A0A5K4F9P2_SCHMA Loading...

Ig-like domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F9P2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,201 aa.

						>A0A5K4F9P2_SCHMA|A0A5K4F9P2
MSINGKSNQKSILLILFYRFIIKLDYHYYYYYYYYYIIIILSWLLSLTMCKELMYNEQYYNIKNYIKGPENQTILYNSNTIMYCRIYNNNNITKLKSFYTEYINVQWIIDGFGVNNESLKAVFGDRYSMPGPIEEGNFDLLIKNTQLEDEASFICQANVKIYSTSSIEPQLDTITSKPAYLTIIFPPSGLTMIHLQDSQLEKNHQTPVTVNSMYILPNNHFTNYISDHSVNRHVYTTNELNQIVDRDLSRIVADDPKTELFIDYNRNYMDHFKQASDTQYTSHNIPLKEMLVRHESSSYTGNMYNRIPKIWTVEKKKLIVSCHTSPSKPASTIQWHLAGILLTKNSDKSHSFSDHQNSLIHYTIKEQIINVSDKSILSSNAESVLFPNTSVTSSTDDVHMQVTQSQLNLTVERKYQHWQLECSVSNSNDFVLAKLPTVTVTIEPMYIEDVKIQIINQTEQVNLREGQLIHFECIAKTSPLTPIYSWTIGNPVPSVNFETFNLLTDDQLKSNNNIDDKHEHNLIDIQMNASILQLTVNRAMHHKRIRCWVGVEAPELLEKITNASLQGVLSNKDSTCESDCRQLRNSLRKKLKDMTWVKSDYRLEVTYGPEFSSPSNDILSGELGQIIHLECSANSNPEADVSLYYIGPEGQILLEEVTKSELTQYQHHYNRPVDSKHPKYLVWNSETEYAEFNISIVKAAIHSSGRKLLGSDIKQVSHKLHLTSHEQFGFYACIAQTTGYPSIYRTVYVGQAESPKILKIDQSISLDGTFAELFCTIYSIPRPTVHQITWSINGISIKPDKRLRIYQEKTHRGVTSILTLNNLRPNDFSTYNCTVVNDYGSDWKLITLSSDNKWPLTFAVISGFAALLGVLFVTIICCFIRYTRLKGTNSKVYYKSKQENNLQNNEENKQISDGVELQSILKNKLNQTGLSKANPIEDVTLTNNECYPVQNVYKSNVDDTGIGKCTSHDLGSINFYTNDIDLSTNLIEENYLNYISCTYPQDTTSLLNNIHPMNGNACTNKMSTNYNQLPYCSTPLIDHQFNTIISNISPLSTSECFTNDMISNIKQSDITSIIHSHSPKPWIQNINELKNSMTPPLAFSSYTNHSTSLAPIFLMTSDLNYSTGIHQDFNNSNTSTVIIPPVILHSTNDQTLISSPYGPMTINNNNSSNNKNTSIMFNTTNSNDRNHIPDISIIPFNVRNC
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.8	Very low	36.4	Very low	240 Å²	240	145.7 Å²	145.7	100%	1.182	80%	0.803	S	S	*	*				0	130.8	0	-176.5	163.7	156.9	0	0	107.3
2	S	29.1	Very low	37.4	Very low	101 Å²	101	144.3 Å²	144.3	71%	0.706	79%	0.791	S	S	*	*			trans	68.2	117.5	176.7	-82	0	0	0	0	122.1
3	I	38.5	Very low	37.9	Very low	137 Å²	137	144.3 Å²	144.3	70%	0.703	79%	0.789	S	S	*	*				91.3	104.2	128.3	-63.2	167.7	0	0	0	120.4
4	N	35.7	Very low	38.6	Very low	158 Å²	158	144.7 Å²	144.7	85%	0.845	79%	0.789	S	S	*	*			trans	48.1	144.4	132.3	-53.3	-18.1	0	0	0	122.3
5	G	38	Very low	39.6	Very low	67 Å²	67	144.3 Å²	144.3	69%	0.691	78%	0.783	S	S	*	*			cis	155.5	172.6	-4.8	0	0	0	0	0	114.1
6	K	37.6	Very low	40.2	Very low	217 Å²	217	144.4 Å²	144.4	94%	0.943	78%	0.782	S	S	*	*			trans	70.2	146.9	174.5	-70.5	178.9	178.9	177.1	0	116.6
7	S	39.5	Very low	40.7	Very low	111 Å²	111	147.6 Å²	147.6	78%	0.776	79%	0.787	S	S	*	*			cis	-153	142.9	-2.9	-175.3	0	0	0	0	111.8
8	N	36.1	Very low	41.2	Very low	158 Å²	158	151.6 Å²	151.6	85%	0.845	79%	0.791	S	S	*	*			trans	-78	151.7	167.7	-86.2	-30.6	0	0	0	112.2
9	Q	38.6	Very low	41.5	Very low	156 Å²	156	155.9 Å²	155.9	73%	0.729	80%	0.796	S	S	*	*			trans	-153.7	139.5	144.9	-116.5	-168.3	24.7	0	0	114.2
10	K	35.7	Very low	41.7	Very low	146 Å²	146	158 Å²	158	64%	0.635	80%	0.8	S	S	*	*			trans	78.3	66.4	153.3	-66.4	167.3	175.9	152.1	0	119.2	I12	K10-I12 HydrophobicContact CB-CD1 4.3Å; K10-I12 HydrophobicContact CB-CG1 4.15Å; K10-I12 HydrophobicContact CD-CD1 4.36Å; K10-I12 HydrophobicContact CG-CD1 3.86Å; K10-I12 HydrophobicContact CG-CG1 4.22Å; K10-I12 PolarHBondContact O-N 2.75Å
11	S	40.1	Very low	42	Very low	112 Å²	112	158.4 Å²	158.4	78%	0.783	80%	0.802	S	S	*	*			trans	-54.6	85.2	134.3	168.3	0	0	0	0	111.4
12	I	48.1	Very low	42.6	Very low	128 Å²	128	154.4 Å²	154.4	66%	0.656	78%	0.784	S	S	*	*			trans	-143.2	56.2	169.6	-44.3	178.6	0	0	0	110.5	K10	K10-I12 HydrophobicContact CB-CD1 4.3Å; K10-I12 HydrophobicContact CB-CG1 4.15Å; K10-I12 HydrophobicContact CD-CD1 4.36Å; K10-I12 HydrophobicContact CG-CD1 3.86Å; K10-I12 HydrophobicContact CG-CG1 4.22Å; K10-I12 PolarHBondContact O-N 2.75Å
13	L	44	Very low	43.1	Very low	145 Å²	145	158.4 Å²	158.4	76%	0.759	79%	0.789	S	S	*	*	S	Bend	trans	-146.3	-9	169.3	-145.3	72.9	0	0	0	115.3
14	L	48.2	Very low	43	Very low	150 Å²	150	158.8 Å²	158.8	79%	0.785	79%	0.791	S	S	*	*	S	Bend	trans	-88.5	-2.6	-177.4	-110.4	133.9	0	0	0	114.8
15	I	53.1	Low	43.7	Very low	138 Å²	138	156.9 Å²	156.9	71%	0.708	78%	0.781	S	S	*	*	S	Bend	trans	-100.5	-14.1	-172.9	-65	174.5	0	0	0	112.7
16	L	49.5	Very low	43.8	Very low	147 Å²	147	163.3 Å²	163.3	77%	0.77	79%	0.786	S	S	*	*	S	Bend	trans	-92.1	-18.1	-177.7	-70.8	174	0	0	0	114.9
17	F	48.3	Very low	44.2	Very low	198 Å²	198	161.6 Å²	161.6	87%	0.868	78%	0.781	S	S	*	*	G	3₁₀ helix	trans	-80.1	-15.3	176.1	-100.2	-89	0	0	0	114.2	R19	F17-R19 PolarHBondContact O-N 3.15Å
18	Y	49.6	Very low	44.7	Very low	219 Å²	219	164.7 Å²	164.7	86%	0.859	78%	0.777	S	S	*	*	G	3₁₀ helix	trans	-90	12	-169.9	-126.6	-86.6	0	0	0	115.1
19	R	47.5	Very low	45.3	Very low	235 Å²	235	164.9 Å²	164.9	89%	0.887	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-133.6	13.6	-166	-122.8	-179.4	-174.3	-172.8	1.4	117.4	F17	F17-R19 PolarHBondContact O-N 3.15Å
20	F	45	Very low	45.9	Very low	197 Å²	197	166.3 Å²	166.3	86%	0.864	77%	0.767	S	S	*	*	S	Bend	trans	-130.8	7.7	-175.2	-136.4	-92.3	0	0	0	117.1
21	I	47.2	Very low	46.8	Very low	166 Å²	166	168.7 Å²	168.7	85%	0.851	77%	0.773	S	S	*	*			trans	-129.8	77.4	178.7	-50.3	-176.8	0	0	0	111.3
22	I	44.9	Very low	47.6	Very low	157 Å²	157	169.7 Å²	169.7	81%	0.805	76%	0.761	S	S	*	*			trans	-143.3	133.2	165.9	-65.1	-176.9	0	0	0	107.2
23	K	39.1	Very low	48.2	Very low	185 Å²	185	170.1 Å²	170.1	80%	0.804	76%	0.755	S	S	*	*			trans	67.6	136.9	-177.8	-76.5	177.9	175.3	-176.6	0	114.4
24	L	36.3	Very low	49.2	Very low	144 Å²	144	170 Å²	170	75%	0.754	75%	0.746	S	S	*	*			cis	-146.2	164	-0.7	-65.9	103.8	0	0	0	108.5
25	D	50.9	Low	50.2	Low	119 Å²	119	169.3 Å²	169.3	64%	0.636	73%	0.734	S	S	*	*			cis	-163.3	177.1	-25.7	-103	-6	0	0	0	113	H27	D25-H27 PolarHBondContact O-N 2.93Å
26	Y	39.7	Very low	50.8	Low	201 Å²	201	169.7 Å²	169.7	79%	0.788	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-32.3	89.1	165.5	-81.3	-104.6	0	0	0	119.9
27	H	47.6	Very low	51.9	Low	181 Å²	181	165.4 Å²	165.4	84%	0.838	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn		-165.8	-21.3	128.2	-131.2	-76	0	0	0	113.7	D25 Y29	D25-H27 PolarHBondContact O-N 2.93Å; H27-Y29 PolarHBondContact O-N 3.45Å
28	Y	49.6	Very low	53.2	Low	176 Å²	176	160.6 Å²	160.6	69%	0.69	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-10.2	171.3	-121.9	-123.2	0	0	0	113	Y30 Y31 Y32	Y28-Y30 PolarHBondContact O-N 3.24Å; Y28-Y31 PolarHBondContact O-N 2.94Å; Y28-Y32 AromaticContact CD1-CD2 3.43Å; Y28-Y32 HydrophobicContact CD1-CD2 3.43Å; Y28-Y32 VanDerWaalsContact CD1-CD2 3.43Å; Y28-Y32 AromaticContact CD1-CE2 3.65Å; Y28-Y32 HydrophobicContact CD1-CE2 3.65Å; Y28-Y32 HydrophobicContact CD1-CG 4.44Å; Y28-Y32 AromaticContact CE1-CD2 3.89Å; Y28-Y32 HydrophobicContact CE1-CD2 3.89Å; Y28-Y32 AromaticContact CE1-CE2 3.77Å; Y28-Y32 HydrophobicContact CE1-CE2 3.77Å; Y28-Y32 WeakPolarHBondContact O-CB 3.43Å; Y28-Y32 PolarHBondContact O-N 3.06Å
29	Y	47.7	Very low	54.4	Low	163 Å²	163	152.9 Å²	152.9	64%	0.639	66%	0.66	S	S	*	*	H	α-helix	trans	-65.2	-30.6	-164.9	-135.8	-93	0	0	0	114.6	H27 Y33	H27-Y29 PolarHBondContact O-N 3.45Å; Y29-Y33 WeakPolarHBondContact O-CA 3.4Å; Y29-Y33 WeakPolarHBondContact O-CB 3.44Å; Y29-Y33 PolarHBondContact O-N 3.06Å
30	Y	51.4	Low	55.6	Low	185 Å²	185	145.5 Å²	145.5	73%	0.725	64%	0.637	S	S	*	*	H	α-helix	trans	-77.6	-38.5	179.5	-135.7	-89.3	0	0	0	112.6	Y28 Y33 Y34	Y28-Y30 PolarHBondContact O-N 3.24Å; Y30-Y33 PolarHBondContact O-N 3.48Å; Y30-Y34 HydrophobicContact CD1-CD2 4.33Å; Y30-Y34 HydrophobicContact CE1-CD2 4.31Å; Y30-Y34 HydrophobicContact CE1-CE2 4.28Å; Y30-Y34 PolarHBondContact O-N 3.2Å
31	Y	55.4	Low	56.9	Low	196 Å²	196	140.3 Å²	140.3	77%	0.769	62%	0.618	S	S	*	*	H	α-helix	trans	-74.6	-38.1	175.2	-129.3	-85.6	0	0	0	111.3	Y28 Y35	Y28-Y31 PolarHBondContact O-N 2.94Å; Y31-Y35 WeakPolarHBondContact O-CB 3.47Å; Y31-Y35 PolarHBondContact O-N 3.24Å
32	Y	56.1	Low	58.1	Low	133 Å²	133	135.7 Å²	135.7	52%	0.522	60%	0.6	S	S	.	*	H	α-helix	trans	-66.8	-37.6	168.1	-109.9	-114	0	0	0	111.7	Y28 Y34 Y35 Y36	Y28-Y32 AromaticContact CD1-CD2 3.43Å; Y28-Y32 HydrophobicContact CD1-CD2 3.43Å; Y28-Y32 VanDerWaalsContact CD1-CD2 3.43Å; Y28-Y32 AromaticContact CD1-CE2 3.65Å; Y28-Y32 HydrophobicContact CD1-CE2 3.65Å; Y28-Y32 HydrophobicContact CD1-CG 4.44Å; Y28-Y32 AromaticContact CE1-CD2 3.89Å; Y28-Y32 HydrophobicContact CE1-CD2 3.89Å; Y28-Y32 AromaticContact CE1-CE2 3.77Å; Y28-Y32 HydrophobicContact CE1-CE2 3.77Å; Y28-Y32 WeakPolarHBondContact O-CB 3.43Å; Y28-Y32 PolarHBondContact O-N 3.06Å; Y32-Y34 PolarHBondContact O-N 3.17Å; Y32-Y35 CarbonylContact O-C 3.59Å; Y32-Y35 PolarHBondContact O-N 3.43Å; Y32-Y36 WeakPolarHBondContact O-CA 3.44Å; Y32-Y36 WeakPolarHBondContact O-CB 3.24Å; Y32-Y36 PolarHBondContact O-N 3.32Å
33	Y	61.3	Low	59.2	Low	137 Å²	137	136 Å²	136	54%	0.537	59%	0.592	S	S	.	*	H	α-helix	trans	-67.3	-38	177.4	-165.3	-105	0	0	0	111.2	Y29 Y30 I37	Y29-Y33 WeakPolarHBondContact O-CA 3.4Å; Y29-Y33 WeakPolarHBondContact O-CB 3.44Å; Y29-Y33 PolarHBondContact O-N 3.06Å; Y30-Y33 PolarHBondContact O-N 3.48Å; Y33-I37 HydrophobicContact CD1-CD1 3.61Å; Y33-I37 HydrophobicContact CD1-CG1 4.38Å; Y33-I37 HydrophobicContact CE1-CD1 3.32Å; Y33-I37 HydrophobicContact CE1-CG1 4.32Å; Y33-I37 HydrophobicContact CG-CD1 4.41Å; Y33-I37 WeakPolarHBondContact O-CB 3.16Å; Y33-I37 VanDerWaalsContact O-CG1 3.28Å; Y33-I37 WeakPolarHBondContact O-CG1 3.33Å; Y33-I37 PolarHBondContact O-N 3.21Å
34	Y	64.2	Low	60.6	Low	142 Å²	142	131.7 Å²	131.7	56%	0.557	58%	0.577	S	S	*	*	H	α-helix	trans	-67.7	-39.4	169.2	-108.7	-85.3	0	0	0	113	Y30 Y32 I37 I38	Y30-Y34 HydrophobicContact CD1-CD2 4.33Å; Y30-Y34 HydrophobicContact CE1-CD2 4.31Å; Y30-Y34 HydrophobicContact CE1-CE2 4.28Å; Y30-Y34 PolarHBondContact O-N 3.2Å; Y32-Y34 PolarHBondContact O-N 3.17Å; Y34-I37 PolarHBondContact O-N 3.45Å; Y34-I38 HydrophobicContact CD1-CD1 4.24Å; Y34-I38 VanDerWaalsContact O-CB 3.27Å; Y34-I38 WeakPolarHBondContact O-CB 3.43Å; Y34-I38 WeakPolarHBondContact O-CD1 3.44Å; Y34-I38 WeakPolarHBondContact O-CG1 3.18Å; Y34-I38 PolarHBondContact O-N 3.21Å
35	Y	69.1	Low	61.9	Low	137 Å²	137	129.7 Å²	129.7	54%	0.537	57%	0.566	S	S	.	*	H	α-helix	trans	-72.1	-31.6	177.7	-164.8	-107.9	0	0	0	112.3	Y31 Y32 I39	Y31-Y35 WeakPolarHBondContact O-CB 3.47Å; Y31-Y35 PolarHBondContact O-N 3.24Å; Y32-Y35 CarbonylContact O-C 3.59Å; Y32-Y35 PolarHBondContact O-N 3.43Å; Y35-I39 HydrophobicContact CD1-CD1 3.61Å; Y35-I39 HydrophobicContact CD1-CG1 4.44Å; Y35-I39 HydrophobicContact CE1-CD1 3.37Å; Y35-I39 HydrophobicContact CE1-CG1 4.36Å; Y35-I39 HydrophobicContact CG-CD1 4.46Å; Y35-I39 WeakPolarHBondContact O-CB 3.38Å; Y35-I39 WeakPolarHBondContact O-CG1 3.38Å; Y35-I39 PolarHBondContact O-N 3.1Å
36	Y	66.7	Low	62.5	Low	145 Å²	145	126.3 Å²	126.3	57%	0.569	55%	0.552	S	S	*	*	H	α-helix	trans	-81.3	-28.2	174.8	-141.2	-97.9	0	0	0	110.8	Y32 I40	Y32-Y36 WeakPolarHBondContact O-CA 3.44Å; Y32-Y36 WeakPolarHBondContact O-CB 3.24Å; Y32-Y36 PolarHBondContact O-N 3.32Å; Y36-I40 HydrophobicContact CD1-CD1 3.53Å; Y36-I40 HydrophobicContact CD1-CG1 4.14Å; Y36-I40 HydrophobicContact CE1-CD1 3.88Å; Y36-I40 HydrophobicContact CE1-CG1 4.47Å; Y36-I40 WeakPolarHBondContact O-CA 3.46Å; Y36-I40 WeakPolarHBondContact O-CB 3.3Å; Y36-I40 WeakPolarHBondContact O-CG1 3.47Å; Y36-I40 PolarHBondContact O-N 3.18Å
37	I	73.2	Confident	63.4	Low	58 Å²	58	120.7 Å²	120.7	30%	0.297	54%	0.535	S	S	.	.	H	α-helix	trans	-73.7	-36.4	165.9	-79.8	178.8	0	0	0	110.9	Y33 Y34 I40 L41	Y33-I37 HydrophobicContact CD1-CD1 3.61Å; Y33-I37 HydrophobicContact CD1-CG1 4.38Å; Y33-I37 HydrophobicContact CE1-CD1 3.32Å; Y33-I37 HydrophobicContact CE1-CG1 4.32Å; Y33-I37 HydrophobicContact CG-CD1 4.41Å; Y33-I37 WeakPolarHBondContact O-CB 3.16Å; Y33-I37 VanDerWaalsContact O-CG1 3.28Å; Y33-I37 WeakPolarHBondContact O-CG1 3.33Å; Y33-I37 PolarHBondContact O-N 3.21Å; Y34-I37 PolarHBondContact O-N 3.45Å; I37-I40 CarbonylContact O-C 3.34Å; I37-I40 PolarHBondContact O-N 2.87Å; I37-L41 HydrophobicContact CG2-CD1 3.65Å; I37-L41 HydrophobicContact CG2-CG 4.3Å; I37-L41 WeakPolarHBondContact O-CA 3.3Å; I37-L41 WeakPolarHBondContact O-CB 3.47Å; I37-L41 VanDerWaalsContact O-CG 3.23Å; I37-L41 WeakPolarHBondContact O-CG 3.45Å; I37-L41 PolarHBondContact O-N 3.08Å
38	I	74	Confident	64	Low	96 Å²	96	115.7 Å²	115.7	49%	0.492	52%	0.517	S	S	.	.	H	α-helix	trans	-73.4	-33.4	173.8	-71.8	165.2	0	0	0	110.5	Y34 S42	Y34-I38 HydrophobicContact CD1-CD1 4.24Å; Y34-I38 VanDerWaalsContact O-CB 3.27Å; Y34-I38 WeakPolarHBondContact O-CB 3.43Å; Y34-I38 WeakPolarHBondContact O-CD1 3.44Å; Y34-I38 WeakPolarHBondContact O-CG1 3.18Å; Y34-I38 PolarHBondContact O-N 3.21Å; I38-S42 WeakPolarHBondContact O-CA 3.39Å; I38-S42 WeakPolarHBondContact O-CB 3.32Å; I38-S42 PolarHBondContact O-N 3.42Å
39	I	74.9	Confident	64.1	Low	58 Å²	58	112.6 Å²	112.6	30%	0.297	51%	0.51	S	S	.	.	H	α-helix	trans	-72.2	-41.9	169.6	-75.8	172.6	0	0	0	110.3	Y35 L41 S42 W43	Y35-I39 HydrophobicContact CD1-CD1 3.61Å; Y35-I39 HydrophobicContact CD1-CG1 4.44Å; Y35-I39 HydrophobicContact CE1-CD1 3.37Å; Y35-I39 HydrophobicContact CE1-CG1 4.36Å; Y35-I39 HydrophobicContact CG-CD1 4.46Å; Y35-I39 WeakPolarHBondContact O-CB 3.38Å; Y35-I39 WeakPolarHBondContact O-CG1 3.38Å; Y35-I39 PolarHBondContact O-N 3.1Å; I39-L41 VanDerWaalsContact C-N 3.33Å; I39-L41 PolarHBondContact O-N 3.28Å; I39-S42 CarbonylContact O-C 3.54Å; I39-S42 PolarHBondContact O-N 2.84Å; I39-W43 HydrophobicContact CG2-CG 4.43Å; I39-W43 WeakPolarHBondContact O-CA 3.21Å; I39-W43 WeakPolarHBondContact O-CB 3.47Å; I39-W43 PolarHBondContact O-N 3.41Å
40	I	73.5	Confident	64.3	Low	80 Å²	80	107.2 Å²	107.2	41%	0.41	50%	0.496	S	S	.	.	H	α-helix	trans	-69.1	-30.5	174.7	-74.9	170.6	0	0	0	111.2	Y36 I37 W43 L44	Y36-I40 HydrophobicContact CD1-CD1 3.53Å; Y36-I40 HydrophobicContact CD1-CG1 4.14Å; Y36-I40 HydrophobicContact CE1-CD1 3.88Å; Y36-I40 HydrophobicContact CE1-CG1 4.47Å; Y36-I40 WeakPolarHBondContact O-CA 3.46Å; Y36-I40 WeakPolarHBondContact O-CB 3.3Å; Y36-I40 WeakPolarHBondContact O-CG1 3.47Å; Y36-I40 PolarHBondContact O-N 3.18Å; I37-I40 CarbonylContact O-C 3.34Å; I37-I40 PolarHBondContact O-N 2.87Å; I40-W43 CarbonylContact O-C 3.57Å; I40-L44 HydrophobicContact CG2-CD1 3.69Å; I40-L44 HydrophobicContact CG2-CG 4.31Å; I40-L44 WeakPolarHBondContact O-CA 3.39Å; I40-L44 WeakPolarHBondContact O-CB 3.27Å; I40-L44 WeakPolarHBondContact O-CD1 3.44Å; I40-L44 WeakPolarHBondContact O-CG 3.42Å; I40-L44 PolarHBondContact O-N 2.88Å
41	L	72.9	Confident	64.2	Low	87 Å²	87	105.5 Å²	105.5	46%	0.455	49%	0.493	S	S	.	.	H	α-helix	trans	-79.5	-29	171.2	-78.4	166.2	0	0	0	111.8	I37 I39 L45	I37-L41 HydrophobicContact CG2-CD1 3.65Å; I37-L41 HydrophobicContact CG2-CG 4.3Å; I37-L41 WeakPolarHBondContact O-CA 3.3Å; I37-L41 WeakPolarHBondContact O-CB 3.47Å; I37-L41 VanDerWaalsContact O-CG 3.23Å; I37-L41 WeakPolarHBondContact O-CG 3.45Å; I37-L41 PolarHBondContact O-N 3.08Å; I39-L41 VanDerWaalsContact C-N 3.33Å; I39-L41 PolarHBondContact O-N 3.28Å; L41-L45 HydrophobicContact CD2-CD1 4.49Å; L41-L45 WeakPolarHBondContact O-CA 3.44Å; L41-L45 WeakPolarHBondContact O-CB 3.38Å; L41-L45 WeakPolarHBondContact O-CD1 3.4Å; L41-L45 PolarHBondContact O-N 3.49Å
42	S	72	Confident	64	Low	69 Å²	69	103.6 Å²	103.6	48%	0.483	49%	0.491	S	S	.	.	H	α-helix	trans	-77.1	-27.8	171.3	178.5	0	0	0	0	111.3	I38 I39 S46	I38-S42 WeakPolarHBondContact O-CA 3.39Å; I38-S42 WeakPolarHBondContact O-CB 3.32Å; I38-S42 PolarHBondContact O-N 3.42Å; I39-S42 CarbonylContact O-C 3.54Å; I39-S42 PolarHBondContact O-N 2.84Å; S42-S46 WeakPolarHBondContact O-CA 3.48Å; S42-S46 WeakPolarHBondContact O-CB 3.34Å; S42-S46 PolarHBondContact O-N 3.21Å; S42-S46 PolarHBondContact O-OG 2.65Å; S42-S46 VanDerWaalsContact O-OG 3.05Å
43	W	68.1	Low	63.5	Low	165 Å²	165	104 Å²	104	63%	0.625	50%	0.501	S	S	*	.	H	α-helix	trans	-85.6	-26.3	171.1	-80.6	58.5	0	0	0	110.9	I39 I40 S46 L47	I39-W43 HydrophobicContact CG2-CG 4.43Å; I39-W43 WeakPolarHBondContact O-CA 3.21Å; I39-W43 WeakPolarHBondContact O-CB 3.47Å; I39-W43 PolarHBondContact O-N 3.41Å; I40-W43 CarbonylContact O-C 3.57Å; W43-S46 WeakPolarHBondContact CA-OG 3.46Å; W43-L47 HydrophobicContact CB-CD1 4.38Å; W43-L47 HydrophobicContact CE3-CD1 4.09Å; W43-L47 WeakPolarHBondContact O-CA 3.36Å; W43-L47 WeakPolarHBondContact O-CB 3.42Å; W43-L47 WeakPolarHBondContact O-CD1 3.27Å; W43-L47 PolarHBondContact O-N 3.26Å
44	L	68	Low	62.4	Low	94 Å²	94	104.9 Å²	104.9	49%	0.492	51%	0.512	S	S	.	.	H	α-helix	trans	-78.5	-40.9	168.8	-81.2	162.9	0	0	0	110.1	I40 L47 T48	I40-L44 HydrophobicContact CG2-CD1 3.69Å; I40-L44 HydrophobicContact CG2-CG 4.31Å; I40-L44 WeakPolarHBondContact O-CA 3.39Å; I40-L44 WeakPolarHBondContact O-CB 3.27Å; I40-L44 WeakPolarHBondContact O-CD1 3.44Å; I40-L44 WeakPolarHBondContact O-CG 3.42Å; I40-L44 PolarHBondContact O-N 2.88Å; L44-L47 CarbonylContact O-C 3.58Å; L44-L47 PolarHBondContact O-N 3.11Å; L44-T48 WeakPolarHBondContact O-CB 3.49Å; L44-T48 VanDerWaalsContact O-CG2 3.25Å; L44-T48 WeakPolarHBondContact O-CG2 3.31Å; L44-T48 PolarHBondContact O-N 3.49Å; L44-T48 PolarHBondContact O-OG1 3.45Å; L44-T48 VanDerWaalsContact O-OG1 3.04Å
45	L	63.3	Low	60.9	Low	101 Å²	101	104.3 Å²	104.3	53%	0.529	51%	0.51	S	S	.	.	H	α-helix	trans	-68.8	-34.4	170.1	-90	82.5	0	0	0	111.4	L41 T48 M49	L41-L45 HydrophobicContact CD2-CD1 4.49Å; L41-L45 WeakPolarHBondContact O-CA 3.44Å; L41-L45 WeakPolarHBondContact O-CB 3.38Å; L41-L45 WeakPolarHBondContact O-CD1 3.4Å; L41-L45 PolarHBondContact O-N 3.49Å; L45-T48 WeakPolarHBondContact CA-OG1 3.41Å; L45-T48 PolarHBondContact O-OG1 2.76Å; L45-M49 WeakPolarHBondContact O-CA 3.2Å; L45-M49 WeakPolarHBondContact O-CB 3.2Å; L45-M49 WeakPolarHBondContact O-CG 3Å; L45-M49 PolarHBondContact O-N 2.9Å
46	S	63.4	Low	59	Low	48 Å²	48	104.9 Å²	104.9	34%	0.336	52%	0.522	S	S	.	.	H	α-helix	trans	-77.5	-24.4	169.8	80.8	0	0	0	0	112.7	S42 W43 C50	S42-S46 WeakPolarHBondContact O-CA 3.48Å; S42-S46 WeakPolarHBondContact O-CB 3.34Å; S42-S46 PolarHBondContact O-N 3.21Å; S42-S46 PolarHBondContact O-OG 2.65Å; S42-S46 VanDerWaalsContact O-OG 3.05Å; W43-S46 WeakPolarHBondContact CA-OG 3.46Å; S46-C50 VanDerWaalsContact O-CA 3.27Å; S46-C50 WeakPolarHBondContact O-CA 3.44Å; S46-C50 WeakPolarHBondContact O-CB 3.4Å; S46-C50 PolarHBondContact O-N 2.94Å; S46-C50 PolarHBondContact O-SG 2.88Å
47	L	59.2	Low	57.3	Low	83 Å²	83	107.1 Å²	107.1	44%	0.435	54%	0.538	S	S	.	.	H	α-helix	trans	-83.8	-13	168.2	-89.3	92.7	0	0	0	113.3	W43 L44 K51	W43-L47 HydrophobicContact CB-CD1 4.38Å; W43-L47 HydrophobicContact CE3-CD1 4.09Å; W43-L47 WeakPolarHBondContact O-CA 3.36Å; W43-L47 WeakPolarHBondContact O-CB 3.42Å; W43-L47 WeakPolarHBondContact O-CD1 3.27Å; W43-L47 PolarHBondContact O-N 3.26Å; L44-L47 CarbonylContact O-C 3.58Å; L44-L47 PolarHBondContact O-N 3.11Å; L47-K51 WeakPolarHBondContact O-CB 3.44Å; L47-K51 WeakPolarHBondContact O-CD 3.31Å; L47-K51 WeakPolarHBondContact O-CG 3.26Å; L47-K51 PolarHBondContact O-N 2.8Å; L47-K51 VanDerWaalsContact O-N 3.13Å
48	T	59.4	Low	55.1	Low	76 Å²	76	110.4 Å²	110.4	47%	0.466	55%	0.552	S	S	.	*	H	α-helix	trans	-91.8	-41.2	168.5	58.5	0	0	0	0	110.2	L44 L45 K51 E52	L44-T48 WeakPolarHBondContact O-CB 3.49Å; L44-T48 VanDerWaalsContact O-CG2 3.25Å; L44-T48 WeakPolarHBondContact O-CG2 3.31Å; L44-T48 PolarHBondContact O-N 3.49Å; L44-T48 PolarHBondContact O-OG1 3.45Å; L44-T48 VanDerWaalsContact O-OG1 3.04Å; L45-T48 WeakPolarHBondContact CA-OG1 3.41Å; L45-T48 PolarHBondContact O-OG1 2.76Å; T48-K51 CarbonylContact O-C 3.54Å; T48-K51 PolarHBondContact O-N 3.36Å; T48-K51 VanDerWaalsContact O-N 3.12Å; T48-E52 PolarHBondContact O-N 2.87Å; T48-E52 VanDerWaalsContact O-N 3.13Å
49	M	52.7	Low	53.1	Low	111 Å²	111	112 Å²	112	55%	0.547	55%	0.552	S	S	.	*	H	α-helix	trans	-72.3	-30.4	171.4	-65.4	-69.2	170.2	0	0	112.3	L45 E52 L53	L45-M49 WeakPolarHBondContact O-CA 3.2Å; L45-M49 WeakPolarHBondContact O-CB 3.2Å; L45-M49 WeakPolarHBondContact O-CG 3Å; L45-M49 PolarHBondContact O-N 2.9Å; M49-E52 CarbonylContact O-C 3.54Å; M49-E52 PolarHBondContact O-N 2.79Å; M49-L53 WeakPolarHBondContact O-CA 3.07Å; M49-L53 VanDerWaalsContact O-CB 3.22Å; M49-L53 WeakPolarHBondContact O-CB 3.31Å; M49-L53 PolarHBondContact O-N 3.27Å
50	C	51.4	Low	51.2	Low	51 Å²	51	115.4 Å²	115.4	35%	0.345	56%	0.563	S	S	.	*	H	α-helix	trans	-85.7	-4.5	164.1	-63	0	0	0	0	113.4	S46 E52 M54	S46-C50 VanDerWaalsContact O-CA 3.27Å; S46-C50 WeakPolarHBondContact O-CA 3.44Å; S46-C50 WeakPolarHBondContact O-CB 3.4Å; S46-C50 PolarHBondContact O-N 2.94Å; S46-C50 PolarHBondContact O-SG 2.88Å; C50-E52 VanDerWaalsContact C-N 3.28Å; C50-M54 HydrophobicContact CB-CB 4.13Å; C50-M54 HydrophobicContact CB-CG 3.73Å; C50-M54 HydrophobicContact CB-SD 4.07Å; C50-M54 VanDerWaalsContact O-CA 3.3Å; C50-M54 WeakPolarHBondContact O-CA 3.43Å; C50-M54 WeakPolarHBondContact O-CB 3.33Å; C50-M54 PolarHBondContact O-N 3.41Å
51	K	49.7	Very low	49.6	Very low	149 Å²	149	117.2 Å²	117.2	65%	0.648	57%	0.573	S	S	*	*	H	α-helix	trans	-80.5	-12.5	158.7	-85.3	170.2	-172.5	178.4	0	112.6	L47 T48 Y55	L47-K51 WeakPolarHBondContact O-CB 3.44Å; L47-K51 WeakPolarHBondContact O-CD 3.31Å; L47-K51 WeakPolarHBondContact O-CG 3.26Å; L47-K51 PolarHBondContact O-N 2.8Å; L47-K51 VanDerWaalsContact O-N 3.13Å; T48-K51 CarbonylContact O-C 3.54Å; T48-K51 PolarHBondContact O-N 3.36Å; T48-K51 VanDerWaalsContact O-N 3.12Å; K51-Y55 WeakPolarHBondContact O-CB 3.3Å
52	E	51.4	Low	48.5	Very low	155 Å²	155	114.5 Å²	114.5	72%	0.724	56%	0.559	S	S	*	*	H	α-helix	trans	-106.1	-19.9	166	-65	-159	155.6	0	0	114.3	T48 M49 C50	T48-E52 PolarHBondContact O-N 2.87Å; T48-E52 VanDerWaalsContact O-N 3.13Å; M49-E52 CarbonylContact O-C 3.54Å; M49-E52 PolarHBondContact O-N 2.79Å; C50-E52 VanDerWaalsContact C-N 3.28Å
53	L	45.1	Very low	47.8	Very low	143 Å²	143	118 Å²	118	75%	0.749	57%	0.565	S	S	*	*	H	α-helix	trans	-119.6	4.5	179.5	-72.1	155.1	0	0	0	115.4	M49	M49-L53 WeakPolarHBondContact O-CA 3.07Å; M49-L53 VanDerWaalsContact O-CB 3.22Å; M49-L53 WeakPolarHBondContact O-CB 3.31Å; M49-L53 PolarHBondContact O-N 3.27Å
54	M	38.5	Very low	47.8	Very low	154 Å²	154	110.6 Å²	110.6	76%	0.759	54%	0.538	S	S	*	.	S	Bend	trans	-115.1	18.2	152.7	-61.5	-175.1	77.2	0	0	111.6	C50	C50-M54 HydrophobicContact CB-CB 4.13Å; C50-M54 HydrophobicContact CB-CG 3.73Å; C50-M54 HydrophobicContact CB-SD 4.07Å; C50-M54 VanDerWaalsContact O-CA 3.3Å; C50-M54 WeakPolarHBondContact O-CA 3.43Å; C50-M54 WeakPolarHBondContact O-CB 3.33Å; C50-M54 PolarHBondContact O-N 3.41Å
55	Y	32.5	Very low	48.3	Very low	131 Å²	131	110.2 Å²	110.2	51%	0.514	53%	0.531	S	S	.	.	S	Bend	trans	-105.6	56.5	163.7	-164.2	-95.7	0	0	0	109.9	K51 Q58	K51-Y55 WeakPolarHBondContact O-CB 3.3Å; Y55-Q58 VanDerWaalsContact CE2-OE1 3.22Å
56	N	30.3	Very low	49.2	Very low	149 Å²	149	106.9 Å²	106.9	80%	0.797	51%	0.513	S	S	*	.	S	Bend	trans	-157.7	36	165.3	-116.4	-8	0	0	0	114.1
57	E	30	Very low	50.3	Low	192 Å²	192	109.6 Å²	109.6	90%	0.897	52%	0.519	S	S	*	.			trans	-133.4	22.4	151.5	-144.3	-179.6	-136.5	0	0	112.1	Y59	E57-Y59 PolarHBondContact O-N 3.14Å; E57-Y59 VanDerWaalsContact O-N 3.15Å
58	Q	27.7	Very low	51.6	Low	127 Å²	127	106.3 Å²	106.3	59%	0.593	51%	0.505	S	S	*	.	S	Bend	trans	-70.6	98.1	136.4	-81.4	-169	-51.5	0	0	105.5	Y55 Y60	Y55-Q58 VanDerWaalsContact CE2-OE1 3.22Å; Q58-Y60 VanDerWaalsContact C-N 3.33Å; Q58-Y60 PolarHBondContact O-N 3.16Å
59	Y	31.3	Very low	53.2	Low	128 Å²	128	103.2 Å²	103.2	50%	0.502	49%	0.486	S	S	.	.			trans	-45.8	109.1	153.5	-162.2	-75.2	0	0	0	104.9	E57 N61 Q170	E57-Y59 PolarHBondContact O-N 3.14Å; E57-Y59 VanDerWaalsContact O-N 3.15Å; Y59-N61 VanDerWaalsContact C-N 3.26Å; Y59-N61 PolarHBondContact O-N 3.11Å; Y59-Q170 PolarHBondContact OH-OE1 2.87Å
60	Y	34.2	Very low	55.1	Low	130 Å²	130	104.2 Å²	104.2	51%	0.51	49%	0.489	S	S	.	.			trans	-60.9	104.7	177.2	-148.6	-86	0	0	0	103.2	Q58 I62	Q58-Y60 VanDerWaalsContact C-N 3.33Å; Q58-Y60 PolarHBondContact O-N 3.16Å; Y60-I62 HydrophobicContact CD1-CG1 4.02Å; Y60-I62 PolarHBondContact O-N 3.3Å
61	N	39.7	Very low	57.1	Low	118 Å²	118	107.1 Å²	107.1	63%	0.631	50%	0.501	S	S	*	.			trans	-77.8	81.6	-172	-139.4	-21.2	0	0	0	103.7	Y59 K63	Y59-N61 VanDerWaalsContact C-N 3.26Å; Y59-N61 PolarHBondContact O-N 3.11Å; N61-K63 PolarHBondContact O-N 3.18Å
62	I	50.2	Low	59.1	Low	30 Å²	30	102.1 Å²	102.1	15%	0.154	48%	0.48	C	S	.	.			trans	-67.4	70.6	175.1	-62.5	170.3	0	0	0	105	Y60 N64 N88 Y99	Y60-I62 HydrophobicContact CD1-CG1 4.02Å; Y60-I62 PolarHBondContact O-N 3.3Å; I62-N64 PolarHBondContact O-N 3.24Å; I62-N88 WeakPolarHBondContact CG2-ND2 3.38Å; I62-Y99 HydrophobicContact CD1-CE2 4.18Å
63	K	58.6	Low	60.9	Low	143 Å²	143	98.7 Å²	98.7	62%	0.622	47%	0.47	S	S	*	.			trans	-86.3	80.8	-175.5	-164.4	171.4	-172	175.9	0	105.8	N61 Y65	N61-K63 PolarHBondContact O-N 3.18Å; K63-Y65 PolarHBondContact O-N 3.38Å
64	N	68.3	Low	62.9	Low	9 Å²	9	93.6 Å²	93.6	5%	0.048	44%	0.443	C	S	.	.			trans	-52.5	132.2	173	-72.4	-27.2	0	0	0	108.4	I62 Y87 I174	I62-N64 PolarHBondContact O-N 3.24Å; N64-Y87 CarbonylContact C-O 3.59Å; N64-Y87 WeakPolarHBondContact CA-O 3Å; N64-I174 HydrophobicContact CB-CD1 3.44Å; N64-I174 VanDerWaalsContact CB-CD1 3.44Å
65	Y	76.9	Confident	65.2	Low	87 Å²	87	89.8 Å²	89.8	34%	0.341	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	137	-178.7	71.9	-95.5	0	0	0	110.3	K63 Y87 N91	K63-Y65 PolarHBondContact O-N 3.38Å; Y65-Y87 HydrophobicContact CD2-CD2 4.06Å; Y65-Y87 HydrophobicContact CD2-CG 4.49Å; Y65-Y87 VanDerWaalsContact CE1-CB 3.46Å; Y65-Y87 HydrophobicContact CE1-CG 4.42Å; Y65-Y87 AromaticContact CE2-CD2 3.45Å; Y65-Y87 HydrophobicContact CE2-CD2 3.45Å; Y65-Y87 VanDerWaalsContact CE2-CD2 3.45Å; Y65-Y87 HydrophobicContact CE2-CE2 4.35Å; Y65-Y87 AromaticContact CE2-CG 3.75Å; Y65-Y87 HydrophobicContact CE2-CG 3.75Å; Y65-Y87 AromaticContact CZ-CD2 3.93Å; Y65-Y87 AromaticContact CZ-CG 3.71Å; Y65-Y87 PolarHBondContact N-O 2.86Å; Y65-Y87 PolarHBondContact O-N 3.24Å; Y65-Y87 WeakPolarHBondContact OH-CB 3.43Å; Y65-N91 PolarHBondContact OH-OD1 2.85Å
66	I	83.4	Confident	67.7	Low	30 Å²	30	87.1 Å²	87.1	15%	0.154	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	118.6	-179.7	-161.7	168.3	0	0	0	109.2	G68 I86 C155 A157 I174	I66-G68 PolarHBondContact O-N 3.18Å; I66-I86 HydrophobicContact CG1-CG1 4.37Å; I66-C155 HydrophobicContact CD1-CB 3.95Å; I66-C155 WeakPolarHBondContact CD1-O 3.34Å; I66-A157 HydrophobicContact CD1-CB 4.44Å; I66-I174 HydrophobicContact CB-CG2 3.87Å; I66-I174 HydrophobicContact CG2-CG2 3.69Å
67	K	86.1	Confident	70.3	Confident	106 Å²	106	84.9 Å²	84.9	46%	0.461	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	95.1	160.8	-172.3	-179.6	179.3	-179.1	0	106.8	C84 R85 Y87	K67-C84 WeakPolarHBondContact O-CA 3.29Å; K67-R85 HydrophobicContact CB-CB 4.49Å; K67-R85 PolarHBondContact N-O 3.45Å; K67-R85 PolarHBondContact O-N 2.98Å; K67-Y87 HydrophobicContact CB-CD2 4.31Å; K67-Y87 HydrophobicContact CB-CE2 3.76Å
68	G	86.4	Confident	73	Confident	13 Å²	13	77.1 Å²	77.1	13%	0.134	37%	0.37	C	S	.	.			trans	-81.4	-171.3	178.1	0	0	0	0	0	114.1	I66 Y83	I66-G68 PolarHBondContact O-N 3.18Å; G68-Y83 CarbonylContact C-O 3.57Å
69	P	92.9	Very high	76.1	Confident	11 Å²	11	76.2 Å²	76.2	7%	0.071	37%	0.369	C	S	.	.			trans	-70.7	163	-179.3	32.4	-40.2	0	0	0	112.1	M82 Y83 W107 A179	P69-M82 HydrophobicContact CB-CB 4.24Å; P69-M82 HydrophobicContact CB-CE 3.89Å; P69-Y83 WeakPolarHBondContact CA-O 3.11Å; P69-Y83 WeakPolarHBondContact CD-O 3.39Å; P69-W107 HydrophobicContact CB-CH2 4.18Å; P69-W107 HydrophobicContact CB-CZ3 4.26Å; P69-W107 HydrophobicContact CG-CH2 4.13Å; P69-W107 HydrophobicContact CG-CZ3 3.87Å; P69-A179 HydrophobicContact CB-CB 3.58Å; P69-A179 HydrophobicContact CG-CB 3.53Å
70	E	93.6	Very high	79	Confident	133 Å²	133	70.3 Å²	70.3	62%	0.621	35%	0.347	S	S	*	.			trans	-117.2	156.6	171.1	-66.3	175.1	-163.4	0	0	108.3	Q72 A179	E70-Q72 PolarHBondContact O-N 2.91Å; E70-A179 WeakPolarHBondContact O-CB 3.37Å
71	N	93.3	Very high	81.7	Confident	112 Å²	112	67.3 Å²	67.3	60%	0.599	34%	0.339	S	S	*	.			trans	-60.5	135.5	176.6	-70	-5.1	0	0	0	110.1	A179 Y180	N71-A179 VanDerWaalsContact OD1-CA 3.3Å; N71-A179 WeakPolarHBondContact OD1-CA 3.18Å; N71-Y180 WeakPolarHBondContact CA-O 3.37Å; N71-Y180 PolarHBondContact OD1-N 2.81Å
72	Q	91	Very high	84.3	Confident	43 Å²	43	61.7 Å²	61.7	20%	0.201	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	143.4	-179.6	-65.9	-174.5	38.5	0	0	110.9	E70 T80 I81 M82 Y180 L181 T182	E70-Q72 PolarHBondContact O-N 2.91Å; Q72-T80 PolarHBondContact OE1-OG1 3.34Å; Q72-I81 PolarHBondContact NE2-O 3.29Å; Q72-M82 HydrophobicContact CG-SD 4.37Å; Q72-Y180 PolarHBondContact N-O 2.8Å; Q72-L181 HydrophobicContact CB-CD1 4.05Å; Q72-L181 WeakPolarHBondContact O-CA 3.34Å; Q72-T182 PolarHBondContact O-N 2.85Å
73	T	88.9	Confident	86.3	Confident	84 Å²	84	65.4 Å²	65.4	52%	0.515	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	121.7	173	-46.8	0	0	0	0	107.9	T182 I184	T73-T182 CarbonylContact C-O 3.53Å; T73-T182 VanDerWaalsContact CA-O 3.29Å; T73-T182 WeakPolarHBondContact CA-O 3.35Å; T73-T182 HydrophobicContact CG2-CG2 4.23Å; T73-I184 HydrophobicContact CG2-CD1 3.38Å; T73-I184 HydrophobicContact CG2-CG1 3.64Å
74	I	87.9	Confident	87.9	Confident	35 Å²	35	58.6 Å²	58.6	18%	0.179	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	153.3	-166	-148.8	82.3	0	0	0	111	S78 T145 L181 T182 I183 I184	I74-S78 WeakPolarHBondContact CG1-OG 3.42Å; I74-T145 HydrophobicContact CG2-CG2 4.14Å; I74-L181 HydrophobicContact CB-CD1 4.38Å; I74-L181 HydrophobicContact CG2-CD1 3.96Å; I74-T182 PolarHBondContact N-O 3.45Å; I74-I183 HydrophobicContact CG2-CG1 4.07Å; I74-I183 WeakPolarHBondContact O-CA 3.35Å; I74-I184 PolarHBondContact O-N 2.87Å
75	L	85.5	Confident	88.8	Confident	74 Å²	74	62 Å²	62	39%	0.387	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	142.9	177.3	-169.3	69.7	0	0	0	110.6	S78 T145 I184 P186	L75-S78 VanDerWaalsContact O-CB 3.26Å; L75-S78 WeakPolarHBondContact O-CB 3.43Å; L75-S78 PolarHBondContact O-N 3.06Å; L75-S78 PolarHBondContact O-OG 2.96Å; L75-T145 PolarHBondContact O-OG1 3.03Å; L75-T145 VanDerWaalsContact O-OG1 3.12Å; L75-I184 HydrophobicContact CD1-CG2 4.37Å; L75-P186 HydrophobicContact CD1-CG 3.88Å
76	Y	85.4	Confident	89.1	Confident	76 Å²	76	58.2 Å²	58.2	30%	0.298	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	143	169.5	178.3	-96.5	0	0	0	112.1	S78 T145 Q146 L147 I183 I184 F185	Y76-S78 PolarHBondContact O-N 2.88Å; Y76-T145 WeakPolarHBondContact CD2-O 3.4Å; Y76-Q146 PolarHBondContact OH-OE1 2.74Å; Y76-L147 HydrophobicContact CD2-CG 4.3Å; Y76-I183 HydrophobicContact CD2-CG2 4.48Å; Y76-I184 PolarHBondContact N-O 2.99Å; Y76-F185 AromaticContact CD1-CD2 3.95Å; Y76-F185 HydrophobicContact CD1-CD2 3.95Å; Y76-F185 AromaticContact CD1-CE2 3.69Å; Y76-F185 HydrophobicContact CD1-CE2 3.69Å; Y76-F185 HydrophobicContact CD2-CD2 4.12Å; Y76-F185 HydrophobicContact CD2-CE2 4.41Å; Y76-F185 HydrophobicContact CE1-CE2 4.09Å; Y76-F185 AromaticContact CG-CD2 3.65Å; Y76-F185 HydrophobicContact CG-CD2 3.65Å; Y76-F185 AromaticContact CG-CE2 3.89Å; Y76-F185 HydrophobicContact CG-CE2 3.89Å
77	N	85.5	Confident	88.7	Confident	101 Å²	101	60.5 Å²	60.5	54%	0.54	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	32.3	-176	-172.5	19.9	0	0	0	114.2	N144 T145	N77-N144 WeakPolarHBondContact CA-OD1 3.37Å; N77-N144 PolarHBondContact OD1-OD1 3.01Å; N77-T145 PolarHBondContact N-O 2.97Å
78	S	86.9	Confident	87.8	Confident	29 Å²	29	57.8 Å²	57.8	20%	0.203	29%	0.287	C	S	.	.			trans	-103.9	-177.9	167.7	71.2	0	0	0	0	110.8	I74 L75 Y76 N144 T145	I74-S78 WeakPolarHBondContact CG1-OG 3.42Å; L75-S78 VanDerWaalsContact O-CB 3.26Å; L75-S78 WeakPolarHBondContact O-CB 3.43Å; L75-S78 PolarHBondContact O-N 3.06Å; L75-S78 PolarHBondContact O-OG 2.96Å; Y76-S78 PolarHBondContact O-N 2.88Å; S78-N144 VanDerWaalsContact O-CA 3.31Å; S78-N144 WeakPolarHBondContact O-CA 3.32Å; S78-N144 PolarHBondContact O-N 2.85Å; S78-N144 VanDerWaalsContact O-N 3.09Å; S78-T145 PolarHBondContact N-OG1 3.1Å; S78-T145 PolarHBondContact O-N 2.72Å; S78-T145 PolarHBondContact O-OG1 2.84Å
79	N	91.9	Very high	86.6	Confident	108 Å²	108	61.4 Å²	61.4	58%	0.578	30%	0.303	S	S	*	.			trans	-116.5	136.5	175.1	-59.8	-30.6	0	0	0	108.6	I142 K143 N144	N79-I142 CarbonylContact C-O 3.59Å; N79-I142 WeakPolarHBondContact CA-O 3.48Å; N79-K143 VanDerWaalsContact OD1-CA 3.24Å; N79-K143 WeakPolarHBondContact OD1-CA 3.48Å; N79-N144 PolarHBondContact OD1-N 3.06Å
80	T	91.6	Very high	84.9	Confident	5 Å²	5	65.1 Å²	65.1	3%	0.031	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	156.7	179.2	-174.9	0	0	0	0	112.4	Q72 I142 T145 L181	Q72-T80 PolarHBondContact OE1-OG1 3.34Å; T80-I142 HydrophobicContact CG2-CB 3.91Å; T80-I142 HydrophobicContact CG2-CD1 4.28Å; T80-I142 HydrophobicContact CG2-CG1 4.48Å; T80-I142 PolarHBondContact N-O 3.48Å; T80-I142 PolarHBondContact O-N 3.17Å; T80-T145 HydrophobicContact CG2-CG2 3.79Å; T80-L181 HydrophobicContact CG2-CD1 4.22Å; T80-L181 HydrophobicContact CG2-CD2 3.96Å
81	I	92.5	Very high	83	Confident	67 Å²	67	64.4 Å²	64.4	34%	0.344	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	115.9	177.8	-59.8	176	0	0	0	109	Q72 Y83 D139 L140 L141	Q72-I81 PolarHBondContact NE2-O 3.29Å; I81-Y83 HydrophobicContact CG2-CD1 4.18Å; I81-Y83 HydrophobicContact CG2-CE1 3.96Å; I81-D139 HydrophobicContact CG2-CB 3.89Å; I81-L140 CarbonylContact C-O 3.55Å; I81-L140 WeakPolarHBondContact CA-O 3.47Å; I81-L141 HydrophobicContact CD1-CD1 4.34Å; I81-L141 HydrophobicContact CG1-CB 4.5Å; I81-L141 HydrophobicContact CG1-CD1 3.76Å
82	M	93.2	Very high	81.1	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	108.4	171.1	-62	-60.9	-90.1	0	0	108.4	P69 Q72 W107 D139 L140 F153 A179	P69-M82 HydrophobicContact CB-CB 4.24Å; P69-M82 HydrophobicContact CB-CE 3.89Å; Q72-M82 HydrophobicContact CG-SD 4.37Å; M82-W107 HydrophobicContact CB-CH2 3.66Å; M82-W107 HydrophobicContact CB-CZ2 4.39Å; M82-W107 HydrophobicContact CB-CZ3 3.99Å; M82-W107 VanDerWaalsContact O-CH2 3.3Å; M82-W107 WeakPolarHBondContact O-CH2 3.37Å; M82-W107 VanDerWaalsContact O-CZ2 3.25Å; M82-W107 WeakPolarHBondContact O-CZ2 3.44Å; M82-D139 CarbonylContact O-C 3.56Å; M82-D139 WeakPolarHBondContact O-CA 3.36Å; M82-L140 HydrophobicContact CB-CB 4.28Å; M82-L140 PolarHBondContact N-O 2.93Å; M82-L140 PolarHBondContact O-N 3.22Å; M82-F153 HydrophobicContact CE-CB 3.72Å; M82-F153 HydrophobicContact CE-CD2 3.73Å; M82-F153 HydrophobicContact CE-CG 3.82Å; M82-F153 HydrophobicContact CG-CD1 4.45Å; M82-F153 HydrophobicContact CG-CG 4.41Å; M82-A179 HydrophobicContact CE-CB 3.8Å
83	Y	92.2	Very high	79	Confident	107 Å²	107	68.6 Å²	68.6	42%	0.42	35%	0.349	S	S	.	.			trans	-68.5	136.5	-174.6	-65.7	-71.2	0	0	0	112.5	G68 P69 I81 D139	G68-Y83 CarbonylContact C-O 3.57Å; P69-Y83 WeakPolarHBondContact CA-O 3.11Å; P69-Y83 WeakPolarHBondContact CD-O 3.39Å; I81-Y83 HydrophobicContact CG2-CD1 4.18Å; I81-Y83 HydrophobicContact CG2-CE1 3.96Å; Y83-D139 VanDerWaalsContact CA-OD1 3.29Å; Y83-D139 WeakPolarHBondContact CA-OD1 3.34Å; Y83-D139 HydrophobicContact CD1-CB 4.47Å; Y83-D139 WeakPolarHBondContact CD1-OD2 3.38Å
84	C	92	Very high	77	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	35%	0.352	C	S	.	.			trans	-144.8	114.4	165.3	-179.8	0	0	0	0	110.5	K67 W107 F138 D139 C155	K67-C84 WeakPolarHBondContact O-CA 3.29Å; C84-W107 HydrophobicContact CB-CH2 3.86Å; C84-W107 HydrophobicContact CB-CZ2 3.32Å; C84-F138 HydrophobicContact CB-CB 4.28Å; C84-F138 CarbonylContact O-C 3.56Å; C84-F138 WeakPolarHBondContact O-CA 3.45Å; C84-F138 PolarHBondContact O-N 2.92Å; C84-D139 PolarHBondContact N-OD1 3.11Å; C84-D139 PolarHBondContact O-N 3.37Å; C84-C155 HydrophobicContact CB-CB 3.59Å; C84-C155 WeakPolarHBondContact CB-SG 3.36Å; C84-C155 WeakPolarHBondContact SG-CB 3.2Å; C84-C155 CovalentContact SG-SG 2.03Å; C84-C155 PolarHBondContact SG-SG 3.45Å
85	R	88.3	Confident	75.3	Confident	82 Å²	82	72 Å²	72	31%	0.309	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	126.6	-175.9	-59.2	-178.2	-173.7	176.1	-1	111.1	K67 Y87 G136 D139	K67-R85 HydrophobicContact CB-CB 4.49Å; K67-R85 PolarHBondContact N-O 3.45Å; K67-R85 PolarHBondContact O-N 2.98Å; R85-Y87 HydrophobicContact CB-CD2 4.34Å; R85-Y87 HydrophobicContact CB-CE2 3.5Å; R85-Y87 VanDerWaalsContact CB-CE2 3.5Å; R85-Y87 WeakPolarHBondContact CD-OH 3.01Å; R85-G136 VanDerWaalsContact CA-O 3.32Å; R85-G136 WeakPolarHBondContact CA-O 3.32Å; R85-D139 WeakPolarHBondContact CG-OD1 3.32Å; R85-D139 IonicContact CZ-OD2 2.67Å; R85-D139 IonicContact NE-OD1 3.05Å; R85-D139 PolarHBondContact NE-OD1 2.99Å; R85-D139 IonicContact NE-OD2 3.87Å; R85-D139 PolarHBondContact NE-OD2 2.92Å; R85-D139 VanDerWaalsContact NE-OD2 3.14Å; R85-D139 IonicContact NH2-OD2 3.42Å; R85-D139 PolarHBondContact NH2-OD2 2.77Å
