 K479	L444-K448 VanDerWaalsContact O-CG 3.3Å; L444-K448 WeakPolarHBondContact O-CG 3.47Å; L444-K448 PolarHBondContact O-N 3.31Å; L444-K448 VanDerWaalsContact O-N 3.13Å; E445-K448 PolarHBondContact O-N 3.36Å; S446-K448 VanDerWaalsContact C-N 3.3Å; S446-K448 PolarHBondContact O-N 3.38Å; K448-E475 WeakPolarHBondContact CE-OE1 3.17Å; K448-E475 HydrophobicContact CG-CG 3.95Å; K448-E475 IonicContact NZ-OE1 3.31Å; K448-K479 HydrophobicContact CB-CD 4.2Å; K448-K479 HydrophobicContact CG-CD 3.98Å
449	C	84.5	Confident	84.2	Confident	17 Å²	17	76.7 Å²	76.7	12%	0.115	35%	0.352	C	S	.	.	H	α-helix	trans	-74.7	-46.5	178.7	-62.3	0	0	0	0	110.7	A434 E445 S446 A447 A451 L452	A434-C449 HydrophobicContact CB-CB 3.66Å; E445-C449 PolarHBondContact O-N 3.34Å; E445-C449 VanDerWaalsContact O-N 3.1Å; E445-C449 PolarHBondContact O-SG 3.04Å; S446-C449 PolarHBondContact O-N 3.46Å; S446-C449 VanDerWaalsContact O-N 3.15Å; A447-C449 VanDerWaalsContact C-N 3.34Å; A447-C449 PolarHBondContact O-N 2.7Å; C449-A451 VanDerWaalsContact C-N 3.26Å; C449-A451 PolarHBondContact O-N 3.16Å; C449-L452 WeakPolarHBondContact O-CB 3.43Å; C449-L452 PolarHBondContact O-N 3.34Å
450	Y	85.6	Confident	84	Confident	5 Å²	5	70.6 Å²	70.6	2%	0.02	32%	0.324	C	S	.	.	H	α-helix	trans	-59	-35.2	176.8	-84.7	-49.7	0	0	0	113.2	A434 E435 S446 L452 T453 I460 F464	A434-Y450 HydrophobicContact CB-CD1 3.54Å; A434-Y450 HydrophobicContact CB-CD2 3.58Å; A434-Y450 HydrophobicContact CB-CE1 3.57Å; A434-Y450 HydrophobicContact CB-CE2 3.63Å; A434-Y450 HydrophobicContact CB-CG 3.53Å; E435-Y450 WeakPolarHBondContact CA-OH 2.87Å; E435-Y450 PolarHBondContact N-OH 3.43Å; E435-Y450 PolarHBondContact OE2-OH 3.39Å; S446-Y450 WeakPolarHBondContact O-CB 3.49Å; S446-Y450 WeakPolarHBondContact O-CD2 3.36Å; S446-Y450 PolarHBondContact O-N 2.92Å; S446-Y450 WeakPolarHBondContact OG-CD2 3.3Å; S446-Y450 WeakPolarHBondContact OG-CE2 2.73Å; Y450-L452 PolarHBondContact O-N 2.78Å; Y450-T453 PolarHBondContact O-N 3.32Å; Y450-T453 PolarHBondContact O-OG1 3.3Å; Y450-I460 HydrophobicContact CD1-CD1 3.59Å; Y450-I460 HydrophobicContact CD1-CG1 3.88Å; Y450-I460 HydrophobicContact CD1-CG2 4.45Å; Y450-I460 HydrophobicContact CD2-CG2 4.01Å; Y450-I460 HydrophobicContact CE1-CD1 4.29Å; Y450-I460 HydrophobicContact CE1-CG1 4.2Å; Y450-I460 HydrophobicContact CG-CD1 4Å; Y450-I460 HydrophobicContact CG-CG1 4.19Å; Y450-I460 HydrophobicContact CG-CG2 3.9Å; Y450-F464 HydrophobicContact CD2-CE2 4.05Å; Y450-F464 HydrophobicContact CD2-CZ 4.04Å
451	A	83.1	Confident	83.8	Confident	4 Å²	4	67.2 Å²	67.2	3%	0.033	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-19.4	178.6	0	0	0	0	0	114	A447 C449 F476 K479 N483	A447-A451 WeakPolarHBondContact O-CB 3.39Å; A447-A451 PolarHBondContact O-N 3.13Å; C449-A451 VanDerWaalsContact C-N 3.26Å; C449-A451 PolarHBondContact O-N 3.16Å; A451-F476 HydrophobicContact CB-CD2 3.91Å; A451-F476 HydrophobicContact CB-CE2 4.36Å; A451-K479 HydrophobicContact CB-CB 3.42Å; A451-K479 VanDerWaalsContact CB-CB 3.42Å; A451-K479 HydrophobicContact CB-CD 4.42Å; A451-N483 PolarHBondContact O-ND2 3.19Å
452	L	81.3	Confident	83.7	Confident	94 Å²	94	64.1 Å²	64.1	49%	0.492	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-8.5	175.9	-63.6	168.6	0	0	0	112.5	L430 C449 Y450	L430-L452 HydrophobicContact CD1-CB 4.01Å; C449-L452 WeakPolarHBondContact O-CB 3.43Å; C449-L452 PolarHBondContact O-N 3.34Å; Y450-L452 PolarHBondContact O-N 2.78Å
453	T	81.9	Confident	83.6	Confident	9 Å²	9	59.5 Å²	59.5	6%	0.055	28%	0.281	C	S	.	.	S	Bend	trans	-90	157.6	-177	65	0	0	0	0	113.5	D427 L430 A431 Y450 N455	D427-T453 WeakPolarHBondContact OD1-CA 3.33Å; D427-T453 VanDerWaalsContact OD1-CB 3.29Å; D427-T453 WeakPolarHBondContact OD1-CB 3.42Å; L430-T453 HydrophobicContact CB-CG2 3.68Å; A431-T453 HydrophobicContact CB-CG2 4.2Å; Y450-T453 PolarHBondContact O-N 3.32Å; Y450-T453 PolarHBondContact O-OG1 3.3Å; T453-N455 VanDerWaalsContact C-N 3.32Å
454	Q	75.7	Confident	83.6	Confident	178 Å²	178	57 Å²	57	83%	0.832	27%	0.271	S	S	*	.			trans	-90	8.8	173.9	-61.2	-168.2	-0.9	0	0	113.7	D427	D427-Q454 PolarHBondContact OD1-N 3.39Å
455	N	75.9	Confident	83.6	Confident	59 Å²	59	56.9 Å²	56.9	32%	0.316	27%	0.27	S	S	.	.	S	Bend	trans	-61.1	155.8	176.5	-74.2	-17.3	0	0	0	112.6	A431 T453 F457 I460	A431-N455 WeakPolarHBondContact CB-ND2 2.94Å; T453-N455 VanDerWaalsContact C-N 3.32Å; N455-F457 PolarHBondContact O-N 3.22Å; N455-I460 HydrophobicContact CB-CD1 3.67Å
456	Y	79.3	Confident	83.7	Confident	151 Å²	151	59.8 Å²	59.8	59%	0.592	28%	0.284	S	S	*	.			trans	-53.4	123.6	179.2	-64.1	-71.6	0	0	0	110.5	E458 E459 I460	Y456-E458 VanDerWaalsContact C-N 3.29Å; Y456-E458 PolarHBondContact O-N 3.49Å; Y456-E459 PolarHBondContact O-N 3.13Å; Y456-I460 PolarHBondContact O-N 3.18Å
457	F	80.2	Confident	83.5	Confident	49 Å²	49	61.1 Å²	61.1	22%	0.215	30%	0.295	C	S	.	.	H	α-helix	trans	-62.5	-41.7	-174.6	170	-106.2	0	0	0	111.4	N455 I460 A461 F476 L477 K480 L495 W498	N455-F457 PolarHBondContact O-N 3.22Å; F457-I460 PolarHBondContact O-N 3.02Å; F457-A461 VanDerWaalsContact O-CB 3.26Å; F457-A461 WeakPolarHBondContact O-CB 3.4Å; F457-A461 PolarHBondContact O-N 2.97Å; F457-F476 AromaticContact CD2-CE1 3.67Å; F457-F476 HydrophobicContact CD2-CE1 3.67Å; F457-F476 AromaticContact CD2-CZ 3.9Å; F457-F476 HydrophobicContact CD2-CZ 3.9Å; F457-F476 HydrophobicContact CE2-CD1 4.43Å; F457-F476 AromaticContact CE2-CE1 3.58Å; F457-F476 HydrophobicContact CE2-CE1 3.58Å; F457-F476 HydrophobicContact CE2-CZ 4.24Å; F457-L477 HydrophobicContact CE2-CD2 3.63Å; F457-L477 HydrophobicContact CZ-CD2 3.56Å; F457-K480 HydrophobicContact CD2-CD 3.64Å; F457-K480 HydrophobicContact CE2-CD 4.05Å; F457-L495 HydrophobicContact CE1-CD2 4.28Å; F457-L495 HydrophobicContact CE2-CD2 3.78Å; F457-L495 HydrophobicContact CZ-CD2 3.38Å; F457-W498 HydrophobicContact CE1-CZ3 4.06Å; F457-W498 HydrophobicContact CZ-CE3 4.18Å; F457-W498 AromaticContact CZ-CZ3 3.67Å; F457-W498 HydrophobicContact CZ-CZ3 3.67Å
458	E	81.6	Confident	83.3	Confident	117 Å²	117	69.8 Å²	69.8	55%	0.547	33%	0.332	S	S	.	.	H	α-helix	trans	-64	-43.4	-177.1	-60	76.2	-168.8	0	0	110.8	Y456 I460 A461 L462	Y456-E458 VanDerWaalsContact C-N 3.29Å; Y456-E458 PolarHBondContact O-N 3.49Å; E458-I460 PolarHBondContact O-N 3.02Å; E458-A461 PolarHBondContact O-N 3.3Å; E458-L462 WeakPolarHBondContact O-CB 3.34Å; E458-L462 WeakPolarHBondContact O-CG 3.47Å; E458-L462 PolarHBondContact O-N 3.33Å
459	E	84.9	Confident	83.1	Confident	100 Å²	100	69.3 Å²	69.3	47%	0.467	33%	0.332	S	S	.	.	H	α-helix	trans	-62.3	-46.7	179.4	-169.5	-169.2	151.2	0	0	111.2	Y456 L462 K463	Y456-E459 PolarHBondContact O-N 3.13Å; E459-L462 PolarHBondContact O-N 3.48Å; E459-K463 WeakPolarHBondContact O-CG 3.47Å; E459-K463 PolarHBondContact O-N 3.09Å; E459-K463 IonicContact OE1-NZ 2.63Å
460	I	85	Confident	82.9	Confident	3 Å²	3	72.3 Å²	72.3	2%	0.015	34%	0.344	C	S	.	.	H	α-helix	trans	-67.2	-43.5	179.5	-64.5	163.1	0	0	0	110.9	Y450 N455 Y456 F457 E458 L462 K463 F464 F476	Y450-I460 HydrophobicContact CD1-CD1 3.59Å; Y450-I460 HydrophobicContact CD1-CG1 3.88Å; Y450-I460 HydrophobicContact CD1-CG2 4.45Å; Y450-I460 HydrophobicContact CD2-CG2 4.01Å; Y450-I460 HydrophobicContact CE1-CD1 4.29Å; Y450-I460 HydrophobicContact CE1-CG1 4.2Å; Y450-I460 HydrophobicContact CG-CD1 4Å; Y450-I460 HydrophobicContact CG-CG1 4.19Å; Y450-I460 HydrophobicContact CG-CG2 3.9Å; N455-I460 HydrophobicContact CB-CD1 3.67Å; Y456-I460 PolarHBondContact O-N 3.18Å; F457-I460 PolarHBondContact O-N 3.02Å; E458-I460 PolarHBondContact O-N 3.02Å; I460-L462 VanDerWaalsContact C-N 3.35Å; I460-L462 PolarHBondContact O-N 3.21Å; I460-K463 WeakPolarHBondContact O-CB 3.49Å; I460-K463 PolarHBondContact O-N 3.45Å; I460-F464 HydrophobicContact CG2-CD2 3.83Å; I460-F464 HydrophobicContact CG2-CE2 3.55Å; I460-F464 VanDerWaalsContact O-CD2 3.25Å; I460-F464 WeakPolarHBondContact O-CD2 3.33Å; I460-F464 PolarHBondContact O-N 3.23Å; I460-F476 HydrophobicContact CB-CE1 4.39Å; I460-F476 HydrophobicContact CB-CE2 4.37Å; I460-F476 HydrophobicContact CB-CZ 3.92Å; I460-F476 HydrophobicContact CD1-CE2 4.24Å; I460-F476 HydrophobicContact CD1-CZ 4.21Å; I460-F476 HydrophobicContact CG2-CD1 4.38Å; I460-F476 HydrophobicContact CG2-CD2 4.09Å; I460-F476 HydrophobicContact CG2-CE1 3.97Å; I460-F476 HydrophobicContact CG2-CE2 3.67Å; I460-F476 HydrophobicContact CG2-CG 4.43Å; I460-F476 HydrophobicContact CG2-CZ 3.58Å
461	A	83.9	Confident	82.6	Confident	5 Å²	5	77.2 Å²	77.2	4%	0.041	37%	0.367	C	S	.	.	H	α-helix	trans	-58	-47.6	176.7	0	0	0	0	0	111.4	F457 E458 K463 F464 I465 L473 W498	F457-A461 VanDerWaalsContact O-CB 3.26Å; F457-A461 WeakPolarHBondContact O-CB 3.4Å; F457-A461 PolarHBondContact O-N 2.97Å; E458-A461 PolarHBondContact O-N 3.3Å; A461-K463 PolarHBondContact O-N 2.79Å; A461-F464 PolarHBondContact O-N 2.78Å; A461-I465 VanDerWaalsContact O-CG1 3.25Å; A461-I465 WeakPolarHBondContact O-CG1 3.46Å; A461-I465 PolarHBondContact O-N 3.32Å; A461-L473 HydrophobicContact CB-CD1 4.41Å; A461-W498 HydrophobicContact CB-CH2 3.9Å; A461-W498 HydrophobicContact CB-CZ3 4.26Å
462	L	85.6	Confident	82.7	Confident	95 Å²	95	77.1 Å²	77.1	50%	0.497	37%	0.366	S	S	.	.	H	α-helix	trans	-61.1	-42.9	176.6	-72.7	170	0	0	0	111.8	E458 E459 I460 F464 I465 E466	E458-L462 WeakPolarHBondContact O-CB 3.34Å; E458-L462 WeakPolarHBondContact O-CG 3.47Å; E458-L462 PolarHBondContact O-N 3.33Å; E459-L462 PolarHBondContact O-N 3.48Å; I460-L462 VanDerWaalsContact C-N 3.35Å; I460-L462 PolarHBondContact O-N 3.21Å; L462-F464 VanDerWaalsContact C-N 3.3Å; L462-F464 PolarHBondContact O-N 3.13Å; L462-I465 PolarHBondContact O-N 2.95Å; L462-I465 VanDerWaalsContact O-N 3.14Å; L462-E466 WeakPolarHBondContact O-CB 3.07Å; L462-E466 WeakPolarHBondContact O-CG 3.32Å; L462-E466 PolarHBondContact O-N 3.41Å
463	K	86.6	Confident	82.9	Confident	51 Å²	51	72.9 Å²	72.9	22%	0.222	34%	0.344	C	S	.	.	H	α-helix	trans	-54.8	-42.9	175.2	-77.5	-178.9	178.9	-176.3	0	112.6	E435 F438 E459 I460 A461 A467	E435-K463 IonicContact OE2-NZ 3Å; E435-K463 PolarHBondContact OE2-NZ 3.41Å; F438-K463 HydrophobicContact CE2-CB 4.27Å; F438-K463 HydrophobicContact CZ-CB 4.14Å; E459-K463 WeakPolarHBondContact O-CG 3.47Å; E459-K463 PolarHBondContact O-N 3.09Å; E459-K463 IonicContact OE1-NZ 2.63Å; I460-K463 WeakPolarHBondContact O-CB 3.49Å; I460-K463 PolarHBondContact O-N 3.45Å; A461-K463 PolarHBondContact O-N 2.79Å; K463-A467 WeakPolarHBondContact O-CB 3.32Å; K463-A467 PolarHBondContact O-N 3.24Å
464	F	87.3	Confident	83	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-74.1	-33.9	178.2	-73.9	-65.5	0	0	0	113.3	F438 Y443 A447 Y450 I460 A461 L462 A467 K468 Q469 A472 L473 F476	F438-F464 HydrophobicContact CD2-CD1 4.47Å; F438-F464 AromaticContact CD2-CE1 3.94Å; F438-F464 HydrophobicContact CD2-CE1 3.94Å; F438-F464 HydrophobicContact CD2-CZ 4.31Å; F438-F464 AromaticContact CE2-CD1 3.95Å; F438-F464 HydrophobicContact CE2-CD1 3.95Å; F438-F464 AromaticContact CE2-CE1 3.88Å; F438-F464 HydrophobicContact CE2-CE1 3.88Å; F438-F464 HydrophobicContact CE2-CZ 4.48Å; Y443-F464 HydrophobicContact CD1-CE1 4.41Å; A447-F464 HydrophobicContact CB-CE1 4.36Å; A447-F464 HydrophobicContact CB-CE2 4.29Å; A447-F464 HydrophobicContact CB-CZ 3.81Å; Y450-F464 HydrophobicContact CD2-CE2 4.05Å; Y450-F464 HydrophobicContact CD2-CZ 4.04Å; I460-F464 HydrophobicContact CG2-CD2 3.83Å; I460-F464 HydrophobicContact CG2-CE2 3.55Å; I460-F464 VanDerWaalsContact O-CD2 3.25Å; I460-F464 WeakPolarHBondContact O-CD2 3.33Å; I460-F464 PolarHBondContact O-N 3.23Å; A461-F464 PolarHBondContact O-N 2.78Å; L462-F464 VanDerWaalsContact C-N 3.3Å; L462-F464 PolarHBondContact O-N 3.13Å; F464-A467 PolarHBondContact O-N 2.87Å; F464-K468 PolarHBondContact O-N 3.26Å; F464-Q469 PolarHBondContact O-N 2.76Å; F464-Q469 VanDerWaalsContact O-N 3.15Å; F464-A472 HydrophobicContact CD1-CB 3.75Å; F464-A472 HydrophobicContact CE1-CB 3.73Å; F464-L473 HydrophobicContact CB-CB 4.03Å; F464-L473 HydrophobicContact CB-CD1 4.15Å; F464-F476 HydrophobicContact CE2-CB 4.43Å; F464-F476 HydrophobicContact CE2-CG 4.5Å
465	I	86.1	Confident	83.4	Confident	83 Å²	83	68.3 Å²	68.3	43%	0.426	32%	0.321	S	S	.	.	H	α-helix	trans	-65.9	-46.9	175.1	-66.8	164.6	0	0	0	110.5	A461 L462 A467 K468 L473 W498	A461-I465 VanDerWaalsContact O-CG1 3.25Å; A461-I465 WeakPolarHBondContact O-CG1 3.46Å; A461-I465 PolarHBondContact O-N 3.32Å; L462-I465 PolarHBondContact O-N 2.95Å; L462-I465 VanDerWaalsContact O-N 3.14Å; I465-A467 VanDerWaalsContact C-N 3.29Å; I465-A467 PolarHBondContact O-N 3.49Å; I465-K468 WeakPolarHBondContact O-CA 3.47Å; I465-K468 PolarHBondContact O-N 2.85Å; I465-L473 HydrophobicContact CG1-CD2 3.9Å; I465-W498 HydrophobicContact CD1-CH2 4.2Å; I465-W498 HydrophobicContact CD1-CZ2 4Å
466	E	87.5	Confident	83.9	Confident	153 Å²	153	65.5 Å²	65.5	72%	0.715	31%	0.306	S	S	*	.	H	α-helix	trans	-61.4	-37.5	177	-73.1	178.1	179.2	0	0	112	L462 K468	L462-E466 WeakPolarHBondContact O-CB 3.07Å; L462-E466 WeakPolarHBondContact O-CG 3.32Å; L462-E466 PolarHBondContact O-N 3.41Å; E466-K468 PolarHBondContact O-N 3.35Å
467	A	84.3	Confident	84.1	Confident	28 Å²	28	58.3 Å²	58.3	23%	0.231	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-5.3	175	0	0	0	0	0	113.9	F438 Y443 K463 F464 I465 Q469	F438-A467 HydrophobicContact CZ-CB 4.05Å; Y443-A467 HydrophobicContact CE1-CB 4.38Å; K463-A467 WeakPolarHBondContact O-CB 3.32Å; K463-A467 PolarHBondContact O-N 3.24Å; F464-A467 PolarHBondContact O-N 2.87Å; I465-A467 VanDerWaalsContact C-N 3.29Å; I465-A467 PolarHBondContact O-N 3.49Å; A467-Q469 HydrophobicContact CB-CG 4.1Å; A467-Q469 WeakPolarHBondContact O-CG 3.18Å; A467-Q469 PolarHBondContact O-N 3.26Å; A467-Q469 PolarHBondContact O-NE2 3.06Å
468	K	82.6	Confident	84.2	Confident	182 Å²	182	57.6 Å²	57.6	79%	0.791	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	36.9	-175	-58.7	-177.2	177.2	-176.2	0	113.2	F464 I465 E466	F464-K468 PolarHBondContact O-N 3.26Å; I465-K468 WeakPolarHBondContact O-CA 3.47Å; I465-K468 PolarHBondContact O-N 2.85Å; E466-K468 PolarHBondContact O-N 3.35Å
469	Q	83.4	Confident	84.2	Confident	73 Å²	73	55.2 Å²	55.2	34%	0.341	26%	0.264	S	S	.	.			trans	-107	82.4	-179.8	-62.9	-59.2	-42.8	0	0	110.7	Y443 F464 A467 E471 A472 L473	Y443-Q469 HydrophobicContact CD1-CG 4.31Å; Y443-Q469 HydrophobicContact CD2-CG 3.61Å; Y443-Q469 HydrophobicContact CE2-CG 3.85Å; Y443-Q469 HydrophobicContact CG-CB 4.46Å; Y443-Q469 HydrophobicContact CG-CG 3.85Å; F464-Q469 PolarHBondContact O-N 2.76Å; F464-Q469 VanDerWaalsContact O-N 3.15Å; A467-Q469 HydrophobicContact CB-CG 4.1Å; A467-Q469 WeakPolarHBondContact O-CG 3.18Å; A467-Q469 PolarHBondContact O-N 3.26Å; A467-Q469 PolarHBondContact O-NE2 3.06Å; Q469-E471 PolarHBondContact O-N 2.85Å; Q469-A472 HydrophobicContact CB-CB 4.08Å; Q469-A472 PolarHBondContact O-N 3.46Å; Q469-L473 PolarHBondContact O-N 2.93Å; Q469-L473 VanDerWaalsContact O-N 3.15Å
470	E	79.6	Confident	84	Confident	79 Å²	79	52.2 Å²	52.2	37%	0.369	25%	0.25	S	C	.	.	H	α-helix	trans	-64.9	-36.7	-178.5	-65.4	-179.5	-179.9	0	0	112.7	L473 K474	E470-L473 PolarHBondContact O-N 3.36Å; E470-K474 WeakPolarHBondContact O-CB 3.43Å; E470-K474 PolarHBondContact O-N 3.02Å
471	E	80.1	Confident	83.8	Confident	109 Å²	109	52.4 Å²	52.4	51%	0.509	25%	0.251	S	S	.	.	H	α-helix	trans	-67.5	-38.9	179.9	-66.6	-176.7	171	0	0	112.6	Q469 K474 E475 R506	Q469-E471 PolarHBondContact O-N 2.85Å; E471-K474 PolarHBondContact O-N 3.24Å; E471-E475 PolarHBondContact O-N 3.03Å; E471-R506 IonicContact OE1-NH2 3.51Å; E471-R506 PolarHBondContact OE1-NH2 3.07Å
472	A	84	Confident	83.6	Confident	2 Å²	2	56.1 Å²	56.1	2%	0.017	27%	0.27	C	S	.	.	H	α-helix	trans	-69.8	-38.8	175.5	0	0	0	0	0	111.8	A447 F464 Q469 E475 F476	A447-A472 HydrophobicContact CB-CB 4.31Å; A447-A472 WeakPolarHBondContact CB-O 3.45Å; F464-A472 HydrophobicContact CD1-CB 3.75Å; F464-A472 HydrophobicContact CE1-CB 3.73Å; Q469-A472 HydrophobicContact CB-CB 4.08Å; Q469-A472 PolarHBondContact O-N 3.46Å; A472-E475 PolarHBondContact O-N 2.73Å; A472-F476 WeakPolarHBondContact O-CB 3.47Å; A472-F476 PolarHBondContact O-N 3.4Å
473	L	85.8	Confident	83.2	Confident	5 Å²	5	56.1 Å²	56.1	3%	0.026	27%	0.27	C	S	.	.	H	α-helix	trans	-61.6	-45.1	173.4	-178.9	63	0	0	0	111.3	A461 F464 I465 Q469 E470 E475 F476 L477 W498 L502	A461-L473 HydrophobicContact CB-CD1 4.41Å; F464-L473 HydrophobicContact CB-CB 4.03Å; F464-L473 HydrophobicContact CB-CD1 4.15Å; I465-L473 HydrophobicContact CG1-CD2 3.9Å; Q469-L473 PolarHBondContact O-N 2.93Å; Q469-L473 VanDerWaalsContact O-N 3.15Å; E470-L473 PolarHBondContact O-N 3.36Å; L473-E475 PolarHBondContact O-N 3.01Å; L473-F476 HydrophobicContact CD1-CD1 4.41Å; L473-F476 WeakPolarHBondContact O-CB 3.29Å; L473-F476 PolarHBondContact O-N 3.45Å; L473-L477 HydrophobicContact CD1-CD1 4.28Å; L473-L477 HydrophobicContact CD1-CG 4.29Å; L473-L477 HydrophobicContact CG-CD1 4Å; L473-L477 HydrophobicContact CG-CG 4.43Å; L473-L477 VanDerWaalsContact O-CG 3.24Å; L473-L477 WeakPolarHBondContact O-CG 3.5Å; L473-L477 PolarHBondContact O-N 2.92Å; L473-W498 HydrophobicContact CD1-CH2 4.02Å; L473-W498 HydrophobicContact CD2-CH2 4.13Å; L473-W498 HydrophobicContact CD2-CZ2 3.82Å; L473-L502 HydrophobicContact CD2-CD1 4.14Å; L473-L502 HydrophobicContact CG-CD1 4.39Å
474	K	83.6	Confident	82.7	Confident	39 Å²	39	55.3 Å²	55.3	17%	0.17	27%	0.268	C	S	.	.	H	α-helix	trans	-56.6	-49.4	175.2	174.1	-175.4	164.7	-176.1	0	111.7	E470 E471 F476 L477 L478 L499 Y503 E525	E470-K474 WeakPolarHBondContact O-CB 3.43Å; E470-K474 PolarHBondContact O-N 3.02Å; E471-K474 PolarHBondContact O-N 3.24Å; K474-F476 VanDerWaalsContact C-N 3.31Å; K474-F476 PolarHBondContact O-N 3.33Å; K474-L477 PolarHBondContact O-N 2.92Å; K474-L478 HydrophobicContact CG-CD1 3.97Å; K474-L478 HydrophobicContact CG-CG 4.46Å; K474-L478 WeakPolarHBondContact O-CB 3.31Å; K474-L478 WeakPolarHBondContact O-CG 3.4Å; K474-L478 PolarHBondContact O-N 2.83Å; K474-L499 HydrophobicContact CG-CD2 4.44Å; K474-Y503 HydrophobicContact CD-CE1 4.27Å; K474-Y503 WeakPolarHBondContact CE-OH 3.45Å; K474-Y503 VanDerWaalsContact NZ-CE1 3.31Å; K474-E525 IonicContact NZ-OE2 2.74Å; K474-E525 PolarHBondContact NZ-OE2 3.39Å
475	E	84.1	Confident	81.9	Confident	52 Å²	52	62.5 Å²	62.5	24%	0.243	30%	0.299	C	S	.	.	H	α-helix	trans	-62.6	-38.8	179.3	-173	67.6	-176.5	0	0	112	L444 A447 K448 E471 A472 L473 K479	L444-E475 HydrophobicContact CD2-CB 4.41Å; A447-E475 HydrophobicContact CB-CB 4.43Å; K448-E475 WeakPolarHBondContact CE-OE1 3.17Å; K448-E475 HydrophobicContact CG-CG 3.95Å; K448-E475 IonicContact NZ-OE1 3.31Å; E471-E475 PolarHBondContact O-N 3.03Å; A472-E475 PolarHBondContact O-N 2.73Å; L473-E475 PolarHBondContact O-N 3.01Å; E475-K479 WeakPolarHBondContact O-CB 3.34Å; E475-K479 PolarHBondContact O-N 2.89Å; E475-K479 VanDerWaalsContact O-N 3.08Å
476	F	85.9	Confident	81	Confident	0 Å²	0	66 Å²	66	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-61.2	-49.4	174	170.5	-108.8	0	0	0	111.5	A447 A451 F457 I460 F464 A472 L473 K474 K479 K480	A447-F476 HydrophobicContact CB-CB 3.89Å; A451-F476 HydrophobicContact CB-CD2 3.91Å; A451-F476 HydrophobicContact CB-CE2 4.36Å; F457-F476 AromaticContact CD2-CE1 3.67Å; F457-F476 HydrophobicContact CD2-CE1 3.67Å; F457-F476 AromaticContact CD2-CZ 3.9Å; F457-F476 HydrophobicContact CD2-CZ 3.9Å; F457-F476 HydrophobicContact CE2-CD1 4.43Å; F457-F476 AromaticContact CE2-CE1 3.58Å; F457-F476 HydrophobicContact CE2-CE1 3.58Å; F457-F476 HydrophobicContact CE2-CZ 4.24Å; I460-F476 HydrophobicContact CB-CE1 4.39Å; I460-F476 HydrophobicContact CB-CE2 4.37Å; I460-F476 HydrophobicContact CB-CZ 3.92Å; I460-F476 HydrophobicContact CD1-CE2 4.24Å; I460-F476 HydrophobicContact CD1-CZ 4.21Å; I460-F476 HydrophobicContact CG2-CD1 4.38Å; I460-F476 HydrophobicContact CG2-CD2 4.09Å; I460-F476 HydrophobicContact CG2-CE1 3.97Å; I460-F476 HydrophobicContact CG2-CE2 3.67Å; I460-F476 HydrophobicContact CG2-CG 4.43Å; I460-F476 HydrophobicContact CG2-CZ 3.58Å; F464-F476 HydrophobicContact CE2-CB 4.43Å; F464-F476 HydrophobicContact CE2-CG 4.5Å; A472-F476 WeakPolarHBondContact O-CB 3.47Å; A472-F476 PolarHBondContact O-N 3.4Å; L473-F476 HydrophobicContact CD1-CD1 4.41Å; L473-F476 WeakPolarHBondContact O-CB 3.29Å; L473-F476 PolarHBondContact O-N 3.45Å; K474-F476 VanDerWaalsContact C-N 3.31Å; K474-F476 PolarHBondContact O-N 3.33Å; F476-K479 PolarHBondContact O-N 3.5Å; F476-K480 HydrophobicContact CE1-CD 4.32Å; F476-K480 HydrophobicContact CE2-CD 4.2Å; F476-K480 HydrophobicContact CZ-CD 3.81Å; F476-K480 VanDerWaalsContact O-CB 3.31Å; F476-K480 WeakPolarHBondContact O-CB 3.28Å; F476-K480 PolarHBondContact O-N 3.25Å
477	L	84	Confident	79.9	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-64	-43.9	-179.7	-67.4	172.3	0	0	0	111.7	F457 L473 K474 K479 K480 L481 L495 W498 L499 L502	F457-L477 HydrophobicContact CE2-CD2 3.63Å; F457-L477 HydrophobicContact CZ-CD2 3.56Å; L473-L477 HydrophobicContact CD1-CD1 4.28Å; L473-L477 HydrophobicContact CD1-CG 4.29Å; L473-L477 HydrophobicContact CG-CD1 4Å; L473-L477 HydrophobicContact CG-CG 4.43Å; L473-L477 VanDerWaalsContact O-CG 3.24Å; L473-L477 WeakPolarHBondContact O-CG 3.5Å; L473-L477 PolarHBondContact O-N 2.92Å; K474-L477 PolarHBondContact O-N 2.92Å; L477-K479 PolarHBondContact O-N 3.46Å; L477-K480 PolarHBondContact O-N 2.92Å; L477-L481 WeakPolarHBondContact O-CB 3.22Å; L477-L481 PolarHBondContact O-N 3.45Å; L477-L495 HydrophobicContact CD2-CD2 3.53Å; L477-W498 HydrophobicContact CD1-CD2 4.11Å; L477-W498 HydrophobicContact CD1-CE3 3.86Å; L477-W498 HydrophobicContact CD1-CH2 4.46Å; L477-W498 HydrophobicContact CD1-CZ3 4.06Å; L477-W498 HydrophobicContact CD2-CE3 3.72Å; L477-W498 HydrophobicContact CD2-CZ3 3.61Å; L477-W498 HydrophobicContact CG-CE3 4.48Å; L477-W498 HydrophobicContact CG-CZ3 4.43Å; L477-L499 HydrophobicContact CB-CD1 4.15Å; L477-L499 HydrophobicContact CB-CD2 3.63Å; L477-L499 HydrophobicContact CB-CG 3.93Å; L477-L499 HydrophobicContact CD1-CD2 3.95Å; L477-L499 HydrophobicContact CD1-CG 4.24Å; L477-L499 HydrophobicContact CG-CD2 4.46Å; L477-L502 HydrophobicContact CD1-CD1 3.51Å
478	L	82.3	Confident	79.4	Confident	33 Å²	33	65.2 Å²	65.2	17%	0.173	32%	0.316	C	S	.	.	H	α-helix	trans	-61.9	-44.2	177.6	-75.5	172.7	0	0	0	112.3	K474 N482 L499 F529	K474-L478 HydrophobicContact CG-CD1 3.97Å; K474-L478 HydrophobicContact CG-CG 4.46Å; K474-L478 WeakPolarHBondContact O-CB 3.31Å; K474-L478 WeakPolarHBondContact O-CG 3.4Å; K474-L478 PolarHBondContact O-N 2.83Å; L478-N482 PolarHBondContact O-N 3.08Å; L478-N482 PolarHBondContact O-ND2 3.5Å; L478-N482 VanDerWaalsContact O-ND2 3.12Å; L478-L499 HydrophobicContact CD2-CD1 4.05Å; L478-L499 HydrophobicContact CD2-CD2 4.49Å; L478-L499 HydrophobicContact CG-CD2 4.34Å; L478-F529 HydrophobicContact CD2-CD2 3.87Å; L478-F529 HydrophobicContact CD2-CE2 4.02Å
479	K	82.1	Confident	78.9	Confident	68 Å²	68	64.8 Å²	64.8	30%	0.296	31%	0.309	S	S	.	.	H	α-helix	trans	-69.4	-39.2	177.4	-80.5	-161	173	-168.1	0	112.6	K448 A451 E475 F476 L477 N482 N483	K448-K479 HydrophobicContact CB-CD 4.2Å; K448-K479 HydrophobicContact CG-CD 3.98Å; A451-K479 HydrophobicContact CB-CB 3.42Å; A451-K479 VanDerWaalsContact CB-CB 3.42Å; A451-K479 HydrophobicContact CB-CD 4.42Å; E475-K479 WeakPolarHBondContact O-CB 3.34Å; E475-K479 PolarHBondContact O-N 2.89Å; E475-K479 VanDerWaalsContact O-N 3.08Å; F476-K479 PolarHBondContact O-N 3.5Å; L477-K479 PolarHBondContact O-N 3.46Å; K479-N482 PolarHBondContact O-N 3.13Å; K479-N483 PolarHBondContact O-N 3.45Å; K479-N483 PolarHBondContact O-ND2 2.91Å
480	K	81	Confident	78.6	Confident	37 Å²	37	66.3 Å²	66.3	16%	0.161	32%	0.324	C	S	.	.	H	α-helix	trans	-64.9	-42.6	176.5	-164.2	154.3	-176.9	159.2	0	110.9	F457 F476 L477 N482 N483 L484	F457-K480 HydrophobicContact CD2-CD 3.64Å; F457-K480 HydrophobicContact CE2-CD 4.05Å; F476-K480 HydrophobicContact CE1-CD 4.32Å; F476-K480 HydrophobicContact CE2-CD 4.2Å; F476-K480 HydrophobicContact CZ-CD 3.81Å; F476-K480 VanDerWaalsContact O-CB 3.31Å; F476-K480 WeakPolarHBondContact O-CB 3.28Å; F476-K480 PolarHBondContact O-N 3.25Å; L477-K480 PolarHBondContact O-N 2.92Å; K480-N482 VanDerWaalsContact C-N 3.29Å; K480-N482 PolarHBondContact O-N 2.98Å; K480-N483 PolarHBondContact O-N 3.34Å; K480-N483 VanDerWaalsContact O-N 3.09Å; K480-L484 WeakPolarHBondContact O-CG 3.49Å; K480-L484 PolarHBondContact O-N 3.41Å; K480-L484 VanDerWaalsContact O-N 3.13Å
481	L	79.9	Confident	78.4	Confident	7 Å²	7	67.2 Å²	67.2	4%	0.037	33%	0.328	C	S	.	.	H	α-helix	trans	-57.7	-39.2	173.3	-172.6	77.5	0	0	0	112.7	L477 N483 L484 I492 L495 V496 L499 F529 H535	L477-L481 WeakPolarHBondContact O-CB 3.22Å; L477-L481 PolarHBondContact O-N 3.45Å; L481-N483 VanDerWaalsContact C-N 3.32Å; L481-N483 PolarHBondContact O-N 3.31Å; L481-L484 PolarHBondContact O-N 2.89Å; L481-I492 HydrophobicContact CD1-CG2 4.07Å; L481-L495 HydrophobicContact CD1-CB 3.9Å; L481-L495 HydrophobicContact CD1-CD1 4.23Å; L481-V496 HydrophobicContact CD1-CG2 3.93Å; L481-V496 HydrophobicContact CD2-CG2 4.34Å; L481-L499 HydrophobicContact CD2-CD1 3.9Å; L481-F529 HydrophobicContact CD2-CE2 3.82Å; L481-F529 HydrophobicContact CD2-CZ 4.48Å; L481-H535 WeakPolarHBondContact CD2-CE1 3.49Å; L481-H535 WeakPolarHBondContact CD2-NE2 3.38Å
482	N	80.1	Confident	78.2	Confident	83 Å²	83	62.7 Å²	62.7	44%	0.444	31%	0.307	S	S	.	.	H	α-helix	trans	-68.7	-28.5	176.7	-82.7	-43.5	0	0	0	114	L478 K479 K480	L478-N482 PolarHBondContact O-N 3.08Å; L478-N482 PolarHBondContact O-ND2 3.5Å; L478-N482 VanDerWaalsContact O-ND2 3.12Å; K479-N482 PolarHBondContact O-N 3.13Å; K480-N482 VanDerWaalsContact C-N 3.29Å; K480-N482 PolarHBondContact O-N 2.98Å
483	N	77.5	Confident	77.9	Confident	94 Å²	94	64.1 Å²	64.1	50%	0.503	32%	0.316	S	S	.	.	H	α-helix	trans	-85.4	-18	179.5	-70.5	-19.9	0	0	0	113.4	A451 K479 K480 L481	A451-N483 PolarHBondContact O-ND2 3.19Å; K479-N483 PolarHBondContact O-N 3.45Å; K479-N483 PolarHBondContact O-ND2 2.91Å; K480-N483 PolarHBondContact O-N 3.34Å; K480-N483 VanDerWaalsContact O-N 3.09Å; L481-N483 VanDerWaalsContact C-N 3.32Å; L481-N483 PolarHBondContact O-N 3.31Å
484	L	74.9	Confident	77.6	Confident	35 Å²	35	69.9 Å²	69.9	18%	0.183	35%	0.346	C	S	.	.	S	Bend	trans	-68.9	144.3	177.7	-71.6	172.2	0	0	0	111.7	K480 L481 E488 Q491 I492 L495	K480-L484 WeakPolarHBondContact O-CG 3.49Å; K480-L484 PolarHBondContact O-N 3.41Å; K480-L484 VanDerWaalsContact O-N 3.13Å; L481-L484 PolarHBondContact O-N 2.89Å; L484-E488 WeakPolarHBondContact CD2-OE2 3.4Å; L484-Q491 HydrophobicContact CD1-CB 4.3Å; L484-I492 HydrophobicContact CB-CG1 4.21Å; L484-I492 HydrophobicContact CD1-CG1 4.06Å; L484-L495 HydrophobicContact CD1-CD1 3.37Å
485	K	71.6	Confident	77.4	Confident	150 Å²	150	68.6 Å²	68.6	65%	0.652	34%	0.341	S	S	*	.			trans	-80.1	147.3	175.6	-66.8	176.9	-177.2	172.7	0	109.4	S487 E488 I492	K485-S487 WeakPolarHBondContact CB-OG 3.3Å; K485-S487 PolarHBondContact O-N 3.46Å; K485-E488 PolarHBondContact N-OE2 3.06Å; K485-E488 PolarHBondContact O-N 3.47Å; K485-I492 WeakPolarHBondContact O-CD1 3.37Å
486	Q	65.8	Low	77.3	Confident	157 Å²	157	66.3 Å²	66.3	73%	0.734	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-15	176.7	-71.5	178.2	-9.9	0	0	114.2	E488	Q486-E488 VanDerWaalsContact C-N 3.34Å
487	S	65.6	Low	77.1	Confident	93 Å²	93	68 Å²	68	65%	0.65	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-26.9	173.7	50.3	0	0	0	0	113.7	K485 R489	K485-S487 WeakPolarHBondContact CB-OG 3.3Å; K485-S487 PolarHBondContact O-N 3.46Å; S487-R489 VanDerWaalsContact C-N 3.25Å; S487-R489 PolarHBondContact O-N 3.26Å
488	E	74.1	Confident	77.1	Confident	72 Å²	72	71.1 Å²	71.1	34%	0.336	35%	0.353	S	S	.	.			trans	-88.5	54	-172.7	-67.2	164.9	156.9	0	0	111.7	L484 K485 Q486 T490 Q491 I492	L484-E488 WeakPolarHBondContact CD2-OE2 3.4Å; K485-E488 PolarHBondContact N-OE2 3.06Å; K485-E488 PolarHBondContact O-N 3.47Å; Q486-E488 VanDerWaalsContact C-N 3.34Å; E488-T490 VanDerWaalsContact C-N 3.28Å; E488-T490 PolarHBondContact O-N 3.15Å; E488-T490 VanDerWaalsContact O-N 3.16Å; E488-Q491 HydrophobicContact CB-CB 4.46Å; E488-Q491 PolarHBondContact O-N 2.98Å; E488-I492 WeakPolarHBondContact O-CG1 3.27Å; E488-I492 PolarHBondContact O-N 3.39Å
489	R	71.9	Confident	77.1	Confident	172 Å²	172	69.6 Å²	69.6	65%	0.649	34%	0.344	S	S	*	.	H	α-helix	trans	-55.7	-35.3	-171.1	-66.9	-177.7	176.8	174.6	-2.1	114.6	S487 T493	S487-R489 VanDerWaalsContact C-N 3.25Å; S487-R489 PolarHBondContact O-N 3.26Å; R489-T493 VanDerWaalsContact O-CB 3.32Å; R489-T493 WeakPolarHBondContact O-CB 3.31Å; R489-T493 PolarHBondContact O-N 3.13Å; R489-T493 PolarHBondContact O-OG1 3Å
490	T	77.4	Confident	77	Confident	106 Å²	106	66.3 Å²	66.3	65%	0.65	33%	0.33	S	S	*	.	H	α-helix	trans	-71.3	-45.5	-179.6	48.2	0	0	0	0	112.1	E488 T493 L494	E488-T490 VanDerWaalsContact C-N 3.28Å; E488-T490 PolarHBondContact O-N 3.15Å; E488-T490 VanDerWaalsContact O-N 3.16Å; T490-T493 PolarHBondContact O-N 3.36Å; T490-L494 WeakPolarHBondContact O-CG 3.24Å; T490-L494 PolarHBondContact O-N 3.35Å
491	Q	74.3	Confident	77	Confident	98 Å²	98	68.5 Å²	68.5	46%	0.458	34%	0.341	S	S	.	.	H	α-helix	trans	-65.2	-42.3	176.5	-66.8	180	-2.2	0	0	111	L484 E488 T493 L494 L495	L484-Q491 HydrophobicContact CD1-CB 4.3Å; E488-Q491 HydrophobicContact CB-CB 4.46Å; E488-Q491 PolarHBondContact O-N 2.98Å; Q491-T493 VanDerWaalsContact C-N 3.34Å; Q491-T493 PolarHBondContact O-N 2.85Å; Q491-L494 PolarHBondContact O-N 3.26Å; Q491-L495 WeakPolarHBondContact O-CB 3.41Å; Q491-L495 VanDerWaalsContact O-CG 3.26Å; Q491-L495 WeakPolarHBondContact O-CG 3.12Å; Q491-L495 PolarHBondContact O-N 3.23Å
492	I	76.4	Confident	77.1	Confident	14 Å²	14	69.3 Å²	69.3	7%	0.072	35%	0.345	C	S	.	.	H	α-helix	trans	-59.9	-45.6	174	-64.9	168.4	0	0	0	110.5	L481 L484 K485 E488 L494 L495 V496 C538	L481-I492 HydrophobicContact CD1-CG2 4.07Å; L484-I492 HydrophobicContact CB-CG1 4.21Å; L484-I492 HydrophobicContact CD1-CG1 4.06Å; K485-I492 WeakPolarHBondContact O-CD1 3.37Å; E488-I492 WeakPolarHBondContact O-CG1 3.27Å; E488-I492 PolarHBondContact O-N 3.39Å; I492-L494 PolarHBondContact O-N 3.48Å; I492-L495 PolarHBondContact O-N 2.77Å; I492-V496 HydrophobicContact CG2-CG2 4.1Å; I492-V496 VanDerWaalsContact O-CB 3.32Å; I492-V496 WeakPolarHBondContact O-CB 3.17Å; I492-V496 WeakPolarHBondContact O-CG2 3.3Å; I492-V496 PolarHBondContact O-N 2.74Å; I492-C538 HydrophobicContact CG2-CB 4.16Å; I492-C538 WeakPolarHBondContact CG2-SG 3.4Å
493	T	76.9	Confident	77.2	Confident	31 Å²	31	65.8 Å²	65.8	19%	0.19	33%	0.326	C	S	.	.	H	α-helix	trans	-60.4	-46.5	178.7	-65.2	0	0	0	0	112.3	R489 T490 Q491 V496 T497 N542	R489-T493 VanDerWaalsContact O-CB 3.32Å; R489-T493 WeakPolarHBondContact O-CB 3.31Å; R489-T493 PolarHBondContact O-N 3.13Å; R489-T493 PolarHBondContact O-OG1 3Å; T490-T493 PolarHBondContact O-N 3.36Å; Q491-T493 VanDerWaalsContact C-N 3.34Å; Q491-T493 PolarHBondContact O-N 2.85Å; T493-V496 PolarHBondContact O-N 2.87Å; T493-T497 WeakPolarHBondContact O-CB 3.33Å; T493-T497 PolarHBondContact O-N 2.72Å; T493-T497 PolarHBondContact O-OG1 3.15Å; T493-N542 WeakPolarHBondContact CG2-ND2 3.23Å; T493-N542 PolarHBondContact OG1-ND2 3.5Å
494	L	79.9	Confident	77.3	Confident	126 Å²	126	61.4 Å²	61.4	66%	0.66	30%	0.302	S	S	*	.	H	α-helix	trans	-63.4	-46.2	178.7	-73.5	169.4	0	0	0	111.4	T490 Q491 I492 T497 W498	T490-L494 WeakPolarHBondContact O-CG 3.24Å; T490-L494 PolarHBondContact O-N 3.35Å; Q491-L494 PolarHBondContact O-N 3.26Å; I492-L494 PolarHBondContact O-N 3.48Å; L494-T497 PolarHBondContact O-N 2.79Å; L494-W498 WeakPolarHBondContact O-CB 3.35Å; L494-W498 PolarHBondContact O-N 3.5Å
495	L	79.7	Confident	77.6	Confident	13 Å²	13	62.6 Å²	62.6	7%	0.068	31%	0.309	C	S	.	.	H	α-helix	trans	-64.4	-41.2	178	-70.7	176.2	0	0	0	112.4	F457 L477 L481 L484 Q491 I492 W498 L499	F457-L495 HydrophobicContact CE1-CD2 4.28Å; F457-L495 HydrophobicContact CE2-CD2 3.78Å; F457-L495 HydrophobicContact CZ-CD2 3.38Å; L477-L495 HydrophobicContact CD2-CD2 3.53Å; L481-L495 HydrophobicContact CD1-CB 3.9Å; L481-L495 HydrophobicContact CD1-CD1 4.23Å; L484-L495 HydrophobicContact CD1-CD1 3.37Å; Q491-L495 WeakPolarHBondContact O-CB 3.41Å; Q491-L495 VanDerWaalsContact O-CG 3.26Å; Q491-L495 WeakPolarHBondContact O-CG 3.12Å; Q491-L495 PolarHBondContact O-N 3.23Å; I492-L495 PolarHBondContact O-N 2.77Å; L495-W498 PolarHBondContact O-N 2.96Å; L495-L499 VanDerWaalsContact O-CB 3.22Å; L495-L499 WeakPolarHBondContact O-CB 3.36Å; L495-L499 VanDerWaalsContact O-CG 3.28Å; L495-L499 WeakPolarHBondContact O-CG 3.36Å; L495-L499 PolarHBondContact O-N 3.47Å
496	V	81.3	Confident	77.9	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.018	29%	0.29	C	S	.	.	H	α-helix	trans	-65.2	-45.3	177.2	169.2	0	0	0	0	110.5	L481 I492 T493 W498 L499 T500 F529 H535 L539	L481-V496 HydrophobicContact CD1-CG2 3.93Å; L481-V496 HydrophobicContact CD2-CG2 4.34Å; I492-V496 HydrophobicContact CG2-CG2 4.1Å; I492-V496 VanDerWaalsContact O-CB 3.32Å; I492-V496 WeakPolarHBondContact O-CB 3.17Å; I492-V496 WeakPolarHBondContact O-CG2 3.3Å; I492-V496 PolarHBondContact O-N 2.74Å; T493-V496 PolarHBondContact O-N 2.87Å; V496-W498 VanDerWaalsContact C-N 3.34Å; V496-W498 PolarHBondContact O-N 3.22Å; V496-L499 PolarHBondContact O-N 3.25Å; V496-T500 WeakPolarHBondContact O-CB 3.08Å; V496-T500 PolarHBondContact O-N 3.16Å; V496-T500 PolarHBondContact O-OG1 3.13Å; V496-F529 HydrophobicContact CG1-CE1 4.42Å; V496-F529 HydrophobicContact CG1-CZ 4.2Å; V496-F529 HydrophobicContact CG2-CZ 4.31Å; V496-H535 HydrophobicContact CG2-CB 4.5Å; V496-L539 HydrophobicContact CG1-CD2 3.53Å; V496-L539 HydrophobicContact CG1-CG 4.34Å
497	T	81.9	Confident	78.5	Confident	36 Å²	36	51.3 Å²	51.3	22%	0.221	26%	0.256	C	S	.	.	H	α-helix	trans	-61.6	-45.3	178.2	-52	0	0	0	0	110.7	T493 L494 T500 E501 L549	T493-T497 WeakPolarHBondContact O-CB 3.33Å; T493-T497 PolarHBondContact O-N 2.72Å; T493-T497 PolarHBondContact O-OG1 3.15Å; L494-T497 PolarHBondContact O-N 2.79Å; T497-T500 PolarHBondContact O-N 3.17Å; T497-E501 PolarHBondContact O-N 3.1Å; T497-L549 HydrophobicContact CG2-CD1 3.94Å
498	W	84.3	Confident	79	Confident	66 Å²	66	48.1 Å²	48.1	25%	0.25	24%	0.237	C	C	.	.	H	α-helix	trans	-67	-40.2	178.7	-171.2	24	0	0	0	112.5	F457 A461 I465 L473 L477 L494 L495 V496 E501 L502	F457-W498 HydrophobicContact CE1-CZ3 4.06Å; F457-W498 HydrophobicContact CZ-CE3 4.18Å; F457-W498 AromaticContact CZ-CZ3 3.67Å; F457-W498 HydrophobicContact CZ-CZ3 3.67Å; A461-W498 HydrophobicContact CB-CH2 3.9Å; A461-W498 HydrophobicContact CB-CZ3 4.26Å; I465-W498 HydrophobicContact CD1-CH2 4.2Å; I465-W498 HydrophobicContact CD1-CZ2 4Å; L473-W498 HydrophobicContact CD1-CH2 4.02Å; L473-W498 HydrophobicContact CD2-CH2 4.13Å; L473-W498 HydrophobicContact CD2-CZ2 3.82Å; L477-W498 HydrophobicContact CD1-CD2 4.11Å; L477-W498 HydrophobicContact CD1-CE3 3.86Å; L477-W498 HydrophobicContact CD1-CH2 4.46Å; L477-W498 HydrophobicContact CD1-CZ3 4.06Å; L477-W498 HydrophobicContact CD2-CE3 3.72Å; L477-W498 HydrophobicContact CD2-CZ3 3.61Å; L477-W498 HydrophobicContact CG-CE3 4.48Å; L477-W498 HydrophobicContact CG-CZ3 4.43Å; L494-W498 WeakPolarHBondContact O-CB 3.35Å; L494-W498 PolarHBondContact O-N 3.5Å; L495-W498 PolarHBondContact O-N 2.96Å; V496-W498 VanDerWaalsContact C-N 3.34Å; V496-W498 PolarHBondContact O-N 3.22Å; W498-E501 PolarHBondContact O-N 3.18Å; W498-L502 WeakPolarHBondContact O-CG 3.19Å; W498-L502 PolarHBondContact O-N 3.46Å
499	L	82.4	Confident	79.1	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.7	-44.4	172.6	-83.3	169.6	0	0	0	111.4	K474 L477 L478 L481 L495 V496 E501 L502 Y503 F529	K474-L499 HydrophobicContact CG-CD2 4.44Å; L477-L499 HydrophobicContact CB-CD1 4.15Å; L477-L499 HydrophobicContact CB-CD2 3.63Å; L477-L499 HydrophobicContact CB-CG 3.93Å; L477-L499 HydrophobicContact CD1-CD2 3.95Å; L477-L499 HydrophobicContact CD1-CG 4.24Å; L477-L499 HydrophobicContact CG-CD2 4.46Å; L478-L499 HydrophobicContact CD2-CD1 4.05Å; L478-L499 HydrophobicContact CD2-CD2 4.49Å; L478-L499 HydrophobicContact CG-CD2 4.34Å; L481-L499 HydrophobicContact CD2-CD1 3.9Å; L495-L499 VanDerWaalsContact O-CB 3.22Å; L495-L499 WeakPolarHBondContact O-CB 3.36Å; L495-L499 VanDerWaalsContact O-CG 3.28Å; L495-L499 WeakPolarHBondContact O-CG 3.36Å; L495-L499 PolarHBondContact O-N 3.47Å; V496-L499 PolarHBondContact O-N 3.25Å; L499-E501 VanDerWaalsContact C-N 3.32Å; L499-E501 PolarHBondContact O-N 3.32Å; L499-L502 PolarHBondContact O-N 2.69Å; L499-Y503 HydrophobicContact CD2-CE2 4.5Å; L499-Y503 WeakPolarHBondContact O-CD2 3.42Å; L499-Y503 PolarHBondContact O-N 3.06Å; L499-F529 HydrophobicContact CB-CE1 4.4Å; L499-F529 HydrophobicContact CB-CZ 3.95Å; L499-F529 HydrophobicContact CD1-CE2 3.92Å; L499-F529 HydrophobicContact CD1-CZ 4Å
500	T	80.1	Confident	79.2	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.8	-44.7	176.2	-63.9	0	0	0	0	111	V496 T497 Y503 L504 F526 I546	V496-T500 WeakPolarHBondContact O-CB 3.08Å; V496-T500 PolarHBondContact O-N 3.16Å; V496-T500 PolarHBondContact O-OG1 3.13Å; T497-T500 PolarHBondContact O-N 3.17Å; T500-Y503 PolarHBondContact O-N 2.79Å; T500-L504 HydrophobicContact CG2-CD1 3.9Å; T500-L504 HydrophobicContact CG2-CG 4.36Å; T500-L504 WeakPolarHBondContact O-CB 3.36Å; T500-L504 VanDerWaalsContact O-CG 3.26Å; T500-L504 WeakPolarHBondContact O-CG 3.47Å; T500-L504 PolarHBondContact O-N 3.49Å; T500-F526 HydrophobicContact CG2-CE2 4.23Å; T500-F526 HydrophobicContact CG2-CZ 4.29Å; T500-I546 HydrophobicContact CG2-CG2 4.39Å
501	E	82.3	Confident	78.8	Confident	83 Å²	83	41.6 Å²	41.6	39%	0.388	21%	0.207	S	C	.	.	H	α-helix	trans	-61.9	-43	175.2	-169.7	-179.6	173.8	0	0	112	T497 W498 L499 L504 N505	T497-E501 PolarHBondContact O-N 3.1Å; W498-E501 PolarHBondContact O-N 3.18Å; L499-E501 VanDerWaalsContact C-N 3.32Å; L499-E501 PolarHBondContact O-N 3.32Å; E501-L504 PolarHBondContact O-N 3.48Å; E501-N505 VanDerWaalsContact O-CB 3.3Å; E501-N505 WeakPolarHBondContact O-CB 3.47Å; E501-N505 VanDerWaalsContact O-CG 3.25Å; E501-N505 PolarHBondContact O-N 3.46Å; E501-N505 PolarHBondContact O-ND2 2.84Å
502	L	82	Confident	78.5	Confident	24 Å²	24	41.8 Å²	41.8	13%	0.126	22%	0.219	C	C	.	.	H	α-helix	trans	-62.3	-43.6	175.2	-76	171	0	0	0	112.4	L473 L477 W498 L499 R506	L473-L502 HydrophobicContact CD2-CD1 4.14Å; L473-L502 HydrophobicContact CG-CD1 4.39Å; L477-L502 HydrophobicContact CD1-CD1 3.51Å; W498-L502 WeakPolarHBondContact O-CG 3.19Å; W498-L502 PolarHBondContact O-N 3.46Å; L499-L502 PolarHBondContact O-N 2.69Å; L502-R506 WeakPolarHBondContact O-CB 3.23Å; L502-R506 PolarHBondContact O-N 3.44Å