86	I	81.8	Confident	73.5	Confident	7 Å²	7	75.3 Å²	75.3	4%	0.036	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	129	-178.9	-57.5	171.8	0	0	0	108.4	I66 I103 V105 G136 F138 A157	I66-I86 HydrophobicContact CG1-CG1 4.37Å; I86-I103 HydrophobicContact CD1-CG2 3.75Å; I86-V105 HydrophobicContact CD1-CG2 3.57Å; I86-G136 PolarHBondContact N-O 3.36Å; I86-F138 HydrophobicContact CD1-CD2 3.91Å; I86-F138 HydrophobicContact CD1-CE2 3.72Å; I86-F138 HydrophobicContact CG1-CD2 4.29Å; I86-F138 HydrophobicContact CG1-CE2 4.38Å; I86-A157 HydrophobicContact CD1-CB 3.4Å; I86-A157 VanDerWaalsContact CD1-CB 3.4Å; I86-A157 HydrophobicContact CG1-CB 4.27Å
87	Y	74.9	Confident	71.6	Confident	77 Å²	77	74.9 Å²	74.9	30%	0.302	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	149.1	-178	-60.2	-85.4	0	0	0	110.9	N64 Y65 K67 R85	N64-Y87 CarbonylContact C-O 3.59Å; N64-Y87 WeakPolarHBondContact CA-O 3Å; Y65-Y87 HydrophobicContact CD2-CD2 4.06Å; Y65-Y87 HydrophobicContact CD2-CG 4.49Å; Y65-Y87 VanDerWaalsContact CE1-CB 3.46Å; Y65-Y87 HydrophobicContact CE1-CG 4.42Å; Y65-Y87 AromaticContact CE2-CD2 3.45Å; Y65-Y87 HydrophobicContact CE2-CD2 3.45Å; Y65-Y87 VanDerWaalsContact CE2-CD2 3.45Å; Y65-Y87 HydrophobicContact CE2-CE2 4.35Å; Y65-Y87 AromaticContact CE2-CG 3.75Å; Y65-Y87 HydrophobicContact CE2-CG 3.75Å; Y65-Y87 AromaticContact CZ-CD2 3.93Å; Y65-Y87 AromaticContact CZ-CG 3.71Å; Y65-Y87 PolarHBondContact N-O 2.86Å; Y65-Y87 PolarHBondContact O-N 3.24Å; Y65-Y87 WeakPolarHBondContact OH-CB 3.43Å; K67-Y87 HydrophobicContact CB-CD2 4.31Å; K67-Y87 HydrophobicContact CB-CE2 3.76Å; R85-Y87 HydrophobicContact CB-CD2 4.34Å; R85-Y87 HydrophobicContact CB-CE2 3.5Å; R85-Y87 VanDerWaalsContact CB-CE2 3.5Å; R85-Y87 WeakPolarHBondContact CD-OH 3.01Å
88	N	68.2	Low	69.7	Low	49 Å²	49	77.4 Å²	77.4	26%	0.262	38%	0.384	S	S	.	.			trans	-99.2	150.2	167.5	-170.6	-20.8	0	0	0	108.8	I62 N90 N91	I62-N88 WeakPolarHBondContact CG2-ND2 3.38Å; N88-N90 PolarHBondContact O-N 2.78Å; N88-N91 PolarHBondContact O-N 2.74Å; N88-N91 VanDerWaalsContact O-N 3.11Å
89	N	60.2	Low	67.5	Low	89 Å²	89	82.4 Å²	82.4	48%	0.476	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-23	-173.7	-91.2	-25.1	0	0	0	115.2	N91	N89-N91 VanDerWaalsContact C-N 3.33Å; N89-N91 PolarHBondContact O-N 2.7Å
90	N	58.2	Low	65.5	Low	89 Å²	89	82.2 Å²	82.2	48%	0.476	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-7.2	-177.3	-71.3	-4.8	0	0	0	114.6	N88 I92	N88-N90 PolarHBondContact O-N 2.78Å; N90-I92 WeakPolarHBondContact O-CB 3.41Å; N90-I92 WeakPolarHBondContact O-CD1 3.11Å; N90-I92 WeakPolarHBondContact O-CG1 3.33Å; N90-I92 PolarHBondContact O-N 2.9Å
91	N	53.7	Low	63.9	Low	119 Å²	119	83.7 Å²	83.7	64%	0.636	41%	0.409	S	S	*	.			trans	53.9	11.5	172.6	-103.5	-12.3	0	0	0	117.1	Y65 N88 N89	Y65-N91 PolarHBondContact OH-OD1 2.85Å; N88-N91 PolarHBondContact O-N 2.74Å; N88-N91 VanDerWaalsContact O-N 3.11Å; N89-N91 VanDerWaalsContact C-N 3.33Å; N89-N91 PolarHBondContact O-N 2.7Å
92	I	52.6	Low	62.6	Low	137 Å²	137	88.3 Å²	88.3	70%	0.703	42%	0.423	S	S	*	.			trans	-124.1	112	-169.2	-70	162.3	0	0	0	108.7	N90	N90-I92 WeakPolarHBondContact O-CB 3.41Å; N90-I92 WeakPolarHBondContact O-CD1 3.11Å; N90-I92 WeakPolarHBondContact O-CG1 3.33Å; N90-I92 PolarHBondContact O-N 2.9Å
93	T	47.2	Very low	61.6	Low	105 Å²	105	90.1 Å²	90.1	64%	0.644	43%	0.432	S	S	*	.	S	Bend	trans	54.4	114.3	160.2	59.7	0	0	0	0	119.5	S97	T93-S97 PolarHBondContact O-OG 2.89Å
94	K	47	Very low	61.1	Low	130 Å²	130	89.2 Å²	89.2	57%	0.565	44%	0.435	S	S	*	.			trans	41	109.4	154.2	-59.2	-167	-174.1	-138.4	0	116.8	K96 S97 E135	K94-K96 PolarHBondContact O-N 2.79Å; K94-S97 PolarHBondContact O-N 2.77Å; K94-S97 VanDerWaalsContact O-N 3.08Å; K94-S97 PolarHBondContact O-OG 2.97Å; K94-E135 WeakPolarHBondContact CE-OE1 3.37Å; K94-E135 HydrophobicContact CG-CG 4.4Å; K94-E135 IonicContact NZ-OE1 2.96Å; K94-E135 PolarHBondContact NZ-OE1 2.91Å
95	L	53.6	Low	60.9	Low	62 Å²	62	89.7 Å²	89.7	33%	0.325	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-41.3	-33.7	167.8	-110	157.5	0	0	0	113.6	S97 I103 E134 G136	L95-S97 PolarHBondContact O-N 2.85Å; L95-I103 HydrophobicContact CD1-CD1 3.93Å; L95-I103 HydrophobicContact CD2-CD1 3.62Å; L95-I103 HydrophobicContact CG-CD1 4.44Å; L95-E134 VanDerWaalsContact CB-O 3.31Å; L95-E134 WeakPolarHBondContact CB-O 3.4Å; L95-G136 VanDerWaalsContact CD1-CA 3.49Å
96	K	45.7	Very low	61	Low	142 Å²	142	88.2 Å²	88.2	62%	0.617	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-62.1	5.7	175.9	-136	-178.2	-170.6	172.6	0	117.7	K94 E134	K94-K96 PolarHBondContact O-N 2.79Å; K96-E134 HydrophobicContact CD-CB 4.21Å; K96-E134 WeakPolarHBondContact CD-OE2 3.23Å; K96-E134 WeakPolarHBondContact CE-OE1 3.38Å; K96-E134 VanDerWaalsContact CE-OE2 3.29Å; K96-E134 WeakPolarHBondContact CE-OE2 3.36Å; K96-E134 PolarHBondContact N-O 2.85Å; K96-E134 IonicContact NZ-OE1 2.74Å; K96-E134 PolarHBondContact NZ-OE1 2.81Å; K96-E134 IonicContact NZ-OE2 2.66Å; K96-E134 PolarHBondContact NZ-OE2 3.28Å
97	S	46.5	Very low	61.6	Low	67 Å²	67	87.9 Å²	87.9	47%	0.469	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-121	-5.2	-169.7	65.3	0	0	0	0	117.8	T93 K94 L95	T93-S97 PolarHBondContact O-OG 2.89Å; K94-S97 PolarHBondContact O-N 2.77Å; K94-S97 VanDerWaalsContact O-N 3.08Å; K94-S97 PolarHBondContact O-OG 2.97Å; L95-S97 PolarHBondContact O-N 2.85Å
98	F	45.3	Very low	62.4	Low	154 Å²	154	85.6 Å²	85.6	68%	0.675	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.6	-35.9	-169.3	-102.8	-88.6	0	0	0	118.8
99	Y	40	Very low	63.6	Low	135 Å²	135	83.6 Å²	83.6	53%	0.529	42%	0.415	S	S	.	.			trans	-145.1	155.4	-173.8	-65.6	-73.8	0	0	0	114.2	I62 E101	I62-Y99 HydrophobicContact CD1-CE2 4.18Å; Y99-E101 PolarHBondContact O-N 2.85Å
100	T	50.2	Low	64.9	Low	103 Å²	103	83.4 Å²	83.4	63%	0.632	41%	0.414	S	S	*	.			trans	-75.6	55.8	170.4	50.2	0	0	0	0	111.5	Y162	T100-Y162 VanDerWaalsContact O-CD2 3.31Å; T100-Y162 WeakPolarHBondContact O-CD2 3.44Å
101	E	59.6	Low	66.3	Low	36 Å²	36	82.2 Å²	82.2	17%	0.168	42%	0.423	C	S	.	.			trans	-88.2	113.5	-178.2	-76.2	173.3	-156.7	0	0	111	Y99 I103 V159	Y99-E101 PolarHBondContact O-N 2.85Å; E101-I103 HydrophobicContact CB-CG1 4.34Å; E101-I103 PolarHBondContact O-N 2.68Å; E101-V159 HydrophobicContact CG-CG1 4.47Å
102	Y	64.5	Low	68	Low	165 Å²	165	84.1 Å²	84.1	65%	0.647	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	101.6	165.1	-77.4	-93	0	0	0	108.6	K160 Y162	Y102-K160 PolarHBondContact O-N 3.4Å; Y102-Y162 AromaticContact CD2-CE2 3.87Å; Y102-Y162 HydrophobicContact CD2-CE2 3.87Å
103	I	72.8	Confident	69.7	Low	37 Å²	37	79.7 Å²	79.7	19%	0.19	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	121.2	172.5	-54.4	-176.8	0	0	0	108.7	I86 L95 E101 V105 F138 A157 V159	I86-I103 HydrophobicContact CD1-CG2 3.75Å; L95-I103 HydrophobicContact CD1-CD1 3.93Å; L95-I103 HydrophobicContact CD2-CD1 3.62Å; L95-I103 HydrophobicContact CG-CD1 4.44Å; E101-I103 HydrophobicContact CB-CG1 4.34Å; E101-I103 PolarHBondContact O-N 2.68Å; I103-V105 HydrophobicContact CG2-CG2 3.75Å; I103-F138 HydrophobicContact CG2-CZ 4.48Å; I103-A157 HydrophobicContact CG2-CB 4.46Å; I103-V159 HydrophobicContact CG1-CG1 4.28Å; I103-V159 HydrophobicContact CG1-CG2 4.23Å; I103-V159 HydrophobicContact CG2-CG2 4.38Å
104	N	81.7	Confident	71.8	Confident	89 Å²	89	75 Å²	75	48%	0.476	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	120.4	170.7	-177.6	18.5	0	0	0	109.3	N158	N104-N158 PolarHBondContact N-O 2.82Å; N104-N158 PolarHBondContact O-N 3Å
105	V	87	Confident	73.6	Confident	9 Å²	9	71.4 Å²	71.4	6%	0.055	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	133.9	-177.8	-174.8	0	0	0	0	110.4	I86 I103 F138 C155 Q156 A157	I86-V105 HydrophobicContact CD1-CG2 3.57Å; I103-V105 HydrophobicContact CG2-CG2 3.75Å; V105-F138 HydrophobicContact CB-CB 4.45Å; V105-F138 HydrophobicContact CB-CD1 3.59Å; V105-F138 HydrophobicContact CB-CD2 4.42Å; V105-F138 HydrophobicContact CB-CE1 3.82Å; V105-F138 HydrophobicContact CB-CG 3.91Å; V105-F138 HydrophobicContact CB-CZ 4.35Å; V105-F138 HydrophobicContact CG1-CB 3.9Å; V105-F138 HydrophobicContact CG1-CD1 4Å; V105-F138 HydrophobicContact CG1-CD2 4.46Å; V105-F138 HydrophobicContact CG1-CG 3.87Å; V105-F138 HydrophobicContact CG2-CD1 3.63Å; V105-F138 HydrophobicContact CG2-CD2 3.75Å; V105-F138 HydrophobicContact CG2-CE1 3.49Å; V105-F138 VanDerWaalsContact CG2-CE1 3.49Å; V105-F138 HydrophobicContact CG2-CE2 3.65Å; V105-F138 HydrophobicContact CG2-CG 3.74Å; V105-F138 HydrophobicContact CG2-CZ 3.51Å; V105-C155 VanDerWaalsContact CG1-SG 3.56Å; V105-Q156 WeakPolarHBondContact CA-O 3.09Å; V105-A157 HydrophobicContact CG2-CB 4.08Å
106	Q	91	Very high	75	Confident	52 Å²	52	72.2 Å²	72.2	24%	0.243	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	145.4	172.8	66.3	-175.6	13	0	0	110.2	V114 Q156	Q106-V114 CarbonylContact C-O 3.53Å; Q106-V114 VanDerWaalsContact CA-O 3.31Å; Q106-V114 WeakPolarHBondContact CA-O 3.45Å; Q106-V114 WeakPolarHBondContact CB-O 3.5Å; Q106-Q156 HydrophobicContact CG-CB 3.93Å; Q106-Q156 HydrophobicContact CG-CG 4.37Å; Q106-Q156 PolarHBondContact N-O 3.1Å; Q106-Q156 VanDerWaalsContact NE2-CD 3.3Å; Q106-Q156 PolarHBondContact O-N 2.71Å
107	W	93.2	Very high	76.6	Confident	0 Å²	0	73 Å²	73	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	132.9	166.3	-78.6	88.3	0	0	0	108.8	P69 M82 C84 I109 G113 V114 M129 F138 L140 F153 I154 C155	P69-W107 HydrophobicContact CB-CH2 4.18Å; P69-W107 HydrophobicContact CB-CZ3 4.26Å; P69-W107 HydrophobicContact CG-CH2 4.13Å; P69-W107 HydrophobicContact CG-CZ3 3.87Å; M82-W107 HydrophobicContact CB-CH2 3.66Å; M82-W107 HydrophobicContact CB-CZ2 4.39Å; M82-W107 HydrophobicContact CB-CZ3 3.99Å; M82-W107 VanDerWaalsContact O-CH2 3.3Å; M82-W107 WeakPolarHBondContact O-CH2 3.37Å; M82-W107 VanDerWaalsContact O-CZ2 3.25Å; M82-W107 WeakPolarHBondContact O-CZ2 3.44Å; C84-W107 HydrophobicContact CB-CH2 3.86Å; C84-W107 HydrophobicContact CB-CZ2 3.32Å; W107-I109 HydrophobicContact CB-CG1 4.33Å; W107-G113 CarbonylContact O-C 3.58Å; W107-G113 WeakPolarHBondContact O-CA 3.48Å; W107-V114 HydrophobicContact CB-CG2 4.2Å; W107-V114 PolarHBondContact N-O 2.77Å; W107-V114 WeakPolarHBondContact O-CG2 3.29Å; W107-V114 PolarHBondContact O-N 3.34Å; W107-M129 PolarHBondContact NE1-SD 3.42Å; W107-F138 PolarHBondContact NE1-O 3.05Å; W107-L140 HydrophobicContact CD2-CB 4.01Å; W107-L140 HydrophobicContact CD2-CD2 3.94Å; W107-L140 VanDerWaalsContact CE2-CB 3.48Å; W107-L140 HydrophobicContact CE3-CD2 4.14Å; W107-L140 HydrophobicContact CG-CB 4.43Å; W107-L140 HydrophobicContact CG-CD2 4.13Å; W107-L140 HydrophobicContact CH2-CB 4.27Å; W107-L140 HydrophobicContact CZ2-CB 3.61Å; W107-F153 HydrophobicContact CE3-CB 4.2Å; W107-F153 HydrophobicContact CE3-CD1 4.39Å; W107-F153 HydrophobicContact CZ3-CB 3.99Å; W107-I154 CarbonylContact C-O 3.51Å; W107-I154 WeakPolarHBondContact CA-O 3.31Å; W107-C155 HydrophobicContact CD2-CB 4.38Å; W107-C155 HydrophobicContact CE3-CB 4.29Å; W107-C155 HydrophobicContact CH2-CB 4.17Å; W107-C155 HydrophobicContact CZ2-CB 4.25Å; W107-C155 HydrophobicContact CZ3-CB 4.19Å
108	I	92.8	Very high	78.5	Confident	29 Å²	29	71.7 Å²	71.7	15%	0.149	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	117.7	167.8	-53	169.5	0	0	0	106.1	G111 F112 F153 I154 Q156	I108-G111 VanDerWaalsContact CG2-C 3.47Å; I108-G111 VanDerWaalsContact CG2-CA 3.43Å; I108-F112 WeakPolarHBondContact CA-O 3.41Å; I108-F153 WeakPolarHBondContact O-CA 3.26Å; I108-I154 HydrophobicContact CB-CB 4.17Å; I108-I154 HydrophobicContact CD1-CB 4.46Å; I108-I154 HydrophobicContact CD1-CG2 4.41Å; I108-I154 PolarHBondContact N-O 2.99Å; I108-I154 PolarHBondContact O-N 3.38Å; I108-Q156 HydrophobicContact CD1-CB 4.43Å
109	I	92.1	Very high	80.4	Confident	7 Å²	7	64.4 Å²	64.4	4%	0.036	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	111.2	179.6	-53.6	176.7	0	0	0	106	W107 G111 F112 V114 L119 F123 Y127 L140 A151 S152 F153	W107-I109 HydrophobicContact CB-CG1 4.33Å; I109-G111 VanDerWaalsContact C-N 3.25Å; I109-G111 PolarHBondContact O-N 2.88Å; I109-F112 PolarHBondContact N-O 2.81Å; I109-F112 WeakPolarHBondContact O-CB 3.42Å; I109-F112 PolarHBondContact O-N 2.86Å; I109-V114 HydrophobicContact CD1-CG2 3.83Å; I109-V114 HydrophobicContact CG1-CG2 4.24Å; I109-L119 HydrophobicContact CD1-CD1 4.36Å; I109-F123 HydrophobicContact CB-CZ 4.42Å; I109-F123 HydrophobicContact CD1-CD2 4.49Å; I109-F123 HydrophobicContact CD1-CE2 3.76Å; I109-F123 HydrophobicContact CD1-CZ 3.99Å; I109-F123 HydrophobicContact CG2-CZ 4.19Å; I109-Y127 HydrophobicContact CD1-CD1 4.17Å; I109-Y127 HydrophobicContact CD1-CE1 3.97Å; I109-L140 HydrophobicContact CD1-CD2 4.28Å; I109-A151 HydrophobicContact CG2-CB 3.63Å; I109-S152 WeakPolarHBondContact CA-O 3.36Å; I109-F153 HydrophobicContact CB-CE1 4.5Å; I109-F153 HydrophobicContact CD1-CD1 4.34Å; I109-F153 HydrophobicContact CD1-CE1 3.96Å; I109-F153 HydrophobicContact CG1-CD1 3.89Å; I109-F153 HydrophobicContact CG1-CE1 3.9Å; I109-F153 HydrophobicContact CG2-CD1 4.38Å; I109-F153 HydrophobicContact CG2-CE1 3.91Å; I109-F153 HydrophobicContact CG2-CZ 4.16Å
110	D	88	Confident	82.5	Confident	85 Å²	85	63.6 Å²	63.6	46%	0.455	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.3	44.8	-172.8	-74.1	-23.9	0	0	0	115	F112 A151 S152	D110-F112 VanDerWaalsContact C-N 3.27Å; D110-F112 WeakPolarHBondContact O-CD2 3.45Å; D110-F112 PolarHBondContact O-N 3.02Å; D110-A151 HydrophobicContact CB-CB 4.47Å; D110-A151 VanDerWaalsContact OD2-CA 3.27Å; D110-A151 WeakPolarHBondContact OD2-CA 3.35Å; D110-A151 WeakPolarHBondContact OD2-CB 3.4Å; D110-S152 PolarHBondContact N-O 3.47Å; D110-S152 WeakPolarHBondContact OD1-CB 3.4Å; D110-S152 PolarHBondContact OD1-N 3.44Å; D110-S152 PolarHBondContact OD1-OG 3.42Å
111	G	88	Confident	84	Confident	64 Å²	64	62.9 Å²	62.9	66%	0.66	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	-10.8	-179.9	0	0	0	0	0	114.8	I108 I109	I108-G111 VanDerWaalsContact CG2-C 3.47Å; I108-G111 VanDerWaalsContact CG2-CA 3.43Å; I109-G111 VanDerWaalsContact C-N 3.25Å; I109-G111 PolarHBondContact O-N 2.88Å
112	F	89.2	Confident	85.2	Confident	158 Å²	158	65.5 Å²	65.5	69%	0.693	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	114.6	177.1	-62.7	-82.5	0	0	0	111.6	I108 I109 D110	I108-F112 WeakPolarHBondContact CA-O 3.41Å; I109-F112 PolarHBondContact N-O 2.81Å; I109-F112 WeakPolarHBondContact O-CB 3.42Å; I109-F112 PolarHBondContact O-N 2.86Å; D110-F112 VanDerWaalsContact C-N 3.27Å; D110-F112 WeakPolarHBondContact O-CD2 3.45Å; D110-F112 PolarHBondContact O-N 3.02Å
113	G	89.3	Confident	86.2	Confident	45 Å²	45	60.1 Å²	60.1	46%	0.464	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	122.2	176.2	0	0	0	0	0	112.8	W107	W107-G113 CarbonylContact O-C 3.58Å; W107-G113 WeakPolarHBondContact O-CA 3.48Å
114	V	90.2	Very high	86.7	Confident	7 Å²	7	59.8 Å²	59.8	4%	0.042	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	136.4	177.9	-70.5	0	0	0	0	111.7	Q106 W107 I109 S118 L119 V122 F123	Q106-V114 CarbonylContact C-O 3.53Å; Q106-V114 VanDerWaalsContact CA-O 3.31Å; Q106-V114 WeakPolarHBondContact CA-O 3.45Å; Q106-V114 WeakPolarHBondContact CB-O 3.5Å; W107-V114 HydrophobicContact CB-CG2 4.2Å; W107-V114 PolarHBondContact N-O 2.77Å; W107-V114 WeakPolarHBondContact O-CG2 3.29Å; W107-V114 PolarHBondContact O-N 3.34Å; I109-V114 HydrophobicContact CD1-CG2 3.83Å; I109-V114 HydrophobicContact CG1-CG2 4.24Å; V114-S118 WeakPolarHBondContact CA-OG 3.4Å; V114-L119 HydrophobicContact CB-CD1 4.45Å; V114-L119 HydrophobicContact CG2-CD1 3.73Å; V114-V122 HydrophobicContact CG1-CG2 4.39Å; V114-F123 HydrophobicContact CG1-CE2 4.32Å; V114-F123 HydrophobicContact CG2-CE2 4.48Å
115	N	85.6	Confident	86.8	Confident	54 Å²	54	61 Å²	61	29%	0.289	36%	0.355	S	S	.	.			trans	-100.1	178.2	172.8	76.3	-0.4	0	0	0	109.5	E117 S118 L119	N115-E117 PolarHBondContact O-N 3.34Å; N115-E117 VanDerWaalsContact O-N 3.15Å; N115-E117 PolarHBondContact OD1-N 3.33Å; N115-E117 VanDerWaalsContact OD1-N 3.1Å; N115-S118 PolarHBondContact N-OG 2.86Å; N115-S118 PolarHBondContact O-N 2.79Å; N115-S118 PolarHBondContact O-OG 3.49Å; N115-S118 PolarHBondContact OD1-N 2.75Å; N115-S118 PolarHBondContact OD1-OG 3.36Å; N115-S118 VanDerWaalsContact OD1-OG 3.05Å; N115-L119 VanDerWaalsContact O-CB 3.25Å; N115-L119 WeakPolarHBondContact O-CB 3.39Å; N115-L119 PolarHBondContact O-N 3.35Å
116	N	82	Confident	87	Confident	78 Å²	78	63.3 Å²	63.3	42%	0.417	36%	0.363	S	S	.	.	H	α-helix	trans	-60.4	-28.5	-176.4	-159.6	31	0	0	0	114	M129	N116-M129 VanDerWaalsContact CA-CE 3.4Å; N116-M129 HydrophobicContact CB-CE 3.61Å
117	E	79.9	Confident	87	Confident	160 Å²	160	61.1 Å²	61.1	75%	0.748	35%	0.353	S	S	*	.	H	α-helix	trans	-80.2	-43.3	-178.8	-60.1	171.1	164.2	0	0	111.2	N115	N115-E117 PolarHBondContact O-N 3.34Å; N115-E117 VanDerWaalsContact O-N 3.15Å; N115-E117 PolarHBondContact OD1-N 3.33Å; N115-E117 VanDerWaalsContact OD1-N 3.1Å
118	S	85.8	Confident	86.9	Confident	39 Å²	39	62.6 Å²	62.6	27%	0.273	36%	0.363	S	S	.	.	H	α-helix	trans	-78.7	-25.4	178.9	61.8	0	0	0	0	113.5	V114 N115 K120 A121 V122	V114-S118 WeakPolarHBondContact CA-OG 3.4Å; N115-S118 PolarHBondContact N-OG 2.86Å; N115-S118 PolarHBondContact O-N 2.79Å; N115-S118 PolarHBondContact O-OG 3.49Å; N115-S118 PolarHBondContact OD1-N 2.75Å; N115-S118 PolarHBondContact OD1-OG 3.36Å; N115-S118 VanDerWaalsContact OD1-OG 3.05Å; S118-K120 VanDerWaalsContact C-N 3.32Å; S118-K120 PolarHBondContact O-N 2.78Å; S118-A121 WeakPolarHBondContact O-CB 3.33Å; S118-A121 PolarHBondContact O-N 3.16Å; S118-V122 WeakPolarHBondContact O-CG2 3.38Å; S118-V122 PolarHBondContact O-N 3.48Å
119	L	86.3	Confident	86.7	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.005	36%	0.361	C	S	.	.	H	α-helix	trans	-52.2	-49.1	176	-168.4	81.7	0	0	0	111.9	I109 V114 N115 A121 V122 F123 Y127 M129 L140	I109-L119 HydrophobicContact CD1-CD1 4.36Å; V114-L119 HydrophobicContact CB-CD1 4.45Å; V114-L119 HydrophobicContact CG2-CD1 3.73Å; N115-L119 VanDerWaalsContact O-CB 3.25Å; N115-L119 WeakPolarHBondContact O-CB 3.39Å; N115-L119 PolarHBondContact O-N 3.35Å; L119-A121 VanDerWaalsContact C-N 3.35Å; L119-V122 PolarHBondContact O-N 2.99Å; L119-F123 HydrophobicContact CD1-CD2 4.42Å; L119-F123 PolarHBondContact O-N 3.35Å; L119-Y127 HydrophobicContact CD1-CD1 4.2Å; L119-M129 HydrophobicContact CD2-CG 4.4Å; L119-L140 HydrophobicContact CD1-CD1 3.87Å; L119-L140 HydrophobicContact CD2-CD1 3.75Å; L119-L140 HydrophobicContact CG-CD1 4.4Å
120	K	82.9	Confident	86.4	Confident	118 Å²	118	66.1 Å²	66.1	51%	0.513	39%	0.387	S	S	.	.	H	α-helix	trans	-71.3	-27.8	178.1	179.7	164.7	174.7	154.2	0	113	S118 G124 D125	S118-K120 VanDerWaalsContact C-N 3.32Å; S118-K120 PolarHBondContact O-N 2.78Å; K120-G124 WeakPolarHBondContact O-CA 3.15Å; K120-G124 PolarHBondContact O-N 3.26Å; K120-G124 VanDerWaalsContact O-N 3.13Å; K120-D125 WeakPolarHBondContact CE-OD1 3.25Å; K120-D125 IonicContact NZ-OD1 2.68Å; K120-D125 PolarHBondContact NZ-OD1 3.29Å; K120-D125 IonicContact NZ-OD2 2.62Å
121	A	82.9	Confident	85.6	Confident	87 Å²	87	62.7 Å²	62.7	72%	0.719	37%	0.372	S	S	*	.	H	α-helix	trans	-74.9	-32.9	177.1	0	0	0	0	0	112.8	S118 L119	S118-A121 WeakPolarHBondContact O-CB 3.33Å; S118-A121 PolarHBondContact O-N 3.16Å; L119-A121 VanDerWaalsContact C-N 3.35Å
122	V	84.4	Confident	85.2	Confident	92 Å²	92	62.6 Å²	62.6	56%	0.558	36%	0.36	S	S	*	.	H	α-helix	trans	-88.4	-45	-179.1	179	0	0	0	0	111.9	V114 S118 L119	V114-V122 HydrophobicContact CG1-CG2 4.39Å; S118-V122 WeakPolarHBondContact O-CG2 3.38Å; S118-V122 PolarHBondContact O-N 3.48Å; L119-V122 PolarHBondContact O-N 2.99Å
123	F	84.2	Confident	84.7	Confident	51 Å²	51	59.6 Å²	59.6	22%	0.224	35%	0.35	C	S	.	.	H	α-helix	trans	-113.1	6.5	-171.3	-57.3	-82.8	0	0	0	114.4	I109 V114 L119 Y127	I109-F123 HydrophobicContact CB-CZ 4.42Å; I109-F123 HydrophobicContact CD1-CD2 4.49Å; I109-F123 HydrophobicContact CD1-CE2 3.76Å; I109-F123 HydrophobicContact CD1-CZ 3.99Å; I109-F123 HydrophobicContact CG2-CZ 4.19Å; V114-F123 HydrophobicContact CG1-CE2 4.32Å; V114-F123 HydrophobicContact CG2-CE2 4.48Å; L119-F123 HydrophobicContact CD1-CD2 4.42Å; L119-F123 PolarHBondContact O-N 3.35Å; F123-Y127 HydrophobicContact CB-CD1 4.13Å; F123-Y127 HydrophobicContact CB-CD2 3.42Å; F123-Y127 VanDerWaalsContact CB-CD2 3.42Å; F123-Y127 HydrophobicContact CB-CE2 3.93Å; F123-Y127 HydrophobicContact CB-CG 3.54Å; F123-Y127 HydrophobicContact CD1-CD1 4.45Å; F123-Y127 HydrophobicContact CD1-CD2 4.32Å; F123-Y127 HydrophobicContact CD1-CE1 4.13Å; F123-Y127 AromaticContact CD1-CE2 3.98Å; F123-Y127 HydrophobicContact CD1-CE2 3.98Å; F123-Y127 AromaticContact CD1-CZ 3.88Å; F123-Y127 HydrophobicContact CD2-CD1 4.12Å; F123-Y127 HydrophobicContact CD2-CE1 4.42Å; F123-Y127 HydrophobicContact CD2-CG 4.35Å; F123-Y127 HydrophobicContact CE1-CE1 4.42Å; F123-Y127 AromaticContact CG-CD1 3.99Å; F123-Y127 HydrophobicContact CG-CD1 3.99Å; F123-Y127 AromaticContact CG-CD2 4Å; F123-Y127 HydrophobicContact CG-CD2 4Å; F123-Y127 HydrophobicContact CG-CE1 4.14Å; F123-Y127 HydrophobicContact CG-CE2 4.13Å; F123-Y127 AromaticContact CG-CG 3.93Å; F123-Y127 HydrophobicContact CG-CG 3.93Å
124	G	83.4	Confident	83.8	Confident	31 Å²	31	62.6 Å²	62.6	32%	0.32	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	66	-158.7	179.9	0	0	0	0	0	114	K120 R126	K120-G124 WeakPolarHBondContact O-CA 3.15Å; K120-G124 PolarHBondContact O-N 3.26Å; K120-G124 VanDerWaalsContact O-N 3.13Å; G124-R126 PolarHBondContact O-N 3.18Å; G124-R126 VanDerWaalsContact O-N 3.16Å
125	D	85.1	Confident	83	Confident	113 Å²	113	66.8 Å²	66.8	60%	0.604	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-71.2	-0.9	178.6	-78.4	-56.8	0	0	0	114.7	K120	K120-D125 WeakPolarHBondContact CE-OD1 3.25Å; K120-D125 IonicContact NZ-OD1 2.68Å; K120-D125 PolarHBondContact NZ-OD1 3.29Å; K120-D125 IonicContact NZ-OD2 2.62Å
126	R	90	Very high	82.6	Confident	58 Å²	58	64.2 Å²	64.2	22%	0.219	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-73	-38.6	178.2	-60.5	-162.9	-54.5	109.6	-3.7	111.8	G124 K143 N144 D149	G124-R126 PolarHBondContact O-N 3.18Å; G124-R126 VanDerWaalsContact O-N 3.16Å; R126-K143 PolarHBondContact O-N 2.02Å; R126-N144 PolarHBondContact NH1-O 2.79Å; R126-D149 IonicContact CZ-OD1 3.4Å; R126-D149 IonicContact CZ-OD2 3.39Å; R126-D149 VanDerWaalsContact NH1-CG 3.34Å; R126-D149 IonicContact NH1-OD1 2.68Å; R126-D149 PolarHBondContact NH1-OD1 3.17Å; R126-D149 VanDerWaalsContact NH1-OD1 3.14Å; R126-D149 IonicContact NH1-OD2 3.47Å; R126-D149 PolarHBondContact NH1-OD2 3.46Å; R126-D149 IonicContact NH2-OD1 2.7Å; R126-D149 PolarHBondContact NH2-OD1 2.97Å; R126-D149 IonicContact NH2-OD2 3.14Å
127	Y	92.3	Very high	82.9	Confident	6 Å²	6	62 Å²	62	2%	0.024	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	137	-177.6	-74.2	-128.9	0	0	0	110.1	I109 L119 F123 L140 L141 I142 D149 F153	I109-Y127 HydrophobicContact CD1-CD1 4.17Å; I109-Y127 HydrophobicContact CD1-CE1 3.97Å; L119-Y127 HydrophobicContact CD1-CD1 4.2Å; F123-Y127 HydrophobicContact CB-CD1 4.13Å; F123-Y127 HydrophobicContact CB-CD2 3.42Å; F123-Y127 VanDerWaalsContact CB-CD2 3.42Å; F123-Y127 HydrophobicContact CB-CE2 3.93Å; F123-Y127 HydrophobicContact CB-CG 3.54Å; F123-Y127 HydrophobicContact CD1-CD1 4.45Å; F123-Y127 HydrophobicContact CD1-CD2 4.32Å; F123-Y127 HydrophobicContact CD1-CE1 4.13Å; F123-Y127 AromaticContact CD1-CE2 3.98Å; F123-Y127 HydrophobicContact CD1-CE2 3.98Å; F123-Y127 AromaticContact CD1-CZ 3.88Å; F123-Y127 HydrophobicContact CD2-CD1 4.12Å; F123-Y127 HydrophobicContact CD2-CE1 4.42Å; F123-Y127 HydrophobicContact CD2-CG 4.35Å; F123-Y127 HydrophobicContact CE1-CE1 4.42Å; F123-Y127 AromaticContact CG-CD1 3.99Å; F123-Y127 HydrophobicContact CG-CD1 3.99Å; F123-Y127 AromaticContact CG-CD2 4Å; F123-Y127 HydrophobicContact CG-CD2 4Å; F123-Y127 HydrophobicContact CG-CE1 4.14Å; F123-Y127 HydrophobicContact CG-CE2 4.13Å; F123-Y127 AromaticContact CG-CG 3.93Å; F123-Y127 HydrophobicContact CG-CG 3.93Å; Y127-L140 HydrophobicContact CD1-CD1 4.12Å; Y127-L140 HydrophobicContact CD1-CD2 4.4Å; Y127-L141 CarbonylContact C-O 3.58Å; Y127-L141 WeakPolarHBondContact CA-O 3.4Å; Y127-I142 HydrophobicContact CD1-CD1 4.31Å; Y127-I142 HydrophobicContact CD1-CG1 3.91Å; Y127-I142 HydrophobicContact CD2-CG1 4.42Å; Y127-I142 HydrophobicContact CD2-CG2 4.09Å; Y127-I142 HydrophobicContact CE1-CD1 3.7Å; Y127-I142 HydrophobicContact CE1-CG1 3.77Å; Y127-I142 HydrophobicContact CE2-CG1 4.32Å; Y127-I142 HydrophobicContact CE2-CG2 3.68Å; Y127-I142 HydrophobicContact CG-CG1 4.23Å; Y127-D149 VanDerWaalsContact CE2-OD1 3.27Å; Y127-D149 WeakPolarHBondContact CE2-OD1 3.32Å; Y127-D149 WeakPolarHBondContact OH-CB 3.41Å; Y127-D149 PolarHBondContact OH-OD1 3.03Å; Y127-F153 HydrophobicContact CE1-CE1 4.23Å
128	S	90.4	Very high	83.3	Confident	32 Å²	32	55 Å²	55	22%	0.224	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	150.4	178.1	53	0	0	0	0	112	P130 L141	S128-P130 VanDerWaalsContact O-CD 3.23Å; S128-P130 WeakPolarHBondContact O-CD 3.5Å; S128-L141 PolarHBondContact N-O 3.36Å; S128-L141 PolarHBondContact O-N 2.94Å
129	M	89.7	Confident	83.6	Confident	19 Å²	19	53.7 Å²	53.7	9%	0.094	30%	0.303	C	S	.	.			trans	-106.9	88.1	165.4	-73.2	-177.1	-79.4	0	0	109.5	W107 N116 L119 G131 L140	W107-M129 PolarHBondContact NE1-SD 3.42Å; N116-M129 VanDerWaalsContact CA-CE 3.4Å; N116-M129 HydrophobicContact CB-CE 3.61Å; L119-M129 HydrophobicContact CD2-CG 4.4Å; M129-G131 VanDerWaalsContact C-N 3.32Å; M129-G131 PolarHBondContact O-N 2.94Å; M129-L140 HydrophobicContact CG-CD1 4.44Å
130	P	85	Confident	84	Confident	90 Å²	90	53.7 Å²	53.7	58%	0.584	30%	0.303	S	S	*	.			trans	-80.1	-7.9	-173.2	32.8	-38.4	0	0	0	114.6	S128 D139 L141	S128-P130 VanDerWaalsContact O-CD 3.23Å; S128-P130 WeakPolarHBondContact O-CD 3.5Å; P130-D139 WeakPolarHBondContact CD-O 3.35Å; P130-L141 HydrophobicContact CG-CB 4.14Å; P130-L141 HydrophobicContact CG-CD2 4.32Å
131	G	71.7	Confident	84.4	Confident	14 Å²	14	49.6 Å²	49.6	14%	0.144	29%	0.286	C	S	.	.	S	Bend	trans	-67.1	152.4	-170.7	0	0	0	0	0	114.3	M129 I133	M129-G131 VanDerWaalsContact C-N 3.32Å; M129-G131 PolarHBondContact O-N 2.94Å; G131-I133 PolarHBondContact O-N 3.22Å
132	P	79.7	Confident	84.9	Confident	61 Å²	61	45.5 Å²	45.5	40%	0.396	25%	0.252	S	S	.	.			trans	-67.2	98.1	169.4	28	-33.6	0	0	0	110	E134 E135 N137	P132-E134 PolarHBondContact O-N 3.29Å; P132-E134 VanDerWaalsContact O-N 3.09Å; P132-E135 HydrophobicContact CB-CB 4.35Å; P132-E135 HydrophobicContact CB-CG 4.13Å; P132-E135 HydrophobicContact CG-CB 4.14Å; P132-E135 HydrophobicContact CG-CG 4.21Å; P132-E135 PolarHBondContact O-N 3.29Å; P132-N137 HydrophobicContact CG-CB 4.33Å; P132-N137 PolarHBondContact O-N 3.47Å
133	I	77.9	Confident	85.2	Confident	96 Å²	96	45.5 Å²	45.5	49%	0.492	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-47.3	-37.9	175.3	-67.5	168.1	0	0	0	111.4	G131 E135 G136 F138	G131-I133 PolarHBondContact O-N 3.22Å; I133-E135 PolarHBondContact O-N 3.17Å; I133-G136 PolarHBondContact O-N 3.49Å; I133-G136 VanDerWaalsContact O-N 3.1Å; I133-F138 HydrophobicContact CB-CE1 4.2Å; I133-F138 HydrophobicContact CB-CZ 4.43Å; I133-F138 HydrophobicContact CG1-CD1 4.38Å; I133-F138 HydrophobicContact CG1-CE1 3.97Å; I133-F138 HydrophobicContact CG2-CE1 3.76Å; I133-F138 HydrophobicContact CG2-CZ 3.83Å
134	E	69.4	Low	85.4	Confident	108 Å²	108	46.1 Å²	46.1	51%	0.505	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-66.9	-14.9	180	-47.6	-174.2	146	0	0	114.9	L95 K96 P132	L95-E134 VanDerWaalsContact CB-O 3.31Å; L95-E134 WeakPolarHBondContact CB-O 3.4Å; K96-E134 HydrophobicContact CD-CB 4.21Å; K96-E134 WeakPolarHBondContact CD-OE2 3.23Å; K96-E134 WeakPolarHBondContact CE-OE1 3.38Å; K96-E134 VanDerWaalsContact CE-OE2 3.29Å; K96-E134 WeakPolarHBondContact CE-OE2 3.36Å; K96-E134 PolarHBondContact N-O 2.85Å; K96-E134 IonicContact NZ-OE1 2.74Å; K96-E134 PolarHBondContact NZ-OE1 2.81Å; K96-E134 IonicContact NZ-OE2 2.66Å; K96-E134 PolarHBondContact NZ-OE2 3.28Å; P132-E134 PolarHBondContact O-N 3.29Å; P132-E134 VanDerWaalsContact O-N 3.09Å
135	E	74.2	Confident	85.7	Confident	94 Å²	94	44.6 Å²	44.6	44%	0.439	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-107.8	7.5	177.1	-56	-168.9	154.1	0	0	111.9	K94 P132 I133 N137	K94-E135 WeakPolarHBondContact CE-OE1 3.37Å; K94-E135 HydrophobicContact CG-CG 4.4Å; K94-E135 IonicContact NZ-OE1 2.96Å; K94-E135 PolarHBondContact NZ-OE1 2.91Å; P132-E135 HydrophobicContact CB-CB 4.35Å; P132-E135 HydrophobicContact CB-CG 4.13Å; P132-E135 HydrophobicContact CG-CB 4.14Å; P132-E135 HydrophobicContact CG-CG 4.21Å; P132-E135 PolarHBondContact O-N 3.29Å; I133-E135 PolarHBondContact O-N 3.17Å; E135-N137 VanDerWaalsContact C-N 3.35Å
136	G	77.8	Confident	85.7	Confident	1 Å²	1	41 Å²	41	1%	0.01	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	14.9	-179.8	0	0	0	0	0	114.3	R85 I86 L95 I133 F138	R85-G136 VanDerWaalsContact CA-O 3.32Å; R85-G136 WeakPolarHBondContact CA-O 3.32Å; I86-G136 PolarHBondContact N-O 3.36Å; L95-G136 VanDerWaalsContact CD1-CA 3.49Å; I133-G136 PolarHBondContact O-N 3.49Å; I133-G136 VanDerWaalsContact O-N 3.1Å; G136-F138 WeakPolarHBondContact O-CD2 3.39Å
137	N	87.8	Confident	85.4	Confident	31 Å²	31	39.4 Å²	39.4	17%	0.166	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-93.4	116.5	178.3	-174	-25.3	0	0	0	111	P132 E135 D139	P132-N137 HydrophobicContact CG-CB 4.33Å; P132-N137 PolarHBondContact O-N 3.47Å; E135-N137 VanDerWaalsContact C-N 3.35Å; N137-D139 PolarHBondContact ND2-OD2 3.07Å; N137-D139 VanDerWaalsContact ND2-OD2 3.13Å; N137-D139 VanDerWaalsContact OD1-CB 3.25Å; N137-D139 WeakPolarHBondContact OD1-CB 3.46Å; N137-D139 PolarHBondContact OD1-N 2.92Å; N137-D139 PolarHBondContact OD1-OD1 2.97Å; N137-D139 PolarHBondContact OD1-OD2 2.83Å; N137-D139 VanDerWaalsContact OD1-OD2 3.12Å
138	F	89.1	Confident	85	Confident	14 Å²	14	46.5 Å²	46.5	6%	0.061	24%	0.244	C	C	.	.			trans	-126.7	28	177.3	-58.9	-89	0	0	0	111.3	C84 I86 I103 V105 W107 I133 G136 L140	C84-F138 HydrophobicContact CB-CB 4.28Å; C84-F138 CarbonylContact O-C 3.56Å; C84-F138 WeakPolarHBondContact O-CA 3.45Å; C84-F138 PolarHBondContact O-N 2.92Å; I86-F138 HydrophobicContact CD1-CD2 3.91Å; I86-F138 HydrophobicContact CD1-CE2 3.72Å; I86-F138 HydrophobicContact CG1-CD2 4.29Å; I86-F138 HydrophobicContact CG1-CE2 4.38Å; I103-F138 HydrophobicContact CG2-CZ 4.48Å; V105-F138 HydrophobicContact CB-CB 4.45Å; V105-F138 HydrophobicContact CB-CD1 3.59Å; V105-F138 HydrophobicContact CB-CD2 4.42Å; V105-F138 HydrophobicContact CB-CE1 3.82Å; V105-F138 HydrophobicContact CB-CG 3.91Å; V105-F138 HydrophobicContact CB-CZ 4.35Å; V105-F138 HydrophobicContact CG1-CB 3.9Å; V105-F138 HydrophobicContact CG1-CD1 4Å; V105-F138 HydrophobicContact CG1-CD2 4.46Å; V105-F138 HydrophobicContact CG1-CG 3.87Å; V105-F138 HydrophobicContact CG2-CD1 3.63Å; V105-F138 HydrophobicContact CG2-CD2 3.75Å; V105-F138 HydrophobicContact CG2-CE1 3.49Å; V105-F138 VanDerWaalsContact CG2-CE1 3.49Å; V105-F138 HydrophobicContact CG2-CE2 3.65Å; V105-F138 HydrophobicContact CG2-CG 3.74Å; V105-F138 HydrophobicContact CG2-CZ 3.51Å; W107-F138 PolarHBondContact NE1-O 3.05Å; I133-F138 HydrophobicContact CB-CE1 4.2Å; I133-F138 HydrophobicContact CB-CZ 4.43Å; I133-F138 HydrophobicContact CG1-CD1 4.38Å; I133-F138 HydrophobicContact CG1-CE1 3.97Å; I133-F138 HydrophobicContact CG2-CE1 3.76Å; I133-F138 HydrophobicContact CG2-CZ 3.83Å; G136-F138 WeakPolarHBondContact O-CD2 3.39Å; F138-L140 PolarHBondContact O-N 2.92Å
139	D	92.2	Very high	84.9	Confident	11 Å²	11	45.1 Å²	45.1	6%	0.059	23%	0.233	C	C	.	.			trans	-54.3	128.6	177.5	-62	-22.8	0	0	0	110.1	I81 M82 Y83 C84 R85 P130 N137	I81-D139 HydrophobicContact CG2-CB 3.89Å; M82-D139 CarbonylContact O-C 3.56Å; M82-D139 WeakPolarHBondContact O-CA 3.36Å; Y83-D139 VanDerWaalsContact CA-OD1 3.29Å; Y83-D139 WeakPolarHBondContact CA-OD1 3.34Å; Y83-D139 HydrophobicContact CD1-CB 4.47Å; Y83-D139 WeakPolarHBondContact CD1-OD2 3.38Å; C84-D139 PolarHBondContact N-OD1 3.11Å; C84-D139 PolarHBondContact O-N 3.37Å; R85-D139 WeakPolarHBondContact CG-OD1 3.32Å; R85-D139 IonicContact CZ-OD2 2.67Å; R85-D139 IonicContact NE-OD1 3.05Å; R85-D139 PolarHBondContact NE-OD1 2.99Å; R85-D139 IonicContact NE-OD2 3.87Å; R85-D139 PolarHBondContact NE-OD2 2.92Å; R85-D139 VanDerWaalsContact NE-OD2 3.14Å; R85-D139 IonicContact NH2-OD2 3.42Å; R85-D139 PolarHBondContact NH2-OD2 2.77Å; P130-D139 WeakPolarHBondContact CD-O 3.35Å; N137-D139 PolarHBondContact ND2-OD2 3.07Å; N137-D139 VanDerWaalsContact ND2-OD2 3.13Å; N137-D139 VanDerWaalsContact OD1-CB 3.25Å; N137-D139 WeakPolarHBondContact OD1-CB 3.46Å; N137-D139 PolarHBondContact OD1-N 2.92Å; N137-D139 PolarHBondContact OD1-OD1 2.97Å; N137-D139 PolarHBondContact OD1-OD2 2.83Å; N137-D139 VanDerWaalsContact OD1-OD2 3.12Å
140	L	92.9	Very high	84.8	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	115.9	179.6	170.1	66.8	0	0	0	110.4	I81 M82 W107 I109 L119 Y127 M129 F138 I142 F153	I81-L140 CarbonylContact C-O 3.55Å; I81-L140 WeakPolarHBondContact CA-O 3.47Å; M82-L140 HydrophobicContact CB-CB 4.28Å; M82-L140 PolarHBondContact N-O 2.93Å; M82-L140 PolarHBondContact O-N 3.22Å; W107-L140 HydrophobicContact CD2-CB 4.01Å; W107-L140 HydrophobicContact CD2-CD2 3.94Å; W107-L140 VanDerWaalsContact CE2-CB 3.48Å; W107-L140 HydrophobicContact CE3-CD2 4.14Å; W107-L140 HydrophobicContact CG-CB 4.43Å; W107-L140 HydrophobicContact CG-CD2 4.13Å; W107-L140 HydrophobicContact CH2-CB 4.27Å; W107-L140 HydrophobicContact CZ2-CB 3.61Å; I109-L140 HydrophobicContact CD1-CD2 4.28Å; L119-L140 HydrophobicContact CD1-CD1 3.87Å; L119-L140 HydrophobicContact CD2-CD1 3.75Å; L119-L140 HydrophobicContact CG-CD1 4.4Å; Y127-L140 HydrophobicContact CD1-CD1 4.12Å; Y127-L140 HydrophobicContact CD1-CD2 4.4Å; M129-L140 HydrophobicContact CG-CD1 4.44Å; F138-L140 PolarHBondContact O-N 2.92Å; L140-I142 HydrophobicContact CD2-CD1 4.49Å; L140-I142 HydrophobicContact CG-CG1 4.27Å; L140-F153 HydrophobicContact CD2-CD1 3.77Å; L140-F153 HydrophobicContact CD2-CE1 3.79Å
141	L	92.8	Very high	85.1	Confident	33 Å²	33	43.1 Å²	43.1	17%	0.173	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	123	175	170.6	66.1	0	0	0	110.2	I81 Y127 S128 P130 K143	I81-L141 HydrophobicContact CD1-CD1 4.34Å; I81-L141 HydrophobicContact CG1-CB 4.5Å; I81-L141 HydrophobicContact CG1-CD1 3.76Å; Y127-L141 CarbonylContact C-O 3.58Å; Y127-L141 WeakPolarHBondContact CA-O 3.4Å; S128-L141 PolarHBondContact N-O 3.36Å; S128-L141 PolarHBondContact O-N 2.94Å; P130-L141 HydrophobicContact CG-CB 4.14Å; P130-L141 HydrophobicContact CG-CD2 4.32Å; L141-K143 HydrophobicContact CD1-CG 4.48Å; L141-K143 HydrophobicContact CD2-CG 4.42Å; L141-K143 HydrophobicContact CG-CG 4.23Å
142	I	93	Very high	86.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122.1	173.1	-55.5	172.7	0	0	0	108.2	N79 T80 Y127 L140 T145 F153 L181	N79-I142 CarbonylContact C-O 3.59Å; N79-I142 WeakPolarHBondContact CA-O 3.48Å; T80-I142 HydrophobicContact CG2-CB 3.91Å; T80-I142 HydrophobicContact CG2-CD1 4.28Å; T80-I142 HydrophobicContact CG2-CG1 4.48Å; T80-I142 PolarHBondContact N-O 3.48Å; T80-I142 PolarHBondContact O-N 3.17Å; Y127-I142 HydrophobicContact CD1-CD1 4.31Å; Y127-I142 HydrophobicContact CD1-CG1 3.91Å; Y127-I142 HydrophobicContact CD2-CG1 4.42Å; Y127-I142 HydrophobicContact CD2-CG2 4.09Å; Y127-I142 HydrophobicContact CE1-CD1 3.7Å; Y127-I142 HydrophobicContact CE1-CG1 3.77Å; Y127-I142 HydrophobicContact CE2-CG1 4.32Å; Y127-I142 HydrophobicContact CE2-CG2 3.68Å; Y127-I142 HydrophobicContact CG-CG1 4.23Å; L140-I142 HydrophobicContact CD2-CD1 4.49Å; L140-I142 HydrophobicContact CG-CG1 4.27Å; I142-T145 HydrophobicContact CG2-CG2 3.99Å; I142-F153 HydrophobicContact CD1-CE1 3.77Å; I142-F153 HydrophobicContact CD1-CZ 3.67Å; I142-L181 HydrophobicContact CD1-CD2 4.05Å