503	Y	80.9	Confident	78.1	Confident	9 Å²	9	46.1 Å²	46.1	4%	0.035	24%	0.242	C	C	.	.	H	α-helix	trans	-62.8	-44.1	175.8	-84.8	-74.3	0	0	0	111.6	K474 L499 T500 R506 L507 E525 F526 F529	K474-Y503 HydrophobicContact CD-CE1 4.27Å; K474-Y503 WeakPolarHBondContact CE-OH 3.45Å; K474-Y503 VanDerWaalsContact NZ-CE1 3.31Å; L499-Y503 HydrophobicContact CD2-CE2 4.5Å; L499-Y503 WeakPolarHBondContact O-CD2 3.42Å; L499-Y503 PolarHBondContact O-N 3.06Å; T500-Y503 PolarHBondContact O-N 2.79Å; Y503-R506 PolarHBondContact O-N 2.99Å; Y503-L507 WeakPolarHBondContact O-CB 3.11Å; Y503-L507 VanDerWaalsContact O-CG 3.29Å; Y503-L507 WeakPolarHBondContact O-CG 2.92Å; Y503-L507 PolarHBondContact O-N 3.49Å; Y503-E525 HydrophobicContact CE1-CB 4.37Å; Y503-F526 VanDerWaalsContact CB-CD2 3.43Å; Y503-F526 HydrophobicContact CD1-CB 3.89Å; Y503-F526 HydrophobicContact CD1-CD2 4.03Å; Y503-F526 HydrophobicContact CD1-CG 4.38Å; Y503-F526 AromaticContact CD2-CD2 3.87Å; Y503-F526 HydrophobicContact CD2-CD2 3.87Å; Y503-F526 HydrophobicContact CD2-CE2 4.45Å; Y503-F526 HydrophobicContact CE1-CB 4.27Å; Y503-F526 HydrophobicContact CG-CB 4.3Å; Y503-F526 AromaticContact CG-CD2 3.55Å; Y503-F526 HydrophobicContact CG-CD2 3.55Å; Y503-F526 HydrophobicContact CG-CE2 4.29Å; Y503-F526 HydrophobicContact CG-CG 4.3Å; Y503-F529 HydrophobicContact CD2-CD1 4.36Å; Y503-F529 HydrophobicContact CE2-CB 4.32Å; Y503-F529 HydrophobicContact CE2-CD1 4.11Å; Y503-F529 HydrophobicContact CE2-CD2 4.42Å; Y503-F529 HydrophobicContact CE2-CG 4.03Å
504	L	79.4	Confident	77.3	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-69	-40.5	179.9	-68.2	174.4	0	0	0	112.4	T500 E501 R506 L507 G508 F526 L549 L550 H553	T500-L504 HydrophobicContact CG2-CD1 3.9Å; T500-L504 HydrophobicContact CG2-CG 4.36Å; T500-L504 WeakPolarHBondContact O-CB 3.36Å; T500-L504 VanDerWaalsContact O-CG 3.26Å; T500-L504 WeakPolarHBondContact O-CG 3.47Å; T500-L504 PolarHBondContact O-N 3.49Å; E501-L504 PolarHBondContact O-N 3.48Å; L504-R506 VanDerWaalsContact C-N 3.32Å; L504-R506 PolarHBondContact O-N 3.25Å; L504-L507 PolarHBondContact O-N 3.35Å; L504-G508 PolarHBondContact O-N 3.47Å; L504-F526 HydrophobicContact CD2-CE1 4.31Å; L504-F526 HydrophobicContact CD2-CZ 4.2Å; L504-L549 HydrophobicContact CD1-CB 4.16Å; L504-L550 HydrophobicContact CD1-CD2 4.08Å; L504-L550 HydrophobicContact CD1-CG 4.47Å; L504-L550 HydrophobicContact CD2-CD2 3.73Å; L504-L550 HydrophobicContact CG-CD2 4.5Å; L504-H553 HydrophobicContact CB-CB 4.49Å
505	N	80.8	Confident	76.8	Confident	59 Å²	59	49.7 Å²	49.7	32%	0.316	26%	0.261	S	S	.	.	H	α-helix	trans	-59.6	-44.2	172.3	-77.3	-28.4	0	0	0	111.2	E501 G508 Q509 H553	E501-N505 VanDerWaalsContact O-CB 3.3Å; E501-N505 WeakPolarHBondContact O-CB 3.47Å; E501-N505 VanDerWaalsContact O-CG 3.25Å; E501-N505 PolarHBondContact O-N 3.46Å; E501-N505 PolarHBondContact O-ND2 2.84Å; N505-G508 PolarHBondContact O-N 2.84Å; N505-Q509 WeakPolarHBondContact O-CG 3.01Å; N505-Q509 PolarHBondContact O-N 2.81Å; N505-H553 PolarHBondContact OD1-CE1 3.12Å; N505-H553 VanDerWaalsContact OD1-CE1 3.23Å
506	R	77.9	Confident	76.3	Confident	69 Å²	69	53.9 Å²	53.9	26%	0.26	29%	0.287	S	S	.	.	H	α-helix	trans	-65.4	-43.5	177.9	-174.5	57.6	170.2	171	-3	112	E471 L502 Y503 L504 Q509 L510 T522	E471-R506 IonicContact OE1-NH2 3.51Å; E471-R506 PolarHBondContact OE1-NH2 3.07Å; L502-R506 WeakPolarHBondContact O-CB 3.23Å; L502-R506 PolarHBondContact O-N 3.44Å; Y503-R506 PolarHBondContact O-N 2.99Å; L504-R506 VanDerWaalsContact C-N 3.32Å; L504-R506 PolarHBondContact O-N 3.25Å; R506-Q509 PolarHBondContact O-N 2.97Å; R506-L510 HydrophobicContact CG-CD1 3.97Å; R506-L510 WeakPolarHBondContact O-CB 3.49Å; R506-L510 VanDerWaalsContact O-CG 3.25Å; R506-L510 WeakPolarHBondContact O-CG 3.25Å; R506-L510 PolarHBondContact O-N 3.46Å; R506-T522 HydrophobicContact CG-CG2 4.14Å
507	L	78.3	Confident	76	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-62.3	-42.9	175.8	-73.4	171.4	0	0	0	111.4	Y503 L504 L510 E511 F519 T522 R523 F526	Y503-L507 WeakPolarHBondContact O-CB 3.11Å; Y503-L507 VanDerWaalsContact O-CG 3.29Å; Y503-L507 WeakPolarHBondContact O-CG 2.92Å; Y503-L507 PolarHBondContact O-N 3.49Å; L504-L507 PolarHBondContact O-N 3.35Å; L507-L510 PolarHBondContact O-N 3.45Å; L507-E511 WeakPolarHBondContact O-CB 3.4Å; L507-E511 PolarHBondContact O-N 3.01Å; L507-F519 HydrophobicContact CB-CE2 4.29Å; L507-F519 HydrophobicContact CD2-CD2 4.03Å; L507-F519 HydrophobicContact CD2-CE2 3.93Å; L507-F519 HydrophobicContact CD2-CZ 4.49Å; L507-F519 WeakPolarHBondContact O-CE2 3.49Å; L507-T522 HydrophobicContact CD2-CG2 3.95Å; L507-T522 HydrophobicContact CG-CG2 4.32Å; L507-R523 HydrophobicContact CD2-CB 4.06Å; L507-F526 HydrophobicContact CD1-CB 4.49Å; L507-F526 HydrophobicContact CD1-CD1 4.15Å; L507-F526 HydrophobicContact CD1-CG 4.41Å
508	G	77.4	Confident	75.6	Confident	25 Å²	25	61.7 Å²	61.7	26%	0.258	33%	0.326	S	S	.	.	H	α-helix	trans	-65.3	-37.8	176.8	0	0	0	0	0	113.9	L504 N505 S512	L504-G508 PolarHBondContact O-N 3.47Å; N505-G508 PolarHBondContact O-N 2.84Å; G508-S512 PolarHBondContact O-N 3.35Å; G508-S512 PolarHBondContact O-OG 2.93Å; G508-S512 VanDerWaalsContact O-OG 3.07Å
509	Q	76.6	Confident	75.2	Confident	82 Å²	82	60.2 Å²	60.2	38%	0.383	32%	0.321	S	S	.	.	H	α-helix	trans	-63.5	-46.1	171.8	-73.3	174.5	10.2	0	0	111.3	N505 R506 E511 S512 D513	N505-Q509 WeakPolarHBondContact O-CG 3.01Å; N505-Q509 PolarHBondContact O-N 2.81Å; R506-Q509 PolarHBondContact O-N 2.97Å; Q509-E511 VanDerWaalsContact C-N 3.34Å; Q509-E511 PolarHBondContact O-N 3.36Å; Q509-S512 WeakPolarHBondContact O-CB 3.14Å; Q509-S512 PolarHBondContact O-N 3.24Å; Q509-S512 VanDerWaalsContact O-N 3.12Å; Q509-D513 PolarHBondContact O-N 3.42Å
510	L	73.7	Confident	74.8	Confident	6 Å²	6	65.3 Å²	65.3	3%	0.031	35%	0.345	C	S	.	.	H	α-helix	trans	-69.9	-29.3	-178.5	-71	172.3	0	0	0	113.1	R506 L507 S512 D513 I518 F519 T522	R506-L510 HydrophobicContact CG-CD1 3.97Å; R506-L510 WeakPolarHBondContact O-CB 3.49Å; R506-L510 VanDerWaalsContact O-CG 3.25Å; R506-L510 WeakPolarHBondContact O-CG 3.25Å; R506-L510 PolarHBondContact O-N 3.46Å; L507-L510 PolarHBondContact O-N 3.45Å; L510-S512 PolarHBondContact O-N 3.4Å; L510-D513 PolarHBondContact O-N 2.86Å; L510-I518 HydrophobicContact CD1-CG2 4Å; L510-I518 HydrophobicContact CD2-CG2 4.13Å; L510-F519 HydrophobicContact CB-CB 4.37Å; L510-F519 HydrophobicContact CB-CD2 3.94Å; L510-T522 HydrophobicContact CD1-CG2 4.41Å
511	E	69.6	Low	74.7	Confident	126 Å²	126	71.4 Å²	71.4	59%	0.589	37%	0.374	S	S	*	.	H	α-helix	trans	-65.7	-28.5	171.6	-170.3	172	-161.5	0	0	111.8	L507 Q509 F519	L507-E511 WeakPolarHBondContact O-CB 3.4Å; L507-E511 PolarHBondContact O-N 3.01Å; Q509-E511 VanDerWaalsContact C-N 3.34Å; Q509-E511 PolarHBondContact O-N 3.36Å; E511-F519 HydrophobicContact CB-CE2 4Å
512	S	66.3	Low	74.4	Confident	101 Å²	101	68.2 Å²	68.2	71%	0.706	36%	0.36	S	S	*	.	H	α-helix	trans	-82.2	-21.9	176.8	-55	0	0	0	0	113.6	G508 Q509 L510	G508-S512 PolarHBondContact O-N 3.35Å; G508-S512 PolarHBondContact O-OG 2.93Å; G508-S512 VanDerWaalsContact O-OG 3.07Å; Q509-S512 WeakPolarHBondContact O-CB 3.14Å; Q509-S512 PolarHBondContact O-N 3.24Å; Q509-S512 VanDerWaalsContact O-N 3.12Å; L510-S512 PolarHBondContact O-N 3.4Å
513	D	67.8	Low	74.2	Confident	106 Å²	106	69.7 Å²	69.7	57%	0.567	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	6.7	-171.8	-83.8	-11.9	0	0	0	114.5	Q509 L510 N515	Q509-D513 PolarHBondContact O-N 3.42Å; L510-D513 PolarHBondContact O-N 2.86Å; D513-N515 PolarHBondContact O-N 2.96Å
514	D	60.8	Low	74.1	Confident	149 Å²	149	73.8 Å²	73.8	80%	0.797	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	15.5	178.9	-89.9	-19.1	0	0	0	116	T516	D514-T516 PolarHBondContact O-N 3.2Å; D514-T516 VanDerWaalsContact O-N 3.07Å
515	N	68.9	Low	74.1	Confident	82 Å²	82	78 Å²	78	44%	0.439	41%	0.406	S	S	.	.			trans	-84.8	75.4	178.6	-80.6	-40	0	0	0	112.2	D513 L517 I518 F519	D513-N515 PolarHBondContact O-N 2.96Å; N515-L517 VanDerWaalsContact C-N 3.33Å; N515-L517 PolarHBondContact O-N 2.83Å; N515-I518 PolarHBondContact O-N 3.46Å; N515-F519 VanDerWaalsContact O-CB 3.31Å; N515-F519 WeakPolarHBondContact O-CB 3.24Å; N515-F519 PolarHBondContact O-N 2.93Å
516	T	70.6	Confident	74	Confident	101 Å²	101	75.3 Å²	75.3	62%	0.62	39%	0.391	S	S	*	.	H	α-helix	trans	-56.6	-33.3	-175.2	37.3	0	0	0	0	115.9	D514 Q520	D514-T516 PolarHBondContact O-N 3.2Å; D514-T516 VanDerWaalsContact O-N 3.07Å; T516-Q520 WeakPolarHBondContact O-CG 3.18Å; T516-Q520 PolarHBondContact O-N 2.87Å
517	L	73.8	Confident	74.1	Confident	128 Å²	128	74.5 Å²	74.5	67%	0.67	39%	0.388	S	S	*	.	H	α-helix	trans	-73.3	-50.6	-179.4	-72.8	168.5	0	0	0	112.6	N515 F519 Q520 E521	N515-L517 VanDerWaalsContact C-N 3.33Å; N515-L517 PolarHBondContact O-N 2.83Å; L517-F519 VanDerWaalsContact C-N 3.26Å; L517-F519 PolarHBondContact O-N 3.38Å; L517-Q520 PolarHBondContact O-N 3.38Å; L517-E521 PolarHBondContact O-N 2.86Å
518	I	73.4	Confident	74.1	Confident	75 Å²	75	81.2 Å²	81.2	39%	0.385	42%	0.419	S	S	.	.	H	α-helix	trans	-67.4	-33	-179.7	-57.8	172.7	0	0	0	110.2	L510 N515 T522	L510-I518 HydrophobicContact CD1-CG2 4Å; L510-I518 HydrophobicContact CD2-CG2 4.13Å; N515-I518 PolarHBondContact O-N 3.46Å; I518-T522 VanDerWaalsContact O-CB 3.26Å; I518-T522 WeakPolarHBondContact O-CB 3.26Å; I518-T522 PolarHBondContact O-N 3.44Å; I518-T522 PolarHBondContact O-OG1 3.24Å
519	F	76.2	Confident	74.2	Confident	36 Å²	36	80.6 Å²	80.6	16%	0.158	41%	0.41	C	S	.	.	H	α-helix	trans	-61.2	-47.1	172.4	-178.8	-95.6	0	0	0	111.9	L507 L510 E511 N515 L517 T522 R523	L507-F519 HydrophobicContact CB-CE2 4.29Å; L507-F519 HydrophobicContact CD2-CD2 4.03Å; L507-F519 HydrophobicContact CD2-CE2 3.93Å; L507-F519 HydrophobicContact CD2-CZ 4.49Å; L507-F519 WeakPolarHBondContact O-CE2 3.49Å; L510-F519 HydrophobicContact CB-CB 4.37Å; L510-F519 HydrophobicContact CB-CD2 3.94Å; E511-F519 HydrophobicContact CB-CE2 4Å; N515-F519 VanDerWaalsContact O-CB 3.31Å; N515-F519 WeakPolarHBondContact O-CB 3.24Å; N515-F519 PolarHBondContact O-N 2.93Å; L517-F519 VanDerWaalsContact C-N 3.26Å; L517-F519 PolarHBondContact O-N 3.38Å; F519-T522 PolarHBondContact O-N 3.23Å; F519-R523 VanDerWaalsContact O-CB 3.26Å; F519-R523 WeakPolarHBondContact O-CB 3.46Å; F519-R523 PolarHBondContact O-N 2.92Å
520	Q	74.4	Confident	74.1	Confident	107 Å²	107	76.7 Å²	76.7	50%	0.5	39%	0.392	S	S	.	.	H	α-helix	trans	-65.9	-44.7	178.1	-75.2	179	3.1	0	0	112.3	T516 L517 T522 R523 D524	T516-Q520 WeakPolarHBondContact O-CG 3.18Å; T516-Q520 PolarHBondContact O-N 2.87Å; L517-Q520 PolarHBondContact O-N 3.38Å; Q520-T522 PolarHBondContact O-N 3.34Å; Q520-R523 PolarHBondContact O-N 3.34Å; Q520-D524 PolarHBondContact O-N 3.36Å
521	E	78.4	Confident	73.9	Confident	128 Å²	128	79.3 Å²	79.3	60%	0.598	41%	0.41	S	S	*	.	H	α-helix	trans	-59.9	-46.1	176	-71.6	179.5	166.7	0	0	111.5	L517 R523 D524 E525	L517-E521 PolarHBondContact O-N 2.86Å; E521-R523 VanDerWaalsContact C-N 3.3Å; E521-R523 PolarHBondContact O-N 2.89Å; E521-D524 PolarHBondContact O-N 2.98Å; E521-E525 WeakPolarHBondContact O-CG 3.29Å; E521-E525 PolarHBondContact O-N 3.19Å
522	T	74.9	Confident	74.2	Confident	15 Å²	15	74.9 Å²	74.9	9%	0.092	39%	0.393	C	S	.	.	H	α-helix	trans	-64.7	-36	177.7	-55.1	0	0	0	0	111.5	R506 L507 L510 I518 F519 Q520 F526	R506-T522 HydrophobicContact CG-CG2 4.14Å; L507-T522 HydrophobicContact CD2-CG2 3.95Å; L507-T522 HydrophobicContact CG-CG2 4.32Å; L510-T522 HydrophobicContact CD1-CG2 4.41Å; I518-T522 VanDerWaalsContact O-CB 3.26Å; I518-T522 WeakPolarHBondContact O-CB 3.26Å; I518-T522 PolarHBondContact O-N 3.44Å; I518-T522 PolarHBondContact O-OG1 3.24Å; F519-T522 PolarHBondContact O-N 3.23Å; Q520-T522 PolarHBondContact O-N 3.34Å; T522-F526 WeakPolarHBondContact O-CB 3.45Å; T522-F526 PolarHBondContact O-N 2.88Å
523	R	78.2	Confident	74	Confident	56 Å²	56	75 Å²	75	21%	0.211	39%	0.394	C	S	.	.	H	α-helix	trans	-69	-40.6	176.8	-167.2	172.6	81.1	162.2	2.3	111.6	L507 F519 Q520 E521 F526 R527	L507-R523 HydrophobicContact CD2-CB 4.06Å; F519-R523 VanDerWaalsContact O-CB 3.26Å; F519-R523 WeakPolarHBondContact O-CB 3.46Å; F519-R523 PolarHBondContact O-N 2.92Å; Q520-R523 PolarHBondContact O-N 3.34Å; E521-R523 VanDerWaalsContact C-N 3.3Å; E521-R523 PolarHBondContact O-N 2.89Å; R523-F526 PolarHBondContact O-N 3.36Å; R523-R527 WeakPolarHBondContact O-CB 3.34Å; R523-R527 VanDerWaalsContact O-CG 3.27Å; R523-R527 WeakPolarHBondContact O-CG 3.25Å; R523-R527 PolarHBondContact O-N 3.47Å
524	D	78.3	Confident	73.6	Confident	94 Å²	94	75.2 Å²	75.2	50%	0.503	39%	0.39	S	S	.	.	H	α-helix	trans	-67.1	-39.9	176.7	-73.1	-17.5	0	0	0	111.5	Q520 E521 F526 R527 Q528	Q520-D524 PolarHBondContact O-N 3.36Å; E521-D524 PolarHBondContact O-N 2.98Å; D524-F526 VanDerWaalsContact C-N 3.35Å; D524-F526 PolarHBondContact O-N 2.98Å; D524-R527 PolarHBondContact O-N 2.97Å; D524-Q528 WeakPolarHBondContact O-CB 3.4Å; D524-Q528 PolarHBondContact O-N 3.35Å
525	E	79.1	Confident	73.7	Confident	92 Å²	92	68.7 Å²	68.7	43%	0.43	36%	0.355	S	S	.	.	H	α-helix	trans	-61	-42.1	171	-74.3	-176.4	-179	0	0	112.3	K474 Y503 E521 Q528 F529	K474-E525 IonicContact NZ-OE2 2.74Å; K474-E525 PolarHBondContact NZ-OE2 3.39Å; Y503-E525 HydrophobicContact CE1-CB 4.37Å; E521-E525 WeakPolarHBondContact O-CG 3.29Å; E521-E525 PolarHBondContact O-N 3.19Å; E525-Q528 PolarHBondContact O-N 3.39Å; E525-F529 WeakPolarHBondContact O-CB 3.36Å; E525-F529 PolarHBondContact O-N 3.12Å
526	F	80.3	Confident	73.5	Confident	1 Å²	1	70.3 Å²	70.3	0%	0.004	36%	0.355	C	S	.	.	H	α-helix	trans	-63.3	-42.2	176	178.4	-119.8	0	0	0	111.5	T500 Y503 L504 L507 T522 R523 D524 Q528 F529 L530 L550 D558	T500-F526 HydrophobicContact CG2-CE2 4.23Å; T500-F526 HydrophobicContact CG2-CZ 4.29Å; Y503-F526 VanDerWaalsContact CB-CD2 3.43Å; Y503-F526 HydrophobicContact CD1-CB 3.89Å; Y503-F526 HydrophobicContact CD1-CD2 4.03Å; Y503-F526 HydrophobicContact CD1-CG 4.38Å; Y503-F526 AromaticContact CD2-CD2 3.87Å; Y503-F526 HydrophobicContact CD2-CD2 3.87Å; Y503-F526 HydrophobicContact CD2-CE2 4.45Å; Y503-F526 HydrophobicContact CE1-CB 4.27Å; Y503-F526 HydrophobicContact CG-CB 4.3Å; Y503-F526 AromaticContact CG-CD2 3.55Å; Y503-F526 HydrophobicContact CG-CD2 3.55Å; Y503-F526 HydrophobicContact CG-CE2 4.29Å; Y503-F526 HydrophobicContact CG-CG 4.3Å; L504-F526 HydrophobicContact CD2-CE1 4.31Å; L504-F526 HydrophobicContact CD2-CZ 4.2Å; L507-F526 HydrophobicContact CD1-CB 4.49Å; L507-F526 HydrophobicContact CD1-CD1 4.15Å; L507-F526 HydrophobicContact CD1-CG 4.41Å; T522-F526 WeakPolarHBondContact O-CB 3.45Å; T522-F526 PolarHBondContact O-N 2.88Å; R523-F526 PolarHBondContact O-N 3.36Å; D524-F526 VanDerWaalsContact C-N 3.35Å; D524-F526 PolarHBondContact O-N 2.98Å; F526-Q528 PolarHBondContact O-N 3.41Å; F526-F529 HydrophobicContact CD2-CD1 4.45Å; F526-F529 WeakPolarHBondContact O-CB 3.41Å; F526-F529 PolarHBondContact O-N 3.47Å; F526-L530 HydrophobicContact CD1-CD1 4.01Å; F526-L530 HydrophobicContact CD2-CG 4.41Å; F526-L530 HydrophobicContact CE1-CD1 3.52Å; F526-L530 HydrophobicContact CE1-CG 4.26Å; F526-L530 HydrophobicContact CE2-CD1 4.2Å; F526-L530 HydrophobicContact CE2-CD2 4.16Å; F526-L530 HydrophobicContact CE2-CG 4.08Å; F526-L530 HydrophobicContact CZ-CD1 3.63Å; F526-L530 HydrophobicContact CZ-CD2 4.14Å; F526-L530 HydrophobicContact CZ-CG 4Å; F526-L530 WeakPolarHBondContact O-CG 3.5Å; F526-L530 PolarHBondContact O-N 3.38Å; F526-L550 HydrophobicContact CE1-CD2 4.48Å; F526-L550 HydrophobicContact CZ-CD2 4.44Å; F526-D558 HydrophobicContact CE1-CB 4.41Å
527	R	78.6	Confident	73.1	Confident	52 Å²	52	70.6 Å²	70.6	20%	0.196	35%	0.352	C	S	.	.	H	α-helix	trans	-65.2	-38.6	175.5	-72.3	176.5	176.7	-162	-4.3	112.1	R523 D524 F529 L530 S531 D558 Y561	R523-R527 WeakPolarHBondContact O-CB 3.34Å; R523-R527 VanDerWaalsContact O-CG 3.27Å; R523-R527 WeakPolarHBondContact O-CG 3.25Å; R523-R527 PolarHBondContact O-N 3.47Å; D524-R527 PolarHBondContact O-N 2.97Å; R527-F529 VanDerWaalsContact C-N 3.34Å; R527-L530 PolarHBondContact O-N 3.07Å; R527-S531 WeakPolarHBondContact O-CB 3.05Å; R527-S531 PolarHBondContact O-N 2.87Å; R527-S531 PolarHBondContact O-OG 3.3Å; R527-D558 IonicContact CZ-OD1 2.95Å; R527-D558 IonicContact NE-OD1 3.83Å; R527-D558 PolarHBondContact NE-OD1 3.25Å; R527-D558 IonicContact NH2-OD1 3.24Å; R527-D558 PolarHBondContact NH2-OD1 3.35Å; R527-Y561 HydrophobicContact CB-CD1 4.27Å; R527-Y561 HydrophobicContact CB-CE1 3.59Å; R527-Y561 HydrophobicContact CB-CE2 4.45Å; R527-Y561 HydrophobicContact CG-CD1 3.74Å; R527-Y561 HydrophobicContact CG-CE1 3.59Å; R527-Y561 HydrophobicContact CG-CE2 4.37Å; R527-Y561 HydrophobicContact CG-CG 4.21Å; R527-Y561 PolarHBondContact O-OH 2.81Å
528	Q	79.3	Confident	72.4	Confident	144 Å²	144	65.1 Å²	65.1	67%	0.673	33%	0.325	S	S	*	.	H	α-helix	trans	-65	-39.2	173	-167.9	175.9	16	0	0	111.8	D524 E525 F526 S531 S532	D524-Q528 WeakPolarHBondContact O-CB 3.4Å; D524-Q528 PolarHBondContact O-N 3.35Å; E525-Q528 PolarHBondContact O-N 3.39Å; F526-Q528 PolarHBondContact O-N 3.41Å; Q528-S531 WeakPolarHBondContact CA-OG 3.01Å; Q528-S531 PolarHBondContact O-N 2.89Å; Q528-S531 PolarHBondContact O-OG 3.04Å; Q528-S531 VanDerWaalsContact O-OG 3.11Å; Q528-S532 PolarHBondContact O-N 3.14Å
529	F	79	Confident	71.9	Confident	11 Å²	11	61.6 Å²	61.6	5%	0.048	31%	0.306	C	S	.	.	H	α-helix	trans	-61.5	-48	173.9	173.4	-103.9	0	0	0	111.6	L478 L481 V496 L499 Y503 E525 F526 R527 S531 S532 H535	L478-F529 HydrophobicContact CD2-CD2 3.87Å; L478-F529 HydrophobicContact CD2-CE2 4.02Å; L481-F529 HydrophobicContact CD2-CE2 3.82Å; L481-F529 HydrophobicContact CD2-CZ 4.48Å; V496-F529 HydrophobicContact CG1-CE1 4.42Å; V496-F529 HydrophobicContact CG1-CZ 4.2Å; V496-F529 HydrophobicContact CG2-CZ 4.31Å; L499-F529 HydrophobicContact CB-CE1 4.4Å; L499-F529 HydrophobicContact CB-CZ 3.95Å; L499-F529 HydrophobicContact CD1-CE2 3.92Å; L499-F529 HydrophobicContact CD1-CZ 4Å; Y503-F529 HydrophobicContact CD2-CD1 4.36Å; Y503-F529 HydrophobicContact CE2-CB 4.32Å; Y503-F529 HydrophobicContact CE2-CD1 4.11Å; Y503-F529 HydrophobicContact CE2-CD2 4.42Å; Y503-F529 HydrophobicContact CE2-CG 4.03Å; E525-F529 WeakPolarHBondContact O-CB 3.36Å; E525-F529 PolarHBondContact O-N 3.12Å; F526-F529 HydrophobicContact CD2-CD1 4.45Å; F526-F529 WeakPolarHBondContact O-CB 3.41Å; F526-F529 PolarHBondContact O-N 3.47Å; R527-F529 VanDerWaalsContact C-N 3.34Å; F529-S531 VanDerWaalsContact C-N 3.32Å; F529-S531 PolarHBondContact O-N 3.28Å; F529-S532 WeakPolarHBondContact O-CB 3.4Å; F529-S532 PolarHBondContact O-N 2.77Å; F529-S532 PolarHBondContact O-OG 3.07Å; F529-H535 AromaticContact CD2-CD2 3.89Å; F529-H535 AromaticContact CE2-CD2 3.58Å; F529-H535 AromaticContact CE2-NE2 3.87Å
530	L	74.1	Confident	71.3	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-64.4	-32.2	178.2	-70.3	179.5	0	0	0	113.5	F526 R527 L539 Y561 F562 V565	F526-L530 HydrophobicContact CD1-CD1 4.01Å; F526-L530 HydrophobicContact CD2-CG 4.41Å; F526-L530 HydrophobicContact CE1-CD1 3.52Å; F526-L530 HydrophobicContact CE1-CG 4.26Å; F526-L530 HydrophobicContact CE2-CD1 4.2Å; F526-L530 HydrophobicContact CE2-CD2 4.16Å; F526-L530 HydrophobicContact CE2-CG 4.08Å; F526-L530 HydrophobicContact CZ-CD1 3.63Å; F526-L530 HydrophobicContact CZ-CD2 4.14Å; F526-L530 HydrophobicContact CZ-CG 4Å; F526-L530 WeakPolarHBondContact O-CG 3.5Å; F526-L530 PolarHBondContact O-N 3.38Å; R527-L530 PolarHBondContact O-N 3.07Å; L530-L539 HydrophobicContact CD2-CD1 4.5Å; L530-Y561 HydrophobicContact CB-CE1 4.37Å; L530-Y561 HydrophobicContact CD1-CD1 4.29Å; L530-F562 HydrophobicContact CD1-CB 4.41Å; L530-F562 HydrophobicContact CD1-CD2 4.1Å; L530-F562 HydrophobicContact CD2-CD2 3.86Å; L530-F562 HydrophobicContact CD2-CE2 4.1Å; L530-F562 HydrophobicContact CG-CD2 4.48Å; L530-V565 WeakPolarHBondContact O-CG1 3.39Å
531	S	71.1	Confident	70.9	Confident	61 Å²	61	65 Å²	65	43%	0.427	33%	0.325	S	S	.	.	H	α-helix	trans	-84.6	-6.2	-179.5	55.1	0	0	0	0	114.5	R527 Q528 F529	R527-S531 WeakPolarHBondContact O-CB 3.05Å; R527-S531 PolarHBondContact O-N 2.87Å; R527-S531 PolarHBondContact O-OG 3.3Å; Q528-S531 WeakPolarHBondContact CA-OG 3.01Å; Q528-S531 PolarHBondContact O-N 2.89Å; Q528-S531 PolarHBondContact O-OG 3.04Å; Q528-S531 VanDerWaalsContact O-OG 3.11Å; F529-S531 VanDerWaalsContact C-N 3.32Å; F529-S531 PolarHBondContact O-N 3.28Å
532	S	75.9	Confident	70.3	Confident	33 Å²	33	61 Å²	61	23%	0.231	31%	0.307	C	S	.	.			trans	-68.9	134	-178.8	69.9	0	0	0	0	113	Q528 F529 K534 H535 R536	Q528-S532 PolarHBondContact O-N 3.14Å; F529-S532 WeakPolarHBondContact O-CB 3.4Å; F529-S532 PolarHBondContact O-N 2.77Å; F529-S532 PolarHBondContact O-OG 3.07Å; S532-K534 VanDerWaalsContact C-N 3.3Å; S532-K534 PolarHBondContact O-N 3.11Å; S532-H535 PolarHBondContact O-N 2.92Å; S532-H535 PolarHBondContact OG-CD2 2.67Å; S532-R536 PolarHBondContact O-N 2.65Å
533	S	60.2	Low	70.2	Confident	102 Å²	102	65 Å²	65	71%	0.713	32%	0.321	S	S	*	.	H	α-helix	trans	-65.3	-28.9	-172.5	60.7	0	0	0	0	114.2	H535	S533-H535 VanDerWaalsContact C-N 3.29Å; S533-H535 PolarHBondContact O-N 3.31Å
534	K	61.2	Low	70	Confident	111 Å²	111	63.9 Å²	63.9	48%	0.483	33%	0.327	S	S	.	.	H	α-helix	trans	-68.9	-26.9	179.3	-68.4	-174.5	179.9	179.8	0	113	S532	S532-K534 VanDerWaalsContact C-N 3.3Å; S532-K534 PolarHBondContact O-N 3.11Å
535	H	63	Low	69.8	Low	13 Å²	13	62.6 Å²	62.6	6%	0.06	32%	0.322	C	S	.	.	H	α-helix	trans	-96.9	-19.6	-175.8	-53.8	-28.7	0	0	0	111.7	L481 V496 F529 S532 S533 D537 C538 L539	L481-H535 WeakPolarHBondContact CD2-CE1 3.49Å; L481-H535 WeakPolarHBondContact CD2-NE2 3.38Å; V496-H535 HydrophobicContact CG2-CB 4.5Å; F529-H535 AromaticContact CD2-CD2 3.89Å; F529-H535 AromaticContact CE2-CD2 3.58Å; F529-H535 AromaticContact CE2-NE2 3.87Å; S532-H535 PolarHBondContact O-N 2.92Å; S532-H535 PolarHBondContact OG-CD2 2.67Å; S533-H535 VanDerWaalsContact C-N 3.29Å; S533-H535 PolarHBondContact O-N 3.31Å; H535-D537 VanDerWaalsContact C-N 3.33Å; H535-D537 PolarHBondContact O-N 2.96Å; H535-C538 PolarHBondContact O-N 3.08Å; H535-L539 HydrophobicContact CB-CD1 3.85Å; H535-L539 HydrophobicContact CB-CG 4.24Å; H535-L539 WeakPolarHBondContact O-CB 3.49Å; H535-L539 WeakPolarHBondContact O-CG 3.33Å; H535-L539 PolarHBondContact O-N 3.21Å
536	R	63	Low	69.6	Low	116 Å²	116	58.2 Å²	58.2	44%	0.438	30%	0.302	S	S	.	.	H	α-helix	trans	-52.1	-44.1	-176.3	-156.5	179.6	81.4	117.1	2.5	114.2	S532 C538 L539 F540	S532-R536 PolarHBondContact O-N 2.65Å; R536-C538 PolarHBondContact O-N 3.32Å; R536-L539 PolarHBondContact O-N 3.27Å; R536-F540 WeakPolarHBondContact O-CB 3.41Å; R536-F540 PolarHBondContact O-N 3.43Å
537	D	62.1	Low	69.3	Low	107 Å²	107	58.4 Å²	58.4	57%	0.572	30%	0.303	S	S	*	.	H	α-helix	trans	-70.3	-32.3	-179.8	-64.5	-15.6	0	0	0	112.5	H535 N541	H535-D537 VanDerWaalsContact C-N 3.33Å; H535-D537 PolarHBondContact O-N 2.96Å; D537-N541 PolarHBondContact O-N 2.68Å; D537-N541 PolarHBondContact O-ND2 3.41Å; D537-N541 VanDerWaalsContact O-ND2 3.15Å
538	C	60.5	Low	69.2	Low	13 Å²	13	61.4 Å²	61.4	9%	0.088	32%	0.323	C	S	.	.	H	α-helix	trans	-77.1	-37.2	176.2	-66.2	0	0	0	0	111.6	I492 H535 R536 N541 N542	I492-C538 HydrophobicContact CG2-CB 4.16Å; I492-C538 WeakPolarHBondContact CG2-SG 3.4Å; H535-C538 PolarHBondContact O-N 3.08Å; R536-C538 PolarHBondContact O-N 3.32Å; C538-N541 PolarHBondContact O-N 3.23Å; C538-N542 PolarHBondContact O-N 2.91Å; C538-N542 PolarHBondContact O-ND2 3.48Å
539	L	62.7	Low	69	Low	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-66.5	-37.7	175.3	-64.5	167.4	0	0	0	111	V496 L530 H535 R536 N541 N542 R543 I546 F562 M566	V496-L539 HydrophobicContact CG1-CD2 3.53Å; V496-L539 HydrophobicContact CG1-CG 4.34Å; L530-L539 HydrophobicContact CD2-CD1 4.5Å; H535-L539 HydrophobicContact CB-CD1 3.85Å; H535-L539 HydrophobicContact CB-CG 4.24Å; H535-L539 WeakPolarHBondContact O-CB 3.49Å; H535-L539 WeakPolarHBondContact O-CG 3.33Å; H535-L539 PolarHBondContact O-N 3.21Å; R536-L539 PolarHBondContact O-N 3.27Å; L539-N541 PolarHBondContact O-N 2.75Å; L539-N542 CarbonylContact O-C 3.6Å; L539-N542 PolarHBondContact O-N 3.4Å; L539-R543 PolarHBondContact O-N 2.97Å; L539-R543 VanDerWaalsContact O-N 3.07Å; L539-I546 HydrophobicContact CB-CD1 4.46Å; L539-I546 HydrophobicContact CD2-CD1 3.19Å; L539-I546 HydrophobicContact CG-CD1 4.39Å; L539-F562 HydrophobicContact CB-CE2 4.45Å; L539-F562 HydrophobicContact CD2-CE2 4.27Å; L539-M566 HydrophobicContact CB-CE 3.28Å; L539-M566 HydrophobicContact CB-SD 3.7Å; L539-M566 HydrophobicContact CD1-CE 3.43Å; L539-M566 VanDerWaalsContact CD1-CE 3.43Å; L539-M566 HydrophobicContact CG-CE 3.93Å
540	F	63.2	Low	68.9	Low	102 Å²	102	55.8 Å²	55.8	45%	0.447	30%	0.298	S	S	.	.	H	α-helix	trans	-63.4	-39.7	176.9	-174.9	-96.5	0	0	0	113.3	R536 R543	R536-F540 WeakPolarHBondContact O-CB 3.41Å; R536-F540 PolarHBondContact O-N 3.43Å; F540-R543 PolarHBondContact O-NE 2.93Å; F540-R543 VanDerWaalsContact O-NE 3.1Å; F540-R543 PolarHBondContact O-NH2 3.4Å
541	N	66.6	Low	68.9	Low	112 Å²	112	58.7 Å²	58.7	60%	0.599	32%	0.322	S	S	*	.	H	α-helix	trans	-72.5	-32.1	178.6	-69.8	-26.6	0	0	0	112.1	D537 C538 L539	D537-N541 PolarHBondContact O-N 2.68Å; D537-N541 PolarHBondContact O-ND2 3.41Å; D537-N541 VanDerWaalsContact O-ND2 3.15Å; C538-N541 PolarHBondContact O-N 3.23Å; L539-N541 PolarHBondContact O-N 2.75Å
542	N	66.1	Low	69.2	Low	44 Å²	44	60 Å²	60	24%	0.235	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	32	-177.9	-58	-66	0	0	0	112.6	T493 C538 L539 G544 T545 I546	T493-N542 WeakPolarHBondContact CG2-ND2 3.23Å; T493-N542 PolarHBondContact OG1-ND2 3.5Å; C538-N542 PolarHBondContact O-N 2.91Å; C538-N542 PolarHBondContact O-ND2 3.48Å; L539-N542 CarbonylContact O-C 3.6Å; L539-N542 PolarHBondContact O-N 3.4Å; N542-G544 VanDerWaalsContact C-N 3.25Å; N542-G544 PolarHBondContact O-N 2.63Å; N542-T545 PolarHBondContact O-N 3.22Å; N542-T545 PolarHBondContact O-OG1 3.47Å; N542-I546 PolarHBondContact O-N 2.87Å
543	R	71.6	Confident	68.7	Low	100 Å²	100	61.4 Å²	61.4	38%	0.377	33%	0.334	S	S	.	.	H	α-helix	trans	-56.3	-41.5	-177.8	74.2	-174.7	80.6	175.6	6.1	112.1	L539 F540 I546 Y547	L539-R543 PolarHBondContact O-N 2.97Å; L539-R543 VanDerWaalsContact O-N 3.07Å; F540-R543 PolarHBondContact O-NE 2.93Å; F540-R543 VanDerWaalsContact O-NE 3.1Å; F540-R543 PolarHBondContact O-NH2 3.4Å; R543-I546 PolarHBondContact O-N 3.29Å; R543-Y547 HydrophobicContact CB-CD2 4.2Å; R543-Y547 HydrophobicContact CB-CE2 4.08Å; R543-Y547 WeakPolarHBondContact O-CB 3.37Å; R543-Y547 WeakPolarHBondContact O-CD2 3.43Å; R543-Y547 PolarHBondContact O-N 3.34Å
544	G	73.6	Confident	68.9	Low	33 Å²	33	59.1 Å²	59.1	34%	0.34	33%	0.326	S	S	.	.	H	α-helix	trans	-61.4	-50.3	-175.8	0	0	0	0	0	112.8	N542 I546 Y547 D548	N542-G544 VanDerWaalsContact C-N 3.25Å; N542-G544 PolarHBondContact O-N 2.63Å; G544-I546 VanDerWaalsContact C-N 3.35Å; G544-I546 PolarHBondContact O-N 3.27Å; G544-Y547 WeakPolarHBondContact O-CB 3.42Å; G544-Y547 PolarHBondContact O-N 3.47Å; G544-D548 PolarHBondContact O-N 3.28Å
545	T	74	Confident	69.1	Low	66 Å²	66	55 Å²	55	41%	0.405	31%	0.31	S	S	.	.	H	α-helix	trans	-65.6	-37.9	-178.3	52.4	0	0	0	0	112.2	N542 D548 L549	N542-T545 PolarHBondContact O-N 3.22Å; N542-T545 PolarHBondContact O-OG1 3.47Å; T545-D548 PolarHBondContact O-N 3.47Å; T545-L549 VanDerWaalsContact O-CG 3.27Å; T545-L549 WeakPolarHBondContact O-CG 3.38Å; T545-L549 PolarHBondContact O-N 2.72Å
546	I	74.8	Confident	69.3	Low	1 Å²	1	57.2 Å²	57.2	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-70.1	-37.3	177.5	-62	176.3	0	0	0	110.9	T500 L539 N542 R543 G544 L549 L550 F562	T500-I546 HydrophobicContact CG2-CG2 4.39Å; L539-I546 HydrophobicContact CB-CD1 4.46Å; L539-I546 HydrophobicContact CD2-CD1 3.19Å; L539-I546 HydrophobicContact CG-CD1 4.39Å; N542-I546 PolarHBondContact O-N 2.87Å; R543-I546 PolarHBondContact O-N 3.29Å; G544-I546 VanDerWaalsContact C-N 3.35Å; G544-I546 PolarHBondContact O-N 3.27Å; I546-L549 PolarHBondContact O-N 3.48Å; I546-L550 HydrophobicContact CG2-CD1 3.84Å; I546-L550 HydrophobicContact CG2-CG 4.32Å; I546-L550 WeakPolarHBondContact O-CB 3.26Å; I546-L550 VanDerWaalsContact O-CG 3.25Å; I546-L550 WeakPolarHBondContact O-CG 3.49Å; I546-L550 PolarHBondContact O-N 2.93Å; I546-F562 HydrophobicContact CB-CE1 4.23Å; I546-F562 HydrophobicContact CB-CZ 3.9Å; I546-F562 HydrophobicContact CD1-CE2 4.37Å; I546-F562 HydrophobicContact CD1-CZ 4.11Å; I546-F562 HydrophobicContact CG2-CD1 4.33Å; I546-F562 HydrophobicContact CG2-CD2 4.28Å; I546-F562 HydrophobicContact CG2-CE1 3.81Å; I546-F562 HydrophobicContact CG2-CE2 3.75Å; I546-F562 HydrophobicContact CG2-CZ 3.49Å; I546-F562 VanDerWaalsContact CG2-CZ 3.49Å
547	Y	74.9	Confident	69.6	Low	5 Å²	5	56.6 Å²	56.6	2%	0.02	33%	0.329	C	S	.	.	H	α-helix	trans	-63.2	-42	172.1	-80.5	-58.1	0	0	0	112.5	R543 G544 L549 L550 A551 M559 F562 S563 R571	R543-Y547 HydrophobicContact CB-CD2 4.2Å; R543-Y547 HydrophobicContact CB-CE2 4.08Å; R543-Y547 WeakPolarHBondContact O-CB 3.37Å; R543-Y547 WeakPolarHBondContact O-CD2 3.43Å; R543-Y547 PolarHBondContact O-N 3.34Å; G544-Y547 WeakPolarHBondContact O-CB 3.42Å; G544-Y547 PolarHBondContact O-N 3.47Å; Y547-L549 VanDerWaalsContact C-N 3.34Å; Y547-L550 PolarHBondContact O-N 3.29Å; Y547-A551 VanDerWaalsContact O-CB 3.24Å; Y547-A551 WeakPolarHBondContact O-CB 3.39Å; Y547-A551 PolarHBondContact O-N 3.19Å; Y547-M559 HydrophobicContact CD1-CG 4.14Å; Y547-M559 HydrophobicContact CE1-CG 4.2Å; Y547-F562 HydrophobicContact CD1-CD1 4.13Å; Y547-F562 HydrophobicContact CD1-CE1 4.33Å; Y547-F562 HydrophobicContact CD2-CE1 4.31Å; Y547-F562 AromaticContact CE1-CD1 3.6Å; Y547-F562 HydrophobicContact CE1-CD1 3.6Å; Y547-F562 AromaticContact CE1-CE1 3.99Å; Y547-F562 HydrophobicContact CE1-CE1 3.99Å; Y547-F562 HydrophobicContact CE2-CD1 4.37Å; Y547-F562 AromaticContact CE2-CE1 3.97Å; Y547-F562 HydrophobicContact CE2-CE1 3.97Å; Y547-F562 HydrophobicContact CG-CE1 4.45Å; Y547-F562 AromaticContact CZ-CD1 3.72Å; Y547-F562 AromaticContact CZ-CE1 3.78Å; Y547-S563 VanDerWaalsContact CE1-OG 3.23Å; Y547-S563 WeakPolarHBondContact CE1-OG 3.37Å; Y547-S563 WeakPolarHBondContact OH-CA 3.5Å; Y547-S563 WeakPolarHBondContact OH-CB 3.3Å; Y547-S563 PolarHBondContact OH-OG 2.86Å; Y547-R571 VanDerWaalsContact CB-NH1 3.33Å
548	D	76.2	Confident	69.9	Low	115 Å²	115	51.5 Å²	51.5	62%	0.615	30%	0.302	S	S	*	.	H	α-helix	trans	-64.7	-39.6	177.3	-64.3	-24.7	0	0	0	111.2	G544 T545 A551 S552	G544-D548 PolarHBondContact O-N 3.28Å; T545-D548 PolarHBondContact O-N 3.47Å; D548-A551 PolarHBondContact O-N 3Å; D548-S552 WeakPolarHBondContact O-CB 3.39Å; D548-S552 PolarHBondContact O-N 3.35Å; D548-S552 PolarHBondContact O-OG 2.87Å
549	L	75.5	Confident	70.4	Confident	34 Å²	34	53.1 Å²	53.1	18%	0.178	31%	0.309	C	S	.	.	H	α-helix	trans	-65.6	-44.8	173.8	-71.4	171.6	0	0	0	112.2	T497 L504 T545 I546 Y547 A551 S552 H553	T497-L549 HydrophobicContact CG2-CD1 3.94Å; L504-L549 HydrophobicContact CD1-CB 4.16Å; T545-L549 VanDerWaalsContact O-CG 3.27Å; T545-L549 WeakPolarHBondContact O-CG 3.38Å; T545-L549 PolarHBondContact O-N 2.72Å; I546-L549 PolarHBondContact O-N 3.48Å; Y547-L549 VanDerWaalsContact C-N 3.34Å; L549-A551 VanDerWaalsContact C-N 3.3Å; L549-A551 PolarHBondContact O-N 3.22Å; L549-S552 PolarHBondContact O-N 3.01Å; L549-S552 PolarHBondContact O-OG 3.26Å; L549-H553 PolarHBondContact O-CD2 3.12Å; L549-H553 VanDerWaalsContact O-CD2 3.24Å; L549-H553 PolarHBondContact O-N 3.04Å
550	L	75.8	Confident	70.8	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-63.9	-38.8	176.9	-73.3	166.3	0	0	0	111.5	L504 F526 I546 Y547 H553 G554 M559 F562	L504-L550 HydrophobicContact CD1-CD2 4.08Å; L504-L550 HydrophobicContact CD1-CG 4.47Å; L504-L550 HydrophobicContact CD2-CD2 3.73Å; L504-L550 HydrophobicContact CG-CD2 4.5Å; F526-L550 HydrophobicContact CE1-CD2 4.48Å; F526-L550 HydrophobicContact CZ-CD2 4.44Å; I546-L550 HydrophobicContact CG2-CD1 3.84Å; I546-L550 HydrophobicContact CG2-CG 4.32Å; I546-L550 WeakPolarHBondContact O-CB 3.26Å; I546-L550 VanDerWaalsContact O-CG 3.25Å; I546-L550 WeakPolarHBondContact O-CG 3.49Å; I546-L550 PolarHBondContact O-N 2.93Å; Y547-L550 PolarHBondContact O-N 3.29Å; L550-H553 PolarHBondContact O-N 3.43Å; L550-G554 PolarHBondContact O-N 3.31Å; L550-M559 HydrophobicContact CB-CB 4.45Å; L550-F562 HydrophobicContact CD1-CB 3.91Å; L550-F562 HydrophobicContact CD1-CD1 3.87Å; L550-F562 HydrophobicContact CD1-CG 3.88Å
551	A	76.1	Confident	71.2	Confident	63 Å²	63	52.1 Å²	52.1	52%	0.521	30%	0.304	S	S	.	.	H	α-helix	trans	-67.3	-39.4	176.5	0	0	0	0	0	112.2	Y547 D548 L549 H553 G554	Y547-A551 VanDerWaalsContact O-CB 3.24Å; Y547-A551 WeakPolarHBondContact O-CB 3.39Å; Y547-A551 PolarHBondContact O-N 3.19Å; D548-A551 PolarHBondContact O-N 3Å; L549-A551 VanDerWaalsContact C-N 3.3Å; L549-A551 PolarHBondContact O-N 3.22Å; A551-H553 VanDerWaalsContact C-N 3.27Å; A551-H553 PolarHBondContact O-N 3.15Å; A551-G554 PolarHBondContact O-N 3.3Å
552	S	75.6	Confident	71.5	Confident	88 Å²	88	46.8 Å²	46.8	62%	0.615	28%	0.276	S	S	*	.	H	α-helix	trans	-66.6	-29.3	178.4	63.5	0	0	0	0	113.2	D548 L549	D548-S552 WeakPolarHBondContact O-CB 3.39Å; D548-S552 PolarHBondContact O-N 3.35Å; D548-S552 PolarHBondContact O-OG 2.87Å; L549-S552 PolarHBondContact O-N 3.01Å; L549-S552 PolarHBondContact O-OG 3.26Å
553	H	66.3	Low	71.7	Confident	62 Å²	62	44.9 Å²	44.9	29%	0.287	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-6.2	175.7	-77.5	-81.5	0	0	0	113.9	L504 N505 L549 L550 A551 N555	L504-H553 HydrophobicContact CB-CB 4.49Å; N505-H553 PolarHBondContact OD1-CE1 3.12Å; N505-H553 VanDerWaalsContact OD1-CE1 3.23Å; L549-H553 PolarHBondContact O-CD2 3.12Å; L549-H553 VanDerWaalsContact O-CD2 3.24Å; L549-H553 PolarHBondContact O-N 3.04Å; L550-H553 PolarHBondContact O-N 3.43Å; A551-H553 VanDerWaalsContact C-N 3.27Å; A551-H553 PolarHBondContact O-N 3.15Å; H553-N555 VanDerWaalsContact C-N 3.26Å; H553-N555 PolarHBondContact O-N 2.6Å
554	G	63.5	Low	71.7	Confident	54 Å²	54	43 Å²	43	56%	0.557	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	11.5	174.8	0	0	0	0	0	115.5	L550 A551 V556	L550-G554 PolarHBondContact O-N 3.31Å; A551-G554 PolarHBondContact O-N 3.3Å; G554-V556 PolarHBondContact O-N 3.31Å
555	N	66.3	Low	71.6	Confident	25 Å²	25	43 Å²	43	13%	0.134	26%	0.258	C	S	.	.			trans	-90.2	89.3	-175.2	-166.5	-18.7	0	0	0	111.7	H553 D558 M559	H553-N555 VanDerWaalsContact C-N 3.26Å; H553-N555 PolarHBondContact O-N 2.6Å; N555-D558 PolarHBondContact ND2-OD2 2.94Å; N555-D558 PolarHBondContact OD1-N 3.45Å; N555-D558 PolarHBondContact OD1-OD2 2.9Å; N555-M559 WeakPolarHBondContact O-CB 3.34Å; N555-M559 PolarHBondContact O-N 2.88Å; N555-M559 VanDerWaalsContact O-N 3.16Å
556	V	66.6	Low	71.2	Confident	60 Å²	60	40.4 Å²	40.4	36%	0.364	24%	0.242	S	C	.	.	H	α-helix	trans	-68.2	-38.4	-173.8	-178.9	0	0	0	0	112.5	G554 M559 V560 H575	G554-V556 PolarHBondContact O-N 3.31Å; V556-M559 HydrophobicContact CG1-CE 4.49Å; V556-M559 WeakPolarHBondContact O-CB 3.39Å; V556-M559 PolarHBondContact O-N 3.27Å; V556-V560 WeakPolarHBondContact O-CG2 3.33Å; V556-V560 PolarHBondContact O-N 3.01Å; V556-H575 WeakPolarHBondContact CG1-NE2 3.12Å
557	D	69	Low	70.9	Confident	102 Å²	102	46 Å²	46	55%	0.545	27%	0.268	S	S	.	.	H	α-helix	trans	-68.6	-41.6	-178.6	-76.8	-17.2	0	0	0	112.3	M559 V560 Y561	D557-M559 VanDerWaalsContact C-N 3.32Å; D557-V560 PolarHBondContact O-N 3.47Å; D557-Y561 PolarHBondContact O-N 3.32Å
558	D	70.3	Confident	70.7	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-75.5	-25	178	-67.9	-32	0	0	0	111.7	F526 R527 N555 Y561 F562	F526-D558 HydrophobicContact CE1-CB 4.41Å; R527-D558 IonicContact CZ-OD1 2.95Å; R527-D558 IonicContact NE-OD1 3.83Å; R527-D558 PolarHBondContact NE-OD1 3.25Å; R527-D558 IonicContact NH2-OD1 3.24Å; R527-D558 PolarHBondContact NH2-OD1 3.35Å; N555-D558 PolarHBondContact ND2-OD2 2.94Å; N555-D558 PolarHBondContact OD1-N 3.45Å; N555-D558 PolarHBondContact OD1-OD2 2.9Å; D558-Y561 PolarHBondContact O-N 3.11Å; D558-F562 VanDerWaalsContact O-CB 3.28Å; D558-F562 WeakPolarHBondContact O-CB 3.43Å; D558-F562 PolarHBondContact O-N 3.43Å
559	M	71.1	Confident	70.3	Confident	47 Å²	47	42.6 Å²	42.6	23%	0.232	25%	0.249	C	C	.	.	H	α-helix	trans	-65.8	-41.8	167.6	-174.8	-175.3	65.5	0	0	112.3	Y547 L550 N555 V556 D557 F562 S563	Y547-M559 HydrophobicContact CD1-CG 4.14Å; Y547-M559 HydrophobicContact CE1-CG 4.2Å; L550-M559 HydrophobicContact CB-CB 4.45Å; N555-M559 WeakPolarHBondContact O-CB 3.34Å; N555-M559 PolarHBondContact O-N 2.88Å; N555-M559 VanDerWaalsContact O-N 3.16Å; V556-M559 HydrophobicContact CG1-CE 4.49Å; V556-M559 WeakPolarHBondContact O-CB 3.39Å; V556-M559 PolarHBondContact O-N 3.27Å; D557-M559 VanDerWaalsContact C-N 3.32Å; M559-F562 PolarHBondContact O-N 2.98Å; M559-S563 WeakPolarHBondContact O-CB 3.38Å; M559-S563 PolarHBondContact O-N 3.23Å; M559-S563 PolarHBondContact O-OG 3.48Å
560	V	71.1	Confident	70.1	Confident	15 Å²	15	44.8 Å²	44.8	9%	0.091	26%	0.258	C	S	.	.	H	α-helix	trans	-64.8	-45.2	174.1	173.5	0	0	0	0	110.2	V556 D557 F562 S563 V564 H575	V556-V560 WeakPolarHBondContact O-CG2 3.33Å; V556-V560 PolarHBondContact O-N 3.01Å; D557-V560 PolarHBondContact O-N 3.47Å; V560-F562 PolarHBondContact O-N 2.71Å; V560-S563 PolarHBondContact O-N 3.35Å; V560-V564 WeakPolarHBondContact O-CG2 3.28Å; V560-V564 PolarHBondContact O-N 2.85Å; V560-H575 WeakPolarHBondContact CG2-ND1 3.19Å
561	Y	71.2	Confident	69.8	Low	67 Å²	67	50.4 Å²	50.4	26%	0.263	28%	0.279	S	S	.	.	H	α-helix	trans	-58.3	-48.9	175.5	-179.3	-95.3	0	0	0	111.9	R527 L530 D557 D558 S563 V564 V565	R527-Y561 HydrophobicContact CB-CD1 4.27Å; R527-Y561 HydrophobicContact CB-CE1 3.59Å; R527-Y561 HydrophobicContact CB-CE2 4.45Å; R527-Y561 HydrophobicContact CG-CD1 3.74Å; R527-Y561 HydrophobicContact CG-CE1 3.59Å; R527-Y561 HydrophobicContact CG-CE2 4.37Å; R527-Y561 HydrophobicContact CG-CG 4.21Å; R527-Y561 PolarHBondContact O-OH 2.81Å; L530-Y561 HydrophobicContact CB-CE1 4.37Å; L530-Y561 HydrophobicContact CD1-CD1 4.29Å; D557-Y561 PolarHBondContact O-N 3.32Å; D558-Y561 PolarHBondContact O-N 3.11Å; Y561-S563 VanDerWaalsContact C-N 3.29Å; Y561-S563 PolarHBondContact O-N 3.5Å; Y561-V564 PolarHBondContact O-N 2.97Å; Y561-V565 HydrophobicContact CD1-CG2 4.09Å; Y561-V565 HydrophobicContact CE1-CG2 3.67Å; Y561-V565 HydrophobicContact CE2-CG2 4.33Å; Y561-V565 WeakPolarHBondContact O-CG2 3.27Å; Y561-V565 PolarHBondContact O-N 3.48Å