143	K	91.1	Very high	86.9	Confident	93 Å²	93	40.8 Å²	40.8	40%	0.404	20%	0.2	S	C	.	.			trans	-104.3	141.5	179.4	-60.4	173.1	-173.7	163.1	0	111.6	N79 R126 L141	N79-K143 VanDerWaalsContact OD1-CA 3.24Å; N79-K143 WeakPolarHBondContact OD1-CA 3.48Å; R126-K143 PolarHBondContact O-N 2.02Å; L141-K143 HydrophobicContact CD1-CG 4.48Å; L141-K143 HydrophobicContact CD2-CG 4.42Å; L141-K143 HydrophobicContact CG-CG 4.23Å
144	N	88.9	Confident	87.7	Confident	63 Å²	63	38.1 Å²	38.1	34%	0.337	19%	0.186	S	C	.	.	S	Bend	trans	49.2	69.8	-179.3	-178.9	6.8	0	0	0	111.1	N77 S78 N79 R126 Q146	N77-N144 WeakPolarHBondContact CA-OD1 3.37Å; N77-N144 PolarHBondContact OD1-OD1 3.01Å; S78-N144 VanDerWaalsContact O-CA 3.31Å; S78-N144 WeakPolarHBondContact O-CA 3.32Å; S78-N144 PolarHBondContact O-N 2.85Å; S78-N144 VanDerWaalsContact O-N 3.09Å; N79-N144 PolarHBondContact OD1-N 3.06Å; R126-N144 PolarHBondContact NH1-O 2.79Å; N144-Q146 PolarHBondContact O-N 2.66Å; N144-Q146 PolarHBondContact O-NE2 2.59Å; N144-Q146 VanDerWaalsContact O-NE2 3.14Å; N144-Q146 PolarHBondContact OD1-NE2 2.9Å
145	T	88.4	Confident	88.8	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.162	C	C	.	.			trans	-59.1	116.2	-176.1	51.2	0	0	0	0	111.6	I74 L75 Y76 N77 S78 T80 I142 D149	I74-T145 HydrophobicContact CG2-CG2 4.14Å; L75-T145 PolarHBondContact O-OG1 3.03Å; L75-T145 VanDerWaalsContact O-OG1 3.12Å; Y76-T145 WeakPolarHBondContact CD2-O 3.4Å; N77-T145 PolarHBondContact N-O 2.97Å; S78-T145 PolarHBondContact N-OG1 3.1Å; S78-T145 PolarHBondContact O-N 2.72Å; S78-T145 PolarHBondContact O-OG1 2.84Å; T80-T145 HydrophobicContact CG2-CG2 3.79Å; I142-T145 HydrophobicContact CG2-CG2 3.99Å; T145-D149 VanDerWaalsContact CA-OD2 3.26Å; T145-D149 WeakPolarHBondContact CA-OD2 3.33Å
146	Q	85.8	Confident	89.7	Confident	37 Å²	37	30 Å²	30	17%	0.173	15%	0.149	C	C	.	.			trans	-92.4	157.5	173.7	-61.1	-51.4	-51.6	0	0	110.3	Y76 N144 E148 D149 I183	Y76-Q146 PolarHBondContact OH-OE1 2.74Å; N144-Q146 PolarHBondContact O-N 2.66Å; N144-Q146 PolarHBondContact O-NE2 2.59Å; N144-Q146 VanDerWaalsContact O-NE2 3.14Å; N144-Q146 PolarHBondContact OD1-NE2 2.9Å; Q146-E148 HydrophobicContact CB-CB 4.39Å; Q146-E148 PolarHBondContact O-N 3.08Å; Q146-E148 VanDerWaalsContact O-N 3.09Å; Q146-D149 PolarHBondContact N-OD2 3.13Å; Q146-D149 VanDerWaalsContact O-CB 3.32Å; Q146-D149 WeakPolarHBondContact O-CB 3.34Å; Q146-D149 PolarHBondContact O-N 2.91Å; Q146-I183 WeakPolarHBondContact O-CD1 3.31Å
147	L	83.2	Confident	90.1	Very high	24 Å²	24	30 Å²	30	13%	0.126	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-58.2	-25.6	177.4	-68	163.2	0	0	0	113.2	Y76 D149 E150 I183 K328 V398 M400	Y76-L147 HydrophobicContact CD2-CG 4.3Å; L147-D149 PolarHBondContact O-N 3.45Å; L147-E150 PolarHBondContact O-N 2.9Å; L147-I183 HydrophobicContact CD2-CB 4.47Å; L147-I183 HydrophobicContact CD2-CG2 4.08Å; L147-K328 HydrophobicContact CD2-CD 4.02Å; L147-V398 HydrophobicContact CB-CG1 3.57Å; L147-V398 HydrophobicContact CB-CG2 4.49Å; L147-V398 HydrophobicContact CD1-CG1 3.76Å; L147-V398 HydrophobicContact CD2-CG1 4.22Å; L147-V398 HydrophobicContact CG-CG1 4.05Å; L147-M400 HydrophobicContact CD1-CE 4.45Å; L147-M400 HydrophobicContact CD1-CG 4.28Å; L147-M400 HydrophobicContact CD1-SD 4.17Å
148	E	83.2	Confident	89.9	Confident	156 Å²	156	30 Å²	30	73%	0.729	15%	0.148	S	C	*	.	G	3₁₀ helix	trans	-63.2	-18.1	171.7	-63	156.4	-147.6	0	0	114.1	Q146 E150	Q146-E148 HydrophobicContact CB-CB 4.39Å; Q146-E148 PolarHBondContact O-N 3.08Å; Q146-E148 VanDerWaalsContact O-N 3.09Å; E148-E150 VanDerWaalsContact C-N 3.29Å
149	D	88.4	Confident	89.2	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.011	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-85.5	1.6	-179.7	-55.9	-39.9	0	0	0	112.9	R126 Y127 T145 Q146 L147 A151 L181 I183	R126-D149 IonicContact CZ-OD1 3.4Å; R126-D149 IonicContact CZ-OD2 3.39Å; R126-D149 VanDerWaalsContact NH1-CG 3.34Å; R126-D149 IonicContact NH1-OD1 2.68Å; R126-D149 PolarHBondContact NH1-OD1 3.17Å; R126-D149 VanDerWaalsContact NH1-OD1 3.14Å; R126-D149 IonicContact NH1-OD2 3.47Å; R126-D149 PolarHBondContact NH1-OD2 3.46Å; R126-D149 IonicContact NH2-OD1 2.7Å; R126-D149 PolarHBondContact NH2-OD1 2.97Å; R126-D149 IonicContact NH2-OD2 3.14Å; Y127-D149 VanDerWaalsContact CE2-OD1 3.27Å; Y127-D149 WeakPolarHBondContact CE2-OD1 3.32Å; Y127-D149 WeakPolarHBondContact OH-CB 3.41Å; Y127-D149 PolarHBondContact OH-OD1 3.03Å; T145-D149 VanDerWaalsContact CA-OD2 3.26Å; T145-D149 WeakPolarHBondContact CA-OD2 3.33Å; Q146-D149 PolarHBondContact N-OD2 3.13Å; Q146-D149 VanDerWaalsContact O-CB 3.32Å; Q146-D149 WeakPolarHBondContact O-CB 3.34Å; Q146-D149 PolarHBondContact O-N 2.91Å; L147-D149 PolarHBondContact O-N 3.45Å; D149-A151 VanDerWaalsContact C-N 3.27Å; D149-A151 PolarHBondContact O-N 2.66Å; D149-L181 HydrophobicContact CB-CD2 4.46Å; D149-I183 HydrophobicContact CB-CD1 3.98Å
150	E	88.6	Confident	88.1	Confident	61 Å²	61	33.4 Å²	33.4	29%	0.285	16%	0.162	S	C	.	.			trans	-70.9	81.5	173.4	-77.4	-165	-176.1	0	0	112	L147 E148 L181 I183 K328	L147-E150 PolarHBondContact O-N 2.9Å; E148-E150 VanDerWaalsContact C-N 3.29Å; E150-L181 WeakPolarHBondContact CA-O 3.5Å; E150-I183 HydrophobicContact CG-CB 3.88Å; E150-I183 HydrophobicContact CG-CD1 3.93Å; E150-I183 HydrophobicContact CG-CG1 3.76Å; E150-I183 WeakPolarHBondContact OE1-CA 3.07Å; E150-I183 WeakPolarHBondContact OE1-CB 3.47Å; E150-I183 PolarHBondContact OE1-N 2.92Å; E150-K328 WeakPolarHBondContact OE1-CE 3.13Å; E150-K328 IonicContact OE1-NZ 3.24Å; E150-K328 PolarHBondContact OE1-NZ 2.66Å; E150-K328 IonicContact OE2-NZ 3.64Å; E150-K328 PolarHBondContact OE2-NZ 2.86Å
151	A	91.6	Very high	86.7	Confident	6 Å²	6	34.8 Å²	34.8	5%	0.05	17%	0.17	C	C	.	.			trans	-124.3	167.4	-176.9	0	0	0	0	0	113	I109 D110 D149 F153 L181	I109-A151 HydrophobicContact CG2-CB 3.63Å; D110-A151 HydrophobicContact CB-CB 4.47Å; D110-A151 VanDerWaalsContact OD2-CA 3.27Å; D110-A151 WeakPolarHBondContact OD2-CA 3.35Å; D110-A151 WeakPolarHBondContact OD2-CB 3.4Å; D149-A151 VanDerWaalsContact C-N 3.27Å; D149-A151 PolarHBondContact O-N 2.66Å; A151-F153 HydrophobicContact CB-CD2 4.29Å; A151-F153 HydrophobicContact CB-CE2 3.66Å; A151-F153 HydrophobicContact CB-CZ 3.94Å; A151-F153 WeakPolarHBondContact O-CD2 3.33Å; A151-F153 WeakPolarHBondContact O-CE2 3.15Å; A151-L181 PolarHBondContact O-N 3.4Å; A151-L181 VanDerWaalsContact O-N 3.09Å
152	S	93.6	Very high	85.3	Confident	26 Å²	26	38.2 Å²	38.2	18%	0.182	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	124.8	163.5	62.1	0	0	0	0	110.5	I109 D110	I109-S152 WeakPolarHBondContact CA-O 3.36Å; D110-S152 PolarHBondContact N-O 3.47Å; D110-S152 WeakPolarHBondContact OD1-CB 3.4Å; D110-S152 PolarHBondContact OD1-N 3.44Å; D110-S152 PolarHBondContact OD1-OG 3.42Å
153	F	94.4	Very high	83.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	123.8	-175.6	-66.4	-96.3	0	0	0	110.5	M82 W107 I108 I109 Y127 L140 I142 A151 A179 L181	M82-F153 HydrophobicContact CE-CB 3.72Å; M82-F153 HydrophobicContact CE-CD2 3.73Å; M82-F153 HydrophobicContact CE-CG 3.82Å; M82-F153 HydrophobicContact CG-CD1 4.45Å; M82-F153 HydrophobicContact CG-CG 4.41Å; W107-F153 HydrophobicContact CE3-CB 4.2Å; W107-F153 HydrophobicContact CE3-CD1 4.39Å; W107-F153 HydrophobicContact CZ3-CB 3.99Å; I108-F153 WeakPolarHBondContact O-CA 3.26Å; I109-F153 HydrophobicContact CB-CE1 4.5Å; I109-F153 HydrophobicContact CD1-CD1 4.34Å; I109-F153 HydrophobicContact CD1-CE1 3.96Å; I109-F153 HydrophobicContact CG1-CD1 3.89Å; I109-F153 HydrophobicContact CG1-CE1 3.9Å; I109-F153 HydrophobicContact CG2-CD1 4.38Å; I109-F153 HydrophobicContact CG2-CE1 3.91Å; I109-F153 HydrophobicContact CG2-CZ 4.16Å; Y127-F153 HydrophobicContact CE1-CE1 4.23Å; L140-F153 HydrophobicContact CD2-CD1 3.77Å; L140-F153 HydrophobicContact CD2-CE1 3.79Å; I142-F153 HydrophobicContact CD1-CE1 3.77Å; I142-F153 HydrophobicContact CD1-CZ 3.67Å; A151-F153 HydrophobicContact CB-CD2 4.29Å; A151-F153 HydrophobicContact CB-CE2 3.66Å; A151-F153 HydrophobicContact CB-CZ 3.94Å; A151-F153 WeakPolarHBondContact O-CD2 3.33Å; A151-F153 WeakPolarHBondContact O-CE2 3.15Å; F153-A179 PolarHBondContact N-O 2.97Å; F153-A179 PolarHBondContact O-N 3.29Å; F153-L181 HydrophobicContact CD2-CB 4.13Å; F153-L181 HydrophobicContact CE2-CB 3.62Å; F153-L181 HydrophobicContact CE2-CD2 4.11Å; F153-L181 HydrophobicContact CZ-CD2 4.32Å
154	I	94.7	Very high	81.7	Confident	40 Å²	40	43.1 Å²	43.1	21%	0.205	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	132	173.1	-57.2	157.1	0	0	0	107.9	W107 I108 P178	W107-I154 CarbonylContact C-O 3.51Å; W107-I154 WeakPolarHBondContact CA-O 3.31Å; I108-I154 HydrophobicContact CB-CB 4.17Å; I108-I154 HydrophobicContact CD1-CB 4.46Å; I108-I154 HydrophobicContact CD1-CG2 4.41Å; I108-I154 PolarHBondContact N-O 2.99Å; I108-I154 PolarHBondContact O-N 3.38Å; I154-P178 HydrophobicContact CD1-CB 4.22Å; I154-P178 HydrophobicContact CG1-CB 3.77Å
155	C	93.4	Very high	80.3	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	129.4	169	-166.3	0	0	0	0	109.5	I66 C84 V105 W107 S176	I66-C155 HydrophobicContact CD1-CB 3.95Å; I66-C155 WeakPolarHBondContact CD1-O 3.34Å; C84-C155 HydrophobicContact CB-CB 3.59Å; C84-C155 WeakPolarHBondContact CB-SG 3.36Å; C84-C155 WeakPolarHBondContact SG-CB 3.2Å; C84-C155 CovalentContact SG-SG 2.03Å; C84-C155 PolarHBondContact SG-SG 3.45Å; V105-C155 VanDerWaalsContact CG1-SG 3.56Å; W107-C155 HydrophobicContact CD2-CB 4.38Å; W107-C155 HydrophobicContact CE3-CB 4.29Å; W107-C155 HydrophobicContact CH2-CB 4.17Å; W107-C155 HydrophobicContact CZ2-CB 4.25Å; W107-C155 HydrophobicContact CZ3-CB 4.19Å; C155-S176 PolarHBondContact N-OG 3.09Å; C155-S176 PolarHBondContact O-N 3.39Å
156	Q	92.4	Very high	78.6	Confident	32 Å²	32	48.2 Å²	48.2	15%	0.15	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	130.5	175.7	176.6	-179.3	-10.5	0	0	110.3	V105 Q106 I108 N158 T173 I174 T175	V105-Q156 WeakPolarHBondContact CA-O 3.09Å; Q106-Q156 HydrophobicContact CG-CB 3.93Å; Q106-Q156 HydrophobicContact CG-CG 4.37Å; Q106-Q156 PolarHBondContact N-O 3.1Å; Q106-Q156 VanDerWaalsContact NE2-CD 3.3Å; Q106-Q156 PolarHBondContact O-N 2.71Å; I108-Q156 HydrophobicContact CD1-CB 4.43Å; Q156-N158 PolarHBondContact NE2-OD1 3.24Å; Q156-T173 HydrophobicContact CG-CG2 4.13Å; Q156-I174 WeakPolarHBondContact CA-O 3.27Å; Q156-T175 HydrophobicContact CB-CG2 4.02Å; Q156-T175 HydrophobicContact CG-CG2 3.83Å
157	A	87	Confident	77.2	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.2	175.5	0	0	0	0	0	111.2	I66 I86 I103 V105 T173 I174	I66-A157 HydrophobicContact CD1-CB 4.44Å; I86-A157 HydrophobicContact CD1-CB 3.4Å; I86-A157 VanDerWaalsContact CD1-CB 3.4Å; I86-A157 HydrophobicContact CG1-CB 4.27Å; I103-A157 HydrophobicContact CG2-CB 4.46Å; V105-A157 HydrophobicContact CG2-CB 4.08Å; A157-T173 WeakPolarHBondContact O-CA 3.45Å; A157-I174 PolarHBondContact N-O 2.85Å; A157-I174 PolarHBondContact O-N 2.8Å
158	N	83.6	Confident	76.1	Confident	32 Å²	32	61.8 Å²	61.8	17%	0.171	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	112.8	173.2	-58.3	-26.3	0	0	0	108	N104 Q156 L171 D172 T173	N104-N158 PolarHBondContact N-O 2.82Å; N104-N158 PolarHBondContact O-N 3Å; Q156-N158 PolarHBondContact NE2-OD1 3.24Å; N158-L171 HydrophobicContact CB-CD1 4.38Å; N158-D172 CarbonylContact C-O 3.52Å; N158-D172 WeakPolarHBondContact CA-O 3.35Å; N158-T173 WeakPolarHBondContact OD1-CG2 3.36Å; N158-T173 PolarHBondContact OD1-OG1 2.77Å
159	V	75	Confident	75.1	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	124	-176	-175.6	0	0	0	0	109.8	E101 I103 I161 L171 D172 I174	E101-V159 HydrophobicContact CG-CG1 4.47Å; I103-V159 HydrophobicContact CG1-CG1 4.28Å; I103-V159 HydrophobicContact CG1-CG2 4.23Å; I103-V159 HydrophobicContact CG2-CG2 4.38Å; V159-I161 HydrophobicContact CG1-CG1 4.29Å; V159-L171 WeakPolarHBondContact O-CA 3.36Å; V159-D172 PolarHBondContact N-O 3.46Å; V159-D172 PolarHBondContact O-N 3.15Å; V159-I174 HydrophobicContact CG2-CD1 3.92Å
160	K	69	Low	73.9	Confident	96 Å²	96	62.2 Å²	62.2	42%	0.417	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	113.7	171.5	-68.6	-179.4	179.6	179.1	0	110.9	Y102 Y162 L171	Y102-K160 PolarHBondContact O-N 3.4Å; K160-Y162 HydrophobicContact CB-CE2 3.92Å; K160-L171 HydrophobicContact CG-CD1 3.63Å
161	I	63.7	Low	72.9	Confident	29 Å²	29	64.1 Å²	64.1	15%	0.149	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	115.3	176.9	-53.8	172.9	0	0	0	108.6	V159 P169 Q170	V159-I161 HydrophobicContact CG1-CG1 4.29Å; I161-P169 WeakPolarHBondContact O-CA 3.35Å; I161-Q170 HydrophobicContact CB-CB 4.39Å; I161-Q170 PolarHBondContact N-O 3.37Å; I161-Q170 PolarHBondContact O-N 2.87Å
162	Y	61.8	Low	72	Confident	106 Å²	106	66.6 Å²	66.6	42%	0.416	36%	0.359	S	S	.	.			trans	-94.4	99.2	171.5	-65.9	-98.9	0	0	0	108.3	T100 Y102 K160 P169	T100-Y162 VanDerWaalsContact O-CD2 3.31Å; T100-Y162 WeakPolarHBondContact O-CD2 3.44Å; Y102-Y162 AromaticContact CD2-CE2 3.87Å; Y102-Y162 HydrophobicContact CD2-CE2 3.87Å; K160-Y162 HydrophobicContact CB-CE2 3.92Å; Y162-P169 HydrophobicContact CD1-CB 4.13Å; Y162-P169 HydrophobicContact CE1-CB 4.03Å; Y162-P169 HydrophobicContact CG-CB 4.5Å
163	S	55	Low	71.5	Confident	40 Å²	40	68.5 Å²	68.5	28%	0.28	37%	0.37	S	S	.	.			trans	-72.7	141	169.8	95	0	0	0	0	109.1	S165 S166	S163-S165 PolarHBondContact O-N 3.35Å; S163-S165 PolarHBondContact OG-N 3.15Å; S163-S165 PolarHBondContact OG-OG 2.8Å; S163-S165 VanDerWaalsContact OG-OG 3.14Å; S163-S166 PolarHBondContact O-N 2.85Å; S163-S166 VanDerWaalsContact OG-CB 3.24Å; S163-S166 WeakPolarHBondContact OG-CB 3.23Å; S163-S166 PolarHBondContact OG-N 2.87Å; S163-S166 PolarHBondContact OG-OG 3.46Å
164	T	55.2	Low	71.1	Confident	156 Å²	156	69.5 Å²	69.5	96%	0.957	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	9.9	176.6	49.1	0	0	0	0	113.7
165	S	57.7	Low	70.9	Confident	112 Å²	112	71.6 Å²	71.6	78%	0.783	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.4	-0.8	-170.2	44.2	0	0	0	0	114.1	S163	S163-S165 PolarHBondContact O-N 3.35Å; S163-S165 PolarHBondContact OG-N 3.15Å; S163-S165 PolarHBondContact OG-OG 2.8Å; S163-S165 VanDerWaalsContact OG-OG 3.14Å
166	S	52.4	Low	70.8	Confident	57 Å²	57	72.2 Å²	72.2	40%	0.399	39%	0.394	S	S	.	.			trans	-122.6	136.7	179.8	64.4	0	0	0	0	111.8	S163 E168	S163-S166 PolarHBondContact O-N 2.85Å; S163-S166 VanDerWaalsContact OG-CB 3.24Å; S163-S166 WeakPolarHBondContact OG-CB 3.23Å; S163-S166 PolarHBondContact OG-N 2.87Å; S163-S166 PolarHBondContact OG-OG 3.46Å; S166-E168 VanDerWaalsContact C-N 3.28Å; S166-E168 WeakPolarHBondContact CB-O 3.48Å; S166-E168 PolarHBondContact OG-O 3.49Å
167	I	58	Low	70.8	Confident	183 Å²	183	79.1 Å²	79.1	94%	0.938	42%	0.424	S	S	*	.	S	Bend	trans	-75.2	-21.8	178	-63.8	171.2	0	0	0	111
168	E	60.5	Low	71	Confident	163 Å²	163	82.3 Å²	82.3	76%	0.762	44%	0.444	S	S	*	.	S	Bend	trans	-104.6	138.7	172.5	-68.3	-177.3	136.7	0	0	111.5	S166	S166-E168 VanDerWaalsContact C-N 3.28Å; S166-E168 WeakPolarHBondContact CB-O 3.48Å; S166-E168 PolarHBondContact OG-O 3.49Å
169	P	61.3	Low	71.5	Confident	63 Å²	63	80.8 Å²	80.8	41%	0.409	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-78.4	133.7	171.3	31.9	-32.6	0	0	0	110.6	I161 Y162	I161-P169 WeakPolarHBondContact O-CA 3.35Å; Y162-P169 HydrophobicContact CD1-CB 4.13Å; Y162-P169 HydrophobicContact CE1-CB 4.03Å; Y162-P169 HydrophobicContact CG-CB 4.5Å
170	Q	63	Low	72.4	Confident	105 Å²	105	86.9 Å²	86.9	49%	0.491	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	122.8	176.8	-175.3	170.6	-23.5	0	0	109.6	Y59 I161	Y59-Q170 PolarHBondContact OH-OE1 2.87Å; I161-Q170 HydrophobicContact CB-CB 4.39Å; I161-Q170 PolarHBondContact N-O 3.37Å; I161-Q170 PolarHBondContact O-N 2.87Å
171	L	67.7	Low	73.5	Confident	100 Å²	100	82.5 Å²	82.5	52%	0.524	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	118.3	176.5	-172	75.3	0	0	0	109.6	N158 V159 K160	N158-L171 HydrophobicContact CB-CD1 4.38Å; V159-L171 WeakPolarHBondContact O-CA 3.36Å; K160-L171 HydrophobicContact CG-CD1 3.63Å
172	D	73.2	Confident	74.8	Confident	58 Å²	58	84.2 Å²	84.2	31%	0.31	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	143.6	169.3	-166	12.4	0	0	0	110	N158 V159	N158-D172 CarbonylContact C-O 3.52Å; N158-D172 WeakPolarHBondContact CA-O 3.35Å; V159-D172 PolarHBondContact N-O 3.46Å; V159-D172 PolarHBondContact O-N 3.15Å
173	T	83	Confident	76	Confident	66 Å²	66	79.3 Å²	79.3	41%	0.405	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	115.6	-176.7	-63.3	0	0	0	0	109.9	Q156 A157 N158	Q156-T173 HydrophobicContact CG-CG2 4.13Å; A157-T173 WeakPolarHBondContact O-CA 3.45Å; N158-T173 WeakPolarHBondContact OD1-CG2 3.36Å; N158-T173 PolarHBondContact OD1-OG1 2.77Å
174	I	86.1	Confident	77.5	Confident	22 Å²	22	77.9 Å²	77.9	11%	0.113	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	117.8	-169.4	-45.2	162.9	0	0	0	107.9	N64 I66 Q156 A157 V159	N64-I174 HydrophobicContact CB-CD1 3.44Å; N64-I174 VanDerWaalsContact CB-CD1 3.44Å; I66-I174 HydrophobicContact CB-CG2 3.87Å; I66-I174 HydrophobicContact CG2-CG2 3.69Å; Q156-I174 WeakPolarHBondContact CA-O 3.27Å; A157-I174 PolarHBondContact N-O 2.85Å; A157-I174 PolarHBondContact O-N 2.8Å; V159-I174 HydrophobicContact CG2-CD1 3.92Å
175	T	89.6	Confident	78.9	Confident	83 Å²	83	72.8 Å²	72.8	51%	0.509	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	143.7	179.1	48.9	0	0	0	0	111.1	Q156	Q156-T175 HydrophobicContact CB-CG2 4.02Å; Q156-T175 HydrophobicContact CG-CG2 3.83Å
176	S	91.9	Very high	80.2	Confident	14 Å²	14	69 Å²	69	10%	0.098	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-73.9	169.8	169.9	72.2	0	0	0	0	111.9	C155	C155-S176 PolarHBondContact N-OG 3.09Å; C155-S176 PolarHBondContact O-N 3.39Å
177	K	91.3	Very high	81.9	Confident	177 Å²	177	66.5 Å²	66.5	77%	0.77	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-63.5	149.6	156	-63.8	-179.4	-178.7	178.9	0	109.2
178	P	92.7	Very high	83	Confident	66 Å²	66	62.9 Å²	62.9	43%	0.429	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-66.8	139.8	168.5	28.8	-33.7	0	0	0	110	I154	I154-P178 HydrophobicContact CD1-CB 4.22Å; I154-P178 HydrophobicContact CG1-CB 3.77Å
179	A	94.2	Very high	83.9	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.008	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	140.2	169.1	0	0	0	0	0	110	P69 E70 N71 M82 F153	P69-A179 HydrophobicContact CB-CB 3.58Å; P69-A179 HydrophobicContact CG-CB 3.53Å; E70-A179 WeakPolarHBondContact O-CB 3.37Å; N71-A179 VanDerWaalsContact OD1-CA 3.3Å; N71-A179 WeakPolarHBondContact OD1-CA 3.18Å; M82-A179 HydrophobicContact CE-CB 3.8Å; F153-A179 PolarHBondContact N-O 2.97Å; F153-A179 PolarHBondContact O-N 3.29Å
180	Y	93.5	Very high	85	Confident	128 Å²	128	53.9 Å²	53.9	50%	0.502	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	133.9	178.7	-62	-87.8	0	0	0	110.3	N71 Q72	N71-Y180 WeakPolarHBondContact CA-O 3.37Å; N71-Y180 PolarHBondContact OD1-N 2.81Å; Q72-Y180 PolarHBondContact N-O 2.8Å
181	L	92.3	Very high	86	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.021	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	126.9	167.6	-175.1	58.6	0	0	0	108.8	Q72 I74 T80 I142 D149 E150 A151 F153	Q72-L181 HydrophobicContact CB-CD1 4.05Å; Q72-L181 WeakPolarHBondContact O-CA 3.34Å; I74-L181 HydrophobicContact CB-CD1 4.38Å; I74-L181 HydrophobicContact CG2-CD1 3.96Å; T80-L181 HydrophobicContact CG2-CD1 4.22Å; T80-L181 HydrophobicContact CG2-CD2 3.96Å; I142-L181 HydrophobicContact CD1-CD2 4.05Å; D149-L181 HydrophobicContact CB-CD2 4.46Å; E150-L181 WeakPolarHBondContact CA-O 3.5Å; A151-L181 PolarHBondContact O-N 3.4Å; A151-L181 VanDerWaalsContact O-N 3.09Å; F153-L181 HydrophobicContact CD2-CB 4.13Å; F153-L181 HydrophobicContact CE2-CB 3.62Å; F153-L181 HydrophobicContact CE2-CD2 4.11Å; F153-L181 HydrophobicContact CZ-CD2 4.32Å
182	T	90	Very high	86.7	Confident	65 Å²	65	48.5 Å²	48.5	40%	0.399	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	136.1	176.9	-55	0	0	0	0	109.6	Q72 T73 I74	Q72-T182 PolarHBondContact O-N 2.85Å; T73-T182 CarbonylContact C-O 3.53Å; T73-T182 VanDerWaalsContact CA-O 3.29Å; T73-T182 WeakPolarHBondContact CA-O 3.35Å; T73-T182 HydrophobicContact CG2-CG2 4.23Å; I74-T182 PolarHBondContact N-O 3.45Å
183	I	87.8	Confident	87.1	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	120.3	-171.3	-63.2	175.6	0	0	0	110.1	I74 Y76 Q146 L147 D149 E150	I74-I183 HydrophobicContact CG2-CG1 4.07Å; I74-I183 WeakPolarHBondContact O-CA 3.35Å; Y76-I183 HydrophobicContact CD2-CG2 4.48Å; Q146-I183 WeakPolarHBondContact O-CD1 3.31Å; L147-I183 HydrophobicContact CD2-CB 4.47Å; L147-I183 HydrophobicContact CD2-CG2 4.08Å; D149-I183 HydrophobicContact CB-CD1 3.98Å; E150-I183 HydrophobicContact CG-CB 3.88Å; E150-I183 HydrophobicContact CG-CD1 3.93Å; E150-I183 HydrophobicContact CG-CG1 3.76Å; E150-I183 WeakPolarHBondContact OE1-CA 3.07Å; E150-I183 WeakPolarHBondContact OE1-CB 3.47Å; E150-I183 PolarHBondContact OE1-N 2.92Å
184	I	86.8	Confident	86.9	Confident	10 Å²	10	47.6 Å²	47.6	5%	0.051	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	130.6	177.4	-67.3	166.6	0	0	0	109.2	T73 I74 L75 Y76 K328 D429 F430 V431	T73-I184 HydrophobicContact CG2-CD1 3.38Å; T73-I184 HydrophobicContact CG2-CG1 3.64Å; I74-I184 PolarHBondContact O-N 2.87Å; L75-I184 HydrophobicContact CD1-CG2 4.37Å; Y76-I184 PolarHBondContact N-O 2.99Å; I184-K328 CarbonylContact C-O 3.55Å; I184-K328 WeakPolarHBondContact CA-O 3.13Å; I184-D429 VanDerWaalsContact CD1-O 3.25Å; I184-D429 WeakPolarHBondContact CD1-O 3.35Å; I184-F430 HydrophobicContact CG2-CD1 3.71Å; I184-F430 HydrophobicContact CG2-CE1 4.48Å; I184-V431 HydrophobicContact CD1-CG2 3.68Å
185	F	84.8	Confident	86.5	Confident	50 Å²	50	49.5 Å²	49.5	22%	0.219	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-120.5	100.4	170.9	-162.9	-76.7	0	0	0	109.2	Y76 S327 K328	Y76-F185 AromaticContact CD1-CD2 3.95Å; Y76-F185 HydrophobicContact CD1-CD2 3.95Å; Y76-F185 AromaticContact CD1-CE2 3.69Å; Y76-F185 HydrophobicContact CD1-CE2 3.69Å; Y76-F185 HydrophobicContact CD2-CD2 4.12Å; Y76-F185 HydrophobicContact CD2-CE2 4.41Å; Y76-F185 HydrophobicContact CE1-CE2 4.09Å; Y76-F185 AromaticContact CG-CD2 3.65Å; Y76-F185 HydrophobicContact CG-CD2 3.65Å; Y76-F185 AromaticContact CG-CE2 3.89Å; Y76-F185 HydrophobicContact CG-CE2 3.89Å; F185-S327 CarbonylContact O-C 3.58Å; F185-S327 VanDerWaalsContact O-CA 3.31Å; F185-S327 WeakPolarHBondContact O-CA 3.11Å; F185-K328 HydrophobicContact CB-CB 4.07Å; F185-K328 PolarHBondContact N-O 2.86Å; F185-K328 PolarHBondContact O-N 2.86Å
186	P	85.2	Confident	85.1	Confident	32 Å²	32	52.4 Å²	52.4	21%	0.208	28%	0.279	C	S	.	.			trans	-71	151.4	178.5	30.5	-35.5	0	0	0	111.6	L75 S188 F430 L435	L75-P186 HydrophobicContact CD1-CG 3.88Å; P186-S188 PolarHBondContact O-N 3.5Å; P186-F430 VanDerWaalsContact CA-CD1 3.46Å; P186-F430 HydrophobicContact CB-CB 4.15Å; P186-F430 HydrophobicContact CB-CD1 3.79Å; P186-F430 HydrophobicContact CB-CG 4.14Å; P186-L435 HydrophobicContact CB-CD2 4.06Å
187	P	86.7	Confident	83.2	Confident	5 Å²	5	57 Å²	57	3%	0.032	30%	0.302	C	S	.	.			trans	-65.3	124.6	173.8	27.3	-33.2	0	0	0	110.7	G189 S325 V424 L435	P187-G189 VanDerWaalsContact C-N 3.32Å; P187-S325 VanDerWaalsContact C-OG 3.24Å; P187-S325 WeakPolarHBondContact CA-OG 3.26Å; P187-S325 VanDerWaalsContact CB-OG 3.27Å; P187-S325 WeakPolarHBondContact CB-OG 3.35Å; P187-V424 HydrophobicContact CG-CG2 4.12Å; P187-L435 HydrophobicContact CG-CD2 4.21Å
188	S	81.7	Confident	80.6	Confident	106 Å²	106	53.6 Å²	53.6	74%	0.741	30%	0.301	S	S	*	.	S	Bend	trans	-72.2	-21.4	174.3	59.1	0	0	0	0	113.9	P186 S325	P186-S188 PolarHBondContact O-N 3.5Å; S188-S325 PolarHBondContact N-OG 3.28Å; S188-S325 WeakPolarHBondContact OG-CB 3.12Å; S188-S325 PolarHBondContact OG-OG 2.83Å
189	G	79.5	Confident	77.7	Confident	23 Å²	23	58.6 Å²	58.6	24%	0.237	32%	0.319	C	S	.	.			trans	-158.5	159.2	-177.1	0	0	0	0	0	114.7	P187 S325	P187-G189 VanDerWaalsContact C-N 3.32Å; G189-S325 PolarHBondContact N-OG 3.33Å; G189-S325 VanDerWaalsContact N-OG 3.12Å; G189-S325 PolarHBondContact O-N 2.92Å; G189-S325 PolarHBondContact O-OG 3.39Å
190	L	84.4	Confident	74.6	Confident	15 Å²	15	65.7 Å²	65.7	8%	0.079	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	143	163.7	-73.3	178.3	0	0	0	108.2	H323 T324 C422 V424 P436 V438	L190-H323 CarbonylContact C-O 3.58Å; L190-H323 WeakPolarHBondContact CA-O 3.38Å; L190-T324 HydrophobicContact CD2-CG2 3.37Å; L190-C422 WeakPolarHBondContact CD1-O 3.2Å; L190-V424 HydrophobicContact CD1-CG2 4.26Å; L190-V424 HydrophobicContact CD2-CG2 4.09Å; L190-V424 HydrophobicContact CG-CG2 4.38Å; L190-P436 VanDerWaalsContact CD1-O 3.24Å; L190-P436 WeakPolarHBondContact CD1-O 3.43Å; L190-P436 HydrophobicContact CG-CB 4.44Å; L190-P436 HydrophobicContact CG-CG 4.15Å; L190-V438 HydrophobicContact CB-CG2 3.66Å; L190-V438 WeakPolarHBondContact O-CG2 3.29Å
191	T	83.5	Confident	71.6	Confident	76 Å²	76	66.6 Å²	66.6	47%	0.466	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	131.8	173.1	54.3	0	0	0	0	110.2	C322 H323	T191-C322 CarbonylContact O-C 3.59Å; T191-C322 VanDerWaalsContact O-CA 3.26Å; T191-C322 WeakPolarHBondContact O-CA 3.24Å; T191-H323 PolarHBondContact N-O 2.83Å; T191-H323 PolarHBondContact O-N 2.95Å
192	M	82.7	Confident	68.7	Low	15 Å²	15	76.4 Å²	76.4	7%	0.074	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	129.5	-179	-170.2	-173.9	-68.1	0	0	109.9	V320 S321 W335 C422 V438 V440	M192-V320 HydrophobicContact CG-CG1 3.28Å; M192-V320 HydrophobicContact SD-CG1 3.74Å; M192-S321 CarbonylContact C-O 3.6Å; M192-S321 WeakPolarHBondContact CA-O 3.32Å; M192-W335 HydrophobicContact CE-CH2 4.3Å; M192-W335 HydrophobicContact CE-CZ3 3.68Å; M192-W335 HydrophobicContact CG-CH2 4.42Å; M192-W335 HydrophobicContact SD-CZ3 4.22Å; M192-C422 HydrophobicContact CE-CB 3.53Å; M192-V438 HydrophobicContact CB-CB 4.47Å; M192-V438 HydrophobicContact CB-CG1 3.68Å; M192-V438 HydrophobicContact CE-CB 4.25Å; M192-V438 HydrophobicContact CE-CG1 3.99Å; M192-V438 VanDerWaalsContact CE-O 3.28Å; M192-V438 WeakPolarHBondContact CE-O 3.43Å; M192-V438 HydrophobicContact SD-CG1 4.47Å; M192-V440 HydrophobicContact CE-CG2 4.47Å; M192-V440 HydrophobicContact SD-CB 4.25Å; M192-V440 HydrophobicContact SD-CG1 3.61Å; M192-V440 HydrophobicContact SD-CG2 3.54Å; M192-V440 VanDerWaalsContact SD-CG2 3.54Å
193	I	81.2	Confident	65.8	Low	53 Å²	53	79.8 Å²	79.8	27%	0.272	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	124.3	-171	-51.1	177.5	0	0	0	109	L195 V320 S321	I193-L195 HydrophobicContact CG2-CD2 4.03Å; I193-V320 CarbonylContact O-C 3.59Å; I193-V320 WeakPolarHBondContact O-CA 2.96Å; I193-V320 WeakPolarHBondContact O-CG1 3.4Å; I193-S321 PolarHBondContact N-O 3.48Å; I193-S321 PolarHBondContact O-N 3.32Å
194	H	79.8	Confident	62.9	Low	52 Å²	52	88.2 Å²	88.2	24%	0.241	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	127.8	170	178.7	-157.4	0	0	0	109.3	V210 L318 I319	H194-V210 VanDerWaalsContact O-CG1 3.28Å; H194-V210 WeakPolarHBondContact O-CG1 3.34Å; H194-L318 WeakPolarHBondContact CD2-CD1 3.38Å; H194-L318 WeakPolarHBondContact NE2-CD1 3.25Å; H194-I319 PolarHBondContact CD2-O 3.37Å
195	L	76	Confident	60.1	Low	62 Å²	62	95 Å²	95	33%	0.325	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	127.5	177.4	-56.2	-179	0	0	0	110	I193 I319	I193-L195 HydrophobicContact CG2-CD2 4.03Å; L195-I319 HydrophobicContact CB-CB 4.16Å; L195-I319 HydrophobicContact CB-CG2 3.82Å; L195-I319 HydrophobicContact CD1-CG2 3.89Å; L195-I319 HydrophobicContact CG-CG2 4.23Å; L195-I319 PolarHBondContact N-O 2.83Å
196	Q	61.9	Low	57.4	Low	144 Å²	144	98 Å²	98	67%	0.673	52%	0.515	S	S	*	.			trans	-90.6	138.2	172.1	-70	180	-30.3	0	0	110.3	S198	Q196-S198 PolarHBondContact O-N 2.92Å
197	D	52.2	Low	54.6	Low	111 Å²	111	99.7 Å²	99.7	59%	0.594	53%	0.527	S	S	*	.			trans	-67.2	91.9	176.4	-90.1	-35.8	0	0	0	111.4	Q199	D197-Q199 PolarHBondContact O-N 3.41Å
198	S	36.4	Very low	51.9	Low	105 Å²	105	104.8 Å²	104.8	73%	0.734	56%	0.557	S	S	*	*			trans	-79.3	80.3	170.6	54.2	0	0	0	0	111.7	Q196 L200	Q196-S198 PolarHBondContact O-N 2.92Å; S198-L200 PolarHBondContact O-N 3.49Å
199	Q	30.7	Very low	49.2	Very low	172 Å²	172	105.6 Å²	105.6	80%	0.804	56%	0.558	S	S	*	*			trans	-74.5	67	167	-70.9	-76.1	-19.7	0	0	111.2	D197	D197-Q199 PolarHBondContact O-N 3.41Å
200	L	29.4	Very low	46.7	Very low	150 Å²	150	107.4 Å²	107.4	79%	0.785	56%	0.564	S	S	*	*			trans	-159.5	143.5	159.9	-137.4	72.6	0	0	0	113	S198	S198-L200 PolarHBondContact O-N 3.49Å
201	E	30.8	Very low	44.2	Very low	147 Å²	147	112.6 Å²	112.6	69%	0.687	59%	0.592	S	S	*	*			trans	66.7	105.9	170.1	-55.9	-165.7	139	0	0	118.4	N203	E201-N203 VanDerWaalsContact C-N 3.28Å; E201-N203 PolarHBondContact O-N 2.75Å
202	K	30.4	Very low	41.5	Very low	209 Å²	209	112.2 Å²	112.2	91%	0.909	59%	0.592	S	S	*	*	S	Bend	trans	-77.8	0.2	178.6	-102.3	-180	178	175.4	0	115.3
203	N	29.3	Very low	39	Very low	136 Å²	136	115.7 Å²	115.7	73%	0.727	61%	0.609	S	S	*	*	S	Bend	trans	-140.7	134	177.9	-72	-49.1	0	0	0	108.3	E201	E201-N203 VanDerWaalsContact C-N 3.28Å; E201-N203 PolarHBondContact O-N 2.75Å
204	H	28.4	Very low	36.5	Very low	180 Å²	180	120.5 Å²	120.5	83%	0.833	63%	0.625	S	S	*	*			trans	68.5	67.2	-172.8	-57.9	-39.8	0	0	0	116.5	T206	H204-T206 PolarHBondContact O-N 3.32Å; H204-T206 VanDerWaalsContact O-N 3.1Å
205	Q	26.8	Very low	34.1	Very low	151 Å²	151	123.2 Å²	123.2	71%	0.706	64%	0.64	S	S	*	*			trans	-72.8	94.9	161.6	-72.4	175.3	-31.9	0	0	111
206	T	28.8	Very low	31.8	Very low	113 Å²	113	125.4 Å²	125.4	69%	0.693	65%	0.652	S	S	*	*			trans	-76.1	127.9	155.6	43.6	0	0	0	0	108.6	H204 V208	H204-T206 PolarHBondContact O-N 3.32Å; H204-T206 VanDerWaalsContact O-N 3.1Å; T206-V208 PolarHBondContact O-N 3.24Å
207	P	26.4	Very low	30.3	Very low	69 Å²	69	124.5 Å²	124.5	45%	0.448	66%	0.658	S	S	.	*			trans	-69.8	98.5	174	-13.1	27.9	0	0	0	108.8	T209	P207-T209 PolarHBondContact O-N 2.91Å
208	V	29.8	Very low	29	Very low	112 Å²	112	124.3 Å²	124.3	68%	0.679	66%	0.658	S	S	*	*			trans	-63	124.6	167.6	178.9	0	0	0	0	107.1	T206 V210	T206-V208 PolarHBondContact O-N 3.24Å; V208-V210 WeakPolarHBondContact O-CG2 3.3Å; V208-V210 PolarHBondContact O-N 2.94Å
209	T	25	Very low	28.7	Very low	123 Å²	123	126.8 Å²	126.8	76%	0.755	66%	0.663	S	S	*	*			trans	-57.8	104	-176.4	22.8	0	0	0	0	111.3	P207	P207-T209 PolarHBondContact O-N 2.91Å
210	V	27.6	Very low	28.5	Very low	60 Å²	60	125.8 Å²	125.8	36%	0.364	66%	0.657	S	S	.	*			trans	-84.6	134.9	172.1	-164.4	0	0	0	0	108	H194 V208 S212	H194-V210 VanDerWaalsContact O-CG1 3.28Å; H194-V210 WeakPolarHBondContact O-CG1 3.34Å; V208-V210 WeakPolarHBondContact O-CG2 3.3Å; V208-V210 PolarHBondContact O-N 2.94Å; V210-S212 PolarHBondContact O-N 2.89Å
211	N	30.5	Very low	28.5	Very low	125 Å²	125	126 Å²	126	67%	0.668	65%	0.652	S	S	*	*			trans	-40.5	101.4	-176.1	-79.1	1	0	0	0	112.8	M213	N211-M213 PolarHBondContact O-N 3.5Å
212	S	28.3	Very low	28.4	Very low	67 Å²	67	124 Å²	124	47%	0.469	65%	0.651	S	S	.	*			trans	-81.4	112.4	172.8	43.3	0	0	0	0	109.1	V210 Y214	V210-S212 PolarHBondContact O-N 2.89Å; S212-Y214 WeakPolarHBondContact O-CD2 3.45Å; S212-Y214 PolarHBondContact O-N 3.32Å; S212-Y214 WeakPolarHBondContact OG-CE2 3.27Å; S212-Y214 PolarHBondContact OG-OH 3.28Å
213	M	28.9	Very low	28.3	Very low	88 Å²	88	120.2 Å²	120.2	43%	0.433	64%	0.64	S	S	.	*			trans	-95.2	94	-177.9	-168.3	-170	79.9	0	0	110.5	N211 I215 P308 V440	N211-M213 PolarHBondContact O-N 3.5Å; M213-I215 HydrophobicContact CE-CD1 4.15Å; M213-I215 HydrophobicContact CE-CG1 4.14Å; M213-P308 HydrophobicContact CE-CB 3.33Å; M213-P308 HydrophobicContact CE-CG 3.42Å; M213-P308 VanDerWaalsContact CE-CG 3.42Å; M213-P308 HydrophobicContact SD-CB 3.15Å; M213-P308 WeakPolarHBondContact SD-CB 3.47Å; M213-P308 HydrophobicContact SD-CG 3.98Å; M213-V440 HydrophobicContact CE-CG1 4.34Å
214	Y	28.2	Very low	28.2	Very low	155 Å²	155	124.7 Å²	124.7	61%	0.608	65%	0.648	S	S	*	*			trans	-77.9	121.9	175.5	-55.1	-84.4	0	0	0	110.4	S212	S212-Y214 WeakPolarHBondContact O-CD2 3.45Å; S212-Y214 PolarHBondContact O-N 3.32Å; S212-Y214 WeakPolarHBondContact OG-CE2 3.27Å; S212-Y214 PolarHBondContact OG-OH 3.28Å
215	I	29.8	Very low	28.3	Very low	108 Å²	108	122.3 Å²	122.3	55%	0.554	64%	0.641	S	S	*	*			trans	-93	99.4	167.8	-56.2	177.2	0	0	0	107.4	M213 V438	M213-I215 HydrophobicContact CE-CD1 4.15Å; M213-I215 HydrophobicContact CE-CG1 4.14Å; I215-V438 HydrophobicContact CD1-CG1 4.38Å
216	L	28.3	Very low	28.4	Very low	109 Å²	109	119.5 Å²	119.5	57%	0.571	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-91.2	141.9	172.4	-80.8	158.6	0	0	0	110.2
217	P	29.8	Very low	28.4	Very low	124 Å²	124	121.9 Å²	121.9	81%	0.805	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-65	142.7	-179.9	-21.1	33.2	0	0	0	113.4
218	N	26.1	Very low	28.6	Very low	108 Å²	108	127.5 Å²	127.5	58%	0.578	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-53	138.2	-171.7	-67.2	-19	0	0	0	115.9
219	N	28.7	Very low	28.6	Very low	157 Å²	157	127.2 Å²	127.2	84%	0.84	67%	0.669	S	S	*	*			trans	-147.6	151	139.9	-105.8	-30.4	0	0	0	110.8
220	H	27.9	Very low	28.9	Very low	150 Å²	150	128.1 Å²	128.1	69%	0.694	67%	0.674	S	S	*	*			trans	-80.7	153.3	-158.8	-68	-114.1	0	0	0	115.2
221	F	28.3	Very low	29.1	Very low	155 Å²	155	131 Å²	131	68%	0.68	69%	0.687	S	S	*	*				160.5	113.3	106.9	-94.2	-75	0	0	0	114.5	N302	F221-N302 PolarHBondContact N-OD1 2.82Å; F221-N302 PolarHBondContact O-ND2 3.41Å; F221-N302 PolarHBondContact O-OD1 3.38Å
222	T	28.7	Very low	29.1	Very low	106 Å²	106	135.2 Å²	135.2	65%	0.65	69%	0.694	S	S	*	*			trans	24.5	156.7	142.7	57.1	0	0	0	0	123.2	N302	T222-N302 PolarHBondContact N-ND2 3.04Å; T222-N302 PolarHBondContact N-OD1 2.68Å
223	N	28.4	Very low	29.4	Very low	128 Å²	128	137.4 Å²	137.4	68%	0.684	70%	0.696	S	S	*	*			cis	174.7	135.9	-25.1	-161.5	31.2	0	0	0	106.7
224	Y	27.8	Very low	29.4	Very low	231 Å²	231	137.5 Å²	137.5	91%	0.906	70%	0.702	S	S	*	*			trans	-167	164.9	151.5	-129.7	-95	0	0	0	113.4
225	I	30.4	Very low	29.6	Very low	130 Å²	130	134.7 Å²	134.7	67%	0.667	69%	0.691	S	S	*	*			trans	-119.6	156.5	-148	-76.9	170.1	0	0	0	114.9
226	S	29.1	Very low	29.8	Very low	91 Å²	91	131.8 Å²	131.8	64%	0.636	68%	0.678	S	S	*	*			trans	-23.5	160.7	175.6	63.2	0	0	0	0	122.5
227	D	28.9	Very low	30.3	Very low	164 Å²	164	130 Å²	130	88%	0.877	67%	0.672	S	S	*	*				-144.1	151.9	123.1	-112.6	-28.1	0	0	0	113.3
228	H	29.6	Very low	30.7	Very low	187 Å²	187	130.1 Å²	130.1	87%	0.866	67%	0.666	S	S	*	*			trans	-122.8	128.6	-179.5	-86.9	-13.3	0	0	0	110.9
229	S	30.2	Very low	31.3	Very low	106 Å²	106	130.7 Å²	130.7	74%	0.741	67%	0.665	S	S	*	*			trans	-134.5	124.1	171.4	62	0	0	0	0	112
230	V	31	Very low	31.7	Very low	142 Å²	142	126 Å²	126	86%	0.861	64%	0.64	S	S	*	*			trans	-87	113.2	-179.1	177.5	0	0	0	0	110.1
231	N	33.2	Very low	32.1	Very low	121 Å²	121	124.2 Å²	124.2	65%	0.647	64%	0.635	S	S	*	*			trans	-85.2	128.1	176.2	-75.1	-7.5	0	0	0	111.5
232	R	30.2	Very low	32.5	Very low	213 Å²	213	123.4 Å²	123.4	80%	0.804	63%	0.633	S	S	*	*			trans	-115.9	110.9	-177.6	-160.4	-178.4	-162.8	173.1	4.6	108.1
233	H	33.7	Very low	32.9	Very low	112 Å²	112	122.6 Å²	122.6	52%	0.519	62%	0.624	S	S	.	*			trans	-103.9	136.3	178.6	-77.8	-66.7	0	0	0	111.6	Q533	H233-Q533 PolarHBondContact O-OE1 2.79Å
234	V	29.1	Very low	33.2	Very low	91 Å²	91	122 Å²	122	55%	0.552	63%	0.625	S	S	*	*			trans	-116.1	117.4	178.8	-177.6	0	0	0	0	107.8
235	Y	33.2	Very low	33.2	Very low	96 Å²	96	116.7 Å²	116.7	38%	0.376	61%	0.612	S	S	.	*			trans	-83.7	135.2	172.9	-64.5	-77.4	0	0	0	110.3	I525	Y235-I525 HydrophobicContact CE2-CG2 3.85Å
236	T	33.8	Very low	33.5	Very low	47 Å²	47	119.5 Å²	119.5	29%	0.288	61%	0.614	S	S	.	*			trans	-111	152	176.2	68.8	0	0	0	0	111.4	N238 E239	T236-N238 PolarHBondContact O-N 3.49Å; T236-E239 PolarHBondContact O-N 3.43Å
237	T	37.8	Very low	33.6	Very low	72 Å²	72	122.1 Å²	122.1	44%	0.442	62%	0.621	S	S	.	*	H	α-helix	trans	-65.2	-14.9	-165.7	47.4	0	0	0	0	115.6	E239 T535	T237-E239 VanDerWaalsContact C-N 3.31Å; T237-E239 PolarHBondContact O-N 3.38Å; T237-T535 HydrophobicContact CG2-CG2 3.86Å