562	F	71.8	Confident	69.6	Low	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-58.2	-41.9	177	179.7	-106.1	0	0	0	112	L530 L539 I546 Y547 L550 D558 M559 V560 V564 V565 M566	L530-F562 HydrophobicContact CD1-CB 4.41Å; L530-F562 HydrophobicContact CD1-CD2 4.1Å; L530-F562 HydrophobicContact CD2-CD2 3.86Å; L530-F562 HydrophobicContact CD2-CE2 4.1Å; L530-F562 HydrophobicContact CG-CD2 4.48Å; L539-F562 HydrophobicContact CB-CE2 4.45Å; L539-F562 HydrophobicContact CD2-CE2 4.27Å; I546-F562 HydrophobicContact CB-CE1 4.23Å; I546-F562 HydrophobicContact CB-CZ 3.9Å; I546-F562 HydrophobicContact CD1-CE2 4.37Å; I546-F562 HydrophobicContact CD1-CZ 4.11Å; I546-F562 HydrophobicContact CG2-CD1 4.33Å; I546-F562 HydrophobicContact CG2-CD2 4.28Å; I546-F562 HydrophobicContact CG2-CE1 3.81Å; I546-F562 HydrophobicContact CG2-CE2 3.75Å; I546-F562 HydrophobicContact CG2-CZ 3.49Å; I546-F562 VanDerWaalsContact CG2-CZ 3.49Å; Y547-F562 HydrophobicContact CD1-CD1 4.13Å; Y547-F562 HydrophobicContact CD1-CE1 4.33Å; Y547-F562 HydrophobicContact CD2-CE1 4.31Å; Y547-F562 AromaticContact CE1-CD1 3.6Å; Y547-F562 HydrophobicContact CE1-CD1 3.6Å; Y547-F562 AromaticContact CE1-CE1 3.99Å; Y547-F562 HydrophobicContact CE1-CE1 3.99Å; Y547-F562 HydrophobicContact CE2-CD1 4.37Å; Y547-F562 AromaticContact CE2-CE1 3.97Å; Y547-F562 HydrophobicContact CE2-CE1 3.97Å; Y547-F562 HydrophobicContact CG-CE1 4.45Å; Y547-F562 AromaticContact CZ-CD1 3.72Å; Y547-F562 AromaticContact CZ-CE1 3.78Å; L550-F562 HydrophobicContact CD1-CB 3.91Å; L550-F562 HydrophobicContact CD1-CD1 3.87Å; L550-F562 HydrophobicContact CD1-CG 3.88Å; D558-F562 VanDerWaalsContact O-CB 3.28Å; D558-F562 WeakPolarHBondContact O-CB 3.43Å; D558-F562 PolarHBondContact O-N 3.43Å; M559-F562 PolarHBondContact O-N 2.98Å; V560-F562 PolarHBondContact O-N 2.71Å; F562-V564 PolarHBondContact O-N 2.97Å; F562-V565 PolarHBondContact O-N 2.85Å; F562-M566 HydrophobicContact CD1-CG 4.24Å; F562-M566 HydrophobicContact CD2-CE 4.25Å; F562-M566 HydrophobicContact CD2-CG 4.13Å; F562-M566 HydrophobicContact CE1-CG 3.84Å; F562-M566 HydrophobicContact CE2-CE 3.67Å; F562-M566 HydrophobicContact CE2-CG 3.73Å; F562-M566 HydrophobicContact CE2-SD 4.28Å; F562-M566 HydrophobicContact CG-CG 4.38Å; F562-M566 HydrophobicContact CZ-CE 4.24Å; F562-M566 HydrophobicContact CZ-CG 3.57Å; F562-M566 HydrophobicContact CZ-SD 4.27Å; F562-M566 WeakPolarHBondContact O-CB 3.49Å; F562-M566 WeakPolarHBondContact O-CG 3.45Å; F562-M566 PolarHBondContact O-N 2.9Å
563	S	71	Confident	69.4	Low	4 Å²	4	43.3 Å²	43.3	3%	0.028	23%	0.226	C	C	.	.	H	α-helix	trans	-67.4	-34.6	179.2	-54.5	0	0	0	0	112.9	Y547 M559 V560 Y561 Q567 D568	Y547-S563 VanDerWaalsContact CE1-OG 3.23Å; Y547-S563 WeakPolarHBondContact CE1-OG 3.37Å; Y547-S563 WeakPolarHBondContact OH-CA 3.5Å; Y547-S563 WeakPolarHBondContact OH-CB 3.3Å; Y547-S563 PolarHBondContact OH-OG 2.86Å; M559-S563 WeakPolarHBondContact O-CB 3.38Å; M559-S563 PolarHBondContact O-N 3.23Å; M559-S563 PolarHBondContact O-OG 3.48Å; V560-S563 PolarHBondContact O-N 3.35Å; Y561-S563 VanDerWaalsContact C-N 3.29Å; Y561-S563 PolarHBondContact O-N 3.5Å; S563-Q567 PolarHBondContact O-N 2.96Å; S563-Q567 VanDerWaalsContact O-N 3.15Å; S563-D568 PolarHBondContact O-N 3.16Å
564	V	72.3	Confident	69.8	Low	61 Å²	61	42.5 Å²	42.5	37%	0.37	23%	0.227	S	C	.	.	H	α-helix	trans	-66.9	-42.9	172.4	172.1	0	0	0	0	111.3	V560 Y561 F562 Q567 V572	V560-V564 WeakPolarHBondContact O-CG2 3.28Å; V560-V564 PolarHBondContact O-N 2.85Å; Y561-V564 PolarHBondContact O-N 2.97Å; F562-V564 PolarHBondContact O-N 2.97Å; V564-Q567 PolarHBondContact O-N 3.03Å; V564-V572 HydrophobicContact CG2-CG1 4.35Å; V564-V572 HydrophobicContact CG2-CG2 4.06Å
565	V	69.9	Low	70.2	Confident	31 Å²	31	41 Å²	41	19%	0.188	21%	0.206	C	C	.	.	H	α-helix	trans	-66.8	-38.8	178.7	174.9	0	0	0	0	111.2	L530 Y561 F562 Q567	L530-V565 WeakPolarHBondContact O-CG1 3.39Å; Y561-V565 HydrophobicContact CD1-CG2 4.09Å; Y561-V565 HydrophobicContact CE1-CG2 3.67Å; Y561-V565 HydrophobicContact CE2-CG2 4.33Å; Y561-V565 WeakPolarHBondContact O-CG2 3.27Å; Y561-V565 PolarHBondContact O-N 3.48Å; F562-V565 PolarHBondContact O-N 2.85Å; V565-Q567 VanDerWaalsContact C-N 3.26Å; V565-Q567 PolarHBondContact O-N 3.35Å
566	M	66.8	Low	70.6	Confident	13 Å²	13	42.3 Å²	42.3	6%	0.064	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-2.3	178.4	-67.3	-59.6	137.8	0	0	114.2	L539 F562 D568	L539-M566 HydrophobicContact CB-CE 3.28Å; L539-M566 HydrophobicContact CB-SD 3.7Å; L539-M566 HydrophobicContact CD1-CE 3.43Å; L539-M566 VanDerWaalsContact CD1-CE 3.43Å; L539-M566 HydrophobicContact CG-CE 3.93Å; F562-M566 HydrophobicContact CD1-CG 4.24Å; F562-M566 HydrophobicContact CD2-CE 4.25Å; F562-M566 HydrophobicContact CD2-CG 4.13Å; F562-M566 HydrophobicContact CE1-CG 3.84Å; F562-M566 HydrophobicContact CE2-CE 3.67Å; F562-M566 HydrophobicContact CE2-CG 3.73Å; F562-M566 HydrophobicContact CE2-SD 4.28Å; F562-M566 HydrophobicContact CG-CG 4.38Å; F562-M566 HydrophobicContact CZ-CE 4.24Å; F562-M566 HydrophobicContact CZ-CG 3.57Å; F562-M566 HydrophobicContact CZ-SD 4.27Å; F562-M566 WeakPolarHBondContact O-CB 3.49Å; F562-M566 WeakPolarHBondContact O-CG 3.45Å; F562-M566 PolarHBondContact O-N 2.9Å; M566-D568 PolarHBondContact O-N 3.29Å
567	Q	67.5	Low	70.9	Confident	117 Å²	117	40.4 Å²	40.4	55%	0.547	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	25.5	-176.7	-51	-176.4	-22.6	0	0	113.5	S563 V564 V565 Y569	S563-Q567 PolarHBondContact O-N 2.96Å; S563-Q567 VanDerWaalsContact O-N 3.15Å; V564-Q567 PolarHBondContact O-N 3.03Å; V565-Q567 VanDerWaalsContact C-N 3.26Å; V565-Q567 PolarHBondContact O-N 3.35Å; Q567-Y569 VanDerWaalsContact C-N 3.27Å; Q567-Y569 HydrophobicContact CB-CD2 4.44Å; Q567-Y569 HydrophobicContact CB-CE2 3.61Å; Q567-Y569 HydrophobicContact CG-CE2 4.27Å; Q567-Y569 WeakPolarHBondContact CG-OH 3.08Å; Q567-Y569 VanDerWaalsContact O-CD2 3.3Å; Q567-Y569 WeakPolarHBondContact O-CD2 3.47Å; Q567-Y569 WeakPolarHBondContact O-CE2 3.39Å; Q567-Y569 PolarHBondContact O-N 3.36Å; Q567-Y569 VanDerWaalsContact O-N 3.12Å
568	D	70.5	Confident	71.2	Confident	29 Å²	29	42.2 Å²	42.2	16%	0.155	20%	0.203	C	C	.	.			trans	-88.9	68.3	176	-159.5	-20.8	0	0	0	109.6	S563 M566 E570 R571 V572	S563-D568 PolarHBondContact O-N 3.16Å; M566-D568 PolarHBondContact O-N 3.29Å; D568-E570 PolarHBondContact O-N 3.48Å; D568-R571 PolarHBondContact O-N 2.72Å; D568-R571 IonicContact OD2-NE 3.68Å; D568-V572 PolarHBondContact O-N 2.82Å
569	Y	68.8	Low	71.2	Confident	20 Å²	20	47.7 Å²	47.7	8%	0.078	23%	0.229	C	C	.	.	H	α-helix	trans	-65.9	-22.5	-174.3	-58	-63.2	0	0	0	112.6	Q567 R571 V572 I573 V588 H592	Q567-Y569 VanDerWaalsContact C-N 3.27Å; Q567-Y569 HydrophobicContact CB-CD2 4.44Å; Q567-Y569 HydrophobicContact CB-CE2 3.61Å; Q567-Y569 HydrophobicContact CG-CE2 4.27Å; Q567-Y569 WeakPolarHBondContact CG-OH 3.08Å; Q567-Y569 VanDerWaalsContact O-CD2 3.3Å; Q567-Y569 WeakPolarHBondContact O-CD2 3.47Å; Q567-Y569 WeakPolarHBondContact O-CE2 3.39Å; Q567-Y569 PolarHBondContact O-N 3.36Å; Q567-Y569 VanDerWaalsContact O-N 3.12Å; Y569-R571 PolarHBondContact O-N 3.04Å; Y569-V572 PolarHBondContact O-N 3.33Å; Y569-I573 WeakPolarHBondContact O-CB 3.26Å; Y569-I573 WeakPolarHBondContact O-CD1 3.33Å; Y569-I573 WeakPolarHBondContact O-CG1 3.31Å; Y569-I573 PolarHBondContact O-N 3.29Å; Y569-V588 HydrophobicContact CD1-CG1 3.71Å; Y569-V588 HydrophobicContact CE1-CG1 4.49Å; Y569-V588 HydrophobicContact CG-CG1 4.41Å; Y569-H592 AromaticContact CD1-CD2 3.49Å; Y569-H592 VanDerWaalsContact CD1-CD2 3.49Å; Y569-H592 WeakPolarHBondContact CD1-CD2 3.29Å; Y569-H592 AromaticContact CD1-NE2 3.86Å; Y569-H592 HydrophobicContact CD2-CB 3.95Å; Y569-H592 AromaticContact CD2-CG 3.68Å; Y569-H592 AromaticContact CE1-CD2 3.24Å; Y569-H592 WeakPolarHBondContact CE1-CD2 3.49Å; Y569-H592 AromaticContact CE1-CE1 3.56Å; Y569-H592 AromaticContact CE1-CG 3.79Å; Y569-H592 AromaticContact CE1-ND1 3.94Å; Y569-H592 AromaticContact CE1-NE2 3.1Å; Y569-H592 WeakPolarHBondContact CE1-NE2 3.4Å; Y569-H592 HydrophobicContact CE2-CB 4.07Å; Y569-H592 AromaticContact CE2-CD2 3.79Å; Y569-H592 AromaticContact CE2-CE1 3.67Å; Y569-H592 AromaticContact CE2-CG 3.4Å; Y569-H592 VanDerWaalsContact CE2-CG 3.4Å; Y569-H592 AromaticContact CE2-ND1 3.3Å; Y569-H592 VanDerWaalsContact CE2-ND1 3.3Å; Y569-H592 WeakPolarHBondContact CE2-ND1 3.43Å; Y569-H592 AromaticContact CE2-NE2 3.97Å; Y569-H592 HydrophobicContact CG-CB 4.33Å; Y569-H592 AromaticContact CG-CD2 3.9Å; Y569-H592 AromaticContact CG-CG 4Å; Y569-H592 AromaticContact CZ-CD2 3.42Å; Y569-H592 VanDerWaalsContact CZ-CD2 3.42Å; Y569-H592 AromaticContact CZ-CE1 3.07Å; Y569-H592 AromaticContact CZ-CG 3.48Å; Y569-H592 VanDerWaalsContact CZ-CG 3.48Å; Y569-H592 AromaticContact CZ-ND1 3.25Å; Y569-H592 AromaticContact CZ-NE2 3.18Å; Y569-H592 PolarHBondContact OH-CE1 3.4Å; Y569-H592 PolarHBondContact OH-ND1 2.87Å; Y569-H592 PolarHBondContact OH-NE2 3.21Å
570	E	71.6	Confident	71.2	Confident	80 Å²	80	51.1 Å²	51.1	37%	0.374	25%	0.248	S	C	.	.	H	α-helix	trans	-59.1	-46.4	176.7	-168.5	176.6	170.1	0	0	111.8	D568 S574 L597 K600 F601	D568-E570 PolarHBondContact O-N 3.48Å; E570-S574 WeakPolarHBondContact O-CB 3.49Å; E570-S574 PolarHBondContact O-N 3.07Å; E570-L597 HydrophobicContact CB-CD2 3.67Å; E570-L597 HydrophobicContact CG-CD2 3.87Å; E570-K600 IonicContact OE1-NZ 2.7Å; E570-K600 PolarHBondContact OE1-NZ 3.03Å; E570-F601 HydrophobicContact CG-CE2 4.14Å; E570-F601 HydrophobicContact CG-CZ 4.18Å; E570-F601 WeakPolarHBondContact O-CZ 3.05Å
571	R	69	Low	71.5	Confident	121 Å²	121	53.7 Å²	53.7	46%	0.457	26%	0.261	S	S	.	.	H	α-helix	trans	-71.6	-38.4	178.2	-68.9	-176.5	176.7	-150.2	-3.3	111.9	Y547 D568 Y569 S574 H575	Y547-R571 VanDerWaalsContact CB-NH1 3.33Å; D568-R571 PolarHBondContact O-N 2.72Å; D568-R571 IonicContact OD2-NE 3.68Å; Y569-R571 PolarHBondContact O-N 3.04Å; R571-S574 PolarHBondContact O-N 3.22Å; R571-H575 VanDerWaalsContact O-CB 3.26Å; R571-H575 WeakPolarHBondContact O-CB 3.29Å; R571-H575 PolarHBondContact O-N 2.9Å
572	V	71.8	Confident	71.8	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.006	25%	0.252	C	S	.	.	H	α-helix	trans	-58.9	-48.6	175.6	177.7	0	0	0	0	110.9	V564 D568 Y569 H575 Y576 V588	V564-V572 HydrophobicContact CG2-CG1 4.35Å; V564-V572 HydrophobicContact CG2-CG2 4.06Å; D568-V572 PolarHBondContact O-N 2.82Å; Y569-V572 PolarHBondContact O-N 3.33Å; V572-H575 WeakPolarHBondContact O-CB 3.3Å; V572-H575 PolarHBondContact O-N 3.02Å; V572-Y576 HydrophobicContact CG1-CD2 3.63Å; V572-Y576 HydrophobicContact CG1-CE2 3.29Å; V572-Y576 WeakPolarHBondContact O-CD2 3.46Å; V572-Y576 PolarHBondContact O-N 3.19Å; V572-V588 HydrophobicContact CG1-CG1 4.19Å; V572-V588 HydrophobicContact CG1-CG2 4.38Å
573	I	71.1	Confident	71.9	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-68.7	-43.9	-178.9	-63.8	156.9	0	0	0	110	Y569 H575 Y576 C577 A585 V588 L589 L597 F601	Y569-I573 WeakPolarHBondContact O-CB 3.26Å; Y569-I573 WeakPolarHBondContact O-CD1 3.33Å; Y569-I573 WeakPolarHBondContact O-CG1 3.31Å; Y569-I573 PolarHBondContact O-N 3.29Å; I573-H575 VanDerWaalsContact C-N 3.26Å; I573-H575 PolarHBondContact O-N 3.2Å; I573-Y576 PolarHBondContact O-N 3.07Å; I573-C577 WeakPolarHBondContact O-CB 3.31Å; I573-C577 PolarHBondContact O-N 3.4Å; I573-C577 PolarHBondContact O-SG 3.45Å; I573-A585 HydrophobicContact CG2-CB 4.31Å; I573-V588 HydrophobicContact CG1-CG1 4.33Å; I573-L589 HydrophobicContact CD1-CD1 4.22Å; I573-L589 HydrophobicContact CD1-CD2 3.33Å; I573-L589 HydrophobicContact CD1-CG 3.45Å; I573-L589 VanDerWaalsContact CD1-CG 3.45Å; I573-L589 HydrophobicContact CG1-CD2 4.39Å; I573-L589 HydrophobicContact CG1-CG 4Å; I573-L589 HydrophobicContact CG2-CD1 4.11Å; I573-L589 HydrophobicContact CG2-CG 4.48Å; I573-L597 HydrophobicContact CD1-CB 4.43Å; I573-L597 HydrophobicContact CD1-CD1 4.12Å; I573-F601 HydrophobicContact CB-CD2 4.16Å; I573-F601 HydrophobicContact CB-CE1 4.4Å; I573-F601 HydrophobicContact CB-CE2 3.95Å; I573-F601 HydrophobicContact CB-CG 4.49Å; I573-F601 HydrophobicContact CB-CZ 4.07Å; I573-F601 HydrophobicContact CD1-CD2 4.31Å; I573-F601 HydrophobicContact CD1-CE2 4.35Å; I573-F601 HydrophobicContact CG2-CB 4.07Å; I573-F601 HydrophobicContact CG2-CD1 3.6Å; I573-F601 HydrophobicContact CG2-CD2 3.56Å; I573-F601 HydrophobicContact CG2-CE1 3.84Å; I573-F601 HydrophobicContact CG2-CE2 3.81Å; I573-F601 HydrophobicContact CG2-CG 3.46Å; I573-F601 VanDerWaalsContact CG2-CG 3.46Å; I573-F601 HydrophobicContact CG2-CZ 3.94Å
574	S	74.4	Confident	72	Confident	45 Å²	45	55 Å²	55	32%	0.315	28%	0.279	S	S	.	.	H	α-helix	trans	-58.2	-40.4	175.5	-173.1	0	0	0	0	112.1	E570 R571 C577 Q578	E570-S574 WeakPolarHBondContact O-CB 3.49Å; E570-S574 PolarHBondContact O-N 3.07Å; R571-S574 PolarHBondContact O-N 3.22Å; S574-C577 PolarHBondContact O-N 3.26Å; S574-Q578 VanDerWaalsContact O-CG 3.3Å; S574-Q578 WeakPolarHBondContact O-CG 3.38Å; S574-Q578 PolarHBondContact O-N 2.97Å
575	H	73	Confident	72.1	Confident	22 Å²	22	52.1 Å²	52.1	10%	0.102	26%	0.262	C	S	.	.	H	α-helix	trans	-64.6	-49.8	175.9	176	-89.7	0	0	0	111.6	V556 V560 R571 V572 I573 C577 Q578 H579	V556-H575 WeakPolarHBondContact CG1-NE2 3.12Å; V560-H575 WeakPolarHBondContact CG2-ND1 3.19Å; R571-H575 VanDerWaalsContact O-CB 3.26Å; R571-H575 WeakPolarHBondContact O-CB 3.29Å; R571-H575 PolarHBondContact O-N 2.9Å; V572-H575 WeakPolarHBondContact O-CB 3.3Å; V572-H575 PolarHBondContact O-N 3.02Å; I573-H575 VanDerWaalsContact C-N 3.26Å; I573-H575 PolarHBondContact O-N 3.2Å; H575-C577 PolarHBondContact O-N 3.48Å; H575-Q578 PolarHBondContact O-N 3.47Å; H575-H579 AromaticContact CD2-CD2 3.61Å; H575-H579 AromaticContact CD2-NE2 3.79Å; H575-H579 AromaticContact CE1-CD2 3.39Å; H575-H579 PolarHBondContact CE1-CD2 3.04Å; H575-H579 AromaticContact CE1-NE2 3.85Å; H575-H579 AromaticContact ND1-CD2 3.97Å; H575-H579 AromaticContact NE2-CD2 3.12Å; H575-H579 PolarHBondContact NE2-CD2 3.39Å; H575-H579 AromaticContact NE2-NE2 3.17Å; H575-H579 PolarHBondContact NE2-NE2 2.75Å; H575-H579 VanDerWaalsContact NE2-NE2 3.17Å; H575-H579 PolarHBondContact O-CD2 3.27Å; H575-H579 PolarHBondContact O-N 3.19Å; H575-H579 VanDerWaalsContact O-N 3.09Å
576	Y	73.4	Confident	72.2	Confident	52 Å²	52	51.6 Å²	51.6	20%	0.204	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-33.6	176.4	-72.8	-50.2	0	0	0	112.9	V572 I573 H579 D580 N581 A584 V588	V572-Y576 HydrophobicContact CG1-CD2 3.63Å; V572-Y576 HydrophobicContact CG1-CE2 3.29Å; V572-Y576 WeakPolarHBondContact O-CD2 3.46Å; V572-Y576 PolarHBondContact O-N 3.19Å; I573-Y576 PolarHBondContact O-N 3.07Å; Y576-H579 PolarHBondContact O-N 2.9Å; Y576-D580 PolarHBondContact O-N 2.9Å; Y576-N581 HydrophobicContact CD1-CB 4.31Å; Y576-N581 PolarHBondContact O-N 3.07Å; Y576-A584 HydrophobicContact CD1-CB 4.24Å; Y576-A584 HydrophobicContact CE1-CB 4.25Å; Y576-A584 HydrophobicContact CG-CB 4.41Å; Y576-V588 HydrophobicContact CE2-CG2 4.1Å
577	C	72.5	Confident	72.6	Confident	20 Å²	20	55.3 Å²	55.3	14%	0.135	28%	0.278	C	S	.	.	H	α-helix	trans	-68.5	-33.7	172.8	-71.8	0	0	0	0	113.2	I573 S574 H575 F582	I573-C577 WeakPolarHBondContact O-CB 3.31Å; I573-C577 PolarHBondContact O-N 3.4Å; I573-C577 PolarHBondContact O-SG 3.45Å; S574-C577 PolarHBondContact O-N 3.26Å; H575-C577 PolarHBondContact O-N 3.48Å; C577-F582 HydrophobicContact CB-CE1 4.38Å
578	Q	75.9	Confident	72.7	Confident	140 Å²	140	50.8 Å²	50.8	65%	0.654	26%	0.258	S	S	*	.	H	α-helix	trans	-72.5	-28.9	176	-75.6	170.5	0.8	0	0	112.8	S574 H575	S574-Q578 VanDerWaalsContact O-CG 3.3Å; S574-Q578 WeakPolarHBondContact O-CG 3.38Å; S574-Q578 PolarHBondContact O-N 2.97Å; H575-Q578 PolarHBondContact O-N 3.47Å
579	H	71.3	Confident	72.9	Confident	116 Å²	116	49.7 Å²	49.7	54%	0.537	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	18.5	179.1	-73.9	-81	0	0	0	113.8	H575 Y576 N581	H575-H579 AromaticContact CD2-CD2 3.61Å; H575-H579 AromaticContact CD2-NE2 3.79Å; H575-H579 AromaticContact CE1-CD2 3.39Å; H575-H579 PolarHBondContact CE1-CD2 3.04Å; H575-H579 AromaticContact CE1-NE2 3.85Å; H575-H579 AromaticContact ND1-CD2 3.97Å; H575-H579 AromaticContact NE2-CD2 3.12Å; H575-H579 PolarHBondContact NE2-CD2 3.39Å; H575-H579 AromaticContact NE2-NE2 3.17Å; H575-H579 PolarHBondContact NE2-NE2 2.75Å; H575-H579 VanDerWaalsContact NE2-NE2 3.17Å; H575-H579 PolarHBondContact O-CD2 3.27Å; H575-H579 PolarHBondContact O-N 3.19Å; H575-H579 VanDerWaalsContact O-N 3.09Å; Y576-H579 PolarHBondContact O-N 2.9Å; H579-N581 PolarHBondContact O-N 3.16Å
580	D	70	Confident	73	Confident	119 Å²	119	49.9 Å²	49.9	64%	0.636	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	14.9	-179.9	-65.7	-35.6	0	0	0	115.7	Y576 F582	Y576-D580 PolarHBondContact O-N 2.9Å; D580-F582 VanDerWaalsContact C-N 3.32Å; D580-F582 HydrophobicContact CB-CE2 4Å; D580-F582 HydrophobicContact CB-CZ 4.47Å; D580-F582 VanDerWaalsContact O-CD2 3.27Å; D580-F582 WeakPolarHBondContact O-CD2 3.1Å; D580-F582 PolarHBondContact O-N 2.86Å; D580-F582 VanDerWaalsContact O-N 3.15Å
581	N	78.3	Confident	72.9	Confident	68 Å²	68	53.6 Å²	53.6	36%	0.364	27%	0.273	S	S	.	.			trans	-92.3	64.4	179.5	-163	-12.4	0	0	0	111.2	Y576 H579 S583 A584 A585	Y576-N581 HydrophobicContact CD1-CB 4.31Å; Y576-N581 PolarHBondContact O-N 3.07Å; H579-N581 PolarHBondContact O-N 3.16Å; N581-S583 VanDerWaalsContact C-N 3.28Å; N581-S583 PolarHBondContact O-N 3.24Å; N581-S583 PolarHBondContact OD1-OG 3.36Å; N581-A584 PolarHBondContact O-N 3.5Å; N581-A584 WeakPolarHBondContact OD1-CB 3.24Å; N581-A584 PolarHBondContact OD1-N 3.31Å; N581-A585 PolarHBondContact O-N 3.44Å
582	F	76.5	Confident	72.7	Confident	18 Å²	18	51.1 Å²	51.1	8%	0.079	27%	0.267	C	S	.	.	H	α-helix	trans	-67.9	-23.1	-174.9	-55.4	-71.1	0	0	0	113.9	C577 D580 L586 V604 L605 H608 I609	C577-F582 HydrophobicContact CB-CE1 4.38Å; D580-F582 VanDerWaalsContact C-N 3.32Å; D580-F582 HydrophobicContact CB-CE2 4Å; D580-F582 HydrophobicContact CB-CZ 4.47Å; D580-F582 VanDerWaalsContact O-CD2 3.27Å; D580-F582 WeakPolarHBondContact O-CD2 3.1Å; D580-F582 PolarHBondContact O-N 2.86Å; D580-F582 VanDerWaalsContact O-N 3.15Å; F582-L586 WeakPolarHBondContact O-CB 3.42Å; F582-L586 PolarHBondContact O-N 3.19Å; F582-L586 VanDerWaalsContact O-N 3.08Å; F582-V604 HydrophobicContact CE1-CG1 4.24Å; F582-L605 HydrophobicContact CB-CD2 3.98Å; F582-L605 HydrophobicContact CD1-CD2 3.93Å; F582-L605 HydrophobicContact CG-CD2 4.43Å; F582-H608 HydrophobicContact CD2-CB 3.84Å; F582-H608 HydrophobicContact CE2-CB 3.95Å; F582-H608 AromaticContact CE2-CG 3.66Å; F582-H608 AromaticContact CE2-ND1 3.81Å; F582-H608 HydrophobicContact CG-CB 4.19Å; F582-H608 HydrophobicContact CZ-CB 4.39Å; F582-H608 AromaticContact CZ-CD2 3.7Å; F582-H608 AromaticContact CZ-CG 3.84Å; F582-H608 AromaticContact CZ-NE2 3.97Å; F582-I609 HydrophobicContact CB-CD1 3.58Å; F582-I609 HydrophobicContact CB-CG1 4.11Å
583	S	73.8	Confident	72.3	Confident	60 Å²	60	52.9 Å²	52.9	42%	0.42	28%	0.279	S	S	.	.	H	α-helix	trans	-71.4	-46.2	176	48.6	0	0	0	0	112.1	N581 A585 L586 D587	N581-S583 VanDerWaalsContact C-N 3.28Å; N581-S583 PolarHBondContact O-N 3.24Å; N581-S583 PolarHBondContact OD1-OG 3.36Å; S583-A585 VanDerWaalsContact C-N 3.31Å; S583-A585 PolarHBondContact O-N 2.99Å; S583-L586 PolarHBondContact O-N 2.98Å; S583-D587 PolarHBondContact O-N 3.43Å
584	A	74.1	Confident	72.2	Confident	21 Å²	21	56.5 Å²	56.5	17%	0.174	30%	0.298	C	S	.	.	H	α-helix	trans	-64.8	-37.8	175.4	0	0	0	0	0	111.7	Y576 N581 L586 D587 V588	Y576-A584 HydrophobicContact CD1-CB 4.24Å; Y576-A584 HydrophobicContact CE1-CB 4.25Å; Y576-A584 HydrophobicContact CG-CB 4.41Å; N581-A584 PolarHBondContact O-N 3.5Å; N581-A584 WeakPolarHBondContact OD1-CB 3.24Å; N581-A584 PolarHBondContact OD1-N 3.31Å; A584-L586 VanDerWaalsContact C-N 3.3Å; A584-L586 PolarHBondContact O-N 2.87Å; A584-D587 PolarHBondContact O-N 3.32Å; A584-V588 WeakPolarHBondContact O-CG2 3.17Å; A584-V588 PolarHBondContact O-N 3.26Å
585	A	74	Confident	72	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-57.5	-43.9	172.3	0	0	0	0	0	111.9	I573 N581 S583 V588 L589 L605	I573-A585 HydrophobicContact CG2-CB 4.31Å; N581-A585 PolarHBondContact O-N 3.44Å; S583-A585 VanDerWaalsContact C-N 3.31Å; S583-A585 PolarHBondContact O-N 2.99Å; A585-V588 PolarHBondContact O-N 2.84Å; A585-L589 WeakPolarHBondContact O-CB 3.5Å; A585-L589 WeakPolarHBondContact O-CG 3.26Å; A585-L589 PolarHBondContact O-N 2.97Å; A585-L605 HydrophobicContact CB-CD2 4.31Å
586	L	71.1	Confident	71.9	Confident	21 Å²	21	66.1 Å²	66.1	11%	0.11	34%	0.335	C	S	.	.	H	α-helix	trans	-69.4	-38.1	178.6	-172.9	140.3	0	0	0	112.4	F582 S583 A584 V588 L589 A590 N612 V613 A616	F582-L586 WeakPolarHBondContact O-CB 3.42Å; F582-L586 PolarHBondContact O-N 3.19Å; F582-L586 VanDerWaalsContact O-N 3.08Å; S583-L586 PolarHBondContact O-N 2.98Å; A584-L586 VanDerWaalsContact C-N 3.3Å; A584-L586 PolarHBondContact O-N 2.87Å; L586-V588 VanDerWaalsContact C-N 3.32Å; L586-V588 PolarHBondContact O-N 3.33Å; L586-L589 PolarHBondContact O-N 3.37Å; L586-A590 VanDerWaalsContact O-CB 3.25Å; L586-A590 WeakPolarHBondContact O-CB 3.38Å; L586-A590 PolarHBondContact O-N 2.89Å; L586-N612 HydrophobicContact CD1-CB 3.95Å; L586-N612 HydrophobicContact CD2-CB 4.35Å; L586-V613 HydrophobicContact CD1-CB 4.23Å; L586-V613 HydrophobicContact CD1-CG2 3.59Å; L586-A616 HydrophobicContact CD1-CB 4.37Å; L586-A616 HydrophobicContact CD2-CB 4.25Å; L586-A616 HydrophobicContact CG-CB 4.34Å
587	D	75.3	Confident	71.8	Confident	90 Å²	90	64.6 Å²	64.6	48%	0.481	33%	0.33	S	S	.	.	H	α-helix	trans	-64.3	-38	175.8	-72.2	-18.9	0	0	0	111.9	S583 A584 K591	S583-D587 PolarHBondContact O-N 3.43Å; A584-D587 PolarHBondContact O-N 3.32Å; D587-K591 WeakPolarHBondContact O-CD 3.39Å; D587-K591 VanDerWaalsContact O-CG 3.24Å; D587-K591 WeakPolarHBondContact O-CG 3.32Å; D587-K591 PolarHBondContact O-N 3.07Å
588	V	71.4	Confident	71.7	Confident	22 Å²	22	64 Å²	64	13%	0.133	33%	0.325	C	S	.	.	H	α-helix	trans	-67.9	-44	174.3	174	0	0	0	0	110.4	Y569 V572 I573 Y576 A584 A585 L586 K591 H592	Y569-V588 HydrophobicContact CD1-CG1 3.71Å; Y569-V588 HydrophobicContact CE1-CG1 4.49Å; Y569-V588 HydrophobicContact CG-CG1 4.41Å; V572-V588 HydrophobicContact CG1-CG1 4.19Å; V572-V588 HydrophobicContact CG1-CG2 4.38Å; I573-V588 HydrophobicContact CG1-CG1 4.33Å; Y576-V588 HydrophobicContact CE2-CG2 4.1Å; A584-V588 WeakPolarHBondContact O-CG2 3.17Å; A584-V588 PolarHBondContact O-N 3.26Å; A585-V588 PolarHBondContact O-N 2.84Å; L586-V588 VanDerWaalsContact C-N 3.32Å; L586-V588 PolarHBondContact O-N 3.33Å; V588-K591 PolarHBondContact O-N 3.24Å; V588-H592 PolarHBondContact O-CD2 3.35Å; V588-H592 PolarHBondContact O-N 3.3Å
589	L	73.1	Confident	71.6	Confident	6 Å²	6	59.4 Å²	59.4	3%	0.031	30%	0.303	C	S	.	.	H	α-helix	trans	-60.9	-45.3	175	-83.2	165.9	0	0	0	112.7	I573 A585 L586 K591 H592 C593 L597 F598 F601 L605	I573-L589 HydrophobicContact CD1-CD1 4.22Å; I573-L589 HydrophobicContact CD1-CD2 3.33Å; I573-L589 HydrophobicContact CD1-CG 3.45Å; I573-L589 VanDerWaalsContact CD1-CG 3.45Å; I573-L589 HydrophobicContact CG1-CD2 4.39Å; I573-L589 HydrophobicContact CG1-CG 4Å; I573-L589 HydrophobicContact CG2-CD1 4.11Å; I573-L589 HydrophobicContact CG2-CG 4.48Å; A585-L589 WeakPolarHBondContact O-CB 3.5Å; A585-L589 WeakPolarHBondContact O-CG 3.26Å; A585-L589 PolarHBondContact O-N 2.97Å; L586-L589 PolarHBondContact O-N 3.37Å; L589-K591 VanDerWaalsContact C-N 3.26Å; L589-K591 PolarHBondContact O-N 2.99Å; L589-H592 PolarHBondContact O-N 3.09Å; L589-C593 PolarHBondContact O-N 3.43Å; L589-C593 VanDerWaalsContact O-N 3.08Å; L589-L597 HydrophobicContact CD2-CB 3.84Å; L589-F598 HydrophobicContact CB-CE1 4.37Å; L589-F598 HydrophobicContact CB-CE2 4.19Å; L589-F598 HydrophobicContact CB-CZ 3.85Å; L589-F598 HydrophobicContact CD2-CD2 4.28Å; L589-F598 HydrophobicContact CD2-CE2 4.24Å; L589-F598 VanDerWaalsContact O-CE2 3.29Å; L589-F598 WeakPolarHBondContact O-CE2 3.46Å; L589-F601 HydrophobicContact CD1-CB 4.35Å; L589-L605 HydrophobicContact CD1-CD1 3.31Å
590	A	70.7	Confident	71.7	Confident	25 Å²	25	59.9 Å²	59.9	21%	0.207	30%	0.303	C	S	.	.	H	α-helix	trans	-64.4	-30.7	-179.3	0	0	0	0	0	112.6	L586 C593 M620	L586-A590 VanDerWaalsContact O-CB 3.25Å; L586-A590 WeakPolarHBondContact O-CB 3.38Å; L586-A590 PolarHBondContact O-N 2.89Å; A590-C593 PolarHBondContact O-SG 3.17Å; A590-M620 VanDerWaalsContact O-CE 3.24Å; A590-M620 WeakPolarHBondContact O-CE 3.36Å
591	K	71.2	Confident	71.8	Confident	158 Å²	158	54.9 Å²	54.9	69%	0.687	28%	0.275	S	S	*	.	H	α-helix	trans	-77.7	-34.6	177.3	-74.7	171.6	-175.4	174.3	0	113.6	D587 V588 L589	D587-K591 WeakPolarHBondContact O-CD 3.39Å; D587-K591 VanDerWaalsContact O-CG 3.24Å; D587-K591 WeakPolarHBondContact O-CG 3.32Å; D587-K591 PolarHBondContact O-N 3.07Å; V588-K591 PolarHBondContact O-N 3.24Å; L589-K591 VanDerWaalsContact C-N 3.26Å; L589-K591 PolarHBondContact O-N 2.99Å
592	H	64.4	Low	71.5	Confident	69 Å²	69	51.8 Å²	51.8	32%	0.319	26%	0.259	S	S	.	.	H	α-helix	trans	-97.9	-16.7	-171.2	-69.9	-63.4	0	0	0	114.5	Y569 V588 L589 D594	Y569-H592 AromaticContact CD1-CD2 3.49Å; Y569-H592 VanDerWaalsContact CD1-CD2 3.49Å; Y569-H592 WeakPolarHBondContact CD1-CD2 3.29Å; Y569-H592 AromaticContact CD1-NE2 3.86Å; Y569-H592 HydrophobicContact CD2-CB 3.95Å; Y569-H592 AromaticContact CD2-CG 3.68Å; Y569-H592 AromaticContact CE1-CD2 3.24Å; Y569-H592 WeakPolarHBondContact CE1-CD2 3.49Å; Y569-H592 AromaticContact CE1-CE1 3.56Å; Y569-H592 AromaticContact CE1-CG 3.79Å; Y569-H592 AromaticContact CE1-ND1 3.94Å; Y569-H592 AromaticContact CE1-NE2 3.1Å; Y569-H592 WeakPolarHBondContact CE1-NE2 3.4Å; Y569-H592 HydrophobicContact CE2-CB 4.07Å; Y569-H592 AromaticContact CE2-CD2 3.79Å; Y569-H592 AromaticContact CE2-CE1 3.67Å; Y569-H592 AromaticContact CE2-CG 3.4Å; Y569-H592 VanDerWaalsContact CE2-CG 3.4Å; Y569-H592 AromaticContact CE2-ND1 3.3Å; Y569-H592 VanDerWaalsContact CE2-ND1 3.3Å; Y569-H592 WeakPolarHBondContact CE2-ND1 3.43Å; Y569-H592 AromaticContact CE2-NE2 3.97Å; Y569-H592 HydrophobicContact CG-CB 4.33Å; Y569-H592 AromaticContact CG-CD2 3.9Å; Y569-H592 AromaticContact CG-CG 4Å; Y569-H592 AromaticContact CZ-CD2 3.42Å; Y569-H592 VanDerWaalsContact CZ-CD2 3.42Å; Y569-H592 AromaticContact CZ-CE1 3.07Å; Y569-H592 AromaticContact CZ-CG 3.48Å; Y569-H592 VanDerWaalsContact CZ-CG 3.48Å; Y569-H592 AromaticContact CZ-ND1 3.25Å; Y569-H592 AromaticContact CZ-NE2 3.18Å; Y569-H592 PolarHBondContact OH-CE1 3.4Å; Y569-H592 PolarHBondContact OH-ND1 2.87Å; Y569-H592 PolarHBondContact OH-NE2 3.21Å; V588-H592 PolarHBondContact O-CD2 3.35Å; V588-H592 PolarHBondContact O-N 3.3Å; L589-H592 PolarHBondContact O-N 3.09Å; H592-D594 PolarHBondContact O-N 3.12Å; H592-D594 VanDerWaalsContact O-N 3.11Å
593	C	62	Low	71.3	Confident	38 Å²	38	52.5 Å²	52.5	26%	0.257	27%	0.266	S	S	.	.			trans	55.5	28.7	167.4	-48.5	0	0	0	0	115.7	L589 A590 M620	L589-C593 PolarHBondContact O-N 3.43Å; L589-C593 VanDerWaalsContact O-N 3.08Å; A590-C593 PolarHBondContact O-SG 3.17Å; C593-M620 HydrophobicContact CB-CE 3.74Å; C593-M620 HydrophobicContact CB-SD 3.46Å; C593-M620 WeakPolarHBondContact CB-SD 2.97Å; C593-M620 WeakPolarHBondContact SG-CE 3.44Å; C593-M620 PolarHBondContact SG-SD 2.83Å
594	D	70.4	Confident	71.2	Confident	77 Å²	77	52.4 Å²	52.4	41%	0.412	26%	0.262	S	S	.	.			trans	-84.3	114.5	-178.5	-80.5	-32.6	0	0	0	112.6	H592 K596 L597 F598	H592-D594 PolarHBondContact O-N 3.12Å; H592-D594 VanDerWaalsContact O-N 3.11Å; D594-K596 VanDerWaalsContact C-N 3.31Å; D594-K596 PolarHBondContact O-N 3.23Å; D594-L597 HydrophobicContact CB-CB 4.22Å; D594-L597 HydrophobicContact CB-CD1 3.91Å; D594-L597 HydrophobicContact CB-CG 4.02Å; D594-L597 PolarHBondContact O-N 3.4Å; D594-L597 VanDerWaalsContact O-N 3.16Å; D594-F598 WeakPolarHBondContact O-CD2 3.3Å; D594-F598 PolarHBondContact O-N 3.39Å; D594-F598 VanDerWaalsContact O-N 3.14Å
595	E	69.2	Low	71.2	Confident	90 Å²	90	51.7 Å²	51.7	42%	0.421	26%	0.256	S	S	.	.	H	α-helix	trans	-53.5	-43.8	-175.9	-60.1	174.5	-167.9	0	0	113.2	L597 F598 Y599 R623	E595-L597 PolarHBondContact O-N 3.03Å; E595-F598 PolarHBondContact O-N 3.07Å; E595-Y599 HydrophobicContact CB-CE2 4.09Å; E595-Y599 WeakPolarHBondContact O-CD2 3.42Å; E595-Y599 WeakPolarHBondContact O-CE2 3.49Å; E595-Y599 PolarHBondContact O-N 3.39Å; E595-Y599 VanDerWaalsContact O-N 3.1Å; E595-R623 VanDerWaalsContact CG-O 3.29Å; E595-R623 WeakPolarHBondContact CG-O 2.84Å
596	K	71.4	Confident	70.9	Confident	178 Å²	178	52.5 Å²	52.5	77%	0.774	26%	0.26	S	S	*	.	H	α-helix	trans	-66.6	-37.1	-177.4	-66.1	179.3	-177.3	173.8	0	113.1	D594 Y599 K600	D594-K596 VanDerWaalsContact C-N 3.31Å; D594-K596 PolarHBondContact O-N 3.23Å; K596-Y599 PolarHBondContact O-N 3.03Å; K596-K600 PolarHBondContact O-N 3.47Å
597	L	71.1	Confident	70.9	Confident	20 Å²	20	57 Å²	57	11%	0.105	28%	0.28	C	S	.	.	H	α-helix	trans	-73.1	-38.7	179.2	-62.6	-179.7	0	0	0	110.6	E570 I573 L589 D594 E595 Y599 K600 F601	E570-L597 HydrophobicContact CB-CD2 3.67Å; E570-L597 HydrophobicContact CG-CD2 3.87Å; I573-L597 HydrophobicContact CD1-CB 4.43Å; I573-L597 HydrophobicContact CD1-CD1 4.12Å; L589-L597 HydrophobicContact CD2-CB 3.84Å; D594-L597 HydrophobicContact CB-CB 4.22Å; D594-L597 HydrophobicContact CB-CD1 3.91Å; D594-L597 HydrophobicContact CB-CG 4.02Å; D594-L597 PolarHBondContact O-N 3.4Å; D594-L597 VanDerWaalsContact O-N 3.16Å; E595-L597 PolarHBondContact O-N 3.03Å; L597-Y599 PolarHBondContact O-N 3.38Å; L597-K600 PolarHBondContact O-N 3.26Å; L597-F601 HydrophobicContact CB-CD2 4.4Å; L597-F601 HydrophobicContact CD2-CE2 4.12Å; L597-F601 VanDerWaalsContact O-CD2 3.31Å; L597-F601 WeakPolarHBondContact O-CD2 3.49Å; L597-F601 PolarHBondContact O-N 2.98Å
598	F	71.1	Confident	70.5	Confident	8 Å²	8	57.2 Å²	57.2	4%	0.035	28%	0.278	C	S	.	.	H	α-helix	trans	-55.2	-52.4	170.4	-88.6	-82.5	0	0	0	110.7	L589 D594 E595 K600 F601 S602 A616 W617 M620 L624	L589-F598 HydrophobicContact CB-CE1 4.37Å; L589-F598 HydrophobicContact CB-CE2 4.19Å; L589-F598 HydrophobicContact CB-CZ 3.85Å; L589-F598 HydrophobicContact CD2-CD2 4.28Å; L589-F598 HydrophobicContact CD2-CE2 4.24Å; L589-F598 VanDerWaalsContact O-CE2 3.29Å; L589-F598 WeakPolarHBondContact O-CE2 3.46Å; D594-F598 WeakPolarHBondContact O-CD2 3.3Å; D594-F598 PolarHBondContact O-N 3.39Å; D594-F598 VanDerWaalsContact O-N 3.14Å; E595-F598 PolarHBondContact O-N 3.07Å; F598-K600 VanDerWaalsContact C-N 3.31Å; F598-K600 PolarHBondContact O-N 3.44Å; F598-F601 PolarHBondContact O-N 2.98Å; F598-S602 WeakPolarHBondContact O-CA 3.35Å; F598-S602 WeakPolarHBondContact O-CB 3.39Å; F598-S602 PolarHBondContact O-N 2.83Å; F598-S602 PolarHBondContact O-OG 3.15Å; F598-A616 HydrophobicContact CE1-CB 4.47Å; F598-W617 AromaticContact CD1-CD1 3.9Å; F598-W617 AromaticContact CD1-NE1 3.97Å; F598-M620 HydrophobicContact CE2-CE 3.65Å; F598-M620 HydrophobicContact CE2-CG 4.24Å; F598-M620 HydrophobicContact CE2-SD 4.17Å; F598-M620 HydrophobicContact CZ-CE 3.62Å; F598-M620 HydrophobicContact CZ-CG 4.06Å; F598-M620 HydrophobicContact CZ-SD 4.41Å; F598-L624 HydrophobicContact CB-CD2 3.72Å; F598-L624 HydrophobicContact CD1-CD1 4.43Å; F598-L624 HydrophobicContact CG-CD2 4.1Å
599	Y	72.6	Confident	70.6	Confident	44 Å²	44	58.2 Å²	58.2	17%	0.173	28%	0.282	C	S	.	.	H	α-helix	trans	-59	-38	179.9	-61.9	-50.7	0	0	0	114.3	E595 K596 L597 P603 L624 D625 K628 L629	E595-Y599 HydrophobicContact CB-CE2 4.09Å; E595-Y599 WeakPolarHBondContact O-CD2 3.42Å; E595-Y599 WeakPolarHBondContact O-CE2 3.49Å; E595-Y599 PolarHBondContact O-N 3.39Å; E595-Y599 VanDerWaalsContact O-N 3.1Å; K596-Y599 PolarHBondContact O-N 3.03Å; L597-Y599 PolarHBondContact O-N 3.38Å; Y599-P603 WeakPolarHBondContact O-CD 3.47Å; Y599-L624 HydrophobicContact CE1-CD2 4.49Å; Y599-D625 WeakPolarHBondContact OH-CA 3.47Å; Y599-D625 VanDerWaalsContact OH-CB 3.26Å; Y599-D625 WeakPolarHBondContact OH-CB 3.46Å; Y599-D625 PolarHBondContact OH-N 2.84Å; Y599-D625 PolarHBondContact OH-O 3.14Å; Y599-K628 HydrophobicContact CD1-CB 3.66Å; Y599-K628 HydrophobicContact CD1-CD 4.46Å; Y599-K628 HydrophobicContact CD2-CD 4.03Å; Y599-K628 HydrophobicContact CE1-CB 3.48Å; Y599-K628 VanDerWaalsContact CE1-CB 3.48Å; Y599-K628 HydrophobicContact CE1-CD 4.08Å; Y599-K628 HydrophobicContact CE1-CG 4.42Å; Y599-K628 HydrophobicContact CE2-CB 4.5Å; Y599-K628 HydrophobicContact CE2-CD 3.61Å; Y599-K628 HydrophobicContact CG-CB 4.28Å; Y599-K628 HydrophobicContact CG-CD 4.45Å; Y599-L629 HydrophobicContact CD1-CD2 3.7Å; Y599-L629 HydrophobicContact CD1-CG 4.1Å; Y599-L629 HydrophobicContact CE1-CD2 4.02Å; Y599-L629 HydrophobicContact CE1-CG 3.92Å
600	K	74.4	Confident	70.4	Confident	125 Å²	125	59 Å²	59	54%	0.543	29%	0.288	S	S	.	.	H	α-helix	trans	-74.4	-42.4	-177	-172.1	175.5	178.5	174.7	0	113	E570 K596 L597 F598	E570-K600 IonicContact OE1-NZ 2.7Å; E570-K600 PolarHBondContact OE1-NZ 3.03Å; K596-K600 PolarHBondContact O-N 3.47Å; L597-K600 PolarHBondContact O-N 3.26Å; F598-K600 VanDerWaalsContact C-N 3.31Å; F598-K600 PolarHBondContact O-N 3.44Å
601	F	71.8	Confident	70.6	Confident	14 Å²	14	62.6 Å²	62.6	6%	0.061	30%	0.299	C	S	.	.	H	α-helix	trans	-95.1	-14.3	-174.8	-65.7	-72.8	0	0	0	113.6	E570 I573 L589 L597 F598 V604 L605	E570-F601 HydrophobicContact CG-CE2 4.14Å; E570-F601 HydrophobicContact CG-CZ 4.18Å; E570-F601 WeakPolarHBondContact O-CZ 3.05Å; I573-F601 HydrophobicContact CB-CD2 4.16Å; I573-F601 HydrophobicContact CB-CE1 4.4Å; I573-F601 HydrophobicContact CB-CE2 3.95Å; I573-F601 HydrophobicContact CB-CG 4.49Å; I573-F601 HydrophobicContact CB-CZ 4.07Å; I573-F601 HydrophobicContact CD1-CD2 4.31Å; I573-F601 HydrophobicContact CD1-CE2 4.35Å; I573-F601 HydrophobicContact CG2-CB 4.07Å; I573-F601 HydrophobicContact CG2-CD1 3.6Å; I573-F601 HydrophobicContact CG2-CD2 3.56Å; I573-F601 HydrophobicContact CG2-CE1 3.84Å; I573-F601 HydrophobicContact CG2-CE2 3.81Å; I573-F601 HydrophobicContact CG2-CG 3.46Å; I573-F601 VanDerWaalsContact CG2-CG 3.46Å; I573-F601 HydrophobicContact CG2-CZ 3.94Å; L589-F601 HydrophobicContact CD1-CB 4.35Å; L597-F601 HydrophobicContact CB-CD2 4.4Å; L597-F601 HydrophobicContact CD2-CE2 4.12Å; L597-F601 VanDerWaalsContact O-CD2 3.31Å; L597-F601 WeakPolarHBondContact O-CD2 3.49Å; L597-F601 PolarHBondContact O-N 2.98Å; F598-F601 PolarHBondContact O-N 2.98Å; F601-V604 PolarHBondContact O-N 2.87Å; F601-L605 HydrophobicContact CB-CD1 4.1Å; F601-L605 WeakPolarHBondContact O-CG 3.33Å; F601-L605 PolarHBondContact O-N 3.44Å
602	S	71.9	Confident	70.7	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.021	29%	0.285	C	S	.	.	H	α-helix	trans	-53.6	-43.7	176.4	-86.6	0	0	0	0	114.7	F598 V604 M606 W617	F598-S602 WeakPolarHBondContact O-CA 3.35Å; F598-S602 WeakPolarHBondContact O-CB 3.39Å; F598-S602 PolarHBondContact O-N 2.83Å; F598-S602 PolarHBondContact O-OG 3.15Å; S602-V604 VanDerWaalsContact C-N 3.35Å; S602-V604 PolarHBondContact O-N 2.94Å; S602-M606 VanDerWaalsContact O-CB 3.26Å; S602-M606 WeakPolarHBondContact O-CB 3.2Å; S602-M606 WeakPolarHBondContact O-CG 3.36Å; S602-M606 PolarHBondContact O-N 3.28Å; S602-W617 WeakPolarHBondContact OG-CZ2 3.14Å; S602-W617 PolarHBondContact OG-NE1 3.43Å
603	P	73.2	Confident	71.2	Confident	33 Å²	33	55.5 Å²	55.5	21%	0.214	27%	0.271	C	S	.	.	H	α-helix	trans	-59.5	-42.3	176.7	-26.2	36.1	0	0	0	113.4	Y599 Q607 A632 Y636	Y599-P603 WeakPolarHBondContact O-CD 3.47Å; P603-Q607 PolarHBondContact O-N 3.24Å; P603-A632 HydrophobicContact CG-CB 4.31Å; P603-Y636 HydrophobicContact CB-CE2 3.89Å; P603-Y636 WeakPolarHBondContact CB-OH 3.18Å
604	V	71.7	Confident	71.7	Confident	58 Å²	58	53.7 Å²	53.7	35%	0.352	26%	0.258	S	S	.	.	H	α-helix	trans	-71.9	-44.2	-178.4	-179.3	0	0	0	0	110.9	F582 F601 S602 Q607 H608	F582-V604 HydrophobicContact CE1-CG1 4.24Å; F601-V604 PolarHBondContact O-N 2.87Å; S602-V604 VanDerWaalsContact C-N 3.35Å; S602-V604 PolarHBondContact O-N 2.94Å; V604-Q607 PolarHBondContact O-N 2.86Å; V604-H608 PolarHBondContact O-CD2 3.37Å
605	L	72.5	Confident	72.1	Confident	6 Å²	6	52.8 Å²	52.8	3%	0.031	25%	0.254	C	S	.	.	H	α-helix	trans	-71	-34	-178.9	-66	168.9	0	0	0	112.4	F582 A585 L589 F601 Q607 H608 I609 V613	F582-L605 HydrophobicContact CB-CD2 3.98Å; F582-L605 HydrophobicContact CD1-CD2 3.93Å; F582-L605 HydrophobicContact CG-CD2 4.43Å; A585-L605 HydrophobicContact CB-CD2 4.31Å; L589-L605 HydrophobicContact CD1-CD1 3.31Å; F601-L605 HydrophobicContact CB-CD1 4.1Å; F601-L605 WeakPolarHBondContact O-CG 3.33Å; F601-L605 PolarHBondContact O-N 3.44Å; L605-Q607 VanDerWaalsContact C-N 3.28Å; L605-Q607 PolarHBondContact O-N 3.13Å; L605-H608 PolarHBondContact O-N 2.93Å; L605-I609 CarbonylContact O-C 3.59Å; L605-I609 PolarHBondContact O-N 3.46Å; L605-V613 HydrophobicContact CB-CG2 3.54Å
606	M	69	Low	72.1	Confident	17 Å²	17	48.6 Å²	48.6	8%	0.084	24%	0.235	C	C	.	.	H	α-helix	trans	-65.6	-29.6	176.2	-78.4	-63.5	-70.6	0	0	113	S602 H608 P610 V613 V614 W617 L633	S602-M606 VanDerWaalsContact O-CB 3.26Å; S602-M606 WeakPolarHBondContact O-CB 3.2Å; S602-M606 WeakPolarHBondContact O-CG 3.36Å; S602-M606 PolarHBondContact O-N 3.28Å; M606-H608 VanDerWaalsContact C-N 3.34Å; M606-P610 HydrophobicContact CE-CB 4.24Å; M606-P610 HydrophobicContact SD-CB 4.47Å; M606-V613 HydrophobicContact CG-CB 4.5Å; M606-V613 HydrophobicContact CG-CG1 3.88Å; M606-V613 HydrophobicContact SD-CB 3.7Å; M606-V613 HydrophobicContact SD-CG1 3.45Å; M606-V613 WeakPolarHBondContact SD-CG1 3.44Å; M606-V613 HydrophobicContact SD-CG2 4.5Å; M606-V614 HydrophobicContact CE-CG2 4.23Å; M606-V614 HydrophobicContact SD-CG2 4.27Å; M606-W617 HydrophobicContact CE-CH2 4.21Å; M606-W617 HydrophobicContact CE-CZ3 4.39Å; M606-W617 HydrophobicContact CG-CH2 3.83Å; M606-W617 HydrophobicContact CG-CZ2 3.95Å; M606-W617 HydrophobicContact SD-CH2 3.81Å; M606-W617 HydrophobicContact SD-CZ2 4.16Å; M606-W617 HydrophobicContact SD-CZ3 4.24Å; M606-L633 HydrophobicContact CE-CD2 4.19Å
607	Q	69.8	Low	72.2	Confident	115 Å²	115	40.2 Å²	40.2	54%	0.537	20%	0.198	S	C	.	.	H	α-helix	trans	-66.1	-36.8	176.9	-175.9	175	-2.2	0	0	112.2	P603 V604 L605	P603-Q607 PolarHBondContact O-N 3.24Å; V604-Q607 PolarHBondContact O-N 2.86Å; L605-Q607 VanDerWaalsContact C-N 3.28Å; L605-Q607 PolarHBondContact O-N 3.13Å
608	H	68.8	Low	72.4	Confident	96 Å²	96	41.1 Å²	41.1	44%	0.444	20%	0.203	S	C	.	.	H	α-helix	trans	-102.7	-37.3	-173.2	-67.8	-85.6	0	0	0	113.7	F582 V604 L605 M606	F582-H608 HydrophobicContact CD2-CB 3.84Å; F582-H608 HydrophobicContact CE2-CB 3.95Å; F582-H608 AromaticContact CE2-CG 3.66Å; F582-H608 AromaticContact CE2-ND1 3.81Å; F582-H608 HydrophobicContact CG-CB 4.19Å; F582-H608 HydrophobicContact CZ-CB 4.39Å; F582-H608 AromaticContact CZ-CD2 3.7Å; F582-H608 AromaticContact CZ-CG 3.84Å; F582-H608 AromaticContact CZ-NE2 3.97Å; V604-H608 PolarHBondContact O-CD2 3.37Å; L605-H608 PolarHBondContact O-N 2.93Å; M606-H608 VanDerWaalsContact C-N 3.34Å
609	I	72.8	Confident	72.5	Confident	43 Å²	43	48 Å²	48	22%	0.221	24%	0.235	C	C	.	.			trans	-138.5	71.9	-176	-46.3	-175	0	0	0	112.4	F582 L605 K611 N612 V613	F582-I609 HydrophobicContact CB-CD1 3.58Å; F582-I609 HydrophobicContact CB-CG1 4.11Å; L605-I609 CarbonylContact O-C 3.59Å; L605-I609 PolarHBondContact O-N 3.46Å; I609-K611 PolarHBondContact O-N 3.23Å; I609-N612 HydrophobicContact CG2-CB 3.58Å; I609-N612 WeakPolarHBondContact CG2-ND2 3.47Å; I609-V613 WeakPolarHBondContact O-CG2 3.36Å; I609-V613 PolarHBondContact O-N 3.15Å
610	P	69.7	Low	72	Confident	23 Å²	23	46.7 Å²	46.7	15%	0.149	23%	0.231	C	C	.	.	H	α-helix	trans	-64.2	-37.6	-175.1	23.8	-34.2	0	0	0	114.1	M606 V614 Q644	M606-P610 HydrophobicContact CE-CB 4.24Å; M606-P610 HydrophobicContact SD-CB 4.47Å; P610-V614 WeakPolarHBondContact O-CB 3.41Å; P610-V614 WeakPolarHBondContact O-CG2 3.47Å; P610-V614 PolarHBondContact O-N 2.97Å; P610-Q644 HydrophobicContact CB-CG 4.07Å; P610-Q644 HydrophobicContact CG-CG 3.93Å
611	K	73.5	Confident	71.6	Confident	99 Å²	99	41.2 Å²	41.2	43%	0.43	21%	0.21	S	C	.	.	H	α-helix	trans	-66.6	-46.5	-176.9	-67.7	-173.6	174.5	-179.3	0	113.1	I609 V613 N615 E647	I609-K611 PolarHBondContact O-N 3.23Å; K611-V613 VanDerWaalsContact C-N 3.34Å; K611-N615 VanDerWaalsContact O-CG 3.25Å; K611-N615 PolarHBondContact O-N 3.25Å; K611-N615 PolarHBondContact O-ND2 3.25Å; K611-E647 HydrophobicContact CG-CG 4Å
612	N	73.6	Confident	71.1	Confident	75 Å²	75	48.9 Å²	48.9	40%	0.401	24%	0.243	S	C	.	.	H	α-helix	trans	-72.8	-33.6	-177.5	-60.9	-10.3	0	0	0	110.7	L586 I609 N615 A616	L586-N612 HydrophobicContact CD1-CB 3.95Å; L586-N612 HydrophobicContact CD2-CB 4.35Å; I609-N612 HydrophobicContact CG2-CB 3.58Å; I609-N612 WeakPolarHBondContact CG2-ND2 3.47Å; N612-N615 PolarHBondContact O-N 2.87Å; N612-A616 WeakPolarHBondContact O-CB 3.43Å; N612-A616 PolarHBondContact O-N 2.95Å
613	V	74.9	Confident	70.6	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.018	27%	0.27	C	S	.	.	H	α-helix	trans	-65.4	-45.8	175.3	176.5	0	0	0	0	111.3	L586 L605 M606 I609 K611 N615 A616 W617	L586-V613 HydrophobicContact CD1-CB 4.23Å; L586-V613 HydrophobicContact CD1-CG2 3.59Å; L605-V613 HydrophobicContact CB-CG2 3.54Å; M606-V613 HydrophobicContact CG-CB 4.5Å; M606-V613 HydrophobicContact CG-CG1 3.88Å; M606-V613 HydrophobicContact SD-CB 3.7Å; M606-V613 HydrophobicContact SD-CG1 3.45Å; M606-V613 WeakPolarHBondContact SD-CG1 3.44Å; M606-V613 HydrophobicContact SD-CG2 4.5Å; I609-V613 WeakPolarHBondContact O-CG2 3.36Å; I609-V613 PolarHBondContact O-N 3.15Å; K611-V613 VanDerWaalsContact C-N 3.34Å; V613-N615 PolarHBondContact O-N 3.11Å; V613-A616 CarbonylContact O-C 3.49Å; V613-A616 WeakPolarHBondContact O-CB 3.45Å; V613-A616 PolarHBondContact O-N 3.4Å; V613-A616 VanDerWaalsContact O-N 3.12Å; V613-W617 HydrophobicContact CG1-CD2 4.16Å; V613-W617 HydrophobicContact CG1-CZ2 3.81Å; V613-W617 PolarHBondContact O-N 3.37Å
614	V	72.8	Confident	70.4	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64	-40.4	176.2	168.4	0	0	0	0	111.4	M606 P610 A616 W617 I618 E647	M606-V614 HydrophobicContact CE-CG2 4.23Å; M606-V614 HydrophobicContact SD-CG2 4.27Å; P610-V614 WeakPolarHBondContact O-CB 3.41Å; P610-V614 WeakPolarHBondContact O-CG2 3.47Å; P610-V614 PolarHBondContact O-N 2.97Å; V614-A616 VanDerWaalsContact C-N 3.3Å; V614-A616 PolarHBondContact O-N 2.87Å; V614-W617 HydrophobicContact CG2-CE3 4.16Å; V614-W617 HydrophobicContact CG2-CZ3 4.31Å; V614-W617 PolarHBondContact O-N 2.62Å; V614-I618 HydrophobicContact CG1-CD1 3.86Å; V614-I618 HydrophobicContact CG1-CG1 4.39Å; V614-I618 WeakPolarHBondContact O-CB 3.26Å; V614-I618 VanDerWaalsContact O-CG1 3.26Å; V614-I618 WeakPolarHBondContact O-CG1 3.42Å; V614-I618 PolarHBondContact O-N 3.19Å; V614-E647 HydrophobicContact CG2-CB 4.12Å
615	N	77.8	Confident	70.1	Confident	58 Å²	58	55.6 Å²	55.6	31%	0.31	26%	0.263	S	S	.	.	H	α-helix	trans	-60.3	-39.6	172.4	-70.3	-24	0	0	0	111.9	K611 N612 V613 I618 Q619 R650	K611-N615 VanDerWaalsContact O-CG 3.25Å; K611-N615 PolarHBondContact O-N 3.25Å; K611-N615 PolarHBondContact O-ND2 3.25Å; N612-N615 PolarHBondContact O-N 2.87Å; V613-N615 PolarHBondContact O-N 3.11Å; N615-I618 PolarHBondContact O-N 3.41Å; N615-Q619 WeakPolarHBondContact O-CG 3.29Å; N615-Q619 PolarHBondContact O-N 3.34Å; N615-R650 PolarHBondContact OD1-NH1 3.09Å; N615-R650 PolarHBondContact OD1-NH2 3.39Å
616	A	70.1	Confident	69.7	Low	3 Å²	3	55.8 Å²	55.8	3%	0.025	27%	0.265	C	S	.	.	H	α-helix	trans	-67	-38.6	175.6	0	0	0	0	0	112.1	L586 F598 N612 V613 V614 Q619 M620	L586-A616 HydrophobicContact CD1-CB 4.37Å; L586-A616 HydrophobicContact CD2-CB 4.25Å; L586-A616 HydrophobicContact CG-CB 4.34Å; F598-A616 HydrophobicContact CE1-CB 4.47Å; N612-A616 WeakPolarHBondContact O-CB 3.43Å; N612-A616 PolarHBondContact O-N 2.95Å; V613-A616 CarbonylContact O-C 3.49Å; V613-A616 WeakPolarHBondContact O-CB 3.45Å; V613-A616 PolarHBondContact O-N 3.4Å; V613-A616 VanDerWaalsContact O-N 3.12Å; V614-A616 VanDerWaalsContact C-N 3.3Å; V614-A616 PolarHBondContact O-N 2.87Å; A616-Q619 PolarHBondContact O-N 3.47Å; A616-M620 VanDerWaalsContact O-CG 3.26Å; A616-M620 WeakPolarHBondContact O-CG 3.37Å; A616-M620 PolarHBondContact O-N 3.44Å; A616-M620 VanDerWaalsContact O-N 3.08Å
617	W	73.9	Confident	69.7	Low	1 Å²	1	60.8 Å²	60.8	0%	0.004	29%	0.286	C	S	.	.	H	α-helix	trans	-65.2	-40.3	173.5	-65.8	-16.4	0	0	0	112.6	F598 S602 M606 V613 V614 Q619 M620 G621 L624 L629 L633 Y651	F598-W617 AromaticContact CD1-CD1 3.9Å; F598-W617 AromaticContact CD1-NE1 3.97Å; S602-W617 WeakPolarHBondContact OG-CZ2 3.14Å; S602-W617 PolarHBondContact OG-NE1 3.43Å; M606-W617 HydrophobicContact CE-CH2 4.21Å; M606-W617 HydrophobicContact CE-CZ3 4.39Å; M606-W617 HydrophobicContact CG-CH2 3.83Å; M606-W617 HydrophobicContact CG-CZ2 3.95Å; M606-W617 HydrophobicContact SD-CH2 3.81Å; M606-W617 HydrophobicContact SD-CZ2 4.16Å; M606-W617 HydrophobicContact SD-CZ3 4.24Å; V613-W617 HydrophobicContact CG1-CD2 4.16Å; V613-W617 HydrophobicContact CG1-CZ2 3.81Å; V613-W617 PolarHBondContact O-N 3.37Å; V614-W617 HydrophobicContact CG2-CE3 4.16Å; V614-W617 HydrophobicContact CG2-CZ3 4.31Å; V614-W617 PolarHBondContact O-N 2.62Å; W617-Q619 VanDerWaalsContact C-N 3.33Å; W617-Q619 PolarHBondContact O-N 3.07Å; W617-M620 PolarHBondContact O-N 3.46Å; W617-G621 PolarHBondContact O-N 3.16Å; W617-G621 VanDerWaalsContact O-N 3.12Å; W617-L624 HydrophobicContact CB-CD1 4.36Å; W617-L624 HydrophobicContact CG-CD1 4.28Å; W617-L629 HydrophobicContact CD2-CD1 4.44Å; W617-L629 HydrophobicContact CZ2-CD1 4.48Å; W617-L629 HydrophobicContact CZ2-CD2 4.11Å; W617-L633 HydrophobicContact CH2-CD1 4.42Å; W617-L633 HydrophobicContact CH2-CD2 3.85Å; W617-L633 HydrophobicContact CH2-CG 4.24Å; W617-L633 HydrophobicContact CZ3-CD1 4.12Å; W617-L633 HydrophobicContact CZ3-CD2 3.75Å; W617-L633 HydrophobicContact CZ3-CG 4.29Å; W617-Y651 HydrophobicContact CB-CD2 3.84Å; W617-Y651 HydrophobicContact CB-CE2 3.36Å; W617-Y651 HydrophobicContact CD2-CE2 4.41Å; W617-Y651 AromaticContact CE3-CD1 3.68Å; W617-Y651 HydrophobicContact CE3-CD1 3.68Å; W617-Y651 AromaticContact CE3-CD2 3.93Å; W617-Y651 HydrophobicContact CE3-CD2 3.93Å; W617-Y651 AromaticContact CE3-CE1 3.73Å; W617-Y651 HydrophobicContact CE3-CE1 3.73Å; W617-Y651 HydrophobicContact CE3-CE2 4.02Å; W617-Y651 AromaticContact CE3-CG 3.77Å; W617-Y651 HydrophobicContact CE3-CG 3.77Å; W617-Y651 AromaticContact CE3-CZ 3.9Å; W617-Y651 HydrophobicContact CG-CE2 4.25Å; W617-Y651 AromaticContact CZ3-CD1 3.95Å; W617-Y651 HydrophobicContact CZ3-CD1 3.95Å; W617-Y651 HydrophobicContact CZ3-CE1 4.15Å; W617-Y651 HydrophobicContact CZ3-CG 4.33Å
618	I	74.5	Confident	69.5	Low	40 Å²	40	60.9 Å²	60.9	21%	0.205	29%	0.285	C	S	.	.	H	α-helix	trans	-60.6	-43.7	174.5	-71.4	168.6	0	0	0	110.2	V614 N615 M620 G621 Y651 F654	V614-I618 HydrophobicContact CG1-CD1 3.86Å; V614-I618 HydrophobicContact CG1-CG1 4.39Å; V614-I618 WeakPolarHBondContact O-CB 3.26Å; V614-I618 VanDerWaalsContact O-CG1 3.26Å; V614-I618 WeakPolarHBondContact O-CG1 3.42Å; V614-I618 PolarHBondContact O-N 3.19Å; N615-I618 PolarHBondContact O-N 3.41Å; I618-M620 VanDerWaalsContact C-N 3.32Å; I618-M620 PolarHBondContact O-N 3.22Å; I618-G621 PolarHBondContact O-N 2.77Å; I618-Y651 HydrophobicContact CG1-CD2 4.22Å; I618-F654 HydrophobicContact CB-CD1 4.48Å; I618-F654 HydrophobicContact CB-CE1 4.39Å; I618-F654 HydrophobicContact CB-CE2 4.45Å; I618-F654 HydrophobicContact CB-CZ 4.38Å; I618-F654 HydrophobicContact CG1-CB 4.29Å; I618-F654 HydrophobicContact CG1-CD1 4.02Å; I618-F654 HydrophobicContact CG1-CD2 4.3Å; I618-F654 HydrophobicContact CG1-CE1 4.41Å; I618-F654 HydrophobicContact CG1-CG 3.95Å; I618-F654 HydrophobicContact CG2-CD2 3.88Å; I618-F654 HydrophobicContact CG2-CE1 4.39Å; I618-F654 HydrophobicContact CG2-CE2 3.63Å; I618-F654 HydrophobicContact CG2-CG 4.35Å; I618-F654 HydrophobicContact CG2-CZ 3.93Å; I618-F654 WeakPolarHBondContact O-CZ 3.38Å
619	Q	72.8	Confident	69.5	Low	151 Å²	151	56.4 Å²	56.4	71%	0.706	26%	0.264	S	S	*	.	H	α-helix	trans	-63.3	-34.3	176	-75.1	177.1	-1.8	0	0	113.5	N615 A616 W617 G621	N615-Q619 WeakPolarHBondContact O-CG 3.29Å; N615-Q619 PolarHBondContact O-N 3.34Å; A616-Q619 PolarHBondContact O-N 3.47Å; W617-Q619 VanDerWaalsContact C-N 3.33Å; W617-Q619 PolarHBondContact O-N 3.07Å; Q619-G621 VanDerWaalsContact C-N 3.33Å
620	M	63	Low	69.1	Low	17 Å²	17	55.3 Å²	55.3	8%	0.084	26%	0.259	C	S	.	.	H	α-helix	trans	-75.2	-22.5	178.1	-67.9	-70.1	165	0	0	113	A590 C593 F598 A616 W617 I618 K622 R623 L624	A590-M620 VanDerWaalsContact O-CE 3.24Å; A590-M620 WeakPolarHBondContact O-CE 3.36Å; C593-M620 HydrophobicContact CB-CE 3.74Å; C593-M620 HydrophobicContact CB-SD 3.46Å; C593-M620 WeakPolarHBondContact CB-SD 2.97Å; C593-M620 WeakPolarHBondContact SG-CE 3.44Å; C593-M620 PolarHBondContact SG-SD 2.83Å; F598-M620 HydrophobicContact CE2-CE 3.65Å; F598-M620 HydrophobicContact CE2-CG 4.24Å; F598-M620 HydrophobicContact CE2-SD 4.17Å; F598-M620 HydrophobicContact CZ-CE 3.62Å; F598-M620 HydrophobicContact CZ-CG 4.06Å; F598-M620 HydrophobicContact CZ-SD 4.41Å; A616-M620 VanDerWaalsContact O-CG 3.26Å; A616-M620 WeakPolarHBondContact O-CG 3.37Å; A616-M620 PolarHBondContact O-N 3.44Å; A616-M620 VanDerWaalsContact O-N 3.08Å; W617-M620 PolarHBondContact O-N 3.46Å; I618-M620 VanDerWaalsContact C-N 3.32Å; I618-M620 PolarHBondContact O-N 3.22Å; M620-K622 PolarHBondContact O-N 2.81Å; M620-R623 PolarHBondContact O-N 3.36Å; M620-L624 HydrophobicContact CB-CD1 3.77Å; M620-L624 HydrophobicContact CB-CG 4.14Å; M620-L624 HydrophobicContact CG-CD1 4.3Å
621	G	65.8	Low	68.9	Low	11 Å²	11	57.8 Å²	57.8	11%	0.113	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	51.7	-118.4	171.1	0	0	0	0	0	113.5	W617 I618 Q619 R623	W617-G621 PolarHBondContact O-N 3.16Å; W617-G621 VanDerWaalsContact O-N 3.12Å; I618-G621 PolarHBondContact O-N 2.77Å; Q619-G621 VanDerWaalsContact C-N 3.33Å; G621-R623 PolarHBondContact O-N 3.21Å
622	K	62.2	Low	68.3	Low	175 Å²	175	54 Å²	54	76%	0.761	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-70.9	-5.7	-173	-66.7	-176.7	178.7	-175.8	0	115.6	M620 L659	M620-K622 PolarHBondContact O-N 2.81Å; K622-L659 HydrophobicContact CB-CD2 4.35Å; K622-L659 HydrophobicContact CG-CD2 3.48Å; K622-L659 VanDerWaalsContact CG-CD2 3.48Å
623	R	61.3	Low	67.9	Low	156 Å²	156	50.7 Å²	50.7	59%	0.589	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-84.1	-19.8	-176	-67.2	-172.9	174.1	-162.8	-0.6	114	E595 M620 G621	E595-R623 VanDerWaalsContact CG-O 3.29Å; E595-R623 WeakPolarHBondContact CG-O 2.84Å; M620-R623 PolarHBondContact O-N 3.36Å; G621-R623 PolarHBondContact O-N 3.21Å
624	L	67.3	Low	67.3	Low	6 Å²	6	54.1 Å²	54.1	3%	0.031	26%	0.261	C	S	.	.	S	Bend	trans	-99.8	122.3	-179.5	-67	170.4	0	0	0	109.3	F598 Y599 W617 M620 P626 L629	F598-L624 HydrophobicContact CB-CD2 3.72Å; F598-L624 HydrophobicContact CD1-CD1 4.43Å; F598-L624 HydrophobicContact CG-CD2 4.1Å; Y599-L624 HydrophobicContact CE1-CD2 4.49Å; W617-L624 HydrophobicContact CB-CD1 4.36Å; W617-L624 HydrophobicContact CG-CD1 4.28Å; M620-L624 HydrophobicContact CB-CD1 3.77Å; M620-L624 HydrophobicContact CB-CG 4.14Å; M620-L624 HydrophobicContact CG-CD1 4.3Å; L624-P626 WeakPolarHBondContact O-CD 3.01Å; L624-L629 HydrophobicContact CB-CD1 4.44Å
625	D	65.6	Low	66.8	Low	72 Å²	72	59 Å²	59	39%	0.385	29%	0.287	S	S	.	.			trans	-64	115.2	165.4	-63.1	-33.3	0	0	0	109.1	Y599 K627 K628	Y599-D625 WeakPolarHBondContact OH-CA 3.47Å; Y599-D625 VanDerWaalsContact OH-CB 3.26Å; Y599-D625 WeakPolarHBondContact OH-CB 3.46Å; Y599-D625 PolarHBondContact OH-N 2.84Å; Y599-D625 PolarHBondContact OH-O 3.14Å; D625-K627 PolarHBondContact O-N 3.1Å; D625-K628 HydrophobicContact CB-CD 4.49Å; D625-K628 PolarHBondContact O-N 3.4Å; D625-K628 IonicContact OD2-NZ 3.68Å; D625-K628 PolarHBondContact OD2-NZ 3.11Å
626	P	65.6	Low	65.7	Low	10 Å²	10	60.1 Å²	60.1	7%	0.065	29%	0.287	C	S	.	.	H	α-helix	trans	-64.2	-28.3	178.9	-20.4	33.6	0	0	0	111.7	L624 K628 L629 I630 V661 I666	L624-P626 WeakPolarHBondContact O-CD 3.01Å; P626-K628 VanDerWaalsContact C-N 3.3Å; P626-K628 PolarHBondContact O-N 3.14Å; P626-L629 WeakPolarHBondContact O-CA 3.37Å; P626-L629 WeakPolarHBondContact O-CB 3.46Å; P626-L629 PolarHBondContact O-N 3.08Å; P626-I630 WeakPolarHBondContact O-CG1 3.48Å; P626-I630 PolarHBondContact O-N 3.22Å; P626-V661 HydrophobicContact CG-CG2 4.33Å; P626-I666 HydrophobicContact CB-CD1 3.55Å; P626-I666 HydrophobicContact CB-CG1 4.33Å; P626-I666 HydrophobicContact CG-CD1 3.91Å
627	K	67.3	Low	65	Low	122 Å²	122	61.1 Å²	61.1	53%	0.53	29%	0.294	S	S	.	.	H	α-helix	trans	-49.1	-45	177.6	-70.6	-177.4	156.3	134.2	0	114.2	D625 L629 I630 P631 E663	D625-K627 PolarHBondContact O-N 3.1Å; K627-L629 PolarHBondContact O-N 3.34Å; K627-I630 PolarHBondContact O-N 3.43Å; K627-P631 WeakPolarHBondContact O-CD 3.44Å; K627-E663 WeakPolarHBondContact CD-OE1 2.92Å; K627-E663 WeakPolarHBondContact CD-OE2 3.48Å; K627-E663 WeakPolarHBondContact CE-OE1 3.14Å; K627-E663 WeakPolarHBondContact CE-OE2 3.4Å; K627-E663 WeakPolarHBondContact CG-OE2 3.48Å; K627-E663 IonicContact NZ-OE1 3.76Å; K627-E663 PolarHBondContact NZ-OE1 3.24Å; K627-E663 IonicContact NZ-OE2 3.84Å
628	K	66.9	Low	64.2	Low	117 Å²	117	68.4 Å²	68.4	51%	0.509	33%	0.328	S	S	.	.	H	α-helix	trans	-76.9	-15.9	-176.2	-69.2	170.3	-174.4	141.7	0	112.2	Y599 D625 P626	Y599-K628 HydrophobicContact CD1-CB 3.66Å; Y599-K628 HydrophobicContact CD1-CD 4.46Å; Y599-K628 HydrophobicContact CD2-CD 4.03Å; Y599-K628 HydrophobicContact CE1-CB 3.48Å; Y599-K628 VanDerWaalsContact CE1-CB 3.48Å; Y599-K628 HydrophobicContact CE1-CD 4.08Å; Y599-K628 HydrophobicContact CE1-CG 4.42Å; Y599-K628 HydrophobicContact CE2-CB 4.5Å; Y599-K628 HydrophobicContact CE2-CD 3.61Å; Y599-K628 HydrophobicContact CG-CB 4.28Å; Y599-K628 HydrophobicContact CG-CD 4.45Å; D625-K628 HydrophobicContact CB-CD 4.49Å; D625-K628 PolarHBondContact O-N 3.4Å; D625-K628 IonicContact OD2-NZ 3.68Å; D625-K628 PolarHBondContact OD2-NZ 3.11Å; P626-K628 VanDerWaalsContact C-N 3.3Å; P626-K628 PolarHBondContact O-N 3.14Å
629	L	67.5	Low	63.3	Low	2 Å²	2	74.3 Å²	74.3	1%	0.01	36%	0.357	C	S	.	.	H	α-helix	trans	-91.1	-17.9	176.1	-61	172.6	0	0	0	112.3	Y599 W617 L624 P626 K627 A632 L633 Y651	Y599-L629 HydrophobicContact CD1-CD2 3.7Å; Y599-L629 HydrophobicContact CD1-CG 4.1Å; Y599-L629 HydrophobicContact CE1-CD2 4.02Å; Y599-L629 HydrophobicContact CE1-CG 3.92Å; W617-L629 HydrophobicContact CD2-CD1 4.44Å; W617-L629 HydrophobicContact CZ2-CD1 4.48Å; W617-L629 HydrophobicContact CZ2-CD2 4.11Å; L624-L629 HydrophobicContact CB-CD1 4.44Å; P626-L629 WeakPolarHBondContact O-CA 3.37Å; P626-L629 WeakPolarHBondContact O-CB 3.46Å; P626-L629 PolarHBondContact O-N 3.08Å; K627-L629 PolarHBondContact O-N 3.34Å; L629-A632 PolarHBondContact O-N 3.49Å; L629-L633 HydrophobicContact CB-CD1 4.15Å; L629-L633 WeakPolarHBondContact O-CB 3.25Å; L629-L633 VanDerWaalsContact O-CG 3.31Å; L629-L633 WeakPolarHBondContact O-CG 3.24Å; L629-L633 PolarHBondContact O-N 2.86Å; L629-Y651 HydrophobicContact CD1-CE1 4.32Å
630	I	66	Low	62.3	Low	21 Å²	21	68.4 Å²	68.4	11%	0.108	34%	0.337	C	S	.	.	H	α-helix	trans	-56.4	-49.9	179.3	-64.3	172.8	0	0	0	112.3	P626 K627 A632 L633 M634 A665 I666	P626-I630 WeakPolarHBondContact O-CG1 3.48Å; P626-I630 PolarHBondContact O-N 3.22Å; K627-I630 PolarHBondContact O-N 3.43Å; I630-A632 VanDerWaalsContact C-N 3.29Å; I630-A632 PolarHBondContact O-N 2.79Å; I630-L633 PolarHBondContact O-N 3.22Å; I630-L633 VanDerWaalsContact O-N 3.14Å; I630-M634 HydrophobicContact CG2-CG 3.89Å; I630-M634 HydrophobicContact CG2-SD 3.52Å; I630-M634 VanDerWaalsContact CG2-SD 3.52Å; I630-M634 WeakPolarHBondContact O-CB 3.48Å; I630-M634 VanDerWaalsContact O-CG 3.3Å; I630-M634 WeakPolarHBondContact O-CG 3.4Å; I630-M634 PolarHBondContact O-N 3.01Å; I630-A665 HydrophobicContact CD1-CB 4.17Å; I630-I666 HydrophobicContact CD1-CG1 4.12Å
631	P	64.3	Low	62.1	Low	75 Å²	75	70.8 Å²	70.8	49%	0.487	36%	0.355	S	S	.	.	H	α-helix	trans	-64.2	-34.4	-178.9	-22.4	34.6	0	0	0	112.9	K627 N635	K627-P631 WeakPolarHBondContact O-CD 3.44Å; P631-N635 WeakPolarHBondContact O-CB 3.42Å; P631-N635 PolarHBondContact O-N 3.24Å; P631-N635 VanDerWaalsContact O-N 3.08Å; P631-N635 PolarHBondContact O-ND2 3.3Å
632	A	61.3	Low	61.9	Low	19 Å²	19	75 Å²	75	16%	0.157	38%	0.379	C	S	.	.	H	α-helix	trans	-64	-51.7	172.5	0	0	0	0	0	109.6	P603 L629 I630 M634 N635 Y636	P603-A632 HydrophobicContact CG-CB 4.31Å; L629-A632 PolarHBondContact O-N 3.49Å; I630-A632 VanDerWaalsContact C-N 3.29Å; I630-A632 PolarHBondContact O-N 2.79Å; A632-M634 VanDerWaalsContact C-N 3.33Å; A632-M634 PolarHBondContact O-N 3.3Å; A632-N635 PolarHBondContact O-N 3Å; A632-Y636 WeakPolarHBondContact O-CD2 3.27Å; A632-Y636 PolarHBondContact O-N 3.36Å
633	L	65.8	Low	61.9	Low	5 Å²	5	72.8 Å²	72.8	3%	0.026	37%	0.371	C	S	.	.	H	α-helix	trans	-63.4	-34.4	-179.2	-69.7	164.4	0	0	0	113.7	M606 W617 L629 I630 S637 T648 Y651 M652 Y669	M606-L633 HydrophobicContact CE-CD2 4.19Å; W617-L633 HydrophobicContact CH2-CD1 4.42Å; W617-L633 HydrophobicContact CH2-CD2 3.85Å; W617-L633 HydrophobicContact CH2-CG 4.24Å; W617-L633 HydrophobicContact CZ3-CD1 4.12Å; W617-L633 HydrophobicContact CZ3-CD2 3.75Å; W617-L633 HydrophobicContact CZ3-CG 4.29Å; L629-L633 HydrophobicContact CB-CD1 4.15Å; L629-L633 WeakPolarHBondContact O-CB 3.25Å; L629-L633 VanDerWaalsContact O-CG 3.31Å; L629-L633 WeakPolarHBondContact O-CG 3.24Å; L629-L633 PolarHBondContact O-N 2.86Å; I630-L633 PolarHBondContact O-N 3.22Å; I630-L633 VanDerWaalsContact O-N 3.14Å; L633-S637 VanDerWaalsContact O-CB 3.31Å; L633-S637 WeakPolarHBondContact O-CB 3.43Å; L633-S637 PolarHBondContact O-N 3.2Å; L633-S637 PolarHBondContact O-OG 2.97Å; L633-T648 HydrophobicContact CB-CG2 4.49Å; L633-T648 HydrophobicContact CD2-CG2 4.04Å; L633-Y651 HydrophobicContact CD1-CD1 4.3Å; L633-M652 HydrophobicContact CD1-CE 3.5Å; L633-Y669 PolarHBondContact O-OH 3.08Å
634	M	61.5	Low	62	Low	76 Å²	76	67.5 Å²	67.5	37%	0.374	35%	0.353	S	S	.	.	H	α-helix	trans	-73.5	-42.6	178.1	-73.8	-175.3	73.1	0	0	112.9	I630 A632 Y636 S637 Q638 Y669	I630-M634 HydrophobicContact CG2-CG 3.89Å; I630-M634 HydrophobicContact CG2-SD 3.52Å; I630-M634 VanDerWaalsContact CG2-SD 3.52Å; I630-M634 WeakPolarHBondContact O-CB 3.48Å; I630-M634 VanDerWaalsContact O-CG 3.3Å; I630-M634 WeakPolarHBondContact O-CG 3.4Å; I630-M634 PolarHBondContact O-N 3.01Å; A632-M634 VanDerWaalsContact C-N 3.33Å; A632-M634 PolarHBondContact O-N 3.3Å; M634-Y636 VanDerWaalsContact C-N 3.26Å; M634-Y636 PolarHBondContact O-N 3.42Å; M634-S637 PolarHBondContact O-OG 3.47Å; M634-Q638 WeakPolarHBondContact O-CG 3.26Å; M634-Y669 HydrophobicContact CG-CD2 4.11Å; M634-Y669 HydrophobicContact CG-CE2 3.63Å
635	N	61.9	Low	62.1	Low	103 Å²	103	67.8 Å²	67.8	55%	0.551	35%	0.354	S	S	*	.	H	α-helix	trans	-65.3	-32.2	177.8	-78.3	-16.7	0	0	0	111.6	P631 A632	P631-N635 WeakPolarHBondContact O-CB 3.42Å; P631-N635 PolarHBondContact O-N 3.24Å; P631-N635 VanDerWaalsContact O-N 3.08Å; P631-N635 PolarHBondContact O-ND2 3.3Å; A632-N635 PolarHBondContact O-N 3Å
636	Y	56	Low	62.3	Low	80 Å²	80	67.5 Å²	67.5	31%	0.314	35%	0.353	S	S	.	.	H	α-helix	trans	-88.8	-29.5	-178.9	-65.4	-64.5	0	0	0	114.1	P603 A632 M634 Q638 M639 G640	P603-Y636 HydrophobicContact CB-CE2 3.89Å; P603-Y636 WeakPolarHBondContact CB-OH 3.18Å; A632-Y636 WeakPolarHBondContact O-CD2 3.27Å; A632-Y636 PolarHBondContact O-N 3.36Å; M634-Y636 VanDerWaalsContact C-N 3.26Å; M634-Y636 PolarHBondContact O-N 3.42Å; Y636-Q638 PolarHBondContact O-N 3.22Å; Y636-M639 PolarHBondContact O-N 3.32Å; Y636-M639 VanDerWaalsContact O-N 3.08Å; Y636-G640 PolarHBondContact O-N 3.43Å
637	S	55.1	Low	62.6	Low	24 Å²	24	68.3 Å²	68.3	17%	0.168	36%	0.356	C	S	.	.	H	α-helix	trans	-65.3	-20.6	172.7	67.8	0	0	0	0	113.2	L633 M634 Y669	L633-S637 VanDerWaalsContact O-CB 3.31Å; L633-S637 WeakPolarHBondContact O-CB 3.43Å; L633-S637 PolarHBondContact O-N 3.2Å; L633-S637 PolarHBondContact O-OG 2.97Å; M634-S637 PolarHBondContact O-OG 3.47Å; S637-Y669 WeakPolarHBondContact CB-OH 3.47Å; S637-Y669 PolarHBondContact OG-OH 3.48Å
638	Q	56.3	Low	62.8	Low	154 Å²	154	62.8 Å²	62.8	72%	0.72	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-20.5	173.1	-67.6	-177.5	1.9	0	0	113.8	M634 Y636	M634-Q638 WeakPolarHBondContact O-CG 3.26Å; Y636-Q638 PolarHBondContact O-N 3.22Å
639	M	54.9	Low	63.1	Low	164 Å²	164	57.2 Å²	57.2	81%	0.808	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-15.7	-170.7	-69	-166.1	87.8	0	0	116.8	Y636	Y636-M639 PolarHBondContact O-N 3.32Å; Y636-M639 VanDerWaalsContact O-N 3.08Å
640	G	53.3	Low	63.5	Low	27 Å²	27	62.4 Å²	62.4	28%	0.278	33%	0.328	S	S	.	.	S	Bend	trans	177.3	148.2	173.4	0	0	0	0	0	120.4	Y636 Q644	Y636-G640 PolarHBondContact O-N 3.43Å; G640-Q644 PolarHBondContact O-OE1 3.45Å
641	S	58.6	Low	63.8	Low	68 Å²	68	61.4 Å²	61.4	48%	0.476	32%	0.323	S	S	.	.			trans	61.8	125.5	160.9	67.9	0	0	0	0	120.6	Q643 Q644 I645	S641-Q643 PolarHBondContact O-N 2.94Å; S641-Q644 PolarHBondContact O-N 3.4Å; S641-Q644 VanDerWaalsContact OG-CD 3.23Å; S641-Q644 WeakPolarHBondContact OG-CG 3.25Å; S641-Q644 PolarHBondContact OG-OE1 3.34Å; S641-I645 PolarHBondContact O-N 2.99Å
642	T	60.8	Low	64.3	Low	99 Å²	99	57.9 Å²	57.9	61%	0.607	30%	0.3	S	S	*	.	H	α-helix	trans	-51.5	-28.6	176.3	-42.8	0	0	0	0	113.9	N646	T642-N646 WeakPolarHBondContact O-CB 3.3Å; T642-N646 PolarHBondContact O-N 3.09Å; T642-N646 PolarHBondContact O-ND2 2.81Å
643	Q	61.9	Low	64.9	Low	128 Å²	128	59.4 Å²	59.4	60%	0.598	30%	0.304	S	S	*	.	H	α-helix	trans	-69.7	-41.3	177.3	-69.5	-175.9	-1.9	0	0	112.5	S641 I645 N646 E647	S641-Q643 PolarHBondContact O-N 2.94Å; Q643-I645 VanDerWaalsContact C-N 3.33Å; Q643-N646 PolarHBondContact O-N 3.48Å; Q643-E647 WeakPolarHBondContact O-CG 3.12Å; Q643-E647 PolarHBondContact O-N 3.2Å
644	Q	64.9	Low	65.4	Low	45 Å²	45	60.2 Å²	60.2	21%	0.21	31%	0.307	C	S	.	.	H	α-helix	trans	-69.1	-35.3	178.7	-69.8	173.2	-15.3	0	0	111.2	P610 G640 S641 T648	P610-Q644 HydrophobicContact CB-CG 4.07Å; P610-Q644 HydrophobicContact CG-CG 3.93Å; G640-Q644 PolarHBondContact O-OE1 3.45Å; S641-Q644 PolarHBondContact O-N 3.4Å; S641-Q644 VanDerWaalsContact OG-CD 3.23Å; S641-Q644 WeakPolarHBondContact OG-CG 3.25Å; S641-Q644 PolarHBondContact OG-OE1 3.34Å; Q644-T648 WeakPolarHBondContact O-CB 3.4Å; Q644-T648 PolarHBondContact O-N 3.46Å; Q644-T648 PolarHBondContact O-OG1 2.8Å
645	I	67.9	Low	65.7	Low	12 Å²	12	56.6 Å²	56.6	6%	0.062	29%	0.289	C	S	.	.	H	α-helix	trans	-66.3	-44.6	174.6	-59.5	173.4	0	0	0	110.6	S641 Q643 E647 T648 I649 Y677	S641-I645 PolarHBondContact O-N 2.99Å; Q643-I645 VanDerWaalsContact C-N 3.33Å; I645-E647 PolarHBondContact O-N 2.97Å; I645-T648 WeakPolarHBondContact O-CB 3.43Å; I645-T648 PolarHBondContact O-N 2.96Å; I645-I649 HydrophobicContact CG2-CD1 4.14Å; I645-I649 WeakPolarHBondContact O-CG1 3.17Å; I645-I649 PolarHBondContact O-N 3.2Å; I645-Y677 HydrophobicContact CD1-CE1 3.9Å; I645-Y677 HydrophobicContact CD1-CE2 4.19Å; I645-Y677 HydrophobicContact CG2-CD2 3.82Å; I645-Y677 HydrophobicContact CG2-CE2 3.98Å; I645-Y677 HydrophobicContact CG2-CG 4.13Å
646	N	71.1	Confident	66.1	Low	67 Å²	67	52.3 Å²	52.3	36%	0.358	27%	0.267	S	S	.	.	H	α-helix	trans	-64.3	-39.2	177.9	-75.5	-18.7	0	0	0	113	T642 Q643 I649 R650	T642-N646 WeakPolarHBondContact O-CB 3.3Å; T642-N646 PolarHBondContact O-N 3.09Å; T642-N646 PolarHBondContact O-ND2 2.81Å; Q643-N646 PolarHBondContact O-N 3.48Å; N646-I649 PolarHBondContact O-N 3.48Å; N646-R650 WeakPolarHBondContact O-CB 3.42Å; N646-R650 PolarHBondContact O-N 2.52Å
647	E	70.6	Confident	66.8	Low	26 Å²	26	53 Å²	53	12%	0.121	27%	0.269	C	S	.	.	H	α-helix	trans	-73.1	-30.5	175.3	-59.8	-62.9	163.2	0	0	111.9	K611 V614 Q643 I645 R650 Y651	K611-E647 HydrophobicContact CG-CG 4Å; V614-E647 HydrophobicContact CG2-CB 4.12Å; Q643-E647 WeakPolarHBondContact O-CG 3.12Å; Q643-E647 PolarHBondContact O-N 3.2Å; I645-E647 PolarHBondContact O-N 2.97Å; E647-R650 PolarHBondContact O-N 2.95Å; E647-R650 WeakPolarHBondContact OE2-CD 3.36Å; E647-R650 IonicContact OE2-NH1 3.7Å; E647-R650 PolarHBondContact OE2-NH1 2.85Å; E647-Y651 PolarHBondContact O-N 2.83Å
648	T	72	Confident	67.2	Low	6 Å²	6	58.4 Å²	58.4	4%	0.037	29%	0.292	C	S	.	.	H	α-helix	trans	-63.1	-44.6	170.1	-59.1	0	0	0	0	110.7	L633 Q644 I645 R650 Y651 M652 Y669 L673	L633-T648 HydrophobicContact CB-CG2 4.49Å; L633-T648 HydrophobicContact CD2-CG2 4.04Å; Q644-T648 WeakPolarHBondContact O-CB 3.4Å; Q644-T648 PolarHBondContact O-N 3.46Å; Q644-T648 PolarHBondContact O-OG1 2.8Å; I645-T648 WeakPolarHBondContact O-CB 3.43Å; I645-T648 PolarHBondContact O-N 2.96Å; T648-R650 VanDerWaalsContact C-N 3.34Å; T648-R650 PolarHBondContact O-N 3.38Å; T648-Y651 PolarHBondContact O-N 3.12Å; T648-M652 VanDerWaalsContact O-CG 3.28Å; T648-M652 WeakPolarHBondContact O-CG 3.36Å; T648-M652 PolarHBondContact O-N 3.49Å; T648-Y669 HydrophobicContact CG2-CE1 4.04Å; T648-L673 HydrophobicContact CG2-CD1 3.96Å
649	I	73.8	Confident	67.4	Low	1 Å²	1	52.3 Å²	52.3	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-60.1	-45.7	174	-68.6	167.7	0	0	0	110	I645 N646 Y651 M652 E653 L673 Y674	I645-I649 HydrophobicContact CG2-CD1 4.14Å; I645-I649 WeakPolarHBondContact O-CG1 3.17Å; I645-I649 PolarHBondContact O-N 3.2Å; N646-I649 PolarHBondContact O-N 3.48Å; I649-Y651 VanDerWaalsContact C-N 3.34Å; I649-Y651 PolarHBondContact O-N 3.42Å; I649-M652 PolarHBondContact O-N 3.18Å; I649-E653 HydrophobicContact CG2-CG 4.19Å; I649-E653 WeakPolarHBondContact CG2-OE1 3.41Å; I649-E653 WeakPolarHBondContact O-CB 3.22Å; I649-E653 WeakPolarHBondContact O-CG 3.26Å; I649-E653 PolarHBondContact O-N 3.05Å; I649-L673 HydrophobicContact CD1-CB 4.49Å; I649-L673 HydrophobicContact CG1-CB 4.14Å; I649-L673 HydrophobicContact CG1-CD1 4.16Å; I649-Y674 HydrophobicContact CG2-CD1 4.49Å; I649-Y674 HydrophobicContact CG2-CE1 3.75Å
650	R	75.2	Confident	67.8	Low	111 Å²	111	50.3 Å²	50.3	42%	0.419	26%	0.257	S	S	.	.	H	α-helix	trans	-59.6	-41.7	178.4	-174.3	-177.6	176.4	-156.8	-7.3	112.9	N615 N646 E647 T648 F654	N615-R650 PolarHBondContact OD1-NH1 3.09Å; N615-R650 PolarHBondContact OD1-NH2 3.39Å; N646-R650 WeakPolarHBondContact O-CB 3.42Å; N646-R650 PolarHBondContact O-N 2.52Å; E647-R650 PolarHBondContact O-N 2.95Å; E647-R650 WeakPolarHBondContact OE2-CD 3.36Å; E647-R650 IonicContact OE2-NH1 3.7Å; E647-R650 PolarHBondContact OE2-NH1 2.85Å; T648-R650 VanDerWaalsContact C-N 3.34Å; T648-R650 PolarHBondContact O-N 3.38Å; R650-F654 PolarHBondContact O-N 2.67Å; R650-F654 VanDerWaalsContact O-N 3.07Å
651	Y	73.4	Confident	68.5	Low	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-67.5	-41.4	175.8	-177.7	-115.7	0	0	0	112	W617 I618 L629 L633 E647 T648 I649 F654 C655	W617-Y651 HydrophobicContact CB-CD2 3.84Å; W617-Y651 HydrophobicContact CB-CE2 3.36Å; W617-Y651 HydrophobicContact CD2-CE2 4.41Å; W617-Y651 AromaticContact CE3-CD1 3.68Å; W617-Y651 HydrophobicContact CE3-CD1 3.68Å; W617-Y651 AromaticContact CE3-CD2 3.93Å; W617-Y651 HydrophobicContact CE3-CD2 3.93Å; W617-Y651 AromaticContact CE3-CE1 3.73Å; W617-Y651 HydrophobicContact CE3-CE1 3.73Å; W617-Y651 HydrophobicContact CE3-CE2 4.02Å; W617-Y651 AromaticContact CE3-CG 3.77Å; W617-Y651 HydrophobicContact CE3-CG 3.77Å; W617-Y651 AromaticContact CE3-CZ 3.9Å; W617-Y651 HydrophobicContact CG-CE2 4.25Å; W617-Y651 AromaticContact CZ3-CD1 3.95Å; W617-Y651 HydrophobicContact CZ3-CD1 3.95Å; W617-Y651 HydrophobicContact CZ3-CE1 4.15Å; W617-Y651 HydrophobicContact CZ3-CG 4.33Å; I618-Y651 HydrophobicContact CG1-CD2 4.22Å; L629-Y651 HydrophobicContact CD1-CE1 4.32Å; L633-Y651 HydrophobicContact CD1-CD1 4.3Å; E647-Y651 PolarHBondContact O-N 2.83Å; T648-Y651 PolarHBondContact O-N 3.12Å; I649-Y651 VanDerWaalsContact C-N 3.34Å; I649-Y651 PolarHBondContact O-N 3.42Å; Y651-F654 HydrophobicContact CE2-CD1 4.47Å; Y651-F654 WeakPolarHBondContact O-CB 3.47Å; Y651-F654 PolarHBondContact O-N 3.12Å; Y651-C655 PolarHBondContact O-N 3.16Å; Y651-C655 PolarHBondContact O-SG 3.37Å
652	M	74	Confident	68.7	Low	1 Å²	1	51.2 Å²	51.2	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-67.2	-38.4	177.2	-68.4	-60	177.1	0	0	112	L633 T648 I649 F654 C655 V656 I666 Y669 L670	L633-M652 HydrophobicContact CD1-CE 3.5Å; T648-M652 VanDerWaalsContact O-CG 3.28Å; T648-M652 WeakPolarHBondContact O-CG 3.36Å; T648-M652 PolarHBondContact O-N 3.49Å; I649-M652 PolarHBondContact O-N 3.18Å; M652-F654 VanDerWaalsContact C-N 3.34Å; M652-F654 PolarHBondContact O-N 2.97Å; M652-C655 WeakPolarHBondContact O-CB 3.36Å; M652-C655 PolarHBondContact O-N 2.87Å; M652-V656 WeakPolarHBondContact O-CG2 3.49Å; M652-V656 PolarHBondContact O-N 3.02Å; M652-I666 HydrophobicContact SD-CG2 3.81Å; M652-Y669 HydrophobicContact CE-CD1 3.68Å; M652-Y669 HydrophobicContact CE-CE1 3.91Å; M652-Y669 HydrophobicContact CG-CD1 4.48Å; M652-Y669 HydrophobicContact SD-CD1 4.49Å; M652-L670 HydrophobicContact CB-CB 4.44Å; M652-L670 HydrophobicContact CB-CD1 3.85Å
653	E	75.1	Confident	69.1	Low	51 Å²	51	48.6 Å²	48.6	24%	0.238	24%	0.235	C	C	.	.	H	α-helix	trans	-58.4	-45.3	171	-79.2	172.6	176.1	0	0	111.2	I649 C655 V656 Y657 Y674	I649-E653 HydrophobicContact CG2-CG 4.19Å; I649-E653 WeakPolarHBondContact CG2-OE1 3.41Å; I649-E653 WeakPolarHBondContact O-CB 3.22Å; I649-E653 WeakPolarHBondContact O-CG 3.26Å; I649-E653 PolarHBondContact O-N 3.05Å; E653-C655 PolarHBondContact O-N 3.01Å; E653-V656 PolarHBondContact O-N 3.41Å; E653-Y657 HydrophobicContact CB-CD2 4.12Å; E653-Y657 HydrophobicContact CB-CE2 4.31Å; E653-Y657 HydrophobicContact CG-CE2 4.19Å; E653-Y657 WeakPolarHBondContact O-CB 2.99Å; E653-Y657 WeakPolarHBondContact O-CD2 3.36Å; E653-Y657 PolarHBondContact O-N 2.84Å; E653-Y674 VanDerWaalsContact CD-OH 3.27Å; E653-Y674 WeakPolarHBondContact CG-OH 3.29Å; E653-Y674 PolarHBondContact OE1-OH 3.18Å
654	F	74.6	Confident	69.6	Low	21 Å²	21	48.6 Å²	48.6	9%	0.092	24%	0.235	C	C	.	.	H	α-helix	trans	-62	-41.4	173.8	173.9	-96.4	0	0	0	112.3	I618 R650 Y651 M652 V656 E658 L659	I618-F654 HydrophobicContact CB-CD1 4.48Å; I618-F654 HydrophobicContact CB-CE1 4.39Å; I618-F654 HydrophobicContact CB-CE2 4.45Å; I618-F654 HydrophobicContact CB-CZ 4.38Å; I618-F654 HydrophobicContact CG1-CB 4.29Å; I618-F654 HydrophobicContact CG1-CD1 4.02Å; I618-F654 HydrophobicContact CG1-CD2 4.3Å; I618-F654 HydrophobicContact CG1-CE1 4.41Å; I618-F654 HydrophobicContact CG1-CG 3.95Å; I618-F654 HydrophobicContact CG2-CD2 3.88Å; I618-F654 HydrophobicContact CG2-CE1 4.39Å; I618-F654 HydrophobicContact CG2-CE2 3.63Å; I618-F654 HydrophobicContact CG2-CG 4.35Å; I618-F654 HydrophobicContact CG2-CZ 3.93Å; I618-F654 WeakPolarHBondContact O-CZ 3.38Å; R650-F654 PolarHBondContact O-N 2.67Å; R650-F654 VanDerWaalsContact O-N 3.07Å; Y651-F654 HydrophobicContact CE2-CD1 4.47Å; Y651-F654 WeakPolarHBondContact O-CB 3.47Å; Y651-F654 PolarHBondContact O-N 3.12Å; M652-F654 VanDerWaalsContact C-N 3.34Å; M652-F654 PolarHBondContact O-N 2.97Å; F654-V656 VanDerWaalsContact C-N 3.26Å; F654-V656 PolarHBondContact O-N 3Å; F654-E658 HydrophobicContact CD2-CB 3.79Å; F654-E658 VanDerWaalsContact CD2-CD 3.46Å; F654-E658 HydrophobicContact CD2-CG 3.94Å; F654-E658 WeakPolarHBondContact CD2-OE2 3.11Å; F654-E658 HydrophobicContact CE2-CB 3.82Å; F654-E658 HydrophobicContact CE2-CG 4.19Å; F654-E658 WeakPolarHBondContact CE2-OE2 3.24Å; F654-E658 HydrophobicContact CG-CB 4.45Å; F654-E658 WeakPolarHBondContact O-CB 3.39Å; F654-E658 PolarHBondContact O-N 2.92Å; F654-L659 HydrophobicContact CD1-CD1 4.04Å; F654-L659 HydrophobicContact CD1-CG 4.18Å; F654-L659 HydrophobicContact CE1-CD1 3.67Å; F654-L659 HydrophobicContact CE1-CD2 4.1Å; F654-L659 HydrophobicContact CE1-CG 3.74Å; F654-L659 HydrophobicContact CZ-CD2 4.27Å; F654-L659 HydrophobicContact CZ-CG 4.28Å; F654-L659 PolarHBondContact O-N 3.26Å; F654-L659 VanDerWaalsContact O-N 3.14Å
655	C	68.8	Low	69.9	Low	0 Å²	0	49 Å²	49	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.3	-34.3	176.4	-66.8	0	0	0	0	112.7	Y651 M652 E653 L659 N660 V661	Y651-C655 PolarHBondContact O-N 3.16Å; Y651-C655 PolarHBondContact O-SG 3.37Å; M652-C655 WeakPolarHBondContact O-CB 3.36Å; M652-C655 PolarHBondContact O-N 2.87Å; E653-C655 PolarHBondContact O-N 3.01Å; C655-L659 WeakPolarHBondContact O-CB 3.46Å; C655-N660 PolarHBondContact O-N 3.03Å; C655-V661 PolarHBondContact O-N 3.14Å
656	V	69.4	Low	70.2	Confident	14 Å²	14	48.5 Å²	48.5	9%	0.085	24%	0.243	C	C	.	.	H	α-helix	trans	-86.3	-45.3	-177.6	175.1	0	0	0	0	112.3	M652 E653 F654 N660 I666 L670 Y685	M652-V656 WeakPolarHBondContact O-CG2 3.49Å; M652-V656 PolarHBondContact O-N 3.02Å; E653-V656 PolarHBondContact O-N 3.41Å; F654-V656 VanDerWaalsContact C-N 3.26Å; F654-V656 PolarHBondContact O-N 3Å; V656-N660 PolarHBondContact O-OD1 3.3Å; V656-I666 HydrophobicContact CG2-CG2 4.28Å; V656-L670 HydrophobicContact CB-CD2 4.37Å; V656-L670 HydrophobicContact CG2-CD2 3.81Å; V656-Y685 HydrophobicContact CG1-CE2 3.75Å
657	Y	70.4	Confident	70.2	Confident	94 Å²	94	45.9 Å²	45.9	37%	0.369	23%	0.229	S	C	.	.	H	α-helix	trans	-88.2	-32	-174.3	-66.1	-63.1	0	0	0	114.6	E653 N660	E653-Y657 HydrophobicContact CB-CD2 4.12Å; E653-Y657 HydrophobicContact CB-CE2 4.31Å; E653-Y657 HydrophobicContact CG-CE2 4.19Å; E653-Y657 WeakPolarHBondContact O-CB 2.99Å; E653-Y657 WeakPolarHBondContact O-CD2 3.36Å; E653-Y657 PolarHBondContact O-N 2.84Å; Y657-N660 PolarHBondContact O-OD1 3.08Å
658	E	64.2	Low	70.5	Confident	138 Å²	138	46 Å²	46	65%	0.645	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-35.2	-177.2	-68.2	-165.8	-152	0	0	113.1	F654	F654-E658 HydrophobicContact CD2-CB 3.79Å; F654-E658 VanDerWaalsContact CD2-CD 3.46Å; F654-E658 HydrophobicContact CD2-CG 3.94Å; F654-E658 WeakPolarHBondContact CD2-OE2 3.11Å; F654-E658 HydrophobicContact CE2-CB 3.82Å; F654-E658 HydrophobicContact CE2-CG 4.19Å; F654-E658 WeakPolarHBondContact CE2-OE2 3.24Å; F654-E658 HydrophobicContact CG-CB 4.45Å; F654-E658 WeakPolarHBondContact O-CB 3.39Å; F654-E658 PolarHBondContact O-N 2.92Å
659	L	60.9	Low	70.6	Confident	26 Å²	26	46.7 Å²	46.7	14%	0.136	23%	0.233	C	C	.	.	S	Bend	trans	-90.2	-11.5	178.1	-59.7	178.8	0	0	0	113.6	K622 F654 C655 V661	K622-L659 HydrophobicContact CB-CD2 4.35Å; K622-L659 HydrophobicContact CG-CD2 3.48Å; K622-L659 VanDerWaalsContact CG-CD2 3.48Å; F654-L659 HydrophobicContact CD1-CD1 4.04Å; F654-L659 HydrophobicContact CD1-CG 4.18Å; F654-L659 HydrophobicContact CE1-CD1 3.67Å; F654-L659 HydrophobicContact CE1-CD2 4.1Å; F654-L659 HydrophobicContact CE1-CG 3.74Å; F654-L659 HydrophobicContact CZ-CD2 4.27Å; F654-L659 HydrophobicContact CZ-CG 4.28Å; F654-L659 PolarHBondContact O-N 3.26Å; F654-L659 VanDerWaalsContact O-N 3.14Å; C655-L659 WeakPolarHBondContact O-CB 3.46Å; L659-V661 HydrophobicContact CB-CG2 3.74Å; L659-V661 PolarHBondContact O-N 3.37Å
660	N	63.8	Low	70.7	Confident	121 Å²	121	46.7 Å²	46.7	65%	0.647	23%	0.232	S	C	*	.			trans	44.9	42.6	-177	-71	-6.3	0	0	0	112.7	C655 V656 Y657 T662	C655-N660 PolarHBondContact O-N 3.03Å; V656-N660 PolarHBondContact O-OD1 3.3Å; Y657-N660 PolarHBondContact O-OD1 3.08Å; N660-T662 PolarHBondContact O-N 3.14Å
661	V	67	Low	70.7	Confident	25 Å²	25	41.4 Å²	41.4	15%	0.152	21%	0.212	C	C	.	.			trans	-70.5	120.8	-177.8	-177.3	0	0	0	0	108.8	P626 C655 L659 E663 I666 H667	P626-V661 HydrophobicContact CG-CG2 4.33Å; C655-V661 PolarHBondContact O-N 3.14Å; L659-V661 HydrophobicContact CB-CG2 3.74Å; L659-V661 PolarHBondContact O-N 3.37Å; V661-E663 HydrophobicContact CG1-CB 3.95Å; V661-E663 HydrophobicContact CG1-CG 3.67Å; V661-E663 PolarHBondContact O-N 3.42Å; V661-I666 HydrophobicContact CB-CD1 4.17Å; V661-I666 HydrophobicContact CG1-CD1 3.48Å; V661-I666 VanDerWaalsContact CG1-CD1 3.48Å; V661-H667 PolarHBondContact O-NE2 2.67Å
662	T	62.4	Low	70.8	Confident	89 Å²	89	42.8 Å²	42.8	55%	0.546	22%	0.222	S	C	.	.			trans	-84	14.5	-173.6	57.6	0	0	0	0	114.3	N660	N660-T662 PolarHBondContact O-N 3.14Å
663	E	70.2	Confident	70.7	Confident	44 Å²	44	43.1 Å²	43.1	21%	0.206	22%	0.224	C	C	.	.			trans	-88.3	119.6	-168.1	-65	-175	168.9	0	0	113.6	K627 V661 A665 I666 H667	K627-E663 WeakPolarHBondContact CD-OE1 2.92Å; K627-E663 WeakPolarHBondContact CD-OE2 3.48Å; K627-E663 WeakPolarHBondContact CE-OE1 3.14Å; K627-E663 WeakPolarHBondContact CE-OE2 3.4Å; K627-E663 WeakPolarHBondContact CG-OE2 3.48Å; K627-E663 IonicContact NZ-OE1 3.76Å; K627-E663 PolarHBondContact NZ-OE1 3.24Å; K627-E663 IonicContact NZ-OE2 3.84Å; V661-E663 HydrophobicContact CG1-CB 3.95Å; V661-E663 HydrophobicContact CG1-CG 3.67Å; V661-E663 PolarHBondContact O-N 3.42Å; E663-A665 VanDerWaalsContact C-N 3.27Å; E663-A665 PolarHBondContact O-N 3.2Å; E663-A665 VanDerWaalsContact O-N 3.08Å; E663-I666 HydrophobicContact CB-CD1 4.02Å; E663-I666 HydrophobicContact CB-CG1 4.32Å; E663-I666 PolarHBondContact O-N 3.41Å; E663-H667 PolarHBondContact O-CD2 2.63Å; E663-H667 PolarHBondContact O-N 3.28Å