238	N	38	Very low	33.9	Very low	126 Å²	126	117.7 Å²	117.7	67%	0.674	60%	0.597	S	S	*	*	H	α-helix	trans	-73.2	-23.2	-178.1	-69.5	-7.7	0	0	0	113.1	T236	T236-N238 PolarHBondContact O-N 3.49Å
239	E	38.3	Very low	33.9	Very low	120 Å²	120	110.7 Å²	110.7	56%	0.561	57%	0.569	S	S	*	*	H	α-helix	trans	-84.1	-26.3	179.6	-63	177.3	148.1	0	0	112.3	T236 T237 I243	T236-E239 PolarHBondContact O-N 3.43Å; T237-E239 VanDerWaalsContact C-N 3.31Å; T237-E239 PolarHBondContact O-N 3.38Å; E239-I243 WeakPolarHBondContact O-CD1 3.36Å
240	L	37.7	Very low	33.8	Very low	59 Å²	59	112.7 Å²	112.7	31%	0.309	56%	0.561	S	S	.	*	H	α-helix	trans	-80.3	-29.2	-178.8	-121.2	75.9	0	0	0	113.6	I243 M540	L240-I243 PolarHBondContact O-N 3.23Å; L240-M540 HydrophobicContact CD2-CE 3.87Å
241	N	36.5	Very low	33.6	Very low	112 Å²	112	109.2 Å²	109.2	60%	0.599	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-81.8	-17.1	-174.1	-73.7	-7	0	0	0	113.9	I243	N241-I243 VanDerWaalsContact C-N 3.28Å
242	Q	37.9	Very low	33.5	Very low	138 Å²	138	105.5 Å²	105.5	65%	0.645	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-81	-7.2	172.3	-68	-172.9	-7.1	0	0	113.3
243	I	35.4	Very low	33.7	Very low	89 Å²	89	96 Å²	96	46%	0.456	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-92.9	-2.3	-176.8	-64.5	173.9	0	0	0	111.7	E239 L240 N241 L248	E239-I243 WeakPolarHBondContact O-CD1 3.36Å; L240-I243 PolarHBondContact O-N 3.23Å; N241-I243 VanDerWaalsContact C-N 3.28Å; I243-L248 HydrophobicContact CG2-CD2 3.85Å
244	V	34.6	Very low	34.2	Very low	116 Å²	116	92.3 Å²	92.3	70%	0.703	47%	0.469	S	S	*	.			trans	-91.2	6.4	-173.4	-169.7	0	0	0	0	113
245	D	29.5	Very low	35.3	Very low	119 Å²	119	90.1 Å²	90.1	64%	0.636	45%	0.454	S	S	*	.	S	Bend	trans	-78.4	149.1	176.3	-146	-17.3	0	0	0	112.3	D247	D245-D247 PolarHBondContact O-N 3.26Å
246	R	36.2	Very low	36.2	Very low	188 Å²	188	86.4 Å²	86.4	71%	0.709	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	4.3	-148.5	-86.3	174.7	167.6	137.4	-1.5	118.9	E686	R246-E686 IonicContact CZ-OE1 2.65Å; R246-E686 IonicContact NH1-OE1 2.68Å; R246-E686 PolarHBondContact NH1-OE1 3.02Å; R246-E686 IonicContact NH2-OE1 2.95Å; R246-E686 PolarHBondContact NH2-OE1 2.86Å; R246-E686 IonicContact NH2-OE2 2.92Å
247	D	31.8	Very low	37	Very low	147 Å²	147	87.6 Å²	87.6	79%	0.786	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	0.5	-166.7	-78.3	-47.3	0	0	0	117	D245	D245-D247 PolarHBondContact O-N 3.26Å
248	L	34.9	Very low	37.3	Very low	71 Å²	71	87 Å²	87	37%	0.372	44%	0.439	S	S	.	.			trans	-90.7	1.3	-172.7	-129.4	74.4	0	0	0	116.6	I243 R250 Y268	I243-L248 HydrophobicContact CG2-CD2 3.85Å; L248-R250 PolarHBondContact O-N 3.14Å; L248-Y268 HydrophobicContact CD1-CD1 4.17Å; L248-Y268 HydrophobicContact CD1-CD2 3.51Å; L248-Y268 HydrophobicContact CD1-CE1 3.97Å; L248-Y268 HydrophobicContact CD1-CE2 3.27Å; L248-Y268 HydrophobicContact CD1-CG 3.97Å
249	S	28.4	Very low	37.5	Very low	40 Å²	40	88.2 Å²	88.2	28%	0.28	44%	0.441	S	S	.	.			trans	-84.6	52.6	-167.7	64.1	0	0	0	0	116.3	E519 N521	S249-E519 VanDerWaalsContact CB-OE1 3.26Å; S249-E519 WeakPolarHBondContact CB-OE1 3.13Å; S249-E519 PolarHBondContact OG-OE1 3.38Å; S249-N521 WeakPolarHBondContact CA-OD1 3.43Å; S249-N521 WeakPolarHBondContact CB-OD1 3.27Å
250	R	28.6	Very low	37.5	Very low	147 Å²	147	87.1 Å²	87.1	56%	0.555	44%	0.439	S	S	*	.	S	Bend	trans	-133.9	99.1	-179.4	-87	-179.1	-179.1	179	5.5	114.9	L248 V252 Y264	L248-R250 PolarHBondContact O-N 3.14Å; R250-V252 PolarHBondContact O-N 3.12Å; R250-Y264 HydrophobicContact CB-CE1 4.1Å; R250-Y264 HydrophobicContact CB-CE2 3.67Å; R250-Y264 WeakPolarHBondContact CB-OH 3.44Å; R250-Y264 VanDerWaalsContact CD-OH 3.24Å; R250-Y264 WeakPolarHBondContact CD-OH 3.49Å; R250-Y264 VanDerWaalsContact O-CD2 3.31Å; R250-Y264 WeakPolarHBondContact O-CD2 3.41Å; R250-Y264 VanDerWaalsContact O-CE2 3.26Å; R250-Y264 WeakPolarHBondContact O-CE2 3.07Å
251	I	26.4	Very low	37.4	Very low	70 Å²	70	86.2 Å²	86.2	36%	0.359	43%	0.432	S	S	.	.			trans	50.6	65.6	146.2	-35.2	178.5	0	0	0	115.3	L260	I251-L260 HydrophobicContact CG2-CD1 4.35Å; I251-L260 HydrophobicContact CG2-CD2 4.17Å
252	V	32.1	Very low	37.6	Very low	42 Å²	42	82 Å²	82	26%	0.255	41%	0.41	S	S	.	.			trans	-72.9	142.8	140.6	176.6	0	0	0	0	106.7	R250 F261 L522	R250-V252 PolarHBondContact O-N 3.12Å; V252-F261 HydrophobicContact CG1-CD2 4.22Å; V252-F261 HydrophobicContact CG1-CE2 4.4Å; V252-L522 HydrophobicContact CB-CB 4.19Å; V252-L522 HydrophobicContact CB-CD1 4.35Å; V252-L522 HydrophobicContact CG1-CB 4.33Å; V252-L522 HydrophobicContact CG1-CD1 4.24Å; V252-L522 WeakPolarHBondContact O-CD1 3.42Å
253	A	33.7	Very low	37.6	Very low	13 Å²	13	80.5 Å²	80.5	11%	0.107	41%	0.406	C	S	.	.			trans	-89.7	141.7	-177.9	0	0	0	0	0	112.1	D255 T258 L260	A253-D255 PolarHBondContact O-N 3.43Å; A253-T258 WeakPolarHBondContact CB-OG1 3.09Å; A253-L260 HydrophobicContact CB-CB 3.84Å
254	D	45.2	Very low	37.4	Very low	36 Å²	36	80.9 Å²	80.9	19%	0.193	40%	0.402	C	S	.	.	S	Bend	trans	-61.8	-27.1	-170.5	-126.9	37.1	0	0	0	113.5	L522 R546 W548	D254-L522 HydrophobicContact CB-CD1 4.38Å; D254-L522 VanDerWaalsContact OD1-CD1 3.31Å; D254-L522 WeakPolarHBondContact OD1-CD1 3.49Å; D254-L522 WeakPolarHBondContact OD1-CD2 3.37Å; D254-R546 VanDerWaalsContact CG-CZ 3.48Å; D254-R546 VanDerWaalsContact CG-NH1 3.28Å; D254-R546 IonicContact OD1-CZ 3.43Å; D254-R546 IonicContact OD1-NH1 2.7Å; D254-R546 PolarHBondContact OD1-NH1 3.4Å; D254-R546 IonicContact OD1-NH2 2.69Å; D254-R546 PolarHBondContact OD1-NH2 2.82Å; D254-R546 IonicContact OD2-CZ 3.88Å; D254-R546 IonicContact OD2-NE 2.63Å; D254-R546 IonicContact OD2-NH1 3.98Å; D254-R546 PolarHBondContact OD2-NH1 3.01Å; D254-R546 IonicContact OD2-NH2 3.32Å; D254-R546 PolarHBondContact OD2-NH2 2.82Å; D254-W548 VanDerWaalsContact O-CE2 3.27Å; D254-W548 WeakPolarHBondContact O-CZ2 3.41Å; D254-W548 PolarHBondContact O-NE1 2.94Å; D254-W548 VanDerWaalsContact O-NE1 3.15Å
255	D	51.8	Low	37.4	Very low	44 Å²	44	79.9 Å²	79.9	24%	0.235	39%	0.393	C	S	.	.	S	Bend	trans	-114.5	125.5	-175.1	-177.5	-20.5	0	0	0	111.2	A253 K257 T258 W548	A253-D255 PolarHBondContact O-N 3.43Å; D255-K257 PolarHBondContact O-N 3.44Å; D255-K257 VanDerWaalsContact OD1-CB 3.28Å; D255-K257 WeakPolarHBondContact OD1-CB 3.43Å; D255-K257 WeakPolarHBondContact OD1-CG 3.32Å; D255-K257 PolarHBondContact OD1-N 2.83Å; D255-T258 HydrophobicContact CB-CG2 4.18Å; D255-T258 PolarHBondContact O-N 3.42Å; D255-T258 PolarHBondContact O-OG1 3.01Å; D255-W548 HydrophobicContact CB-CH2 3.72Å; D255-W548 HydrophobicContact CB-CZ2 4.03Å
256	P	51.4	Low	37.7	Very low	19 Å²	19	84.3 Å²	84.3	12%	0.123	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-13.3	178.2	24.7	-34.7	0	0	0	114.9	T258 W548 W596	P256-T258 VanDerWaalsContact C-N 3.34Å; P256-W548 HydrophobicContact CG-CD2 4.11Å; P256-W548 HydrophobicContact CG-CE3 4.12Å; P256-W548 HydrophobicContact CG-CG 4.3Å; P256-W596 HydrophobicContact CB-CD2 4.49Å; P256-W596 HydrophobicContact CB-CZ2 4.15Å; P256-W596 HydrophobicContact CG-CD2 3.66Å; P256-W596 HydrophobicContact CG-CE3 3.93Å; P256-W596 HydrophobicContact CG-CG 4.06Å; P256-W596 HydrophobicContact CG-CH2 4.4Å; P256-W596 HydrophobicContact CG-CZ2 4.16Å; P256-W596 HydrophobicContact CG-CZ3 4.3Å
257	K	50.5	Low	37.4	Very low	71 Å²	71	82.3 Å²	82.3	31%	0.309	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-14.4	172.5	-62.8	169.3	-175	152.9	0	114.2	D255 W596	D255-K257 PolarHBondContact O-N 3.44Å; D255-K257 VanDerWaalsContact OD1-CB 3.28Å; D255-K257 WeakPolarHBondContact OD1-CB 3.43Å; D255-K257 WeakPolarHBondContact OD1-CG 3.32Å; D255-K257 PolarHBondContact OD1-N 2.83Å; K257-W596 PolarHBondContact NZ-O 3.46Å
258	T	44.7	Very low	37.4	Very low	59 Å²	59	81.1 Å²	81.1	36%	0.362	39%	0.39	S	S	.	.	S	Bend	trans	-94.3	139.7	-169.2	52.6	0	0	0	0	113.4	A253 D255 P256 L260 F261	A253-T258 WeakPolarHBondContact CB-OG1 3.09Å; D255-T258 HydrophobicContact CB-CG2 4.18Å; D255-T258 PolarHBondContact O-N 3.42Å; D255-T258 PolarHBondContact O-OG1 3.01Å; P256-T258 VanDerWaalsContact C-N 3.34Å; T258-L260 PolarHBondContact O-N 2.91Å; T258-F261 PolarHBondContact O-N 2.9Å
259	E	41.6	Very low	37.4	Very low	153 Å²	153	84.1 Å²	84.1	72%	0.715	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-66.4	-16.6	-161.6	-67	176.2	175.6	0	0	115	F261 K592	E259-F261 VanDerWaalsContact C-N 3.29Å; E259-F261 PolarHBondContact O-N 3.27Å; E259-K592 IonicContact OE1-NZ 3.45Å; E259-K592 PolarHBondContact OE1-NZ 2.71Å
260	L	38.6	Very low	37.7	Very low	96 Å²	96	89.2 Å²	89.2	50%	0.503	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-75.9	-8.2	179	-88.8	142.8	0	0	0	114.4	I251 A253 T258 I262	I251-L260 HydrophobicContact CG2-CD1 4.35Å; I251-L260 HydrophobicContact CG2-CD2 4.17Å; A253-L260 HydrophobicContact CB-CB 3.84Å; T258-L260 PolarHBondContact O-N 2.91Å; L260-I262 PolarHBondContact O-N 2.85Å
261	F	35.9	Very low	38.1	Very low	40 Å²	40	91.3 Å²	91.3	18%	0.175	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-62.7	-13.3	-176.5	-162.3	-95.8	0	0	0	115	V252 T258 E259	V252-F261 HydrophobicContact CG1-CD2 4.22Å; V252-F261 HydrophobicContact CG1-CE2 4.4Å; T258-F261 PolarHBondContact O-N 2.9Å; E259-F261 VanDerWaalsContact C-N 3.29Å; E259-F261 PolarHBondContact O-N 3.27Å
262	I	41.4	Very low	38.4	Very low	24 Å²	24	94.7 Å²	94.7	12%	0.123	46%	0.456	C	S	.	.	S	Bend	trans	-129.7	-17.2	-165.7	-61.9	173.4	0	0	0	115.1	L260 L569 R588	L260-I262 PolarHBondContact O-N 2.85Å; I262-L569 HydrophobicContact CD1-CD2 3.73Å; I262-L569 HydrophobicContact CG1-CD2 4.04Å; I262-L569 HydrophobicContact CG2-CD2 4.02Å; I262-R588 HydrophobicContact CD1-CG 3.77Å
263	D	36.6	Very low	38.3	Very low	106 Å²	106	100.7 Å²	100.7	57%	0.567	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-86.3	-4.6	-171.9	-91.4	12.3	0	0	0	114.8	N265 R588	D263-N265 PolarHBondContact O-N 3.01Å; D263-R588 IonicContact OD1-NH2 2.75Å; D263-R588 PolarHBondContact OD1-NH2 2.66Å
264	Y	31.3	Very low	38.3	Very low	98 Å²	98	109 Å²	109	38%	0.384	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-79.8	-14.8	-174.2	-137.8	-96.9	0	0	0	115.7	R250 R266	R250-Y264 HydrophobicContact CB-CE1 4.1Å; R250-Y264 HydrophobicContact CB-CE2 3.67Å; R250-Y264 WeakPolarHBondContact CB-OH 3.44Å; R250-Y264 VanDerWaalsContact CD-OH 3.24Å; R250-Y264 WeakPolarHBondContact CD-OH 3.49Å; R250-Y264 VanDerWaalsContact O-CD2 3.31Å; R250-Y264 WeakPolarHBondContact O-CD2 3.41Å; R250-Y264 VanDerWaalsContact O-CE2 3.26Å; R250-Y264 WeakPolarHBondContact O-CE2 3.07Å; Y264-R266 PolarHBondContact O-N 3.01Å
265	N	34.9	Very low	37.7	Very low	94 Å²	94	112.2 Å²	112.2	50%	0.503	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-73.8	17.2	-178.7	-90.4	-13	0	0	0	115.4	D263 N571	D263-N265 PolarHBondContact O-N 3.01Å; N265-N571 PolarHBondContact O-ND2 3.22Å; N265-N571 VanDerWaalsContact O-ND2 3.13Å
266	R	34.8	Very low	36.8	Very low	212 Å²	212	115.2 Å²	115.2	80%	0.8	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-95.3	-17.7	-169	-136	173.1	-172	179.8	-0.4	115.6	Y264	Y264-R266 PolarHBondContact O-N 3.01Å
267	N	31.8	Very low	35.6	Very low	147 Å²	147	121.9 Å²	121.9	79%	0.786	61%	0.605	S	S	*	*	S	Bend	trans	-124.9	7	-167.2	-69.7	2.1	0	0	0	115.8
268	Y	31.8	Very low	35	Very low	122 Å²	122	125.1 Å²	125.1	48%	0.478	63%	0.631	S	S	.	*	S	Bend	trans	-121.7	28	-168.7	-155.9	-105.8	0	0	0	115.7	L248	L248-Y268 HydrophobicContact CD1-CD1 4.17Å; L248-Y268 HydrophobicContact CD1-CD2 3.51Å; L248-Y268 HydrophobicContact CD1-CE1 3.97Å; L248-Y268 HydrophobicContact CD1-CE2 3.27Å; L248-Y268 HydrophobicContact CD1-CG 3.97Å
269	M	34.4	Very low	34.3	Very low	134 Å²	134	131 Å²	131	66%	0.66	65%	0.654	S	S	*	*	S	Bend	trans	-125.6	0.7	-177.4	-79.9	-78.5	95.3	0	0	116.6
270	D	34.6	Very low	33.8	Very low	146 Å²	146	135.1 Å²	135.1	78%	0.781	67%	0.665	S	S	*	*	S	Bend	trans	-84.8	-8.9	176.8	-91.9	-36.5	0	0	0	114.6
271	H	35.7	Very low	33.2	Very low	191 Å²	191	136.9 Å²	136.9	88%	0.884	68%	0.68	S	S	*	*	S	Bend	trans	-96.7	-8.1	-175.9	-102.3	-71	0	0	0	116.4
272	F	34.5	Very low	33.1	Very low	142 Å²	142	139.6 Å²	139.6	62%	0.623	70%	0.704	S	S	*	*			trans	-102.5	15.5	-175	-99.4	-82.9	0	0	0	115.5	Q274	F272-Q274 PolarHBondContact O-N 3.2Å; F272-Q274 VanDerWaalsContact O-N 3.1Å
273	K	30	Very low	32.7	Very low	168 Å²	168	147.4 Å²	147.4	73%	0.73	74%	0.74	S	S	*	*			trans	-82.2	71.1	173.7	-84	179.1	176.2	161.2	0	112.9
274	Q	32.1	Very low	32.7	Very low	187 Å²	187	149.2 Å²	149.2	87%	0.874	75%	0.749	S	S	*	*			trans	-174.9	134.3	149.5	-105.4	151.3	39.8	0	0	113.1	F272	F272-Q274 PolarHBondContact O-N 3.2Å; F272-Q274 VanDerWaalsContact O-N 3.1Å
275	A	32.9	Very low	33.1	Very low	103 Å²	103	150.6 Å²	150.6	85%	0.851	76%	0.762	S	S	*	*			trans	67.5	136.6	178.6	0	0	0	0	0	116.1
276	S	32.5	Very low	33.1	Very low	108 Å²	108	149.9 Å²	149.9	76%	0.755	76%	0.763	S	S	*	*			cis	-156.2	154.8	-1.9	46.2	0	0	0	0	111.7
277	D	27.9	Very low	33.3	Very low	158 Å²	158	144.7 Å²	144.7	85%	0.845	75%	0.75	S	S	*	*			trans	-58.8	138.1	-177.2	-53.6	-84.5	0	0	0	115.1
278	T	36.5	Very low	33.7	Very low	139 Å²	139	144.8 Å²	144.8	85%	0.853	74%	0.744	S	S	*	*			trans	-161	135.8	144.4	8.6	0	0	0	0	109.8
279	Q	29.6	Very low	34.2	Very low	182 Å²	182	145.2 Å²	145.2	85%	0.85	75%	0.75	S	S	*	*			trans	-88.8	124.6	-170.3	-65.6	167.1	-43.8	0	0	112.3
280	Y	31.2	Very low	34.2	Very low	240 Å²	240	145.6 Å²	145.6	94%	0.941	75%	0.752	S	S	*	*			trans	-142.5	117.1	154.8	-90.2	-79.4	0	0	0	110.1
281	T	27.5	Very low	34.4	Very low	134 Å²	134	143.1 Å²	143.1	82%	0.822	74%	0.738	S	S	*	*			trans	-104.6	101.8	-176.3	50.6	0	0	0	0	111.6
282	S	34.1	Very low	34.5	Very low	96 Å²	96	139.8 Å²	139.8	67%	0.671	73%	0.731	S	S	*	*			trans	-89.9	141.2	160.5	59	0	0	0	0	110.1	N284	S282-N284 PolarHBondContact O-N 2.71Å
283	H	32.6	Very low	34.4	Very low	188 Å²	188	142.1 Å²	142.1	87%	0.87	74%	0.736	S	S	*	*			trans	-66.5	98.5	-176.6	-81.8	28.5	0	0	0	112.6	I285	H283-I285 PolarHBondContact O-N 2.82Å
284	N	35.9	Very low	34.5	Very low	144 Å²	144	142.2 Å²	142.2	77%	0.77	74%	0.738	S	S	*	*			trans	-83.8	106.9	166.5	-68.3	-15.8	0	0	0	109.2	S282	S282-N284 PolarHBondContact O-N 2.71Å
285	I	39.7	Very low	34.4	Very low	127 Å²	127	141.6 Å²	141.6	65%	0.651	74%	0.736	S	S	*	*			trans	-70.5	125.4	169.8	-60	173.2	0	0	0	107.9	H283	H283-I285 PolarHBondContact O-N 2.82Å
286	P	34.7	Very low	34.3	Very low	80 Å²	80	143 Å²	143	52%	0.519	74%	0.739	S	S	.	*			trans	-65.9	134.7	-177.6	-20.8	32.9	0	0	0	112.4	K288 E289	P286-K288 PolarHBondContact O-N 2.92Å; P286-E289 PolarHBondContact O-N 2.87Å
287	L	38.5	Very low	34.3	Very low	103 Å²	103	140.8 Å²	140.8	54%	0.539	72%	0.723	S	S	.	*	G	3₁₀ helix	trans	-53.3	-23.8	177.1	-98.1	93.1	0	0	0	113.9	E289 M290	L287-E289 PolarHBondContact O-N 3.21Å; L287-M290 PolarHBondContact O-N 2.98Å
288	K	40.6	Very low	34.4	Very low	148 Å²	148	138.2 Å²	138.2	64%	0.643	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-65.9	-18.6	-179.8	-151.5	152	-172.3	148.4	0	113.3	P286 V292 E577	P286-K288 PolarHBondContact O-N 2.92Å; K288-V292 WeakPolarHBondContact O-CG2 3.49Å; K288-E577 IonicContact NZ-OE2 3.14Å; K288-E577 PolarHBondContact NZ-OE2 2.76Å
289	E	43.4	Very low	34.1	Very low	132 Å²	132	141.5 Å²	141.5	62%	0.617	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-88.6	-12.9	171.7	-67.7	-171.2	137.7	0	0	113.8	P286 L287	P286-E289 PolarHBondContact O-N 2.87Å; L287-E289 PolarHBondContact O-N 3.21Å
290	M	34.2	Very low	34.3	Very low	142 Å²	142	138.8 Å²	138.8	70%	0.7	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-29.7	176.2	-71.6	-177.3	68.7	0	0	113.4	L287	L287-M290 PolarHBondContact O-N 2.98Å
291	L	37.6	Very low	34.4	Very low	93 Å²	93	130.2 Å²	130.2	49%	0.487	70%	0.697	S	S	.	*	S	Bend	trans	-84.6	-19.9	-178.2	-92.6	89.4	0	0	0	114.9	D579	L291-D579 HydrophobicContact CD2-CB 4.3Å
292	V	37.7	Very low	34.7	Very low	122 Å²	122	128.3 Å²	128.3	74%	0.739	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	11.8	-168.9	-172	0	0	0	0	113.1	K288	K288-V292 WeakPolarHBondContact O-CG2 3.49Å
293	R	33.3	Very low	34.9	Very low	191 Å²	191	130.3 Å²	130.3	72%	0.721	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	20	172.6	-140.3	177.7	-66.1	-156.4	1.3	113.9	E295	R293-E295 VanDerWaalsContact C-N 3.31Å; R293-E295 PolarHBondContact O-N 3.47Å
294	H	32.7	Very low	35.2	Very low	170 Å²	170	127.4 Å²	127.4	79%	0.787	66%	0.664	S	S	*	*			trans	-88.6	47.3	174.9	-91.1	-71.8	0	0	0	113.1
295	E	29.9	Very low	35.3	Very low	174 Å²	174	127.9 Å²	127.9	81%	0.813	67%	0.667	S	S	*	*	S	Bend	trans	-158.6	129.3	166.9	-113.6	161.4	-151	0	0	109.8	R293	R293-E295 VanDerWaalsContact C-N 3.31Å; R293-E295 PolarHBondContact O-N 3.47Å
296	S	30.1	Very low	36	Very low	133 Å²	133	132.7 Å²	132.7	93%	0.93	68%	0.677	S	S	*	*	S	Bend	trans	55.1	58.3	174	65.6	0	0	0	0	117.7
297	S	32.4	Very low	37.5	Very low	60 Å²	60	132.8 Å²	132.8	42%	0.42	67%	0.672	S	S	.	*			trans	-127.9	124.9	151.7	52.4	0	0	0	0	111	Y299	S297-Y299 WeakPolarHBondContact O-CD2 3.34Å; S297-Y299 PolarHBondContact O-N 2.99Å; S297-Y299 WeakPolarHBondContact OG-CE2 3.46Å
298	S	29.8	Very low	39.3	Very low	105 Å²	105	129.1 Å²	129.1	73%	0.734	66%	0.655	S	S	*	*			trans	-75.5	91.1	-176.8	52.3	0	0	0	0	111.1	T300	S298-T300 PolarHBondContact O-N 2.87Å
299	Y	30.3	Very low	41.4	Very low	207 Å²	207	127 Å²	127	81%	0.812	65%	0.645	S	S	*	*			trans	-71.8	75.7	170	-75.4	-88.2	0	0	0	110.9	S297	S297-Y299 WeakPolarHBondContact O-CD2 3.34Å; S297-Y299 PolarHBondContact O-N 2.99Å; S297-Y299 WeakPolarHBondContact OG-CE2 3.46Å
300	T	34.2	Very low	43.4	Very low	126 Å²	126	121.6 Å²	121.6	77%	0.773	62%	0.62	S	S	*	*			trans	-126.2	103.3	-178.2	52.8	0	0	0	0	111.7	S298	S298-T300 PolarHBondContact O-N 2.87Å
301	G	32.3	Very low	45.8	Very low	59 Å²	59	117 Å²	117	61%	0.608	60%	0.595	S	S	*	*	S	Bend	trans	142.3	130.7	167.2	0	0	0	0	0	115.2
302	N	35.4	Very low	48.2	Very low	94 Å²	94	113.2 Å²	113.2	50%	0.503	58%	0.576	S	S	.	*	S	Bend	trans	80.9	52.8	166.6	-52.5	-34.1	0	0	0	121.1	F221 T222	F221-N302 PolarHBondContact N-OD1 2.82Å; F221-N302 PolarHBondContact O-ND2 3.41Å; F221-N302 PolarHBondContact O-OD1 3.38Å; T222-N302 PolarHBondContact N-ND2 3.04Å; T222-N302 PolarHBondContact N-OD1 2.68Å
303	M	37.6	Very low	50.4	Low	139 Å²	139	108.6 Å²	108.6	69%	0.685	55%	0.548	S	S	*	.			trans	-124.7	-5.8	161.9	-159.4	171.9	172.4	0	0	115	N305	M303-N305 PolarHBondContact O-N 2.75Å
304	Y	38.3	Very low	53	Low	127 Å²	127	102.1 Å²	102.1	50%	0.498	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	19.8	-154.3	-65.4	-73.1	0	0	0	118
305	N	39.3	Very low	55.5	Low	154 Å²	154	101 Å²	101	82%	0.824	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.5	15.3	176.5	-134.1	26.1	0	0	0	114.4	M303	M303-N305 PolarHBondContact O-N 2.75Å
306	R	54.7	Low	58.1	Low	227 Å²	227	98.2 Å²	98.2	86%	0.857	50%	0.504	S	S	*	.	S	Bend	trans	-100.5	129.9	166.8	-75	-176.6	173.6	178	-0.5	108.8
307	I	64.2	Low	60.7	Low	82 Å²	82	98.5 Å²	98.5	42%	0.421	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-58.1	126	167.4	-55.6	177.8	0	0	0	106.6	T441	I307-T441 VanDerWaalsContact CG2-OG1 3.25Å; I307-T441 WeakPolarHBondContact CG2-OG1 3.18Å
308	P	77.9	Confident	63.3	Low	27 Å²	27	95.7 Å²	95.7	18%	0.175	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-64.1	145.1	-173	24.3	-35.1	0	0	0	112	M213 T439 V440 T441	M213-P308 HydrophobicContact CE-CB 3.33Å; M213-P308 HydrophobicContact CE-CG 3.42Å; M213-P308 VanDerWaalsContact CE-CG 3.42Å; M213-P308 HydrophobicContact SD-CB 3.15Å; M213-P308 WeakPolarHBondContact SD-CB 3.47Å; M213-P308 HydrophobicContact SD-CG 3.98Å; P308-T439 VanDerWaalsContact CG-O 3.31Å; P308-T439 WeakPolarHBondContact CG-O 3.41Å; P308-V440 HydrophobicContact CB-CG1 4.48Å; P308-V440 HydrophobicContact CG-CB 4.44Å; P308-V440 HydrophobicContact CG-CG1 3.97Å; P308-V440 CarbonylContact O-C 3.59Å; P308-T441 PolarHBondContact O-N 3.15Å
309	K	83.2	Confident	66.2	Low	103 Å²	103	91.6 Å²	91.6	45%	0.448	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	129.8	-174.3	-68.4	-177.2	170.9	-142.5	0	111.1	W311 T441 E443	K309-W311 HydrophobicContact CD-CZ2 4.44Å; K309-T441 CarbonylContact C-O 3.58Å; K309-T441 WeakPolarHBondContact CA-O 3.48Å; K309-E443 HydrophobicContact CB-CG 4.08Å; K309-E443 HydrophobicContact CD-CG 3.94Å; K309-E443 VanDerWaalsContact CE-OE1 3.29Å; K309-E443 WeakPolarHBondContact CE-OE1 3.03Å; K309-E443 HydrophobicContact CG-CG 4.1Å; K309-E443 IonicContact NZ-OE1 3.19Å; K309-E443 PolarHBondContact NZ-OE1 3.48Å
310	I	85.7	Confident	69	Low	18 Å²	18	81.8 Å²	81.8	9%	0.092	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	110.1	170.5	-60.9	-175.1	0	0	0	108.6	L318 V320 V440 T441 E443	I310-L318 HydrophobicContact CG2-CD1 3.68Å; I310-L318 HydrophobicContact CG2-CD2 4.36Å; I310-V320 HydrophobicContact CD1-CG2 4.46Å; I310-V440 HydrophobicContact CD1-CB 4.08Å; I310-V440 HydrophobicContact CD1-CG1 4.32Å; I310-V440 HydrophobicContact CD1-CG2 3.61Å; I310-V440 HydrophobicContact CG1-CB 4.17Å; I310-V440 HydrophobicContact CG1-CG2 4.14Å; I310-T441 PolarHBondContact N-O 2.89Å; I310-E443 PolarHBondContact O-N 2.7Å
311	W	86	Confident	71.7	Confident	46 Å²	46	75.8 Å²	75.8	17%	0.174	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	129.3	173	-63.3	92.2	0	0	0	110.2	K309 E443 M445 P479 A553 P554	K309-W311 HydrophobicContact CD-CZ2 4.44Å; W311-E443 WeakPolarHBondContact CA-O 3.29Å; W311-E443 HydrophobicContact CD2-CB 3.75Å; W311-E443 HydrophobicContact CD2-CG 4.45Å; W311-E443 HydrophobicContact CE3-CB 3.52Å; W311-E443 HydrophobicContact CE3-CG 4.47Å; W311-E443 HydrophobicContact CG-CB 4.42Å; W311-E443 HydrophobicContact CH2-CB 4.09Å; W311-E443 HydrophobicContact CH2-CG 4.29Å; W311-E443 HydrophobicContact CZ2-CB 4.28Å; W311-E443 HydrophobicContact CZ2-CG 4.24Å; W311-E443 HydrophobicContact CZ3-CB 3.71Å; W311-E443 HydrophobicContact CZ3-CG 4.41Å; W311-M445 HydrophobicContact CB-CE 4.35Å; W311-M445 HydrophobicContact CB-CG 4.29Å; W311-M445 HydrophobicContact CB-SD 4.02Å; W311-M445 HydrophobicContact CE3-CG 3.72Å; W311-M445 HydrophobicContact CE3-SD 4.3Å; W311-P479 HydrophobicContact CH2-CB 3.86Å; W311-P479 HydrophobicContact CZ3-CB 3.88Å; W311-P479 HydrophobicContact CZ3-CG 4.26Å; W311-A553 HydrophobicContact CB-CB 3.73Å; W311-A553 HydrophobicContact CG-CB 3.84Å; W311-P554 HydrophobicContact CH2-CG 4.17Å; W311-P554 HydrophobicContact CZ2-CG 3.69Å
312	T	86.7	Confident	74.5	Confident	13 Å²	13	73 Å²	73	8%	0.08	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	147.9	177.2	-172.5	0	0	0	0	111	L318 V411 E443 P444 M445	T312-L318 HydrophobicContact CG2-CB 4.29Å; T312-L318 HydrophobicContact CG2-CD2 4.47Å; T312-V411 HydrophobicContact CG2-CB 3.92Å; T312-V411 HydrophobicContact CG2-CG1 3.86Å; T312-V411 HydrophobicContact CG2-CG2 3.8Å; T312-E443 PolarHBondContact N-O 2.91Å; T312-P444 CarbonylContact O-C 3.59Å; T312-P444 WeakPolarHBondContact O-CA 3.43Å; T312-M445 PolarHBondContact O-N 2.82Å
313	V	85.3	Confident	76.9	Confident	25 Å²	25	70.5 Å²	70.5	15%	0.152	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	137	-175.3	-173.5	0	0	0	0	110.5	K315 K316 M445 T595	V313-K315 PolarHBondContact O-N 2.81Å; V313-K316 HydrophobicContact CB-CB 4.48Å; V313-K316 HydrophobicContact CB-CD 3.79Å; V313-K316 HydrophobicContact CB-CG 3.95Å; V313-K316 HydrophobicContact CG1-CD 4.49Å; V313-K316 HydrophobicContact CG1-CG 4.42Å; V313-K316 HydrophobicContact CG2-CD 4.15Å; V313-K316 WeakPolarHBondContact O-CB 3.02Å; V313-K316 PolarHBondContact O-N 2.9Å; V313-K316 VanDerWaalsContact O-N 3.14Å; V313-M445 HydrophobicContact CG2-CE 4.02Å; V313-T595 HydrophobicContact CG1-CG2 4.25Å; V313-T595 VanDerWaalsContact CG2-OG1 3.28Å; V313-T595 WeakPolarHBondContact CG2-OG1 3.48Å
314	E	87	Confident	79.3	Confident	55 Å²	55	64.1 Å²	64.1	26%	0.257	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	140	175.1	-156	-147.7	163.7	0	0	111.4	K316 R413 M445	E314-K316 PolarHBondContact O-N 2.96Å; E314-K316 VanDerWaalsContact O-N 3.08Å; E314-R413 HydrophobicContact CG-CB 4.49Å; E314-M445 PolarHBondContact N-O 3.1Å
315	K	84.9	Confident	81.5	Confident	147 Å²	147	59 Å²	59	64%	0.639	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	-1.2	-178.6	-58	159.3	-174.7	145.6	0	115.3	V313 V411	V313-K315 PolarHBondContact O-N 2.81Å; K315-V411 WeakPolarHBondContact CA-O 3.22Å; K315-V411 PolarHBondContact N-O 3.08Å
316	K	84.4	Confident	83.6	Confident	115 Å²	115	53.6 Å²	53.6	50%	0.5	25%	0.245	S	C	.	.	S	Bend	trans	-77.1	160.1	164.8	-66.5	-165.3	-171.5	175.6	0	111	V313 E314 V411	V313-K316 HydrophobicContact CB-CB 4.48Å; V313-K316 HydrophobicContact CB-CD 3.79Å; V313-K316 HydrophobicContact CB-CG 3.95Å; V313-K316 HydrophobicContact CG1-CD 4.49Å; V313-K316 HydrophobicContact CG1-CG 4.42Å; V313-K316 HydrophobicContact CG2-CD 4.15Å; V313-K316 WeakPolarHBondContact O-CB 3.02Å; V313-K316 PolarHBondContact O-N 2.9Å; V313-K316 VanDerWaalsContact O-N 3.14Å; E314-K316 PolarHBondContact O-N 2.96Å; E314-K316 VanDerWaalsContact O-N 3.08Å; K316-V411 PolarHBondContact O-N 2.89Å; K316-V411 VanDerWaalsContact O-N 3.07Å
317	K	85.3	Confident	85.1	Confident	139 Å²	139	42.8 Å²	42.8	60%	0.604	20%	0.204	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	116.8	172.6	-67	177.7	-177.6	174.3	0	108.9	L409	K317-L409 CarbonylContact C-O 3.59Å
318	L	88	Confident	86.2	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	123	165.4	171.7	57.5	0	0	0	108.4	H194 I310 T312 V320 N408 L409 V411 I442	H194-L318 WeakPolarHBondContact CD2-CD1 3.38Å; H194-L318 WeakPolarHBondContact NE2-CD1 3.25Å; I310-L318 HydrophobicContact CG2-CD1 3.68Å; I310-L318 HydrophobicContact CG2-CD2 4.36Å; T312-L318 HydrophobicContact CG2-CB 4.29Å; T312-L318 HydrophobicContact CG2-CD2 4.47Å; L318-V320 HydrophobicContact CD1-CG2 3.77Å; L318-V320 HydrophobicContact CD2-CG2 4.16Å; L318-V320 HydrophobicContact CG-CG2 3.72Å; L318-N408 CarbonylContact O-C 3.54Å; L318-N408 WeakPolarHBondContact O-CA 3.49Å; L318-L409 PolarHBondContact N-O 3.29Å; L318-L409 PolarHBondContact O-N 2.93Å; L318-V411 HydrophobicContact CB-CG2 3.53Å; L318-V411 HydrophobicContact CD2-CG2 3.89Å; L318-V411 HydrophobicContact CG-CG2 4.35Å; L318-I442 HydrophobicContact CD2-CD1 4.24Å; L318-I442 HydrophobicContact CD2-CG1 4.35Å
319	I	89.3	Confident	86.6	Confident	19 Å²	19	42 Å²	42	10%	0.097	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	120.2	177.6	-57.5	177.8	0	0	0	108.5	H194 L195 Q406 N408	H194-I319 PolarHBondContact CD2-O 3.37Å; L195-I319 HydrophobicContact CB-CB 4.16Å; L195-I319 HydrophobicContact CB-CG2 3.82Å; L195-I319 HydrophobicContact CD1-CG2 3.89Å; L195-I319 HydrophobicContact CG-CG2 4.23Å; L195-I319 PolarHBondContact N-O 2.83Å; I319-Q406 HydrophobicContact CG2-CG 3.99Å; I319-Q406 VanDerWaalsContact CG2-NE2 3.29Å; I319-N408 WeakPolarHBondContact CG2-OD1 3.36Å
320	V	89.2	Confident	86.8	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.006	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	130.4	-178.6	-165.7	0	0	0	0	109.9	M192 I193 I310 L318 W335 Q406 L407 L420	M192-V320 HydrophobicContact CG-CG1 3.28Å; M192-V320 HydrophobicContact SD-CG1 3.74Å; I193-V320 CarbonylContact O-C 3.59Å; I193-V320 WeakPolarHBondContact O-CA 2.96Å; I193-V320 WeakPolarHBondContact O-CG1 3.4Å; I310-V320 HydrophobicContact CD1-CG2 4.46Å; L318-V320 HydrophobicContact CD1-CG2 3.77Å; L318-V320 HydrophobicContact CD2-CG2 4.16Å; L318-V320 HydrophobicContact CG-CG2 3.72Å; V320-W335 HydrophobicContact CB-CH2 4.02Å; V320-W335 HydrophobicContact CB-CZ3 4.48Å; V320-W335 HydrophobicContact CG1-CH2 3.82Å; V320-W335 HydrophobicContact CG1-CZ3 4.26Å; V320-Q406 CarbonylContact O-C 3.59Å; V320-Q406 VanDerWaalsContact O-CA 3.31Å; V320-Q406 WeakPolarHBondContact O-CA 3.4Å; V320-L407 PolarHBondContact N-O 3.03Å; V320-L407 PolarHBondContact O-N 2.64Å; V320-L420 HydrophobicContact CG2-CD2 4.05Å
321	S	91	Very high	87	Confident	1 Å²	1	37 Å²	37	1%	0.007	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	125.7	175.2	-169.4	0	0	0	0	109.8	M192 I193 H323 Q404 S405	M192-S321 CarbonylContact C-O 3.6Å; M192-S321 WeakPolarHBondContact CA-O 3.32Å; I193-S321 PolarHBondContact N-O 3.48Å; I193-S321 PolarHBondContact O-N 3.32Å; S321-H323 PolarHBondContact OG-CD2 3.12Å; S321-H323 PolarHBondContact OG-NE2 2.85Å; S321-Q404 WeakPolarHBondContact OG-CG 3.07Å; S321-Q404 PolarHBondContact OG-NE2 3.45Å; S321-S405 CarbonylContact C-O 3.45Å; S321-S405 WeakPolarHBondContact CA-O 3.45Å
322	C	90.4	Very high	87.2	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	131.2	172.6	-169.7	0	0	0	0	109.5	T191 I333 W335 Q404 S405 C422	T191-C322 CarbonylContact O-C 3.59Å; T191-C322 VanDerWaalsContact O-CA 3.26Å; T191-C322 WeakPolarHBondContact O-CA 3.24Å; C322-I333 HydrophobicContact CB-CD1 4.35Å; C322-I333 WeakPolarHBondContact O-CD1 3.45Å; C322-W335 HydrophobicContact CB-CH2 3.71Å; C322-W335 HydrophobicContact CB-CZ2 3.58Å; C322-Q404 CarbonylContact O-C 3.42Å; C322-Q404 WeakPolarHBondContact O-CA 3.35Å; C322-S405 PolarHBondContact N-O 2.98Å; C322-S405 PolarHBondContact O-N 2.77Å; C322-C422 HydrophobicContact CB-CB 3.8Å; C322-C422 WeakPolarHBondContact CB-SG 3.49Å; C322-C422 WeakPolarHBondContact SG-CB 3.34Å; C322-C422 CovalentContact SG-SG 2.03Å; C322-C422 PolarHBondContact SG-SG 3.29Å
323	H	87.5	Confident	87.3	Confident	41 Å²	41	37.3 Å²	37.3	19%	0.19	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	141.5	-179.1	-58	-116	0	0	0	109.9	L190 T191 S321 T403 Q404	L190-H323 CarbonylContact C-O 3.58Å; L190-H323 WeakPolarHBondContact CA-O 3.38Å; T191-H323 PolarHBondContact N-O 2.83Å; T191-H323 PolarHBondContact O-N 2.95Å; S321-H323 PolarHBondContact OG-CD2 3.12Å; S321-H323 PolarHBondContact OG-NE2 2.85Å; H323-T403 CarbonylContact C-O 3.55Å; H323-T403 WeakPolarHBondContact CA-O 3.39Å; H323-Q404 VanDerWaalsContact CE1-CG 3.46Å; H323-Q404 WeakPolarHBondContact CE1-CG 3.39Å; H323-Q404 PolarHBondContact CE1-NE2 2.93Å; H323-Q404 VanDerWaalsContact CE1-NE2 3.33Å; H323-Q404 PolarHBondContact CE1-OE1 3.33Å
324	T	87.8	Confident	87.6	Confident	6 Å²	6	38.8 Å²	38.8	4%	0.037	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	153.8	171.1	69.6	0	0	0	0	111.1	L190 S331 I333 V402 T403	L190-T324 HydrophobicContact CD2-CG2 3.37Å; T324-S331 WeakPolarHBondContact CB-OG 3.35Å; T324-S331 WeakPolarHBondContact CG2-OG 3.19Å; T324-S331 PolarHBondContact OG1-OG 3.26Å; T324-S331 VanDerWaalsContact OG1-OG 3.11Å; T324-I333 HydrophobicContact CG2-CD1 3.86Å; T324-I333 HydrophobicContact CG2-CG1 3.93Å; T324-V402 WeakPolarHBondContact O-CG1 3.28Å; T324-T403 PolarHBondContact N-O 2.9Å; T324-T403 PolarHBondContact OG1-N 2.7Å
325	S	83.8	Confident	87.9	Confident	20 Å²	20	36.1 Å²	36.1	14%	0.14	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-59.8	159.4	156.1	57	0	0	0	0	111	P187 S188 G189 S327	P187-S325 VanDerWaalsContact C-OG 3.24Å; P187-S325 WeakPolarHBondContact CA-OG 3.26Å; P187-S325 VanDerWaalsContact CB-OG 3.27Å; P187-S325 WeakPolarHBondContact CB-OG 3.35Å; S188-S325 PolarHBondContact N-OG 3.28Å; S188-S325 WeakPolarHBondContact OG-CB 3.12Å; S188-S325 PolarHBondContact OG-OG 2.83Å; G189-S325 PolarHBondContact N-OG 3.33Å; G189-S325 VanDerWaalsContact N-OG 3.12Å; G189-S325 PolarHBondContact O-N 2.92Å; G189-S325 PolarHBondContact O-OG 3.39Å; S325-S327 PolarHBondContact O-N 2.7Å
326	P	84.4	Confident	88.1	Confident	40 Å²	40	30.7 Å²	30.7	26%	0.26	16%	0.157	S	C	.	.	S	Bend	trans	-51.4	135.5	173.3	-24.5	33.4	0	0	0	112.2	V371 M400 V402	P326-V371 HydrophobicContact CB-CG2 4.43Å; P326-V371 HydrophobicContact CG-CG2 4.3Å; P326-M400 HydrophobicContact CB-CB 3.99Å; P326-M400 HydrophobicContact CB-SD 4.04Å; P326-V402 HydrophobicContact CB-CG2 4.28Å; P326-V402 HydrophobicContact CG-CG2 3.89Å
327	S	85.9	Confident	88.4	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.133	C	C	.	.	B	Isolated β-bridge	trans	-145.2	156	-173.6	55.1	0	0	0	0	112	F185 S325 P329 S331 Q401	F185-S327 CarbonylContact O-C 3.58Å; F185-S327 VanDerWaalsContact O-CA 3.31Å; F185-S327 WeakPolarHBondContact O-CA 3.11Å; S325-S327 PolarHBondContact O-N 2.7Å; S327-P329 CarbonylContact C-O 3.5Å; S327-S331 PolarHBondContact OG-N 3.47Å; S327-S331 PolarHBondContact OG-OG 2.87Å; S327-S331 VanDerWaalsContact OG-OG 3.04Å; S327-Q401 PolarHBondContact N-O 2.95Å; S327-Q401 PolarHBondContact O-N 3.06Å; S327-Q401 PolarHBondContact OG-O 2.82Å
328	K	86	Confident	88.4	Confident	38 Å²	38	21 Å²	21	17%	0.165	12%	0.124	C	C	.	.	B	Isolated β-bridge	trans	-147.6	117.3	175.1	-168.6	-179.4	-175.3	-171.1	0	109.5	L147 E150 I184 F185	L147-K328 HydrophobicContact CD2-CD 4.02Å; E150-K328 WeakPolarHBondContact OE1-CE 3.13Å; E150-K328 IonicContact OE1-NZ 3.24Å; E150-K328 PolarHBondContact OE1-NZ 2.66Å; E150-K328 IonicContact OE2-NZ 3.64Å; E150-K328 PolarHBondContact OE2-NZ 2.86Å; I184-K328 CarbonylContact C-O 3.55Å; I184-K328 WeakPolarHBondContact CA-O 3.13Å; F185-K328 HydrophobicContact CB-CB 4.07Å; F185-K328 PolarHBondContact N-O 2.86Å; F185-K328 PolarHBondContact O-N 2.86Å
329	P	87.9	Confident	88.2	Confident	53 Å²	53	23.9 Å²	23.9	34%	0.344	15%	0.154	S	C	.	.	S	Bend	cis	-61.8	171.3	-6.7	30.3	-36.8	0	0	0	112.3	S327 S331 D429 F430	S327-P329 CarbonylContact C-O 3.5Å; P329-S331 PolarHBondContact O-N 2.68Å; P329-D429 HydrophobicContact CG-CB 3.92Å; P329-F430 HydrophobicContact CG-CE1 4.37Å; P329-F430 HydrophobicContact CG-CZ 4.45Å; P329-F430 VanDerWaalsContact O-CZ 3.3Å; P329-F430 WeakPolarHBondContact O-CZ 3.34Å
330	A	86.7	Confident	88	Confident	16 Å²	16	25.4 Å²	25.4	13%	0.132	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-55	131.3	174.3	0	0	0	0	0	111.6	I368 Q401 N426	A330-I368 HydrophobicContact CB-CD1 4.02Å; A330-I368 HydrophobicContact CB-CG2 4.1Å; A330-Q401 HydrophobicContact CB-CB 4.01Å; A330-Q401 VanDerWaalsContact CB-OE1 3.29Å; A330-N426 PolarHBondContact O-ND2 2.94Å
331	S	88.6	Confident	87.9	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-67.9	140.4	167.8	42.2	0	0	0	0	111	T324 S327 P329 T403 N426	T324-S331 WeakPolarHBondContact CB-OG 3.35Å; T324-S331 WeakPolarHBondContact CG2-OG 3.19Å; T324-S331 PolarHBondContact OG1-OG 3.26Å; T324-S331 VanDerWaalsContact OG1-OG 3.11Å; S327-S331 PolarHBondContact OG-N 3.47Å; S327-S331 PolarHBondContact OG-OG 2.87Å; S327-S331 VanDerWaalsContact OG-OG 3.04Å; P329-S331 PolarHBondContact O-N 2.68Å; S331-T403 WeakPolarHBondContact O-CB 3.36Å; S331-T403 WeakPolarHBondContact O-CG2 3.4Å; S331-T403 PolarHBondContact O-OG1 3.19Å; S331-N426 WeakPolarHBondContact CA-OD1 3.39Å
332	T	90.5	Very high	87.7	Confident	57 Å²	57	30.2 Å²	30.2	35%	0.35	19%	0.187	S	C	.	.			trans	-107.9	126.7	173.2	-59.8	0	0	0	0	109.2	S425 N426	T332-S425 VanDerWaalsContact CB-OG 3.32Å; T332-S425 WeakPolarHBondContact CB-OG 3.33Å; T332-S425 WeakPolarHBondContact CG2-OG 3.45Å; T332-S425 PolarHBondContact O-N 3.14Å; T332-S425 PolarHBondContact O-OG 2.97Å; T332-N426 PolarHBondContact N-OD1 2.88Å
333	I	90.4	Very high	87.3	Confident	9 Å²	9	33.9 Å²	33.9	5%	0.046	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	134.5	-175.1	-64.9	170.9	0	0	0	110.5	C322 T324 E366 T403 C422	C322-I333 HydrophobicContact CB-CD1 4.35Å; C322-I333 WeakPolarHBondContact O-CD1 3.45Å; T324-I333 HydrophobicContact CG2-CD1 3.86Å; T324-I333 HydrophobicContact CG2-CG1 3.93Å; I333-E366 WeakPolarHBondContact CB-OE2 3.49Å; I333-E366 PolarHBondContact N-OE2 3.23Å; I333-T403 HydrophobicContact CD1-CG2 4.04Å; I333-T403 HydrophobicContact CG1-CG2 4.16Å; I333-C422 WeakPolarHBondContact CG2-SG 3.32Å
334	Q	91.1	Very high	86.5	Confident	56 Å²	56	37.6 Å²	37.6	26%	0.262	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	148.5	168	69.9	-172.2	-5	0	0	111	L341 S423	Q334-L341 HydrophobicContact CB-CD1 3.85Å; Q334-L341 HydrophobicContact CG-CD1 4.22Å; Q334-S423 WeakPolarHBondContact CG-OG 3.38Å; Q334-S423 PolarHBondContact N-O 3.3Å; Q334-S423 PolarHBondContact NE2-OG 2.87Å; Q334-S423 VanDerWaalsContact NE2-OG 3.12Å; Q334-S423 PolarHBondContact O-N 2.89Å