664	E	72.7	Confident	70.7	Confident	129 Å²	129	40.8 Å²	40.8	60%	0.603	21%	0.213	S	C	*	.	H	α-helix	trans	-49.2	-40	-178.6	-64.9	175.1	-167.1	0	0	115.1	I666 H667 N668 H697	E664-I666 VanDerWaalsContact C-N 3.33Å; E664-I666 PolarHBondContact O-N 3.17Å; E664-H667 PolarHBondContact O-N 3.43Å; E664-N668 VanDerWaalsContact O-CB 3.23Å; E664-N668 WeakPolarHBondContact O-CB 3.46Å; E664-N668 PolarHBondContact O-N 3.49Å; E664-N668 PolarHBondContact O-ND2 3.47Å; E664-N668 PolarHBondContact O-OD1 3.14Å; E664-H697 WeakPolarHBondContact CA-O 3.27Å
665	A	71.3	Confident	70.5	Confident	54 Å²	54	40.1 Å²	40.1	45%	0.446	21%	0.211	S	C	.	.	H	α-helix	trans	-64.5	-35.3	-177.6	0	0	0	0	0	113.2	I630 E663 Y669	I630-A665 HydrophobicContact CD1-CB 4.17Å; E663-A665 VanDerWaalsContact C-N 3.27Å; E663-A665 PolarHBondContact O-N 3.2Å; E663-A665 VanDerWaalsContact O-N 3.08Å; A665-Y669 WeakPolarHBondContact O-CB 3.47Å; A665-Y669 PolarHBondContact O-N 3.24Å
666	I	72.6	Confident	70.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-72.4	-46.6	-179	-62.2	171.2	0	0	0	109.4	P626 I630 M652 V656 V661 E663 E664 Y669 L670	P626-I666 HydrophobicContact CB-CD1 3.55Å; P626-I666 HydrophobicContact CB-CG1 4.33Å; P626-I666 HydrophobicContact CG-CD1 3.91Å; I630-I666 HydrophobicContact CD1-CG1 4.12Å; M652-I666 HydrophobicContact SD-CG2 3.81Å; V656-I666 HydrophobicContact CG2-CG2 4.28Å; V661-I666 HydrophobicContact CB-CD1 4.17Å; V661-I666 HydrophobicContact CG1-CD1 3.48Å; V661-I666 VanDerWaalsContact CG1-CD1 3.48Å; E663-I666 HydrophobicContact CB-CD1 4.02Å; E663-I666 HydrophobicContact CB-CG1 4.32Å; E663-I666 PolarHBondContact O-N 3.41Å; E664-I666 VanDerWaalsContact C-N 3.33Å; E664-I666 PolarHBondContact O-N 3.17Å; I666-Y669 PolarHBondContact O-N 2.89Å; I666-L670 WeakPolarHBondContact O-CB 3.26Å; I666-L670 PolarHBondContact O-N 2.8Å
667	H	72.5	Confident	70.6	Confident	13 Å²	13	50.2 Å²	50.2	6%	0.06	25%	0.252	C	S	.	.	H	α-helix	trans	-65.5	-40.2	177.9	-66.3	-109.4	0	0	0	111.3	V661 E663 E664 Y669 L670 L671 Y685 H697	V661-H667 PolarHBondContact O-NE2 2.67Å; E663-H667 PolarHBondContact O-CD2 2.63Å; E663-H667 PolarHBondContact O-N 3.28Å; E664-H667 PolarHBondContact O-N 3.43Å; H667-Y669 PolarHBondContact O-N 3.33Å; H667-L670 PolarHBondContact O-N 3.18Å; H667-L671 VanDerWaalsContact O-CB 3.25Å; H667-L671 WeakPolarHBondContact O-CB 3.5Å; H667-L671 PolarHBondContact O-N 2.97Å; H667-Y685 PolarHBondContact CE1-OH 3.42Å; H667-Y685 AromaticContact ND1-CZ 3.92Å; H667-Y685 PolarHBondContact ND1-OH 3.21Å; H667-H697 VanDerWaalsContact CB-O 3.29Å; H667-H697 WeakPolarHBondContact CB-O 3.45Å; H667-H697 PolarHBondContact CD2-O 3.12Å; H667-H697 VanDerWaalsContact CG-O 3.26Å
668	N	77.2	Confident	70.5	Confident	27 Å²	27	49.5 Å²	49.5	14%	0.144	25%	0.251	C	S	.	.	H	α-helix	trans	-63.5	-39.2	175.5	-70.8	-14.3	0	0	0	112.2	E664 S672 D699 Y702	E664-N668 VanDerWaalsContact O-CB 3.23Å; E664-N668 WeakPolarHBondContact O-CB 3.46Å; E664-N668 PolarHBondContact O-N 3.49Å; E664-N668 PolarHBondContact O-ND2 3.47Å; E664-N668 PolarHBondContact O-OD1 3.14Å; N668-S672 PolarHBondContact O-N 3.05Å; N668-D699 PolarHBondContact OD1-N 3.39Å; N668-Y702 HydrophobicContact CB-CD1 3.96Å; N668-Y702 HydrophobicContact CB-CE1 4.05Å
669	Y	74.4	Confident	70.5	Confident	22 Å²	22	45.5 Å²	45.5	9%	0.086	24%	0.237	C	C	.	.	H	α-helix	trans	-68.9	-44.5	175.5	-175.2	-118.3	0	0	0	111.7	L633 M634 S637 T648 M652 A665 I666 H667 L671 S672 L673	L633-Y669 PolarHBondContact O-OH 3.08Å; M634-Y669 HydrophobicContact CG-CD2 4.11Å; M634-Y669 HydrophobicContact CG-CE2 3.63Å; S637-Y669 WeakPolarHBondContact CB-OH 3.47Å; S637-Y669 PolarHBondContact OG-OH 3.48Å; T648-Y669 HydrophobicContact CG2-CE1 4.04Å; M652-Y669 HydrophobicContact CE-CD1 3.68Å; M652-Y669 HydrophobicContact CE-CE1 3.91Å; M652-Y669 HydrophobicContact CG-CD1 4.48Å; M652-Y669 HydrophobicContact SD-CD1 4.49Å; A665-Y669 WeakPolarHBondContact O-CB 3.47Å; A665-Y669 PolarHBondContact O-N 3.24Å; I666-Y669 PolarHBondContact O-N 2.89Å; H667-Y669 PolarHBondContact O-N 3.33Å; Y669-L671 VanDerWaalsContact C-N 3.31Å; Y669-L671 PolarHBondContact O-N 2.79Å; Y669-S672 PolarHBondContact O-N 3.41Å; Y669-S672 PolarHBondContact O-OG 3.39Å; Y669-L673 HydrophobicContact CD1-CD1 4Å; Y669-L673 HydrophobicContact CE1-CD1 3.61Å; Y669-L673 HydrophobicContact CE1-CG 4.32Å; Y669-L673 HydrophobicContact CE2-CD2 4.47Å; Y669-L673 HydrophobicContact CE2-CG 4.4Å; Y669-L673 WeakPolarHBondContact O-CG 3.26Å; Y669-L673 PolarHBondContact O-N 3.27Å
670	L	74.6	Confident	70.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.3	-43	174.3	-179.7	58.6	0	0	0	111.5	M652 V656 I666 H667 S672 L673 Y674 Y685	M652-L670 HydrophobicContact CB-CB 4.44Å; M652-L670 HydrophobicContact CB-CD1 3.85Å; V656-L670 HydrophobicContact CB-CD2 4.37Å; V656-L670 HydrophobicContact CG2-CD2 3.81Å; I666-L670 WeakPolarHBondContact O-CB 3.26Å; I666-L670 PolarHBondContact O-N 2.8Å; H667-L670 PolarHBondContact O-N 3.18Å; L670-S672 VanDerWaalsContact C-N 3.33Å; L670-S672 PolarHBondContact O-N 3.23Å; L670-L673 PolarHBondContact O-N 3.35Å; L670-L673 VanDerWaalsContact O-N 3.15Å; L670-Y674 HydrophobicContact CD1-CD1 4.4Å; L670-Y674 HydrophobicContact CD1-CD2 4.03Å; L670-Y674 HydrophobicContact CD1-CE1 4.03Å; L670-Y674 HydrophobicContact CD1-CE2 3.63Å; L670-Y674 HydrophobicContact CD1-CG 4.41Å; L670-Y674 HydrophobicContact CD2-CE2 3.79Å; L670-Y674 HydrophobicContact CG-CD2 3.82Å; L670-Y674 HydrophobicContact CG-CE2 3.51Å; L670-Y674 PolarHBondContact O-N 3.19Å; L670-Y685 HydrophobicContact CD2-CE2 4.02Å
671	L	75	Confident	70.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.3	-41.8	176.4	-165.1	108.7	0	0	0	111.6	H667 Y669 L673 Y674 A675 L682 L686 A703 L706	H667-L671 VanDerWaalsContact O-CB 3.25Å; H667-L671 WeakPolarHBondContact O-CB 3.5Å; H667-L671 PolarHBondContact O-N 2.97Å; Y669-L671 VanDerWaalsContact C-N 3.31Å; Y669-L671 PolarHBondContact O-N 2.79Å; L671-L673 VanDerWaalsContact C-N 3.32Å; L671-L673 PolarHBondContact O-N 3.47Å; L671-Y674 PolarHBondContact O-N 3.47Å; L671-A675 WeakPolarHBondContact O-CB 3.38Å; L671-A675 PolarHBondContact O-N 3.08Å; L671-L682 HydrophobicContact CD1-CD1 3.72Å; L671-L682 HydrophobicContact CG-CD1 3.9Å; L671-L686 HydrophobicContact CD1-CD2 4.02Å; L671-A703 HydrophobicContact CD1-CB 4.28Å; L671-A703 VanDerWaalsContact CD2-CA 3.46Å; L671-A703 HydrophobicContact CD2-CB 3.53Å; L671-L706 HydrophobicContact CD2-CD2 4.19Å
672	S	75.4	Confident	70.9	Confident	29 Å²	29	45.5 Å²	45.5	20%	0.203	24%	0.239	C	C	.	.	H	α-helix	trans	-63.7	-36.6	174.9	79.2	0	0	0	0	112.8	N668 Y669 L670 K676	N668-S672 PolarHBondContact O-N 3.05Å; Y669-S672 PolarHBondContact O-N 3.41Å; Y669-S672 PolarHBondContact O-OG 3.39Å; L670-S672 VanDerWaalsContact C-N 3.33Å; L670-S672 PolarHBondContact O-N 3.23Å; S672-K676 WeakPolarHBondContact O-CB 3.24Å; S672-K676 PolarHBondContact O-N 3.41Å
673	L	73.3	Confident	71.1	Confident	9 Å²	9	43 Å²	43	5%	0.047	22%	0.222	C	C	.	.	H	α-helix	trans	-72.1	-39.8	176.2	-68.8	177.4	0	0	0	111.7	T648 I649 Y669 L670 L671 K676 Y677	T648-L673 HydrophobicContact CG2-CD1 3.96Å; I649-L673 HydrophobicContact CD1-CB 4.49Å; I649-L673 HydrophobicContact CG1-CB 4.14Å; I649-L673 HydrophobicContact CG1-CD1 4.16Å; Y669-L673 HydrophobicContact CD1-CD1 4Å; Y669-L673 HydrophobicContact CE1-CD1 3.61Å; Y669-L673 HydrophobicContact CE1-CG 4.32Å; Y669-L673 HydrophobicContact CE2-CD2 4.47Å; Y669-L673 HydrophobicContact CE2-CG 4.4Å; Y669-L673 WeakPolarHBondContact O-CG 3.26Å; Y669-L673 PolarHBondContact O-N 3.27Å; L670-L673 PolarHBondContact O-N 3.35Å; L670-L673 VanDerWaalsContact O-N 3.15Å; L671-L673 VanDerWaalsContact C-N 3.32Å; L671-L673 PolarHBondContact O-N 3.47Å; L673-K676 PolarHBondContact O-N 3.38Å; L673-Y677 HydrophobicContact CD2-CD2 4.42Å; L673-Y677 HydrophobicContact CD2-CE2 4.32Å; L673-Y677 WeakPolarHBondContact O-CD2 3.46Å; L673-Y677 PolarHBondContact O-N 3.47Å
674	Y	74.4	Confident	71	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.008	24%	0.24	C	C	.	.	H	α-helix	trans	-66.4	-46.7	177.2	-77.8	-31.9	0	0	0	112.6	I649 E653 L670 L671 K676 Y677 K678 Y685	I649-Y674 HydrophobicContact CG2-CD1 4.49Å; I649-Y674 HydrophobicContact CG2-CE1 3.75Å; E653-Y674 VanDerWaalsContact CD-OH 3.27Å; E653-Y674 WeakPolarHBondContact CG-OH 3.29Å; E653-Y674 PolarHBondContact OE1-OH 3.18Å; L670-Y674 HydrophobicContact CD1-CD1 4.4Å; L670-Y674 HydrophobicContact CD1-CD2 4.03Å; L670-Y674 HydrophobicContact CD1-CE1 4.03Å; L670-Y674 HydrophobicContact CD1-CE2 3.63Å; L670-Y674 HydrophobicContact CD1-CG 4.41Å; L670-Y674 HydrophobicContact CD2-CE2 3.79Å; L670-Y674 HydrophobicContact CG-CD2 3.82Å; L670-Y674 HydrophobicContact CG-CE2 3.51Å; L670-Y674 PolarHBondContact O-N 3.19Å; L671-Y674 PolarHBondContact O-N 3.47Å; Y674-K676 PolarHBondContact O-N 3.33Å; Y674-Y677 PolarHBondContact O-N 2.96Å; Y674-K678 HydrophobicContact CD1-CB 4.24Å; Y674-K678 CarbonylContact O-C 3.51Å; Y674-K678 WeakPolarHBondContact O-CA 3.4Å; Y674-K678 PolarHBondContact O-N 2.94Å; Y674-Y685 HydrophobicContact CD2-CD1 4.4Å; Y674-Y685 HydrophobicContact CD2-CG 4.33Å; Y674-Y685 HydrophobicContact CE2-CD1 4.37Å; Y674-Y685 HydrophobicContact CE2-CD2 4.16Å; Y674-Y685 AromaticContact CE2-CG 3.94Å; Y674-Y685 HydrophobicContact CE2-CG 3.94Å
675	A	70.4	Confident	70.8	Confident	6 Å²	6	40.9 Å²	40.9	5%	0.05	21%	0.212	C	C	.	.	H	α-helix	trans	-62.9	-30.1	179.3	0	0	0	0	0	113.2	L671 L682 L706 F712	L671-A675 WeakPolarHBondContact O-CB 3.38Å; L671-A675 PolarHBondContact O-N 3.08Å; A675-L682 HydrophobicContact CB-CD2 4.27Å; A675-L706 HydrophobicContact CB-CD2 3.11Å; A675-L706 HydrophobicContact CB-CG 4.37Å; A675-F712 HydrophobicContact CB-CE2 4.46Å
676	K	70.9	Confident	70.7	Confident	136 Å²	136	38.4 Å²	38.4	59%	0.591	19%	0.191	S	C	*	.	H	α-helix	trans	-85.4	-32.9	-179.1	-168.7	172.5	178	-171.3	0	113.9	S672 L673 Y674	S672-K676 WeakPolarHBondContact O-CB 3.24Å; S672-K676 PolarHBondContact O-N 3.41Å; L673-K676 PolarHBondContact O-N 3.38Å; Y674-K676 PolarHBondContact O-N 3.33Å
677	Y	68.6	Low	70.4	Confident	90 Å²	90	46.8 Å²	46.8	35%	0.353	22%	0.223	S	C	.	.	H	α-helix	trans	-125.1	-21.7	-169.7	-60.4	-77.9	0	0	0	115.6	I645 L673 Y674	I645-Y677 HydrophobicContact CD1-CE1 3.9Å; I645-Y677 HydrophobicContact CD1-CE2 4.19Å; I645-Y677 HydrophobicContact CG2-CD2 3.82Å; I645-Y677 HydrophobicContact CG2-CE2 3.98Å; I645-Y677 HydrophobicContact CG2-CG 4.13Å; L673-Y677 HydrophobicContact CD2-CD2 4.42Å; L673-Y677 HydrophobicContact CD2-CE2 4.32Å; L673-Y677 WeakPolarHBondContact O-CD2 3.46Å; L673-Y677 PolarHBondContact O-N 3.47Å; Y674-Y677 PolarHBondContact O-N 2.96Å
678	K	68.9	Low	70	Confident	80 Å²	80	51.7 Å²	51.7	35%	0.348	25%	0.246	S	C	.	.			trans	-147.3	83.5	-179.4	-74.3	-169.7	179.6	176.5	0	112.5	Y674 D680 L682	Y674-K678 HydrophobicContact CD1-CB 4.24Å; Y674-K678 CarbonylContact O-C 3.51Å; Y674-K678 WeakPolarHBondContact O-CA 3.4Å; Y674-K678 PolarHBondContact O-N 2.94Å; K678-D680 PolarHBondContact O-N 2.85Å; K678-L682 PolarHBondContact O-N 3.15Å
679	P	63.9	Low	69.2	Low	53 Å²	53	51.6 Å²	51.6	34%	0.344	25%	0.248	S	C	.	.	H	α-helix	trans	-68.3	-30.9	-177.7	27.2	-34.4	0	0	0	113.8	L682 F712	P679-L682 VanDerWaalsContact O-CB 3.3Å; P679-L682 WeakPolarHBondContact O-CB 3.3Å; P679-L682 PolarHBondContact O-N 3.4Å; P679-F712 HydrophobicContact CB-CE1 3.77Å; P679-F712 HydrophobicContact CB-CE2 4.45Å; P679-F712 HydrophobicContact CB-CZ 3.64Å
680	D	65.1	Low	68.3	Low	136 Å²	136	51.5 Å²	51.5	73%	0.727	25%	0.254	S	S	*	.	H	α-helix	trans	-68.8	-38.1	-178.8	-59.8	-35.6	0	0	0	112.4	K678 L682 L683 Q684	K678-D680 PolarHBondContact O-N 2.85Å; D680-L682 VanDerWaalsContact C-N 3.31Å; D680-L682 PolarHBondContact O-N 3.25Å; D680-L683 PolarHBondContact O-N 2.92Å; D680-Q684 PolarHBondContact O-N 2.84Å
681	S	65.9	Low	67.4	Low	35 Å²	35	55.3 Å²	55.3	25%	0.245	28%	0.277	C	S	.	.	H	α-helix	trans	-72.2	-25.1	176.4	-56.1	0	0	0	0	112.4	Q684 Y685	S681-Q684 PolarHBondContact O-N 3.48Å; S681-Y685 VanDerWaalsContact O-CB 3.23Å; S681-Y685 WeakPolarHBondContact O-CB 3.31Å; S681-Y685 PolarHBondContact O-N 3.29Å
682	L	69.3	Low	66.4	Low	1 Å²	1	60.1 Å²	60.1	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-62.5	-45.5	174.2	-176	68.6	0	0	0	111.2	L671 A675 K678 P679 D680 Q684 Y685 L686 F712	L671-L682 HydrophobicContact CD1-CD1 3.72Å; L671-L682 HydrophobicContact CG-CD1 3.9Å; A675-L682 HydrophobicContact CB-CD2 4.27Å; K678-L682 PolarHBondContact O-N 3.15Å; P679-L682 VanDerWaalsContact O-CB 3.3Å; P679-L682 WeakPolarHBondContact O-CB 3.3Å; P679-L682 PolarHBondContact O-N 3.4Å; D680-L682 VanDerWaalsContact C-N 3.31Å; D680-L682 PolarHBondContact O-N 3.25Å; L682-Q684 VanDerWaalsContact C-N 3.34Å; L682-Q684 PolarHBondContact O-N 2.85Å; L682-Y685 PolarHBondContact O-N 2.85Å; L682-L686 HydrophobicContact CD1-CD1 4.4Å; L682-L686 HydrophobicContact CD1-CG 4.5Å; L682-L686 HydrophobicContact CG-CD1 4.04Å; L682-L686 HydrophobicContact CG-CG 4.49Å; L682-L686 WeakPolarHBondContact O-CB 3.47Å; L682-L686 VanDerWaalsContact O-CG 3.27Å; L682-L686 WeakPolarHBondContact O-CG 3.41Å; L682-L686 PolarHBondContact O-N 3.2Å; L682-F712 HydrophobicContact CD2-CD2 4.32Å
683	L	66.9	Low	65.6	Low	38 Å²	38	61 Å²	61	20%	0.199	31%	0.305	C	S	.	.	H	α-helix	trans	-64.9	-39.6	179	-71.3	171.8	0	0	0	111.8	D680 R687 Q714 A715 L718	D680-L683 PolarHBondContact O-N 2.92Å; L683-R687 WeakPolarHBondContact O-CB 3.25Å; L683-R687 VanDerWaalsContact O-CG 3.24Å; L683-R687 WeakPolarHBondContact O-CG 3.48Å; L683-R687 PolarHBondContact O-N 3.39Å; L683-R687 VanDerWaalsContact O-N 3.09Å; L683-Q714 HydrophobicContact CD2-CB 4.35Å; L683-A715 HydrophobicContact CD2-CB 3.85Å; L683-L718 HydrophobicContact CD2-CD1 4.44Å
684	Q	66.6	Low	64.7	Low	122 Å²	122	65.9 Å²	65.9	57%	0.57	34%	0.34	S	S	*	.	H	α-helix	trans	-65.2	-43.6	175	-173.6	175.9	-1.7	0	0	111.4	D680 S681 L682 R687 Q688	D680-Q684 PolarHBondContact O-N 2.84Å; S681-Q684 PolarHBondContact O-N 3.48Å; L682-Q684 VanDerWaalsContact C-N 3.34Å; L682-Q684 PolarHBondContact O-N 2.85Å; Q684-R687 PolarHBondContact O-N 3.43Å; Q684-Q688 VanDerWaalsContact O-CB 3.31Å; Q684-Q688 WeakPolarHBondContact O-CB 3.24Å; Q684-Q688 PolarHBondContact O-N 2.75Å
685	Y	70.6	Confident	63.9	Low	5 Å²	5	71.1 Å²	71.1	2%	0.02	36%	0.364	C	S	.	.	H	α-helix	trans	-61.4	-46.8	177.8	-177.6	-109	0	0	0	112.5	V656 H667 L670 Y674 S681 L682 R687 Q688 A689 Y698	V656-Y685 HydrophobicContact CG1-CE2 3.75Å; H667-Y685 PolarHBondContact CE1-OH 3.42Å; H667-Y685 AromaticContact ND1-CZ 3.92Å; H667-Y685 PolarHBondContact ND1-OH 3.21Å; L670-Y685 HydrophobicContact CD2-CE2 4.02Å; Y674-Y685 HydrophobicContact CD2-CD1 4.4Å; Y674-Y685 HydrophobicContact CD2-CG 4.33Å; Y674-Y685 HydrophobicContact CE2-CD1 4.37Å; Y674-Y685 HydrophobicContact CE2-CD2 4.16Å; Y674-Y685 AromaticContact CE2-CG 3.94Å; Y674-Y685 HydrophobicContact CE2-CG 3.94Å; S681-Y685 VanDerWaalsContact O-CB 3.23Å; S681-Y685 WeakPolarHBondContact O-CB 3.31Å; S681-Y685 PolarHBondContact O-N 3.29Å; L682-Y685 PolarHBondContact O-N 2.85Å; Y685-R687 VanDerWaalsContact C-N 3.32Å; Y685-R687 PolarHBondContact O-N 3.03Å; Y685-Q688 PolarHBondContact O-N 2.8Å; Y685-A689 WeakPolarHBondContact O-CB 2.91Å; Y685-A689 PolarHBondContact O-N 3.28Å; Y685-Y698 HydrophobicContact CE1-CD1 4.47Å
686	L	68.7	Low	63.5	Low	2 Å²	2	71.6 Å²	71.6	1%	0.01	37%	0.366	C	S	.	.	H	α-helix	trans	-64.2	-35	177.2	-70.4	172.4	0	0	0	112.5	L671 L682 Q688 Y698 A715 V719	L671-L686 HydrophobicContact CD1-CD2 4.02Å; L682-L686 HydrophobicContact CD1-CD1 4.4Å; L682-L686 HydrophobicContact CD1-CG 4.5Å; L682-L686 HydrophobicContact CG-CD1 4.04Å; L682-L686 HydrophobicContact CG-CG 4.49Å; L682-L686 WeakPolarHBondContact O-CB 3.47Å; L682-L686 VanDerWaalsContact O-CG 3.27Å; L682-L686 WeakPolarHBondContact O-CG 3.41Å; L682-L686 PolarHBondContact O-N 3.2Å; L686-Q688 VanDerWaalsContact C-N 3.35Å; L686-Y698 HydrophobicContact CD2-CE1 4.21Å; L686-Y698 HydrophobicContact CD2-CE2 3.95Å; L686-Y698 VanDerWaalsContact CD2-OH 3.23Å; L686-Y698 WeakPolarHBondContact CD2-OH 3.37Å; L686-A715 HydrophobicContact CD1-CB 3.67Å; L686-V719 HydrophobicContact CD1-CG2 4.29Å; L686-V719 HydrophobicContact CD2-CG2 4.1Å
687	R	66.4	Low	63.2	Low	176 Å²	176	68.3 Å²	68.3	66%	0.664	35%	0.352	S	S	*	.	H	α-helix	trans	-71	-30.2	174.6	-74	173.9	-177.1	-178.1	1.7	113	L683 Q684 Y685 L718	L683-R687 WeakPolarHBondContact O-CB 3.25Å; L683-R687 VanDerWaalsContact O-CG 3.24Å; L683-R687 WeakPolarHBondContact O-CG 3.48Å; L683-R687 PolarHBondContact O-N 3.39Å; L683-R687 VanDerWaalsContact O-N 3.09Å; Q684-R687 PolarHBondContact O-N 3.43Å; Y685-R687 VanDerWaalsContact C-N 3.32Å; Y685-R687 PolarHBondContact O-N 3.03Å; R687-L718 HydrophobicContact CG-CD1 4.08Å
688	Q	63.9	Low	63.2	Low	117 Å²	117	64.3 Å²	64.3	55%	0.547	34%	0.337	S	S	.	.	H	α-helix	trans	-89.4	-21	-175.1	-165.4	165.3	2.4	0	0	113	Q684 Y685 L686 G690	Q684-Q688 VanDerWaalsContact O-CB 3.31Å; Q684-Q688 WeakPolarHBondContact O-CB 3.24Å; Q684-Q688 PolarHBondContact O-N 2.75Å; Y685-Q688 PolarHBondContact O-N 2.8Å; L686-Q688 VanDerWaalsContact C-N 3.35Å; Q688-G690 PolarHBondContact O-N 3.29Å
689	A	59.2	Low	63.5	Low	24 Å²	24	63.7 Å²	63.7	20%	0.198	34%	0.337	C	S	.	.	S	Bend	trans	-75	5.3	-178.8	0	0	0	0	0	115.3	Y685 I696 Y698	Y685-A689 WeakPolarHBondContact O-CB 2.91Å; Y685-A689 PolarHBondContact O-N 3.28Å; A689-I696 WeakPolarHBondContact O-CG1 3.44Å; A689-Y698 HydrophobicContact CB-CE1 3.8Å
690	G	56.4	Low	63.9	Low	20 Å²	20	62.5 Å²	62.5	21%	0.206	33%	0.328	C	S	.	.			trans	99.2	164.4	174	0	0	0	0	0	114.6	Q688	Q688-G690 PolarHBondContact O-N 3.29Å
691	T	54.4	Low	64.4	Low	80 Å²	80	62.9 Å²	62.9	49%	0.491	32%	0.323	S	S	.	.	S	Bend	trans	-97	-12.4	-179.4	43.5	0	0	0	0	113.4
692	H	54.3	Low	64.9	Low	101 Å²	101	64.9 Å²	64.9	47%	0.468	33%	0.326	S	S	.	.	S	Bend	trans	-107.9	141.4	-175.2	-65.7	-67.2	0	0	0	112.6	S694 E695 I696	H692-S694 PolarHBondContact O-N 3.49Å; H692-S694 VanDerWaalsContact O-N 3.09Å; H692-E695 HydrophobicContact CB-CG 4.43Å; H692-E695 PolarHBondContact O-N 3.33Å; H692-E695 VanDerWaalsContact O-N 3.16Å; H692-I696 WeakPolarHBondContact O-CD1 3.26Å; H692-I696 WeakPolarHBondContact O-CG1 3.2Å
693	P	58.4	Low	65	Low	49 Å²	49	64.8 Å²	64.8	32%	0.318	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-54.8	-30.2	177.6	-24.2	30.8	0	0	0	114.1	I722	P693-I722 WeakPolarHBondContact CG-O 3.39Å
694	S	55.5	Low	65.3	Low	110 Å²	110	63.9 Å²	63.9	77%	0.769	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-76.6	-23.7	-175.9	-44.8	0	0	0	0	114.2	H692 I696	H692-S694 PolarHBondContact O-N 3.49Å; H692-S694 VanDerWaalsContact O-N 3.09Å; S694-I696 VanDerWaalsContact C-N 3.31Å
695	E	57.4	Low	65.8	Low	112 Å²	112	65.4 Å²	65.4	52%	0.523	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-88.9	-7.7	178.9	-65.4	-179.5	163.9	0	0	111.8	H692	H692-E695 HydrophobicContact CB-CG 4.43Å; H692-E695 PolarHBondContact O-N 3.33Å; H692-E695 VanDerWaalsContact O-N 3.16Å
696	I	62.7	Low	65.9	Low	16 Å²	16	65.9 Å²	65.9	8%	0.082	32%	0.324	C	S	.	.			trans	-97.9	114.4	-171.7	-68.4	170.5	0	0	0	109.9	A689 H692 S694 Y698 L700 I722	A689-I696 WeakPolarHBondContact O-CG1 3.44Å; H692-I696 WeakPolarHBondContact O-CD1 3.26Å; H692-I696 WeakPolarHBondContact O-CG1 3.2Å; S694-I696 VanDerWaalsContact C-N 3.31Å; I696-Y698 VanDerWaalsContact C-N 3.33Å; I696-Y698 HydrophobicContact CB-CE1 4.44Å; I696-Y698 HydrophobicContact CG1-CE1 4.47Å; I696-Y698 HydrophobicContact CG2-CD1 3.45Å; I696-Y698 VanDerWaalsContact CG2-CD1 3.45Å; I696-Y698 HydrophobicContact CG2-CD2 3.95Å; I696-Y698 HydrophobicContact CG2-CE1 3.34Å; I696-Y698 HydrophobicContact CG2-CE2 3.88Å; I696-Y698 HydrophobicContact CG2-CG 3.73Å; I696-L700 HydrophobicContact CD1-CD2 4.32Å; I696-L700 HydrophobicContact CG2-CD2 3.99Å; I696-L700 HydrophobicContact CG2-CG 4.4Å; I696-I722 HydrophobicContact CD1-CB 4.15Å; I696-I722 HydrophobicContact CD1-CD1 3.88Å; I696-I722 HydrophobicContact CD1-CG1 4.06Å; I696-I722 HydrophobicContact CD1-CG2 3.05Å
697	H	63.7	Low	66.1	Low	67 Å²	67	65.8 Å²	65.8	31%	0.31	32%	0.323	S	S	.	.			trans	-95.1	23.8	-179.3	-56.4	-50.2	0	0	0	112.6	E664 H667	E664-H697 WeakPolarHBondContact CA-O 3.27Å; H667-H697 VanDerWaalsContact CB-O 3.29Å; H667-H697 WeakPolarHBondContact CB-O 3.45Å; H667-H697 PolarHBondContact CD2-O 3.12Å; H667-H697 VanDerWaalsContact CG-O 3.26Å
698	Y	68.9	Low	66.4	Low	7 Å²	7	60.4 Å²	60.4	3%	0.027	32%	0.317	C	S	.	.	S	Bend	trans	-123.4	153.8	170.6	58.1	-93.1	0	0	0	111.8	Y685 L686 A689 I696 L700 A703	Y685-Y698 HydrophobicContact CE1-CD1 4.47Å; L686-Y698 HydrophobicContact CD2-CE1 4.21Å; L686-Y698 HydrophobicContact CD2-CE2 3.95Å; L686-Y698 VanDerWaalsContact CD2-OH 3.23Å; L686-Y698 WeakPolarHBondContact CD2-OH 3.37Å; A689-Y698 HydrophobicContact CB-CE1 3.8Å; I696-Y698 VanDerWaalsContact C-N 3.33Å; I696-Y698 HydrophobicContact CB-CE1 4.44Å; I696-Y698 HydrophobicContact CG1-CE1 4.47Å; I696-Y698 HydrophobicContact CG2-CD1 3.45Å; I696-Y698 VanDerWaalsContact CG2-CD1 3.45Å; I696-Y698 HydrophobicContact CG2-CD2 3.95Å; I696-Y698 HydrophobicContact CG2-CE1 3.34Å; I696-Y698 HydrophobicContact CG2-CE2 3.88Å; I696-Y698 HydrophobicContact CG2-CG 3.73Å; Y698-L700 HydrophobicContact CD2-CD2 4.29Å; Y698-L700 HydrophobicContact CE2-CD2 3.66Å; Y698-L700 PolarHBondContact O-N 3.13Å; Y698-L700 VanDerWaalsContact O-N 3.12Å; Y698-A703 HydrophobicContact CD2-CB 3.85Å; Y698-A703 HydrophobicContact CE2-CB 3.92Å
699	D	75.8	Confident	66.9	Low	66 Å²	66	61.5 Å²	61.5	35%	0.353	32%	0.322	S	S	.	.			trans	-72.4	107.4	175.9	178.6	-4.7	0	0	0	109.5	N668 K701 Y702 A703	N668-D699 PolarHBondContact OD1-N 3.39Å; D699-K701 PolarHBondContact O-N 3.33Å; D699-K701 WeakPolarHBondContact OD1-CB 3.29Å; D699-K701 PolarHBondContact OD1-N 3.4Å; D699-Y702 PolarHBondContact O-N 3.17Å; D699-Y702 PolarHBondContact OD1-N 3.46Å; D699-A703 WeakPolarHBondContact O-CB 3.41Å; D699-A703 PolarHBondContact O-N 2.77Å
700	L	71.5	Confident	67.4	Low	28 Å²	28	64.7 Å²	64.7	15%	0.147	33%	0.332	C	S	.	.	H	α-helix	trans	-57.8	-34.8	179.4	-64.8	166.7	0	0	0	112.5	I696 Y698 A703 L704 V719 I722 M723	I696-L700 HydrophobicContact CD1-CD2 4.32Å; I696-L700 HydrophobicContact CG2-CD2 3.99Å; I696-L700 HydrophobicContact CG2-CG 4.4Å; Y698-L700 HydrophobicContact CD2-CD2 4.29Å; Y698-L700 HydrophobicContact CE2-CD2 3.66Å; Y698-L700 PolarHBondContact O-N 3.13Å; Y698-L700 VanDerWaalsContact O-N 3.12Å; L700-A703 PolarHBondContact O-N 3.26Å; L700-L704 WeakPolarHBondContact O-CB 3.27Å; L700-L704 WeakPolarHBondContact O-CG 3.45Å; L700-L704 PolarHBondContact O-N 2.95Å; L700-V719 HydrophobicContact CB-CG1 4.44Å; L700-V719 HydrophobicContact CD2-CG1 4.06Å; L700-I722 HydrophobicContact CD1-CG2 4.08Å; L700-I722 HydrophobicContact CD2-CB 4.46Å; L700-I722 HydrophobicContact CD2-CG2 3.46Å; L700-I722 VanDerWaalsContact CD2-CG2 3.46Å; L700-I722 HydrophobicContact CG-CG2 4.45Å; L700-M723 HydrophobicContact CB-CG 3.73Å; L700-M723 HydrophobicContact CB-SD 3.73Å; L700-M723 HydrophobicContact CD1-CG 3.76Å; L700-M723 HydrophobicContact CD2-CG 4.35Å; L700-M723 HydrophobicContact CG-CG 4.15Å
701	K	75.4	Confident	67.9	Low	145 Å²	145	66 Å²	66	63%	0.63	35%	0.347	S	S	*	.	H	α-helix	trans	-74.1	-38.5	179.2	-63.4	177.4	-178.5	173.9	0	111.5	D699 R705 M723	D699-K701 PolarHBondContact O-N 3.33Å; D699-K701 WeakPolarHBondContact OD1-CB 3.29Å; D699-K701 PolarHBondContact OD1-N 3.4Å; K701-R705 PolarHBondContact O-N 2.9Å; K701-R705 VanDerWaalsContact O-N 3.08Å; K701-M723 HydrophobicContact CG-CE 4.26Å
702	Y	76	Confident	68.8	Low	76 Å²	76	65.4 Å²	65.4	30%	0.298	34%	0.337	S	S	.	.	H	α-helix	trans	-65.6	-43	173	-178.1	-107	0	0	0	110.9	N668 D699 R705 L706	N668-Y702 HydrophobicContact CB-CD1 3.96Å; N668-Y702 HydrophobicContact CB-CE1 4.05Å; D699-Y702 PolarHBondContact O-N 3.17Å; D699-Y702 PolarHBondContact OD1-N 3.46Å; Y702-R705 PolarHBondContact O-N 3.32Å; Y702-L706 HydrophobicContact CE1-CD1 4.02Å; Y702-L706 HydrophobicContact CE2-CD1 4.46Å; Y702-L706 WeakPolarHBondContact O-CB 3.47Å; Y702-L706 PolarHBondContact O-N 3.4Å
703	A	72.6	Confident	69.5	Low	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-61.5	-45.5	176	0	0	0	0	0	112.4	L671 Y698 D699 L700 R705 L706 C707	L671-A703 HydrophobicContact CD1-CB 4.28Å; L671-A703 VanDerWaalsContact CD2-CA 3.46Å; L671-A703 HydrophobicContact CD2-CB 3.53Å; Y698-A703 HydrophobicContact CD2-CB 3.85Å; Y698-A703 HydrophobicContact CE2-CB 3.92Å; D699-A703 WeakPolarHBondContact O-CB 3.41Å; D699-A703 PolarHBondContact O-N 2.77Å; L700-A703 PolarHBondContact O-N 3.26Å; A703-R705 PolarHBondContact O-N 3.37Å; A703-L706 PolarHBondContact O-N 3.23Å; A703-C707 WeakPolarHBondContact O-CB 3.45Å; A703-C707 PolarHBondContact O-N 3.37Å; A703-C707 PolarHBondContact O-SG 3.42Å
704	L	72.1	Confident	70.1	Confident	19 Å²	19	66 Å²	66	10%	0.099	34%	0.338	C	S	.	.	H	α-helix	trans	-58.7	-46.4	174.5	-82.1	-178.9	0	0	0	112.4	L700 L706 C707 A708 V719 Y720 M723	L700-L704 WeakPolarHBondContact O-CB 3.27Å; L700-L704 WeakPolarHBondContact O-CG 3.45Å; L700-L704 PolarHBondContact O-N 2.95Å; L704-L706 VanDerWaalsContact C-N 3.29Å; L704-L706 PolarHBondContact O-N 3.2Å; L704-C707 PolarHBondContact O-N 3.04Å; L704-A708 WeakPolarHBondContact O-CB 3.39Å; L704-A708 PolarHBondContact O-N 3.1Å; L704-V719 HydrophobicContact CD1-CG1 4.44Å; L704-V719 HydrophobicContact CD2-CB 3.72Å; L704-V719 HydrophobicContact CD2-CG1 3.59Å; L704-V719 HydrophobicContact CG-CB 4.24Å; L704-V719 HydrophobicContact CG-CG1 3.53Å; L704-Y720 HydrophobicContact CD1-CD1 3.97Å; L704-Y720 HydrophobicContact CD1-CE1 3.52Å; L704-Y720 HydrophobicContact CD2-CD1 4.18Å; L704-Y720 HydrophobicContact CD2-CD2 3.83Å; L704-Y720 HydrophobicContact CD2-CE1 4.01Å; L704-Y720 HydrophobicContact CD2-CE2 3.6Å; L704-Y720 HydrophobicContact CD2-CG 4.09Å; L704-Y720 HydrophobicContact CG-CE1 4.44Å; L704-M723 HydrophobicContact CD1-CE 4.2Å; L704-M723 HydrophobicContact CD1-SD 3.25Å; L704-M723 WeakPolarHBondContact CD1-SD 3.21Å; L704-M723 HydrophobicContact CG-SD 4Å
705	R	77.5	Confident	70.8	Confident	153 Å²	153	60.8 Å²	60.8	58%	0.577	30%	0.301	S	S	*	.	H	α-helix	trans	-58.3	-46.9	178.8	-174.1	-176.7	-56.9	153.4	7	110.7	K701 Y702 A703 A708 E709	K701-R705 PolarHBondContact O-N 2.9Å; K701-R705 VanDerWaalsContact O-N 3.08Å; Y702-R705 PolarHBondContact O-N 3.32Å; A703-R705 PolarHBondContact O-N 3.37Å; R705-A708 PolarHBondContact O-N 3.42Å; R705-E709 HydrophobicContact CG-CG 4.5Å; R705-E709 WeakPolarHBondContact CG-OE1 3.49Å; R705-E709 WeakPolarHBondContact O-CB 3.38Å; R705-E709 VanDerWaalsContact O-CG 3.28Å; R705-E709 WeakPolarHBondContact O-CG 3.43Å; R705-E709 PolarHBondContact O-N 3.45Å
706	L	73.1	Confident	71.5	Confident	15 Å²	15	55.7 Å²	55.7	8%	0.079	28%	0.278	C	S	.	.	H	α-helix	trans	-71.2	-40.1	-175.3	-158.9	126.9	0	0	0	111.8	L671 A675 Y702 A703 L704 H710	L671-L706 HydrophobicContact CD2-CD2 4.19Å; A675-L706 HydrophobicContact CB-CD2 3.11Å; A675-L706 HydrophobicContact CB-CG 4.37Å; Y702-L706 HydrophobicContact CE1-CD1 4.02Å; Y702-L706 HydrophobicContact CE2-CD1 4.46Å; Y702-L706 WeakPolarHBondContact O-CB 3.47Å; Y702-L706 PolarHBondContact O-N 3.4Å; A703-L706 PolarHBondContact O-N 3.23Å; L704-L706 VanDerWaalsContact C-N 3.29Å; L704-L706 PolarHBondContact O-N 3.2Å; L706-H710 PolarHBondContact O-CD2 3.19Å; L706-H710 PolarHBondContact O-N 3.05Å
707	C	72.7	Confident	72	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66.8	-36.5	173.1	-68.5	0	0	0	0	112.5	A703 L704 G711 F712 A715 C716	A703-C707 WeakPolarHBondContact O-CB 3.45Å; A703-C707 PolarHBondContact O-N 3.37Å; A703-C707 PolarHBondContact O-SG 3.42Å; L704-C707 PolarHBondContact O-N 3.04Å; C707-G711 PolarHBondContact O-N 3.24Å; C707-F712 PolarHBondContact O-N 3.08Å; C707-A715 HydrophobicContact CB-CB 4.44Å; C707-C716 VanDerWaalsContact CB-SG 3.53Å
708	A	73.5	Confident	72.4	Confident	64 Å²	64	53.8 Å²	53.8	53%	0.529	27%	0.271	S	S	.	.	H	α-helix	trans	-70.6	-41.4	176.3	0	0	0	0	0	112.3	L704 R705 H710 G711	L704-A708 WeakPolarHBondContact O-CB 3.39Å; L704-A708 PolarHBondContact O-N 3.1Å; R705-A708 PolarHBondContact O-N 3.42Å; A708-H710 VanDerWaalsContact C-N 3.28Å; A708-H710 PolarHBondContact O-N 3.34Å; A708-G711 PolarHBondContact O-N 3.47Å
709	E	74.6	Confident	72.6	Confident	140 Å²	140	53.5 Å²	53.5	65%	0.654	27%	0.269	S	S	*	.	H	α-helix	trans	-61	-36.4	175.5	-79.4	175.1	-168.1	0	0	112.2	R705	R705-E709 HydrophobicContact CG-CG 4.5Å; R705-E709 WeakPolarHBondContact CG-OE1 3.49Å; R705-E709 WeakPolarHBondContact O-CB 3.38Å; R705-E709 VanDerWaalsContact O-CG 3.28Å; R705-E709 WeakPolarHBondContact O-CG 3.43Å; R705-E709 PolarHBondContact O-N 3.45Å
710	H	68.4	Low	72.7	Confident	90 Å²	90	52.7 Å²	52.7	42%	0.417	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-2.7	178.2	-69.1	-62.3	0	0	0	114.5	L706 A708 F712	L706-H710 PolarHBondContact O-CD2 3.19Å; L706-H710 PolarHBondContact O-N 3.05Å; A708-H710 VanDerWaalsContact C-N 3.28Å; A708-H710 PolarHBondContact O-N 3.34Å; H710-F712 HydrophobicContact CB-CD2 3.61Å; H710-F712 HydrophobicContact CB-CE2 3.38Å; H710-F712 HydrophobicContact CB-CZ 4.17Å
711	G	66.5	Low	72.7	Confident	49 Å²	49	54.7 Å²	54.7	51%	0.505	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	21.4	175.3	0	0	0	0	0	115.7	C707 A708 L713	C707-G711 PolarHBondContact O-N 3.24Å; A708-G711 PolarHBondContact O-N 3.47Å; G711-L713 PolarHBondContact O-N 3.12Å
712	F	73.9	Confident	72.5	Confident	66 Å²	66	48.1 Å²	48.1	29%	0.289	24%	0.239	S	C	.	.			trans	-83.5	77	-178.9	-61.5	-56.4	0	0	0	112.1	A675 P679 L682 C707 H710 Q714 A715 C716	A675-F712 HydrophobicContact CB-CE2 4.46Å; P679-F712 HydrophobicContact CB-CE1 3.77Å; P679-F712 HydrophobicContact CB-CE2 4.45Å; P679-F712 HydrophobicContact CB-CZ 3.64Å; L682-F712 HydrophobicContact CD2-CD2 4.32Å; C707-F712 PolarHBondContact O-N 3.08Å; H710-F712 HydrophobicContact CB-CD2 3.61Å; H710-F712 HydrophobicContact CB-CE2 3.38Å; H710-F712 HydrophobicContact CB-CZ 4.17Å; F712-Q714 VanDerWaalsContact C-N 3.33Å; F712-Q714 PolarHBondContact O-N 2.99Å; F712-A715 HydrophobicContact CB-CB 4.01Å; F712-A715 PolarHBondContact O-N 2.89Å; F712-A715 VanDerWaalsContact O-N 3.14Å; F712-C716 PolarHBondContact O-N 3.5Å; F712-C716 PolarHBondContact O-SG 3.36Å
713	L	70.1	Confident	72.3	Confident	77 Å²	77	46.6 Å²	46.6	40%	0.403	24%	0.235	S	C	.	.	H	α-helix	trans	-57.1	-39.3	-175.1	-62.9	174.1	0	0	0	113.9	G711 C716 V717 V736	G711-L713 PolarHBondContact O-N 3.12Å; L713-C716 WeakPolarHBondContact O-CB 3.41Å; L713-C716 PolarHBondContact O-N 3.08Å; L713-V717 WeakPolarHBondContact O-CG2 3.33Å; L713-V717 PolarHBondContact O-N 3Å; L713-V736 HydrophobicContact CB-CG2 3.74Å; L713-V736 HydrophobicContact CD1-CG2 4.24Å
714	Q	70.1	Confident	72.1	Confident	85 Å²	85	52.3 Å²	52.3	40%	0.397	26%	0.262	S	S	.	.	H	α-helix	trans	-66.2	-38.8	177.8	-71.7	178.6	-15.3	0	0	113	L683 F712 L718 V736	L683-Q714 HydrophobicContact CD2-CB 4.35Å; F712-Q714 VanDerWaalsContact C-N 3.33Å; F712-Q714 PolarHBondContact O-N 2.99Å; Q714-L718 WeakPolarHBondContact O-CG 3.41Å; Q714-L718 PolarHBondContact O-N 2.87Å; Q714-V736 HydrophobicContact CG-CG1 3.86Å
715	A	69.6	Low	72.4	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.008	28%	0.275	C	S	.	.	H	α-helix	trans	-68.1	-39.3	173.2	0	0	0	0	0	110.8	L683 L686 C707 F712 V717 L718 V719	L683-A715 HydrophobicContact CD2-CB 3.85Å; L686-A715 HydrophobicContact CD1-CB 3.67Å; C707-A715 HydrophobicContact CB-CB 4.44Å; F712-A715 HydrophobicContact CB-CB 4.01Å; F712-A715 PolarHBondContact O-N 2.89Å; F712-A715 VanDerWaalsContact O-N 3.14Å; A715-V717 PolarHBondContact O-N 3.42Å; A715-L718 PolarHBondContact O-N 3.23Å; A715-V719 VanDerWaalsContact O-CG2 3.31Å; A715-V719 WeakPolarHBondContact O-CG2 3.45Å; A715-V719 PolarHBondContact O-N 3.33Å
716	C	72	Confident	72.2	Confident	6 Å²	6	48.6 Å²	48.6	4%	0.041	25%	0.252	C	S	.	.	H	α-helix	trans	-59.2	-47.2	174.2	-64.5	0	0	0	0	111.7	C707 F712 L713 L718 V719 Y720	C707-C716 VanDerWaalsContact CB-SG 3.53Å; F712-C716 PolarHBondContact O-N 3.5Å; F712-C716 PolarHBondContact O-SG 3.36Å; L713-C716 WeakPolarHBondContact O-CB 3.41Å; L713-C716 PolarHBondContact O-N 3.08Å; C716-L718 VanDerWaalsContact C-N 3.3Å; C716-L718 PolarHBondContact O-N 3.4Å; C716-V719 PolarHBondContact O-N 2.85Å; C716-Y720 HydrophobicContact CB-CD2 4.3Å; C716-Y720 HydrophobicContact CB-CE2 4.21Å; C716-Y720 WeakPolarHBondContact O-CD2 3.12Å; C716-Y720 PolarHBondContact O-N 3.23Å
717	V	74.4	Confident	72.2	Confident	6 Å²	6	52.1 Å²	52.1	4%	0.036	27%	0.268	C	S	.	.	H	α-helix	trans	-57.9	-42.5	176.8	171.3	0	0	0	0	111.3	L713 A715 Y720 R721 L732 A733	L713-V717 WeakPolarHBondContact O-CG2 3.33Å; L713-V717 PolarHBondContact O-N 3Å; A715-V717 PolarHBondContact O-N 3.42Å; V717-Y720 PolarHBondContact O-N 3.02Å; V717-R721 VanDerWaalsContact O-CB 3.29Å; V717-R721 WeakPolarHBondContact O-CB 3.41Å; V717-R721 PolarHBondContact O-N 3.48Å; V717-L732 HydrophobicContact CG2-CB 3.82Å; V717-A733 HydrophobicContact CG1-CB 3.9Å; V717-A733 HydrophobicContact CG2-CB 4.13Å
718	L	71.4	Confident	72.4	Confident	37 Å²	37	56.6 Å²	56.6	19%	0.194	29%	0.289	C	S	.	.	H	α-helix	trans	-65.2	-41.9	176.6	-70.5	171.6	0	0	0	112.4	L683 R687 Q714 A715 C716 R721 I722	L683-L718 HydrophobicContact CD2-CD1 4.44Å; R687-L718 HydrophobicContact CG-CD1 4.08Å; Q714-L718 WeakPolarHBondContact O-CG 3.41Å; Q714-L718 PolarHBondContact O-N 2.87Å; A715-L718 PolarHBondContact O-N 3.23Å; C716-L718 VanDerWaalsContact C-N 3.3Å; C716-L718 PolarHBondContact O-N 3.4Å; L718-R721 WeakPolarHBondContact O-CB 3.33Å; L718-R721 PolarHBondContact O-N 3.26Å; L718-I722 WeakPolarHBondContact O-CB 3.43Å; L718-I722 WeakPolarHBondContact O-CD1 3.42Å; L718-I722 VanDerWaalsContact O-CG1 3.26Å; L718-I722 WeakPolarHBondContact O-CG1 3.46Å; L718-I722 PolarHBondContact O-N 3.12Å
719	V	74.2	Confident	72.5	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-69.8	-38.5	177.9	-179.8	0	0	0	0	111.3	L686 L700 L704 A715 C716 I722 M723	L686-V719 HydrophobicContact CD1-CG2 4.29Å; L686-V719 HydrophobicContact CD2-CG2 4.1Å; L700-V719 HydrophobicContact CB-CG1 4.44Å; L700-V719 HydrophobicContact CD2-CG1 4.06Å; L704-V719 HydrophobicContact CD1-CG1 4.44Å; L704-V719 HydrophobicContact CD2-CB 3.72Å; L704-V719 HydrophobicContact CD2-CG1 3.59Å; L704-V719 HydrophobicContact CG-CB 4.24Å; L704-V719 HydrophobicContact CG-CG1 3.53Å; A715-V719 VanDerWaalsContact O-CG2 3.31Å; A715-V719 WeakPolarHBondContact O-CG2 3.45Å; A715-V719 PolarHBondContact O-N 3.33Å; C716-V719 PolarHBondContact O-N 2.85Å; V719-I722 WeakPolarHBondContact O-CB 3.31Å; V719-I722 PolarHBondContact O-N 2.93Å; V719-M723 HydrophobicContact CG1-SD 4.32Å; V719-M723 WeakPolarHBondContact O-CG 3.29Å; V719-M723 PolarHBondContact O-N 3.2Å
720	Y	77.4	Confident	72.5	Confident	50 Å²	50	46.9 Å²	46.9	20%	0.196	23%	0.233	C	C	.	.	H	α-helix	trans	-65.4	-38.9	173.2	-76.9	-64.2	0	0	0	112.4	L704 C716 V717 I722 M723 E724 L725 E728 L732	L704-Y720 HydrophobicContact CD1-CD1 3.97Å; L704-Y720 HydrophobicContact CD1-CE1 3.52Å; L704-Y720 HydrophobicContact CD2-CD1 4.18Å; L704-Y720 HydrophobicContact CD2-CD2 3.83Å; L704-Y720 HydrophobicContact CD2-CE1 4.01Å; L704-Y720 HydrophobicContact CD2-CE2 3.6Å; L704-Y720 HydrophobicContact CD2-CG 4.09Å; L704-Y720 HydrophobicContact CG-CE1 4.44Å; C716-Y720 HydrophobicContact CB-CD2 4.3Å; C716-Y720 HydrophobicContact CB-CE2 4.21Å; C716-Y720 WeakPolarHBondContact O-CD2 3.12Å; C716-Y720 PolarHBondContact O-N 3.23Å; V717-Y720 PolarHBondContact O-N 3.02Å; Y720-I722 VanDerWaalsContact C-N 3.29Å; Y720-I722 PolarHBondContact O-N 3.4Å; Y720-M723 PolarHBondContact O-N 3.23Å; Y720-E724 PolarHBondContact O-N 3.01Å; Y720-L725 HydrophobicContact CD1-CB 4.28Å; Y720-L725 HydrophobicContact CD1-CD1 4.28Å; Y720-L725 PolarHBondContact O-N 3.46Å; Y720-E728 HydrophobicContact CD1-CB 4.21Å; Y720-E728 HydrophobicContact CE1-CB 4.35Å; Y720-E728 VanDerWaalsContact CE1-OE2 3.26Å; Y720-E728 WeakPolarHBondContact CE1-OE2 3.23Å; Y720-L732 HydrophobicContact CD2-CD1 3.42Å; Y720-L732 VanDerWaalsContact CD2-CD1 3.42Å; Y720-L732 HydrophobicContact CE2-CD1 3.12Å
721	R	71.6	Confident	72.8	Confident	69 Å²	69	46.3 Å²	46.3	26%	0.26	23%	0.233	S	C	.	.	H	α-helix	trans	-57.3	-44.3	171.5	166.5	179.4	169.9	165.1	1.6	111.3	V717 L718 E724 L747	V717-R721 VanDerWaalsContact O-CB 3.29Å; V717-R721 WeakPolarHBondContact O-CB 3.41Å; V717-R721 PolarHBondContact O-N 3.48Å; L718-R721 WeakPolarHBondContact O-CB 3.33Å; L718-R721 PolarHBondContact O-N 3.26Å; R721-E724 PolarHBondContact O-N 3.37Å; R721-L747 HydrophobicContact CG-CD1 4.01Å; R721-L747 VanDerWaalsContact NH2-CD2 3.27Å
722	I	71.8	Confident	73.2	Confident	8 Å²	8	45.7 Å²	45.7	4%	0.041	22%	0.218	C	C	.	.	H	α-helix	trans	-67.5	-36.9	178.2	-77	166.2	0	0	0	111.8	P693 I696 L700 L718 V719 Y720 E724	P693-I722 WeakPolarHBondContact CG-O 3.39Å; I696-I722 HydrophobicContact CD1-CB 4.15Å; I696-I722 HydrophobicContact CD1-CD1 3.88Å; I696-I722 HydrophobicContact CD1-CG1 4.06Å; I696-I722 HydrophobicContact CD1-CG2 3.05Å; L700-I722 HydrophobicContact CD1-CG2 4.08Å; L700-I722 HydrophobicContact CD2-CB 4.46Å; L700-I722 HydrophobicContact CD2-CG2 3.46Å; L700-I722 VanDerWaalsContact CD2-CG2 3.46Å; L700-I722 HydrophobicContact CG-CG2 4.45Å; L718-I722 WeakPolarHBondContact O-CB 3.43Å; L718-I722 WeakPolarHBondContact O-CD1 3.42Å; L718-I722 VanDerWaalsContact O-CG1 3.26Å; L718-I722 WeakPolarHBondContact O-CG1 3.46Å; L718-I722 PolarHBondContact O-N 3.12Å; V719-I722 WeakPolarHBondContact O-CB 3.31Å; V719-I722 PolarHBondContact O-N 2.93Å; Y720-I722 VanDerWaalsContact C-N 3.29Å; Y720-I722 PolarHBondContact O-N 3.4Å; I722-E724 PolarHBondContact O-N 3.27Å
723	M	70.5	Confident	73.2	Confident	44 Å²	44	42.6 Å²	42.6	22%	0.217	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	3.7	177.6	-74.4	-176.3	70.2	0	0	113.8	L700 K701 L704 V719 Y720 L725	L700-M723 HydrophobicContact CB-CG 3.73Å; L700-M723 HydrophobicContact CB-SD 3.73Å; L700-M723 HydrophobicContact CD1-CG 3.76Å; L700-M723 HydrophobicContact CD2-CG 4.35Å; L700-M723 HydrophobicContact CG-CG 4.15Å; K701-M723 HydrophobicContact CG-CE 4.26Å; L704-M723 HydrophobicContact CD1-CE 4.2Å; L704-M723 HydrophobicContact CD1-SD 3.25Å; L704-M723 WeakPolarHBondContact CD1-SD 3.21Å; L704-M723 HydrophobicContact CG-SD 4Å; V719-M723 HydrophobicContact CG1-SD 4.32Å; V719-M723 WeakPolarHBondContact O-CG 3.29Å; V719-M723 PolarHBondContact O-N 3.2Å; Y720-M723 PolarHBondContact O-N 3.23Å; M723-L725 HydrophobicContact CB-CD1 4.22Å; M723-L725 HydrophobicContact CB-CG 4.3Å; M723-L725 HydrophobicContact CE-CD1 4.09Å; M723-L725 PolarHBondContact O-N 3.2Å
724	E	69.8	Low	73.4	Confident	120 Å²	120	39.9 Å²	39.9	56%	0.561	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.9	15.4	-175.2	-60	172.8	177.9	0	0	113.3	Y720 R721 I722 H726	Y720-E724 PolarHBondContact O-N 3.01Å; R721-E724 PolarHBondContact O-N 3.37Å; I722-E724 PolarHBondContact O-N 3.27Å; E724-H726 PolarHBondContact O-CD2 3.25Å; E724-H726 VanDerWaalsContact O-CD2 3.22Å; E724-H726 PolarHBondContact O-N 3.08Å
725	L	77.6	Confident	73.5	Confident	71 Å²	71	42.5 Å²	42.5	37%	0.372	20%	0.203	S	C	.	.			trans	-86.3	64.6	174.6	-69.3	171.8	0	0	0	109.4	Y720 M723 E727 E728 A729	Y720-L725 HydrophobicContact CD1-CB 4.28Å; Y720-L725 HydrophobicContact CD1-CD1 4.28Å; Y720-L725 PolarHBondContact O-N 3.46Å; M723-L725 HydrophobicContact CB-CD1 4.22Å; M723-L725 HydrophobicContact CB-CG 4.3Å; M723-L725 HydrophobicContact CE-CD1 4.09Å; M723-L725 PolarHBondContact O-N 3.2Å; L725-E727 VanDerWaalsContact C-N 3.27Å; L725-E727 PolarHBondContact O-N 2.75Å; L725-E728 PolarHBondContact O-N 3.43Å; L725-A729 WeakPolarHBondContact O-CB 3.35Å; L725-A729 PolarHBondContact O-N 2.9Å
726	H	72.9	Confident	73.4	Confident	22 Å²	22	44.5 Å²	44.5	10%	0.102	21%	0.214	C	C	.	.	H	α-helix	trans	-62.3	-30.8	-173	-59.6	-67.2	0	0	0	113.5	E724 V730 M754 L758	E724-H726 PolarHBondContact O-CD2 3.25Å; E724-H726 VanDerWaalsContact O-CD2 3.22Å; E724-H726 PolarHBondContact O-N 3.08Å; H726-V730 WeakPolarHBondContact O-CB 3.39Å; H726-V730 VanDerWaalsContact O-CG2 3.22Å; H726-V730 WeakPolarHBondContact O-CG2 3.45Å; H726-V730 PolarHBondContact O-N 3.12Å; H726-M754 HydrophobicContact CB-SD 4.42Å; H726-L758 HydrophobicContact CB-CD1 3.58Å; H726-L758 HydrophobicContact CB-CD2 4.39Å
727	E	74.3	Confident	73.3	Confident	89 Å²	89	48.3 Å²	48.3	42%	0.416	23%	0.234	S	C	.	.	H	α-helix	trans	-65.8	-49.6	177.6	-63.8	-161.4	-176.6	0	0	112.1	L725 A729 V730 D731 L758 K761	L725-E727 VanDerWaalsContact C-N 3.27Å; L725-E727 PolarHBondContact O-N 2.75Å; E727-A729 VanDerWaalsContact C-N 3.34Å; E727-V730 PolarHBondContact O-N 3.04Å; E727-D731 VanDerWaalsContact O-CG 3.28Å; E727-D731 PolarHBondContact O-N 2.9Å; E727-L758 HydrophobicContact CB-CD2 4.38Å; E727-L758 HydrophobicContact CG-CD2 3.89Å; E727-K761 IonicContact OE2-NZ 2.83Å; E727-K761 PolarHBondContact OE2-NZ 3.44Å
728	E	76.4	Confident	73.1	Confident	94 Å²	94	49.4 Å²	49.4	44%	0.439	24%	0.241	S	C	.	.	H	α-helix	trans	-69.2	-35.1	178.6	-61.7	179.5	172.2	0	0	111.3	Y720 L725 D731 L732	Y720-E728 HydrophobicContact CD1-CB 4.21Å; Y720-E728 HydrophobicContact CE1-CB 4.35Å; Y720-E728 VanDerWaalsContact CE1-OE2 3.26Å; Y720-E728 WeakPolarHBondContact CE1-OE2 3.23Å; L725-E728 PolarHBondContact O-N 3.43Å; E728-D731 PolarHBondContact O-N 3.19Å; E728-L732 PolarHBondContact O-N 3.28Å
729	A	74.9	Confident	72.9	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.6	-44	173.5	0	0	0	0	0	111.7	L725 E727 A733	L725-A729 WeakPolarHBondContact O-CB 3.35Å; L725-A729 PolarHBondContact O-N 2.9Å; E727-A729 VanDerWaalsContact C-N 3.34Å; A729-A733 WeakPolarHBondContact O-CB 3.43Å; A729-A733 PolarHBondContact O-N 2.76Å
730	V	74.2	Confident	72.7	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-69.7	-41.1	178.3	168.5	0	0	0	0	110.8	H726 E727 L732 A733 L734 C744 L758 I762	H726-V730 WeakPolarHBondContact O-CB 3.39Å; H726-V730 VanDerWaalsContact O-CG2 3.22Å; H726-V730 WeakPolarHBondContact O-CG2 3.45Å; H726-V730 PolarHBondContact O-N 3.12Å; E727-V730 PolarHBondContact O-N 3.04Å; V730-L732 VanDerWaalsContact C-N 3.32Å; V730-L732 PolarHBondContact O-N 3.38Å; V730-A733 PolarHBondContact O-N 3.27Å; V730-L734 HydrophobicContact CG1-CD1 3.93Å; V730-L734 HydrophobicContact CG1-CG 4.2Å; V730-L734 WeakPolarHBondContact O-CB 3.46Å; V730-L734 WeakPolarHBondContact O-CG 3.46Å; V730-L734 PolarHBondContact O-N 2.86Å; V730-C744 HydrophobicContact CG2-CB 4.01Å; V730-L758 HydrophobicContact CB-CD2 4.38Å; V730-L758 HydrophobicContact CG2-CD2 4.13Å; V730-I762 HydrophobicContact CG1-CD1 4.01Å; V730-I762 HydrophobicContact CG1-CG1 3.67Å
731	D	75.9	Confident	72.3	Confident	79 Å²	79	53.6 Å²	53.6	42%	0.422	27%	0.267	S	S	.	.	H	α-helix	trans	-61.8	-39.5	177.5	-71.1	-19	0	0	0	112	E727 E728	E727-D731 VanDerWaalsContact O-CG 3.28Å; E727-D731 PolarHBondContact O-N 2.9Å; E728-D731 PolarHBondContact O-N 3.19Å
732	L	74.1	Confident	72.3	Confident	36 Å²	36	52.5 Å²	52.5	19%	0.188	26%	0.264	C	S	.	.	H	α-helix	trans	-77.5	-32.5	174.3	-71.9	170.3	0	0	0	113.1	V717 Y720 E728 V730 Q735	V717-L732 HydrophobicContact CG2-CB 3.82Å; Y720-L732 HydrophobicContact CD2-CD1 3.42Å; Y720-L732 VanDerWaalsContact CD2-CD1 3.42Å; Y720-L732 HydrophobicContact CE2-CD1 3.12Å; E728-L732 PolarHBondContact O-N 3.28Å; V730-L732 VanDerWaalsContact C-N 3.32Å; V730-L732 PolarHBondContact O-N 3.38Å; L732-Q735 PolarHBondContact O-N 3.2Å
733	A	74.9	Confident	72.3	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-67.5	-36.8	175.3	0	0	0	0	0	111.9	V717 A729 V730 Q735 V736 D737 A741	V717-A733 HydrophobicContact CG1-CB 3.9Å; V717-A733 HydrophobicContact CG2-CB 4.13Å; A729-A733 WeakPolarHBondContact O-CB 3.43Å; A729-A733 PolarHBondContact O-N 2.76Å; V730-A733 PolarHBondContact O-N 3.27Å; A733-Q735 PolarHBondContact O-N 3.08Å; A733-V736 PolarHBondContact O-N 3.43Å; A733-D737 CarbonylContact O-C 3.58Å; A733-D737 PolarHBondContact O-N 3.29Å; A733-D737 VanDerWaalsContact O-O 3.12Å; A733-A741 HydrophobicContact CB-CB 3.89Å
734	L	73.7	Confident	72	Confident	21 Å²	21	52.3 Å²	52.3	11%	0.11	27%	0.268	C	S	.	.	H	α-helix	trans	-61.7	-26.8	175.2	-74.3	169.3	0	0	0	112.5	V730 V736 A741 I762 H765	V730-L734 HydrophobicContact CG1-CD1 3.93Å; V730-L734 HydrophobicContact CG1-CG 4.2Å; V730-L734 WeakPolarHBondContact O-CB 3.46Å; V730-L734 WeakPolarHBondContact O-CG 3.46Å; V730-L734 PolarHBondContact O-N 2.86Å; L734-V736 VanDerWaalsContact C-N 3.32Å; L734-A741 HydrophobicContact CD2-CB 3.91Å; L734-A741 HydrophobicContact CG-CB 4.11Å; L734-I762 HydrophobicContact CD2-CG1 4.48Å; L734-H765 HydrophobicContact CD1-CB 4.13Å; L734-H765 HydrophobicContact CD2-CB 4.24Å
735	Q	71.9	Confident	71.8	Confident	140 Å²	140	46.6 Å²	46.6	65%	0.654	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-18	173.5	-63.4	179	9.7	0	0	113.6	L732 A733	L732-Q735 PolarHBondContact O-N 3.2Å; A733-Q735 PolarHBondContact O-N 3.08Å
736	V	66.9	Low	71.3	Confident	42 Å²	42	45.6 Å²	45.6	26%	0.255	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-61.6	-175.3	-178.3	0	0	0	0	111.3	L713 Q714 A733 L734 L740	L713-V736 HydrophobicContact CB-CG2 3.74Å; L713-V736 HydrophobicContact CD1-CG2 4.24Å; Q714-V736 HydrophobicContact CG-CG1 3.86Å; A733-V736 PolarHBondContact O-N 3.43Å; L734-V736 VanDerWaalsContact C-N 3.32Å; V736-L740 HydrophobicContact CG1-CD1 4.41Å
737	D	71.2	Confident	70.9	Confident	86 Å²	86	47.5 Å²	47.5	46%	0.46	25%	0.247	S	C	.	.			trans	-155.8	130.8	-178.8	-81.7	-46.9	0	0	0	111.9	A733 D739 L740 A741	A733-D737 CarbonylContact O-C 3.58Å; A733-D737 PolarHBondContact O-N 3.29Å; A733-D737 VanDerWaalsContact O-O 3.12Å; D737-D739 VanDerWaalsContact C-N 3.26Å; D737-D739 PolarHBondContact O-N 2.87Å; D737-L740 HydrophobicContact CB-CB 4.23Å; D737-L740 HydrophobicContact CB-CD1 4.08Å; D737-L740 HydrophobicContact CB-CG 4.05Å; D737-L740 PolarHBondContact O-N 3.29Å; D737-A741 PolarHBondContact O-N 3.47Å; D737-A741 VanDerWaalsContact O-N 3.16Å
738	V	69.1	Low	70.5	Confident	29 Å²	29	43.9 Å²	43.9	18%	0.176	23%	0.231	C	C	.	.	H	α-helix	trans	-63	-31.7	178.9	-177.4	0	0	0	0	112.1	A741 K742 V766	V738-A741 WeakPolarHBondContact O-CB 3.02Å; V738-A741 PolarHBondContact O-N 2.86Å; V738-K742 WeakPolarHBondContact O-CG 3.19Å; V738-K742 PolarHBondContact O-N 3.26Å; V738-V766 HydrophobicContact CG1-CG2 3.92Å
739	D	68.2	Low	69.6	Low	111 Å²	111	47.2 Å²	47.2	59%	0.594	25%	0.246	S	C	*	.	H	α-helix	trans	-74.8	-31.1	179.3	-65	-36.1	0	0	0	112.6	D737 A741 K742 S743	D737-D739 VanDerWaalsContact C-N 3.26Å; D737-D739 PolarHBondContact O-N 2.87Å; D739-A741 VanDerWaalsContact C-N 3.33Å; D739-K742 PolarHBondContact O-N 2.88Å; D739-K742 IonicContact OD1-NZ 2.92Å; D739-K742 PolarHBondContact OD1-NZ 3.45Å; D739-S743 PolarHBondContact O-N 3.48Å; D739-S743 VanDerWaalsContact O-N 3.1Å
740	L	68.5	Low	68.7	Low	65 Å²	65	55 Å²	55	34%	0.34	29%	0.288	S	S	.	.	H	α-helix	trans	-66.6	-38.7	168.8	-70.6	177.6	0	0	0	110.5	V736 D737 S743 C744	V736-L740 HydrophobicContact CG1-CD1 4.41Å; D737-L740 HydrophobicContact CB-CB 4.23Å; D737-L740 HydrophobicContact CB-CD1 4.08Å; D737-L740 HydrophobicContact CB-CG 4.05Å; D737-L740 PolarHBondContact O-N 3.29Å; L740-S743 PolarHBondContact O-N 2.88Å; L740-S743 PolarHBondContact O-OG 3.14Å; L740-C744 PolarHBondContact O-N 3.35Å; L740-C744 PolarHBondContact O-SG 2.95Å
741	A	71.1	Confident	68.4	Low	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-62.8	-41.6	175.1	0	0	0	0	0	112.3	A733 L734 D737 V738 D739 C744 A745 I762	A733-A741 HydrophobicContact CB-CB 3.89Å; L734-A741 HydrophobicContact CD2-CB 3.91Å; L734-A741 HydrophobicContact CG-CB 4.11Å; D737-A741 PolarHBondContact O-N 3.47Å; D737-A741 VanDerWaalsContact O-N 3.16Å; V738-A741 WeakPolarHBondContact O-CB 3.02Å; V738-A741 PolarHBondContact O-N 2.86Å; D739-A741 VanDerWaalsContact C-N 3.33Å; A741-C744 PolarHBondContact O-N 3.24Å; A741-A745 PolarHBondContact O-N 3.48Å; A741-I762 HydrophobicContact CB-CD1 4.21Å; A741-I762 HydrophobicContact CB-CG1 4.44Å; A741-I762 WeakPolarHBondContact O-CD1 3.46Å
742	K	70.9	Confident	67.9	Low	45 Å²	45	61.7 Å²	61.7	20%	0.196	32%	0.32	C	S	.	.	H	α-helix	trans	-58.1	-48.8	172.5	-68.8	172.5	-169.5	161.1	0	111.6	V738 D739 C744 A745 D746 W759 C779	V738-K742 WeakPolarHBondContact O-CG 3.19Å; V738-K742 PolarHBondContact O-N 3.26Å; D739-K742 PolarHBondContact O-N 2.88Å; D739-K742 IonicContact OD1-NZ 2.92Å; D739-K742 PolarHBondContact OD1-NZ 3.45Å; K742-C744 PolarHBondContact O-N 2.68Å; K742-A745 PolarHBondContact O-N 3.18Å; K742-A745 VanDerWaalsContact O-N 3.1Å; K742-D746 PolarHBondContact O-N 2.99Å; K742-D746 VanDerWaalsContact O-N 3.16Å; K742-W759 HydrophobicContact CB-CH2 3.97Å; K742-W759 HydrophobicContact CB-CZ2 4.36Å; K742-W759 HydrophobicContact CD-CH2 4.42Å; K742-W759 HydrophobicContact CG-CH2 3.8Å; K742-W759 HydrophobicContact CG-CZ3 4.14Å; K742-C779 WeakPolarHBondContact CE-SG 3.41Å
743	S	70.3	Confident	67.7	Low	45 Å²	45	67 Å²	67	32%	0.315	34%	0.344	S	S	.	.	H	α-helix	trans	-61.7	-33.6	178.5	77.4	0	0	0	0	112.7	D739 L740 L747	D739-S743 PolarHBondContact O-N 3.48Å; D739-S743 VanDerWaalsContact O-N 3.1Å; L740-S743 PolarHBondContact O-N 2.88Å; L740-S743 PolarHBondContact O-OG 3.14Å; S743-L747 WeakPolarHBondContact O-CD1 3.25Å
744	C	65.1	Low	67.4	Low	4 Å²	4	69.8 Å²	69.8	3%	0.027	36%	0.357	C	S	.	.	H	α-helix	trans	-71.6	-32.9	176.6	-68.7	0	0	0	0	112.5	V730 L740 A741 K742	V730-C744 HydrophobicContact CG2-CB 4.01Å; L740-C744 PolarHBondContact O-N 3.35Å; L740-C744 PolarHBondContact O-SG 2.95Å; A741-C744 PolarHBondContact O-N 3.24Å; K742-C744 PolarHBondContact O-N 2.68Å
745	A	66.4	Low	67.3	Low	0 Å²	0	71.3 Å²	71.3	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-79.5	-19	179.4	0	0	0	0	0	114.3	A741 K742 P748 R755 L758 W759 I762	A741-A745 PolarHBondContact O-N 3.48Å; K742-A745 PolarHBondContact O-N 3.18Å; K742-A745 VanDerWaalsContact O-N 3.1Å; A745-P748 WeakPolarHBondContact O-CD 3.37Å; A745-R755 WeakPolarHBondContact O-CG 3.49Å; A745-L758 HydrophobicContact CB-CB 4.08Å; A745-W759 HydrophobicContact CB-CD2 4.32Å; A745-W759 HydrophobicContact CB-CG 4.27Å; A745-W759 PolarHBondContact O-NE1 2.91Å; A745-I762 HydrophobicContact CB-CD1 3.39Å
746	D	66.8	Low	67.4	Low	50 Å²	50	67.9 Å²	67.9	27%	0.267	35%	0.345	S	S	.	.	H	α-helix	trans	-85.4	-15.2	177.2	-77.1	-31.4	0	0	0	114.9	K742 R755 W759	K742-D746 PolarHBondContact O-N 2.99Å; K742-D746 VanDerWaalsContact O-N 3.16Å; D746-R755 IonicContact OD1-CZ 3.65Å; D746-R755 IonicContact OD1-NE 3.74Å; D746-R755 PolarHBondContact OD1-NE 3.17Å; D746-R755 IonicContact OD1-NH2 3.36Å; D746-R755 PolarHBondContact OD1-NH2 3.49Å; D746-W759 VanDerWaalsContact OD1-CZ2 3.23Å; D746-W759 WeakPolarHBondContact OD1-CZ2 3.39Å; D746-W759 PolarHBondContact OD1-NE1 3.39Å
747	L	64.3	Low	67.8	Low	61 Å²	61	71.3 Å²	71.3	32%	0.319	36%	0.356	S	S	.	.			trans	-69.2	-33.3	-177	-79.8	139.8	0	0	0	117.7	R721 S743 E749	R721-L747 HydrophobicContact CG-CD1 4.01Å; R721-L747 VanDerWaalsContact NH2-CD2 3.27Å; S743-L747 WeakPolarHBondContact O-CD1 3.25Å; L747-E749 VanDerWaalsContact C-N 3.28Å; L747-E749 PolarHBondContact O-N 3.01Å
748	P	65.4	Low	68	Low	13 Å²	13	67.2 Å²	67.2	8%	0.084	33%	0.334	C	S	.	.			trans	-72.9	88.2	174.3	26.7	-29.8	0	0	0	109	A745 R755 L758	A745-P748 WeakPolarHBondContact O-CD 3.37Å; P748-R755 HydrophobicContact CG-CB 4.24Å; P748-L758 HydrophobicContact CG-CD1 4.13Å
749	E	57.4	Low	68.4	Low	164 Å²	164	66 Å²	66	77%	0.766	33%	0.326	S	S	*	.	S	Bend	trans	-74.2	-29.8	177.8	-67.8	-165.8	166.5	0	0	112.2	L747	L747-E749 VanDerWaalsContact C-N 3.28Å; L747-E749 PolarHBondContact O-N 3.01Å
750	D	56.8	Low	68.7	Low	164 Å²	164	62.6 Å²	62.6	88%	0.877	31%	0.308	S	S	*	.	S	Bend	trans	-85.7	-24.6	-175.9	-66	-41.7	0	0	0	114
751	D	67.8	Low	68.9	Low	88 Å²	88	62.4 Å²	62.4	47%	0.471	30%	0.304	S	S	.	.			trans	-110.7	80.8	-175.5	-81.1	-29.5	0	0	0	112.1	E753 M754 R755	D751-E753 PolarHBondContact O-N 2.87Å; D751-E753 VanDerWaalsContact O-N 3.16Å; D751-M754 HydrophobicContact CB-CB 3.77Å; D751-M754 PolarHBondContact O-N 3.44Å; D751-R755 PolarHBondContact O-N 3.19Å
752	E	65.5	Low	68.9	Low	131 Å²	131	62.4 Å²	62.4	61%	0.612	30%	0.304	S	S	*	.	H	α-helix	trans	-54.1	-35.5	176.6	-70.2	-169.6	163.9	0	0	112.7	K756 L785	E752-K756 VanDerWaalsContact O-CB 3.29Å; E752-K756 WeakPolarHBondContact O-CB 3.28Å; E752-K756 PolarHBondContact O-N 3.36Å; E752-L785 HydrophobicContact CB-CD2 4.42Å; E752-L785 HydrophobicContact CG-CD2 3.98Å
753	E	69.2	Low	68.9	Low	149 Å²	149	60.9 Å²	60.9	70%	0.696	30%	0.3	S	S	*	.	H	α-helix	trans	-68.5	-39	178.1	-66.7	-170	178.6	0	0	113	D751 K757	D751-E753 PolarHBondContact O-N 2.87Å; D751-E753 VanDerWaalsContact O-N 3.16Å; E753-K757 VanDerWaalsContact O-CG 3.31Å; E753-K757 WeakPolarHBondContact O-CG 3.43Å; E753-K757 PolarHBondContact O-N 2.99Å
754	M	70	Confident	68.9	Low	57 Å²	57	64.4 Å²	64.4	28%	0.281	31%	0.306	S	S	.	.	H	α-helix	trans	-72.4	-43.7	178.7	-167.6	-171.7	-61.1	0	0	109.8	H726 D751 K756 K757 L758	H726-M754 HydrophobicContact CB-SD 4.42Å; D751-M754 HydrophobicContact CB-CB 3.77Å; D751-M754 PolarHBondContact O-N 3.44Å; M754-K756 VanDerWaalsContact C-N 3.31Å; M754-K756 PolarHBondContact O-N 3.18Å; M754-K757 WeakPolarHBondContact O-CB 3.43Å; M754-K757 PolarHBondContact O-N 2.88Å; M754-K757 VanDerWaalsContact O-N 3.1Å; M754-L758 HydrophobicContact CG-CD1 4.16Å; M754-L758 HydrophobicContact CG-CG 4.43Å; M754-L758 VanDerWaalsContact O-CG 3.3Å; M754-L758 WeakPolarHBondContact O-CG 3.47Å; M754-L758 PolarHBondContact O-N 3.46Å
755	R	71.1	Confident	69.1	Low	54 Å²	54	66.5 Å²	66.5	20%	0.204	32%	0.316	C	S	.	.	H	α-helix	trans	-55.9	-45.9	172.4	-173.7	160.3	175.5	-165.5	4.2	111.2	A745 D746 P748 D751 K757 L758 W759 L785	A745-R755 WeakPolarHBondContact O-CG 3.49Å; D746-R755 IonicContact OD1-CZ 3.65Å; D746-R755 IonicContact OD1-NE 3.74Å; D746-R755 PolarHBondContact OD1-NE 3.17Å; D746-R755 IonicContact OD1-NH2 3.36Å; D746-R755 PolarHBondContact OD1-NH2 3.49Å; P748-R755 HydrophobicContact CG-CB 4.24Å; D751-R755 PolarHBondContact O-N 3.19Å; R755-K757 PolarHBondContact O-N 3.41Å; R755-L758 PolarHBondContact O-N 3.31Å; R755-W759 WeakPolarHBondContact O-CB 3.26Å; R755-W759 VanDerWaalsContact O-CD1 3.27Å; R755-W759 PolarHBondContact O-N 2.83Å; R755-L785 HydrophobicContact CB-CD1 4.24Å; R755-L785 VanDerWaalsContact CD-CD1 3.48Å; R755-L785 HydrophobicContact CG-CD1 3.8Å
756	K	72.4	Confident	69.3	Low	68 Å²	68	66.6 Å²	66.6	30%	0.296	32%	0.316	S	S	.	.	H	α-helix	trans	-60.2	-43	174.8	-171.2	171.7	-179.4	170.6	0	112.1	E752 M754 L760 L786 D790	E752-K756 VanDerWaalsContact O-CB 3.29Å; E752-K756 WeakPolarHBondContact O-CB 3.28Å; E752-K756 PolarHBondContact O-N 3.36Å; M754-K756 VanDerWaalsContact C-N 3.31Å; M754-K756 PolarHBondContact O-N 3.18Å; K756-L760 HydrophobicContact CG-CD1 4.11Å; K756-L760 VanDerWaalsContact O-CB 3.28Å; K756-L760 WeakPolarHBondContact O-CB 3.49Å; K756-L760 WeakPolarHBondContact O-CD1 3.5Å; K756-L760 WeakPolarHBondContact O-CG 3.41Å; K756-L760 PolarHBondContact O-N 2.98Å; K756-L786 HydrophobicContact CG-CD2 3.98Å; K756-D790 VanDerWaalsContact CE-CG 3.5Å; K756-D790 WeakPolarHBondContact CE-OD2 3.38Å; K756-D790 IonicContact NZ-OD1 2.93Å; K756-D790 PolarHBondContact NZ-OD1 3.3Å; K756-D790 IonicContact NZ-OD2 3.33Å; K756-D790 PolarHBondContact NZ-OD2 2.67Å
757	K	76.6	Confident	69.3	Low	113 Å²	113	65.4 Å²	65.4	49%	0.491	31%	0.311	S	S	.	.	H	α-helix	trans	-65.1	-43.3	176.9	-74.4	168.8	-173.8	164.9	0	112.8	E753 M754 R755 L760 K761	E753-K757 VanDerWaalsContact O-CG 3.31Å; E753-K757 WeakPolarHBondContact O-CG 3.43Å; E753-K757 PolarHBondContact O-N 2.99Å; M754-K757 WeakPolarHBondContact O-CB 3.43Å; M754-K757 PolarHBondContact O-N 2.88Å; M754-K757 VanDerWaalsContact O-N 3.1Å; R755-K757 PolarHBondContact O-N 3.41Å; K757-L760 PolarHBondContact O-N 3.35Å; K757-K761 WeakPolarHBondContact O-CG 3.25Å; K757-K761 PolarHBondContact O-N 2.95Å
758	L	75.1	Confident	69.5	Low	0 Å²	0	68.9 Å²	68.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-66.5	-45.8	178.8	-67	170.3	0	0	0	111.2	H726 E727 V730 A745 P748 M754 R755 L760 K761 I762	H726-L758 HydrophobicContact CB-CD1 3.58Å; H726-L758 HydrophobicContact CB-CD2 4.39Å; E727-L758 HydrophobicContact CB-CD2 4.38Å; E727-L758 HydrophobicContact CG-CD2 3.89Å; V730-L758 HydrophobicContact CB-CD2 4.38Å; V730-L758 HydrophobicContact CG2-CD2 4.13Å; A745-L758 HydrophobicContact CB-CB 4.08Å; P748-L758 HydrophobicContact CG-CD1 4.13Å; M754-L758 HydrophobicContact CG-CD1 4.16Å; M754-L758 HydrophobicContact CG-CG 4.43Å; M754-L758 VanDerWaalsContact O-CG 3.3Å; M754-L758 WeakPolarHBondContact O-CG 3.47Å; M754-L758 PolarHBondContact O-N 3.46Å; R755-L758 PolarHBondContact O-N 3.31Å; L758-L760 VanDerWaalsContact C-N 3.32Å; L758-L760 PolarHBondContact O-N 3.5Å; L758-K761 WeakPolarHBondContact O-CB 3.48Å; L758-K761 PolarHBondContact O-N 3.05Å; L758-K761 VanDerWaalsContact O-N 3.11Å; L758-I762 WeakPolarHBondContact O-CG1 3.39Å; L758-I762 PolarHBondContact O-N 3.4Å
759	W	76.6	Confident	69.4	Low	5 Å²	5	75 Å²	75	2%	0.019	35%	0.353	C	S	.	.	H	α-helix	trans	-65.6	-33.9	175.1	-83.9	100.7	0	0	0	112.8	K742 A745 D746 R755 I762 A763 C779 C783 L786	K742-W759 HydrophobicContact CB-CH2 3.97Å; K742-W759 HydrophobicContact CB-CZ2 4.36Å; K742-W759 HydrophobicContact CD-CH2 4.42Å; K742-W759 HydrophobicContact CG-CH2 3.8Å; K742-W759 HydrophobicContact CG-CZ3 4.14Å; A745-W759 HydrophobicContact CB-CD2 4.32Å; A745-W759 HydrophobicContact CB-CG 4.27Å; A745-W759 PolarHBondContact O-NE1 2.91Å; D746-W759 VanDerWaalsContact OD1-CZ2 3.23Å; D746-W759 WeakPolarHBondContact OD1-CZ2 3.39Å; D746-W759 PolarHBondContact OD1-NE1 3.39Å; R755-W759 WeakPolarHBondContact O-CB 3.26Å; R755-W759 VanDerWaalsContact O-CD1 3.27Å; R755-W759 PolarHBondContact O-N 2.83Å; W759-I762 PolarHBondContact O-N 3.33Å; W759-A763 WeakPolarHBondContact O-CB 3.35Å; W759-A763 PolarHBondContact O-N 3.23Å; W759-C779 HydrophobicContact CZ3-CB 4.03Å; W759-C783 VanDerWaalsContact CE3-SG 3.53Å; W759-C783 WeakPolarHBondContact CZ2-SG 3.42Å; W759-L786 HydrophobicContact CB-CD1 3.59Å; W759-L786 HydrophobicContact CG-CD1 4.41Å
760	L	74.6	Confident	69.5	Low	38 Å²	38	70.9 Å²	70.9	20%	0.199	33%	0.334	C	S	.	.	H	α-helix	trans	-66.6	-36.7	169.8	-76.5	169.9	0	0	0	112.4	K756 K757 L758 R764 L786 F794	K756-L760 HydrophobicContact CG-CD1 4.11Å; K756-L760 VanDerWaalsContact O-CB 3.28Å; K756-L760 WeakPolarHBondContact O-CB 3.49Å; K756-L760 WeakPolarHBondContact O-CD1 3.5Å; K756-L760 WeakPolarHBondContact O-CG 3.41Å; K756-L760 PolarHBondContact O-N 2.98Å; K757-L760 PolarHBondContact O-N 3.35Å; L758-L760 VanDerWaalsContact C-N 3.32Å; L758-L760 PolarHBondContact O-N 3.5Å; L760-R764 WeakPolarHBondContact O-CB 3.38Å; L760-R764 PolarHBondContact O-N 3.33Å; L760-L786 HydrophobicContact CD2-CD2 3.97Å; L760-L786 HydrophobicContact CG-CD2 4.03Å; L760-F794 HydrophobicContact CD2-CE2 4.26Å
761	K	72.7	Confident	69.6	Low	61 Å²	61	71.7 Å²	71.7	27%	0.265	33%	0.33	S	S	.	.	H	α-helix	trans	-66.1	-44	173.5	-77.7	-174.7	-177	-178	0	111.2	E727 K757 L758 R764 H765	E727-K761 IonicContact OE2-NZ 2.83Å; E727-K761 PolarHBondContact OE2-NZ 3.44Å; K757-K761 WeakPolarHBondContact O-CG 3.25Å; K757-K761 PolarHBondContact O-N 2.95Å; L758-K761 WeakPolarHBondContact O-CB 3.48Å; L758-K761 PolarHBondContact O-N 3.05Å; L758-K761 VanDerWaalsContact O-N 3.11Å; K761-R764 WeakPolarHBondContact O-CB 3.21Å; K761-R764 PolarHBondContact O-N 3.36Å; K761-H765 WeakPolarHBondContact O-CB 3.45Å; K761-H765 PolarHBondContact O-N 3.07Å
762	I	72.8	Confident	69.5	Low	0 Å²	0	70.7 Å²	70.7	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-63.5	-48.2	175.2	-66.1	169	0	0	0	110.3	V730 L734 A741 A745 L758 W759 R764 H765 V766	V730-I762 HydrophobicContact CG1-CD1 4.01Å; V730-I762 HydrophobicContact CG1-CG1 3.67Å; L734-I762 HydrophobicContact CD2-CG1 4.48Å; A741-I762 HydrophobicContact CB-CD1 4.21Å; A741-I762 HydrophobicContact CB-CG1 4.44Å; A741-I762 WeakPolarHBondContact O-CD1 3.46Å; A745-I762 HydrophobicContact CB-CD1 3.39Å; L758-I762 WeakPolarHBondContact O-CG1 3.39Å; L758-I762 PolarHBondContact O-N 3.4Å; W759-I762 PolarHBondContact O-N 3.33Å; I762-R764 VanDerWaalsContact C-N 3.31Å; I762-R764 PolarHBondContact O-N 2.94Å; I762-H765 PolarHBondContact O-N 3.38Å; I762-H765 VanDerWaalsContact O-N 3.16Å; I762-V766 HydrophobicContact CG2-CG2 4.2Å; I762-V766 WeakPolarHBondContact O-CB 3.36Å; I762-V766 VanDerWaalsContact O-CG2 3.27Å; I762-V766 WeakPolarHBondContact O-CG2 3.34Å; I762-V766 PolarHBondContact O-N 2.75Å
763	A	69.1	Low	69.3	Low	14 Å²	14	66.6 Å²	66.6	12%	0.116	31%	0.308	C	S	.	.	H	α-helix	trans	-61.4	-39.6	177.2	0	0	0	0	0	111.7	W759 V766 V767 I791	W759-A763 WeakPolarHBondContact O-CB 3.35Å; W759-A763 PolarHBondContact O-N 3.23Å; A763-V766 PolarHBondContact O-N 3.48Å; A763-V767 VanDerWaalsContact O-CB 3.27Å; A763-V767 WeakPolarHBondContact O-CB 3.28Å; A763-V767 WeakPolarHBondContact O-CG2 3.4Å; A763-V767 PolarHBondContact O-N 3.16Å; A763-I791 HydrophobicContact CB-CD1 4.3Å
764	R	70.6	Confident	69.1	Low	118 Å²	118	67.1 Å²	67.1	45%	0.445	31%	0.308	S	S	.	.	H	α-helix	trans	-60.4	-46.8	173.2	-175.5	-174.5	-60	175.3	2.4	111.2	L760 K761 I762 V767 Q768	L760-R764 WeakPolarHBondContact O-CB 3.38Å; L760-R764 PolarHBondContact O-N 3.33Å; K761-R764 WeakPolarHBondContact O-CB 3.21Å; K761-R764 PolarHBondContact O-N 3.36Å; I762-R764 VanDerWaalsContact C-N 3.31Å; I762-R764 PolarHBondContact O-N 2.94Å; R764-V767 PolarHBondContact O-N 3.46Å; R764-Q768 HydrophobicContact CG-CG 4.31Å; R764-Q768 WeakPolarHBondContact O-CB 3.42Å; R764-Q768 VanDerWaalsContact O-CG 3.23Å; R764-Q768 WeakPolarHBondContact O-CG 3.39Å; R764-Q768 PolarHBondContact O-N 2.89Å
765	H	69.4	Low	68.8	Low	48 Å²	48	69 Å²	69	22%	0.222	32%	0.315	C	S	.	.	H	α-helix	trans	-64.6	-44.5	178.5	-167.9	-80	0	0	0	111.9	L734 K761 I762 V767 Q768 E769	L734-H765 HydrophobicContact CD1-CB 4.13Å; L734-H765 HydrophobicContact CD2-CB 4.24Å; K761-H765 WeakPolarHBondContact O-CB 3.45Å; K761-H765 PolarHBondContact O-N 3.07Å; I762-H765 PolarHBondContact O-N 3.38Å; I762-H765 VanDerWaalsContact O-N 3.16Å; H765-V767 PolarHBondContact O-N 3.43Å; H765-Q768 PolarHBondContact O-N 3.48Å; H765-E769 VanDerWaalsContact CE1-CD 3.42Å; H765-E769 IonicContact CE1-OE2 3.09Å; H765-E769 PolarHBondContact CE1-OE2 3.32Å; H765-E769 IonicContact ND1-OE2 2.91Å; H765-E769 IonicContact NE2-OE1 2.79Å; H765-E769 IonicContact NE2-OE2 3.6Å; H765-E769 PolarHBondContact NE2-OE2 3.02Å; H765-E769 WeakPolarHBondContact O-CB 3.15Å; H765-E769 PolarHBondContact O-N 2.82Å
766	V	70.8	Confident	68.3	Low	2 Å²	2	66.9 Å²	66.9	1%	0.012	31%	0.309	C	S	.	.	I	π-helix	trans	-66	-38.5	178.6	174.2	0	0	0	0	111.7	V738 I762 A763 E770 K771	V738-V766 HydrophobicContact CG1-CG2 3.92Å; I762-V766 HydrophobicContact CG2-CG2 4.2Å; I762-V766 WeakPolarHBondContact O-CB 3.36Å; I762-V766 VanDerWaalsContact O-CG2 3.27Å; I762-V766 WeakPolarHBondContact O-CG2 3.34Å; I762-V766 PolarHBondContact O-N 2.75Å; A763-V766 PolarHBondContact O-N 3.48Å; V766-E770 WeakPolarHBondContact O-CB 3.47Å; V766-E770 PolarHBondContact O-N 3Å; V766-E770 VanDerWaalsContact O-N 3.17Å; V766-K771 PolarHBondContact O-N 3.09Å
767	V	68.2	Low	67.8	Low	26 Å²	26	65.3 Å²	65.3	16%	0.158	30%	0.303	C	S	.	.	I	π-helix	trans	-75.9	-37.1	178.4	173.9	0	0	0	0	111.9	A763 R764 H765 A776 F795	A763-V767 VanDerWaalsContact O-CB 3.27Å; A763-V767 WeakPolarHBondContact O-CB 3.28Å; A763-V767 WeakPolarHBondContact O-CG2 3.4Å; A763-V767 PolarHBondContact O-N 3.16Å; R764-V767 PolarHBondContact O-N 3.46Å; H765-V767 PolarHBondContact O-N 3.43Å; V767-A776 HydrophobicContact CG2-CB 4.14Å; V767-F795 HydrophobicContact CG2-CE1 4.35Å
768	Q	67.8	Low	67.2	Low	134 Å²	134	65 Å²	65	63%	0.626	31%	0.307	S	S	*	.	I	π-helix	trans	-80.3	-42.5	-178.8	-71.2	180	-11.9	0	0	113.4	R764 H765	R764-Q768 HydrophobicContact CG-CG 4.31Å; R764-Q768 WeakPolarHBondContact O-CB 3.42Å; R764-Q768 VanDerWaalsContact O-CG 3.23Å; R764-Q768 WeakPolarHBondContact O-CG 3.39Å; R764-Q768 PolarHBondContact O-N 2.89Å; H765-Q768 PolarHBondContact O-N 3.48Å
769	E	62.5	Low	66.6	Low	140 Å²	140	65.5 Å²	65.5	65%	0.654	31%	0.31	S	S	*	.	I	π-helix	trans	-92.3	-43	-176.3	-61	-152.9	159.2	0	0	113.5	H765	H765-E769 VanDerWaalsContact CE1-CD 3.42Å; H765-E769 IonicContact CE1-OE2 3.09Å; H765-E769 PolarHBondContact CE1-OE2 3.32Å; H765-E769 IonicContact ND1-OE2 2.91Å; H765-E769 IonicContact NE2-OE1 2.79Å; H765-E769 IonicContact NE2-OE2 3.6Å; H765-E769 PolarHBondContact NE2-OE2 3.02Å; H765-E769 WeakPolarHBondContact O-CB 3.15Å; H765-E769 PolarHBondContact O-N 2.82Å
770	E	59.6	Low	65.9	Low	79 Å²	79	66.2 Å²	66.2	37%	0.369	31%	0.314	S	S	.	.	I	π-helix	trans	-93.3	-15.8	-174.7	-64.8	-159	164	0	0	114.9	V766 D772 K775	V766-E770 WeakPolarHBondContact O-CB 3.47Å; V766-E770 PolarHBondContact O-N 3Å; V766-E770 VanDerWaalsContact O-N 3.17Å; E770-D772 PolarHBondContact O-N 3.37Å; E770-K775 IonicContact OE1-NZ 3.71Å; E770-K775 VanDerWaalsContact OE2-CD 3.23Å; E770-K775 WeakPolarHBondContact OE2-CD 3.36Å; E770-K775 IonicContact OE2-NZ 2.78Å; E770-K775 PolarHBondContact OE2-NZ 2.87Å
771	K	59.3	Low	65.2	Low	181 Å²	181	68.7 Å²	68.7	79%	0.787	33%	0.334	S	S	*	.			trans	48.5	27.2	178.2	-65	-174.5	-179.6	177.5	0	116	V766	V766-K771 PolarHBondContact O-N 3.09Å
772	D	64.6	Low	64.5	Low	66 Å²	66	69.1 Å²	69.1	35%	0.353	35%	0.345	S	S	.	.			trans	-112.1	106.4	-176.1	-161.2	-12.3	0	0	0	112.3	E770 K774 K775 A776	E770-D772 PolarHBondContact O-N 3.37Å; D772-K774 PolarHBondContact O-N 2.86Å; D772-K774 PolarHBondContact OD1-N 3.4Å; D772-K775 HydrophobicContact CB-CB 4.4Å; D772-K775 HydrophobicContact CB-CD 4.47Å; D772-K775 HydrophobicContact CB-CG 4.45Å; D772-K775 PolarHBondContact O-N 3.46Å; D772-A776 PolarHBondContact O-N 2.85Å
773	V	63.3	Low	63.8	Low	46 Å²	46	69.4 Å²	69.4	28%	0.279	35%	0.347	S	S	.	.	H	α-helix	trans	-62.8	-30.3	-177.2	-176.3	0	0	0	0	111.6	M777 F795	V773-M777 HydrophobicContact CG1-CG 4.42Å; V773-M777 WeakPolarHBondContact O-CB 3.35Å; V773-M777 VanDerWaalsContact O-CG 3.26Å; V773-M777 WeakPolarHBondContact O-CG 3.05Å; V773-M777 PolarHBondContact O-N 3.46Å; V773-F795 HydrophobicContact CG1-CE1 4.49Å
774	K	64.1	Low	63.4	Low	159 Å²	159	76.4 Å²	76.4	69%	0.691	38%	0.382	S	S	*	.	H	α-helix	trans	-75	-38.4	-177.6	-66.6	-179.3	-177.7	177.6	0	112.6	D772 M777 N778	D772-K774 PolarHBondContact O-N 2.86Å; D772-K774 PolarHBondContact OD1-N 3.4Å; K774-M777 PolarHBondContact O-N 3.32Å; K774-N778 PolarHBondContact O-N 3.28Å
775	K	63.1	Low	62.9	Low	97 Å²	97	73.1 Å²	73.1	42%	0.422	37%	0.373	S	S	.	.	H	α-helix	trans	-67.7	-38.5	173.3	-73.8	-174	-177.8	-176.9	0	111.3	E770 D772 M777 N778 C779	E770-K775 IonicContact OE1-NZ 3.71Å; E770-K775 VanDerWaalsContact OE2-CD 3.23Å; E770-K775 WeakPolarHBondContact OE2-CD 3.36Å; E770-K775 IonicContact OE2-NZ 2.78Å; E770-K775 PolarHBondContact OE2-NZ 2.87Å; D772-K775 HydrophobicContact CB-CB 4.4Å; D772-K775 HydrophobicContact CB-CD 4.47Å; D772-K775 HydrophobicContact CB-CG 4.45Å; D772-K775 PolarHBondContact O-N 3.46Å; K775-M777 VanDerWaalsContact C-N 3.35Å; K775-N778 PolarHBondContact O-N 3.42Å; K775-C779 PolarHBondContact O-N 2.84Å; K775-C779 PolarHBondContact O-SG 2.64Å
776	A	61.6	Low	62.6	Low	9 Å²	9	71.5 Å²	71.5	7%	0.074	37%	0.366	C	S	.	.	H	α-helix	trans	-63.2	-39.2	172.9	0	0	0	0	0	112.2	V767 D772 C779 L780	V767-A776 HydrophobicContact CG2-CB 4.14Å; D772-A776 PolarHBondContact O-N 2.85Å; A776-C779 WeakPolarHBondContact O-CB 3.35Å; A776-C779 PolarHBondContact O-N 3.3Å; A776-L780 PolarHBondContact O-N 3.02Å
777	M	61.7	Low	62.3	Low	35 Å²	35	76.8 Å²	76.8	17%	0.172	39%	0.389	C	S	.	.	H	α-helix	trans	-67.1	-39.4	173.2	-72.9	-59.8	-75.2	0	0	112.6	V773 K774 K775 C779 L780 S781 F804	V773-M777 HydrophobicContact CG1-CG 4.42Å; V773-M777 WeakPolarHBondContact O-CB 3.35Å; V773-M777 VanDerWaalsContact O-CG 3.26Å; V773-M777 WeakPolarHBondContact O-CG 3.05Å; V773-M777 PolarHBondContact O-N 3.46Å; K774-M777 PolarHBondContact O-N 3.32Å; K775-M777 VanDerWaalsContact C-N 3.35Å; M777-C779 VanDerWaalsContact C-N 3.29Å; M777-C779 PolarHBondContact O-N 3.15Å; M777-L780 WeakPolarHBondContact O-CB 3.5Å; M777-L780 PolarHBondContact O-N 3.07Å; M777-L780 HydrophobicContact SD-CD1 3.7Å; M777-S781 PolarHBondContact O-N 3.17Å; M777-S781 PolarHBondContact O-OG 3.38Å; M777-F804 HydrophobicContact CE-CD1 4.39Å; M777-F804 HydrophobicContact SD-CD1 4.44Å; M777-F804 HydrophobicContact SD-CE1 4.06Å
778	N	64.1	Low	62.2	Low	108 Å²	108	77.4 Å²	77.4	58%	0.578	39%	0.391	S	S	*	.	H	α-helix	trans	-63	-36	171.6	-77.9	-8.9	0	0	0	112	K774 K775 L780 S781 S782	K774-N778 PolarHBondContact O-N 3.28Å; K775-N778 PolarHBondContact O-N 3.42Å; N778-L780 VanDerWaalsContact C-N 3.34Å; N778-S781 PolarHBondContact O-N 3.19Å; N778-S782 PolarHBondContact O-N 3.23Å; N778-S782 VanDerWaalsContact O-N 3.11Å; N778-S782 PolarHBondContact O-OG 2.96Å
779	C	61.8	Low	62.1	Low	9 Å²	9	78 Å²	78	6%	0.061	39%	0.394	C	S	.	.	H	α-helix	trans	-65.4	-36.6	173.8	-65	0	0	0	0	112.1	K742 W759 K775 A776 M777 S782	K742-C779 WeakPolarHBondContact CE-SG 3.41Å; W759-C779 HydrophobicContact CZ3-CB 4.03Å; K775-C779 PolarHBondContact O-N 2.84Å; K775-C779 PolarHBondContact O-SG 2.64Å; A776-C779 WeakPolarHBondContact O-CB 3.35Å; A776-C779 PolarHBondContact O-N 3.3Å; M777-C779 VanDerWaalsContact C-N 3.29Å; M777-C779 PolarHBondContact O-N 3.15Å; C779-S782 PolarHBondContact O-N 3.48Å
780	L	62.1	Low	62.4	Low	20 Å²	20	73.7 Å²	73.7	11%	0.105	38%	0.375	C	S	.	.	H	α-helix	trans	-66.3	-44.6	172.7	-85.9	167.8	0	0	0	112.1	A776 M777 N778 S782 C783 L786 I791	A776-L780 PolarHBondContact O-N 3.02Å; M777-L780 WeakPolarHBondContact O-CB 3.5Å; M777-L780 PolarHBondContact O-N 3.07Å; M777-L780 HydrophobicContact SD-CD1 3.7Å; N778-L780 VanDerWaalsContact C-N 3.34Å; L780-S782 PolarHBondContact O-N 2.78Å; L780-C783 PolarHBondContact O-N 3.35Å; L780-C783 VanDerWaalsContact O-O 3.09Å; L780-L786 HydrophobicContact CD2-CB 4.06Å; L780-I791 HydrophobicContact CD1-CD1 4Å; L780-I791 HydrophobicContact CD2-CD1 3.26Å; L780-I791 HydrophobicContact CD2-CG1 4.02Å; L780-I791 HydrophobicContact CG-CD1 3.63Å
781	S	60.2	Low	62.8	Low	90 Å²	90	70.3 Å²	70.3	63%	0.629	36%	0.36	S	S	*	.	H	α-helix	trans	-62.7	-24	176	-50.4	0	0	0	0	113	M777 N778 C783	M777-S781 PolarHBondContact O-N 3.17Å; M777-S781 PolarHBondContact O-OG 3.38Å; N778-S781 PolarHBondContact O-N 3.19Å; S781-C783 VanDerWaalsContact C-N 3.3Å
782	S	57.3	Low	63.1	Low	70 Å²	70	66 Å²	66	49%	0.49	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-4.9	175.1	-56.7	0	0	0	0	113.6	N778 C779 L780	N778-S782 PolarHBondContact O-N 3.23Å; N778-S782 VanDerWaalsContact O-N 3.11Å; N778-S782 PolarHBondContact O-OG 2.96Å; C779-S782 PolarHBondContact O-N 3.48Å; L780-S782 PolarHBondContact O-N 2.78Å
783	C	58.6	Low	63.4	Low	6 Å²	6	67.7 Å²	67.7	4%	0.041	36%	0.359	C	S	.	.			trans	-129.4	114.3	-175	-83.8	0	0	0	0	113.2	W759 L780 S781 L785 L786	W759-C783 VanDerWaalsContact CE3-SG 3.53Å; W759-C783 WeakPolarHBondContact CZ2-SG 3.42Å; L780-C783 PolarHBondContact O-N 3.35Å; L780-C783 VanDerWaalsContact O-O 3.09Å; S781-C783 VanDerWaalsContact C-N 3.3Å; C783-L785 VanDerWaalsContact C-N 3.27Å; C783-L785 PolarHBondContact O-N 3.45Å; C783-L786 HydrophobicContact CB-CB 4.48Å; C783-L786 HydrophobicContact CB-CD1 4.47Å
784	N	60	Low	63.4	Low	161 Å²	161	70.1 Å²	70.1	86%	0.861	37%	0.366	S	S	*	.	S	Bend	trans	-75.6	-15.4	173.8	-63.8	-6.2	0	0	0	113.2
785	L	60.9	Low	63.5	Low	49 Å²	49	63.8 Å²	63.8	26%	0.257	34%	0.339	S	S	.	.	S	Bend	trans	-89	-22.7	-172.6	-66.8	168	0	0	0	114	E752 R755 C783	E752-L785 HydrophobicContact CB-CD2 4.42Å; E752-L785 HydrophobicContact CG-CD2 3.98Å; R755-L785 HydrophobicContact CB-CD1 4.24Å; R755-L785 VanDerWaalsContact CD-CD1 3.48Å; R755-L785 HydrophobicContact CG-CD1 3.8Å; C783-L785 VanDerWaalsContact C-N 3.27Å; C783-L785 PolarHBondContact O-N 3.45Å
786	L	64.1	Low	63.5	Low	14 Å²	14	63.7 Å²	63.7	7%	0.073	35%	0.348	C	S	.	.			trans	-93.5	116	179.7	-79.8	167.1	0	0	0	109.4	K756 W759 L760 L780 C783 D790 I791	K756-L786 HydrophobicContact CG-CD2 3.98Å; W759-L786 HydrophobicContact CB-CD1 3.59Å; W759-L786 HydrophobicContact CG-CD1 4.41Å; L760-L786 HydrophobicContact CD2-CD2 3.97Å; L760-L786 HydrophobicContact CG-CD2 4.03Å; L780-L786 HydrophobicContact CD2-CB 4.06Å; C783-L786 HydrophobicContact CB-CB 4.48Å; C783-L786 HydrophobicContact CB-CD1 4.47Å; L786-D790 HydrophobicContact CD2-CB 4.21Å; L786-I791 HydrophobicContact CD1-CD1 4.28Å
787	K	64.5	Low	63.3	Low	114 Å²	114	71.7 Å²	71.7	50%	0.496	39%	0.39	S	S	.	.			trans	-78.8	150	170.3	-64	-173.2	-178.7	-177.3	0	108.9	E789 D790	K787-E789 HydrophobicContact CB-CB 4.36Å; K787-E789 PolarHBondContact O-N 3.01Å; K787-D790 PolarHBondContact N-OD2 3.03Å; K787-D790 PolarHBondContact O-N 2.95Å
788	I	64.4	Low	63.1	Low	39 Å²	39	79.8 Å²	79.8	20%	0.2	42%	0.424	C	S	.	.	H	α-helix	trans	-51.8	-32.3	174.3	-61.8	168.6	0	0	0	110.8	D790 I791 L792 F804 A807 I808	I788-D790 VanDerWaalsContact C-N 3.28Å; I788-D790 PolarHBondContact O-N 3.25Å; I788-I791 PolarHBondContact O-N 3.34Å; I788-L792 HydrophobicContact CG2-CD1 4.17Å; I788-L792 HydrophobicContact CG2-CG 4.38Å; I788-L792 WeakPolarHBondContact O-CG 3.37Å; I788-L792 PolarHBondContact O-N 3.3Å; I788-F804 HydrophobicContact CG2-CD1 4.03Å; I788-F804 HydrophobicContact CG2-CE1 4.38Å; I788-A807 HydrophobicContact CD1-CB 3.62Å; I788-I808 HydrophobicContact CD1-CG1 4.27Å
789	E	67.3	Low	62.9	Low	147 Å²	147	76.8 Å²	76.8	69%	0.687	41%	0.41	S	S	*	.	H	α-helix	trans	-55.9	-35.5	176.1	-62	176.6	-172.3	0	0	114.1	K787	K787-E789 HydrophobicContact CB-CB 4.36Å; K787-E789 PolarHBondContact O-N 3.01Å
790	D	67.5	Low	62.8	Low	48 Å²	48	80.2 Å²	80.2	26%	0.257	43%	0.43	S	S	.	.	H	α-helix	trans	-78	-22.5	-173.4	-66.5	-56.6	0	0	0	113.1	K756 L786 K787 I788 F794	K756-D790 VanDerWaalsContact CE-CG 3.5Å; K756-D790 WeakPolarHBondContact CE-OD2 3.38Å; K756-D790 IonicContact NZ-OD1 2.93Å; K756-D790 PolarHBondContact NZ-OD1 3.3Å; K756-D790 IonicContact NZ-OD2 3.33Å; K756-D790 PolarHBondContact NZ-OD2 2.67Å; L786-D790 HydrophobicContact CD2-CB 4.21Å; K787-D790 PolarHBondContact N-OD2 3.03Å; K787-D790 PolarHBondContact O-N 2.95Å; I788-D790 VanDerWaalsContact C-N 3.28Å; I788-D790 PolarHBondContact O-N 3.25Å; D790-F794 WeakPolarHBondContact O-CE2 3.33Å
791	I	68.2	Low	62.9	Low	9 Å²	9	85.9 Å²	85.9	5%	0.046	46%	0.46	C	S	.	.	H	α-helix	trans	-100.7	-23.5	-176.2	-48	-160.4	0	0	0	112.2	A763 L780 L786 I788 P793 F794 F795	A763-I791 HydrophobicContact CB-CD1 4.3Å; L780-I791 HydrophobicContact CD1-CD1 4Å; L780-I791 HydrophobicContact CD2-CD1 3.26Å; L780-I791 HydrophobicContact CD2-CG1 4.02Å; L780-I791 HydrophobicContact CG-CD1 3.63Å; L786-I791 HydrophobicContact CD1-CD1 4.28Å; I788-I791 PolarHBondContact O-N 3.34Å; I791-P793 VanDerWaalsContact C-N 3.31Å; I791-P793 VanDerWaalsContact O-N 3.16Å; I791-F794 PolarHBondContact O-N 3.31Å; I791-F795 HydrophobicContact CB-CE2 4.22Å; I791-F795 HydrophobicContact CG2-CD2 4.24Å; I791-F795 HydrophobicContact CG2-CE2 3.44Å; I791-F795 VanDerWaalsContact CG2-CE2 3.44Å; I791-F795 HydrophobicContact CG2-CZ 3.99Å; I791-F795 WeakPolarHBondContact O-CD2 3.44Å
792	L	66.8	Low	63.1	Low	91 Å²	91	88.2 Å²	88.2	48%	0.476	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-47.7	-40.8	177.8	-86.3	164.9	0	0	0	115	I788 F794 F795	I788-L792 HydrophobicContact CG2-CD1 4.17Å; I788-L792 HydrophobicContact CG2-CG 4.38Å; I788-L792 WeakPolarHBondContact O-CG 3.37Å; I788-L792 PolarHBondContact O-N 3.3Å; L792-F794 PolarHBondContact O-N 3.31Å; L792-F795 PolarHBondContact O-N 3.3Å
793	P	69.6	Low	63.4	Low	100 Å²	100	90.1 Å²	90.1	65%	0.649	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-66.6	-17	-179.6	-22	33.9	0	0	0	115.4	I791	I791-P793 VanDerWaalsContact C-N 3.31Å; I791-P793 VanDerWaalsContact O-N 3.16Å
794	F	63.5	Low	63.7	Low	97 Å²	97	90.7 Å²	90.7	43%	0.425	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-95.6	-5.8	-175.3	-58.2	-70.3	0	0	0	113.3	L760 D790 I791 L792	L760-F794 HydrophobicContact CD2-CE2 4.26Å; D790-F794 WeakPolarHBondContact O-CE2 3.33Å; I791-F794 PolarHBondContact O-N 3.31Å; L792-F794 PolarHBondContact O-N 3.31Å
795	F	65.4	Low	64.2	Low	26 Å²	26	90.1 Å²	90.1	11%	0.114	46%	0.457	C	S	.	.	S	Bend	trans	-87	143.9	173.6	-69.8	-77	0	0	0	111	V767 V773 I791 L792 V799	V767-F795 HydrophobicContact CG2-CE1 4.35Å; V773-F795 HydrophobicContact CG1-CE1 4.49Å; I791-F795 HydrophobicContact CB-CE2 4.22Å; I791-F795 HydrophobicContact CG2-CD2 4.24Å; I791-F795 HydrophobicContact CG2-CE2 3.44Å; I791-F795 VanDerWaalsContact CG2-CE2 3.44Å; I791-F795 HydrophobicContact CG2-CZ 3.99Å; I791-F795 WeakPolarHBondContact O-CD2 3.44Å; L792-F795 PolarHBondContact O-N 3.3Å; F795-V799 HydrophobicContact CB-CG2 4.13Å; F795-V799 HydrophobicContact CD1-CG2 4.32Å