335	W	92.1	Very high	85.3	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131.4	-179.4	-68.4	92.5	0	0	0	110.2	M192 V320 C322 L342 I364 S405 L407 L420 E421 C422	M192-W335 HydrophobicContact CE-CH2 4.3Å; M192-W335 HydrophobicContact CE-CZ3 3.68Å; M192-W335 HydrophobicContact CG-CH2 4.42Å; M192-W335 HydrophobicContact SD-CZ3 4.22Å; V320-W335 HydrophobicContact CB-CH2 4.02Å; V320-W335 HydrophobicContact CB-CZ3 4.48Å; V320-W335 HydrophobicContact CG1-CH2 3.82Å; V320-W335 HydrophobicContact CG1-CZ3 4.26Å; C322-W335 HydrophobicContact CB-CH2 3.71Å; C322-W335 HydrophobicContact CB-CZ2 3.58Å; W335-L342 HydrophobicContact CB-CB 4.2Å; W335-L342 HydrophobicContact CB-CD1 4.06Å; W335-L342 HydrophobicContact CB-CG 4.4Å; W335-L342 PolarHBondContact O-N 3.04Å; W335-I364 HydrophobicContact CB-CD1 4.43Å; W335-I364 HydrophobicContact CG-CD1 4.48Å; W335-S405 WeakPolarHBondContact CZ2-O 3.41Å; W335-S405 PolarHBondContact NE1-OG 2.8Å; W335-L407 HydrophobicContact CD2-CB 3.95Å; W335-L407 HydrophobicContact CD2-CD2 4.03Å; W335-L407 HydrophobicContact CE3-CB 4.32Å; W335-L407 HydrophobicContact CE3-CD2 3.87Å; W335-L407 HydrophobicContact CG-CB 4.44Å; W335-L407 HydrophobicContact CG-CD2 4.39Å; W335-L407 HydrophobicContact CH2-CB 4.19Å; W335-L407 HydrophobicContact CZ2-CB 3.84Å; W335-L407 HydrophobicContact CZ3-CB 4.42Å; W335-L407 HydrophobicContact CZ3-CD2 4.3Å; W335-L420 HydrophobicContact CE3-CD1 3.81Å; W335-L420 HydrophobicContact CE3-CD2 4.37Å; W335-L420 HydrophobicContact CE3-CG 4.06Å; W335-L420 HydrophobicContact CZ3-CD1 4.23Å; W335-L420 HydrophobicContact CZ3-CD2 3.94Å; W335-L420 HydrophobicContact CZ3-CG 4.01Å; W335-E421 CarbonylContact C-O 3.08Å; W335-E421 VanDerWaalsContact CA-O 3.3Å; W335-E421 WeakPolarHBondContact CA-O 3.38Å; W335-C422 HydrophobicContact CE3-CB 4.19Å; W335-C422 HydrophobicContact CH2-CB 4.39Å; W335-C422 HydrophobicContact CZ3-CB 4.08Å
336	H	90.4	Very high	83.8	Confident	32 Å²	32	45.4 Å²	45.4	15%	0.148	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	140.4	167.6	-49.3	106.9	0	0	0	110.2	I340 L420 E421 S423	H336-I340 CarbonylContact C-O 3.57Å; H336-I340 VanDerWaalsContact CA-O 3.27Å; H336-I340 WeakPolarHBondContact CA-O 3.17Å; H336-L420 WeakPolarHBondContact O-CA 3.42Å; H336-E421 HydrophobicContact CB-CB 4.13Å; H336-E421 PolarHBondContact N-O 3.15Å; H336-E421 IonicContact ND1-OE2 2.7Å; H336-E421 PolarHBondContact O-N 2.82Å; H336-S423 PolarHBondContact CE1-OG 3.36Å; H336-S423 VanDerWaalsContact CE1-OG 3.32Å
337	L	89.5	Confident	82.1	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	116.5	174.2	178.9	65.3	0	0	0	108.3	G339 I340 L342 I360 L409 W418 L420 I442	L337-G339 PolarHBondContact O-N 2.9Å; L337-I340 PolarHBondContact N-O 2.92Å; L337-I340 WeakPolarHBondContact O-CB 3.22Å; L337-I340 PolarHBondContact O-N 3.5Å; L337-L342 HydrophobicContact CB-CD1 4.17Å; L337-L342 HydrophobicContact CB-CD2 4.03Å; L337-L342 HydrophobicContact CB-CG 4.18Å; L337-I360 HydrophobicContact CD2-CD1 4.42Å; L337-I360 HydrophobicContact CD2-CG2 4.1Å; L337-L409 HydrophobicContact CD1-CD2 4.19Å; L337-L409 HydrophobicContact CD2-CD1 4.19Å; L337-L409 HydrophobicContact CD2-CD2 4.04Å; L337-W418 HydrophobicContact CD1-CE3 4.12Å; L337-W418 HydrophobicContact CD2-CE3 4.18Å; L337-W418 HydrophobicContact CD2-CZ3 4.24Å; L337-W418 HydrophobicContact CG-CE3 3.83Å; L337-W418 HydrophobicContact CG-CZ3 4.22Å; L337-L420 HydrophobicContact CD1-CB 4.49Å; L337-L420 HydrophobicContact CD1-CD1 4.33Å; L337-I442 HydrophobicContact CD1-CD1 3.82Å
338	A	86.6	Confident	80.2	Confident	50 Å²	50	59.2 Å²	59.2	41%	0.413	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	36.3	-169.4	0	0	0	0	0	113.3	I340 W418 Q419	A338-I340 VanDerWaalsContact C-N 3.28Å; A338-I340 PolarHBondContact O-N 2.84Å; A338-W418 HydrophobicContact CB-CB 4.38Å; A338-W418 HydrophobicContact CB-CD2 3.78Å; A338-W418 HydrophobicContact CB-CE3 3.74Å; A338-W418 HydrophobicContact CB-CG 4.09Å; A338-W418 HydrophobicContact CB-CZ3 4.29Å; A338-Q419 PolarHBondContact N-O 3.03Å
339	G	83.8	Confident	78.3	Confident	62 Å²	62	61.2 Å²	61.2	64%	0.639	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	-6.8	-175.5	0	0	0	0	0	115.3	L337	L337-G339 PolarHBondContact O-N 2.9Å
340	I	85.1	Confident	76.5	Confident	50 Å²	50	61.7 Å²	61.7	26%	0.256	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	123.5	177.6	-54.3	174.4	0	0	0	109.7	H336 L337 A338 L342 F352	H336-I340 CarbonylContact C-O 3.57Å; H336-I340 VanDerWaalsContact CA-O 3.27Å; H336-I340 WeakPolarHBondContact CA-O 3.17Å; L337-I340 PolarHBondContact N-O 2.92Å; L337-I340 WeakPolarHBondContact O-CB 3.22Å; L337-I340 PolarHBondContact O-N 3.5Å; A338-I340 VanDerWaalsContact C-N 3.28Å; A338-I340 PolarHBondContact O-N 2.84Å; I340-L342 PolarHBondContact O-N 2.77Å; I340-F352 HydrophobicContact CD1-CD1 4.43Å; I340-F352 HydrophobicContact CD1-CE1 4.28Å; I340-F352 HydrophobicContact CG2-CD1 4.23Å; I340-F352 HydrophobicContact CG2-CE1 4.21Å
341	L	87.3	Confident	74.5	Confident	90 Å²	90	64.3 Å²	64.3	47%	0.471	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	120.7	176.5	178.1	64.2	0	0	0	111.7	Q334 T343	Q334-L341 HydrophobicContact CB-CD1 3.85Å; Q334-L341 HydrophobicContact CG-CD1 4.22Å; L341-T343 PolarHBondContact O-N 3.44Å
342	L	86.6	Confident	72.6	Confident	13 Å²	13	69.5 Å²	69.5	7%	0.068	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	113.5	175.6	-60	-175	0	0	0	110.2	W335 L337 I340 K344 Y362 I364 L407	W335-L342 HydrophobicContact CB-CB 4.2Å; W335-L342 HydrophobicContact CB-CD1 4.06Å; W335-L342 HydrophobicContact CB-CG 4.4Å; W335-L342 PolarHBondContact O-N 3.04Å; L337-L342 HydrophobicContact CB-CD1 4.17Å; L337-L342 HydrophobicContact CB-CD2 4.03Å; L337-L342 HydrophobicContact CB-CG 4.18Å; I340-L342 PolarHBondContact O-N 2.77Å; L342-K344 PolarHBondContact O-N 2.89Å; L342-Y362 HydrophobicContact CB-CD2 4.35Å; L342-Y362 HydrophobicContact CB-CE2 3.89Å; L342-Y362 HydrophobicContact CD1-CD2 4.34Å; L342-Y362 HydrophobicContact CD1-CG 4.46Å; L342-Y362 HydrophobicContact CD2-CD1 4.2Å; L342-Y362 HydrophobicContact CD2-CE1 4.04Å; L342-I364 HydrophobicContact CB-CD1 3.89Å; L342-L407 HydrophobicContact CD1-CD1 3.85Å; L342-L407 HydrophobicContact CD1-CD2 3.95Å
343	T	81	Confident	70.5	Confident	77 Å²	77	69.7 Å²	69.7	47%	0.472	40%	0.396	S	S	.	.			trans	-72.8	125.7	-178.6	58.3	0	0	0	0	111.8	L341 N345 Y362	L341-T343 PolarHBondContact O-N 3.44Å; T343-N345 PolarHBondContact O-N 3.03Å; T343-Y362 PolarHBondContact N-OH 2.63Å; T343-Y362 VanDerWaalsContact N-OH 3.09Å; T343-Y362 WeakPolarHBondContact O-CE2 3.37Å; T343-Y362 PolarHBondContact O-OH 2.89Å; T343-Y362 PolarHBondContact OG1-OH 2.04Å; T343-Y362 VanDerWaalsContact OG1-OH 3.1Å
344	K	72.2	Confident	68.5	Low	120 Å²	120	70.8 Å²	70.8	52%	0.522	40%	0.403	S	S	.	.			trans	-74.5	105.3	171.7	-178.4	-173.9	178.5	-170.8	0	109.6	L342 I364 E366	L342-K344 PolarHBondContact O-N 2.89Å; K344-I364 HydrophobicContact CG-CG2 4.27Å; K344-E366 IonicContact NZ-OE1 2.75Å; K344-E366 PolarHBondContact NZ-OE1 3.03Å
345	N	61.2	Low	66.6	Low	91 Å²	91	77.7 Å²	77.7	49%	0.487	43%	0.434	S	S	.	.			trans	-127.4	131.6	175.8	-134.5	-10.1	0	0	0	110	T343 D347 H350	T343-N345 PolarHBondContact O-N 3.03Å; N345-D347 PolarHBondContact O-N 2.69Å; N345-H350 PolarHBondContact ND2-CE1 3.44Å; N345-H350 PolarHBondContact ND2-NE2 3.07Å
346	S	51.7	Low	64.7	Low	98 Å²	98	85.4 Å²	85.4	69%	0.685	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	122	-178.1	47.1	0	0	0	0	111.2	K348	S346-K348 PolarHBondContact O-N 3.14Å
347	D	50.3	Low	63	Low	163 Å²	163	90.3 Å²	90.3	87%	0.872	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	20.8	161.1	-49.4	-43.9	0	0	0	118.6	N345	N345-D347 PolarHBondContact O-N 2.69Å
348	K	45.4	Very low	61.5	Low	167 Å²	167	91.6 Å²	91.6	73%	0.726	51%	0.507	S	S	*	.			trans	-133.5	134.3	167.2	-67.6	-175.7	-178.7	175.7	0	112.5	S346 H350	S346-K348 PolarHBondContact O-N 3.14Å; K348-H350 PolarHBondContact O-CD2 2.95Å; K348-H350 PolarHBondContact O-N 2.85Å
349	S	46	Very low	60.4	Low	80 Å²	80	93.4 Å²	93.4	56%	0.559	51%	0.509	S	S	*	.			trans	-66.6	114	171.8	42.2	0	0	0	0	109.9
350	H	49.2	Very low	59.8	Low	64 Å²	64	90.7 Å²	90.7	30%	0.296	48%	0.48	S	S	.	.			trans	-83.1	159.1	176.3	-86.7	-80.9	0	0	0	112.5	N345 K348 Y362	N345-H350 PolarHBondContact ND2-CE1 3.44Å; N345-H350 PolarHBondContact ND2-NE2 3.07Å; K348-H350 PolarHBondContact O-CD2 2.95Å; K348-H350 PolarHBondContact O-N 2.85Å; H350-Y362 HydrophobicContact CB-CE1 4.17Å
351	S	45.7	Very low	59.5	Low	71 Å²	71	92.3 Å²	92.3	50%	0.497	49%	0.486	S	S	.	.			trans	-135	94.6	-173.7	40.3	0	0	0	0	107.9
352	F	49.3	Very low	59.4	Low	109 Å²	109	88.9 Å²	88.9	48%	0.478	47%	0.467	S	S	.	.			trans	-94.4	121.1	172	-167.9	-97	0	0	0	109.5	I340 D354	I340-F352 HydrophobicContact CD1-CD1 4.43Å; I340-F352 HydrophobicContact CD1-CE1 4.28Å; I340-F352 HydrophobicContact CG2-CD1 4.23Å; I340-F352 HydrophobicContact CG2-CE1 4.21Å; F352-D354 PolarHBondContact O-N 2.69Å
353	S	44.8	Very low	59.3	Low	60 Å²	60	91.2 Å²	91.2	42%	0.42	48%	0.482	S	S	.	.			trans	-71.6	105	167.7	52	0	0	0	0	109.2	N357	S353-N357 VanDerWaalsContact CB-OD1 3.32Å; S353-N357 WeakPolarHBondContact CB-OD1 3.19Å
354	D	48.7	Very low	59.7	Low	33 Å²	33	88.6 Å²	88.6	18%	0.176	47%	0.465	C	S	.	.			trans	-51.9	171.2	155.8	-172.9	12.3	0	0	0	110.4	F352 Q356 N357	F352-D354 PolarHBondContact O-N 2.69Å; D354-Q356 PolarHBondContact O-N 3.06Å; D354-N357 PolarHBondContact O-N 3.16Å
355	H	52.4	Low	60.4	Low	200 Å²	200	89.5 Å²	89.5	93%	0.926	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-13.4	174.6	-70.1	-73.1	0	0	0	114
356	Q	52.1	Low	61.7	Low	163 Å²	163	87.2 Å²	87.2	76%	0.762	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	14	174.3	-58.4	-174	-1.2	0	0	114.8	D354 S358	D354-Q356 PolarHBondContact O-N 3.06Å; Q356-S358 VanDerWaalsContact C-N 3.28Å; Q356-S358 PolarHBondContact O-N 2.82Å
357	N	54.8	Low	63.4	Low	134 Å²	134	87.4 Å²	87.4	72%	0.717	45%	0.445	S	S	*	.			trans	62.8	22	173.2	-146.3	27.3	0	0	0	116.3	S353 D354	S353-N357 VanDerWaalsContact CB-OD1 3.32Å; S353-N357 WeakPolarHBondContact CB-OD1 3.19Å; D354-N357 PolarHBondContact O-N 3.16Å
358	S	56.7	Low	65	Low	29 Å²	29	83.9 Å²	83.9	20%	0.203	43%	0.425	C	S	.	.			trans	-91.2	137.2	-176.5	89.4	0	0	0	0	112.8	Q356 K414	Q356-S358 VanDerWaalsContact C-N 3.28Å; Q356-S358 PolarHBondContact O-N 2.82Å; S358-K414 WeakPolarHBondContact OG-CE 3.21Å; S358-K414 PolarHBondContact OG-NZ 3.44Å
359	L	64.9	Low	66.8	Low	88 Å²	88	79.4 Å²	79.4	46%	0.461	41%	0.409	S	S	.	.			trans	-65	141.9	173.5	-112.4	74.3	0	0	0	112.2	K414	L359-K414 PolarHBondContact O-NZ 2.82Å
360	I	71.3	Confident	68.1	Low	5 Å²	5	79.6 Å²	79.6	3%	0.026	40%	0.404	C	S	.	.			trans	-120.3	107.2	171	-54.7	-178	0	0	0	108.8	L337 Y362 L409 Y415 W418	L337-I360 HydrophobicContact CD2-CD1 4.42Å; L337-I360 HydrophobicContact CD2-CG2 4.1Å; I360-Y362 HydrophobicContact CG2-CD1 4.32Å; I360-Y362 WeakPolarHBondContact O-CD1 3.37Å; I360-Y362 PolarHBondContact O-N 2.88Å; I360-L409 HydrophobicContact CG2-CD1 3.73Å; I360-Y415 HydrophobicContact CD1-CE1 4.32Å; I360-Y415 HydrophobicContact CG1-CE1 4.27Å; I360-W418 HydrophobicContact CD1-CZ3 4.14Å
361	H	77.2	Confident	68.9	Low	84 Å²	84	77.7 Å²	77.7	39%	0.389	40%	0.396	S	S	.	.			trans	-85.2	108.7	179.8	-71.8	-76.7	0	0	0	112.2	T410	H361-T410 PolarHBondContact O-N 3.12Å
362	Y	85.7	Confident	69.5	Low	17 Å²	17	78.3 Å²	78.3	7%	0.067	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	161.3	175.8	73.4	-86	0	0	0	113.4	L342 T343 H350 I360 I364 L407 N408	L342-Y362 HydrophobicContact CB-CD2 4.35Å; L342-Y362 HydrophobicContact CB-CE2 3.89Å; L342-Y362 HydrophobicContact CD1-CD2 4.34Å; L342-Y362 HydrophobicContact CD1-CG 4.46Å; L342-Y362 HydrophobicContact CD2-CD1 4.2Å; L342-Y362 HydrophobicContact CD2-CE1 4.04Å; T343-Y362 PolarHBondContact N-OH 2.63Å; T343-Y362 VanDerWaalsContact N-OH 3.09Å; T343-Y362 WeakPolarHBondContact O-CE2 3.37Å; T343-Y362 PolarHBondContact O-OH 2.89Å; T343-Y362 PolarHBondContact OG1-OH 2.04Å; T343-Y362 VanDerWaalsContact OG1-OH 3.1Å; H350-Y362 HydrophobicContact CB-CE1 4.17Å; I360-Y362 HydrophobicContact CG2-CD1 4.32Å; I360-Y362 WeakPolarHBondContact O-CD1 3.37Å; I360-Y362 PolarHBondContact O-N 2.88Å; Y362-I364 HydrophobicContact CD2-CD1 4.18Å; Y362-I364 HydrophobicContact CD2-CG1 4.13Å; Y362-I364 HydrophobicContact CE2-CD1 3.94Å; Y362-I364 HydrophobicContact CE2-CG1 4.31Å; Y362-L407 HydrophobicContact CD2-CD1 4.08Å; Y362-L407 HydrophobicContact CG-CD1 4.45Å; Y362-N408 CarbonylContact C-O 3.59Å; Y362-N408 WeakPolarHBondContact CA-O 3.32Å; Y362-N408 WeakPolarHBondContact CB-O 3.35Å
363	T	85.8	Confident	69.5	Low	62 Å²	62	77.9 Å²	77.9	38%	0.38	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	135.3	169.5	64.5	0	0	0	0	110.2	N408	T363-N408 PolarHBondContact N-O 3.34Å; T363-N408 PolarHBondContact O-N 2.6Å; T363-N408 WeakPolarHBondContact OG1-CB 3.47Å; T363-N408 PolarHBondContact OG1-ND2 2.85Å
364	I	88.3	Confident	69.5	Low	23 Å²	23	84.8 Å²	84.8	12%	0.118	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.9	175.8	-63.2	163.7	0	0	0	109.1	W335 L342 K344 Y362 Q406 L407	W335-I364 HydrophobicContact CB-CD1 4.43Å; W335-I364 HydrophobicContact CG-CD1 4.48Å; L342-I364 HydrophobicContact CB-CD1 3.89Å; K344-I364 HydrophobicContact CG-CG2 4.27Å; Y362-I364 HydrophobicContact CD2-CD1 4.18Å; Y362-I364 HydrophobicContact CD2-CG1 4.13Å; Y362-I364 HydrophobicContact CE2-CD1 3.94Å; Y362-I364 HydrophobicContact CE2-CG1 4.31Å; I364-Q406 CarbonylContact C-O 3.48Å; I364-Q406 WeakPolarHBondContact CA-O 3.4Å; I364-L407 HydrophobicContact CD1-CD1 4.38Å; I364-L407 HydrophobicContact CG1-CD1 3.66Å
365	K	87.6	Confident	69.2	Low	139 Å²	139	86.3 Å²	86.3	60%	0.604	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.5	139	168.8	-65.4	-175.3	177	-174.5	0	108.5	S405 Q406	K365-S405 CarbonylContact O-C 3.6Å; K365-S405 WeakPolarHBondContact O-CA 3.4Å; K365-Q406 PolarHBondContact N-O 2.88Å; K365-Q406 PolarHBondContact O-N 3.37Å
366	E	87.9	Confident	68.8	Low	42 Å²	42	81.1 Å²	81.1	20%	0.196	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	139.1	179.2	-175	-179.9	60.2	0	0	110.1	I333 K344 T403 Q404	I333-E366 WeakPolarHBondContact CB-OE2 3.49Å; I333-E366 PolarHBondContact N-OE2 3.23Å; K344-E366 IonicContact NZ-OE1 2.75Å; K344-E366 PolarHBondContact NZ-OE1 3.03Å; E366-T403 HydrophobicContact CG-CG2 3.64Å; E366-Q404 CarbonylContact C-O 3.55Å; E366-Q404 VanDerWaalsContact CA-O 3.3Å; E366-Q404 WeakPolarHBondContact CA-O 3.21Å
367	Q	86.6	Confident	67.9	Low	102 Å²	102	80.8 Å²	80.8	48%	0.477	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	143.9	179.2	63.7	-174.4	7.9	0	0	110.3	I369 Q404	Q367-I369 HydrophobicContact CG-CG1 4.45Å; Q367-Q404 HydrophobicContact CG-CB 3.93Å; Q367-Q404 HydrophobicContact CG-CG 4.47Å; Q367-Q404 PolarHBondContact N-O 3.2Å; Q367-Q404 PolarHBondContact O-N 2.85Å
368	I	85.2	Confident	66.8	Low	89 Å²	89	78 Å²	78	46%	0.456	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129.3	175.4	-58	173.3	0	0	0	107.2	A330 Q401 T403	A330-I368 HydrophobicContact CB-CD1 4.02Å; A330-I368 HydrophobicContact CB-CG2 4.1Å; I368-Q401 HydrophobicContact CG2-CB 3.85Å; I368-Q401 HydrophobicContact CG2-CG 4.15Å; I368-T403 HydrophobicContact CG1-CG2 4.41Å
369	I	82	Confident	65.6	Low	74 Å²	74	82.2 Å²	82.2	38%	0.379	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	118.9	-175.4	-54.8	173.2	0	0	0	107.5	Q367 V402	Q367-I369 HydrophobicContact CG-CG1 4.45Å; I369-V402 PolarHBondContact N-O 2.98Å; I369-V402 PolarHBondContact O-N 2.9Å
370	N	74.4	Confident	64	Low	84 Å²	84	84.7 Å²	84.7	45%	0.449	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	127.7	173.1	-64.6	-11.8	0	0	0	109.1	H399 Q401	N370-H399 PolarHBondContact ND2-CD2 3.4Å; N370-Q401 PolarHBondContact OD1-NE2 3.43Å
371	V	66.6	Low	62	Low	23 Å²	23	89.1 Å²	89.1	14%	0.139	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	124	177.2	-173.8	0	0	0	0	108.3	P326 S375 I376 M400 V402	P326-V371 HydrophobicContact CB-CG2 4.43Å; P326-V371 HydrophobicContact CG-CG2 4.3Å; V371-S375 VanDerWaalsContact CG1-OG 3.29Å; V371-S375 WeakPolarHBondContact CG1-OG 3.33Å; V371-I376 HydrophobicContact CG1-CD1 4Å; V371-I376 HydrophobicContact CG1-CG1 4.17Å; V371-M400 PolarHBondContact N-O 3.21Å; V371-V402 HydrophobicContact CG2-CB 4.17Å; V371-V402 HydrophobicContact CG2-CG2 3.56Å
372	S	58	Low	59.6	Low	84 Å²	84	93.9 Å²	93.9	59%	0.587	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-95	144.4	169	57.5	0	0	0	0	110.6	K374 S375	S372-K374 PolarHBondContact O-N 3.31Å; S372-S375 PolarHBondContact O-N 3.15Å; S372-S375 VanDerWaalsContact O-N 3.12Å; S372-S375 PolarHBondContact O-OG 2.75Å
373	D	48.6	Very low	57.1	Low	101 Å²	101	96.4 Å²	96.4	54%	0.54	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-56.8	-18.4	-169	-69.5	-44.3	0	0	0	115.4	S375	D373-S375 PolarHBondContact O-N 3.25Å
374	K	44.4	Very low	54.4	Low	204 Å²	204	96.8 Å²	96.8	89%	0.887	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-69.2	-10.3	178.3	-68.3	-178.6	179	174.1	0	114.4	S372	S372-K374 PolarHBondContact O-N 3.31Å
375	S	43	Very low	51.8	Low	66 Å²	66	100.4 Å²	100.4	46%	0.462	56%	0.555	S	S	.	*	G	3₁₀ helix	trans	-95.4	-13.9	-178.8	60.4	0	0	0	0	115.2	V371 S372 D373	V371-S375 VanDerWaalsContact CG1-OG 3.29Å; V371-S375 WeakPolarHBondContact CG1-OG 3.33Å; S372-S375 PolarHBondContact O-N 3.15Å; S372-S375 VanDerWaalsContact O-N 3.12Å; S372-S375 PolarHBondContact O-OG 2.75Å; D373-S375 PolarHBondContact O-N 3.25Å
376	I	43.9	Very low	49.4	Very low	90 Å²	90	102.1 Å²	102.1	46%	0.462	56%	0.563	S	S	.	*	S	Bend	trans	-93.1	-12.5	-170.4	-59.8	177.6	0	0	0	112.5	V371 M400	V371-I376 HydrophobicContact CG1-CD1 4Å; V371-I376 HydrophobicContact CG1-CG1 4.17Å; I376-M400 HydrophobicContact CD1-CE 3.59Å
377	L	32.4	Very low	46.6	Very low	156 Å²	156	103.3 Å²	103.3	82%	0.817	57%	0.574	S	S	*	*			trans	-105.7	7.2	-172	-113.1	80.7	0	0	0	116.7	S379	L377-S379 PolarHBondContact O-N 2.79Å
378	S	31.9	Very low	43.8	Very low	76 Å²	76	105 Å²	105	53%	0.531	59%	0.586	S	S	.	*			trans	-86.7	85.3	173.5	64.5	0	0	0	0	111.4	N380	S378-N380 PolarHBondContact O-N 2.89Å
379	S	32.6	Very low	41.3	Very low	117 Å²	117	106.6 Å²	106.6	82%	0.818	60%	0.601	S	S	*	*			trans	-75	62.6	173.4	60.5	0	0	0	0	112.5	L377	L377-S379 PolarHBondContact O-N 2.79Å
380	N	31.4	Very low	39	Very low	140 Å²	140	108.2 Å²	108.2	75%	0.749	62%	0.619	S	S	*	*	S	Bend	trans	-128.7	129.7	160.2	-83.2	-21.6	0	0	0	107.1	S378	S378-N380 PolarHBondContact O-N 2.89Å
381	A	28.8	Very low	37.1	Very low	99 Å²	99	110.2 Å²	110.2	82%	0.818	63%	0.634	S	S	*	*	S	Bend	trans	-59	146.1	160.3	0	0	0	0	0	108.4
382	E	26.5	Very low	35.5	Very low	184 Å²	184	116.1 Å²	116.1	86%	0.86	67%	0.67	S	S	*	*			trans	85.6	69.3	-172.8	-50.7	-175.1	165	0	0	117
383	S	33.1	Very low	34.4	Very low	70 Å²	70	116.6 Å²	116.6	49%	0.49	67%	0.673	S	S	.	*			trans	-133.4	116.6	138.6	55.7	0	0	0	0	106.5
384	V	29.4	Very low	33.6	Very low	69 Å²	69	117.4 Å²	117.4	42%	0.418	69%	0.687	S	S	.	*			cis	50.4	124.3	27.4	-149.2	0	0	0	0	111.4
385	L	34.1	Very low	33.2	Very low	99 Å²	99	113 Å²	113	52%	0.518	68%	0.677	S	S	.	*			trans	71.4	153.3	-179.2	-42.5	126.6	0	0	0	110	P387	L385-P387 HydrophobicContact CD2-CG 4.27Å
386	F	37.3	Very low	33	Very low	175 Å²	175	117.5 Å²	117.5	77%	0.768	70%	0.696	S	S	*	*			cis	-127.5	116.4	46.5	-62	-75.9	0	0	0	113.3
387	P	28.5	Very low	33.3	Very low	67 Å²	67	118.8 Å²	118.8	44%	0.435	70%	0.704	S	S	.	*			trans	-77.5	144.4	167.9	32.5	-32.5	0	0	0	111.2	L385	L385-P387 HydrophobicContact CD2-CG 4.27Å
388	N	28	Very low	34.3	Very low	137 Å²	137	113.6 Å²	113.6	73%	0.733	68%	0.679	S	S	*	*			trans	69.3	138.5	152.8	-62.4	-16.3	0	0	0	121.6
389	T	32.7	Very low	35.9	Very low	123 Å²	123	114.7 Å²	114.7	76%	0.755	68%	0.675	S	S	*	*			trans	74	97.6	145.9	41.8	0	0	0	0	120.4
390	S	32.8	Very low	37.9	Very low	108 Å²	108	110.2 Å²	110.2	76%	0.755	64%	0.642	S	S	*	*			trans	45.7	94.1	130.8	62.1	0	0	0	0	118.6
391	V	35.8	Very low	40.4	Very low	127 Å²	127	106.2 Å²	106.2	77%	0.77	62%	0.618	S	S	*	*			trans	-126.4	95.1	151.4	-176.7	0	0	0	0	108.9	S393	V391-S393 PolarHBondContact O-N 2.7Å
392	T	32.2	Very low	43.1	Very low	146 Å²	146	102.7 Å²	102.7	90%	0.896	59%	0.587	S	S	*	*			trans	-77.1	104.2	162.6	45.7	0	0	0	0	108.6
393	S	35.9	Very low	46.1	Very low	94 Å²	94	93.9 Å²	93.9	66%	0.657	55%	0.546	S	S	*	.			trans	-135.3	109.7	166.8	57.9	0	0	0	0	109.7	V391 T395	V391-S393 PolarHBondContact O-N 2.7Å; S393-T395 PolarHBondContact O-N 2.93Å
394	S	30.5	Very low	48.7	Very low	118 Å²	118	92.2 Å²	92.2	83%	0.825	53%	0.53	S	S	*	.			trans	-71.6	112.3	176.3	50.5	0	0	0	0	111.8
395	T	37.6	Very low	51.6	Low	112 Å²	112	88.9 Å²	88.9	69%	0.687	51%	0.51	S	S	*	.			trans	-154.2	127.9	144.8	39.6	0	0	0	0	107	S393 D397	S393-T395 PolarHBondContact O-N 2.93Å; T395-D397 PolarHBondContact O-N 2.83Å
396	D	37.5	Very low	54.3	Low	160 Å²	160	86.7 Å²	86.7	86%	0.856	50%	0.497	S	S	*	.			trans	-69.5	109.1	179.7	-55.8	-75.2	0	0	0	110.3
397	D	50.8	Low	56.9	Low	117 Å²	117	78.4 Å²	78.4	63%	0.626	46%	0.461	S	S	*	.			trans	-150.7	125.9	165.9	-85.7	-51.3	0	0	0	110.5	T395 H399	T395-D397 PolarHBondContact O-N 2.83Å; D397-H399 PolarHBondContact O-CE1 3.13Å; D397-H399 PolarHBondContact O-N 2.98Å; D397-H399 PolarHBondContact O-ND1 2.88Å
398	V	53.5	Low	59.8	Low	48 Å²	48	76.7 Å²	76.7	29%	0.291	45%	0.448	S	S	.	.			trans	17.7	83.2	167.2	-168.3	0	0	0	0	117.5	L147 M400	L147-V398 HydrophobicContact CB-CG1 3.57Å; L147-V398 HydrophobicContact CB-CG2 4.49Å; L147-V398 HydrophobicContact CD1-CG1 3.76Å; L147-V398 HydrophobicContact CD2-CG1 4.22Å; L147-V398 HydrophobicContact CG-CG1 4.05Å; V398-M400 PolarHBondContact O-N 2.78Å
399	H	64.9	Low	62.7	Low	99 Å²	99	70.2 Å²	70.2	46%	0.458	41%	0.413	S	S	.	.			trans	-83.4	102.3	177.5	-69.5	19.5	0	0	0	113.2	N370 D397	N370-H399 PolarHBondContact ND2-CD2 3.4Å; D397-H399 PolarHBondContact O-CE1 3.13Å; D397-H399 PolarHBondContact O-N 2.98Å; D397-H399 PolarHBondContact O-ND1 2.88Å
400	M	75.7	Confident	65.4	Low	23 Å²	23	66.2 Å²	66.2	11%	0.113	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	148	159.7	-71.6	-175.2	-79.7	0	0	110.7	L147 P326 V371 I376 V398	L147-M400 HydrophobicContact CD1-CE 4.45Å; L147-M400 HydrophobicContact CD1-CG 4.28Å; L147-M400 HydrophobicContact CD1-SD 4.17Å; P326-M400 HydrophobicContact CB-CB 3.99Å; P326-M400 HydrophobicContact CB-SD 4.04Å; V371-M400 PolarHBondContact N-O 3.21Å; I376-M400 HydrophobicContact CD1-CE 3.59Å; V398-M400 PolarHBondContact O-N 2.78Å
401	Q	83.6	Confident	68	Low	55 Å²	55	61 Å²	61	26%	0.257	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	133.8	-173.7	-65.5	-175.9	-47.7	0	0	112.3	S327 A330 I368 N370	S327-Q401 PolarHBondContact N-O 2.95Å; S327-Q401 PolarHBondContact O-N 3.06Å; S327-Q401 PolarHBondContact OG-O 2.82Å; A330-Q401 HydrophobicContact CB-CB 4.01Å; A330-Q401 VanDerWaalsContact CB-OE1 3.29Å; I368-Q401 HydrophobicContact CG2-CB 3.85Å; I368-Q401 HydrophobicContact CG2-CG 4.15Å; N370-Q401 PolarHBondContact OD1-NE2 3.43Å
402	V	84.7	Confident	70.5	Confident	25 Å²	25	57.7 Å²	57.7	15%	0.152	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	125.6	172	162.6	0	0	0	0	108.3	T324 P326 I369 V371	T324-V402 WeakPolarHBondContact O-CG1 3.28Å; P326-V402 HydrophobicContact CB-CG2 4.28Å; P326-V402 HydrophobicContact CG-CG2 3.89Å; I369-V402 PolarHBondContact N-O 2.98Å; I369-V402 PolarHBondContact O-N 2.9Å; V371-V402 HydrophobicContact CG2-CB 4.17Å; V371-V402 HydrophobicContact CG2-CG2 3.56Å
403	T	88.8	Confident	73.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	131.7	175.2	-59	0	0	0	0	109.5	H323 T324 S331 I333 E366 I368	H323-T403 CarbonylContact C-O 3.55Å; H323-T403 WeakPolarHBondContact CA-O 3.39Å; T324-T403 PolarHBondContact N-O 2.9Å; T324-T403 PolarHBondContact OG1-N 2.7Å; S331-T403 WeakPolarHBondContact O-CB 3.36Å; S331-T403 WeakPolarHBondContact O-CG2 3.4Å; S331-T403 PolarHBondContact O-OG1 3.19Å; I333-T403 HydrophobicContact CD1-CG2 4.04Å; I333-T403 HydrophobicContact CG1-CG2 4.16Å; E366-T403 HydrophobicContact CG-CG2 3.64Å; I368-T403 HydrophobicContact CG1-CG2 4.41Å
404	Q	88.6	Confident	75.5	Confident	34 Å²	34	53.5 Å²	53.5	16%	0.159	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	124.7	173.5	175.8	-178.7	-2.8	0	0	109.2	S321 C322 H323 E366 Q367	S321-Q404 WeakPolarHBondContact OG-CG 3.07Å; S321-Q404 PolarHBondContact OG-NE2 3.45Å; C322-Q404 CarbonylContact O-C 3.42Å; C322-Q404 WeakPolarHBondContact O-CA 3.35Å; H323-Q404 VanDerWaalsContact CE1-CG 3.46Å; H323-Q404 WeakPolarHBondContact CE1-CG 3.39Å; H323-Q404 PolarHBondContact CE1-NE2 2.93Å; H323-Q404 VanDerWaalsContact CE1-NE2 3.33Å; H323-Q404 PolarHBondContact CE1-OE1 3.33Å; E366-Q404 CarbonylContact C-O 3.55Å; E366-Q404 VanDerWaalsContact CA-O 3.3Å; E366-Q404 WeakPolarHBondContact CA-O 3.21Å; Q367-Q404 HydrophobicContact CG-CB 3.93Å; Q367-Q404 HydrophobicContact CG-CG 4.47Å; Q367-Q404 PolarHBondContact N-O 3.2Å; Q367-Q404 PolarHBondContact O-N 2.85Å
405	S	91	Very high	78.2	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	125	177.6	-170.7	0	0	0	0	109.6	S321 C322 W335 K365	S321-S405 CarbonylContact C-O 3.45Å; S321-S405 WeakPolarHBondContact CA-O 3.45Å; C322-S405 PolarHBondContact N-O 2.98Å; C322-S405 PolarHBondContact O-N 2.77Å; W335-S405 WeakPolarHBondContact CZ2-O 3.41Å; W335-S405 PolarHBondContact NE1-OG 2.8Å; K365-S405 CarbonylContact O-C 3.6Å; K365-S405 WeakPolarHBondContact O-CA 3.4Å
406	Q	90.9	Very high	80.6	Confident	53 Å²	53	45.3 Å²	45.3	25%	0.248	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	121.4	178.3	-178.7	-175.2	-28.2	0	0	110.2	I319 V320 I364 K365 N408	I319-Q406 HydrophobicContact CG2-CG 3.99Å; I319-Q406 VanDerWaalsContact CG2-NE2 3.29Å; V320-Q406 CarbonylContact O-C 3.59Å; V320-Q406 VanDerWaalsContact O-CA 3.31Å; V320-Q406 WeakPolarHBondContact O-CA 3.4Å; I364-Q406 CarbonylContact C-O 3.48Å; I364-Q406 WeakPolarHBondContact CA-O 3.4Å; K365-Q406 PolarHBondContact N-O 2.88Å; K365-Q406 PolarHBondContact O-N 3.37Å; Q406-N408 PolarHBondContact NE2-OD1 2.89Å
407	L	90.7	Very high	83	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	126.8	170.3	175.9	67.7	0	0	0	109.7	V320 W335 L342 Y362 I364 L409 L420	V320-L407 PolarHBondContact N-O 3.03Å; V320-L407 PolarHBondContact O-N 2.64Å; W335-L407 HydrophobicContact CD2-CB 3.95Å; W335-L407 HydrophobicContact CD2-CD2 4.03Å; W335-L407 HydrophobicContact CE3-CB 4.32Å; W335-L407 HydrophobicContact CE3-CD2 3.87Å; W335-L407 HydrophobicContact CG-CB 4.44Å; W335-L407 HydrophobicContact CG-CD2 4.39Å; W335-L407 HydrophobicContact CH2-CB 4.19Å; W335-L407 HydrophobicContact CZ2-CB 3.84Å; W335-L407 HydrophobicContact CZ3-CB 4.42Å; W335-L407 HydrophobicContact CZ3-CD2 4.3Å; L342-L407 HydrophobicContact CD1-CD1 3.85Å; L342-L407 HydrophobicContact CD1-CD2 3.95Å; Y362-L407 HydrophobicContact CD2-CD1 4.08Å; Y362-L407 HydrophobicContact CG-CD1 4.45Å; I364-L407 HydrophobicContact CD1-CD1 4.38Å; I364-L407 HydrophobicContact CG1-CD1 3.66Å; L407-L409 HydrophobicContact CG-CB 4.47Å; L407-L420 HydrophobicContact CD2-CD1 3.46Å; L407-L420 VanDerWaalsContact CD2-CD1 3.46Å; L407-L420 HydrophobicContact CD2-CD2 4.12Å; L407-L420 HydrophobicContact CD2-CG 4.41Å
408	N	89.8	Confident	84.9	Confident	31 Å²	31	39.8 Å²	39.8	17%	0.166	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	124.7	162.2	-46.2	-43.5	0	0	0	107.9	L318 I319 Y362 T363 Q406	L318-N408 CarbonylContact O-C 3.54Å; L318-N408 WeakPolarHBondContact O-CA 3.49Å; I319-N408 WeakPolarHBondContact CG2-OD1 3.36Å; Y362-N408 CarbonylContact C-O 3.59Å; Y362-N408 WeakPolarHBondContact CA-O 3.32Å; Y362-N408 WeakPolarHBondContact CB-O 3.35Å; T363-N408 PolarHBondContact N-O 3.34Å; T363-N408 PolarHBondContact O-N 2.6Å; T363-N408 WeakPolarHBondContact OG1-CB 3.47Å; T363-N408 PolarHBondContact OG1-ND2 2.85Å; Q406-N408 PolarHBondContact NE2-OD1 2.89Å
409	L	88.9	Confident	86.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	129.3	180	175.6	64.9	0	0	0	109.3	K317 L318 L337 I360 L407 V411 I442	K317-L409 CarbonylContact C-O 3.59Å; L318-L409 PolarHBondContact N-O 3.29Å; L318-L409 PolarHBondContact O-N 2.93Å; L337-L409 HydrophobicContact CD1-CD2 4.19Å; L337-L409 HydrophobicContact CD2-CD1 4.19Å; L337-L409 HydrophobicContact CD2-CD2 4.04Å; I360-L409 HydrophobicContact CG2-CD1 3.73Å; L407-L409 HydrophobicContact CG-CB 4.47Å; L409-V411 HydrophobicContact CD2-CG2 4.42Å; L409-V411 HydrophobicContact CG-CG2 4.38Å; L409-V411 PolarHBondContact O-N 3.36Å; L409-I442 HydrophobicContact CD2-CD1 3.78Å
410	T	88.9	Confident	87.9	Confident	39 Å²	39	37.1 Å²	37.1	24%	0.239	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	117.7	171.6	-50.7	0	0	0	0	108.3	H361 Y415	H361-T410 PolarHBondContact O-N 3.12Å; T410-Y415 WeakPolarHBondContact O-CE2 3.21Å
411	V	87.6	Confident	88.6	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.178	C	C	.	.			trans	-89.9	130	-170.8	172.8	0	0	0	0	111.9	T312 K315 K316 L318 L409 Y415 I442 P444	T312-V411 HydrophobicContact CG2-CB 3.92Å; T312-V411 HydrophobicContact CG2-CG1 3.86Å; T312-V411 HydrophobicContact CG2-CG2 3.8Å; K315-V411 WeakPolarHBondContact CA-O 3.22Å; K315-V411 PolarHBondContact N-O 3.08Å; K316-V411 PolarHBondContact O-N 2.89Å; K316-V411 VanDerWaalsContact O-N 3.07Å; L318-V411 HydrophobicContact CB-CG2 3.53Å; L318-V411 HydrophobicContact CD2-CG2 3.89Å; L318-V411 HydrophobicContact CG-CG2 4.35Å; L409-V411 HydrophobicContact CD2-CG2 4.42Å; L409-V411 HydrophobicContact CG-CG2 4.38Å; L409-V411 PolarHBondContact O-N 3.36Å; V411-Y415 HydrophobicContact CG1-CD2 4.34Å; V411-I442 HydrophobicContact CG1-CG2 3.84Å; V411-I442 HydrophobicContact CG2-CG2 4.27Å; V411-P444 HydrophobicContact CG1-CB 4.09Å; V411-P444 HydrophobicContact CG1-CG 3.81Å
412	E	87.8	Confident	89	Confident	56 Å²	56	35.8 Å²	35.8	26%	0.262	17%	0.166	S	C	.	.			trans	-117.2	156.9	177	-68	169.6	-118.6	0	0	110.5	K414 Y415 P444	E412-K414 HydrophobicContact CB-CD 4.39Å; E412-K414 HydrophobicContact CB-CG 4.11Å; E412-K414 PolarHBondContact O-N 2.8Å; E412-K414 VanDerWaalsContact O-N 3.1Å; E412-K414 IonicContact OE1-NZ 3.64Å; E412-K414 PolarHBondContact OE1-NZ 2.92Å; E412-K414 WeakPolarHBondContact OE2-CD 3.39Å; E412-K414 WeakPolarHBondContact OE2-CE 3.46Å; E412-K414 IonicContact OE2-NZ 2.93Å; E412-K414 PolarHBondContact OE2-NZ 2.94Å; E412-Y415 HydrophobicContact CB-CD2 4.06Å; E412-Y415 HydrophobicContact CB-CE2 3.74Å; E412-Y415 HydrophobicContact CG-CE2 4.08Å; E412-Y415 VanDerWaalsContact N-CE2 3.31Å; E412-Y415 PolarHBondContact O-N 2.9Å; E412-Y415 PolarHBondContact OE1-OH 2.91Å; E412-P444 WeakPolarHBondContact O-CG 3.33Å
413	R	86.8	Confident	89.3	Confident	88 Å²	88	34.9 Å²	34.9	33%	0.332	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-54.7	-29.6	178.3	-169.7	177.6	-176.6	177.9	9.5	113.8	E314 Y415 Q416 Y446 E448	E314-R413 HydrophobicContact CG-CB 4.49Å; R413-Y415 PolarHBondContact O-N 2.86Å; R413-Q416 WeakPolarHBondContact O-CB 3.41Å; R413-Q416 PolarHBondContact O-N 2.93Å; R413-Y446 HydrophobicContact CG-CD1 4.22Å; R413-Y446 HydrophobicContact CG-CE1 3.76Å; R413-Y446 VanDerWaalsContact CZ-CE2 3.49Å; R413-Y446 PolarHBondContact NE-OH 3.02Å; R413-Y446 VanDerWaalsContact NE-OH 3.15Å; R413-Y446 VanDerWaalsContact NH2-CE2 3.25Å; R413-Y446 PolarHBondContact NH2-OH 2.78Å; R413-E448 IonicContact CZ-OE2 3.38Å; R413-E448 VanDerWaalsContact CZ-OE2 3.26Å; R413-E448 IonicContact NH1-OE1 3.65Å; R413-E448 PolarHBondContact NH1-OE1 2.88Å; R413-E448 IonicContact NH1-OE2 3.41Å; R413-E448 PolarHBondContact NH1-OE2 3.24Å; R413-E448 IonicContact NH2-OE2 2.75Å; R413-E448 PolarHBondContact NH2-OE2 3.15Å
414	K	85.9	Confident	89.2	Confident	65 Å²	65	35.4 Å²	35.4	28%	0.283	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-63.4	-21	177.1	76.3	-164.8	-178	-158.6	0	113.9	S358 L359 E412 Q416 W418	S358-K414 WeakPolarHBondContact OG-CE 3.21Å; S358-K414 PolarHBondContact OG-NZ 3.44Å; L359-K414 PolarHBondContact O-NZ 2.82Å; E412-K414 HydrophobicContact CB-CD 4.39Å; E412-K414 HydrophobicContact CB-CG 4.11Å; E412-K414 PolarHBondContact O-N 2.8Å; E412-K414 VanDerWaalsContact O-N 3.1Å; E412-K414 IonicContact OE1-NZ 3.64Å; E412-K414 PolarHBondContact OE1-NZ 2.92Å; E412-K414 WeakPolarHBondContact OE2-CD 3.39Å; E412-K414 WeakPolarHBondContact OE2-CE 3.46Å; E412-K414 IonicContact OE2-NZ 2.93Å; E412-K414 PolarHBondContact OE2-NZ 2.94Å; K414-Q416 VanDerWaalsContact C-N 3.27Å; K414-Q416 PolarHBondContact O-N 2.85Å; K414-W418 PolarHBondContact O-NE1 2.92Å
415	Y	87.7	Confident	89.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-85.7	9.1	177.2	-47.9	-42.4	0	0	0	113.6	I360 T410 V411 E412 R413 H417 W418	I360-Y415 HydrophobicContact CD1-CE1 4.32Å; I360-Y415 HydrophobicContact CG1-CE1 4.27Å; T410-Y415 WeakPolarHBondContact O-CE2 3.21Å; V411-Y415 HydrophobicContact CG1-CD2 4.34Å; E412-Y415 HydrophobicContact CB-CD2 4.06Å; E412-Y415 HydrophobicContact CB-CE2 3.74Å; E412-Y415 HydrophobicContact CG-CE2 4.08Å; E412-Y415 VanDerWaalsContact N-CE2 3.31Å; E412-Y415 PolarHBondContact O-N 2.9Å; E412-Y415 PolarHBondContact OE1-OH 2.91Å; R413-Y415 PolarHBondContact O-N 2.86Å; Y415-H417 PolarHBondContact O-N 3.26Å; Y415-W418 AromaticContact CD1-CD2 3.79Å; Y415-W418 HydrophobicContact CD1-CD2 3.79Å; Y415-W418 AromaticContact CD1-CE3 3.35Å; Y415-W418 HydrophobicContact CD1-CE3 3.35Å; Y415-W418 AromaticContact CD1-CH2 3.81Å; Y415-W418 HydrophobicContact CD1-CH2 3.81Å; Y415-W418 HydrophobicContact CD1-CZ2 4.17Å; Y415-W418 AromaticContact CD1-CZ3 3.38Å; Y415-W418 HydrophobicContact CD1-CZ3 3.38Å; Y415-W418 HydrophobicContact CE1-CE3 4.03Å; Y415-W418 AromaticContact CE1-CH2 3.95Å; Y415-W418 HydrophobicContact CE1-CH2 3.95Å; Y415-W418 AromaticContact CE1-CZ3 3.59Å; Y415-W418 HydrophobicContact CE1-CZ3 3.59Å; Y415-W418 HydrophobicContact CG-CD2 4.45Å; Y415-W418 HydrophobicContact CG-CE3 4.18Å; Y415-W418 VanDerWaalsContact O-CB 3.29Å; Y415-W418 WeakPolarHBondContact O-CB 3.21Å; Y415-W418 PolarHBondContact O-N 2.89Å
416	Q	87.7	Confident	88.9	Confident	57 Å²	57	37 Å²	37	27%	0.266	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	129	177.4	-168.4	175.5	-8.4	0	0	110.5	R413 K414 W418 P444	R413-Q416 WeakPolarHBondContact O-CB 3.41Å; R413-Q416 PolarHBondContact O-N 2.93Å; K414-Q416 VanDerWaalsContact C-N 3.27Å; K414-Q416 PolarHBondContact O-N 2.85Å; Q416-W418 PolarHBondContact O-N 2.77Å; Q416-P444 HydrophobicContact CB-CG 4.27Å
417	H	88.6	Confident	88.4	Confident	116 Å²	116	36.6 Å²	36.6	54%	0.537	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	7.8	-170.9	-44.7	109.4	0	0	0	116	Y415 T441 I442 E443	Y415-H417 PolarHBondContact O-N 3.26Å; H417-T441 HydrophobicContact CB-CG2 4.42Å; H417-I442 PolarHBondContact N-O 3.26Å; H417-E443 IonicContact CD2-OE1 3.52Å; H417-E443 PolarHBondContact CD2-OE1 3.03Å; H417-E443 IonicContact CD2-OE2 3.72Å; H417-E443 IonicContact NE2-OE1 3.75Å
418	W	91.4	Very high	87.9	Confident	46 Å²	46	43.3 Å²	43.3	17%	0.174	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-71.4	137.9	175.2	-75	26.3	0	0	0	110.7	L337 A338 I360 K414 Y415 Q416 I442	L337-W418 HydrophobicContact CD1-CE3 4.12Å; L337-W418 HydrophobicContact CD2-CE3 4.18Å; L337-W418 HydrophobicContact CD2-CZ3 4.24Å; L337-W418 HydrophobicContact CG-CE3 3.83Å; L337-W418 HydrophobicContact CG-CZ3 4.22Å; A338-W418 HydrophobicContact CB-CB 4.38Å; A338-W418 HydrophobicContact CB-CD2 3.78Å; A338-W418 HydrophobicContact CB-CE3 3.74Å; A338-W418 HydrophobicContact CB-CG 4.09Å; A338-W418 HydrophobicContact CB-CZ3 4.29Å; I360-W418 HydrophobicContact CD1-CZ3 4.14Å; K414-W418 PolarHBondContact O-NE1 2.92Å; Y415-W418 AromaticContact CD1-CD2 3.79Å; Y415-W418 HydrophobicContact CD1-CD2 3.79Å; Y415-W418 AromaticContact CD1-CE3 3.35Å; Y415-W418 HydrophobicContact CD1-CE3 3.35Å; Y415-W418 AromaticContact CD1-CH2 3.81Å; Y415-W418 HydrophobicContact CD1-CH2 3.81Å; Y415-W418 HydrophobicContact CD1-CZ2 4.17Å; Y415-W418 AromaticContact CD1-CZ3 3.38Å; Y415-W418 HydrophobicContact CD1-CZ3 3.38Å; Y415-W418 HydrophobicContact CE1-CE3 4.03Å; Y415-W418 AromaticContact CE1-CH2 3.95Å; Y415-W418 HydrophobicContact CE1-CH2 3.95Å; Y415-W418 AromaticContact CE1-CZ3 3.59Å; Y415-W418 HydrophobicContact CE1-CZ3 3.59Å; Y415-W418 HydrophobicContact CG-CD2 4.45Å; Y415-W418 HydrophobicContact CG-CE3 4.18Å; Y415-W418 VanDerWaalsContact O-CB 3.29Å; Y415-W418 WeakPolarHBondContact O-CB 3.21Å; Y415-W418 PolarHBondContact O-N 2.89Å; Q416-W418 PolarHBondContact O-N 2.77Å; W418-I442 PolarHBondContact O-N 3.41Å