796	P	64.8	Low	64.6	Low	95 Å²	95	96 Å²	96	62%	0.617	48%	0.484	S	S	*	.			trans	-63.8	147.2	170.3	26.1	-31.9	0	0	0	110.5	F798	P796-F798 PolarHBondContact O-N 3.07Å
797	D	56.9	Low	64.6	Low	177 Å²	177	96.7 Å²	96.7	95%	0.947	49%	0.491	S	S	*	.	S	Bend	trans	-55	-3.2	-172.5	-63.8	-28.7	0	0	0	116.6
798	F	56.2	Low	64.9	Low	205 Å²	205	95.5 Å²	95.5	90%	0.899	49%	0.49	S	S	*	.			trans	-117.8	47.8	-173.3	-139.4	-90.5	0	0	0	112.9	P796	P796-F798 PolarHBondContact O-N 3.07Å
799	V	61.8	Low	65.4	Low	45 Å²	45	97 Å²	97	27%	0.273	50%	0.502	S	S	.	.			trans	-104.9	130	170.9	-178.2	0	0	0	0	110	F795 F804	F795-V799 HydrophobicContact CB-CG2 4.13Å; F795-V799 HydrophobicContact CD1-CG2 4.32Å; V799-F804 HydrophobicContact CG1-CE2 4.01Å; V799-F804 HydrophobicContact CG1-CZ 4.48Å
800	T	59.2	Low	65.6	Low	81 Å²	81	93.1 Å²	93.1	50%	0.497	49%	0.492	S	S	.	.			trans	-73.2	128	-177.4	43.1	0	0	0	0	112.5	D802 H803	T800-D802 PolarHBondContact O-N 3.02Å; T800-D802 VanDerWaalsContact O-N 3.08Å; T800-H803 PolarHBondContact O-N 3.18Å; T800-H803 PolarHBondContact OG1-CD2 3.34Å; T800-H803 PolarHBondContact OG1-NE2 3.4Å
801	I	63.5	Low	65.8	Low	140 Å²	140	93.3 Å²	93.3	72%	0.718	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-58.3	-21.5	-177.9	-65.6	171	0	0	0	113.5	H803 F804	I801-H803 PolarHBondContact O-N 3.18Å; I801-H803 VanDerWaalsContact O-N 3.08Å; I801-F804 PolarHBondContact O-N 3.22Å
802	D	64.4	Low	66.2	Low	139 Å²	139	98.4 Å²	98.4	74%	0.743	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-58.2	-24.7	179.5	-75.6	-27.5	0	0	0	113.6	T800 F804	T800-D802 PolarHBondContact O-N 3.02Å; T800-D802 VanDerWaalsContact O-N 3.08Å; D802-F804 VanDerWaalsContact C-N 3.28Å; D802-F804 PolarHBondContact O-N 3.24Å
803	H	64.6	Low	66.7	Low	109 Å²	109	100.8 Å²	100.8	51%	0.505	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-75.3	-10.9	177.2	-62.7	-49	0	0	0	114.4	T800 I801	T800-H803 PolarHBondContact O-N 3.18Å; T800-H803 PolarHBondContact OG1-CD2 3.34Å; T800-H803 PolarHBondContact OG1-NE2 3.4Å; I801-H803 PolarHBondContact O-N 3.18Å; I801-H803 VanDerWaalsContact O-N 3.08Å
804	F	63.3	Low	66.9	Low	18 Å²	18	102.9 Å²	102.9	8%	0.079	53%	0.533	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-7.7	-173.7	-62.5	-78.3	0	0	0	114.8	M777 I788 V799 I801 D802 E806 A807 I808	M777-F804 HydrophobicContact CE-CD1 4.39Å; M777-F804 HydrophobicContact SD-CD1 4.44Å; M777-F804 HydrophobicContact SD-CE1 4.06Å; I788-F804 HydrophobicContact CG2-CD1 4.03Å; I788-F804 HydrophobicContact CG2-CE1 4.38Å; V799-F804 HydrophobicContact CG1-CE2 4.01Å; V799-F804 HydrophobicContact CG1-CZ 4.48Å; I801-F804 PolarHBondContact O-N 3.22Å; D802-F804 VanDerWaalsContact C-N 3.28Å; D802-F804 PolarHBondContact O-N 3.24Å; F804-E806 PolarHBondContact O-N 2.91Å; F804-A807 PolarHBondContact O-N 3.45Å; F804-I808 HydrophobicContact CB-CD1 4.48Å; F804-I808 WeakPolarHBondContact O-CG1 3.5Å; F804-I808 PolarHBondContact O-N 3.25Å
805	K	71.7	Confident	67.5	Low	149 Å²	149	105.4 Å²	105.4	65%	0.648	54%	0.541	S	S	*	.	H	α-helix	trans	-60.4	-43.8	-171.9	-175	-179	177.3	-175.3	0	113.8	C809	K805-C809 PolarHBondContact O-N 3.49Å
806	E	69.2	Low	68.3	Low	173 Å²	173	109.6 Å²	109.6	81%	0.808	57%	0.565	S	S	*	*	H	α-helix	trans	-69.4	-40.5	-175.4	-70.7	-179	169.7	0	0	112.3	F804 I808 C809 S810	F804-E806 PolarHBondContact O-N 2.91Å; E806-I808 VanDerWaalsContact C-N 3.29Å; E806-I808 PolarHBondContact O-N 3.01Å; E806-C809 PolarHBondContact O-N 2.82Å; E806-S810 PolarHBondContact O-N 3.41Å
807	A	63.8	Low	69	Low	28 Å²	28	112.2 Å²	112.2	23%	0.231	57%	0.566	C	S	.	*	H	α-helix	trans	-69.3	-26.3	-178.6	0	0	0	0	0	113.2	I788 F804 S810 S811	I788-A807 HydrophobicContact CD1-CB 3.62Å; F804-A807 PolarHBondContact O-N 3.45Å; A807-S810 PolarHBondContact O-OG 3.2Å; A807-S810 VanDerWaalsContact O-OG 3.09Å; A807-S811 PolarHBondContact O-OG 3.18Å
808	I	70.6	Confident	70	Confident	90 Å²	90	109.5 Å²	109.5	46%	0.462	55%	0.548	S	S	.	.	H	α-helix	trans	-72.8	-39.8	174.4	-65	168.8	0	0	0	110.8	I788 F804 E806	I788-I808 HydrophobicContact CD1-CG1 4.27Å; F804-I808 HydrophobicContact CB-CD1 4.48Å; F804-I808 WeakPolarHBondContact O-CG1 3.5Å; F804-I808 PolarHBondContact O-N 3.25Å; E806-I808 VanDerWaalsContact C-N 3.29Å; E806-I808 PolarHBondContact O-N 3.01Å
809	C	74.8	Confident	71.1	Confident	69 Å²	69	105.4 Å²	105.4	47%	0.466	53%	0.534	S	S	.	.	H	α-helix	trans	-67.8	-41.5	-179.4	-70.5	0	0	0	0	112.6	K805 E806 S811 L812	K805-C809 PolarHBondContact O-N 3.49Å; E806-C809 PolarHBondContact O-N 2.82Å; C809-S811 VanDerWaalsContact C-N 3.34Å; C809-S811 PolarHBondContact O-N 2.99Å; C809-L812 PolarHBondContact O-N 2.92Å
810	S	71.2	Confident	72.2	Confident	66 Å²	66	110.1 Å²	110.1	46%	0.462	55%	0.553	S	S	.	*	H	α-helix	trans	-63.3	-40.2	179.4	57.3	0	0	0	0	112.5	E806 A807 L812 E813 E814	E806-S810 PolarHBondContact O-N 3.41Å; A807-S810 PolarHBondContact O-OG 3.2Å; A807-S810 VanDerWaalsContact O-OG 3.09Å; S810-L812 PolarHBondContact O-N 3.37Å; S810-E813 PolarHBondContact O-N 3.25Å; S810-E814 PolarHBondContact O-N 3.49Å
811	S	72.2	Confident	73.1	Confident	53 Å²	53	111.8 Å²	111.8	37%	0.371	56%	0.555	S	S	.	*	H	α-helix	trans	-62.1	-31.9	179.4	-58.8	0	0	0	0	112.4	A807 C809 Y815	A807-S811 PolarHBondContact O-OG 3.18Å; C809-S811 VanDerWaalsContact C-N 3.34Å; C809-S811 PolarHBondContact O-N 2.99Å; S811-Y815 WeakPolarHBondContact O-CD2 3.35Å
812	L	76.3	Confident	74	Confident	115 Å²	115	110.3 Å²	110.3	60%	0.602	55%	0.548	S	S	*	.	H	α-helix	trans	-74.5	-30.8	179.2	-83.5	160.3	0	0	0	113.4	C809 S810	C809-L812 PolarHBondContact O-N 2.92Å; S810-L812 PolarHBondContact O-N 3.37Å
813	E	77.5	Confident	75.1	Confident	142 Å²	142	111.4 Å²	111.4	66%	0.664	55%	0.546	S	S	*	.	H	α-helix	trans	-74.4	-34.1	-179.9	-71.5	-179.6	171.9	0	0	112.4	S810 Y815 N816	S810-E813 PolarHBondContact O-N 3.25Å; E813-Y815 PolarHBondContact O-N 2.9Å; E813-N816 PolarHBondContact O-N 3.18Å
814	E	74.9	Confident	76	Confident	144 Å²	144	112.1 Å²	112.1	67%	0.673	55%	0.55	S	S	*	*	H	α-helix	trans	-65.9	-38.9	-178.5	-156.8	165.9	-149.8	0	0	112.2	S810 N816 K817 H818	S810-E814 PolarHBondContact O-N 3.49Å; E814-N816 VanDerWaalsContact C-N 3.25Å; E814-N816 PolarHBondContact O-N 3.42Å; E814-K817 PolarHBondContact O-N 3.3Å; E814-H818 PolarHBondContact O-N 2.9Å
815	Y	74.9	Confident	76.9	Confident	149 Å²	149	117.8 Å²	117.8	58%	0.584	58%	0.577	S	S	*	*	H	α-helix	trans	-60.2	-31.8	175.2	-77.2	-69.1	0	0	0	113.4	S811 E813	S811-Y815 WeakPolarHBondContact O-CD2 3.35Å; E813-Y815 PolarHBondContact O-N 2.9Å
816	N	82.7	Confident	77.2	Confident	114 Å²	114	117.8 Å²	117.8	61%	0.61	58%	0.581	S	S	*	*	H	α-helix	trans	-74.5	-39.1	-178.9	-80	-36.8	0	0	0	112.6	E813 E814 H818 I819	E813-N816 PolarHBondContact O-N 3.18Å; E814-N816 VanDerWaalsContact C-N 3.25Å; E814-N816 PolarHBondContact O-N 3.42Å; N816-H818 VanDerWaalsContact C-N 3.34Å; N816-H818 PolarHBondContact O-N 3.28Å; N816-I819 PolarHBondContact O-N 3.49Å
817	K	79.6	Confident	78.1	Confident	150 Å²	150	116.7 Å²	116.7	65%	0.652	58%	0.576	S	S	*	*	H	α-helix	trans	-64.6	-38.7	179.6	-86.1	-176.1	174	178.3	0	112.8	E814 I819 E820	E814-K817 PolarHBondContact O-N 3.3Å; K817-I819 PolarHBondContact O-N 3.5Å; K817-I819 VanDerWaalsContact O-N 3.15Å; K817-E820 PolarHBondContact O-N 3.29Å
818	H	77.8	Confident	79	Confident	121 Å²	121	121.7 Å²	121.7	56%	0.56	59%	0.594	S	S	*	*	H	α-helix	trans	-63.9	-25.9	-174.5	-144.4	7.3	0	0	0	112.7	E814 N816 E820 E821	E814-H818 PolarHBondContact O-N 2.9Å; N816-H818 VanDerWaalsContact C-N 3.34Å; N816-H818 PolarHBondContact O-N 3.28Å; H818-E820 VanDerWaalsContact C-N 3.34Å; H818-E821 IonicContact ND1-OE2 2.82Å
819	I	78.8	Confident	79.4	Confident	119 Å²	119	120.5 Å²	120.5	61%	0.61	60%	0.598	S	S	*	*	H	α-helix	trans	-70.6	-29.5	176.9	-64.4	171.7	0	0	0	111.9	N816 K817	N816-I819 PolarHBondContact O-N 3.49Å; K817-I819 PolarHBondContact O-N 3.5Å; K817-I819 VanDerWaalsContact O-N 3.15Å
820	E	84.5	Confident	79.9	Confident	144 Å²	144	121.5 Å²	121.5	67%	0.673	60%	0.602	S	S	*	*	H	α-helix	trans	-79.4	-38.5	-178.2	-83.2	169.1	157.2	0	0	112.9	K817 H818 K823	K817-E820 PolarHBondContact O-N 3.29Å; H818-E820 VanDerWaalsContact C-N 3.34Å; E820-K823 WeakPolarHBondContact O-CB 3.42Å; E820-K823 PolarHBondContact O-N 3.44Å
821	E	79.8	Confident	80.7	Confident	115 Å²	115	123.6 Å²	123.6	54%	0.537	61%	0.605	S	S	.	*	H	α-helix	trans	-62.7	-44.6	179.1	-72.1	174	165.2	0	0	112.3	H818 K823 Q824 E825	H818-E821 IonicContact ND1-OE2 2.82Å; E821-K823 PolarHBondContact O-N 3.22Å; E821-K823 VanDerWaalsContact O-N 3.09Å; E821-Q824 PolarHBondContact O-N 3.39Å; E821-E825 PolarHBondContact O-N 3.44Å
822	L	82	Confident	81	Confident	109 Å²	109	124.1 Å²	124.1	57%	0.571	61%	0.608	S	S	*	*	H	α-helix	trans	-56.9	-28.4	177.5	-98.1	154.2	0	0	0	113.3
823	K	86.3	Confident	81.2	Confident	163 Å²	163	120.5 Å²	120.5	71%	0.709	60%	0.595	S	S	*	*	H	α-helix	trans	-74.5	-33.8	179	-166.6	180	176.4	-172.6	0	112.1	E820 E821	E820-K823 WeakPolarHBondContact O-CB 3.42Å; E820-K823 PolarHBondContact O-N 3.44Å; E821-K823 PolarHBondContact O-N 3.22Å; E821-K823 VanDerWaalsContact O-N 3.09Å
824	Q	84.9	Confident	81.6	Confident	124 Å²	124	119.9 Å²	119.9	58%	0.579	59%	0.59	S	S	*	*	H	α-helix	trans	-74.2	-40.4	-177.5	-171	172.9	-11.2	0	0	111.8	E821 M826 E827	E821-Q824 PolarHBondContact O-N 3.39Å; Q824-M826 PolarHBondContact O-N 3.04Å; Q824-E827 PolarHBondContact O-N 2.94Å; Q824-E827 VanDerWaalsContact O-N 3.09Å
825	E	81.8	Confident	81.9	Confident	137 Å²	137	120.4 Å²	120.4	64%	0.64	59%	0.586	S	S	*	*	H	α-helix	trans	-59.9	-34.1	178.3	-69.1	-173.6	165.1	0	0	113	E821 E827	E821-E825 PolarHBondContact O-N 3.44Å; E825-E827 VanDerWaalsContact C-N 3.27Å; E825-E827 PolarHBondContact O-N 3.45Å
826	M	78.6	Confident	81.9	Confident	148 Å²	148	118.3 Å²	118.3	73%	0.729	58%	0.583	S	S	*	*	H	α-helix	trans	-63.4	-30.3	177.2	-101.5	-175.1	62.3	0	0	113.5	Q824 T830	Q824-M826 PolarHBondContact O-N 3.04Å; M826-T830 PolarHBondContact O-OG1 3.27Å
827	E	87.3	Confident	81.8	Confident	150 Å²	150	120.3 Å²	120.3	70%	0.701	58%	0.582	S	S	*	*	H	α-helix	trans	-77.5	-42.8	-175.3	-121.7	160.2	-167.5	0	0	111.6	Q824 E825 T830	Q824-E827 PolarHBondContact O-N 2.94Å; Q824-E827 VanDerWaalsContact O-N 3.09Å; E825-E827 VanDerWaalsContact C-N 3.27Å; E825-E827 PolarHBondContact O-N 3.45Å; E827-T830 WeakPolarHBondContact O-CB 3.49Å; E827-T830 PolarHBondContact O-N 3.41Å
828	E	83.3	Confident	81.9	Confident	134 Å²	134	119.2 Å²	119.2	63%	0.626	58%	0.58	S	S	*	*	H	α-helix	trans	-65.9	-41.1	-178.7	-69.1	-173.8	173.1	0	0	113.1	T830 E831 S832	E828-T830 PolarHBondContact O-N 3.46Å; E828-T830 VanDerWaalsContact O-N 3.16Å; E828-E831 PolarHBondContact O-N 3.01Å; E828-S832 PolarHBondContact O-N 3.36Å
829	A	78.3	Confident	81.9	Confident	65 Å²	65	118.6 Å²	118.6	54%	0.537	58%	0.581	S	S	.	*	H	α-helix	trans	-61	-26.3	177.6	0	0	0	0	0	112.6	S832	A829-S832 PolarHBondContact O-OG 2.86Å; A829-S832 VanDerWaalsContact O-OG 3.08Å
830	T	85.8	Confident	81.7	Confident	90 Å²	90	117.6 Å²	117.6	55%	0.552	58%	0.575	S	S	*	*	H	α-helix	trans	-78.3	-30.3	-178.2	-51.5	0	0	0	0	112.3	M826 E827 E828	M826-T830 PolarHBondContact O-OG1 3.27Å; E827-T830 WeakPolarHBondContact O-CB 3.49Å; E827-T830 PolarHBondContact O-N 3.41Å; E828-T830 PolarHBondContact O-N 3.46Å; E828-T830 VanDerWaalsContact O-N 3.16Å
831	E	86.9	Confident	81.2	Confident	110 Å²	110	117.3 Å²	117.3	51%	0.514	57%	0.574	S	S	.	*	H	α-helix	trans	-75.9	-41.2	-179.6	-163.5	-177.4	153.8	0	0	112.2	E828 A833 K834 R835	E828-E831 PolarHBondContact O-N 3.01Å; E831-A833 VanDerWaalsContact C-N 3.29Å; E831-A833 PolarHBondContact O-N 3.04Å; E831-K834 PolarHBondContact O-N 3.21Å; E831-K834 VanDerWaalsContact O-N 3.1Å; E831-R835 IonicContact OE1-CZ 3.61Å; E831-R835 IonicContact OE1-NH2 2.78Å; E831-R835 PolarHBondContact OE1-NH2 3.36Å
832	S	79.4	Confident	80.9	Confident	64 Å²	64	118.8 Å²	118.8	45%	0.448	58%	0.581	S	S	.	*	H	α-helix	trans	-60.5	-38.9	178.6	64.6	0	0	0	0	112.2	E828 A829 K834 R835	E828-S832 PolarHBondContact O-N 3.36Å; A829-S832 PolarHBondContact O-OG 2.86Å; A829-S832 VanDerWaalsContact O-OG 3.08Å; S832-K834 PolarHBondContact O-N 3.42Å; S832-R835 PolarHBondContact O-N 3.4Å
833	A	79.7	Confident	80.3	Confident	39 Å²	39	118.7 Å²	118.7	32%	0.322	58%	0.579	S	S	.	*	H	α-helix	trans	-66.5	-17	178.2	0	0	0	0	0	114.1	E831 R837	E831-A833 VanDerWaalsContact C-N 3.29Å; E831-A833 PolarHBondContact O-N 3.04Å; A833-R837 WeakPolarHBondContact O-CG 3.47Å; A833-R837 PolarHBondContact O-NE 3.27Å
834	K	86.6	Confident	79.4	Confident	128 Å²	128	121.1 Å²	121.1	56%	0.557	58%	0.583	S	S	*	*	H	α-helix	trans	-79.2	-47.1	174.1	-82	-179.6	177.6	173.4	0	111.9	E831 S832 I836 R837	E831-K834 PolarHBondContact O-N 3.21Å; E831-K834 VanDerWaalsContact O-N 3.1Å; S832-K834 PolarHBondContact O-N 3.42Å; K834-I836 VanDerWaalsContact C-N 3.31Å; K834-I836 PolarHBondContact O-N 3.34Å; K834-R837 WeakPolarHBondContact O-CB 3.32Å; K834-R837 PolarHBondContact O-N 2.88Å
835	R	80.6	Confident	78.6	Confident	155 Å²	155	121.6 Å²	121.6	59%	0.585	59%	0.59	S	S	*	*	H	α-helix	trans	-58.2	-42.9	-177.6	-64	-177.4	-169.8	163.8	6	112	E831 S832 R837 E838 D839	E831-R835 IonicContact OE1-CZ 3.61Å; E831-R835 IonicContact OE1-NH2 2.78Å; E831-R835 PolarHBondContact OE1-NH2 3.36Å; S832-R835 PolarHBondContact O-N 3.4Å; R835-R837 PolarHBondContact O-N 2.73Å; R835-E838 PolarHBondContact O-N 3.34Å; R835-E838 VanDerWaalsContact O-N 3.12Å; R835-D839 PolarHBondContact O-N 2.98Å
836	I	74.6	Confident	78	Confident	105 Å²	105	121.8 Å²	121.8	54%	0.538	59%	0.589	S	S	.	*	H	α-helix	trans	-60	-32.9	178.3	-63.2	172.2	0	0	0	112.2	K834 E838 I840	K834-I836 VanDerWaalsContact C-N 3.31Å; K834-I836 PolarHBondContact O-N 3.34Å; I836-E838 VanDerWaalsContact C-N 3.35Å; I836-I840 HydrophobicContact CG2-CD1 4.08Å; I836-I840 WeakPolarHBondContact O-CD1 3.45Å; I836-I840 WeakPolarHBondContact O-CG1 3.26Å; I836-I840 PolarHBondContact O-N 3.33Å
837	R	81.3	Confident	77.5	Confident	156 Å²	156	124.6 Å²	124.6	59%	0.589	59%	0.593	S	S	*	*	H	α-helix	trans	-71.4	-31.6	179.9	-67.4	179.4	-135.4	165.4	-0.4	112.6	A833 K834 R835 Q841	A833-R837 WeakPolarHBondContact O-CG 3.47Å; A833-R837 PolarHBondContact O-NE 3.27Å; K834-R837 WeakPolarHBondContact O-CB 3.32Å; K834-R837 PolarHBondContact O-N 2.88Å; R835-R837 PolarHBondContact O-N 2.73Å; R837-Q841 PolarHBondContact O-N 2.83Å
838	E	82.2	Confident	76.6	Confident	128 Å²	128	119.9 Å²	119.9	60%	0.598	58%	0.584	S	S	*	*	H	α-helix	trans	-68.1	-46	179	-66.7	173.7	172.2	0	0	110.4	R835 I836 I840 Q841 E842	R835-E838 PolarHBondContact O-N 3.34Å; R835-E838 VanDerWaalsContact O-N 3.12Å; I836-E838 VanDerWaalsContact C-N 3.35Å; E838-I840 VanDerWaalsContact C-N 3.34Å; E838-I840 PolarHBondContact O-N 2.94Å; E838-Q841 WeakPolarHBondContact O-CB 3.44Å; E838-Q841 PolarHBondContact O-N 2.98Å; E838-E842 PolarHBondContact O-N 3.03Å
839	D	76.4	Confident	76	Confident	108 Å²	108	118.9 Å²	118.9	58%	0.578	59%	0.587	S	S	*	*	H	α-helix	trans	-60.7	-39.9	178.2	-71	-12.8	0	0	0	112.9	R835 Q841 E842 M843	R835-D839 PolarHBondContact O-N 2.98Å; D839-Q841 PolarHBondContact O-N 2.89Å; D839-E842 PolarHBondContact O-N 3.19Å; D839-M843 WeakPolarHBondContact O-CG 3.45Å; D839-M843 PolarHBondContact O-N 2.92Å
840	I	74.8	Confident	75.7	Confident	98 Å²	98	117.8 Å²	117.8	50%	0.503	57%	0.573	S	S	.	*	H	α-helix	trans	-61.2	-32.7	176.4	-68.7	168.4	0	0	0	111	I836 E838	I836-I840 HydrophobicContact CG2-CD1 4.08Å; I836-I840 WeakPolarHBondContact O-CD1 3.45Å; I836-I840 WeakPolarHBondContact O-CG1 3.26Å; I836-I840 PolarHBondContact O-N 3.33Å; E838-I840 VanDerWaalsContact C-N 3.34Å; E838-I840 PolarHBondContact O-N 2.94Å
841	Q	75.3	Confident	75.1	Confident	137 Å²	137	118.8 Å²	118.8	64%	0.64	58%	0.576	S	S	*	*	H	α-helix	trans	-76.3	-35.3	-175.4	-143.8	164.4	5.7	0	0	112.2	R837 E838 D839	R837-Q841 PolarHBondContact O-N 2.83Å; E838-Q841 WeakPolarHBondContact O-CB 3.44Å; E838-Q841 PolarHBondContact O-N 2.98Å; D839-Q841 PolarHBondContact O-N 2.89Å
842	E	73.9	Confident	74.1	Confident	147 Å²	147	118.2 Å²	118.2	69%	0.687	58%	0.584	S	S	*	*	H	α-helix	trans	-68.5	-38.6	173.9	-71.4	-165.7	162	0	0	112.7	E838 D839 R844 N845	E838-E842 PolarHBondContact O-N 3.03Å; D839-E842 PolarHBondContact O-N 3.19Å; E842-R844 VanDerWaalsContact C-N 3.27Å; E842-R844 PolarHBondContact O-N 3.01Å; E842-N845 PolarHBondContact O-N 3.31Å
843	M	67.6	Low	73.5	Confident	106 Å²	106	123.7 Å²	123.7	52%	0.522	60%	0.602	S	S	.	*	H	α-helix	trans	-66.5	-26.4	-178.3	-71.9	-66.4	-71.8	0	0	113.4	D839 N845 L872	D839-M843 WeakPolarHBondContact O-CG 3.45Å; D839-M843 PolarHBondContact O-N 2.92Å; M843-N845 VanDerWaalsContact C-N 3.26Å; M843-N845 PolarHBondContact O-N 3.09Å; M843-L872 HydrophobicContact CE-CD1 4.19Å
844	R	67.8	Low	73.2	Confident	214 Å²	214	124.9 Å²	124.9	81%	0.808	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-18.2	177.7	-88.3	-175.5	172.3	178.1	-1	114.8	E842	E842-R844 VanDerWaalsContact C-N 3.27Å; E842-R844 PolarHBondContact O-N 3.01Å
845	N	69.5	Low	72.9	Confident	135 Å²	135	124.6 Å²	124.6	72%	0.722	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	7.8	-170.5	-68.3	-25.1	0	0	0	115.1	E842 M843	E842-N845 PolarHBondContact O-N 3.31Å; M843-N845 VanDerWaalsContact C-N 3.26Å; M843-N845 PolarHBondContact O-N 3.09Å
846	K	68.4	Low	72.9	Confident	141 Å²	141	117.2 Å²	117.2	61%	0.613	57%	0.572	S	S	*	*			trans	-94.8	131.4	178.8	-65.6	179.3	-177.9	170.7	0	111.4
847	Y	68.9	Low	72.8	Confident	207 Å²	207	114.1 Å²	114.1	81%	0.812	56%	0.562	S	S	*	*			trans	-126.2	155.2	174.1	66	-88.7	0	0	0	111	V849	Y847-V849 HydrophobicContact CD2-CG2 4.38Å; Y847-V849 HydrophobicContact CE2-CG2 4.23Å
848	G	67.1	Low	72.5	Confident	50 Å²	50	108.5 Å²	108.5	52%	0.515	55%	0.549	S	S	.	.			trans	-122.6	145.7	175.5	0	0	0	0	0	111.9
849	V	72	Confident	72	Confident	113 Å²	113	104.1 Å²	104.1	69%	0.685	53%	0.532	S	S	*	.			trans	-106.4	134.4	-180	-178.4	0	0	0	0	108.6	Y847	Y847-V849 HydrophobicContact CD2-CG2 4.38Å; Y847-V849 HydrophobicContact CE2-CG2 4.23Å
850	V	71.9	Confident	71.8	Confident	42 Å²	42	104.5 Å²	104.5	26%	0.255	53%	0.534	S	S	.	.			trans	-118.3	124.8	-178.8	177.2	0	0	0	0	109.4	E854 F868 L870 M876	V850-E854 VanDerWaalsContact CA-OE2 3.24Å; V850-E854 WeakPolarHBondContact CA-OE2 3.47Å; V850-E854 VanDerWaalsContact CG1-OE2 3.25Å; V850-E854 WeakPolarHBondContact CG1-OE2 3.38Å; V850-F868 HydrophobicContact CB-CZ 4.5Å; V850-F868 HydrophobicContact CG1-CE2 4.3Å; V850-F868 HydrophobicContact CG1-CZ 4.14Å; V850-F868 HydrophobicContact CG2-CE2 4.03Å; V850-F868 HydrophobicContact CG2-CZ 4.32Å; V850-L870 HydrophobicContact CG2-CD1 4.43Å; V850-L870 HydrophobicContact CG2-CD2 3.98Å; V850-M876 HydrophobicContact CB-SD 4.49Å; V850-M876 HydrophobicContact CG1-SD 3.94Å; V850-M876 HydrophobicContact CG2-SD 3.93Å
851	D	72.8	Confident	71.9	Confident	112 Å²	112	106.4 Å²	106.4	60%	0.599	54%	0.539	S	S	*	.			trans	-93.7	153	-177.1	-89.3	-28.2	0	0	0	112.6	Q853 E854	D851-Q853 PolarHBondContact O-N 2.97Å; D851-E854 HydrophobicContact CB-CG 4.17Å; D851-E854 PolarHBondContact N-OE2 3.14Å; D851-E854 WeakPolarHBondContact O-CB 3.26Å; D851-E854 PolarHBondContact O-N 3.26Å; D851-E854 VanDerWaalsContact O-N 3.09Å
852	S	65.1	Low	72	Confident	98 Å²	98	102.6 Å²	102.6	69%	0.685	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-11.9	-172.1	-57.9	0	0	0	0	115.7
853	Q	68.1	Low	72.1	Confident	178 Å²	178	95.7 Å²	95.7	83%	0.832	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-2.2	178.2	-66.8	-174.4	-3.1	0	0	113.3	D851	D851-Q853 PolarHBondContact O-N 2.97Å
854	E	73.5	Confident	72.5	Confident	64 Å²	64	95.8 Å²	95.8	30%	0.299	50%	0.496	S	S	.	.			trans	-72.9	139.1	-176.8	-65.9	-176.1	141.1	0	0	111.5	V850 D851 L863 M876	V850-E854 VanDerWaalsContact CA-OE2 3.24Å; V850-E854 WeakPolarHBondContact CA-OE2 3.47Å; V850-E854 VanDerWaalsContact CG1-OE2 3.25Å; V850-E854 WeakPolarHBondContact CG1-OE2 3.38Å; D851-E854 HydrophobicContact CB-CG 4.17Å; D851-E854 PolarHBondContact N-OE2 3.14Å; D851-E854 WeakPolarHBondContact O-CB 3.26Å; D851-E854 PolarHBondContact O-N 3.26Å; D851-E854 VanDerWaalsContact O-N 3.09Å; E854-L863 HydrophobicContact CB-CD1 3.8Å; E854-L863 PolarHBondContact O-N 3.34Å; E854-M876 HydrophobicContact CB-CE 3.79Å; E854-M876 HydrophobicContact CB-SD 4.38Å; E854-M876 VanDerWaalsContact CD-CE 3.46Å; E854-M876 HydrophobicContact CG-CE 4.06Å; E854-M876 WeakPolarHBondContact OE2-CE 3.06Å; E854-M876 VanDerWaalsContact OE2-SD 3.35Å
855	K	79.6	Confident	72.7	Confident	122 Å²	122	92.1 Å²	92.1	53%	0.53	49%	0.493	S	S	.	.	B	Isolated β-bridge	trans	-112.4	149.3	-172.7	-65.8	173.3	174	-172.4	0	110.1	A857 D860 F861	K855-A857 PolarHBondContact O-N 3.27Å; K855-D860 VanDerWaalsContact CD-O 3.29Å; K855-D860 WeakPolarHBondContact CD-O 3.27Å; K855-D860 WeakPolarHBondContact CG-O 3.23Å; K855-F861 WeakPolarHBondContact CA-O 3.45Å
856	C	80	Confident	72.9	Confident	0 Å²	0	91.8 Å²	91.8	0%	0	48%	0.481	C	S	.	.			trans	-66.8	127.4	173.4	170.6	0	0	0	0	109.6	A858 C859 D860 F861 L863 H878	C856-A858 PolarHBondContact O-N 3.05Å; C856-A858 VanDerWaalsContact O-N 3.09Å; C856-C859 PolarHBondContact O-N 3.48Å; C856-D860 WeakPolarHBondContact O-CA 3.31Å; C856-D860 PolarHBondContact O-N 3.48Å; C856-F861 PolarHBondContact N-O 3.12Å; C856-L863 HydrophobicContact CB-CD2 4.17Å; C856-L863 HydrophobicContact CB-CG 4.43Å; C856-H878 VanDerWaalsContact CB-CE1 3.49Å; C856-H878 WeakPolarHBondContact CB-CE1 3.46Å; C856-H878 WeakPolarHBondContact CB-ND1 3.47Å; C856-H878 PolarHBondContact SG-N 2.87Å
857	A	73.8	Confident	73.3	Confident	41 Å²	41	89.3 Å²	89.3	34%	0.339	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-16.7	-175.3	0	0	0	0	0	114.2	K855 M876 F877 Y955	K855-A857 PolarHBondContact O-N 3.27Å; A857-M876 PolarHBondContact N-O 3.35Å; A857-F877 HydrophobicContact CB-CD1 4.24Å; A857-F877 HydrophobicContact CB-CE1 3.79Å; A857-F877 HydrophobicContact CB-CZ 4.26Å; A857-Y955 HydrophobicContact CB-CE2 3.87Å
858	A	73.1	Confident	73.8	Confident	38 Å²	38	82.9 Å²	82.9	31%	0.314	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-22.6	178.4	0	0	0	0	0	115.1	C856 F877 C881	C856-A858 PolarHBondContact O-N 3.05Å; C856-A858 VanDerWaalsContact O-N 3.09Å; A858-F877 HydrophobicContact CB-CD1 4.08Å; A858-F877 HydrophobicContact CB-CE1 4.45Å; A858-C881 HydrophobicContact CB-CB 3.82Å
859	C	72.9	Confident	74.3	Confident	36 Å²	36	82.3 Å²	82.3	24%	0.243	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.9	0.2	-174.8	73.4	0	0	0	0	115	C856 F861 H878	C856-C859 PolarHBondContact O-N 3.48Å; C859-F861 HydrophobicContact CB-CD2 4.12Å; C859-F861 WeakPolarHBondContact O-CD2 3.31Å; C859-F861 PolarHBondContact O-N 3.01Å; C859-H878 PolarHBondContact SG-ND1 3.46Å
860	D	72	Confident	74.6	Confident	116 Å²	116	80.4 Å²	80.4	62%	0.62	42%	0.424	S	S	*	.			trans	56	9	178.9	-69.3	-39	0	0	0	116.3	K855 C856	K855-D860 VanDerWaalsContact CD-O 3.29Å; K855-D860 WeakPolarHBondContact CD-O 3.27Å; K855-D860 WeakPolarHBondContact CG-O 3.23Å; C856-D860 WeakPolarHBondContact O-CA 3.31Å; C856-D860 PolarHBondContact O-N 3.48Å
861	F	76.3	Confident	74.9	Confident	137 Å²	137	79.6 Å²	79.6	60%	0.601	42%	0.417	S	S	*	.	S	Bend	trans	-83.7	152	172.6	-73.6	-78.9	0	0	0	111.6	K855 C856 C859 L863	K855-F861 WeakPolarHBondContact CA-O 3.45Å; C856-F861 PolarHBondContact N-O 3.12Å; C859-F861 HydrophobicContact CB-CD2 4.12Å; C859-F861 WeakPolarHBondContact O-CD2 3.31Å; C859-F861 PolarHBondContact O-N 3.01Å; F861-L863 PolarHBondContact O-N 3.2Å
862	P	78.1	Confident	74.7	Confident	58 Å²	58	81.1 Å²	81.1	38%	0.377	43%	0.425	S	S	.	.	B	Isolated β-bridge	trans	-55.5	134	179.1	-23.7	32.8	0	0	0	112.8	L864 H878	P862-L864 PolarHBondContact O-N 3.35Å; P862-H878 PolarHBondContact O-NE2 2.92Å; P862-H878 VanDerWaalsContact O-NE2 3.14Å
863	L	75.3	Confident	75.1	Confident	2 Å²	2	79.5 Å²	79.5	1%	0.01	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-62.9	-42.1	-174.3	-85.3	152.2	0	0	0	113.6	E854 C856 F861 N865 R866 F868 M876 H878	E854-L863 HydrophobicContact CB-CD1 3.8Å; E854-L863 PolarHBondContact O-N 3.34Å; C856-L863 HydrophobicContact CB-CD2 4.17Å; C856-L863 HydrophobicContact CB-CG 4.43Å; F861-L863 PolarHBondContact O-N 3.2Å; L863-N865 PolarHBondContact O-N 3.35Å; L863-R866 PolarHBondContact O-N 3.08Å; L863-F868 HydrophobicContact CB-CD1 4.42Å; L863-F868 HydrophobicContact CB-CG 4.48Å; L863-F868 HydrophobicContact CD2-CB 3.5Å; L863-F868 HydrophobicContact CD2-CD2 4.2Å; L863-F868 HydrophobicContact CD2-CG 3.87Å; L863-M876 HydrophobicContact CD1-CB 3.45Å; L863-M876 VanDerWaalsContact CD1-CB 3.45Å; L863-M876 HydrophobicContact CD1-CE 3.84Å; L863-M876 HydrophobicContact CD1-CG 4.09Å; L863-M876 HydrophobicContact CD1-SD 3.56Å; L863-M876 VanDerWaalsContact CD1-SD 3.56Å; L863-M876 HydrophobicContact CD2-CB 3.81Å; L863-M876 HydrophobicContact CG-CB 4.29Å; L863-H878 WeakPolarHBondContact CA-NE2 3.11Å; L863-H878 PolarHBondContact O-NE2 3.1Å
864	L	75.6	Confident	75.2	Confident	107 Å²	107	73.2 Å²	73.2	56%	0.56	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-64.8	-13.1	-171.4	-72.2	162.8	0	0	0	115.5	P862 R866	P862-L864 PolarHBondContact O-N 3.35Å; L864-R866 VanDerWaalsContact C-N 3.33Å
865	N	72.4	Confident	75.5	Confident	138 Å²	138	73 Å²	73	74%	0.738	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-79.8	-12.9	179.5	-77.8	-13.4	0	0	0	113.5	L863	L863-N865 PolarHBondContact O-N 3.35Å
866	R	74.4	Confident	75.4	Confident	127 Å²	127	68.2 Å²	68.2	48%	0.479	38%	0.375	S	S	.	.	S	Bend	trans	-141.8	155.9	-178.1	-68.2	-175.9	-176.1	173.3	1.2	110.6	L863 L864 F868 H878	L863-R866 PolarHBondContact O-N 3.08Å; L864-R866 VanDerWaalsContact C-N 3.33Å; R866-F868 PolarHBondContact O-N 3.16Å; R866-H878 HydrophobicContact CB-CB 4.42Å
867	P	77.4	Confident	75.4	Confident	89 Å²	89	68.3 Å²	68.3	58%	0.578	38%	0.375	S	S	*	.			trans	-57	135	170.8	24.8	-33.3	0	0	0	109.8	H878 N879	P867-H878 WeakPolarHBondContact O-CA 3.37Å; P867-N879 HydrophobicContact CB-CB 4.29Å; P867-N879 HydrophobicContact CG-CB 4.05Å; P867-N879 WeakPolarHBondContact O-CB 3.38Å; P867-N879 PolarHBondContact O-N 3.4Å
868	F	77.8	Confident	75.8	Confident	73 Å²	73	66.4 Å²	66.4	32%	0.32	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	154.6	-174.3	69.5	-92.9	0	0	0	112	V850 L863 R866 F877	V850-F868 HydrophobicContact CB-CZ 4.5Å; V850-F868 HydrophobicContact CG1-CE2 4.3Å; V850-F868 HydrophobicContact CG1-CZ 4.14Å; V850-F868 HydrophobicContact CG2-CE2 4.03Å; V850-F868 HydrophobicContact CG2-CZ 4.32Å; L863-F868 HydrophobicContact CB-CD1 4.42Å; L863-F868 HydrophobicContact CB-CG 4.48Å; L863-F868 HydrophobicContact CD2-CB 3.5Å; L863-F868 HydrophobicContact CD2-CD2 4.2Å; L863-F868 HydrophobicContact CD2-CG 3.87Å; R866-F868 PolarHBondContact O-N 3.16Å; F868-F877 CarbonylContact C-O 3.59Å; F868-F877 WeakPolarHBondContact CA-O 3.42Å; F868-F877 VanDerWaalsContact CB-O 3.25Å; F868-F877 WeakPolarHBondContact CB-O 3.44Å
869	Y	77.5	Confident	76	Confident	38 Å²	38	66.4 Å²	66.4	15%	0.149	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	137.7	170.8	-65.9	-86.8	0	0	0	109.8	M876 F877 N879 L882 D946 A950	Y869-M876 VanDerWaalsContact O-CA 3.3Å; Y869-M876 WeakPolarHBondContact O-CA 3.3Å; Y869-F877 PolarHBondContact N-O 2.91Å; Y869-F877 PolarHBondContact O-N 2.97Å; Y869-F877 VanDerWaalsContact O-N 3.12Å; Y869-N879 HydrophobicContact CE2-CB 3.94Å; Y869-N879 VanDerWaalsContact CE2-ND2 3.26Å; Y869-N879 WeakPolarHBondContact CE2-ND2 3.22Å; Y869-N879 PolarHBondContact OH-ND2 3.1Å; Y869-L882 HydrophobicContact CD2-CD2 3.49Å; Y869-L882 VanDerWaalsContact CD2-CD2 3.49Å; Y869-L882 HydrophobicContact CE2-CD2 3.96Å; Y869-L882 HydrophobicContact CG-CD2 3.94Å; Y869-D946 PolarHBondContact OH-OD1 3.21Å; Y869-A950 HydrophobicContact CD1-CB 4.1Å; Y869-A950 HydrophobicContact CE1-CB 4.19Å
870	L	78.4	Confident	76.2	Confident	72 Å²	72	68.5 Å²	68.5	38%	0.377	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	114.3	169.4	174.4	68	0	0	0	108	V850 M876	V850-L870 HydrophobicContact CG2-CD1 4.43Å; V850-L870 HydrophobicContact CG2-CD2 3.98Å; L870-M876 HydrophobicContact CB-CG 4.47Å; L870-M876 HydrophobicContact CD1-CG 3.39Å; L870-M876 HydrophobicContact CD1-SD 3.97Å
871	F	78.8	Confident	76.4	Confident	26 Å²	26	63.6 Å²	63.6	11%	0.114	34%	0.337	C	S	.	.			trans	-83.7	151.8	173	-70.2	-84.2	0	0	0	110.7	C873 G874 H875 F877 L882 A950 C953	F871-C873 WeakPolarHBondContact CB-SG 3.23Å; F871-C873 PolarHBondContact O-N 3.44Å; F871-G874 PolarHBondContact O-N 3.1Å; F871-H875 PolarHBondContact N-O 3.06Å; F871-F877 AromaticContact CD2-CD2 3.9Å; F871-F877 HydrophobicContact CD2-CD2 3.9Å; F871-F877 HydrophobicContact CD2-CE2 4.04Å; F871-F877 AromaticContact CE2-CD2 3.71Å; F871-F877 HydrophobicContact CE2-CD2 3.71Å; F871-F877 HydrophobicContact CE2-CE2 4.04Å; F871-L882 HydrophobicContact CE2-CD1 4.08Å; F871-L882 HydrophobicContact CE2-CD2 4.08Å; F871-L882 HydrophobicContact CZ-CD1 4.19Å; F871-L882 HydrophobicContact CZ-CD2 3.93Å; F871-A950 HydrophobicContact CE1-CB 4.23Å; F871-A950 HydrophobicContact CZ-CB 4.25Å; F871-C953 HydrophobicContact CB-CB 4.21Å; F871-C953 HydrophobicContact CD1-CB 3.92Å; F871-C953 HydrophobicContact CD2-CB 4.22Å; F871-C953 HydrophobicContact CE1-CB 4.31Å; F871-C953 HydrophobicContact CG-CB 3.86Å
872	L	69.2	Low	76.5	Confident	144 Å²	144	57.1 Å²	57.1	75%	0.754	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-13	176.7	-66.8	171	0	0	0	113.5	M843 G874	M843-L872 HydrophobicContact CE-CD1 4.19Å; L872-G874 VanDerWaalsContact C-N 3.32Å
873	C	73.1	Confident	76.4	Confident	63 Å²	63	55.8 Å²	55.8	43%	0.426	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-3.4	171.9	61	0	0	0	0	114	F871 C953	F871-C873 WeakPolarHBondContact CB-SG 3.23Å; F871-C873 PolarHBondContact O-N 3.44Å; C873-C953 PolarHBondContact SG-SG 3.03Å
874	G	71.2	Confident	76.4	Confident	47 Å²	47	62.5 Å²	62.5	49%	0.485	33%	0.328	S	S	.	.	S	Bend	trans	90.4	-3.8	179.5	0	0	0	0	0	115.1	F871 L872	F871-G874 PolarHBondContact O-N 3.1Å; L872-G874 VanDerWaalsContact C-N 3.32Å
875	H	77.9	Confident	76.3	Confident	60 Å²	60	61.6 Å²	61.6	28%	0.278	32%	0.321	S	S	.	.			trans	-78.6	137.2	174.7	-67.4	128.8	0	0	0	111.9	F871 F877 C953 C956	F871-H875 PolarHBondContact N-O 3.06Å; H875-F877 HydrophobicContact CB-CD2 4.45Å; H875-F877 HydrophobicContact CB-CE2 3.62Å; H875-F877 HydrophobicContact CB-CZ 4.1Å; H875-C953 PolarHBondContact ND1-SG 3.22Å; H875-C953 VanDerWaalsContact ND1-SG 3.39Å; H875-C956 PolarHBondContact CE1-SG 2.9Å; H875-C956 PolarHBondContact ND1-SG 3.39Å; H875-C956 VanDerWaalsContact ND1-SG 3.4Å
876	M	79.1	Confident	76.5	Confident	21 Å²	21	55.3 Å²	55.3	10%	0.103	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	131.5	-177.8	-65.7	169.4	-69.8	0	0	110.9	V850 E854 A857 L863 Y869 L870	V850-M876 HydrophobicContact CB-SD 4.49Å; V850-M876 HydrophobicContact CG1-SD 3.94Å; V850-M876 HydrophobicContact CG2-SD 3.93Å; E854-M876 HydrophobicContact CB-CE 3.79Å; E854-M876 HydrophobicContact CB-SD 4.38Å; E854-M876 VanDerWaalsContact CD-CE 3.46Å; E854-M876 HydrophobicContact CG-CE 4.06Å; E854-M876 WeakPolarHBondContact OE2-CE 3.06Å; E854-M876 VanDerWaalsContact OE2-SD 3.35Å; A857-M876 PolarHBondContact N-O 3.35Å; L863-M876 HydrophobicContact CD1-CB 3.45Å; L863-M876 VanDerWaalsContact CD1-CB 3.45Å; L863-M876 HydrophobicContact CD1-CE 3.84Å; L863-M876 HydrophobicContact CD1-CG 4.09Å; L863-M876 HydrophobicContact CD1-SD 3.56Å; L863-M876 VanDerWaalsContact CD1-SD 3.56Å; L863-M876 HydrophobicContact CD2-CB 3.81Å; L863-M876 HydrophobicContact CG-CB 4.29Å; Y869-M876 VanDerWaalsContact O-CA 3.3Å; Y869-M876 WeakPolarHBondContact O-CA 3.3Å; L870-M876 HydrophobicContact CB-CG 4.47Å; L870-M876 HydrophobicContact CD1-CG 3.39Å; L870-M876 HydrophobicContact CD1-SD 3.97Å
877	F	79.6	Confident	76.4	Confident	1 Å²	1	52.2 Å²	52.2	0%	0.004	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	142.9	-177.8	-59.4	-86.2	0	0	0	110.4	A857 A858 F868 Y869 F871 H875 L882 Y955	A857-F877 HydrophobicContact CB-CD1 4.24Å; A857-F877 HydrophobicContact CB-CE1 3.79Å; A857-F877 HydrophobicContact CB-CZ 4.26Å; A858-F877 HydrophobicContact CB-CD1 4.08Å; A858-F877 HydrophobicContact CB-CE1 4.45Å; F868-F877 CarbonylContact C-O 3.59Å; F868-F877 WeakPolarHBondContact CA-O 3.42Å; F868-F877 VanDerWaalsContact CB-O 3.25Å; F868-F877 WeakPolarHBondContact CB-O 3.44Å; Y869-F877 PolarHBondContact N-O 2.91Å; Y869-F877 PolarHBondContact O-N 2.97Å; Y869-F877 VanDerWaalsContact O-N 3.12Å; F871-F877 AromaticContact CD2-CD2 3.9Å; F871-F877 HydrophobicContact CD2-CD2 3.9Å; F871-F877 HydrophobicContact CD2-CE2 4.04Å; F871-F877 AromaticContact CE2-CD2 3.71Å; F871-F877 HydrophobicContact CE2-CD2 3.71Å; F871-F877 HydrophobicContact CE2-CE2 4.04Å; H875-F877 HydrophobicContact CB-CD2 4.45Å; H875-F877 HydrophobicContact CB-CE2 3.62Å; H875-F877 HydrophobicContact CB-CZ 4.1Å; F877-L882 HydrophobicContact CB-CB 4.04Å; F877-L882 HydrophobicContact CB-CD1 4.44Å; F877-L882 HydrophobicContact CD2-CD1 4.22Å; F877-L882 HydrophobicContact CG-CD1 4.29Å; F877-Y955 HydrophobicContact CE1-CD2 4.06Å; F877-Y955 AromaticContact CE1-CE2 3.59Å; F877-Y955 HydrophobicContact CE1-CE2 3.59Å; F877-Y955 AromaticContact CZ-CD2 3.58Å; F877-Y955 HydrophobicContact CZ-CD2 3.58Å; F877-Y955 AromaticContact CZ-CE2 3.64Å; F877-Y955 HydrophobicContact CZ-CE2 3.64Å; F877-Y955 HydrophobicContact CZ-CG 4.32Å
878	H	81.6	Confident	76.1	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	146.9	161.9	-62.8	138.8	0	0	0	109.5	C856 C859 P862 L863 R866 P867 D880 C881 L882	C856-H878 VanDerWaalsContact CB-CE1 3.49Å; C856-H878 WeakPolarHBondContact CB-CE1 3.46Å; C856-H878 WeakPolarHBondContact CB-ND1 3.47Å; C856-H878 PolarHBondContact SG-N 2.87Å; C859-H878 PolarHBondContact SG-ND1 3.46Å; P862-H878 PolarHBondContact O-NE2 2.92Å; P862-H878 VanDerWaalsContact O-NE2 3.14Å; L863-H878 WeakPolarHBondContact CA-NE2 3.11Å; L863-H878 PolarHBondContact O-NE2 3.1Å; R866-H878 HydrophobicContact CB-CB 4.42Å; P867-H878 WeakPolarHBondContact O-CA 3.37Å; H878-D880 PolarHBondContact O-N 3.16Å; H878-C881 HydrophobicContact CB-CB 4.22Å; H878-C881 PolarHBondContact O-N 2.84Å; H878-C881 VanDerWaalsContact O-N 3.15Å; H878-L882 PolarHBondContact O-N 3.4Å
879	N	77.1	Confident	75.7	Confident	38 Å²	38	50.9 Å²	50.9	20%	0.203	28%	0.277	C	S	.	.	H	α-helix	trans	-50.9	-55.8	177.7	-176.4	-73.2	0	0	0	110.4	P867 Y869 C881 L882 F883	P867-N879 HydrophobicContact CB-CB 4.29Å; P867-N879 HydrophobicContact CG-CB 4.05Å; P867-N879 WeakPolarHBondContact O-CB 3.38Å; P867-N879 PolarHBondContact O-N 3.4Å; Y869-N879 HydrophobicContact CE2-CB 3.94Å; Y869-N879 VanDerWaalsContact CE2-ND2 3.26Å; Y869-N879 WeakPolarHBondContact CE2-ND2 3.22Å; Y869-N879 PolarHBondContact OH-ND2 3.1Å; N879-C881 VanDerWaalsContact C-N 3.3Å; N879-C881 PolarHBondContact O-N 3.22Å; N879-L882 PolarHBondContact O-N 3.18Å; N879-L882 VanDerWaalsContact O-N 3.13Å; N879-F883 WeakPolarHBondContact O-CD2 3.35Å; N879-F883 PolarHBondContact O-N 2.98Å; N879-F883 WeakPolarHBondContact OD1-CD2 3.39Å; N879-F883 WeakPolarHBondContact OD1-CE2 3.24Å
880	D	77.6	Confident	75.3	Confident	81 Å²	81	50 Å²	50	43%	0.433	28%	0.275	S	S	.	.	H	α-helix	trans	-57.6	-38.7	179.9	-55.8	-34.1	0	0	0	113.7	H878 Q884	H878-D880 PolarHBondContact O-N 3.16Å; D880-Q884 WeakPolarHBondContact O-CG 3.37Å; D880-Q884 PolarHBondContact O-N 3.45Å; D880-Q884 VanDerWaalsContact O-N 3.11Å
881	C	75.9	Confident	75	Confident	13 Å²	13	49.8 Å²	49.8	9%	0.088	28%	0.279	C	S	.	.	H	α-helix	trans	-70.6	-40.8	179.6	-66	0	0	0	0	111.6	A858 H878 N879 F883 Q884 E885	A858-C881 HydrophobicContact CB-CB 3.82Å; H878-C881 HydrophobicContact CB-CB 4.22Å; H878-C881 PolarHBondContact O-N 2.84Å; H878-C881 VanDerWaalsContact O-N 3.15Å; N879-C881 VanDerWaalsContact C-N 3.3Å; N879-C881 PolarHBondContact O-N 3.22Å; C881-F883 VanDerWaalsContact C-N 3.33Å; C881-Q884 PolarHBondContact O-N 3.27Å; C881-E885 PolarHBondContact O-N 2.85Å
882	L	79.4	Confident	74.5	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63.3	-41.4	175.4	-174.7	66.5	0	0	0	111	Y869 F871 F877 H878 N879 Q884 E885 V886 V949 V954	Y869-L882 HydrophobicContact CD2-CD2 3.49Å; Y869-L882 VanDerWaalsContact CD2-CD2 3.49Å; Y869-L882 HydrophobicContact CE2-CD2 3.96Å; Y869-L882 HydrophobicContact CG-CD2 3.94Å; F871-L882 HydrophobicContact CE2-CD1 4.08Å; F871-L882 HydrophobicContact CE2-CD2 4.08Å; F871-L882 HydrophobicContact CZ-CD1 4.19Å; F871-L882 HydrophobicContact CZ-CD2 3.93Å; F877-L882 HydrophobicContact CB-CB 4.04Å; F877-L882 HydrophobicContact CB-CD1 4.44Å; F877-L882 HydrophobicContact CD2-CD1 4.22Å; F877-L882 HydrophobicContact CG-CD1 4.29Å; H878-L882 PolarHBondContact O-N 3.4Å; N879-L882 PolarHBondContact O-N 3.18Å; N879-L882 VanDerWaalsContact O-N 3.13Å; L882-Q884 PolarHBondContact O-N 3.32Å; L882-E885 PolarHBondContact O-N 2.97Å; L882-V886 HydrophobicContact CD1-CG2 3.99Å; L882-V886 HydrophobicContact CG-CG2 4.24Å; L882-V886 WeakPolarHBondContact O-CB 3.47Å; L882-V886 VanDerWaalsContact O-CG2 3.24Å; L882-V886 WeakPolarHBondContact O-CG2 3.29Å; L882-V886 PolarHBondContact O-N 2.95Å; L882-V949 HydrophobicContact CD2-CG1 3.87Å; L882-V949 HydrophobicContact CG-CG1 3.86Å; L882-V954 HydrophobicContact CD1-CG2 3.64Å
883	F	76.2	Confident	74.6	Confident	31 Å²	31	52.1 Å²	52.1	14%	0.136	30%	0.296	C	S	.	.	H	α-helix	trans	-59	-46.4	174.8	-89.9	-81.6	0	0	0	112.5	N879 C881 E885 V886 T887 L898 I945 V949	N879-F883 WeakPolarHBondContact O-CD2 3.35Å; N879-F883 PolarHBondContact O-N 2.98Å; N879-F883 WeakPolarHBondContact OD1-CD2 3.39Å; N879-F883 WeakPolarHBondContact OD1-CE2 3.24Å; C881-F883 VanDerWaalsContact C-N 3.33Å; F883-E885 VanDerWaalsContact C-N 3.33Å; F883-E885 PolarHBondContact O-N 3.22Å; F883-V886 PolarHBondContact O-N 2.74Å; F883-T887 WeakPolarHBondContact O-CB 3.29Å; F883-T887 PolarHBondContact O-N 3.3Å; F883-T887 VanDerWaalsContact O-N 3.07Å; F883-T887 PolarHBondContact O-OG1 3.47Å; F883-L898 HydrophobicContact CE1-CD1 4.46Å; F883-L898 HydrophobicContact CE1-CD2 4.33Å; F883-I945 HydrophobicContact CE1-CG2 3.69Å; F883-I945 HydrophobicContact CZ-CG2 3.3Å; F883-V949 HydrophobicContact CD1-CG1 4.31Å; F883-V949 HydrophobicContact CD1-CG2 3.89Å; F883-V949 HydrophobicContact CD2-CG1 4.36Å; F883-V949 HydrophobicContact CE1-CB 4.38Å; F883-V949 HydrophobicContact CE1-CG1 4.36Å; F883-V949 HydrophobicContact CE1-CG2 3.48Å; F883-V949 VanDerWaalsContact CE1-CG2 3.48Å; F883-V949 HydrophobicContact CE2-CG1 4.31Å; F883-V949 HydrophobicContact CG-CG1 4.32Å; F883-V949 HydrophobicContact CZ-CB 4.38Å; F883-V949 HydrophobicContact CZ-CG1 4.33Å; F883-V949 HydrophobicContact CZ-CG2 3.89Å