419	Q	89.7	Confident	87.4	Confident	91 Å²	91	45.7 Å²	45.7	43%	0.425	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	127.2	177.5	-66.6	-179.4	-11.7	0	0	110.5	A338 V440	A338-Q419 PolarHBondContact N-O 3.03Å; Q419-V440 CarbonylContact C-O 3.59Å; Q419-V440 WeakPolarHBondContact CA-O 3.23Å
420	L	90.7	Very high	86.9	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	124.2	168.4	176.8	69.4	0	0	0	108.3	V320 W335 H336 L337 L407 T439 V440 I442	V320-L420 HydrophobicContact CG2-CD2 4.05Å; W335-L420 HydrophobicContact CE3-CD1 3.81Å; W335-L420 HydrophobicContact CE3-CD2 4.37Å; W335-L420 HydrophobicContact CE3-CG 4.06Å; W335-L420 HydrophobicContact CZ3-CD1 4.23Å; W335-L420 HydrophobicContact CZ3-CD2 3.94Å; W335-L420 HydrophobicContact CZ3-CG 4.01Å; H336-L420 WeakPolarHBondContact O-CA 3.42Å; L337-L420 HydrophobicContact CD1-CB 4.49Å; L337-L420 HydrophobicContact CD1-CD1 4.33Å; L407-L420 HydrophobicContact CD2-CD1 3.46Å; L407-L420 VanDerWaalsContact CD2-CD1 3.46Å; L407-L420 HydrophobicContact CD2-CD2 4.12Å; L407-L420 HydrophobicContact CD2-CG 4.41Å; L420-T439 CarbonylContact O-C 3.57Å; L420-T439 WeakPolarHBondContact O-CA 3.39Å; L420-V440 HydrophobicContact CB-CG2 3.83Å; L420-V440 HydrophobicContact CD2-CG2 4.18Å; L420-V440 HydrophobicContact CG-CG2 4.33Å; L420-V440 PolarHBondContact N-O 3.16Å; L420-V440 PolarHBondContact O-N 3.43Å; L420-I442 HydrophobicContact CB-CD1 4.26Å; L420-I442 HydrophobicContact CB-CG1 4.37Å
421	E	91.1	Very high	86	Confident	49 Å²	49	48.4 Å²	48.4	23%	0.229	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	136.2	-178	-173.5	-175.6	163.5	0	0	111	W335 H336 V438 T439	W335-E421 CarbonylContact C-O 3.08Å; W335-E421 VanDerWaalsContact CA-O 3.3Å; W335-E421 WeakPolarHBondContact CA-O 3.38Å; H336-E421 HydrophobicContact CB-CB 4.13Å; H336-E421 PolarHBondContact N-O 3.15Å; H336-E421 IonicContact ND1-OE2 2.7Å; H336-E421 PolarHBondContact O-N 2.82Å; E421-V438 CarbonylContact C-O 3.57Å; E421-V438 VanDerWaalsContact CA-O 3.31Å; E421-V438 WeakPolarHBondContact CA-O 3.34Å; E421-T439 HydrophobicContact CB-CG2 4.05Å; E421-T439 HydrophobicContact CG-CG2 3.78Å
422	C	91	Very high	84.8	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	128.7	162.3	173.7	0	0	0	0	108.9	L190 M192 C322 I333 W335 V438	L190-C422 WeakPolarHBondContact CD1-O 3.2Å; M192-C422 HydrophobicContact CE-CB 3.53Å; C322-C422 HydrophobicContact CB-CB 3.8Å; C322-C422 WeakPolarHBondContact CB-SG 3.49Å; C322-C422 WeakPolarHBondContact SG-CB 3.34Å; C322-C422 CovalentContact SG-SG 2.03Å; C322-C422 PolarHBondContact SG-SG 3.29Å; I333-C422 WeakPolarHBondContact CG2-SG 3.32Å; W335-C422 HydrophobicContact CE3-CB 4.19Å; W335-C422 HydrophobicContact CH2-CB 4.39Å; W335-C422 HydrophobicContact CZ3-CB 4.08Å; C422-V438 PolarHBondContact N-O 3.21Å; C422-V438 PolarHBondContact O-N 2.96Å
423	S	90.8	Very high	83.6	Confident	6 Å²	6	55.5 Å²	55.5	4%	0.042	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	159.5	179	63.5	0	0	0	0	111.6	Q334 H336	Q334-S423 WeakPolarHBondContact CG-OG 3.38Å; Q334-S423 PolarHBondContact N-O 3.3Å; Q334-S423 PolarHBondContact NE2-OG 2.87Å; Q334-S423 VanDerWaalsContact NE2-OG 3.12Å; Q334-S423 PolarHBondContact O-N 2.89Å; H336-S423 PolarHBondContact CE1-OG 3.36Å; H336-S423 VanDerWaalsContact CE1-OG 3.32Å
424	V	88.6	Confident	82.7	Confident	11 Å²	11	61.4 Å²	61.4	7%	0.067	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	124.5	174.3	-176.8	0	0	0	0	109.7	P187 L190 N426 F430 L435	P187-V424 HydrophobicContact CG-CG2 4.12Å; L190-V424 HydrophobicContact CD1-CG2 4.26Å; L190-V424 HydrophobicContact CD2-CG2 4.09Å; L190-V424 HydrophobicContact CG-CG2 4.38Å; V424-N426 WeakPolarHBondContact CG1-OD1 3.49Å; V424-F430 HydrophobicContact CG1-CE2 4.17Å; V424-L435 HydrophobicContact CB-CD1 3.71Å; V424-L435 HydrophobicContact CG1-CD1 3.66Å; V424-L435 HydrophobicContact CG2-CD1 4.38Å
425	S	87.1	Confident	82.1	Confident	44 Å²	44	59.7 Å²	59.7	31%	0.308	31%	0.31	S	S	.	.	S	Bend	trans	-85.4	-33.4	-175.4	58.9	0	0	0	0	114.1	T332 S427	T332-S425 VanDerWaalsContact CB-OG 3.32Å; T332-S425 WeakPolarHBondContact CB-OG 3.33Å; T332-S425 WeakPolarHBondContact CG2-OG 3.45Å; T332-S425 PolarHBondContact O-N 3.14Å; T332-S425 PolarHBondContact O-OG 2.97Å; S425-S427 PolarHBondContact O-N 3.16Å; S425-S427 VanDerWaalsContact O-N 3.11Å
426	N	86.3	Confident	81.3	Confident	23 Å²	23	61.3 Å²	61.3	12%	0.123	32%	0.321	C	S	.	.			trans	-87.9	43.1	-178.7	69.5	-44.2	0	0	0	113.3	A330 S331 T332 V424 N428 D429 F430	A330-N426 PolarHBondContact O-ND2 2.94Å; S331-N426 WeakPolarHBondContact CA-OD1 3.39Å; T332-N426 PolarHBondContact N-OD1 2.88Å; V424-N426 WeakPolarHBondContact CG1-OD1 3.49Å; N426-N428 PolarHBondContact O-N 2.85Å; N426-D429 WeakPolarHBondContact CB-OD2 3.31Å; N426-D429 PolarHBondContact ND2-OD2 3.23Å; N426-D429 WeakPolarHBondContact O-CB 3.46Å; N426-D429 PolarHBondContact O-N 3.13Å; N426-D429 VanDerWaalsContact O-N 3.13Å; N426-F430 VanDerWaalsContact O-CD2 3.25Å; N426-F430 WeakPolarHBondContact O-CD2 3.48Å
427	S	80.1	Confident	81	Confident	46 Å²	46	62.6 Å²	62.6	32%	0.322	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-59.3	-27.8	-178.9	57.8	0	0	0	0	114.4	S425 D429 F430	S425-S427 PolarHBondContact O-N 3.16Å; S425-S427 VanDerWaalsContact O-N 3.11Å; S427-D429 VanDerWaalsContact C-N 3.28Å; S427-D429 PolarHBondContact O-N 3.07Å; S427-F430 PolarHBondContact O-N 2.83Å
428	N	79.8	Confident	80.8	Confident	141 Å²	141	57.7 Å²	57.7	75%	0.754	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-64.3	-31.6	177.5	-66.1	-21	0	0	0	112.7	N426 F430	N426-N428 PolarHBondContact O-N 2.85Å; N428-F430 PolarHBondContact O-N 3.15Å
429	D	79.7	Confident	80.6	Confident	81 Å²	81	57.7 Å²	57.7	43%	0.433	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-68.5	-18.5	178.9	-58.4	-10.7	0	0	0	111.9	I184 P329 N426 S427	I184-D429 VanDerWaalsContact CD1-O 3.25Å; I184-D429 WeakPolarHBondContact CD1-O 3.35Å; P329-D429 HydrophobicContact CG-CB 3.92Å; N426-D429 WeakPolarHBondContact CB-OD2 3.31Å; N426-D429 PolarHBondContact ND2-OD2 3.23Å; N426-D429 WeakPolarHBondContact O-CB 3.46Å; N426-D429 PolarHBondContact O-N 3.13Å; N426-D429 VanDerWaalsContact O-N 3.13Å; S427-D429 VanDerWaalsContact C-N 3.28Å; S427-D429 PolarHBondContact O-N 3.07Å
430	F	78.2	Confident	80.5	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-101.4	17.5	-174.1	-62.9	-68.8	0	0	0	114.1	I184 P186 P329 V424 N426 S427 N428 L435	I184-F430 HydrophobicContact CG2-CD1 3.71Å; I184-F430 HydrophobicContact CG2-CE1 4.48Å; P186-F430 VanDerWaalsContact CA-CD1 3.46Å; P186-F430 HydrophobicContact CB-CB 4.15Å; P186-F430 HydrophobicContact CB-CD1 3.79Å; P186-F430 HydrophobicContact CB-CG 4.14Å; P329-F430 HydrophobicContact CG-CE1 4.37Å; P329-F430 HydrophobicContact CG-CZ 4.45Å; P329-F430 VanDerWaalsContact O-CZ 3.3Å; P329-F430 WeakPolarHBondContact O-CZ 3.34Å; V424-F430 HydrophobicContact CG1-CE2 4.17Å; N426-F430 VanDerWaalsContact O-CD2 3.25Å; N426-F430 WeakPolarHBondContact O-CD2 3.48Å; S427-F430 PolarHBondContact O-N 2.83Å; N428-F430 PolarHBondContact O-N 3.15Å; F430-L435 HydrophobicContact CB-CD2 4.45Å; F430-L435 HydrophobicContact CD2-CD1 3.77Å; F430-L435 HydrophobicContact CE2-CD1 4.36Å; F430-L435 HydrophobicContact CG-CD1 4.47Å
431	V	69.6	Low	80.4	Confident	97 Å²	97	54 Å²	54	59%	0.588	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	65.2	176.8	-169.8	0	0	0	0	112.4	I184 A433	I184-V431 HydrophobicContact CD1-CG2 3.68Å; V431-A433 PolarHBondContact O-N 2.86Å
432	L	63.3	Low	80.3	Confident	168 Å²	168	51.7 Å²	51.7	88%	0.88	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	18.1	170.3	-83.7	150.6	0	0	0	115.9
433	A	61.8	Low	80.3	Confident	36 Å²	36	51.9 Å²	51.9	30%	0.298	29%	0.29	S	S	.	.			trans	-62.7	135.7	170.8	0	0	0	0	0	110.9	V431 L435	V431-A433 PolarHBondContact O-N 2.86Å; A433-L435 HydrophobicContact CB-CD2 4.2Å; A433-L435 PolarHBondContact O-N 3.1Å
434	K	67.2	Low	80.3	Confident	213 Å²	213	51.6 Å²	51.6	93%	0.926	29%	0.288	S	S	*	.			trans	-72.1	97.8	170.9	-176	-178.1	178.6	-178.1	0	108.8
435	L	73.1	Confident	80.3	Confident	28 Å²	28	51.4 Å²	51.4	15%	0.147	29%	0.286	C	S	.	.			trans	-75.8	153.2	-177.8	-63.6	-174.8	0	0	0	112.7	P186 P187 V424 F430 A433	P186-L435 HydrophobicContact CB-CD2 4.06Å; P187-L435 HydrophobicContact CG-CD2 4.21Å; V424-L435 HydrophobicContact CB-CD1 3.71Å; V424-L435 HydrophobicContact CG1-CD1 3.66Å; V424-L435 HydrophobicContact CG2-CD1 4.38Å; F430-L435 HydrophobicContact CB-CD2 4.45Å; F430-L435 HydrophobicContact CD2-CD1 3.77Å; F430-L435 HydrophobicContact CE2-CD1 4.36Å; F430-L435 HydrophobicContact CG-CD1 4.47Å; A433-L435 HydrophobicContact CB-CD2 4.2Å; A433-L435 PolarHBondContact O-N 3.1Å
436	P	71.8	Confident	80.5	Confident	35 Å²	35	50.7 Å²	50.7	23%	0.227	28%	0.277	C	S	.	.			trans	-65.8	146.5	176.6	25.7	-34.6	0	0	0	112.6	L190	L190-P436 VanDerWaalsContact CD1-O 3.24Å; L190-P436 WeakPolarHBondContact CD1-O 3.43Å; L190-P436 HydrophobicContact CG-CB 4.44Å; L190-P436 HydrophobicContact CG-CG 4.15Å
437	T	81.6	Confident	80.8	Confident	84 Å²	84	50.9 Å²	50.9	52%	0.515	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	142.3	169.5	57.6	0	0	0	0	109.2
438	V	83.7	Confident	81.2	Confident	13 Å²	13	51.8 Å²	51.8	8%	0.079	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	119.2	178.7	178.1	0	0	0	0	109.4	L190 M192 I215 E421 C422	L190-V438 HydrophobicContact CB-CG2 3.66Å; L190-V438 WeakPolarHBondContact O-CG2 3.29Å; M192-V438 HydrophobicContact CB-CB 4.47Å; M192-V438 HydrophobicContact CB-CG1 3.68Å; M192-V438 HydrophobicContact CE-CB 4.25Å; M192-V438 HydrophobicContact CE-CG1 3.99Å; M192-V438 VanDerWaalsContact CE-O 3.28Å; M192-V438 WeakPolarHBondContact CE-O 3.43Å; M192-V438 HydrophobicContact SD-CG1 4.47Å; I215-V438 HydrophobicContact CD1-CG1 4.38Å; E421-V438 CarbonylContact C-O 3.57Å; E421-V438 VanDerWaalsContact CA-O 3.31Å; E421-V438 WeakPolarHBondContact CA-O 3.34Å; C422-V438 PolarHBondContact N-O 3.21Å; C422-V438 PolarHBondContact O-N 2.96Å
439	T	86.9	Confident	81.7	Confident	46 Å²	46	49.4 Å²	49.4	28%	0.282	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	134.4	-179.8	54.2	0	0	0	0	111.2	P308 L420 E421	P308-T439 VanDerWaalsContact CG-O 3.31Å; P308-T439 WeakPolarHBondContact CG-O 3.41Å; L420-T439 CarbonylContact O-C 3.57Å; L420-T439 WeakPolarHBondContact O-CA 3.39Å; E421-T439 HydrophobicContact CB-CG2 4.05Å; E421-T439 HydrophobicContact CG-CG2 3.78Å
440	V	87.7	Confident	82.2	Confident	3 Å²	3	46.6 Å²	46.6	2%	0.018	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	151.9	173.2	-58.4	0	0	0	0	110.2	M192 M213 P308 I310 Q419 L420	M192-V440 HydrophobicContact CE-CG2 4.47Å; M192-V440 HydrophobicContact SD-CB 4.25Å; M192-V440 HydrophobicContact SD-CG1 3.61Å; M192-V440 HydrophobicContact SD-CG2 3.54Å; M192-V440 VanDerWaalsContact SD-CG2 3.54Å; M213-V440 HydrophobicContact CE-CG1 4.34Å; P308-V440 HydrophobicContact CB-CG1 4.48Å; P308-V440 HydrophobicContact CG-CB 4.44Å; P308-V440 HydrophobicContact CG-CG1 3.97Å; P308-V440 CarbonylContact O-C 3.59Å; I310-V440 HydrophobicContact CD1-CB 4.08Å; I310-V440 HydrophobicContact CD1-CG1 4.32Å; I310-V440 HydrophobicContact CD1-CG2 3.61Å; I310-V440 HydrophobicContact CG1-CB 4.17Å; I310-V440 HydrophobicContact CG1-CG2 4.14Å; Q419-V440 CarbonylContact C-O 3.59Å; Q419-V440 WeakPolarHBondContact CA-O 3.23Å; L420-V440 HydrophobicContact CB-CG2 3.83Å; L420-V440 HydrophobicContact CD2-CG2 4.18Å; L420-V440 HydrophobicContact CG-CG2 4.33Å; L420-V440 PolarHBondContact N-O 3.16Å; L420-V440 PolarHBondContact O-N 3.43Å
441	T	88.6	Confident	82.8	Confident	11 Å²	11	51.3 Å²	51.3	7%	0.067	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	130.6	177.9	-55.1	0	0	0	0	109.9	I307 P308 K309 I310 H417	I307-T441 VanDerWaalsContact CG2-OG1 3.25Å; I307-T441 WeakPolarHBondContact CG2-OG1 3.18Å; P308-T441 PolarHBondContact O-N 3.15Å; K309-T441 CarbonylContact C-O 3.58Å; K309-T441 WeakPolarHBondContact CA-O 3.48Å; I310-T441 PolarHBondContact N-O 2.89Å; H417-T441 HydrophobicContact CB-CG2 4.42Å
442	I	89.5	Confident	83.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	129.7	177	-58	177.3	0	0	0	109.7	L318 L337 L409 V411 H417 W418 L420 P444	L318-I442 HydrophobicContact CD2-CD1 4.24Å; L318-I442 HydrophobicContact CD2-CG1 4.35Å; L337-I442 HydrophobicContact CD1-CD1 3.82Å; L409-I442 HydrophobicContact CD2-CD1 3.78Å; V411-I442 HydrophobicContact CG1-CG2 3.84Å; V411-I442 HydrophobicContact CG2-CG2 4.27Å; H417-I442 PolarHBondContact N-O 3.26Å; W418-I442 PolarHBondContact O-N 3.41Å; L420-I442 HydrophobicContact CB-CD1 4.26Å; L420-I442 HydrophobicContact CB-CG1 4.37Å; I442-P444 HydrophobicContact CG2-CG 4.47Å
443	E	90.2	Very high	85	Confident	3 Å²	3	42.7 Å²	42.7	1%	0.014	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	96.8	175.9	-64	-70.6	-169.3	0	0	110.3	K309 I310 W311 T312 H417 M445	K309-E443 HydrophobicContact CB-CG 4.08Å; K309-E443 HydrophobicContact CD-CG 3.94Å; K309-E443 VanDerWaalsContact CE-OE1 3.29Å; K309-E443 WeakPolarHBondContact CE-OE1 3.03Å; K309-E443 HydrophobicContact CG-CG 4.1Å; K309-E443 IonicContact NZ-OE1 3.19Å; K309-E443 PolarHBondContact NZ-OE1 3.48Å; I310-E443 PolarHBondContact O-N 2.7Å; W311-E443 WeakPolarHBondContact CA-O 3.29Å; W311-E443 HydrophobicContact CD2-CB 3.75Å; W311-E443 HydrophobicContact CD2-CG 4.45Å; W311-E443 HydrophobicContact CE3-CB 3.52Å; W311-E443 HydrophobicContact CE3-CG 4.47Å; W311-E443 HydrophobicContact CG-CB 4.42Å; W311-E443 HydrophobicContact CH2-CB 4.09Å; W311-E443 HydrophobicContact CH2-CG 4.29Å; W311-E443 HydrophobicContact CZ2-CB 4.28Å; W311-E443 HydrophobicContact CZ2-CG 4.24Å; W311-E443 HydrophobicContact CZ3-CB 3.71Å; W311-E443 HydrophobicContact CZ3-CG 4.41Å; T312-E443 PolarHBondContact N-O 2.91Å; H417-E443 IonicContact CD2-OE1 3.52Å; H417-E443 PolarHBondContact CD2-OE1 3.03Å; H417-E443 IonicContact CD2-OE2 3.72Å; H417-E443 IonicContact NE2-OE1 3.75Å; E443-M445 PolarHBondContact O-N 2.81Å
444	P	91	Very high	86.1	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	127.5	176	-20.2	32.8	0	0	0	111.4	T312 V411 E412 Q416 I442 Y446 S478	T312-P444 CarbonylContact O-C 3.59Å; T312-P444 WeakPolarHBondContact O-CA 3.43Å; V411-P444 HydrophobicContact CG1-CB 4.09Å; V411-P444 HydrophobicContact CG1-CG 3.81Å; E412-P444 WeakPolarHBondContact O-CG 3.33Å; Q416-P444 HydrophobicContact CB-CG 4.27Å; I442-P444 HydrophobicContact CG2-CG 4.47Å; P444-Y446 HydrophobicContact CB-CD1 4.5Å; P444-Y446 WeakPolarHBondContact O-CD1 3.45Å; P444-S478 VanDerWaalsContact O-CB 3.28Å; P444-S478 WeakPolarHBondContact O-CB 3.36Å; P444-S478 PolarHBondContact O-OG 3.23Å
445	M	90	Very high	86.8	Confident	7 Å²	7	34.2 Å²	34.2	3%	0.034	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	130.1	171.8	-63.1	-168.6	-65.8	0	0	110.7	W311 T312 V313 E314 E443 S478 V551 E552 A553	W311-M445 HydrophobicContact CB-CE 4.35Å; W311-M445 HydrophobicContact CB-CG 4.29Å; W311-M445 HydrophobicContact CB-SD 4.02Å; W311-M445 HydrophobicContact CE3-CG 3.72Å; W311-M445 HydrophobicContact CE3-SD 4.3Å; T312-M445 PolarHBondContact O-N 2.82Å; V313-M445 HydrophobicContact CG2-CE 4.02Å; E314-M445 PolarHBondContact N-O 3.1Å; E443-M445 PolarHBondContact O-N 2.81Å; M445-S478 WeakPolarHBondContact CA-O 3.2Å; M445-V551 HydrophobicContact CB-CG2 4.38Å; M445-E552 VanDerWaalsContact SD-C 3.59Å; M445-A553 PolarHBondContact SD-N 3.25Å; M445-A553 VanDerWaalsContact SD-N 3.41Å
446	Y	90.8	Very high	86.7	Confident	30 Å²	30	40.7 Å²	40.7	12%	0.118	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	160.3	-178.7	60.6	-94.4	0	0	0	112	R413 P444 T477 S478	R413-Y446 HydrophobicContact CG-CD1 4.22Å; R413-Y446 HydrophobicContact CG-CE1 3.76Å; R413-Y446 VanDerWaalsContact CZ-CE2 3.49Å; R413-Y446 PolarHBondContact NE-OH 3.02Å; R413-Y446 VanDerWaalsContact NE-OH 3.15Å; R413-Y446 VanDerWaalsContact NH2-CE2 3.25Å; R413-Y446 PolarHBondContact NH2-OH 2.78Å; P444-Y446 HydrophobicContact CB-CD1 4.5Å; P444-Y446 WeakPolarHBondContact O-CD1 3.45Å; Y446-T477 WeakPolarHBondContact O-CA 3.33Å; Y446-S478 PolarHBondContact N-O 2.88Å; Y446-S478 VanDerWaalsContact N-O 3.12Å; Y446-S478 PolarHBondContact O-N 2.85Å
447	I	91.3	Very high	86.3	Confident	26 Å²	26	41.8 Å²	41.8	13%	0.133	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	129.9	172.7	-55.7	178.5	0	0	0	107.7	V450 A475 K476 T477 V549 V551 T595 V597	I447-V450 HydrophobicContact CG2-CG2 3.43Å; I447-V450 VanDerWaalsContact CG2-CG2 3.43Å; I447-A475 HydrophobicContact CG2-CB 4.23Å; I447-K476 WeakPolarHBondContact CA-O 3.18Å; I447-T477 HydrophobicContact CG1-CG2 4.27Å; I447-T477 HydrophobicContact CG2-CG2 4.2Å; I447-V549 HydrophobicContact CD1-CB 4.37Å; I447-V549 HydrophobicContact CD1-CG1 4.14Å; I447-V549 WeakPolarHBondContact CD1-O 3.41Å; I447-V549 HydrophobicContact CG2-CB 4.29Å; I447-V549 HydrophobicContact CG2-CG1 4.15Å; I447-V551 HydrophobicContact CD1-CB 4.32Å; I447-V551 HydrophobicContact CD1-CG1 3.9Å; I447-V551 HydrophobicContact CD1-CG2 3.9Å; I447-V551 HydrophobicContact CG1-CB 4.26Å; I447-V551 HydrophobicContact CG1-CG1 3.67Å; I447-V551 HydrophobicContact CG1-CG2 3.68Å; I447-T595 WeakPolarHBondContact CD1-O 3.08Å; I447-V597 HydrophobicContact CB-CB 4.23Å; I447-V597 HydrophobicContact CB-CG2 3.89Å; I447-V597 HydrophobicContact CD1-CB 4.37Å; I447-V597 HydrophobicContact CD1-CG2 4.23Å; I447-V597 HydrophobicContact CG2-CB 3.97Å; I447-V597 HydrophobicContact CG2-CG2 4.19Å
448	E	89.8	Confident	85.2	Confident	65 Å²	65	44.8 Å²	44.8	30%	0.304	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	155.5	-174.6	177	-180	-122.6	0	0	110	R413 V450 K476	R413-E448 IonicContact CZ-OE2 3.38Å; R413-E448 VanDerWaalsContact CZ-OE2 3.26Å; R413-E448 IonicContact NH1-OE1 3.65Å; R413-E448 PolarHBondContact NH1-OE1 2.88Å; R413-E448 IonicContact NH1-OE2 3.41Å; R413-E448 PolarHBondContact NH1-OE2 3.24Å; R413-E448 IonicContact NH2-OE2 2.75Å; R413-E448 PolarHBondContact NH2-OE2 3.15Å; E448-V450 PolarHBondContact O-N 2.9Å; E448-K476 HydrophobicContact CB-CB 4.17Å; E448-K476 HydrophobicContact CG-CD 4.42Å; E448-K476 PolarHBondContact N-O 3.33Å; E448-K476 PolarHBondContact O-N 2.69Å; E448-K476 WeakPolarHBondContact OE2-CD 3.39Å
449	D	89.3	Confident	84	Confident	91 Å²	91	51.9 Å²	51.9	49%	0.487	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54	36.4	174.6	-62.2	-23.2	0	0	0	116.5	K451 I474 K476	D449-K451 PolarHBondContact O-N 2.83Å; D449-K451 VanDerWaalsContact O-N 3.1Å; D449-I474 VanDerWaalsContact O-O 3.09Å; D449-K476 WeakPolarHBondContact OD2-CD 3.27Å; D449-K476 WeakPolarHBondContact OD2-CE 3.45Å; D449-K476 IonicContact OD2-NZ 3.16Å; D449-K476 PolarHBondContact OD2-NZ 2.92Å
450	V	90.7	Very high	82.5	Confident	23 Å²	23	59.4 Å²	59.4	14%	0.139	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	111.5	178.3	-164.1	0	0	0	0	110.9	I447 E448 I474 A475 V549 V597 S599	I447-V450 HydrophobicContact CG2-CG2 3.43Å; I447-V450 VanDerWaalsContact CG2-CG2 3.43Å; E448-V450 PolarHBondContact O-N 2.9Å; V450-I474 CarbonylContact C-O 3.16Å; V450-I474 VanDerWaalsContact CA-O 3.31Å; V450-I474 WeakPolarHBondContact CA-O 3.33Å; V450-A475 HydrophobicContact CB-CB 4.46Å; V450-A475 HydrophobicContact CG1-CB 4.48Å; V450-A475 HydrophobicContact CG2-CB 3.94Å; V450-V549 HydrophobicContact CG1-CG2 3.67Å; V450-V549 HydrophobicContact CG2-CG2 4.47Å; V450-V597 HydrophobicContact CB-CG1 4.43Å; V450-V597 HydrophobicContact CG2-CB 4.11Å; V450-V597 HydrophobicContact CG2-CG1 3.64Å; V450-S599 WeakPolarHBondContact O-CB 3.41Å; V450-S599 PolarHBondContact O-OG 3.28Å
451	K	91.5	Very high	81.3	Confident	98 Å²	98	62.2 Å²	62.2	43%	0.426	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	146.7	179.5	62.2	171.5	179.7	146.9	0	111.9	D449 C473 I474	D449-K451 PolarHBondContact O-N 2.83Å; D449-K451 VanDerWaalsContact O-N 3.1Å; K451-C473 WeakPolarHBondContact O-CA 3.22Å; K451-I474 HydrophobicContact CG-CB 4.02Å; K451-I474 PolarHBondContact N-O 3.17Å; K451-I474 PolarHBondContact O-N 2.92Å
452	I	89.5	Confident	80.6	Confident	20 Å²	20	67.1 Å²	67.1	10%	0.103	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.8	168.1	-61.5	166.9	0	0	0	108.2	F471 E472 W486 I545 C547 S599 Y601	I452-F471 HydrophobicContact CG2-CB 4.13Å; I452-F471 HydrophobicContact CG2-CD1 3.87Å; I452-F471 HydrophobicContact CG2-CG 4.43Å; I452-E472 CarbonylContact C-O 3.59Å; I452-E472 WeakPolarHBondContact CA-O 3.4Å; I452-W486 HydrophobicContact CD1-CZ3 3.98Å; I452-W486 HydrophobicContact CG1-CH2 4.29Å; I452-W486 HydrophobicContact CG1-CZ3 4.02Å; I452-W486 HydrophobicContact CG2-CH2 4.34Å; I452-W486 HydrophobicContact CG2-CZ3 4.28Å; I452-I545 HydrophobicContact CD1-CG2 4.28Å; I452-C547 HydrophobicContact CD1-CB 4.09Å; I452-C547 HydrophobicContact CG1-CB 3.97Å; I452-S599 WeakPolarHBondContact CD1-O 3.35Å; I452-Y601 HydrophobicContact CB-CD2 4.49Å; I452-Y601 HydrophobicContact CG2-CD2 4.23Å; I452-Y601 HydrophobicContact CG2-CG 4.22Å
453	Q	88.2	Confident	80.4	Confident	64 Å²	64	67.3 Å²	67.3	30%	0.299	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	163.1	172.3	66.2	180	34.9	0	0	110.9	F471 E472 I474	Q453-F471 CarbonylContact O-C 3.6Å; Q453-F471 WeakPolarHBondContact O-CA 3.45Å; Q453-E472 HydrophobicContact CG-CB 4.01Å; Q453-E472 PolarHBondContact N-O 2.8Å; Q453-E472 PolarHBondContact NE2-OE2 3.49Å; Q453-E472 PolarHBondContact O-N 2.93Å; Q453-I474 VanDerWaalsContact CD-CD1 3.44Å; Q453-I474 HydrophobicContact CG-CD1 4.28Å; Q453-I474 VanDerWaalsContact NE2-CD1 3.3Å
454	I	86.8	Confident	80.2	Confident	26 Å²	26	72.1 Å²	72.1	13%	0.133	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	127.5	173.9	-60.4	172.9	0	0	0	108.7	Q457 L463 I469 H470 F471	I454-Q457 HydrophobicContact CB-CB 4.42Å; I454-Q457 HydrophobicContact CG2-CB 4.07Å; I454-Q457 HydrophobicContact CG2-CG 4.08Å; I454-L463 HydrophobicContact CD1-CD2 4.27Å; I454-I469 HydrophobicContact CD1-CG2 4.23Å; I454-I469 HydrophobicContact CG1-CG2 4.2Å; I454-I469 HydrophobicContact CG2-CG2 3.79Å; I454-H470 WeakPolarHBondContact CA-O 3.39Å; I454-F471 HydrophobicContact CD1-CE1 3.96Å; I454-F471 HydrophobicContact CG1-CD1 3.83Å; I454-F471 HydrophobicContact CG1-CE1 3.69Å
455	I	81.4	Confident	80	Confident	46 Å²	46	74.6 Å²	74.6	24%	0.236	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	136.3	177.9	-55.5	179.2	0	0	0	109.2	Q457 H470 E472 I531	I455-Q457 VanDerWaalsContact C-N 3.32Å; I455-Q457 PolarHBondContact O-N 2.74Å; I455-H470 HydrophobicContact CB-CB 4.07Å; I455-H470 HydrophobicContact CD1-CB 4.17Å; I455-H470 HydrophobicContact CG1-CB 4.31Å; I455-H470 PolarHBondContact N-O 3.07Å; I455-E472 HydrophobicContact CD1-CB 3.98Å; I455-E472 HydrophobicContact CG1-CB 3.74Å; I455-I531 HydrophobicContact CD1-CD1 3.76Å; I455-I531 HydrophobicContact CD1-CG1 3.99Å; I455-I531 HydrophobicContact CD1-CG2 3.88Å
456	N	69.7	Low	79.7	Confident	163 Å²	163	76 Å²	76	87%	0.872	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	22.2	177.7	-56.7	-25.3	0	0	0	116.3
457	Q	64.9	Low	79.3	Confident	58 Å²	58	77.4 Å²	77.4	27%	0.271	40%	0.396	S	S	.	.			trans	-125.2	125.3	170.3	-70.9	-173.7	-20.7	0	0	111.4	I454 I455 V461	I454-Q457 HydrophobicContact CB-CB 4.42Å; I454-Q457 HydrophobicContact CG2-CB 4.07Å; I454-Q457 HydrophobicContact CG2-CG 4.08Å; I455-Q457 VanDerWaalsContact C-N 3.32Å; I455-Q457 PolarHBondContact O-N 2.74Å; Q457-V461 HydrophobicContact CG-CG2 4.38Å
458	T	56.8	Low	78.9	Confident	147 Å²	147	79.9 Å²	79.9	90%	0.902	41%	0.409	S	S	*	.			trans	-100.1	-4.1	-175.9	46.9	0	0	0	0	114.3
459	E	58.5	Low	78.6	Confident	163 Å²	163	77 Å²	77	76%	0.762	40%	0.396	S	S	*	.	S	Bend	trans	-136.8	164	-177.8	-65.4	-174.4	152.5	0	0	110.8	V461	E459-V461 PolarHBondContact O-N 2.85Å
460	Q	56.4	Low	78.4	Confident	203 Å²	203	75.5 Å²	75.5	95%	0.949	39%	0.386	S	S	*	.			trans	-71.2	90.5	175.5	-69.8	-177.9	-75	0	0	110.4
461	V	61.9	Low	78.2	Confident	63 Å²	63	74.4 Å²	74.4	38%	0.382	38%	0.379	S	S	.	.			trans	-83.3	123.2	179.4	179.9	0	0	0	0	110.5	Q457 E459 L463	Q457-V461 HydrophobicContact CG-CG2 4.38Å; E459-V461 PolarHBondContact O-N 2.85Å; V461-L463 PolarHBondContact O-N 2.96Å; V461-L463 VanDerWaalsContact O-N 3.15Å
462	N	74.7	Confident	78.1	Confident	114 Å²	114	72.2 Å²	72.2	61%	0.61	37%	0.37	S	S	*	.			trans	-57.8	114.3	165.3	-70	-35.1	0	0	0	109.3	R464 T606	N462-R464 PolarHBondContact O-N 2.88Å; N462-T606 HydrophobicContact CB-CG2 4.01Å
463	L	85.4	Confident	78.1	Confident	3 Å²	3	71.3 Å²	71.3	2%	0.016	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	124.6	-173.5	-55.6	179.2	0	0	0	109.6	I454 V461 I469 F471 V536 L603 E604 V605 T606	I454-L463 HydrophobicContact CD1-CD2 4.27Å; V461-L463 PolarHBondContact O-N 2.96Å; V461-L463 VanDerWaalsContact O-N 3.15Å; L463-I469 HydrophobicContact CD2-CD1 3.83Å; L463-I469 HydrophobicContact CD2-CG1 4.07Å; L463-F471 HydrophobicContact CD1-CZ 4.45Å; L463-V536 HydrophobicContact CB-CG1 4.43Å; L463-L603 HydrophobicContact CD1-CD2 3.62Å; L463-E604 PolarHBondContact N-O 3.04Å; L463-V605 CarbonylContact O-C 3.57Å; L463-V605 VanDerWaalsContact O-CA 3.25Å; L463-V605 WeakPolarHBondContact O-CA 3.47Å; L463-T606 PolarHBondContact O-N 3.31Å; L463-T606 PolarHBondContact O-OG1 3.37Å
464	R	86.6	Confident	78.2	Confident	104 Å²	104	70.9 Å²	70.9	39%	0.392	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	142.6	179.2	-166.5	169.7	176.7	171.9	-0.7	111.4	N462 G466 Q467 Y994	N462-R464 PolarHBondContact O-N 2.88Å; R464-G466 PolarHBondContact O-N 3.32Å; R464-Q467 WeakPolarHBondContact O-CB 3.26Å; R464-Q467 PolarHBondContact O-N 2.75Å; R464-Q467 VanDerWaalsContact O-N 3.08Å; R464-Y994 PolarHBondContact NE-OH 2.76Å; R464-Y994 PolarHBondContact NH1-OH 2.84Å; R464-Y994 PolarHBondContact NH2-OH 2.94Å
465	E	85.8	Confident	78.4	Confident	52 Å²	52	70.6 Å²	70.6	24%	0.243	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	136.2	169.3	173	166.8	-115.6	0	0	111.8	Q467 R538 V605 T606 Y607	E465-Q467 VanDerWaalsContact C-N 3.32Å; E465-R538 VanDerWaalsContact OE1-CB 3.22Å; E465-R538 WeakPolarHBondContact OE1-CB 3.45Å; E465-R538 WeakPolarHBondContact OE1-CG 3.48Å; E465-R538 IonicContact OE1-CZ 2.59Å; E465-R538 PolarHBondContact OE1-N 3.05Å; E465-R538 IonicContact OE1-NE 3.27Å; E465-R538 PolarHBondContact OE1-NE 2.96Å; E465-R538 IonicContact OE1-NH2 2.71Å; E465-R538 IonicContact OE2-CZ 2.98Å; E465-R538 IonicContact OE2-NE 3.9Å; E465-R538 PolarHBondContact OE2-NE 2.89Å; E465-R538 VanDerWaalsContact OE2-NE 3.16Å; E465-R538 IonicContact OE2-NH2 3.84Å; E465-R538 PolarHBondContact OE2-NH2 3.06Å; E465-V605 HydrophobicContact CB-CG1 4.37Å; E465-T606 PolarHBondContact N-O 2.87Å; E465-Y607 WeakPolarHBondContact OE2-CB 3.21Å
466	G	83.7	Confident	78.8	Confident	37 Å²	37	73.7 Å²	73.7	38%	0.381	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	-3.7	-174.2	0	0	0	0	0	114.8	R464 V536	R464-G466 PolarHBondContact O-N 3.32Å; G466-V536 PolarHBondContact N-O 2.92Å
467	Q	83.3	Confident	79.8	Confident	60 Å²	60	66.6 Å²	66.6	28%	0.28	34%	0.34	S	S	.	.			trans	-80.7	132.3	179.7	-168.1	175.4	-4.6	0	0	111.6	R464 E465 I469 V536	R464-Q467 WeakPolarHBondContact O-CB 3.26Å; R464-Q467 PolarHBondContact O-N 2.75Å; R464-Q467 VanDerWaalsContact O-N 3.08Å; E465-Q467 VanDerWaalsContact C-N 3.32Å; Q467-I469 HydrophobicContact CG-CD1 3.72Å; Q467-I469 HydrophobicContact CG-CG1 4.41Å; Q467-V536 PolarHBondContact O-N 3.19Å
468	L	82.5	Confident	81	Confident	78 Å²	78	64.1 Å²	64.1	41%	0.408	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	118.1	171.7	179.3	64.1	0	0	0	110.1	Q533	L468-Q533 HydrophobicContact CD1-CB 4.39Å
469	I	83.1	Confident	82.4	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.021	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	143.9	-179.2	-55.7	-64.6	0	0	0	110.1	I454 L463 Q467 F471 L534 V536	I454-I469 HydrophobicContact CD1-CG2 4.23Å; I454-I469 HydrophobicContact CG1-CG2 4.2Å; I454-I469 HydrophobicContact CG2-CG2 3.79Å; L463-I469 HydrophobicContact CD2-CD1 3.83Å; L463-I469 HydrophobicContact CD2-CG1 4.07Å; Q467-I469 HydrophobicContact CG-CD1 3.72Å; Q467-I469 HydrophobicContact CG-CG1 4.41Å; I469-F471 HydrophobicContact CB-CD2 4.4Å; I469-F471 HydrophobicContact CB-CE2 3.75Å; I469-F471 HydrophobicContact CB-CZ 4.13Å; I469-F471 HydrophobicContact CG2-CD1 4.44Å; I469-F471 HydrophobicContact CG2-CD2 3.91Å; I469-F471 HydrophobicContact CG2-CE1 4.02Å; I469-F471 HydrophobicContact CG2-CE2 3.42Å; I469-F471 VanDerWaalsContact CG2-CE2 3.42Å; I469-F471 HydrophobicContact CG2-CG 4.38Å; I469-F471 HydrophobicContact CG2-CZ 3.48Å; I469-F471 VanDerWaalsContact CG2-CZ 3.48Å; I469-L534 PolarHBondContact N-O 2.74Å; I469-L534 PolarHBondContact O-N 3.45Å; I469-V536 HydrophobicContact CB-CG2 4.33Å; I469-V536 HydrophobicContact CG1-CG2 3.69Å
470	H	85.8	Confident	83.7	Confident	60 Å²	60	57.2 Å²	57.2	28%	0.278	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	106.8	174.7	-68.5	67.5	0	0	0	109.2	I454 I455 L532 Q533	I454-H470 WeakPolarHBondContact CA-O 3.39Å; I455-H470 HydrophobicContact CB-CB 4.07Å; I455-H470 HydrophobicContact CD1-CB 4.17Å; I455-H470 HydrophobicContact CG1-CB 4.31Å; I455-H470 PolarHBondContact N-O 3.07Å; H470-L532 WeakPolarHBondContact CA-O 3.5Å; H470-Q533 PolarHBondContact NE2-NE2 2.94Å
471	F	86.6	Confident	84.7	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	134.5	173.8	-63.8	-84.5	0	0	0	109.6	I452 Q453 I454 L463 I469 W486 I531 L532 L534 I545 Y601 L603	I452-F471 HydrophobicContact CG2-CB 4.13Å; I452-F471 HydrophobicContact CG2-CD1 3.87Å; I452-F471 HydrophobicContact CG2-CG 4.43Å; Q453-F471 CarbonylContact O-C 3.6Å; Q453-F471 WeakPolarHBondContact O-CA 3.45Å; I454-F471 HydrophobicContact CD1-CE1 3.96Å; I454-F471 HydrophobicContact CG1-CD1 3.83Å; I454-F471 HydrophobicContact CG1-CE1 3.69Å; L463-F471 HydrophobicContact CD1-CZ 4.45Å; I469-F471 HydrophobicContact CB-CD2 4.4Å; I469-F471 HydrophobicContact CB-CE2 3.75Å; I469-F471 HydrophobicContact CB-CZ 4.13Å; I469-F471 HydrophobicContact CG2-CD1 4.44Å; I469-F471 HydrophobicContact CG2-CD2 3.91Å; I469-F471 HydrophobicContact CG2-CE1 4.02Å; I469-F471 HydrophobicContact CG2-CE2 3.42Å; I469-F471 VanDerWaalsContact CG2-CE2 3.42Å; I469-F471 HydrophobicContact CG2-CG 4.38Å; I469-F471 HydrophobicContact CG2-CZ 3.48Å; I469-F471 VanDerWaalsContact CG2-CZ 3.48Å; F471-W486 HydrophobicContact CB-CH2 3.95Å; F471-W486 HydrophobicContact CB-CZ3 4.23Å; F471-I531 CarbonylContact O-C 3.31Å; F471-I531 VanDerWaalsContact O-CA 3.27Å; F471-I531 WeakPolarHBondContact O-CA 2.92Å; F471-L532 HydrophobicContact CB-CB 4.29Å; F471-L532 PolarHBondContact N-O 2.79Å; F471-L532 PolarHBondContact O-N 2.76Å; F471-L534 HydrophobicContact CD2-CB 4.39Å; F471-L534 HydrophobicContact CE2-CB 4.21Å; F471-L534 HydrophobicContact CE2-CD2 4.19Å; F471-I545 HydrophobicContact CD1-CD1 4.16Å; F471-I545 HydrophobicContact CD2-CD1 3.61Å; F471-I545 HydrophobicContact CE1-CD1 3.95Å; F471-I545 HydrophobicContact CE2-CD1 3.36Å; F471-I545 HydrophobicContact CG-CD1 4.01Å; F471-I545 HydrophobicContact CZ-CD1 3.55Å; F471-Y601 AromaticContact CE1-CD1 3.84Å; F471-Y601 HydrophobicContact CE1-CD1 3.84Å; F471-Y601 AromaticContact CE1-CE1 3.77Å; F471-Y601 HydrophobicContact CE1-CE1 3.77Å; F471-Y601 HydrophobicContact CE1-CG 4.45Å; F471-Y601 HydrophobicContact CZ-CE1 4.48Å; F471-L603 HydrophobicContact CE1-CD2 4.34Å; F471-L603 HydrophobicContact CE2-CD2 4.42Å; F471-L603 HydrophobicContact CZ-CD2 3.66Å
472	E	89.4	Confident	85.7	Confident	52 Å²	52	49.4 Å²	49.4	24%	0.243	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	131.7	174.7	-175.4	-179.1	-155.3	0	0	109.8	I452 Q453 I455 I474 S530 I531	I452-E472 CarbonylContact C-O 3.59Å; I452-E472 WeakPolarHBondContact CA-O 3.4Å; Q453-E472 HydrophobicContact CG-CB 4.01Å; Q453-E472 PolarHBondContact N-O 2.8Å; Q453-E472 PolarHBondContact NE2-OE2 3.49Å; Q453-E472 PolarHBondContact O-N 2.93Å; I455-E472 HydrophobicContact CD1-CB 3.98Å; I455-E472 HydrophobicContact CG1-CB 3.74Å; E472-I474 HydrophobicContact CG-CG1 3.97Å; E472-S530 CarbonylContact C-O 3.57Å; E472-S530 WeakPolarHBondContact CA-O 3.4Å; E472-I531 HydrophobicContact CG-CG1 4.42Å
473	C	89.8	Confident	85.7	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.007	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	109.8	172.5	-174.1	0	0	0	0	109.9	K451 Y484 W486 S530 C547	K451-C473 WeakPolarHBondContact O-CA 3.22Å; C473-Y484 HydrophobicContact CB-CD1 4.08Å; C473-Y484 HydrophobicContact CB-CE1 4.16Å; C473-Y484 WeakPolarHBondContact O-CE1 3.11Å; C473-W486 HydrophobicContact CB-CH2 3.66Å; C473-W486 HydrophobicContact CB-CZ2 3.47Å; C473-W486 VanDerWaalsContact CB-CZ2 3.47Å; C473-S530 PolarHBondContact N-O 3.41Å; C473-C547 HydrophobicContact CB-CB 3.64Å; C473-C547 WeakPolarHBondContact CB-SG 3.4Å; C473-C547 WeakPolarHBondContact SG-CB 3.42Å; C473-C547 CovalentContact SG-SG 2.02Å; C473-C547 PolarHBondContact SG-SG 2.91Å
474	I	89.9	Confident	85.3	Confident	55 Å²	55	46 Å²	46	28%	0.282	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	135.3	177.2	-62.5	-172.1	0	0	0	108.6	D449 V450 K451 Q453 E472	D449-I474 VanDerWaalsContact O-O 3.09Å; V450-I474 CarbonylContact C-O 3.16Å; V450-I474 VanDerWaalsContact CA-O 3.31Å; V450-I474 WeakPolarHBondContact CA-O 3.33Å; K451-I474 HydrophobicContact CG-CB 4.02Å; K451-I474 PolarHBondContact N-O 3.17Å; K451-I474 PolarHBondContact O-N 2.92Å; Q453-I474 VanDerWaalsContact CD-CD1 3.44Å; Q453-I474 HydrophobicContact CG-CD1 4.28Å; Q453-I474 VanDerWaalsContact NE2-CD1 3.3Å; E472-I474 HydrophobicContact CG-CG1 3.97Å
475	A	90.2	Very high	84.7	Confident	19 Å²	19	41.1 Å²	41.1	16%	0.157	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	150.3	170.1	0	0	0	0	0	109.6	I447 V450 T477 V549	I447-A475 HydrophobicContact CG2-CB 4.23Å; V450-A475 HydrophobicContact CB-CB 4.46Å; V450-A475 HydrophobicContact CG1-CB 4.48Å; V450-A475 HydrophobicContact CG2-CB 3.94Å; A475-T477 HydrophobicContact CB-CG2 3.99Å; A475-V549 HydrophobicContact CB-CB 4.5Å; A475-V549 HydrophobicContact CB-CG1 4.07Å; A475-V549 HydrophobicContact CB-CG2 4.1Å
476	K	90.9	Very high	84.2	Confident	112 Å²	112	38.9 Å²	38.9	49%	0.487	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	123	165.7	-68.3	171	-177.5	161	0	108.1	I447 E448 D449	I447-K476 WeakPolarHBondContact CA-O 3.18Å; E448-K476 HydrophobicContact CB-CB 4.17Å; E448-K476 HydrophobicContact CG-CD 4.42Å; E448-K476 PolarHBondContact N-O 3.33Å; E448-K476 PolarHBondContact O-N 2.69Å; E448-K476 WeakPolarHBondContact OE2-CD 3.39Å; D449-K476 WeakPolarHBondContact OD2-CD 3.27Å; D449-K476 WeakPolarHBondContact OD2-CE 3.45Å; D449-K476 IonicContact OD2-NZ 3.16Å; D449-K476 PolarHBondContact OD2-NZ 2.92Å
477	T	89.6	Confident	83.7	Confident	13 Å²	13	37.3 Å²	37.3	8%	0.08	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	149	-173.9	66.9	0	0	0	0	112.9	Y446 I447 A475 P479 P482 V549 V551	Y446-T477 WeakPolarHBondContact O-CA 3.33Å; I447-T477 HydrophobicContact CG1-CG2 4.27Å; I447-T477 HydrophobicContact CG2-CG2 4.2Å; A475-T477 HydrophobicContact CB-CG2 3.99Å; T477-P479 CarbonylContact C-O 3.57Å; T477-P479 VanDerWaalsContact C-O 3.25Å; T477-P479 VanDerWaalsContact CB-O 3.3Å; T477-P479 WeakPolarHBondContact CB-O 3.42Å; T477-P479 CarbonylContact O-C 3.48Å; T477-P479 PolarHBondContact OG1-O 3.45Å; T477-P482 HydrophobicContact CG2-CB 3.92Å; T477-P482 HydrophobicContact CG2-CG 3.99Å; T477-V549 HydrophobicContact CG2-CG1 3.97Å; T477-V551 HydrophobicContact CG2-CG1 4.11Å
478	S	90.1	Very high	83.1	Confident	6 Å²	6	35.1 Å²	35.1	4%	0.042	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	119.8	164	-179.6	0	0	0	0	107.8	P444 M445 Y446	P444-S478 VanDerWaalsContact O-CB 3.28Å; P444-S478 WeakPolarHBondContact O-CB 3.36Å; P444-S478 PolarHBondContact O-OG 3.23Å; M445-S478 WeakPolarHBondContact CA-O 3.2Å; Y446-S478 PolarHBondContact N-O 2.88Å; Y446-S478 VanDerWaalsContact N-O 3.12Å; Y446-S478 PolarHBondContact O-N 2.85Å
479	P	86.7	Confident	82.4	Confident	8 Å²	8	31.4 Å²	31.4	5%	0.052	16%	0.164	C	C	.	.	S	Bend	cis	-60.4	166.2	-7.5	26.8	-36.9	0	0	0	114.5	W311 T477 T481 E552 P554	W311-P479 HydrophobicContact CH2-CB 3.86Å; W311-P479 HydrophobicContact CZ3-CB 3.88Å; W311-P479 HydrophobicContact CZ3-CG 4.26Å; T477-P479 CarbonylContact C-O 3.57Å; T477-P479 VanDerWaalsContact C-O 3.25Å; T477-P479 VanDerWaalsContact CB-O 3.3Å; T477-P479 WeakPolarHBondContact CB-O 3.42Å; T477-P479 CarbonylContact O-C 3.48Å; T477-P479 PolarHBondContact OG1-O 3.45Å; P479-T481 PolarHBondContact O-N 2.67Å; P479-T481 VanDerWaalsContact O-N 3.14Å; P479-E552 VanDerWaalsContact CG-O 3.31Å; P479-E552 WeakPolarHBondContact CG-O 3.42Å; P479-P554 HydrophobicContact CB-CG 3.97Å; P479-P554 HydrophobicContact CG-CG 4.1Å
480	L	84.8	Confident	81.5	Confident	158 Å²	158	33.3 Å²	33.3	83%	0.827	17%	0.174	S	C	*	.	S	Bend	trans	-72.2	4	178.5	-67.1	172.1	0	0	0	114.4	P482	L480-P482 VanDerWaalsContact C-CD 3.44Å; L480-P482 VanDerWaalsContact O-CD 3.29Å; L480-P482 WeakPolarHBondContact O-CD 3.36Å
481	T	78.2	Confident	79.9	Confident	78 Å²	78	33.1 Å²	33.1	48%	0.479	18%	0.178	S	C	.	.			trans	-117.5	76.7	180	54.3	0	0	0	0	110	P479 L557	P479-T481 PolarHBondContact O-N 2.67Å; P479-T481 VanDerWaalsContact O-N 3.14Å; T481-L557 WeakPolarHBondContact O-CD2 3.31Å
482	P	82.3	Confident	77.9	Confident	24 Å²	24	35.8 Å²	35.8	16%	0.156	19%	0.194	C	C	.	.			trans	-81.3	161.8	176.1	33.7	-34.5	0	0	0	112.3	T477 L480 Y484 V549 G550 V551	T477-P482 HydrophobicContact CG2-CB 3.92Å; T477-P482 HydrophobicContact CG2-CG 3.99Å; L480-P482 VanDerWaalsContact C-CD 3.44Å; L480-P482 VanDerWaalsContact O-CD 3.29Å; L480-P482 WeakPolarHBondContact O-CD 3.36Å; P482-Y484 HydrophobicContact CG-CE2 3.76Å; P482-V549 HydrophobicContact CB-CG1 3.69Å; P482-V549 HydrophobicContact CG-CG1 4.32Å; P482-G550 CarbonylContact C-O 3.44Å; P482-G550 VanDerWaalsContact CA-O 3.26Å; P482-G550 WeakPolarHBondContact CA-O 3.15Å; P482-G550 WeakPolarHBondContact CB-O 3.24Å; P482-V551 HydrophobicContact CB-CG1 4.09Å
483	I	75.5	Confident	75.6	Confident	13 Å²	13	37 Å²	37	7%	0.067	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	137.1	164.8	-71.2	179.1	0	0	0	109	M527 V549 G550 L557 I560 M594 W596	I483-M527 HydrophobicContact CG2-CB 4.35Å; I483-M527 HydrophobicContact CG2-CE 3.66Å; I483-V549 CarbonylContact O-C 3.53Å; I483-V549 WeakPolarHBondContact O-CA 3.39Å; I483-G550 PolarHBondContact N-O 2.91Å; I483-G550 PolarHBondContact O-N 3.42Å; I483-L557 HydrophobicContact CD1-CD1 3.61Å; I483-L557 HydrophobicContact CG1-CD1 3.93Å; I483-I560 HydrophobicContact CD1-CG2 4.37Å; I483-M594 HydrophobicContact CB-CE 4.05Å; I483-M594 HydrophobicContact CD1-CE 3.98Å; I483-M594 HydrophobicContact CG1-CE 4.18Å; I483-W596 HydrophobicContact CB-CH2 4.47Å; I483-W596 HydrophobicContact CG2-CH2 3.87Å; I483-W596 HydrophobicContact CG2-CZ3 4.4Å
484	Y	75.8	Confident	72.9	Confident	33 Å²	33	42.4 Å²	42.4	13%	0.129	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	143.7	171.6	-61.2	-89	0	0	0	110.1	C473 P482 M527 A529 W548 V549	C473-Y484 HydrophobicContact CB-CD1 4.08Å; C473-Y484 HydrophobicContact CB-CE1 4.16Å; C473-Y484 WeakPolarHBondContact O-CE1 3.11Å; P482-Y484 HydrophobicContact CG-CE2 3.76Å; Y484-M527 VanDerWaalsContact O-CA 3.28Å; Y484-M527 WeakPolarHBondContact O-CA 3.32Å; Y484-A529 WeakPolarHBondContact CB-O 3.16Å; Y484-W548 CarbonylContact C-O 3.38Å; Y484-W548 WeakPolarHBondContact CA-O 3.34Å; Y484-V549 HydrophobicContact CD1-CG2 3.91Å; Y484-V549 HydrophobicContact CE1-CG1 4.39Å; Y484-V549 HydrophobicContact CE1-CG2 3.85Å
485	S	75.5	Confident	70	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.007	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	138.9	167.1	162.4	0	0	0	0	108.5	W548	S485-W548 PolarHBondContact N-O 3.25Å; S485-W548 PolarHBondContact O-N 2.77Å
486	W	73.6	Confident	67.1	Low	4 Å²	4	49 Å²	49	2%	0.015	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	135.2	-177.2	-69.5	93.8	0	0	0	110.4	I452 F471 C473 I525 A529 S530 L532 I545 R546 C547	I452-W486 HydrophobicContact CD1-CZ3 3.98Å; I452-W486 HydrophobicContact CG1-CH2 4.29Å; I452-W486 HydrophobicContact CG1-CZ3 4.02Å; I452-W486 HydrophobicContact CG2-CH2 4.34Å; I452-W486 HydrophobicContact CG2-CZ3 4.28Å; F471-W486 HydrophobicContact CB-CH2 3.95Å; F471-W486 HydrophobicContact CB-CZ3 4.23Å; C473-W486 HydrophobicContact CB-CH2 3.66Å; C473-W486 HydrophobicContact CB-CZ2 3.47Å; C473-W486 VanDerWaalsContact CB-CZ2 3.47Å; W486-I525 HydrophobicContact CB-CB 4.09Å; W486-I525 PolarHBondContact O-N 3.4Å; W486-A529 PolarHBondContact NE1-O 2.87Å; W486-S530 WeakPolarHBondContact CZ2-O 3.41Å; W486-L532 HydrophobicContact CB-CD2 4.36Å; W486-L532 HydrophobicContact CD2-CB 3.68Å; W486-L532 HydrophobicContact CD2-CD2 3.94Å; W486-L532 HydrophobicContact CD2-CG 4.38Å; W486-L532 HydrophobicContact CE3-CB 4Å; W486-L532 HydrophobicContact CE3-CD2 3.63Å; W486-L532 HydrophobicContact CE3-CG 4.45Å; W486-L532 HydrophobicContact CG-CB 4.1Å; W486-L532 HydrophobicContact CG-CD2 4.3Å; W486-L532 HydrophobicContact CH2-CB 4.11Å; W486-L532 HydrophobicContact CZ2-CB 3.82Å; W486-L532 HydrophobicContact CZ3-CB 4.2Å; W486-L532 HydrophobicContact CZ3-CD2 4.1Å; W486-I545 HydrophobicContact CE3-CG2 3.54Å; W486-I545 HydrophobicContact CZ3-CG2 3.6Å; W486-R546 WeakPolarHBondContact CA-O 3.45Å; W486-C547 HydrophobicContact CD2-CB 4.27Å; W486-C547 HydrophobicContact CE3-CB 3.88Å; W486-C547 HydrophobicContact CH2-CB 4.12Å; W486-C547 HydrophobicContact CZ2-CB 4.44Å; W486-C547 HydrophobicContact CZ3-CB 3.81Å
487	T	73.3	Confident	64.2	Low	4 Å²	4	52.3 Å²	52.3	3%	0.025	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	142.5	174.9	61.1	0	0	0	0	110.7	I523 I545 R546	T487-I523 WeakPolarHBondContact CA-O 3.47Å; T487-I545 CarbonylContact O-C 3.56Å; T487-I545 WeakPolarHBondContact O-CA 3.28Å; T487-R546 PolarHBondContact N-O 2.79Å; T487-R546 PolarHBondContact O-N 2.02Å; T487-R546 PolarHBondContact OG1-NH1 2.68Å
488	I	71.7	Confident	61.5	Low	14 Å²	14	60 Å²	60	7%	0.072	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	118	171.2	-53.5	-178.4	0	0	0	107.8	L522 I523 I525 L534 K543 R544 I545	I488-L522 WeakPolarHBondContact O-CA 3.49Å; I488-I523 PolarHBondContact N-O 3.46Å; I488-I523 PolarHBondContact O-N 2.9Å; I488-I525 HydrophobicContact CD1-CD1 3.93Å; I488-I525 HydrophobicContact CG1-CD1 4.24Å; I488-L534 HydrophobicContact CD1-CD1 3.61Å; I488-L534 HydrophobicContact CD1-CD2 3.75Å; I488-L534 HydrophobicContact CD1-CG 4.34Å; I488-K543 HydrophobicContact CG2-CB 4.12Å; I488-R544 WeakPolarHBondContact CA-O 3.33Å; I488-I545 HydrophobicContact CG1-CG1 4.32Å
489	G	67.1	Low	58.7	Low	1 Å²	1	64.5 Å²	64.5	1%	0.01	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	168.8	-170.3	0	0	0	0	0	115.6	K543 R544	G489-K543 WeakPolarHBondContact O-CA 3.31Å; G489-R544 PolarHBondContact N-O 2.91Å; G489-R544 PolarHBondContact O-N 2.83Å
490	N	64.9	Low	56	Low	43 Å²	43	71.1 Å²	71.1	23%	0.23	39%	0.386	C	S	.	.			trans	-63.7	149.4	166.3	-74.8	-26	0	0	0	110.6	V492 E519 K543	N490-V492 PolarHBondContact O-N 3.06Å; N490-V492 VanDerWaalsContact O-N 3.11Å; N490-E519 PolarHBondContact ND2-O 3.42Å; N490-K543 PolarHBondContact OD1-NZ 2.64Å
491	P	51.5	Low	53.5	Low	56 Å²	56	70.6 Å²	70.6	36%	0.364	38%	0.384	S	S	.	.			trans	-62.5	115	169.8	27	-33.2	0	0	0	109.4
492	V	45.7	Very low	51.3	Low	56 Å²	56	73.9 Å²	73.9	34%	0.339	40%	0.398	S	S	.	.			trans	-66.3	130.7	170.9	-171	0	0	0	0	107.6	N490 S494	N490-V492 PolarHBondContact O-N 3.06Å; N490-V492 VanDerWaalsContact O-N 3.11Å; V492-S494 PolarHBondContact O-N 3.44Å
493	P	39.7	Very low	48.8	Very low	78 Å²	78	79.9 Å²	79.9	51%	0.506	43%	0.427	S	S	.	.			trans	-59.2	129.5	170.8	24.9	-32.6	0	0	0	108.7	V495	P493-V495 VanDerWaalsContact C-N 3.31Å; P493-V495 PolarHBondContact O-N 2.91Å
494	S	33	Very low	46.8	Very low	114 Å²	114	85.3 Å²	85.3	80%	0.797	46%	0.461	S	S	*	.			trans	-71.5	84.9	-178	52.7	0	0	0	0	110.7	V492	V492-S494 PolarHBondContact O-N 3.44Å
495	V	30.5	Very low	44.7	Very low	94 Å²	94	91.8 Å²	91.8	57%	0.57	50%	0.499	S	S	*	.			trans	-74.9	124.6	167.4	-174.2	0	0	0	0	107.7	P493 F497	P493-V495 VanDerWaalsContact C-N 3.31Å; P493-V495 PolarHBondContact O-N 2.91Å; V495-F497 PolarHBondContact O-N 3.34Å; V495-F497 VanDerWaalsContact O-N 3.11Å
496	N	28.1	Very low	43	Very low	119 Å²	119	98.5 Å²	98.5	64%	0.636	53%	0.534	S	S	*	.			trans	-57.6	116.6	178.6	-75.9	-12.4	0	0	0	110.3	E498 T499	N496-E498 PolarHBondContact O-N 3.46Å; N496-E498 VanDerWaalsContact O-N 3.15Å; N496-T499 PolarHBondContact O-OG1 3.35Å
497	F	30.3	Very low	41.3	Very low	182 Å²	182	106.8 Å²	106.8	80%	0.798	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-67.7	-11.8	-176	-101	-95.9	0	0	0	114.2	V495 T499	V495-F497 PolarHBondContact O-N 3.34Å; V495-F497 VanDerWaalsContact O-N 3.11Å; F497-T499 VanDerWaalsContact C-N 3.31Å; F497-T499 PolarHBondContact O-N 3.05Å
498	E	32.4	Very low	39.7	Very low	175 Å²	175	115 Å²	115	82%	0.818	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-69.8	-24.8	-178.4	-62.4	-174.1	151.9	0	0	113.3	N496	N496-E498 PolarHBondContact O-N 3.46Å; N496-E498 VanDerWaalsContact O-N 3.15Å
499	T	32.5	Very low	38	Very low	99 Å²	99	124.4 Å²	124.4	61%	0.607	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-87.5	-10.2	-178.8	5.5	0	0	0	0	114.7	N496 F497	N496-T499 PolarHBondContact O-OG1 3.35Å; F497-T499 VanDerWaalsContact C-N 3.31Å; F497-T499 PolarHBondContact O-N 3.05Å
500	F	30.4	Very low	36.3	Very low	147 Å²	147	128.9 Å²	128.9	65%	0.645	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-85.8	-16.3	-174	-120.3	-90.4	0	0	0	114.5	L502	F500-L502 PolarHBondContact O-N 3.18Å
501	N	30.8	Very low	34.9	Very low	148 Å²	148	133.4 Å²	133.4	79%	0.791	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-82.4	14.2	-178.2	-69.4	-33.5	0	0	0	114.5
502	L	33.5	Very low	34	Very low	147 Å²	147	138.2 Å²	138.2	77%	0.77	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-123.2	6.2	-174.9	-86.1	165.5	0	0	0	114.7	F500	F500-L502 PolarHBondContact O-N 3.18Å
503	L	30.1	Very low	33.5	Very low	149 Å²	149	142.2 Å²	142.2	78%	0.78	75%	0.754	S	S	*	*			trans	-113	90.7	178.3	-69.2	172.4	0	0	0	110.7	D505	L503-D505 PolarHBondContact O-N 2.75Å
504	T	32.8	Very low	33.4	Very low	127 Å²	127	145.2 Å²	145.2	78%	0.779	76%	0.764	S	S	*	*			trans	-69.9	121.3	176	47.5	0	0	0	0	112.2	D506	T504-D506 PolarHBondContact O-N 3.05Å
505	D	31.7	Very low	33.4	Very low	170 Å²	170	147 Å²	147	91%	0.909	77%	0.765	S	S	*	*	S	Bend	trans	9.4	-14.2	162	-120.5	-11.8	0	0	0	124.4	L503	L503-D505 PolarHBondContact O-N 2.75Å
506	D	38.9	Very low	33.7	Very low	142 Å²	142	150 Å²	150	76%	0.759	78%	0.777	S	S	*	*	S	Bend	trans	-109	6.8	-162.6	-97.1	-32.4	0	0	0	116.2	T504	T504-D506 PolarHBondContact O-N 3.05Å
507	Q	39.4	Very low	33.8	Very low	178 Å²	178	151.2 Å²	151.2	83%	0.832	78%	0.777	S	S	*	*	S	Bend	trans	-123.1	-1.1	-171.4	-70	-65.9	-60	0	0	116.7
508	L	38.9	Very low	34.1	Very low	175 Å²	175	149 Å²	149	92%	0.916	77%	0.769	S	S	*	*			trans	-99.2	18.4	-175.6	-136.3	126.2	0	0	0	115
509	K	35.3	Very low	34	Very low	213 Å²	213	145.8 Å²	145.8	93%	0.926	75%	0.754	S	S	*	*	S	Bend	trans	-97.2	46	173.7	-73.1	179.9	179.6	163.6	0	113.5
510	S	32.8	Very low	34.2	Very low	94 Å²	94	143.5 Å²	143.5	66%	0.657	74%	0.736	S	S	*	*			trans	-173.6	103.8	159.1	-176.9	0	0	0	0	111.4
511	N	35.2	Very low	34.5	Very low	139 Å²	139	139.7 Å²	139.7	74%	0.743	72%	0.723	S	S	*	*				177.6	119.6	123.1	-90	-4.5	0	0	0	110.6	N513	N511-N513 PolarHBondContact O-N 2.79Å
512	N	33	Very low	34.8	Very low	156 Å²	156	133.6 Å²	133.6	83%	0.834	69%	0.69	S	S	*	*			trans	-83.1	95.6	173.2	-63.8	-30.3	0	0	0	109.5
513	N	35.4	Very low	35.2	Very low	140 Å²	140	130.3 Å²	130.3	75%	0.749	67%	0.672	S	S	*	*			trans	-144.1	98.1	157	-79.6	-24.8	0	0	0	103.8	N511	N511-N513 PolarHBondContact O-N 2.79Å
514	I	35.8	Very low	35.7	Very low	142 Å²	142	126.7 Å²	126.7	73%	0.728	65%	0.654	S	S	*	*				54.4	106.7	73.8	-50.3	179.2	0	0	0	109.4
515	D	34.6	Very low	36.3	Very low	151 Å²	151	121.7 Å²	121.7	81%	0.807	62%	0.622	S	S	*	*			trans	102.8	-6	165.3	-53.8	-22.1	0	0	0	122.3	K517	D515-K517 PolarHBondContact O-N 2.8Å
516	D	35.1	Very low	37	Very low	156 Å²	156	115.7 Å²	115.7	83%	0.834	59%	0.589	S	S	*	*			trans	-97.6	49.9	170.4	-80.8	-35.8	0	0	0	114	H518	D516-H518 PolarHBondContact O-N 2.85Å
517	K	31.8	Very low	37.4	Very low	146 Å²	146	110.6 Å²	110.6	64%	0.635	56%	0.561	S	S	*	*			trans	-87.5	94.8	171.9	-89.9	-175	175.6	176.6	0	111.4	D515 E519	D515-K517 PolarHBondContact O-N 2.8Å; K517-E519 PolarHBondContact O-N 2.89Å; K517-E519 VanDerWaalsContact O-N 3.09Å
518	H	35	Very low	38	Very low	135 Å²	135	107.1 Å²	107.1	63%	0.625	55%	0.548	S	S	*	.			trans	-64.1	108.4	167.2	-72.3	-50.1	0	0	0	111.2	D516 H520	D516-H518 PolarHBondContact O-N 2.85Å; H518-H520 PolarHBondContact O-CD2 3.11Å; H518-H520 PolarHBondContact O-N 2.91Å
519	E	31.5	Very low	39.2	Very low	108 Å²	108	100.8 Å²	100.8	51%	0.505	52%	0.521	S	S	.	.			trans	-68.1	97.8	175.7	-73.4	-174.3	121.1	0	0	111.8	S249 N490 K517 N521	S249-E519 VanDerWaalsContact CB-OE1 3.26Å; S249-E519 WeakPolarHBondContact CB-OE1 3.13Å; S249-E519 PolarHBondContact OG-OE1 3.38Å; N490-E519 PolarHBondContact ND2-O 3.42Å; K517-E519 PolarHBondContact O-N 2.89Å; K517-E519 VanDerWaalsContact O-N 3.09Å; E519-N521 PolarHBondContact O-N 2.88Å
520	H	37.3	Very low	41.4	Very low	51 Å²	51	92.5 Å²	92.5	24%	0.236	49%	0.489	C	S	.	.			trans	-92.1	82.9	165.1	-63.8	-72.1	0	0	0	109.6	H518 L522	H518-H520 PolarHBondContact O-CD2 3.11Å; H518-H520 PolarHBondContact O-N 2.91Å; H520-L522 PolarHBondContact O-N 2.91Å
521	N	36.2	Very low	43.7	Very low	67 Å²	67	91.4 Å²	91.4	36%	0.358	48%	0.475	S	S	.	.			trans	-69.4	114	167.9	-69.4	-10.3	0	0	0	108.4	S249 E519	S249-N521 WeakPolarHBondContact CA-OD1 3.43Å; S249-N521 WeakPolarHBondContact CB-OD1 3.27Å; E519-N521 PolarHBondContact O-N 2.88Å
522	L	36.7	Very low	45.8	Very low	19 Å²	19	85 Å²	85	10%	0.099	44%	0.441	C	S	.	.			trans	-122.7	133.5	177.1	-62.3	168.9	0	0	0	109.9	V252 D254 I488 H520 R546	V252-L522 HydrophobicContact CB-CB 4.19Å; V252-L522 HydrophobicContact CB-CD1 4.35Å; V252-L522 HydrophobicContact CG1-CB 4.33Å; V252-L522 HydrophobicContact CG1-CD1 4.24Å; V252-L522 WeakPolarHBondContact O-CD1 3.42Å; D254-L522 HydrophobicContact CB-CD1 4.38Å; D254-L522 VanDerWaalsContact OD1-CD1 3.31Å; D254-L522 WeakPolarHBondContact OD1-CD1 3.49Å; D254-L522 WeakPolarHBondContact OD1-CD2 3.37Å; I488-L522 WeakPolarHBondContact O-CA 3.49Å; H520-L522 PolarHBondContact O-N 2.91Å; L522-R546 VanDerWaalsContact CD2-NH1 3.25Å
523	I	41.2	Very low	48.1	Very low	79 Å²	79	79.2 Å²	79.2	41%	0.405	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	118.4	165.8	-57.4	173.9	0	0	0	106.5	T487 I488 I525	T487-I523 WeakPolarHBondContact CA-O 3.47Å; I488-I523 PolarHBondContact N-O 3.46Å; I488-I523 PolarHBondContact O-N 2.9Å; I523-I525 HydrophobicContact CG2-CG1 4.15Å
524	D	42.4	Very low	50.1	Low	73 Å²	73	73.1 Å²	73.1	39%	0.39	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	131	169.7	179.9	34.3	0	0	0	109.2
525	I	44.7	Very low	52.4	Low	22 Å²	22	68.4 Å²	68.4	11%	0.113	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	129	178.9	-53.4	176.1	0	0	0	108.6	Y235 W486 I488 I523 L532	Y235-I525 HydrophobicContact CE2-CG2 3.85Å; W486-I525 HydrophobicContact CB-CB 4.09Å; W486-I525 PolarHBondContact O-N 3.4Å; I488-I525 HydrophobicContact CD1-CD1 3.93Å; I488-I525 HydrophobicContact CG1-CD1 4.24Å; I523-I525 HydrophobicContact CG2-CG1 4.15Å; I525-L532 HydrophobicContact CB-CD1 4.45Å; I525-L532 HydrophobicContact CD1-CD1 3.56Å; I525-L532 HydrophobicContact CG2-CD1 3.91Å
526	Q	45.6	Very low	54.8	Low	44 Å²	44	61.2 Å²	61.2	21%	0.206	32%	0.316	C	S	.	.			trans	-41.9	135.8	-160.2	-176.3	175.9	-25.1	0	0	116.5	N528 Q566	Q526-N528 PolarHBondContact O-N 3.46Å; Q526-Q566 VanDerWaalsContact NE2-CD 3.32Å; Q526-Q566 VanDerWaalsContact NE2-OE1 3.13Å
527	M	48.7	Very low	57.1	Low	35 Å²	35	56 Å²	56	17%	0.172	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	100	-178.7	-60.3	166.4	68.9	0	0	113.1	I483 Y484 L565 W596	I483-M527 HydrophobicContact CG2-CB 4.35Å; I483-M527 HydrophobicContact CG2-CE 3.66Å; Y484-M527 VanDerWaalsContact O-CA 3.28Å; Y484-M527 WeakPolarHBondContact O-CA 3.32Å; M527-L565 HydrophobicContact CE-CD1 3.53Å; M527-L565 HydrophobicContact CE-CD2 4.29Å; M527-L565 HydrophobicContact SD-CD1 3.86Å; M527-L565 HydrophobicContact SD-CD2 3.93Å; M527-L565 HydrophobicContact SD-CG 4.36Å; M527-W596 HydrophobicContact CE-CH2 4.26Å
528	N	51.6	Low	59.7	Low	105 Å²	105	51.5 Å²	51.5	56%	0.561	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	176.8	-15	157.1	43.4	15	0	0	0	115.1	Q526	Q526-N528 PolarHBondContact O-N 3.46Å
529	A	63.1	Low	61.9	Low	42 Å²	42	48.3 Å²	48.3	35%	0.347	26%	0.264	S	S	.	.			trans	-103.4	132.3	-177.7	0	0	0	0	0	113.7	Y484 W486 I531	Y484-A529 WeakPolarHBondContact CB-O 3.16Å; W486-A529 PolarHBondContact NE1-O 2.87Å; A529-I531 WeakPolarHBondContact CB-O 3.47Å; A529-I531 PolarHBondContact O-N 3.1Å
530	S	81.2	Confident	64.3	Low	38 Å²	38	43.8 Å²	43.8	27%	0.266	24%	0.243	S	C	.	.	S	Bend	trans	-68.6	-4.4	164.8	59.6	0	0	0	0	113.2	E472 C473 W486	E472-S530 CarbonylContact C-O 3.57Å; E472-S530 WeakPolarHBondContact CA-O 3.4Å; C473-S530 PolarHBondContact N-O 3.41Å; W486-S530 WeakPolarHBondContact CZ2-O 3.41Å
531	I	82	Confident	66.7	Low	72 Å²	72	42.9 Å²	42.9	37%	0.369	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	126.6	-177.1	-56.7	175.6	0	0	0	109.6	I455 F471 E472 A529	I455-I531 HydrophobicContact CD1-CD1 3.76Å; I455-I531 HydrophobicContact CD1-CG1 3.99Å; I455-I531 HydrophobicContact CD1-CG2 3.88Å; F471-I531 CarbonylContact O-C 3.31Å; F471-I531 VanDerWaalsContact O-CA 3.27Å; F471-I531 WeakPolarHBondContact O-CA 2.92Å; E472-I531 HydrophobicContact CG-CG1 4.42Å; A529-I531 WeakPolarHBondContact CB-O 3.47Å; A529-I531 PolarHBondContact O-N 3.1Å
532	L	79.8	Confident	69	Low	4 Å²	4	43.5 Å²	43.5	2%	0.021	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	122.6	172.7	167	65.1	0	0	0	109.9	H470 F471 W486 I525 L534 I545	H470-L532 WeakPolarHBondContact CA-O 3.5Å; F471-L532 HydrophobicContact CB-CB 4.29Å; F471-L532 PolarHBondContact N-O 2.79Å; F471-L532 PolarHBondContact O-N 2.76Å; W486-L532 HydrophobicContact CB-CD2 4.36Å; W486-L532 HydrophobicContact CD2-CB 3.68Å; W486-L532 HydrophobicContact CD2-CD2 3.94Å; W486-L532 HydrophobicContact CD2-CG 4.38Å; W486-L532 HydrophobicContact CE3-CB 4Å; W486-L532 HydrophobicContact CE3-CD2 3.63Å; W486-L532 HydrophobicContact CE3-CG 4.45Å; W486-L532 HydrophobicContact CG-CB 4.1Å; W486-L532 HydrophobicContact CG-CD2 4.3Å; W486-L532 HydrophobicContact CH2-CB 4.11Å; W486-L532 HydrophobicContact CZ2-CB 3.82Å; W486-L532 HydrophobicContact CZ3-CB 4.2Å; W486-L532 HydrophobicContact CZ3-CD2 4.1Å; I525-L532 HydrophobicContact CB-CD1 4.45Å; I525-L532 HydrophobicContact CD1-CD1 3.56Å; I525-L532 HydrophobicContact CG2-CD1 3.91Å; L532-L534 HydrophobicContact CG-CB 4.5Å; L532-I545 HydrophobicContact CD2-CD1 4.29Å; L532-I545 HydrophobicContact CD2-CG2 3.76Å
533	Q	80	Confident	71.3	Confident	34 Å²	34	45 Å²	45	16%	0.159	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	123.7	168.4	-71.3	-177.3	-22.7	0	0	109.7	H233 L468 H470	H233-Q533 PolarHBondContact O-OE1 2.79Å; L468-Q533 HydrophobicContact CD1-CB 4.39Å; H470-Q533 PolarHBondContact NE2-NE2 2.94Å
534	L	79	Confident	73.3	Confident	13 Å²	13	44.9 Å²	44.9	7%	0.068	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	121.4	-177.3	-174.5	66.1	0	0	0	111.4	I469 F471 I488 L532 M540 I545 L603	I469-L534 PolarHBondContact N-O 2.74Å; I469-L534 PolarHBondContact O-N 3.45Å; F471-L534 HydrophobicContact CD2-CB 4.39Å; F471-L534 HydrophobicContact CE2-CB 4.21Å; F471-L534 HydrophobicContact CE2-CD2 4.19Å; I488-L534 HydrophobicContact CD1-CD1 3.61Å; I488-L534 HydrophobicContact CD1-CD2 3.75Å; I488-L534 HydrophobicContact CD1-CG 4.34Å; L532-L534 HydrophobicContact CG-CB 4.5Å; L534-M540 HydrophobicContact CD1-CE 3.73Å; L534-M540 HydrophobicContact CD1-SD 4.01Å; L534-M540 HydrophobicContact CD2-SD 3.99Å; L534-M540 HydrophobicContact CG-CE 4.41Å; L534-M540 HydrophobicContact CG-SD 4.06Å; L534-I545 HydrophobicContact CD2-CD1 3.72Å; L534-I545 HydrophobicContact CD2-CG1 4.37Å; L534-L603 HydrophobicContact CD2-CD1 4.17Å
535	T	83.9	Confident	75.3	Confident	43 Å²	43	41.4 Å²	41.4	26%	0.264	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	115.1	166.7	-55.1	0	0	0	0	108.9	T237	T237-T535 HydrophobicContact CG2-CG2 3.86Å
536	V	83.3	Confident	77.2	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.216	C	C	.	.			trans	-81.9	132.5	-169.8	-175.5	0	0	0	0	111	L463 G466 Q467 I469 V605	L463-V536 HydrophobicContact CB-CG1 4.43Å; G466-V536 PolarHBondContact N-O 2.92Å; Q467-V536 PolarHBondContact O-N 3.19Å; I469-V536 HydrophobicContact CB-CG2 4.33Å; I469-V536 HydrophobicContact CG1-CG2 3.69Å; V536-V605 HydrophobicContact CG1-CB 3.99Å; V536-V605 HydrophobicContact CG1-CG1 3.55Å; V536-V605 HydrophobicContact CG1-CG2 3.22Å
537	N	83.9	Confident	79.2	Confident	45 Å²	45	38.3 Å²	38.3	24%	0.241	21%	0.206	C	C	.	.			trans	-125.4	167.4	177.3	72.9	28.5	0	0	0	112.7	A539 M540	N537-A539 VanDerWaalsContact C-N 3.26Å; N537-A539 PolarHBondContact O-N 3.11Å; N537-A539 WeakPolarHBondContact OD1-CA 2.94Å; N537-A539 WeakPolarHBondContact OD1-CB 3Å; N537-A539 PolarHBondContact OD1-N 2.86Å; N537-M540 WeakPolarHBondContact O-CB 3.31Å; N537-M540 PolarHBondContact O-N 3.42Å; N537-M540 WeakPolarHBondContact OD1-CG 3.38Å; N537-M540 PolarHBondContact OD1-N 3.31Å
538	R	86.3	Confident	81	Confident	52 Å²	52	37.2 Å²	37.2	20%	0.196	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-56.9	-33.5	178	61.4	-172.2	56.8	-140.1	-10.1	114.5	E465 M540 H541 Y607 G608 E610	E465-R538 VanDerWaalsContact OE1-CB 3.22Å; E465-R538 WeakPolarHBondContact OE1-CB 3.45Å; E465-R538 WeakPolarHBondContact OE1-CG 3.48Å; E465-R538 IonicContact OE1-CZ 2.59Å; E465-R538 PolarHBondContact OE1-N 3.05Å; E465-R538 IonicContact OE1-NE 3.27Å; E465-R538 PolarHBondContact OE1-NE 2.96Å; E465-R538 IonicContact OE1-NH2 2.71Å; E465-R538 IonicContact OE2-CZ 2.98Å; E465-R538 IonicContact OE2-NE 3.9Å; E465-R538 PolarHBondContact OE2-NE 2.89Å; E465-R538 VanDerWaalsContact OE2-NE 3.16Å; E465-R538 IonicContact OE2-NH2 3.84Å; E465-R538 PolarHBondContact OE2-NH2 3.06Å; R538-M540 PolarHBondContact O-N 3.09Å; R538-H541 WeakPolarHBondContact O-CB 3.33Å; R538-H541 PolarHBondContact O-N 3.11Å; R538-H541 VanDerWaalsContact O-N 3.16Å; R538-Y607 HydrophobicContact CB-CD1 3.78Å; R538-Y607 HydrophobicContact CB-CD2 3.81Å; R538-Y607 HydrophobicContact CB-CE1 3.99Å; R538-Y607 HydrophobicContact CB-CE2 3.99Å; R538-Y607 HydrophobicContact CB-CG 3.7Å; R538-G608 PolarHBondContact NH2-O 2.99Å; R538-E610 WeakPolarHBondContact CD-OE2 3.49Å; R538-E610 IonicContact CZ-OE2 2.68Å; R538-E610 IonicContact NE-OE2 2.92Å; R538-E610 IonicContact NH1-OE2 3.93Å; R538-E610 PolarHBondContact NH1-OE2 2.74Å
539	A	82.2	Confident	82.6	Confident	69 Å²	69	32.2 Å²	32.2	57%	0.57	17%	0.173	S	C	*	.	G	3₁₀ helix	trans	-71.3	-15.8	177.8	0	0	0	0	0	113.4	N537 K543	N537-A539 VanDerWaalsContact C-N 3.26Å; N537-A539 PolarHBondContact O-N 3.11Å; N537-A539 WeakPolarHBondContact OD1-CA 2.94Å; N537-A539 WeakPolarHBondContact OD1-CB 3Å; N537-A539 PolarHBondContact OD1-N 2.86Å; A539-K543 WeakPolarHBondContact O-CE 3.21Å
540	M	82.2	Confident	83.5	Confident	12 Å²	12	30.2 Å²	30.2	6%	0.059	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-84.2	-9.2	172.3	-67.4	170.2	-172.2	0	0	113.5	L240 L534 N537 R538 H542 K543 L603 V605	L240-M540 HydrophobicContact CD2-CE 3.87Å; L534-M540 HydrophobicContact CD1-CE 3.73Å; L534-M540 HydrophobicContact CD1-SD 4.01Å; L534-M540 HydrophobicContact CD2-SD 3.99Å; L534-M540 HydrophobicContact CG-CE 4.41Å; L534-M540 HydrophobicContact CG-SD 4.06Å; N537-M540 WeakPolarHBondContact O-CB 3.31Å; N537-M540 PolarHBondContact O-N 3.42Å; N537-M540 WeakPolarHBondContact OD1-CG 3.38Å; N537-M540 PolarHBondContact OD1-N 3.31Å; R538-M540 PolarHBondContact O-N 3.09Å; M540-H542 PolarHBondContact O-N 3.02Å; M540-K543 WeakPolarHBondContact O-CB 3.43Å; M540-K543 WeakPolarHBondContact O-CG 3.15Å; M540-K543 PolarHBondContact O-N 3.04Å; M540-L603 HydrophobicContact CB-CD1 3.93Å; M540-L603 WeakPolarHBondContact O-CB 3.24Å; M540-V605 HydrophobicContact CB-CG2 4.47Å
541	H	86.4	Confident	83.7	Confident	33 Å²	33	28.4 Å²	28.4	15%	0.153	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	131.5	174.5	-174.2	74.2	0	0	0	110.9	R538 K543 V605 Y607 N636	R538-H541 WeakPolarHBondContact O-CB 3.33Å; R538-H541 PolarHBondContact O-N 3.11Å; R538-H541 VanDerWaalsContact O-N 3.16Å; H541-K543 PolarHBondContact O-N 2.84Å; H541-K543 VanDerWaalsContact O-N 3.14Å; H541-V605 HydrophobicContact CB-CB 4.09Å; H541-V605 HydrophobicContact CB-CG2 4.29Å; H541-V605 PolarHBondContact ND1-N 3.33Å; H541-V605 PolarHBondContact ND1-O 3.41Å; H541-Y607 HydrophobicContact CB-CE1 3.85Å; H541-Y607 AromaticContact CG-CE1 3.88Å; H541-N636 VanDerWaalsContact CE1-CG 3.49Å; H541-N636 PolarHBondContact CE1-ND2 2.68Å
542	H	85.4	Confident	83.6	Confident	79 Å²	79	26.2 Å²	26.2	37%	0.366	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	63	2.1	-173.6	-60.9	148.3	0	0	0	117.5	M540 R602 L603	M540-H542 PolarHBondContact O-N 3.02Å; H542-R602 VanDerWaalsContact CD2-CZ 3.44Å; H542-R602 PolarHBondContact CD2-NH2 2.86Å; H542-R602 PolarHBondContact NE2-NH2 3.22Å; H542-R602 VanDerWaalsContact NE2-NH2 3.19Å; H542-L603 WeakPolarHBondContact CA-O 3.29Å; H542-L603 PolarHBondContact N-O 3.39Å
543	K	83.6	Confident	83.6	Confident	51 Å²	51	26.8 Å²	26.8	22%	0.222	14%	0.138	C	C	.	.			trans	-67.4	159.1	168.6	-57.7	-66	177.1	166.9	0	110.4	I488 G489 N490 A539 M540 H541 L603	I488-K543 HydrophobicContact CG2-CB 4.12Å; G489-K543 WeakPolarHBondContact O-CA 3.31Å; N490-K543 PolarHBondContact OD1-NZ 2.64Å; A539-K543 WeakPolarHBondContact O-CE 3.21Å; M540-K543 WeakPolarHBondContact O-CB 3.43Å; M540-K543 WeakPolarHBondContact O-CG 3.15Å; M540-K543 PolarHBondContact O-N 3.04Å; H541-K543 PolarHBondContact O-N 2.84Å; H541-K543 VanDerWaalsContact O-N 3.14Å; K543-L603 PolarHBondContact O-N 3.32Å
544	R	83.1	Confident	83.4	Confident	77 Å²	77	27.2 Å²	27.2	29%	0.291	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.8	170	-64	-170.6	-174.3	-172.8	3.3	110.1	I488 G489 R546 D600 Y601	I488-R544 WeakPolarHBondContact CA-O 3.33Å; G489-R544 PolarHBondContact N-O 2.91Å; G489-R544 PolarHBondContact O-N 2.83Å; R544-R546 HydrophobicContact CB-CG 4.48Å; R544-D600 WeakPolarHBondContact CD-OD2 3.26Å; R544-D600 IonicContact NH1-OD2 3.7Å; R544-D600 PolarHBondContact NH1-OD2 2.93Å; R544-Y601 CarbonylContact C-O 3.49Å; R544-Y601 VanDerWaalsContact CA-O 3.29Å; R544-Y601 WeakPolarHBondContact CA-O 3.48Å
545	I	85.2	Confident	83	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	136.4	159.4	-59.7	178.2	0	0	0	106.6	I452 F471 W486 T487 I488 L532 L534 D600 Y601 L603	I452-I545 HydrophobicContact CD1-CG2 4.28Å; F471-I545 HydrophobicContact CD1-CD1 4.16Å; F471-I545 HydrophobicContact CD2-CD1 3.61Å; F471-I545 HydrophobicContact CE1-CD1 3.95Å; F471-I545 HydrophobicContact CE2-CD1 3.36Å; F471-I545 HydrophobicContact CG-CD1 4.01Å; F471-I545 HydrophobicContact CZ-CD1 3.55Å; W486-I545 HydrophobicContact CE3-CG2 3.54Å; W486-I545 HydrophobicContact CZ3-CG2 3.6Å; T487-I545 CarbonylContact O-C 3.56Å; T487-I545 WeakPolarHBondContact O-CA 3.28Å; I488-I545 HydrophobicContact CG1-CG1 4.32Å; L532-I545 HydrophobicContact CD2-CD1 4.29Å; L532-I545 HydrophobicContact CD2-CG2 3.76Å; L534-I545 HydrophobicContact CD2-CD1 3.72Å; L534-I545 HydrophobicContact CD2-CG1 4.37Å; I545-D600 CarbonylContact O-C 3.51Å; I545-D600 WeakPolarHBondContact O-CA 3.42Å; I545-Y601 PolarHBondContact N-O 3Å; I545-Y601 PolarHBondContact O-N 2.84Å; I545-L603 HydrophobicContact CD1-CD1 4.04Å; I545-L603 HydrophobicContact CD1-CD2 3.78Å; I545-L603 HydrophobicContact CD1-CG 4.13Å; I545-L603 HydrophobicContact CG1-CD1 3.91Å; I545-L603 HydrophobicContact CG1-CD2 4.29Å; I545-L603 HydrophobicContact CG1-CG 4.09Å
546	R	85.5	Confident	82.1	Confident	1 Å²	1	31.5 Å²	31.5	0%	0.004	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	130.2	172.3	-35.5	-174.1	-158.2	103.6	-14	109.8	D254 W486 T487 L522 R544 S599 D600	D254-R546 VanDerWaalsContact CG-CZ 3.48Å; D254-R546 VanDerWaalsContact CG-NH1 3.28Å; D254-R546 IonicContact OD1-CZ 3.43Å; D254-R546 IonicContact OD1-NH1 2.7Å; D254-R546 PolarHBondContact OD1-NH1 3.4Å; D254-R546 IonicContact OD1-NH2 2.69Å; D254-R546 PolarHBondContact OD1-NH2 2.82Å; D254-R546 IonicContact OD2-CZ 3.88Å; D254-R546 IonicContact OD2-NE 2.63Å; D254-R546 IonicContact OD2-NH1 3.98Å; D254-R546 PolarHBondContact OD2-NH1 3.01Å; D254-R546 IonicContact OD2-NH2 3.32Å; D254-R546 PolarHBondContact OD2-NH2 2.82Å; W486-R546 WeakPolarHBondContact CA-O 3.45Å; T487-R546 PolarHBondContact N-O 2.79Å; T487-R546 PolarHBondContact O-N 2.02Å; T487-R546 PolarHBondContact OG1-NH1 2.68Å; L522-R546 VanDerWaalsContact CD2-NH1 3.25Å; R544-R546 HydrophobicContact CB-CG 4.48Å; R546-S599 CarbonylContact C-O 3.48Å; R546-S599 VanDerWaalsContact CA-O 3.24Å; R546-S599 WeakPolarHBondContact CA-O 3.43Å; R546-D600 VanDerWaalsContact CD-OD1 3.27Å; R546-D600 WeakPolarHBondContact CD-OD1 3.39Å; R546-D600 WeakPolarHBondContact CG-OD1 3.3Å
547	C	87	Confident	81.2	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	127.4	169.1	170.9	0	0	0	0	108.5	I452 C473 W486 K598 S599	I452-C547 HydrophobicContact CD1-CB 4.09Å; I452-C547 HydrophobicContact CG1-CB 3.97Å; C473-C547 HydrophobicContact CB-CB 3.64Å; C473-C547 WeakPolarHBondContact CB-SG 3.4Å; C473-C547 WeakPolarHBondContact SG-CB 3.42Å; C473-C547 CovalentContact SG-SG 2.02Å; C473-C547 PolarHBondContact SG-SG 2.91Å; W486-C547 HydrophobicContact CD2-CB 4.27Å; W486-C547 HydrophobicContact CE3-CB 3.88Å; W486-C547 HydrophobicContact CH2-CB 4.12Å; W486-C547 HydrophobicContact CZ2-CB 4.44Å; W486-C547 HydrophobicContact CZ3-CB 3.81Å; C547-K598 CarbonylContact O-C 3.55Å; C547-K598 WeakPolarHBondContact O-CA 3.38Å; C547-K598 WeakPolarHBondContact O-CB 3.47Å; C547-S599 PolarHBondContact N-O 2.95Å; C547-S599 PolarHBondContact O-N 3.18Å
548	W	85.6	Confident	80.3	Confident	12 Å²	12	35.6 Å²	35.6	5%	0.045	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	129	166.4	-69.1	96.7	0	0	0	108.9	D254 D255 P256 Y484 S485 W596 K598	D254-W548 VanDerWaalsContact O-CE2 3.27Å; D254-W548 WeakPolarHBondContact O-CZ2 3.41Å; D254-W548 PolarHBondContact O-NE1 2.94Å; D254-W548 VanDerWaalsContact O-NE1 3.15Å; D255-W548 HydrophobicContact CB-CH2 3.72Å; D255-W548 HydrophobicContact CB-CZ2 4.03Å; P256-W548 HydrophobicContact CG-CD2 4.11Å; P256-W548 HydrophobicContact CG-CE3 4.12Å; P256-W548 HydrophobicContact CG-CG 4.3Å; Y484-W548 CarbonylContact C-O 3.38Å; Y484-W548 WeakPolarHBondContact CA-O 3.34Å; S485-W548 PolarHBondContact N-O 3.25Å; S485-W548 PolarHBondContact O-N 2.77Å; W548-W596 HydrophobicContact CB-CE3 3.93Å; W548-W596 HydrophobicContact CB-CZ3 4.06Å; W548-W596 HydrophobicContact CE3-CB 4.16Å; W548-W596 HydrophobicContact CZ3-CB 4.43Å; W548-K598 HydrophobicContact CD2-CB 3.8Å; W548-K598 HydrophobicContact CD2-CD 4.48Å; W548-K598 HydrophobicContact CE3-CB 3.73Å; W548-K598 HydrophobicContact CE3-CG 4.49Å; W548-K598 HydrophobicContact CG-CB 4.37Å; W548-K598 HydrophobicContact CH2-CB 4.37Å; W548-K598 HydrophobicContact CH2-CD 3.75Å; W548-K598 HydrophobicContact CH2-CG 4.3Å; W548-K598 HydrophobicContact CZ2-CB 4.4Å; W548-K598 HydrophobicContact CZ2-CD 3.59Å; W548-K598 HydrophobicContact CZ2-CG 4.46Å; W548-K598 HydrophobicContact CZ3-CB 4.04Å; W548-K598 HydrophobicContact CZ3-CD 4.24Å; W548-K598 HydrophobicContact CZ3-CG 4.31Å
549	V	86.5	Confident	79	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	127.1	173.3	-174	0	0	0	0	107.6	I447 V450 A475 T477 P482 I483 Y484 W596 V597	I447-V549 HydrophobicContact CD1-CB 4.37Å; I447-V549 HydrophobicContact CD1-CG1 4.14Å; I447-V549 WeakPolarHBondContact CD1-O 3.41Å; I447-V549 HydrophobicContact CG2-CB 4.29Å; I447-V549 HydrophobicContact CG2-CG1 4.15Å; V450-V549 HydrophobicContact CG1-CG2 3.67Å; V450-V549 HydrophobicContact CG2-CG2 4.47Å; A475-V549 HydrophobicContact CB-CB 4.5Å; A475-V549 HydrophobicContact CB-CG1 4.07Å; A475-V549 HydrophobicContact CB-CG2 4.1Å; T477-V549 HydrophobicContact CG2-CG1 3.97Å; P482-V549 HydrophobicContact CB-CG1 3.69Å; P482-V549 HydrophobicContact CG-CG1 4.32Å; I483-V549 CarbonylContact O-C 3.53Å; I483-V549 WeakPolarHBondContact O-CA 3.39Å; Y484-V549 HydrophobicContact CD1-CG2 3.91Å; Y484-V549 HydrophobicContact CE1-CG1 4.39Å; Y484-V549 HydrophobicContact CE1-CG2 3.85Å; V549-W596 WeakPolarHBondContact O-CA 3.33Å; V549-V597 PolarHBondContact N-O 2.91Å; V549-V597 PolarHBondContact O-N 3.15Å
550	G	82.4	Confident	77.9	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	142.1	179.4	0	0	0	0	0	111.9	P482 I483 M594 T595 W596	P482-G550 CarbonylContact C-O 3.44Å; P482-G550 VanDerWaalsContact CA-O 3.26Å; P482-G550 WeakPolarHBondContact CA-O 3.15Å; P482-G550 WeakPolarHBondContact CB-O 3.24Å; I483-G550 PolarHBondContact N-O 2.91Å; I483-G550 PolarHBondContact O-N 3.42Å; G550-M594 VanDerWaalsContact C-CE 3.41Å; G550-T595 CarbonylContact C-O 3.59Å; G550-T595 VanDerWaalsContact CA-O 3.3Å; G550-T595 WeakPolarHBondContact CA-O 3.44Å; G550-W596 VanDerWaalsContact CA-CE3 3.48Å
551	V	84.4	Confident	76.6	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	147.2	170.8	-63.9	0	0	0	0	111.8	M445 I447 T477 P482 M594 T595	M445-V551 HydrophobicContact CB-CG2 4.38Å; I447-V551 HydrophobicContact CD1-CB 4.32Å; I447-V551 HydrophobicContact CD1-CG1 3.9Å; I447-V551 HydrophobicContact CD1-CG2 3.9Å; I447-V551 HydrophobicContact CG1-CB 4.26Å; I447-V551 HydrophobicContact CG1-CG1 3.67Å; I447-V551 HydrophobicContact CG1-CG2 3.68Å; T477-V551 HydrophobicContact CG2-CG1 4.11Å; P482-V551 HydrophobicContact CB-CG1 4.09Å; V551-M594 WeakPolarHBondContact O-CG 3.34Å; V551-T595 HydrophobicContact CG2-CG2 4.26Å; V551-T595 PolarHBondContact N-O 3.17Å; V551-T595 PolarHBondContact O-N 3.28Å; V551-T595 VanDerWaalsContact O-N 3.16Å
552	E	80	Confident	74.9	Confident	25 Å²	25	42.5 Å²	42.5	12%	0.117	21%	0.209	C	C	.	.			trans	-155.7	161.6	177	-171.6	48.4	-96	0	0	109.3	M445 P479 L556 L557 M594	M445-E552 VanDerWaalsContact SD-C 3.59Å; P479-E552 VanDerWaalsContact CG-O 3.31Å; P479-E552 WeakPolarHBondContact CG-O 3.42Å; E552-L556 HydrophobicContact CG-CB 4.08Å; E552-L556 HydrophobicContact CG-CD2 3.53Å; E552-L556 HydrophobicContact CG-CG 4.4Å; E552-L557 HydrophobicContact CB-CD1 4.2Å; E552-M594 HydrophobicContact CB-CE 4.09Å; E552-M594 HydrophobicContact CB-CG 4.22Å
553	A	79.6	Confident	73.1	Confident	17 Å²	17	40 Å²	40	14%	0.14	20%	0.202	C	C	.	.			trans	-53.8	132	178.9	0	0	0	0	0	111.3	W311 M445 E555 L556 L557	W311-A553 HydrophobicContact CB-CB 3.73Å; W311-A553 HydrophobicContact CG-CB 3.84Å; M445-A553 PolarHBondContact SD-N 3.25Å; M445-A553 VanDerWaalsContact SD-N 3.41Å; A553-E555 VanDerWaalsContact C-N 3.28Å; A553-E555 PolarHBondContact O-N 3.44Å; A553-E555 VanDerWaalsContact O-N 3.11Å; A553-L556 WeakPolarHBondContact O-CA 3.33Å; A553-L556 PolarHBondContact O-N 2.74Å; A553-L557 PolarHBondContact O-N 3.43Å
554	P	75.6	Confident	71.2	Confident	43 Å²	43	40.7 Å²	40.7	28%	0.279	21%	0.213	S	C	.	.	H	α-helix	trans	-54	-38	-172.4	-29.8	36.3	0	0	0	114.9	W311 P479 L556 L557 E558	W311-P554 HydrophobicContact CH2-CG 4.17Å; W311-P554 HydrophobicContact CZ2-CG 3.69Å; P479-P554 HydrophobicContact CB-CG 3.97Å; P479-P554 HydrophobicContact CG-CG 4.1Å; P554-L556 VanDerWaalsContact C-N 3.28Å; P554-L556 PolarHBondContact O-N 3.26Å; P554-L557 PolarHBondContact O-N 3.03Å; P554-E558 WeakPolarHBondContact O-CB 3.12Å; P554-E558 PolarHBondContact O-N 2.81Å
555	E	70.1	Confident	69.5	Low	95 Å²	95	38.7 Å²	38.7	44%	0.444	21%	0.208	S	C	.	.	H	α-helix	trans	-66.6	-26.4	177.8	-60.4	176.5	-170.4	0	0	113.9	A553 K559	A553-E555 VanDerWaalsContact C-N 3.28Å; A553-E555 PolarHBondContact O-N 3.44Å; A553-E555 VanDerWaalsContact O-N 3.11Å; E555-K559 VanDerWaalsContact O-CD 3.3Å; E555-K559 WeakPolarHBondContact O-CD 2.99Å; E555-K559 WeakPolarHBondContact O-CE 3.28Å; E555-K559 WeakPolarHBondContact O-CG 3.29Å