884	Q	74.9	Confident	74.5	Confident	142 Å²	142	53.8 Å²	53.8	66%	0.664	30%	0.295	S	S	*	.	H	α-helix	trans	-61.7	-41.2	-178.8	-75.2	176	0.8	0	0	112.3	D880 C881 L882 P888	D880-Q884 WeakPolarHBondContact O-CG 3.37Å; D880-Q884 PolarHBondContact O-N 3.45Å; D880-Q884 VanDerWaalsContact O-N 3.11Å; C881-Q884 PolarHBondContact O-N 3.27Å; L882-Q884 PolarHBondContact O-N 3.32Å; Q884-P888 WeakPolarHBondContact O-CD 3.31Å
885	E	72	Confident	74.6	Confident	89 Å²	89	54.4 Å²	54.4	42%	0.416	29%	0.286	S	S	.	.	H	α-helix	trans	-74.2	-36.7	-179.7	-69.9	-62.4	146.5	0	0	113.1	C881 L882 F883 P888 V954	C881-E885 PolarHBondContact O-N 2.85Å; L882-E885 PolarHBondContact O-N 2.97Å; F883-E885 VanDerWaalsContact C-N 3.33Å; F883-E885 PolarHBondContact O-N 3.22Å; E885-P888 WeakPolarHBondContact O-CD 3.49Å; E885-V954 HydrophobicContact CB-CG1 4.37Å; E885-V954 HydrophobicContact CB-CG2 4.35Å
886	V	77.4	Confident	74.5	Confident	5 Å²	5	56.4 Å²	56.4	3%	0.03	30%	0.299	C	S	.	.	H	α-helix	trans	-79.3	-36.1	-176.1	174.7	0	0	0	0	112.3	L882 F883 H889 L890 V954 L959	L882-V886 HydrophobicContact CD1-CG2 3.99Å; L882-V886 HydrophobicContact CG-CG2 4.24Å; L882-V886 WeakPolarHBondContact O-CB 3.47Å; L882-V886 VanDerWaalsContact O-CG2 3.24Å; L882-V886 WeakPolarHBondContact O-CG2 3.29Å; L882-V886 PolarHBondContact O-N 2.95Å; F883-V886 PolarHBondContact O-N 2.74Å; V886-H889 PolarHBondContact O-N 2.98Å; V886-L890 HydrophobicContact CG1-CD1 3.91Å; V886-L890 HydrophobicContact CG1-CD2 4.06Å; V886-L890 HydrophobicContact CG1-CG 3.8Å; V886-L890 PolarHBondContact O-N 2.77Å; V886-V954 HydrophobicContact CG2-CG2 3.6Å; V886-L959 HydrophobicContact CG2-CD1 4.42Å
887	T	73.1	Confident	74.4	Confident	62 Å²	62	61.5 Å²	61.5	38%	0.38	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-50.9	-48.5	-176.1	-55.7	0	0	0	0	114.4	F883 H889 L890 Q895	F883-T887 WeakPolarHBondContact O-CB 3.29Å; F883-T887 PolarHBondContact O-N 3.3Å; F883-T887 VanDerWaalsContact O-N 3.07Å; F883-T887 PolarHBondContact O-OG1 3.47Å; T887-H889 PolarHBondContact O-N 3.22Å; T887-L890 PolarHBondContact O-N 3.22Å; T887-Q895 PolarHBondContact O-NE2 3.16Å
888	P	71.2	Confident	74.2	Confident	75 Å²	75	61.8 Å²	61.8	49%	0.487	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-71.1	-10.2	-178.7	26.4	-33.4	0	0	0	114.7	Q884 E885	Q884-P888 WeakPolarHBondContact O-CD 3.31Å; E885-P888 WeakPolarHBondContact O-CD 3.49Å
889	H	68.2	Low	73.9	Confident	60 Å²	60	66.3 Å²	66.3	28%	0.278	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-107.6	-5.8	-179.6	-68.4	-93.4	0	0	0	113.9	V886 T887 L959 K966	V886-H889 PolarHBondContact O-N 2.98Å; T887-H889 PolarHBondContact O-N 3.22Å; H889-L959 HydrophobicContact CB-CD2 3.82Å; H889-K966 PolarHBondContact CE1-NZ 3.28Å; H889-K966 PolarHBondContact ND1-NZ 3.27Å
890	L	69.9	Low	74	Confident	20 Å²	20	69.2 Å²	69.2	11%	0.105	35%	0.352	C	S	.	.	S	Bend	trans	-72.7	147.7	174.4	-73.1	169.3	0	0	0	111.6	V886 T887 K894 Q895 L898 I948	V886-L890 HydrophobicContact CG1-CD1 3.91Å; V886-L890 HydrophobicContact CG1-CD2 4.06Å; V886-L890 HydrophobicContact CG1-CG 3.8Å; V886-L890 PolarHBondContact O-N 2.77Å; T887-L890 PolarHBondContact O-N 3.22Å; L890-K894 HydrophobicContact CB-CB 4.34Å; L890-K894 HydrophobicContact CD2-CB 4.19Å; L890-K894 HydrophobicContact CD2-CD 4.08Å; L890-Q895 HydrophobicContact CB-CG 3.69Å; L890-Q895 PolarHBondContact O-NE2 3.31Å; L890-Q895 VanDerWaalsContact O-NE2 3.16Å; L890-L898 HydrophobicContact CD1-CD1 3.84Å; L890-I948 HydrophobicContact CD1-CG2 4.14Å; L890-I948 HydrophobicContact CD2-CG2 3.99Å
891	S	71.3	Confident	73.9	Confident	67 Å²	67	66.1 Å²	66.1	47%	0.469	34%	0.335	S	S	.	.			trans	-66.8	152.4	173.4	64.5	0	0	0	0	111.5	F893 K894 Q895	S891-F893 PolarHBondContact O-N 2.96Å; S891-F893 VanDerWaalsContact O-N 3.08Å; S891-K894 CarbonylContact O-C 3.01Å; S891-K894 WeakPolarHBondContact O-CA 3.37Å; S891-K894 PolarHBondContact O-N 2.91Å; S891-K894 WeakPolarHBondContact OG-CG 3.3Å; S891-Q895 PolarHBondContact O-N 3.02Å
892	A	69.1	Low	73.8	Confident	67 Å²	67	70 Å²	70	55%	0.554	35%	0.352	S	S	*	.	H	α-helix	trans	-53.9	-34.2	-177.9	0	0	0	0	0	113.4	N896	A892-N896 WeakPolarHBondContact O-CB 3.42Å; A892-N896 PolarHBondContact O-N 2.74Å; A892-N896 PolarHBondContact O-ND2 2.84Å
893	F	70.7	Confident	73.6	Confident	152 Å²	152	76.9 Å²	76.9	67%	0.667	38%	0.382	S	S	*	.	H	α-helix	trans	-68.3	-42.9	174.4	-175.6	-97.8	0	0	0	112.7	S891 R897	S891-F893 PolarHBondContact O-N 2.96Å; S891-F893 VanDerWaalsContact O-N 3.08Å; F893-R897 WeakPolarHBondContact O-CB 3.47Å; F893-R897 PolarHBondContact O-N 2.79Å
894	K	70.4	Confident	73.6	Confident	97 Å²	97	80 Å²	80	42%	0.422	40%	0.395	S	S	.	.	H	α-helix	trans	-70.2	-36.7	176.6	-71.5	-174.2	178.8	-173.7	0	111.8	L890 S891 R897 L898	L890-K894 HydrophobicContact CB-CB 4.34Å; L890-K894 HydrophobicContact CD2-CB 4.19Å; L890-K894 HydrophobicContact CD2-CD 4.08Å; S891-K894 CarbonylContact O-C 3.01Å; S891-K894 WeakPolarHBondContact O-CA 3.37Å; S891-K894 PolarHBondContact O-N 2.91Å; S891-K894 WeakPolarHBondContact OG-CG 3.3Å; K894-R897 PolarHBondContact O-N 3.47Å; K894-L898 VanDerWaalsContact O-CB 3.26Å; K894-L898 WeakPolarHBondContact O-CB 3.48Å; K894-L898 PolarHBondContact O-N 3.11Å
895	Q	75	Confident	73.5	Confident	61 Å²	61	74.8 Å²	74.8	29%	0.285	37%	0.372	S	S	.	.	H	α-helix	trans	-61.6	-50.1	173	-72.4	176.9	-17.1	0	0	111.3	T887 L890 S891 R897 L898 E899	T887-Q895 PolarHBondContact O-NE2 3.16Å; L890-Q895 HydrophobicContact CB-CG 3.69Å; L890-Q895 PolarHBondContact O-NE2 3.31Å; L890-Q895 VanDerWaalsContact O-NE2 3.16Å; S891-Q895 PolarHBondContact O-N 3.02Å; Q895-R897 VanDerWaalsContact C-N 3.31Å; Q895-R897 PolarHBondContact O-N 2.86Å; Q895-L898 PolarHBondContact O-N 3.44Å; Q895-L898 VanDerWaalsContact O-N 3.16Å; Q895-E899 WeakPolarHBondContact O-CG 3.07Å; Q895-E899 PolarHBondContact O-N 2.93Å
896	N	75.9	Confident	73.4	Confident	102 Å²	102	73.2 Å²	73.2	55%	0.545	37%	0.374	S	S	.	.	H	α-helix	trans	-60.5	-40.4	176.9	-74.8	-19.4	0	0	0	112.1	A892 E900	A892-N896 WeakPolarHBondContact O-CB 3.42Å; A892-N896 PolarHBondContact O-N 2.74Å; A892-N896 PolarHBondContact O-ND2 2.84Å; N896-E900 WeakPolarHBondContact O-CB 3.2Å; N896-E900 PolarHBondContact O-N 3.16Å
897	R	75.7	Confident	73	Confident	128 Å²	128	76.1 Å²	76.1	48%	0.483	40%	0.399	S	S	.	.	H	α-helix	trans	-66.8	-38.4	176.2	-172.5	164.4	177.4	164.1	-3.8	112.2	F893 K894 Q895 E900 L901	F893-R897 WeakPolarHBondContact O-CB 3.47Å; F893-R897 PolarHBondContact O-N 2.79Å; K894-R897 PolarHBondContact O-N 3.47Å; Q895-R897 VanDerWaalsContact C-N 3.31Å; Q895-R897 PolarHBondContact O-N 2.86Å; R897-E900 PolarHBondContact O-N 2.84Å; R897-L901 HydrophobicContact CG-CD1 4.21Å; R897-L901 WeakPolarHBondContact O-CB 3.41Å; R897-L901 WeakPolarHBondContact O-CG 3.49Å; R897-L901 PolarHBondContact O-N 2.98Å
898	L	75.3	Confident	72.5	Confident	7 Å²	7	75.8 Å²	75.8	4%	0.037	40%	0.397	C	S	.	.	H	α-helix	trans	-69.2	-40.6	177.1	-165.5	148.2	0	0	0	111.5	F883 L890 K894 Q895 E900 L901 Q902 I948 V949	F883-L898 HydrophobicContact CE1-CD1 4.46Å; F883-L898 HydrophobicContact CE1-CD2 4.33Å; L890-L898 HydrophobicContact CD1-CD1 3.84Å; K894-L898 VanDerWaalsContact O-CB 3.26Å; K894-L898 WeakPolarHBondContact O-CB 3.48Å; K894-L898 PolarHBondContact O-N 3.11Å; Q895-L898 PolarHBondContact O-N 3.44Å; Q895-L898 VanDerWaalsContact O-N 3.16Å; L898-E900 VanDerWaalsContact C-N 3.35Å; L898-L901 PolarHBondContact O-N 3.28Å; L898-Q902 HydrophobicContact CD2-CG 4.22Å; L898-Q902 WeakPolarHBondContact O-CB 3.19Å; L898-Q902 WeakPolarHBondContact O-CG 3.45Å; L898-Q902 PolarHBondContact O-N 3.44Å; L898-I948 HydrophobicContact CD1-CB 4.41Å; L898-I948 HydrophobicContact CD1-CG2 3.78Å; L898-V949 HydrophobicContact CD1-CG2 3.56Å
899	E	76.3	Confident	71.9	Confident	95 Å²	95	75.6 Å²	75.6	44%	0.444	39%	0.394	S	S	.	.	H	α-helix	trans	-63.3	-39	171.6	-74.2	-173.8	-171.1	0	0	112.5	Q895 Q902 K903	Q895-E899 WeakPolarHBondContact O-CG 3.07Å; Q895-E899 PolarHBondContact O-N 2.93Å; E899-Q902 PolarHBondContact O-N 3.29Å; E899-K903 WeakPolarHBondContact O-CB 3.49Å; E899-K903 VanDerWaalsContact O-CG 3.29Å; E899-K903 WeakPolarHBondContact O-CG 3.16Å; E899-K903 PolarHBondContact O-N 3.1Å
900	E	79.1	Confident	71.2	Confident	100 Å²	100	80.9 Å²	80.9	47%	0.467	42%	0.419	S	S	.	.	H	α-helix	trans	-66.4	-42.4	176.1	-161.9	-168.8	152.8	0	0	111.4	N896 R897 L898 K903 K904	N896-E900 WeakPolarHBondContact O-CB 3.2Å; N896-E900 PolarHBondContact O-N 3.16Å; R897-E900 PolarHBondContact O-N 2.84Å; L898-E900 VanDerWaalsContact C-N 3.35Å; E900-K903 PolarHBondContact O-N 3.16Å; E900-K904 WeakPolarHBondContact O-CB 3.28Å; E900-K904 WeakPolarHBondContact O-CG 3.23Å; E900-K904 PolarHBondContact O-N 3.24Å; E900-K904 WeakPolarHBondContact OE1-CE 3.15Å; E900-K904 IonicContact OE1-NZ 2.66Å; E900-K904 PolarHBondContact OE1-NZ 3.29Å
901	L	75.5	Confident	70.3	Confident	15 Å²	15	84.7 Å²	84.7	8%	0.079	45%	0.448	C	S	.	.	H	α-helix	trans	-65.7	-39.5	175	-71	169.4	0	0	0	111.6	R897 L898 K904 L905 I941 D944 I945 I948	R897-L901 HydrophobicContact CG-CD1 4.21Å; R897-L901 WeakPolarHBondContact O-CB 3.41Å; R897-L901 WeakPolarHBondContact O-CG 3.49Å; R897-L901 PolarHBondContact O-N 2.98Å; L898-L901 PolarHBondContact O-N 3.28Å; L901-K904 PolarHBondContact O-N 2.95Å; L901-L905 WeakPolarHBondContact O-CB 3.16Å; L901-L905 PolarHBondContact O-N 2.79Å; L901-I941 HydrophobicContact CB-CG2 4.32Å; L901-I941 HydrophobicContact CD2-CG2 4.06Å; L901-D944 HydrophobicContact CD1-CB 4.04Å; L901-D944 HydrophobicContact CD2-CB 4.49Å; L901-I945 HydrophobicContact CB-CD1 4.01Å; L901-I945 HydrophobicContact CB-CG1 3.78Å; L901-I945 HydrophobicContact CD1-CG1 4.13Å; L901-I948 HydrophobicContact CD1-CD1 3.99Å
902	Q	72.4	Confident	69.2	Low	96 Å²	96	85.9 Å²	85.9	45%	0.449	46%	0.456	S	S	.	.	H	α-helix	trans	-62.8	-43.4	172.7	-78.8	-176.5	-8.8	0	0	112.3	L898 E899 K904 L905 A906	L898-Q902 HydrophobicContact CD2-CG 4.22Å; L898-Q902 WeakPolarHBondContact O-CB 3.19Å; L898-Q902 WeakPolarHBondContact O-CG 3.45Å; L898-Q902 PolarHBondContact O-N 3.44Å; E899-Q902 PolarHBondContact O-N 3.29Å; Q902-K904 VanDerWaalsContact C-N 3.31Å; Q902-K904 PolarHBondContact O-N 3.21Å; Q902-L905 PolarHBondContact O-N 3.26Å; Q902-A906 WeakPolarHBondContact O-CB 3.36Å; Q902-A906 PolarHBondContact O-N 3.09Å
903	K	76.9	Confident	67.8	Low	144 Å²	144	92.7 Å²	92.7	63%	0.626	47%	0.473	S	S	*	.	H	α-helix	trans	-61.1	-40.4	174.9	-75	170.1	-172.3	165.6	0	111.3	E899 E900 A907	E899-K903 WeakPolarHBondContact O-CB 3.49Å; E899-K903 VanDerWaalsContact O-CG 3.29Å; E899-K903 WeakPolarHBondContact O-CG 3.16Å; E899-K903 PolarHBondContact O-N 3.1Å; E900-K903 PolarHBondContact O-N 3.16Å; K903-A907 WeakPolarHBondContact O-CB 3.38Å; K903-A907 PolarHBondContact O-N 3Å
904	K	74.8	Confident	66.2	Low	96 Å²	96	90.3 Å²	90.3	42%	0.417	48%	0.475	S	S	.	.	H	α-helix	trans	-67.1	-37.6	175.4	-74.5	168.6	170.9	167.6	0	112.7	E900 L901 Q902 T908 I941	E900-K904 WeakPolarHBondContact O-CB 3.28Å; E900-K904 WeakPolarHBondContact O-CG 3.23Å; E900-K904 PolarHBondContact O-N 3.24Å; E900-K904 WeakPolarHBondContact OE1-CE 3.15Å; E900-K904 IonicContact OE1-NZ 2.66Å; E900-K904 PolarHBondContact OE1-NZ 3.29Å; L901-K904 PolarHBondContact O-N 2.95Å; Q902-K904 VanDerWaalsContact C-N 3.31Å; Q902-K904 PolarHBondContact O-N 3.21Å; K904-T908 PolarHBondContact O-N 3.09Å; K904-T908 VanDerWaalsContact O-N 3.15Å; K904-T908 PolarHBondContact O-OG1 3.34Å; K904-I941 HydrophobicContact CB-CD1 4.34Å
905	L	72.9	Confident	64.4	Low	32 Å²	32	97.3 Å²	97.3	17%	0.168	50%	0.499	C	S	.	.	H	α-helix	trans	-71	-39.6	178	-147.2	155.9	0	0	0	111.6	L901 Q902 T908 T909 I941 V942 I945	L901-L905 WeakPolarHBondContact O-CB 3.16Å; L901-L905 PolarHBondContact O-N 2.79Å; Q902-L905 PolarHBondContact O-N 3.26Å; L905-T908 PolarHBondContact O-N 3.23Å; L905-T909 PolarHBondContact O-N 3.44Å; L905-T909 PolarHBondContact O-OG1 3.04Å; L905-I941 HydrophobicContact CB-CG2 4.12Å; L905-I941 HydrophobicContact CD1-CB 4.42Å; L905-I941 HydrophobicContact CD1-CG2 3.89Å; L905-I941 HydrophobicContact CG-CG2 4.2Å; L905-V942 HydrophobicContact CD1-CG2 3.81Å; L905-I945 HydrophobicContact CD1-CD1 3.49Å; L905-I945 VanDerWaalsContact CD1-CD1 3.49Å
906	A	71.4	Confident	62.4	Low	56 Å²	56	102.8 Å²	102.8	46%	0.463	52%	0.524	S	S	.	.	H	α-helix	trans	-64.8	-42.2	173.4	0	0	0	0	0	112.3	Q902 T908 T909	Q902-A906 WeakPolarHBondContact O-CB 3.36Å; Q902-A906 PolarHBondContact O-N 3.09Å; A906-T908 VanDerWaalsContact C-N 3.3Å; A906-T908 PolarHBondContact O-N 3.33Å; A906-T909 PolarHBondContact O-N 3.3Å
907	A	67.2	Low	60.2	Low	67 Å²	67	108.6 Å²	108.6	55%	0.554	54%	0.538	S	S	*	.	H	α-helix	trans	-62.1	-35.6	175.9	0	0	0	0	0	112.8	K903 T909	K903-A907 WeakPolarHBondContact O-CB 3.38Å; K903-A907 PolarHBondContact O-N 3Å; A907-T909 VanDerWaalsContact C-N 3.32Å; A907-T909 PolarHBondContact O-N 2.94Å
908	T	62.8	Low	59.1	Low	55 Å²	55	107.1 Å²	107.1	34%	0.337	55%	0.545	S	S	.	.	H	α-helix	trans	-73.7	-22.7	178.1	-53.7	0	0	0	0	112.8	K904 L905 A906 S911	K904-T908 PolarHBondContact O-N 3.09Å; K904-T908 VanDerWaalsContact O-N 3.15Å; K904-T908 PolarHBondContact O-OG1 3.34Å; L905-T908 PolarHBondContact O-N 3.23Å; A906-T908 VanDerWaalsContact C-N 3.3Å; A906-T908 PolarHBondContact O-N 3.33Å; T908-S911 PolarHBondContact O-OG 3.42Å
909	T	58.8	Low	56.7	Low	70 Å²	70	113 Å²	113	43%	0.429	58%	0.581	S	S	.	*	H	α-helix	trans	-81	-18.6	-177.5	-44.6	0	0	0	0	112.6	L905 A906 A907 R938	L905-T909 PolarHBondContact O-N 3.44Å; L905-T909 PolarHBondContact O-OG1 3.04Å; A906-T909 PolarHBondContact O-N 3.3Å; A907-T909 VanDerWaalsContact C-N 3.32Å; A907-T909 PolarHBondContact O-N 2.94Å; T909-R938 PolarHBondContact OG1-NH1 2.94Å
910	Q	54.5	Low	54.5	Low	171 Å²	171	116.7 Å²	116.7	80%	0.799	60%	0.599	S	S	*	*	S	Bend	trans	-85	-14.2	179.7	-68.3	-177.2	-2.6	0	0	114.3
911	S	51.3	Low	52	Low	101 Å²	101	120 Å²	120	71%	0.706	61%	0.611	S	S	*	*	S	Bend	trans	-89	-3.5	-177.7	65.8	0	0	0	0	115.3	T908	T908-S911 PolarHBondContact O-OG 3.42Å
912	S	46.8	Very low	49.7	Very low	92 Å²	92	125.8 Å²	125.8	64%	0.643	64%	0.638	S	S	*	*			trans	-105.5	12.1	-169	58.9	0	0	0	0	116.5
913	K	39.7	Very low	47.5	Very low	210 Å²	210	130.1 Å²	130.1	91%	0.913	66%	0.659	S	S	*	*			trans	-102.1	67.7	172.2	-76.3	-175.7	178	176.2	0	112.7
914	S	36.7	Very low	45.1	Very low	102 Å²	102	127.1 Å²	127.1	71%	0.713	67%	0.668	S	S	*	*	S	Bend	trans	-165.2	116.6	157.1	163.4	0	0	0	0	112.4
915	R	34.3	Very low	42.9	Very low	244 Å²	244	129.8 Å²	129.8	92%	0.921	69%	0.687	S	S	*	*			trans	93	106.8	159.3	-74.8	-177.9	168.8	175.8	-2.8	120.9
916	H	32.1	Very low	40.8	Very low	175 Å²	175	135.1 Å²	135.1	81%	0.81	72%	0.721	S	S	*	*			trans	-41.3	134.4	152.5	-103.4	-45.5	0	0	0	117.6
917	R	30.2	Very low	38.9	Very low	225 Å²	225	137.4 Å²	137.4	85%	0.849	74%	0.74	S	S	*	*				72.7	158.6	124.2	-110.9	-161.5	170.8	168.1	-2	120.4
918	P	51.3	Low	37	Very low	97 Å²	97	139.1 Å²	139.1	63%	0.63	75%	0.748	S	S	*	*				-125.6	176.9	-108.5	39.8	-21.7	0	0	0	113.5
919	T	25.9	Very low	35.5	Very low	129 Å²	129	144.7 Å²	144.7	79%	0.791	78%	0.775	S	S	*	*				164.7	121.3	128.6	42	0	0	0	0	113.1
920	Q	29.3	Very low	34	Very low	174 Å²	174	145 Å²	145	81%	0.813	79%	0.792	S	S	*	*			trans	45	132.7	133.8	-72.9	-176.2	-3.3	0	0	123.7
921	K	26.9	Very low	33.2	Very low	168 Å²	168	147.4 Å²	147.4	73%	0.73	80%	0.799	S	S	*	*			trans	78.7	147	149.6	-73.6	-174.3	172.6	-156.6	0	117.4
922	E	26.9	Very low	32.2	Very low	138 Å²	138	145.8 Å²	145.8	65%	0.645	80%	0.799	S	S	*	*			cis	-171.6	146.3	-17	-118.9	164.7	-179.4	0	0	103.5
923	E	27.4	Very low	32.1	Very low	187 Å²	187	149.3 Å²	149.3	87%	0.874	82%	0.816	S	S	*	*			trans	67.2	136.7	153.4	-63.3	179.4	166.9	0	0	122
924	G	26.5	Very low	31.8	Very low	80 Å²	80	142.4 Å²	142.4	83%	0.825	81%	0.805	S	S	*	*			trans	142	77.3	148.5	0	0	0	0	0	116.5
925	D	28.3	Very low	32.3	Very low	153 Å²	153	141.6 Å²	141.6	82%	0.818	80%	0.804	S	S	*	*			trans	-28.6	137.9	164	-66.3	-42.9	0	0	0	117.6
926	T	27.8	Very low	33.2	Very low	144 Å²	144	134.2 Å²	134.2	88%	0.883	79%	0.786	S	S	*	*				162.3	148.2	102.4	40.7	0	0	0	0	111.9
927	A	31.9	Very low	34.7	Very low	103 Å²	103	128.8 Å²	128.8	85%	0.851	77%	0.768	S	S	*	*			trans	-57	144.8	-171	0	0	0	0	0	116.7
928	S	27.7	Very low	36.5	Very low	104 Å²	104	124.2 Å²	124.2	73%	0.727	75%	0.751	S	S	*	*				-170.9	122.6	122.5	-163.7	0	0	0	0	112.6
929	L	32.1	Very low	37.5	Very low	171 Å²	171	127.4 Å²	127.4	90%	0.895	76%	0.757	S	S	*	*			trans	18.1	121.4	141.8	-66.3	150.6	0	0	0	118.8
930	G	27.4	Very low	39.8	Very low	76 Å²	76	126.3 Å²	126.3	78%	0.784	74%	0.743	S	S	*	*			trans	159.9	103.6	154.2	0	0	0	0	0	114.2
931	K	36.8	Very low	41.9	Very low	222 Å²	222	118.2 Å²	118.2	97%	0.965	71%	0.705	S	S	*	*			trans	18.3	105.8	152.1	-76.7	177	173.1	176.9	0	116.4
932	G	29.7	Very low	44.1	Very low	68 Å²	68	112.7 Å²	112.7	70%	0.701	69%	0.686	S	S	*	*			trans	-147.7	106.8	158.2	0	0	0	0	0	108.7	G934	G932-G934 VanDerWaalsContact C-N 3.27Å; G932-G934 PolarHBondContact O-N 3.38Å
933	V	44.7	Very low	46.4	Very low	166 Å²	166	108.7 Å²	108.7	100%	1.006	67%	0.673	S	S	*	*			trans	-53.1	94.8	163.3	174.6	0	0	0	0	106.9
934	G	34.6	Very low	48.7	Very low	65 Å²	65	102.7 Å²	102.7	67%	0.67	65%	0.647	S	S	*	*			trans	-127.7	91.3	-162.7	0	0	0	0	0	111	G932	G932-G934 VanDerWaalsContact C-N 3.27Å; G932-G934 PolarHBondContact O-N 3.38Å
935	A	47.2	Very low	51	Low	84 Å²	84	99.3 Å²	99.3	69%	0.694	61%	0.61	S	S	*	*			trans	39	96.9	161.8	0	0	0	0	0	116	S937	A935-S937 PolarHBondContact O-N 3Å
936	T	53	Low	53.3	Low	89 Å²	89	94.1 Å²	94.1	55%	0.546	58%	0.582	S	S	.	*			trans	-49	112.5	155.4	11.9	0	0	0	0	107.3
937	S	62.5	Low	55.7	Low	62 Å²	62	92.3 Å²	92.3	43%	0.434	57%	0.567	S	S	.	*			trans	-64.3	142.4	-172.9	-66.6	0	0	0	0	107.7	A935 E939 Q940 I941	A935-S937 PolarHBondContact O-N 3Å; S937-E939 PolarHBondContact O-N 2.89Å; S937-Q940 WeakPolarHBondContact O-CA 3.5Å; S937-Q940 WeakPolarHBondContact O-CB 3.48Å; S937-Q940 PolarHBondContact O-N 3.36Å; S937-I941 PolarHBondContact O-N 3.4Å
938	R	69.7	Low	57.7	Low	128 Å²	128	88.5 Å²	88.5	48%	0.483	53%	0.532	S	S	.	.	H	α-helix	trans	-48.1	-35.6	179.7	178.9	-177.2	166	94.7	2.7	111.8	T909 I941 V942	T909-R938 PolarHBondContact OG1-NH1 2.94Å; R938-I941 PolarHBondContact O-N 3.49Å; R938-V942 VanDerWaalsContact O-CG2 3.27Å; R938-V942 WeakPolarHBondContact O-CG2 3.27Å; R938-V942 PolarHBondContact O-N 3.36Å
939	E	70.9	Confident	59.9	Low	164 Å²	164	83.6 Å²	83.6	77%	0.766	50%	0.498	S	S	*	.	H	α-helix	trans	-64.5	-37.3	176	-69.4	168.3	-179.2	0	0	113.8	S937 V942 S943	S937-E939 PolarHBondContact O-N 2.89Å; E939-V942 PolarHBondContact O-N 3.17Å; E939-S943 WeakPolarHBondContact O-CB 3.48Å; E939-S943 PolarHBondContact O-N 3.48Å
940	Q	74.4	Confident	61.8	Low	106 Å²	106	77 Å²	77	50%	0.495	47%	0.468	S	S	.	.	H	α-helix	trans	-69.3	-39.3	174.4	-71.4	173.5	-24.3	0	0	111.4	S937 V942 S943 D944	S937-Q940 WeakPolarHBondContact O-CA 3.5Å; S937-Q940 WeakPolarHBondContact O-CB 3.48Å; S937-Q940 PolarHBondContact O-N 3.36Å; Q940-V942 VanDerWaalsContact C-N 3.33Å; Q940-S943 PolarHBondContact O-N 3.5Å; Q940-D944 WeakPolarHBondContact O-CB 3.42Å; Q940-D944 VanDerWaalsContact O-CG 3.3Å; Q940-D944 PolarHBondContact O-N 2.88Å
941	I	72.6	Confident	63.9	Low	4 Å²	4	76.6 Å²	76.6	2%	0.021	45%	0.453	C	S	.	.	H	α-helix	trans	-67.7	-37.5	176.9	-53.4	177.7	0	0	0	110.3	L901 K904 L905 S937 R938 I945	L901-I941 HydrophobicContact CB-CG2 4.32Å; L901-I941 HydrophobicContact CD2-CG2 4.06Å; K904-I941 HydrophobicContact CB-CD1 4.34Å; L905-I941 HydrophobicContact CB-CG2 4.12Å; L905-I941 HydrophobicContact CD1-CB 4.42Å; L905-I941 HydrophobicContact CD1-CG2 3.89Å; L905-I941 HydrophobicContact CG-CG2 4.2Å; S937-I941 PolarHBondContact O-N 3.4Å; R938-I941 PolarHBondContact O-N 3.49Å; I941-I945 HydrophobicContact CG2-CD1 4.17Å; I941-I945 WeakPolarHBondContact O-CB 3.43Å; I941-I945 WeakPolarHBondContact O-CD1 3.39Å; I941-I945 WeakPolarHBondContact O-CG1 3.38Å; I941-I945 PolarHBondContact O-N 3.46Å; I941-I945 VanDerWaalsContact O-N 3.12Å
942	V	73.4	Confident	65.7	Low	52 Å²	52	69.3 Å²	69.3	32%	0.315	42%	0.422	S	S	.	.	H	α-helix	trans	-65.8	-43.8	172.4	173	0	0	0	0	110.7	L905 R938 E939 Q940 D944 I945 D946	L905-V942 HydrophobicContact CD1-CG2 3.81Å; R938-V942 VanDerWaalsContact O-CG2 3.27Å; R938-V942 WeakPolarHBondContact O-CG2 3.27Å; R938-V942 PolarHBondContact O-N 3.36Å; E939-V942 PolarHBondContact O-N 3.17Å; Q940-V942 VanDerWaalsContact C-N 3.33Å; V942-D944 PolarHBondContact O-N 3.1Å; V942-I945 PolarHBondContact O-N 2.78Å; V942-D946 WeakPolarHBondContact O-CB 3.4Å; V942-D946 PolarHBondContact O-N 2.85Å
943	S	75.8	Confident	67.9	Low	55 Å²	55	66.5 Å²	66.5	39%	0.385	39%	0.392	S	S	.	.	H	α-helix	trans	-61.2	-43.7	176.3	-169.3	0	0	0	0	112.6	E939 Q940 I945 D946 D947	E939-S943 WeakPolarHBondContact O-CB 3.48Å; E939-S943 PolarHBondContact O-N 3.48Å; Q940-S943 PolarHBondContact O-N 3.5Å; S943-I945 VanDerWaalsContact C-N 3.26Å; S943-I945 PolarHBondContact O-N 3.15Å; S943-D946 CarbonylContact O-C 3.55Å; S943-D946 PolarHBondContact O-N 3.5Å; S943-D947 WeakPolarHBondContact O-CB 3.23Å; S943-D947 VanDerWaalsContact O-CG 3.27Å; S943-D947 PolarHBondContact O-N 3.35Å
944	D	75.6	Confident	69.2	Low	61 Å²	61	59.3 Å²	59.3	33%	0.326	35%	0.349	S	S	.	.	H	α-helix	trans	-65.3	-32.9	177.8	-74.5	-10.2	0	0	0	111.7	L901 Q940 V942 I948	L901-D944 HydrophobicContact CD1-CB 4.04Å; L901-D944 HydrophobicContact CD2-CB 4.49Å; Q940-D944 WeakPolarHBondContact O-CB 3.42Å; Q940-D944 VanDerWaalsContact O-CG 3.3Å; Q940-D944 PolarHBondContact O-N 2.88Å; V942-D944 PolarHBondContact O-N 3.1Å; D944-I948 WeakPolarHBondContact O-CD1 3.19Å; D944-I948 VanDerWaalsContact O-CG1 3.29Å; D944-I948 WeakPolarHBondContact O-CG1 3.27Å; D944-I948 PolarHBondContact O-N 3.01Å
945	I	74.9	Confident	70.9	Confident	9 Å²	9	60.6 Å²	60.6	5%	0.046	33%	0.334	C	S	.	.	H	α-helix	trans	-72.2	-42.7	174	-72.6	171.2	0	0	0	110.1	F883 L901 L905 I941 V942 S943 D947 I948 V949	F883-I945 HydrophobicContact CE1-CG2 3.69Å; F883-I945 HydrophobicContact CZ-CG2 3.3Å; L901-I945 HydrophobicContact CB-CD1 4.01Å; L901-I945 HydrophobicContact CB-CG1 3.78Å; L901-I945 HydrophobicContact CD1-CG1 4.13Å; L905-I945 HydrophobicContact CD1-CD1 3.49Å; L905-I945 VanDerWaalsContact CD1-CD1 3.49Å; I941-I945 HydrophobicContact CG2-CD1 4.17Å; I941-I945 WeakPolarHBondContact O-CB 3.43Å; I941-I945 WeakPolarHBondContact O-CD1 3.39Å; I941-I945 WeakPolarHBondContact O-CG1 3.38Å; I941-I945 PolarHBondContact O-N 3.46Å; I941-I945 VanDerWaalsContact O-N 3.12Å; V942-I945 PolarHBondContact O-N 2.78Å; S943-I945 VanDerWaalsContact C-N 3.26Å; S943-I945 PolarHBondContact O-N 3.15Å; I945-D947 VanDerWaalsContact C-N 3.34Å; I945-D947 PolarHBondContact O-N 3.47Å; I945-I948 PolarHBondContact O-N 3.47Å; I945-V949 HydrophobicContact CG2-CG2 4.41Å; I945-V949 WeakPolarHBondContact O-CB 3.17Å; I945-V949 WeakPolarHBondContact O-CG2 3.41Å; I945-V949 PolarHBondContact O-N 3.43Å
946	D	75.7	Confident	72	Confident	44 Å²	44	60.3 Å²	60.3	24%	0.235	33%	0.326	C	S	.	.	H	α-helix	trans	-62.6	-40	176.7	-69.6	-11.4	0	0	0	111.1	Y869 V942 S943 I948 V949 A950	Y869-D946 PolarHBondContact OH-OD1 3.21Å; V942-D946 WeakPolarHBondContact O-CB 3.4Å; V942-D946 PolarHBondContact O-N 2.85Å; S943-D946 CarbonylContact O-C 3.55Å; S943-D946 PolarHBondContact O-N 3.5Å; D946-I948 PolarHBondContact O-N 2.96Å; D946-V949 PolarHBondContact O-N 3.42Å; D946-A950 WeakPolarHBondContact O-CA 3.33Å; D946-A950 VanDerWaalsContact O-CB 3.27Å; D946-A950 WeakPolarHBondContact O-CB 3.42Å; D946-A950 PolarHBondContact O-N 3.04Å
947	D	79.1	Confident	72.9	Confident	106 Å²	106	56.8 Å²	56.8	57%	0.567	31%	0.307	S	S	*	.	H	α-helix	trans	-63.9	-28.2	176.3	-75.1	-20	0	0	0	112.5	S943 I945 S951	S943-D947 WeakPolarHBondContact O-CB 3.23Å; S943-D947 VanDerWaalsContact O-CG 3.27Å; S943-D947 PolarHBondContact O-N 3.35Å; I945-D947 VanDerWaalsContact C-N 3.34Å; I945-D947 PolarHBondContact O-N 3.47Å; D947-S951 WeakPolarHBondContact O-CB 3.46Å
948	I	74.3	Confident	73.2	Confident	22 Å²	22	58.8 Å²	58.8	11%	0.113	31%	0.31	C	S	.	.	H	α-helix	trans	-84.2	-37.6	176.8	-64.4	167.5	0	0	0	111.1	L890 L898 L901 D944 I945 D946	L890-I948 HydrophobicContact CD1-CG2 4.14Å; L890-I948 HydrophobicContact CD2-CG2 3.99Å; L898-I948 HydrophobicContact CD1-CB 4.41Å; L898-I948 HydrophobicContact CD1-CG2 3.78Å; L901-I948 HydrophobicContact CD1-CD1 3.99Å; D944-I948 WeakPolarHBondContact O-CD1 3.19Å; D944-I948 VanDerWaalsContact O-CG1 3.29Å; D944-I948 WeakPolarHBondContact O-CG1 3.27Å; D944-I948 PolarHBondContact O-N 3.01Å; I945-I948 PolarHBondContact O-N 3.47Å; D946-I948 PolarHBondContact O-N 2.96Å
949	V	73.6	Confident	73.2	Confident	2 Å²	2	54 Å²	54	1%	0.012	29%	0.294	C	S	.	.	H	α-helix	trans	-93	-33.7	-170.5	176.4	0	0	0	0	112.8	L882 F883 L898 I945 D946	L882-V949 HydrophobicContact CD2-CG1 3.87Å; L882-V949 HydrophobicContact CG-CG1 3.86Å; F883-V949 HydrophobicContact CD1-CG1 4.31Å; F883-V949 HydrophobicContact CD1-CG2 3.89Å; F883-V949 HydrophobicContact CD2-CG1 4.36Å; F883-V949 HydrophobicContact CE1-CB 4.38Å; F883-V949 HydrophobicContact CE1-CG1 4.36Å; F883-V949 HydrophobicContact CE1-CG2 3.48Å; F883-V949 VanDerWaalsContact CE1-CG2 3.48Å; F883-V949 HydrophobicContact CE2-CG1 4.31Å; F883-V949 HydrophobicContact CG-CG1 4.32Å; F883-V949 HydrophobicContact CZ-CB 4.38Å; F883-V949 HydrophobicContact CZ-CG1 4.33Å; F883-V949 HydrophobicContact CZ-CG2 3.89Å; L898-V949 HydrophobicContact CD1-CG2 3.56Å; I945-V949 HydrophobicContact CG2-CG2 4.41Å; I945-V949 WeakPolarHBondContact O-CB 3.17Å; I945-V949 WeakPolarHBondContact O-CG2 3.41Å; I945-V949 PolarHBondContact O-N 3.43Å; D946-V949 PolarHBondContact O-N 3.42Å
950	A	71.9	Confident	73	Confident	31 Å²	31	50 Å²	50	26%	0.256	28%	0.276	S	S	.	.	S	Bend	trans	-101.6	16.5	178.7	0	0	0	0	0	112.9	Y869 F871 D946 E952	Y869-A950 HydrophobicContact CD1-CB 4.1Å; Y869-A950 HydrophobicContact CE1-CB 4.19Å; F871-A950 HydrophobicContact CE1-CB 4.23Å; F871-A950 HydrophobicContact CZ-CB 4.25Å; D946-A950 WeakPolarHBondContact O-CA 3.33Å; D946-A950 VanDerWaalsContact O-CB 3.27Å; D946-A950 WeakPolarHBondContact O-CB 3.42Å; D946-A950 PolarHBondContact O-N 3.04Å; A950-E952 PolarHBondContact O-N 2.95Å
951	S	72.5	Confident	72.7	Confident	69 Å²	69	50.4 Å²	50.4	48%	0.483	28%	0.28	S	S	.	.	S	Bend	trans	-60.5	-35.9	177.7	66.3	0	0	0	0	112.5	D947	D947-S951 WeakPolarHBondContact O-CB 3.46Å
952	E	74	Confident	72.4	Confident	68 Å²	68	56 Å²	56	32%	0.318	30%	0.304	S	S	.	.	S	Bend	trans	-142.3	146.5	-179	-67.6	179.9	-152.5	0	0	110.5	A950 V954 E958	A950-E952 PolarHBondContact O-N 2.95Å; E952-V954 PolarHBondContact O-N 3.4Å; E952-E958 PolarHBondContact OE2-N 2.92Å
953	C	75.8	Confident	72	Confident	10 Å²	10	55 Å²	55	7%	0.068	30%	0.3	C	S	.	.			trans	-72.4	127.2	171.8	172.2	0	0	0	0	109.9	F871 C873 H875 Y955 C956 G957	F871-C953 HydrophobicContact CB-CB 4.21Å; F871-C953 HydrophobicContact CD1-CB 3.92Å; F871-C953 HydrophobicContact CD2-CB 4.22Å; F871-C953 HydrophobicContact CE1-CB 4.31Å; F871-C953 HydrophobicContact CG-CB 3.86Å; C873-C953 PolarHBondContact SG-SG 3.03Å; H875-C953 PolarHBondContact ND1-SG 3.22Å; H875-C953 VanDerWaalsContact ND1-SG 3.39Å; C953-Y955 PolarHBondContact O-N 3.11Å; C953-Y955 VanDerWaalsContact O-N 3.13Å; C953-C956 HydrophobicContact CB-CB 4.22Å; C953-C956 PolarHBondContact O-N 3.4Å; C953-C956 VanDerWaalsContact O-N 3.12Å; C953-G957 WeakPolarHBondContact O-CA 3.06Å; C953-G957 PolarHBondContact O-N 2.89Å
954	V	71.9	Confident	71.5	Confident	15 Å²	15	58.2 Å²	58.2	9%	0.091	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-40	-178	178.8	0	0	0	0	113	L882 E885 V886 E952 M960	L882-V954 HydrophobicContact CD1-CG2 3.64Å; E885-V954 HydrophobicContact CB-CG1 4.37Å; E885-V954 HydrophobicContact CB-CG2 4.35Å; V886-V954 HydrophobicContact CG2-CG2 3.6Å; E952-V954 PolarHBondContact O-N 3.4Å; V954-M960 WeakPolarHBondContact O-CB 3.46Å; V954-M960 PolarHBondContact O-N 3.18Å
955	Y	70.8	Confident	70.8	Confident	92 Å²	92	62.3 Å²	62.3	36%	0.361	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-15.7	-178	-63.1	-35	0	0	0	116	A857 F877 C953 M960	A857-Y955 HydrophobicContact CB-CE2 3.87Å; F877-Y955 HydrophobicContact CE1-CD2 4.06Å; F877-Y955 AromaticContact CE1-CE2 3.59Å; F877-Y955 HydrophobicContact CE1-CE2 3.59Å; F877-Y955 AromaticContact CZ-CD2 3.58Å; F877-Y955 HydrophobicContact CZ-CD2 3.58Å; F877-Y955 AromaticContact CZ-CE2 3.64Å; F877-Y955 HydrophobicContact CZ-CE2 3.64Å; F877-Y955 HydrophobicContact CZ-CG 4.32Å; C953-Y955 PolarHBondContact O-N 3.11Å; C953-Y955 VanDerWaalsContact O-N 3.13Å; Y955-M960 HydrophobicContact CD1-SD 4.44Å
956	C	70.5	Confident	70.2	Confident	78 Å²	78	66.9 Å²	66.9	53%	0.527	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-13.8	-176.7	-62.2	0	0	0	0	113.8	H875 C953	H875-C956 PolarHBondContact CE1-SG 2.9Å; H875-C956 PolarHBondContact ND1-SG 3.39Å; H875-C956 VanDerWaalsContact ND1-SG 3.4Å; C953-C956 HydrophobicContact CB-CB 4.22Å; C953-C956 PolarHBondContact O-N 3.4Å; C953-C956 VanDerWaalsContact O-N 3.12Å
957	G	71.1	Confident	69.6	Low	15 Å²	15	69.2 Å²	69.2	16%	0.155	37%	0.37	C	S	.	.	S	Bend	trans	-87.8	-176.3	-179	0	0	0	0	0	112.8	C953 L959 M960	C953-G957 WeakPolarHBondContact O-CA 3.06Å; C953-G957 PolarHBondContact O-N 2.89Å; G957-L959 PolarHBondContact O-N 3.26Å; G957-L959 VanDerWaalsContact O-N 3.17Å; G957-M960 PolarHBondContact O-N 3.42Å
958	E	68.9	Low	68.7	Low	104 Å²	104	74.7 Å²	74.7	49%	0.486	39%	0.389	S	S	.	.	H	α-helix	trans	-63.8	-22.4	179.6	-64.2	-171.4	173.5	0	0	112.4	E952 M960 I961 K962	E952-E958 PolarHBondContact OE2-N 2.92Å; E958-M960 VanDerWaalsContact C-N 3.31Å; E958-M960 PolarHBondContact O-N 2.94Å; E958-I961 PolarHBondContact O-N 3.36Å; E958-K962 WeakPolarHBondContact O-CG 3.34Å; E958-K962 PolarHBondContact O-N 2.98Å; E958-K962 IonicContact OE2-NZ 2.82Å; E958-K962 PolarHBondContact OE2-NZ 3.28Å
959	L	68.8	Low	68.1	Low	28 Å²	28	77.4 Å²	77.4	15%	0.147	40%	0.403	C	S	.	.	H	α-helix	trans	-58	-41.3	177.1	-64.4	178.1	0	0	0	112.2	V886 H889 G957 K962 S963	V886-L959 HydrophobicContact CG2-CD1 4.42Å; H889-L959 HydrophobicContact CB-CD2 3.82Å; G957-L959 PolarHBondContact O-N 3.26Å; G957-L959 VanDerWaalsContact O-N 3.17Å; L959-K962 PolarHBondContact O-N 3.32Å; L959-S963 PolarHBondContact O-N 3.4Å; L959-S963 VanDerWaalsContact O-N 3.1Å
960	M	67.7	Low	67.7	Low	78 Å²	78	81.9 Å²	81.9	38%	0.384	43%	0.427	S	S	.	.	H	α-helix	trans	-64.4	-45.1	176	-170.4	63	-140	0	0	110.8	V954 Y955 G957 E958 K962 S963 I964	V954-M960 WeakPolarHBondContact O-CB 3.46Å; V954-M960 PolarHBondContact O-N 3.18Å; Y955-M960 HydrophobicContact CD1-SD 4.44Å; G957-M960 PolarHBondContact O-N 3.42Å; E958-M960 VanDerWaalsContact C-N 3.31Å; E958-M960 PolarHBondContact O-N 2.94Å; M960-K962 VanDerWaalsContact C-N 3.3Å; M960-K962 PolarHBondContact O-N 3.22Å; M960-S963 WeakPolarHBondContact CE-OG 3.38Å; M960-S963 PolarHBondContact O-N 3.02Å; M960-S963 PolarHBondContact O-OG 3.25Å; M960-I964 PolarHBondContact O-N 2.92Å
961	I	68.5	Low	67.1	Low	116 Å²	116	85 Å²	85	60%	0.595	45%	0.445	S	S	*	.	H	α-helix	trans	-59.5	-44.2	179.5	-60.7	171.7	0	0	0	110.4	E958 S963 I964	E958-I961 PolarHBondContact O-N 3.36Å; I961-S963 PolarHBondContact O-N 2.78Å; I961-I964 PolarHBondContact O-N 3.35Å
962	K	65.9	Low	66.5	Low	121 Å²	121	89.7 Å²	89.7	53%	0.526	46%	0.459	S	S	.	.	H	α-helix	trans	-69.3	-19	178	-69.6	168.7	-172.9	155.8	0	113.6	E958 L959 M960	E958-K962 WeakPolarHBondContact O-CG 3.34Å; E958-K962 PolarHBondContact O-N 2.98Å; E958-K962 IonicContact OE2-NZ 2.82Å; E958-K962 PolarHBondContact OE2-NZ 3.28Å; L959-K962 PolarHBondContact O-N 3.32Å; M960-K962 VanDerWaalsContact C-N 3.3Å; M960-K962 PolarHBondContact O-N 3.22Å
963	S	64.1	Low	65.8	Low	32 Å²	32	92.1 Å²	92.1	22%	0.224	47%	0.469	C	S	.	.	H	α-helix	trans	-83.9	-16.7	178.8	72.7	0	0	0	0	114.3	L959 M960 I961 D965 K966	L959-S963 PolarHBondContact O-N 3.4Å; L959-S963 VanDerWaalsContact O-N 3.1Å; M960-S963 WeakPolarHBondContact CE-OG 3.38Å; M960-S963 PolarHBondContact O-N 3.02Å; M960-S963 PolarHBondContact O-OG 3.25Å; I961-S963 PolarHBondContact O-N 2.78Å; S963-D965 PolarHBondContact O-N 3.25Å; S963-K966 PolarHBondContact O-N 3.23Å; S963-K966 VanDerWaalsContact O-N 3.14Å
964	I	65.9	Low	65.4	Low	122 Å²	122	96.7 Å²	96.7	63%	0.626	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-34	-179.4	-66.6	168.9	0	0	0	111.7	M960 I961 K966	M960-I964 PolarHBondContact O-N 2.92Å; I961-I964 PolarHBondContact O-N 3.35Å; I964-K966 VanDerWaalsContact C-N 3.29Å; I964-K966 PolarHBondContact O-N 3.43Å
965	D	61.5	Low	65	Low	146 Å²	146	103.3 Å²	103.3	78%	0.781	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-1.8	-177.9	-62.8	-36.3	0	0	0	113.6	S963	S963-D965 PolarHBondContact O-N 3.25Å
966	K	61.8	Low	64.7	Low	106 Å²	106	105.3 Å²	105.3	46%	0.461	53%	0.53	S	S	.	.	S	Bend	trans	-87.5	130.1	178.2	-71.2	-172.4	179.6	-177.1	0	110.8	H889 S963 I964	H889-K966 PolarHBondContact CE1-NZ 3.28Å; H889-K966 PolarHBondContact ND1-NZ 3.27Å; S963-K966 PolarHBondContact O-N 3.23Å; S963-K966 VanDerWaalsContact O-N 3.14Å; I964-K966 VanDerWaalsContact C-N 3.29Å; I964-K966 PolarHBondContact O-N 3.43Å
967	P	62.9	Low	64.5	Low	92 Å²	92	105 Å²	105	60%	0.597	52%	0.523	S	S	*	.			trans	-65	139.8	176.7	26.5	-32.8	0	0	0	111.1	I969	P967-I969 PolarHBondContact O-N 3.45Å; P967-I969 VanDerWaalsContact O-N 3.07Å
968	F	60.8	Low	64.2	Low	221 Å²	221	110.3 Å²	110.3	97%	0.969	54%	0.542	S	S	*	.	S	Bend	trans	-58.1	-22.5	-178.3	-72.9	-78.1	0	0	0	114.7
969	I	61.9	Low	63.9	Low	79 Å²	79	109 Å²	109	41%	0.405	54%	0.544	S	S	.	.	S	Bend	trans	-125	126.6	174.3	-55.5	170.8	0	0	0	107.3	P967 F974	P967-I969 PolarHBondContact O-N 3.45Å; P967-I969 VanDerWaalsContact O-N 3.07Å; I969-F974 HydrophobicContact CB-CD2 4.36Å; I969-F974 HydrophobicContact CD1-CD2 4.12Å; I969-F974 HydrophobicContact CD1-CE2 4.38Å; I969-F974 HydrophobicContact CG2-CB 3.97Å; I969-F974 HydrophobicContact CG2-CD2 3.95Å; I969-F974 HydrophobicContact CG2-CG 4.48Å
970	D	63.9	Low	63.9	Low	97 Å²	97	111.2 Å²	111.2	52%	0.519	56%	0.562	S	S	.	*			trans	-62.7	122.4	176.4	-147.7	-12.3	0	0	0	108.6	Q972 K973 F974	D970-Q972 PolarHBondContact O-N 3.25Å; D970-K973 HydrophobicContact CB-CB 4.45Å; D970-K973 PolarHBondContact O-N 3.41Å; D970-F974 PolarHBondContact O-N 3.49Å
971	P	60.5	Low	63.8	Low	95 Å²	95	118.2 Å²	118.2	62%	0.617	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	-23.2	-171.4	17.2	-30.7	0	0	0	113.7
972	Q	59	Low	62.8	Low	169 Å²	169	122 Å²	122	79%	0.79	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-24.7	176.1	-64	-177.2	-1.4	0	0	113.8	D970	D970-Q972 PolarHBondContact O-N 3.25Å
973	K	59.8	Low	62.6	Low	119 Å²	119	122 Å²	122	52%	0.517	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96	-13.4	175.4	-73.4	-177.2	-180	172.9	0	113.2	D970 E975 Q976 D977	D970-K973 HydrophobicContact CB-CB 4.45Å; D970-K973 PolarHBondContact O-N 3.41Å; K973-E975 VanDerWaalsContact C-N 3.25Å; K973-E975 PolarHBondContact O-N 3.37Å; K973-Q976 PolarHBondContact O-N 3.09Å; K973-D977 PolarHBondContact O-N 3.39Å
974	F	67.9	Low	62.5	Low	105 Å²	105	126.7 Å²	126.7	46%	0.461	63%	0.629	S	S	.	*	H	α-helix	trans	-54.2	-38.5	177.5	-175.9	-101.2	0	0	0	113.1	I969 D970 K978	I969-F974 HydrophobicContact CB-CD2 4.36Å; I969-F974 HydrophobicContact CD1-CD2 4.12Å; I969-F974 HydrophobicContact CD1-CE2 4.38Å; I969-F974 HydrophobicContact CG2-CB 3.97Å; I969-F974 HydrophobicContact CG2-CD2 3.95Å; I969-F974 HydrophobicContact CG2-CG 4.48Å; D970-F974 PolarHBondContact O-N 3.49Å; F974-K978 HydrophobicContact CE1-CD 4.17Å; F974-K978 WeakPolarHBondContact O-CB 3.41Å; F974-K978 PolarHBondContact O-N 2.99Å
975	E	62.2	Low	62.3	Low	155 Å²	155	127 Å²	127	72%	0.724	63%	0.629	S	S	*	*	H	α-helix	trans	-71.6	-33.8	176.4	-75	-169	154.6	0	0	113.4	K973 S979	K973-E975 VanDerWaalsContact C-N 3.25Å; K973-E975 PolarHBondContact O-N 3.37Å; E975-S979 WeakPolarHBondContact O-CB 3.26Å; E975-S979 PolarHBondContact O-N 2.73Å; E975-S979 VanDerWaalsContact O-N 3.11Å; E975-S979 PolarHBondContact O-OG 3.08Å
976	Q	64.8	Low	62.4	Low	133 Å²	133	125.9 Å²	125.9	62%	0.621	62%	0.62	S	S	*	*	H	α-helix	trans	-72	-43.6	175.8	-73.5	-177.5	-6.2	0	0	111.4	K973 S979 S980	K973-Q976 PolarHBondContact O-N 3.09Å; Q976-S979 WeakPolarHBondContact CA-OG 3.23Å; Q976-S979 PolarHBondContact O-N 3.34Å; Q976-S979 PolarHBondContact O-OG 3.46Å; Q976-S980 PolarHBondContact O-N 3.24Å
977	D	66.7	Low	62.4	Low	72 Å²	72	127.1 Å²	127.1	39%	0.385	63%	0.63	S	S	.	*	H	α-helix	trans	-70.4	-40.1	178.8	-71.8	-20.5	0	0	0	111	K973 S979 S980 W981	K973-D977 PolarHBondContact O-N 3.39Å; D977-S979 VanDerWaalsContact C-N 3.27Å; D977-S979 PolarHBondContact O-N 3.08Å; D977-S980 WeakPolarHBondContact CA-OG 3.48Å; D977-S980 PolarHBondContact O-N 3.4Å; D977-S980 PolarHBondContact O-OG 3.33Å; D977-W981 PolarHBondContact O-N 3.45Å; D977-W981 VanDerWaalsContact O-N 3.14Å
978	K	65.8	Low	62.4	Low	126 Å²	126	129.5 Å²	129.5	55%	0.548	63%	0.632	S	S	.	*	H	α-helix	trans	-60.4	-34.5	173.1	-175.4	179.2	179.2	-176	0	112.8	F974 L982	F974-K978 HydrophobicContact CE1-CD 4.17Å; F974-K978 WeakPolarHBondContact O-CB 3.41Å; F974-K978 PolarHBondContact O-N 2.99Å; K978-L982 PolarHBondContact O-N 3.41Å
979	S	61.2	Low	62.5	Low	76 Å²	76	122.9 Å²	122.9	53%	0.531	61%	0.608	S	S	.	*	H	α-helix	trans	-79.6	-18.8	175.9	50.2	0	0	0	0	113.6	E975 Q976 D977	E975-S979 WeakPolarHBondContact O-CB 3.26Å; E975-S979 PolarHBondContact O-N 2.73Å; E975-S979 VanDerWaalsContact O-N 3.11Å; E975-S979 PolarHBondContact O-OG 3.08Å; Q976-S979 WeakPolarHBondContact CA-OG 3.23Å; Q976-S979 PolarHBondContact O-N 3.34Å; Q976-S979 PolarHBondContact O-OG 3.46Å; D977-S979 VanDerWaalsContact C-N 3.27Å; D977-S979 PolarHBondContact O-N 3.08Å
980	S	70	Confident	62.5	Low	75 Å²	75	126.3 Å²	126.3	52%	0.524	62%	0.624	S	S	.	*	H	α-helix	trans	-83.1	-16.2	171.2	73.9	0	0	0	0	113.8	Q976 D977	Q976-S980 PolarHBondContact O-N 3.24Å; D977-S980 WeakPolarHBondContact CA-OG 3.48Å; D977-S980 PolarHBondContact O-N 3.4Å; D977-S980 PolarHBondContact O-OG 3.33Å
981	W	65.5	Low	62.4	Low	226 Å²	226	128.8 Å²	128.8	86%	0.856	63%	0.633	S	S	*	*			trans	-98.3	-7	179.3	-67.7	24.5	0	0	0	113	D977	D977-W981 PolarHBondContact O-N 3.45Å; D977-W981 VanDerWaalsContact O-N 3.14Å
982	L	45.9	Very low	62.6	Low	194 Å²	194	131.8 Å²	131.8	100%	1.016	63%	0.634	S	S	*	*			trans	-96.6	0	166.7	-86.1	162.9	0	0	0	109.5	K978	K978-L982 PolarHBondContact O-N 3.41Å

Retrieved 982 of 982 residues in 1917.1 ms (Link to these results)

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