556	L	66.8	Low	67.5	Low	51 Å²	51	44.4 Å²	44.4	27%	0.267	24%	0.235	S	C	.	.	H	α-helix	trans	-87.2	-36.3	173.1	-157.4	94.2	0	0	0	110.3	E552 A553 P554 K559 I560 K590	E552-L556 HydrophobicContact CG-CB 4.08Å; E552-L556 HydrophobicContact CG-CD2 3.53Å; E552-L556 HydrophobicContact CG-CG 4.4Å; A553-L556 WeakPolarHBondContact O-CA 3.33Å; A553-L556 PolarHBondContact O-N 2.74Å; P554-L556 VanDerWaalsContact C-N 3.28Å; P554-L556 PolarHBondContact O-N 3.26Å; L556-K559 WeakPolarHBondContact O-CB 3.24Å; L556-K559 PolarHBondContact O-N 3.41Å; L556-I560 HydrophobicContact CD2-CD1 4.19Å; L556-I560 WeakPolarHBondContact O-CG1 3.28Å; L556-I560 PolarHBondContact O-N 3.41Å; L556-I560 VanDerWaalsContact O-N 3.09Å; L556-K590 HydrophobicContact CD1-CD 4.41Å; L556-K590 HydrophobicContact CD2-CB 4.44Å; L556-K590 HydrophobicContact CD2-CD 4.34Å; L556-K590 HydrophobicContact CD2-CG 4.3Å; L556-K590 HydrophobicContact CG-CD 4.42Å
557	L	63.8	Low	65.3	Low	12 Å²	12	46.6 Å²	46.6	6%	0.063	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-45.9	178.4	-162.2	74.7	0	0	0	111.7	T481 I483 E552 A553 P554 K559 I560 T561 M594	T481-L557 WeakPolarHBondContact O-CD2 3.31Å; I483-L557 HydrophobicContact CD1-CD1 3.61Å; I483-L557 HydrophobicContact CG1-CD1 3.93Å; E552-L557 HydrophobicContact CB-CD1 4.2Å; A553-L557 PolarHBondContact O-N 3.43Å; P554-L557 PolarHBondContact O-N 3.03Å; L557-K559 PolarHBondContact O-N 2.81Å; L557-I560 CarbonylContact O-C 3.58Å; L557-I560 WeakPolarHBondContact O-CA 2.99Å; L557-I560 WeakPolarHBondContact O-CB 3.26Å; L557-I560 PolarHBondContact O-N 3.35Å; L557-T561 PolarHBondContact O-N 3.15Å; L557-T561 PolarHBondContact O-OG1 3.23Å; L557-M594 HydrophobicContact CD1-CE 3.77Å
558	E	64.2	Low	63	Low	119 Å²	119	48 Å²	48	56%	0.556	27%	0.266	S	S	*	.	H	α-helix	trans	-57.2	-38.4	174.9	-175.5	178.4	-179.9	0	0	111.8	P554 I560 T561 N562	P554-E558 WeakPolarHBondContact O-CB 3.12Å; P554-E558 PolarHBondContact O-N 2.81Å; E558-I560 VanDerWaalsContact C-N 3.29Å; E558-I560 PolarHBondContact O-N 3.05Å; E558-T561 WeakPolarHBondContact CA-OG1 3.26Å; E558-T561 PolarHBondContact O-N 3.27Å; E558-T561 PolarHBondContact O-OG1 3.3Å; E558-N562 WeakPolarHBondContact CG-ND2 3.46Å; E558-N562 VanDerWaalsContact O-CB 3.24Å; E558-N562 WeakPolarHBondContact O-CB 3.38Å; E558-N562 PolarHBondContact O-N 3.39Å; E558-N562 PolarHBondContact O-ND2 2.78Å
559	K	60.2	Low	61	Low	119 Å²	119	49.2 Å²	49.2	52%	0.517	27%	0.273	S	S	.	.	H	α-helix	trans	-69.4	-24.9	174.8	-65.9	170.2	-174.2	167.4	0	112.9	E555 L556 L557 A563	E555-K559 VanDerWaalsContact O-CD 3.3Å; E555-K559 WeakPolarHBondContact O-CD 2.99Å; E555-K559 WeakPolarHBondContact O-CE 3.28Å; E555-K559 WeakPolarHBondContact O-CG 3.29Å; L556-K559 WeakPolarHBondContact O-CB 3.24Å; L556-K559 PolarHBondContact O-N 3.41Å; L557-K559 PolarHBondContact O-N 2.81Å; K559-A563 WeakPolarHBondContact O-CB 3.21Å
560	I	57.9	Low	59	Low	1 Å²	1	51.6 Å²	51.6	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-83.4	-40.4	174.8	-66.2	164.8	0	0	0	110.6	I483 L556 L557 E558 A563 L565 L587 K590 L591	I483-I560 HydrophobicContact CD1-CG2 4.37Å; L556-I560 HydrophobicContact CD2-CD1 4.19Å; L556-I560 WeakPolarHBondContact O-CG1 3.28Å; L556-I560 PolarHBondContact O-N 3.41Å; L556-I560 VanDerWaalsContact O-N 3.09Å; L557-I560 CarbonylContact O-C 3.58Å; L557-I560 WeakPolarHBondContact O-CA 2.99Å; L557-I560 WeakPolarHBondContact O-CB 3.26Å; L557-I560 PolarHBondContact O-N 3.35Å; E558-I560 VanDerWaalsContact C-N 3.29Å; E558-I560 PolarHBondContact O-N 3.05Å; I560-A563 VanDerWaalsContact O-O 3.12Å; I560-L565 HydrophobicContact CG2-CD1 4.07Å; I560-L587 HydrophobicContact CG1-CD2 4.4Å; I560-K590 HydrophobicContact CD1-CB 4.33Å; I560-L591 HydrophobicContact CG2-CD2 4.41Å
561	T	56	Low	57.3	Low	73 Å²	73	56.2 Å²	56.2	45%	0.448	31%	0.314	S	S	.	.	H	α-helix	trans	-73.1	-38.6	-179.3	54.5	0	0	0	0	112.5	L557 E558	L557-T561 PolarHBondContact O-N 3.15Å; L557-T561 PolarHBondContact O-OG1 3.23Å; E558-T561 WeakPolarHBondContact CA-OG1 3.26Å; E558-T561 PolarHBondContact O-N 3.27Å; E558-T561 PolarHBondContact O-OG1 3.3Å
562	N	50.4	Low	55.4	Low	118 Å²	118	64.5 Å²	64.5	63%	0.631	35%	0.351	S	S	*	.	H	α-helix	trans	-74.3	-29	179.5	-64.7	-5.6	0	0	0	111.8	E558 S564	E558-N562 WeakPolarHBondContact CG-ND2 3.46Å; E558-N562 VanDerWaalsContact O-CB 3.24Å; E558-N562 WeakPolarHBondContact O-CB 3.38Å; E558-N562 PolarHBondContact O-N 3.39Å; E558-N562 PolarHBondContact O-ND2 2.78Å; N562-S564 VanDerWaalsContact C-N 3.27Å; N562-S564 PolarHBondContact O-N 3.15Å
563	A	46.5	Very low	53.5	Low	25 Å²	25	69.1 Å²	69.1	21%	0.207	38%	0.376	C	S	.	.	S	Bend	trans	-77.1	79.3	167.4	0	0	0	0	0	109.3	K559 I560 L565 L587	K559-A563 WeakPolarHBondContact O-CB 3.21Å; I560-A563 VanDerWaalsContact O-O 3.12Å; A563-L565 PolarHBondContact O-N 2.83Å; A563-L587 HydrophobicContact CB-CD1 4.22Å; A563-L587 HydrophobicContact CB-CD2 4.25Å
564	S	45	Very low	52	Low	66 Å²	66	74.7 Å²	74.7	46%	0.462	41%	0.414	S	S	.	.			trans	-42.8	110.7	-168.4	68.8	0	0	0	0	112.6	N562 Q566 G567 V568	N562-S564 VanDerWaalsContact C-N 3.27Å; N562-S564 PolarHBondContact O-N 3.15Å; S564-Q566 PolarHBondContact O-N 3.47Å; S564-G567 WeakPolarHBondContact O-CA 3.3Å; S564-G567 PolarHBondContact O-N 2.86Å; S564-G567 WeakPolarHBondContact OG-CA 3.33Å; S564-G567 PolarHBondContact OG-N 2.82Å; S564-V568 PolarHBondContact O-N 2.91Å
565	L	47.6	Very low	50.5	Low	36 Å²	36	77.8 Å²	77.8	19%	0.188	43%	0.432	C	S	.	.	H	α-helix	trans	-57	-35.2	-179	-97.6	146.8	0	0	0	111.1	M527 I560 A563 L569 L591	M527-L565 HydrophobicContact CE-CD1 3.53Å; M527-L565 HydrophobicContact CE-CD2 4.29Å; M527-L565 HydrophobicContact SD-CD1 3.86Å; M527-L565 HydrophobicContact SD-CD2 3.93Å; M527-L565 HydrophobicContact SD-CG 4.36Å; I560-L565 HydrophobicContact CG2-CD1 4.07Å; A563-L565 PolarHBondContact O-N 2.83Å; L565-L569 HydrophobicContact CD2-CD1 3.64Å; L565-L569 HydrophobicContact CD2-CG 4.27Å; L565-L569 VanDerWaalsContact O-CB 3.22Å; L565-L569 WeakPolarHBondContact O-CB 3.17Å; L565-L569 WeakPolarHBondContact O-CG 3.28Å; L565-L569 PolarHBondContact O-N 2.91Å; L565-L591 HydrophobicContact CD2-CD1 4.22Å
566	Q	42.6	Very low	49.4	Very low	120 Å²	120	76.8 Å²	76.8	56%	0.561	44%	0.435	S	S	*	.	H	α-helix	trans	-64.2	-40.2	170.2	-71.8	-173.8	-58.2	0	0	113.4	Q526 S564 S570	Q526-Q566 VanDerWaalsContact NE2-CD 3.32Å; Q526-Q566 VanDerWaalsContact NE2-OE1 3.13Å; S564-Q566 PolarHBondContact O-N 3.47Å; Q566-S570 WeakPolarHBondContact O-CA 3.45Å; Q566-S570 WeakPolarHBondContact O-CB 3.32Å; Q566-S570 PolarHBondContact O-N 2.86Å
567	G	38.7	Very low	48.8	Very low	46 Å²	46	80.4 Å²	80.4	47%	0.474	45%	0.45	S	S	.	.	H	α-helix	trans	-75.8	-33.6	179.7	0	0	0	0	0	114.4	S564	S564-G567 WeakPolarHBondContact O-CA 3.3Å; S564-G567 PolarHBondContact O-N 2.86Å; S564-G567 WeakPolarHBondContact OG-CA 3.33Å; S564-G567 PolarHBondContact OG-N 2.82Å
568	V	40.1	Very low	48.2	Very low	29 Å²	29	84 Å²	84	18%	0.176	48%	0.477	C	S	.	.	H	α-helix	trans	-90	-19.8	-176.9	-170.7	0	0	0	0	113	S564 L583 R584 L587	S564-V568 PolarHBondContact O-N 2.91Å; V568-L583 HydrophobicContact CG2-CD2 4.34Å; V568-R584 HydrophobicContact CG1-CB 4.38Å; V568-L587 HydrophobicContact CB-CD1 4.16Å; V568-L587 HydrophobicContact CG1-CD1 3.73Å; V568-L587 HydrophobicContact CG2-CD1 4.25Å
569	L	43.4	Very low	47.9	Very low	38 Å²	38	82.1 Å²	82.1	20%	0.199	47%	0.47	C	S	.	.	H	α-helix	trans	-98.7	-31	172.4	-58.8	-178.5	0	0	0	113.7	I262 L565 N571 R584	I262-L569 HydrophobicContact CD1-CD2 3.73Å; I262-L569 HydrophobicContact CG1-CD2 4.04Å; I262-L569 HydrophobicContact CG2-CD2 4.02Å; L565-L569 HydrophobicContact CD2-CD1 3.64Å; L565-L569 HydrophobicContact CD2-CG 4.27Å; L565-L569 VanDerWaalsContact O-CB 3.22Å; L565-L569 WeakPolarHBondContact O-CB 3.17Å; L565-L569 WeakPolarHBondContact O-CG 3.28Å; L565-L569 PolarHBondContact O-N 2.91Å; L569-N571 PolarHBondContact O-N 3.19Å; L569-R584 PolarHBondContact O-NH2 3.49Å
570	S	44.3	Very low	47.4	Very low	51 Å²	51	78.5 Å²	78.5	36%	0.357	46%	0.459	S	S	.	.	S	Bend	trans	-63.2	127.5	171.7	178.6	0	0	0	0	109.9	Q566 K572	Q566-S570 WeakPolarHBondContact O-CA 3.45Å; Q566-S570 WeakPolarHBondContact O-CB 3.32Å; Q566-S570 PolarHBondContact O-N 2.86Å; S570-K572 PolarHBondContact O-N 3.22Å
571	N	45.4	Very low	47.5	Very low	96 Å²	96	87.6 Å²	87.6	51%	0.513	49%	0.494	S	S	.	.			trans	-80.8	51	-178.1	-149.3	21.6	0	0	0	110.8	N265 L569	N265-N571 PolarHBondContact O-ND2 3.22Å; N265-N571 VanDerWaalsContact O-ND2 3.13Å; L569-N571 PolarHBondContact O-N 3.19Å
572	K	44.9	Very low	47.7	Very low	175 Å²	175	91 Å²	91	76%	0.761	50%	0.504	S	S	*	.			trans	-85	-20.7	-159	-125.2	177.7	-176.5	178.8	0	115.8	S570	S570-K572 PolarHBondContact O-N 3.22Å
573	D	41.6	Very low	47.9	Very low	122 Å²	122	88.6 Å²	88.6	65%	0.652	49%	0.492	S	S	*	.			trans	-135.5	121.5	177.1	-74.9	-56.8	0	0	0	111.1	T575	D573-T575 PolarHBondContact O-N 3.27Å
574	S	46.4	Very low	48.3	Very low	133 Å²	133	89.8 Å²	89.8	93%	0.93	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	11.8	174.6	61.6	0	0	0	0	113.7
575	T	44.7	Very low	49.1	Very low	109 Å²	109	90.2 Å²	90.2	67%	0.669	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116	4.4	-170.1	57.3	0	0	0	0	113.7	D573 E577	D573-T575 PolarHBondContact O-N 3.27Å; T575-E577 PolarHBondContact O-N 3.1Å
576	C	47.9	Very low	49.6	Very low	73 Å²	73	91 Å²	91	49%	0.493	50%	0.497	S	S	.	.			trans	-76.4	118.5	-179.2	-153.3	0	0	0	0	112.1	C580	C576-C580 HydrophobicContact CB-CB 3.58Å; C576-C580 WeakPolarHBondContact CB-SG 3.43Å; C576-C580 WeakPolarHBondContact SG-CB 3.04Å; C576-C580 CovalentContact SG-SG 2.02Å; C576-C580 PolarHBondContact SG-SG 3.12Å
577	E	54.4	Low	50.3	Low	127 Å²	127	86.2 Å²	86.2	59%	0.593	48%	0.475	S	S	*	.			trans	-59.6	176.9	175.5	-79	171.9	106.1	0	0	112.5	K288 T575 D579 C580	K288-E577 IonicContact NZ-OE2 3.14Å; K288-E577 PolarHBondContact NZ-OE2 2.76Å; T575-E577 PolarHBondContact O-N 3.1Å; E577-D579 PolarHBondContact O-N 3.14Å; E577-C580 PolarHBondContact O-N 3.45Å; E577-C580 VanDerWaalsContact O-N 3.13Å
578	S	51.2	Low	51.3	Low	89 Å²	89	87.9 Å²	87.9	62%	0.622	47%	0.467	S	S	*	.	H	α-helix	trans	-39.1	-37.1	-176.5	39.6	0	0	0	0	115.1	C580 R581 Q582	S578-C580 VanDerWaalsContact C-N 3.34Å; S578-C580 PolarHBondContact O-N 3.19Å; S578-R581 WeakPolarHBondContact O-CB 3.41Å; S578-R581 PolarHBondContact O-N 2.93Å; S578-Q582 PolarHBondContact O-N 3.16Å
579	D	55.9	Low	52.3	Low	78 Å²	78	93.2 Å²	93.2	42%	0.417	49%	0.487	S	S	.	.	H	α-helix	trans	-67.2	-34	-168.5	-51.1	-4.8	0	0	0	111.5	L291 E577 R581 Q582 L583	L291-D579 HydrophobicContact CD2-CB 4.3Å; E577-D579 PolarHBondContact O-N 3.14Å; D579-R581 VanDerWaalsContact C-N 3.3Å; D579-R581 PolarHBondContact O-N 2.95Å; D579-Q582 PolarHBondContact O-N 2.88Å; D579-L583 WeakPolarHBondContact O-CB 3.46Å; D579-L583 PolarHBondContact O-N 3.06Å
580	C	51.6	Low	53.4	Low	43 Å²	43	94.1 Å²	94.1	29%	0.291	49%	0.49	S	S	.	.	H	α-helix	trans	-61.1	-38.6	171.9	-94.7	0	0	0	0	112.1	C576 E577 S578 R584	C576-C580 HydrophobicContact CB-CB 3.58Å; C576-C580 WeakPolarHBondContact CB-SG 3.43Å; C576-C580 WeakPolarHBondContact SG-CB 3.04Å; C576-C580 CovalentContact SG-SG 2.02Å; C576-C580 PolarHBondContact SG-SG 3.12Å; E577-C580 PolarHBondContact O-N 3.45Å; E577-C580 VanDerWaalsContact O-N 3.13Å; S578-C580 VanDerWaalsContact C-N 3.34Å; S578-C580 PolarHBondContact O-N 3.19Å; C580-R584 WeakPolarHBondContact O-CB 3.41Å; C580-R584 PolarHBondContact O-N 3.24Å
581	R	58.2	Low	54.3	Low	192 Å²	192	92.7 Å²	92.7	73%	0.725	48%	0.478	S	S	*	.	H	α-helix	trans	-69.6	-38.3	179.7	-170.4	177.8	-179.5	-177.8	-1.5	110.8	S578 D579 N585	S578-R581 WeakPolarHBondContact O-CB 3.41Å; S578-R581 PolarHBondContact O-N 2.93Å; D579-R581 VanDerWaalsContact C-N 3.3Å; D579-R581 PolarHBondContact O-N 2.95Å; R581-N585 WeakPolarHBondContact O-CB 3.44Å; R581-N585 PolarHBondContact O-N 3.5Å; R581-N585 PolarHBondContact O-ND2 2.92Å
582	Q	61.3	Low	55.2	Low	144 Å²	144	93.2 Å²	93.2	67%	0.673	48%	0.476	S	S	*	.	H	α-helix	trans	-68.4	-43.9	175.4	-168.5	173	4.2	0	0	111.7	S578 D579 N585 S586	S578-Q582 PolarHBondContact O-N 3.16Å; D579-Q582 PolarHBondContact O-N 2.88Å; Q582-N585 PolarHBondContact O-N 2.96Å; Q582-S586 WeakPolarHBondContact O-CB 3.34Å; Q582-S586 PolarHBondContact O-N 2.8Å
583	L	54.3	Low	56.2	Low	69 Å²	69	89.6 Å²	89.6	36%	0.361	46%	0.464	S	S	.	.	H	α-helix	trans	-61.5	-46.9	175	-176.4	65	0	0	0	111.7	V568 D579 N585 S586 L587	V568-L583 HydrophobicContact CG2-CD2 4.34Å; D579-L583 WeakPolarHBondContact O-CB 3.46Å; D579-L583 PolarHBondContact O-N 3.06Å; L583-N585 VanDerWaalsContact C-N 3.32Å; L583-N585 PolarHBondContact O-N 2.84Å; L583-S586 WeakPolarHBondContact O-CB 2.83Å; L583-S586 PolarHBondContact O-N 3.41Å; L583-S586 VanDerWaalsContact O-N 3.15Å; L583-L587 HydrophobicContact CD1-CD1 4.43Å; L583-L587 HydrophobicContact CG-CD1 4.14Å; L583-L587 PolarHBondContact O-N 3.08Å
584	R	54.7	Low	57.7	Low	50 Å²	50	83.9 Å²	83.9	19%	0.189	43%	0.434	C	S	.	.	H	α-helix	trans	-60.6	-40.1	176	-166.6	178.4	-163.8	142.6	3.2	111.7	V568 L569 C580 R588	V568-R584 HydrophobicContact CG1-CB 4.38Å; L569-R584 PolarHBondContact O-NH2 3.49Å; C580-R584 WeakPolarHBondContact O-CB 3.41Å; C580-R584 PolarHBondContact O-N 3.24Å; R584-R588 VanDerWaalsContact O-CB 3.3Å; R584-R588 WeakPolarHBondContact O-CB 3.46Å; R584-R588 WeakPolarHBondContact O-CD 3.31Å; R584-R588 WeakPolarHBondContact O-CG 3.22Å; R584-R588 PolarHBondContact O-N 2.95Å
585	N	61	Low	59.4	Low	75 Å²	75	78.9 Å²	78.9	40%	0.401	40%	0.398	S	S	.	.	H	α-helix	trans	-68.9	-36.4	174.6	-74.2	-8.3	0	0	0	112.7	R581 Q582 L583 R588 K589	R581-N585 WeakPolarHBondContact O-CB 3.44Å; R581-N585 PolarHBondContact O-N 3.5Å; R581-N585 PolarHBondContact O-ND2 2.92Å; Q582-N585 PolarHBondContact O-N 2.96Å; L583-N585 VanDerWaalsContact C-N 3.32Å; L583-N585 PolarHBondContact O-N 2.84Å; N585-R588 PolarHBondContact OD1-NH1 2.99Å; N585-K589 PolarHBondContact O-N 3.22Å
586	S	58.7	Low	61.1	Low	53 Å²	53	74.3 Å²	74.3	37%	0.371	37%	0.368	S	S	.	.	H	α-helix	trans	-64.2	-45	174	-169	0	0	0	0	111.6	Q582 L583 K589 K590	Q582-S586 WeakPolarHBondContact O-CB 3.34Å; Q582-S586 PolarHBondContact O-N 2.8Å; L583-S586 WeakPolarHBondContact O-CB 2.83Å; L583-S586 PolarHBondContact O-N 3.41Å; L583-S586 VanDerWaalsContact O-N 3.15Å; S586-K589 PolarHBondContact O-N 3.1Å; S586-K590 WeakPolarHBondContact O-CG 3.29Å; S586-K590 PolarHBondContact O-N 3.04Å; S586-K590 VanDerWaalsContact O-N 3.09Å
587	L	57.7	Low	63	Low	19 Å²	19	73.6 Å²	73.6	10%	0.099	36%	0.361	C	S	.	.	H	α-helix	trans	-66.9	-42.4	175.4	-72.1	165	0	0	0	112.2	I560 A563 V568 L583 K589 K590 L591	I560-L587 HydrophobicContact CG1-CD2 4.4Å; A563-L587 HydrophobicContact CB-CD1 4.22Å; A563-L587 HydrophobicContact CB-CD2 4.25Å; V568-L587 HydrophobicContact CB-CD1 4.16Å; V568-L587 HydrophobicContact CG1-CD1 3.73Å; V568-L587 HydrophobicContact CG2-CD1 4.25Å; L583-L587 HydrophobicContact CD1-CD1 4.43Å; L583-L587 HydrophobicContact CG-CD1 4.14Å; L583-L587 PolarHBondContact O-N 3.08Å; L587-K589 VanDerWaalsContact C-N 3.3Å; L587-K589 PolarHBondContact O-N 3.38Å; L587-K590 PolarHBondContact O-N 3.04Å; L587-L591 WeakPolarHBondContact O-CG 3.44Å; L587-L591 PolarHBondContact O-N 2.71Å
588	R	58.8	Low	64.6	Low	81 Å²	81	71.6 Å²	71.6	31%	0.306	35%	0.351	S	S	.	.	H	α-helix	trans	-52.2	-47.5	172	-82.6	163.5	166.6	178.9	-12.6	111.7	I262 D263 R584 N585 K592	I262-R588 HydrophobicContact CD1-CG 3.77Å; D263-R588 IonicContact OD1-NH2 2.75Å; D263-R588 PolarHBondContact OD1-NH2 2.66Å; R584-R588 VanDerWaalsContact O-CB 3.3Å; R584-R588 WeakPolarHBondContact O-CB 3.46Å; R584-R588 WeakPolarHBondContact O-CD 3.31Å; R584-R588 WeakPolarHBondContact O-CG 3.22Å; R584-R588 PolarHBondContact O-N 2.95Å; N585-R588 PolarHBondContact OD1-NH1 2.99Å; R588-K592 PolarHBondContact O-N 2.96Å
589	K	63	Low	66.4	Low	140 Å²	140	68.6 Å²	68.6	61%	0.609	33%	0.33	S	S	*	.	H	α-helix	trans	-63	-49.1	178	-170.3	175.1	178.7	-179.5	0	111.3	N585 S586 L587 L591 K592 D593	N585-K589 PolarHBondContact O-N 3.22Å; S586-K589 PolarHBondContact O-N 3.1Å; L587-K589 VanDerWaalsContact C-N 3.3Å; L587-K589 PolarHBondContact O-N 3.38Å; K589-L591 PolarHBondContact O-N 2.98Å; K589-K592 WeakPolarHBondContact O-CB 3.41Å; K589-K592 PolarHBondContact O-N 3.48Å; K589-K592 VanDerWaalsContact O-N 3.14Å; K589-D593 PolarHBondContact O-N 3.43Å; K589-D593 VanDerWaalsContact O-N 3.15Å
590	K	65.2	Low	68	Low	58 Å²	58	67.5 Å²	67.5	25%	0.252	32%	0.324	S	S	.	.	H	α-helix	trans	-60.9	-39	179	-70.4	175.8	-179.1	179.4	0	113.8	L556 I560 S586 L587 K592 D593 M594	L556-K590 HydrophobicContact CD1-CD 4.41Å; L556-K590 HydrophobicContact CD2-CB 4.44Å; L556-K590 HydrophobicContact CD2-CD 4.34Å; L556-K590 HydrophobicContact CD2-CG 4.3Å; L556-K590 HydrophobicContact CG-CD 4.42Å; I560-K590 HydrophobicContact CD1-CB 4.33Å; S586-K590 WeakPolarHBondContact O-CG 3.29Å; S586-K590 PolarHBondContact O-N 3.04Å; S586-K590 VanDerWaalsContact O-N 3.09Å; L587-K590 PolarHBondContact O-N 3.04Å; K590-K592 VanDerWaalsContact C-N 3.31Å; K590-K592 PolarHBondContact O-N 3.41Å; K590-D593 PolarHBondContact O-N 3.05Å; K590-M594 PolarHBondContact O-N 2.86Å
591	L	62.9	Low	69.6	Low	20 Å²	20	68.9 Å²	68.9	11%	0.105	32%	0.323	C	S	.	.	H	α-helix	trans	-67.8	-31	176.7	-71.8	168.2	0	0	0	112.7	I560 L565 L587 K589 M594 W596	I560-L591 HydrophobicContact CG2-CD2 4.41Å; L565-L591 HydrophobicContact CD2-CD1 4.22Å; L587-L591 WeakPolarHBondContact O-CG 3.44Å; L587-L591 PolarHBondContact O-N 2.71Å; K589-L591 PolarHBondContact O-N 2.98Å; L591-M594 WeakPolarHBondContact O-CB 3.45Å; L591-W596 PolarHBondContact O-NE1 3.29Å
592	K	63.9	Low	71.1	Confident	108 Å²	108	64.9 Å²	64.9	47%	0.47	31%	0.308	S	S	.	.	H	α-helix	trans	-71.2	-33	175.1	-167.8	173.8	-174.4	177.3	0	112.4	E259 R588 K589 K590 M594	E259-K592 IonicContact OE1-NZ 3.45Å; E259-K592 PolarHBondContact OE1-NZ 2.71Å; R588-K592 PolarHBondContact O-N 2.96Å; K589-K592 WeakPolarHBondContact O-CB 3.41Å; K589-K592 PolarHBondContact O-N 3.48Å; K589-K592 VanDerWaalsContact O-N 3.14Å; K590-K592 VanDerWaalsContact C-N 3.31Å; K590-K592 PolarHBondContact O-N 3.41Å; K592-M594 VanDerWaalsContact C-N 3.35Å
593	D	66.7	Low	72.2	Confident	98 Å²	98	58 Å²	58	52%	0.524	28%	0.276	S	S	.	.	H	α-helix	trans	-77.7	-19.1	179.6	-63.4	-29.3	0	0	0	113.2	K589 K590	K589-D593 PolarHBondContact O-N 3.43Å; K589-D593 VanDerWaalsContact O-N 3.15Å; K590-D593 PolarHBondContact O-N 3.05Å
594	M	73.6	Confident	73.8	Confident	3 Å²	3	59.7 Å²	59.7	2%	0.015	28%	0.282	C	S	.	.	S	Bend	trans	-65.1	146	-176.9	-174.2	167.1	-161.8	0	0	114	I483 G550 V551 E552 L557 K590 L591 K592 W596	I483-M594 HydrophobicContact CB-CE 4.05Å; I483-M594 HydrophobicContact CD1-CE 3.98Å; I483-M594 HydrophobicContact CG1-CE 4.18Å; G550-M594 VanDerWaalsContact C-CE 3.41Å; V551-M594 WeakPolarHBondContact O-CG 3.34Å; E552-M594 HydrophobicContact CB-CE 4.09Å; E552-M594 HydrophobicContact CB-CG 4.22Å; L557-M594 HydrophobicContact CD1-CE 3.77Å; K590-M594 PolarHBondContact O-N 2.86Å; L591-M594 WeakPolarHBondContact O-CB 3.45Å; K592-M594 VanDerWaalsContact C-N 3.35Å; M594-W596 HydrophobicContact CG-CZ2 4.47Å; M594-W596 VanDerWaalsContact O-CD1 3.3Å; M594-W596 PolarHBondContact O-N 2.83Å; M594-W596 HydrophobicContact SD-CH2 4.39Å; M594-W596 HydrophobicContact SD-CZ2 3.67Å
595	T	82	Confident	75.4	Confident	27 Å²	27	57.3 Å²	57.3	17%	0.166	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	105.3	-179.6	-60.7	0	0	0	0	111	V313 I447 G550 V551	V313-T595 HydrophobicContact CG1-CG2 4.25Å; V313-T595 VanDerWaalsContact CG2-OG1 3.28Å; V313-T595 WeakPolarHBondContact CG2-OG1 3.48Å; I447-T595 WeakPolarHBondContact CD1-O 3.08Å; G550-T595 CarbonylContact C-O 3.59Å; G550-T595 VanDerWaalsContact CA-O 3.3Å; G550-T595 WeakPolarHBondContact CA-O 3.44Å; V551-T595 HydrophobicContact CG2-CG2 4.26Å; V551-T595 PolarHBondContact N-O 3.17Å; V551-T595 PolarHBondContact O-N 3.28Å; V551-T595 VanDerWaalsContact O-N 3.16Å
596	W	81	Confident	76.9	Confident	14 Å²	14	54.8 Å²	54.8	5%	0.053	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	140.8	178.9	-61	90.6	0	0	0	113.8	P256 K257 I483 M527 W548 V549 G550 L591 M594	P256-W596 HydrophobicContact CB-CD2 4.49Å; P256-W596 HydrophobicContact CB-CZ2 4.15Å; P256-W596 HydrophobicContact CG-CD2 3.66Å; P256-W596 HydrophobicContact CG-CE3 3.93Å; P256-W596 HydrophobicContact CG-CG 4.06Å; P256-W596 HydrophobicContact CG-CH2 4.4Å; P256-W596 HydrophobicContact CG-CZ2 4.16Å; P256-W596 HydrophobicContact CG-CZ3 4.3Å; K257-W596 PolarHBondContact NZ-O 3.46Å; I483-W596 HydrophobicContact CB-CH2 4.47Å; I483-W596 HydrophobicContact CG2-CH2 3.87Å; I483-W596 HydrophobicContact CG2-CZ3 4.4Å; M527-W596 HydrophobicContact CE-CH2 4.26Å; W548-W596 HydrophobicContact CB-CE3 3.93Å; W548-W596 HydrophobicContact CB-CZ3 4.06Å; W548-W596 HydrophobicContact CE3-CB 4.16Å; W548-W596 HydrophobicContact CZ3-CB 4.43Å; V549-W596 WeakPolarHBondContact O-CA 3.33Å; G550-W596 VanDerWaalsContact CA-CE3 3.48Å; L591-W596 PolarHBondContact O-NE1 3.29Å; M594-W596 HydrophobicContact CG-CZ2 4.47Å; M594-W596 VanDerWaalsContact O-CD1 3.3Å; M594-W596 PolarHBondContact O-N 2.83Å; M594-W596 HydrophobicContact SD-CH2 4.39Å; M594-W596 HydrophobicContact SD-CZ2 3.67Å
597	V	86.8	Confident	78.4	Confident	57 Å²	57	52.8 Å²	52.8	35%	0.345	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	153.6	169.1	180	0	0	0	0	108.9	I447 V450 V549	I447-V597 HydrophobicContact CB-CB 4.23Å; I447-V597 HydrophobicContact CB-CG2 3.89Å; I447-V597 HydrophobicContact CD1-CB 4.37Å; I447-V597 HydrophobicContact CD1-CG2 4.23Å; I447-V597 HydrophobicContact CG2-CB 3.97Å; I447-V597 HydrophobicContact CG2-CG2 4.19Å; V450-V597 HydrophobicContact CB-CG1 4.43Å; V450-V597 HydrophobicContact CG2-CB 4.11Å; V450-V597 HydrophobicContact CG2-CG1 3.64Å; V549-V597 PolarHBondContact N-O 2.91Å; V549-V597 PolarHBondContact O-N 3.15Å
598	K	88.7	Confident	80	Confident	85 Å²	85	52.4 Å²	52.4	37%	0.37	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	165.2	-179.4	72	169.9	173.1	-172.9	0	114.9	C547 W548	C547-K598 CarbonylContact O-C 3.55Å; C547-K598 WeakPolarHBondContact O-CA 3.38Å; C547-K598 WeakPolarHBondContact O-CB 3.47Å; W548-K598 HydrophobicContact CD2-CB 3.8Å; W548-K598 HydrophobicContact CD2-CD 4.48Å; W548-K598 HydrophobicContact CE3-CB 3.73Å; W548-K598 HydrophobicContact CE3-CG 4.49Å; W548-K598 HydrophobicContact CG-CB 4.37Å; W548-K598 HydrophobicContact CH2-CB 4.37Å; W548-K598 HydrophobicContact CH2-CD 3.75Å; W548-K598 HydrophobicContact CH2-CG 4.3Å; W548-K598 HydrophobicContact CZ2-CB 4.4Å; W548-K598 HydrophobicContact CZ2-CD 3.59Å; W548-K598 HydrophobicContact CZ2-CG 4.46Å; W548-K598 HydrophobicContact CZ3-CB 4.04Å; W548-K598 HydrophobicContact CZ3-CD 4.24Å; W548-K598 HydrophobicContact CZ3-CG 4.31Å
599	S	88.8	Confident	81.5	Confident	26 Å²	26	49.2 Å²	49.2	18%	0.182	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	147.1	168.1	-160	0	0	0	0	110.5	V450 I452 R546 C547	V450-S599 WeakPolarHBondContact O-CB 3.41Å; V450-S599 PolarHBondContact O-OG 3.28Å; I452-S599 WeakPolarHBondContact CD1-O 3.35Å; R546-S599 CarbonylContact C-O 3.48Å; R546-S599 VanDerWaalsContact CA-O 3.24Å; R546-S599 WeakPolarHBondContact CA-O 3.43Å; C547-S599 PolarHBondContact N-O 2.95Å; C547-S599 PolarHBondContact O-N 3.18Å
600	D	88.1	Confident	82.8	Confident	56 Å²	56	47.2 Å²	47.2	30%	0.299	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	141.6	-173.9	-78.3	22.9	0	0	0	110.8	R544 I545 R546	R544-D600 WeakPolarHBondContact CD-OD2 3.26Å; R544-D600 IonicContact NH1-OD2 3.7Å; R544-D600 PolarHBondContact NH1-OD2 2.93Å; I545-D600 CarbonylContact O-C 3.51Å; I545-D600 WeakPolarHBondContact O-CA 3.42Å; R546-D600 VanDerWaalsContact CD-OD1 3.27Å; R546-D600 WeakPolarHBondContact CD-OD1 3.39Å; R546-D600 WeakPolarHBondContact CG-OD1 3.3Å
601	Y	87	Confident	83.8	Confident	71 Å²	71	46.1 Å²	46.1	28%	0.278	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	125.9	173	-171.7	-83.5	0	0	0	110.4	I452 F471 R544 I545 L603	I452-Y601 HydrophobicContact CB-CD2 4.49Å; I452-Y601 HydrophobicContact CG2-CD2 4.23Å; I452-Y601 HydrophobicContact CG2-CG 4.22Å; F471-Y601 AromaticContact CE1-CD1 3.84Å; F471-Y601 HydrophobicContact CE1-CD1 3.84Å; F471-Y601 AromaticContact CE1-CE1 3.77Å; F471-Y601 HydrophobicContact CE1-CE1 3.77Å; F471-Y601 HydrophobicContact CE1-CG 4.45Å; F471-Y601 HydrophobicContact CZ-CE1 4.48Å; R544-Y601 CarbonylContact C-O 3.49Å; R544-Y601 VanDerWaalsContact CA-O 3.29Å; R544-Y601 WeakPolarHBondContact CA-O 3.48Å; I545-Y601 PolarHBondContact N-O 3Å; I545-Y601 PolarHBondContact O-N 2.84Å; Y601-L603 HydrophobicContact CD1-CD2 4.22Å; Y601-L603 HydrophobicContact CE1-CD2 4.25Å
602	R	88	Confident	84.5	Confident	108 Å²	108	48 Å²	48	41%	0.408	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	128.8	179.8	-179.5	-177.1	176	94.5	-11.3	110.2	H542 E604	H542-R602 VanDerWaalsContact CD2-CZ 3.44Å; H542-R602 PolarHBondContact CD2-NH2 2.86Å; H542-R602 PolarHBondContact NE2-NH2 3.22Å; H542-R602 VanDerWaalsContact NE2-NH2 3.19Å; R602-E604 IonicContact NE-OE1 3.39Å
603	L	85.7	Confident	84.3	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.241	C	C	.	.			trans	-86.5	124.2	178.3	-67.9	176.2	0	0	0	112	L463 F471 L534 M540 H542 K543 I545 Y601 V605	L463-L603 HydrophobicContact CD1-CD2 3.62Å; F471-L603 HydrophobicContact CE1-CD2 4.34Å; F471-L603 HydrophobicContact CE2-CD2 4.42Å; F471-L603 HydrophobicContact CZ-CD2 3.66Å; L534-L603 HydrophobicContact CD2-CD1 4.17Å; M540-L603 HydrophobicContact CB-CD1 3.93Å; M540-L603 WeakPolarHBondContact O-CB 3.24Å; H542-L603 WeakPolarHBondContact CA-O 3.29Å; H542-L603 PolarHBondContact N-O 3.39Å; K543-L603 PolarHBondContact O-N 3.32Å; I545-L603 HydrophobicContact CD1-CD1 4.04Å; I545-L603 HydrophobicContact CD1-CD2 3.78Å; I545-L603 HydrophobicContact CD1-CG 4.13Å; I545-L603 HydrophobicContact CG1-CD1 3.91Å; I545-L603 HydrophobicContact CG1-CD2 4.29Å; I545-L603 HydrophobicContact CG1-CG 4.09Å; Y601-L603 HydrophobicContact CD1-CD2 4.22Å; Y601-L603 HydrophobicContact CE1-CD2 4.25Å; L603-V605 HydrophobicContact CB-CG2 4.28Å
604	E	88	Confident	83.8	Confident	104 Å²	104	44.9 Å²	44.9	49%	0.486	24%	0.237	S	C	.	.			trans	-114.8	85.3	175.5	-63.8	-169.3	169.1	0	0	109.4	L463 R602	L463-E604 PolarHBondContact N-O 3.04Å; R602-E604 IonicContact NE-OE1 3.39Å
605	V	88.4	Confident	83	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	125.1	-175.3	-168	0	0	0	0	110.9	L463 E465 V536 M540 H541 L603 Y607 N636	L463-V605 CarbonylContact O-C 3.57Å; L463-V605 VanDerWaalsContact O-CA 3.25Å; L463-V605 WeakPolarHBondContact O-CA 3.47Å; E465-V605 HydrophobicContact CB-CG1 4.37Å; V536-V605 HydrophobicContact CG1-CB 3.99Å; V536-V605 HydrophobicContact CG1-CG1 3.55Å; V536-V605 HydrophobicContact CG1-CG2 3.22Å; M540-V605 HydrophobicContact CB-CG2 4.47Å; H541-V605 HydrophobicContact CB-CB 4.09Å; H541-V605 HydrophobicContact CB-CG2 4.29Å; H541-V605 PolarHBondContact ND1-N 3.33Å; H541-V605 PolarHBondContact ND1-O 3.41Å; L603-V605 HydrophobicContact CB-CG2 4.28Å; V605-Y607 HydrophobicContact CG1-CD1 4.36Å; V605-Y607 WeakPolarHBondContact O-CD1 3.47Å; V605-N636 PolarHBondContact O-ND2 3.05Å
606	T	91	Very high	82.2	Confident	22 Å²	22	50.5 Å²	50.5	14%	0.135	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	131.8	170.7	56.2	0	0	0	0	111.6	N462 L463 E465 N636 Y740	N462-T606 HydrophobicContact CB-CG2 4.01Å; L463-T606 PolarHBondContact O-N 3.31Å; L463-T606 PolarHBondContact O-OG1 3.37Å; E465-T606 PolarHBondContact N-O 2.87Å; T606-N636 CarbonylContact C-O 3.53Å; T606-N636 VanDerWaalsContact CA-O 3.23Å; T606-N636 WeakPolarHBondContact CA-O 3.4Å; T606-Y740 WeakPolarHBondContact CB-OH 3.19Å; T606-Y740 PolarHBondContact O-OH 2.98Å; T606-Y740 PolarHBondContact OG1-OH 2.61Å
607	Y	91.6	Very high	82.2	Confident	11 Å²	11	50.6 Å²	50.6	4%	0.043	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	146.7	-176	56.2	-89.7	0	0	0	111.5	E465 R538 H541 V605 N634 S635 N636 Y740	E465-Y607 WeakPolarHBondContact OE2-CB 3.21Å; R538-Y607 HydrophobicContact CB-CD1 3.78Å; R538-Y607 HydrophobicContact CB-CD2 3.81Å; R538-Y607 HydrophobicContact CB-CE1 3.99Å; R538-Y607 HydrophobicContact CB-CE2 3.99Å; R538-Y607 HydrophobicContact CB-CG 3.7Å; H541-Y607 HydrophobicContact CB-CE1 3.85Å; H541-Y607 AromaticContact CG-CE1 3.88Å; V605-Y607 HydrophobicContact CG1-CD1 4.36Å; V605-Y607 WeakPolarHBondContact O-CD1 3.47Å; Y607-N634 WeakPolarHBondContact CE2-OD1 3.33Å; Y607-N634 PolarHBondContact OH-OD1 2.98Å; Y607-S635 VanDerWaalsContact CE2-C 3.5Å; Y607-S635 VanDerWaalsContact CE2-CA 3.46Å; Y607-N636 HydrophobicContact CD1-CB 3.92Å; Y607-N636 HydrophobicContact CE1-CB 3.51Å; Y607-N636 HydrophobicContact CE2-CB 4.45Å; Y607-N636 PolarHBondContact N-O 3.46Å; Y607-N636 CarbonylContact O-C 3.57Å; Y607-N636 PolarHBondContact O-N 3.13Å; Y607-N636 VanDerWaalsContact O-O 3.09Å; Y607-Y740 PolarHBondContact N-OH 3.04Å
608	G	90.4	Very high	82.2	Confident	12 Å²	12	48.4 Å²	48.4	12%	0.124	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	166.4	-179.3	0	0	0	0	0	113.1	R538 Y740	R538-G608 PolarHBondContact NH2-O 2.99Å; G608-Y740 VanDerWaalsContact CA-CG 3.41Å; G608-Y740 VanDerWaalsContact N-CE1 3.27Å
609	P	91.1	Very high	82.2	Confident	13 Å²	13	46 Å²	46	8%	0.084	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	146.7	-176.2	28	-34.1	0	0	0	112.2	A633 N634 A639 A735 I743	P609-A633 HydrophobicContact CB-CB 4.47Å; P609-N634 CarbonylContact C-O 3.59Å; P609-N634 WeakPolarHBondContact CA-O 3.25Å; P609-A639 HydrophobicContact CB-CB 4.29Å; P609-A735 HydrophobicContact CB-CB 3.97Å; P609-I743 HydrophobicContact CB-CD1 3.92Å; P609-I743 HydrophobicContact CB-CG1 4.05Å; P609-I743 HydrophobicContact CG-CD1 4.36Å; P609-I743 HydrophobicContact CG-CG1 4.05Å; P609-I743 HydrophobicContact CG-CG2 4.48Å; P609-I743 WeakPolarHBondContact O-CD1 3.37Å
610	E	88.9	Confident	82.3	Confident	98 Å²	98	46.8 Å²	46.8	46%	0.458	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	134.4	170.3	174.6	-177.6	-146.8	0	0	107.5	R538 A633 N634	R538-E610 WeakPolarHBondContact CD-OE2 3.49Å; R538-E610 IonicContact CZ-OE2 2.68Å; R538-E610 IonicContact NE-OE2 2.92Å; R538-E610 IonicContact NH1-OE2 3.93Å; R538-E610 PolarHBondContact NH1-OE2 2.74Å; E610-A633 CarbonylContact O-C 3.59Å; E610-A633 WeakPolarHBondContact O-CA 3.17Å; E610-N634 PolarHBondContact N-O 3.41Å; E610-N634 PolarHBondContact O-N 3.07Å
611	F	86.3	Confident	82.4	Confident	35 Å²	35	44.1 Å²	44.1	15%	0.154	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	134	177.7	-65.7	-65.8	0	0	0	111	S613 C631 S632 A633 C733 A735 I743 R745	F611-S613 PolarHBondContact O-N 2.78Å; F611-C631 VanDerWaalsContact CD1-SG 3.56Å; F611-C631 WeakPolarHBondContact CE1-SG 3.41Å; F611-S632 WeakPolarHBondContact CA-O 3.4Å; F611-A633 HydrophobicContact CD1-CB 4.13Å; F611-A633 HydrophobicContact CE1-CB 4.41Å; F611-C733 HydrophobicContact CE1-CB 4.22Å; F611-C733 HydrophobicContact CZ-CB 4.41Å; F611-A735 HydrophobicContact CE1-CB 3.79Å; F611-A735 HydrophobicContact CZ-CB 4.07Å; F611-I743 HydrophobicContact CD1-CD1 4.26Å; F611-I743 HydrophobicContact CD2-CD1 3.48Å; F611-I743 VanDerWaalsContact CD2-CD1 3.48Å; F611-I743 HydrophobicContact CD2-CG1 4.11Å; F611-I743 HydrophobicContact CE1-CD1 4.21Å; F611-I743 HydrophobicContact CE1-CG1 4.39Å; F611-I743 HydrophobicContact CE2-CB 3.96Å; F611-I743 HydrophobicContact CE2-CD1 3.42Å; F611-I743 VanDerWaalsContact CE2-CD1 3.42Å; F611-I743 HydrophobicContact CE2-CG1 3.5Å; F611-I743 HydrophobicContact CG-CD1 3.92Å; F611-I743 HydrophobicContact CZ-CB 4.47Å; F611-I743 HydrophobicContact CZ-CD1 3.83Å; F611-I743 HydrophobicContact CZ-CG1 3.68Å; F611-R745 HydrophobicContact CD2-CB 3.48Å; F611-R745 VanDerWaalsContact CD2-CB 3.48Å; F611-R745 HydrophobicContact CD2-CG 4.15Å; F611-R745 HydrophobicContact CE2-CB 3.36Å; F611-R745 HydrophobicContact CE2-CG 4.49Å; F611-R745 HydrophobicContact CG-CB 4.15Å; F611-R745 HydrophobicContact CZ-CB 3.94Å
612	S	77.8	Confident	82.6	Confident	60 Å²	60	44.4 Å²	44.4	42%	0.42	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-66.2	118.8	176.7	-39.1	0	0	0	0	109.6	S632	S612-S632 VanDerWaalsContact CB-OG 3.28Å; S612-S632 WeakPolarHBondContact CB-OG 3.3Å; S612-S632 PolarHBondContact N-O 3.23Å; S612-S632 PolarHBondContact OG-O 3.14Å; S612-S632 PolarHBondContact OG-OG 2.92Å
613	S	61	Low	82.7	Confident	74 Å²	74	43 Å²	43	52%	0.517	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	156.7	-178.5	55.2	0	0	0	0	112.6	F611	F611-S613 PolarHBondContact O-N 2.78Å
614	P	55.1	Low	82.9	Confident	67 Å²	67	45.5 Å²	45.5	44%	0.435	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	cis	-108.5	107.5	-21.2	33.8	-21.5	0	0	0	111.2	Y689	P614-Y689 WeakPolarHBondContact CA-OH 3.45Å; P614-Y689 WeakPolarHBondContact CB-OH 3.49Å
615	S	57.6	Low	83	Confident	37 Å²	37	44.1 Å²	44.1	26%	0.259	26%	0.262	S	S	.	.			trans	-76.9	135.1	163.2	137.3	0	0	0	0	109	D617 E630 Y689 R745	S615-D617 PolarHBondContact O-N 3.28Å; S615-E630 PolarHBondContact OG-O 3.15Å; S615-Y689 PolarHBondContact N-OH 2.91Å; S615-Y689 PolarHBondContact O-OH 3.34Å; S615-R745 PolarHBondContact O-NH1 2.93Å; S615-R745 VanDerWaalsContact O-NH1 3.12Å; S615-R745 PolarHBondContact OG-NH1 3.29Å; S615-R745 PolarHBondContact OG-NH2 2.81Å
616	N	66	Low	83.1	Confident	110 Å²	110	48.6 Å²	48.6	59%	0.588	29%	0.285	S	S	*	.			trans	-55.9	123.7	-178.5	-77.6	-13.6	0	0	0	111.5	L619	N616-L619 HydrophobicContact CB-CD2 3.75Å
617	D	79.8	Confident	83	Confident	17 Å²	17	48.2 Å²	48.2	9%	0.091	28%	0.282	C	S	.	.	S	Bend	trans	-81.5	-17.2	177.5	59.1	-47.4	0	0	0	113.1	S615 Y689 V747 Y748 R782	S615-D617 PolarHBondContact O-N 3.28Å; D617-Y689 HydrophobicContact CB-CD1 3.75Å; D617-Y689 HydrophobicContact CB-CE1 3.82Å; D617-Y689 VanDerWaalsContact CG-CD1 3.44Å; D617-V747 CarbonylContact O-C 3.55Å; D617-V747 WeakPolarHBondContact O-CA 3.39Å; D617-Y748 PolarHBondContact O-N 3.26Å; D617-R782 IonicContact OD1-CZ 2.7Å; D617-R782 IonicContact OD1-NH1 3.1Å; D617-R782 PolarHBondContact OD1-NH1 3.35Å; D617-R782 IonicContact OD1-NH2 3.7Å; D617-R782 IonicContact OD2-CZ 2.91Å; D617-R782 VanDerWaalsContact OD2-CZ 3.27Å; D617-R782 IonicContact OD2-NH1 3.21Å; D617-R782 PolarHBondContact OD2-NH1 3.48Å; D617-R782 IonicContact OD2-NH2 3.37Å; D617-R782 PolarHBondContact OD2-NH2 3.36Å
618	I	86.7	Confident	82.9	Confident	11 Å²	11	51.9 Å²	51.9	6%	0.056	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	124.6	167.3	-60.2	-178.3	0	0	0	108.5	Y748 I780 R782	I618-Y748 WeakPolarHBondContact CA-O 3.29Å; I618-I780 HydrophobicContact CG2-CG2 4.41Å; I618-R782 HydrophobicContact CD1-CB 4.38Å
619	L	89.3	Confident	82.8	Confident	33 Å²	33	51.5 Å²	51.5	17%	0.173	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	122	176.7	-60.5	174.6	0	0	0	109.2	N616 I627 L629 V747 Y748 V749 G750	N616-L619 HydrophobicContact CB-CD2 3.75Å; L619-I627 HydrophobicContact CB-CD1 4.43Å; L619-I627 HydrophobicContact CB-CG2 4.1Å; L619-I627 HydrophobicContact CD1-CG2 3.65Å; L619-I627 HydrophobicContact CG-CG2 4.43Å; L619-L629 HydrophobicContact CD1-CD2 3.63Å; L619-V747 HydrophobicContact CD1-CG1 3.66Å; L619-V747 HydrophobicContact CG-CG1 3.91Å; L619-Y748 PolarHBondContact N-O 2.85Å; L619-V749 HydrophobicContact CB-CG2 4.45Å; L619-V749 HydrophobicContact CD1-CG2 4.48Å; L619-V749 WeakPolarHBondContact O-CA 3.06Å; L619-G750 PolarHBondContact O-N 2.84Å
620	S	90.8	Very high	82.6	Confident	44 Å²	44	55.8 Å²	55.8	31%	0.308	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	139.5	175.6	53.2	0	0	0	0	111
621	G	89.6	Confident	82.6	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	168.6	164.2	0	0	0	0	0	113.9	Q625 G750 Q751 A752	G621-Q625 VanDerWaalsContact CA-OE1 3.26Å; G621-G750 PolarHBondContact N-O 2.98Å; G621-G750 VanDerWaalsContact N-O 3.08Å; G621-Q751 WeakPolarHBondContact O-CA 3.41Å; G621-A752 PolarHBondContact O-N 2.9Å
622	E	90.6	Very high	82.7	Confident	77 Å²	77	51.4 Å²	51.4	36%	0.36	30%	0.298	S	S	.	.			trans	-108.8	160.2	177.5	-63.6	158.6	-143	0	0	110.7	G624 Q625 L722 A752 Y839	E622-G624 PolarHBondContact O-N 2.89Å; E622-Q625 HydrophobicContact CB-CG 4.11Å; E622-Q625 VanDerWaalsContact CD-NE2 3.29Å; E622-Q625 WeakPolarHBondContact O-CB 3.4Å; E622-Q625 PolarHBondContact O-N 3.39Å; E622-Q625 PolarHBondContact OE1-NE2 2.76Å; E622-Q625 PolarHBondContact OE2-NE2 3.48Å; E622-L722 WeakPolarHBondContact O-CD1 3.36Å; E622-A752 HydrophobicContact CG-CB 4.25Å; E622-Y839 VanDerWaalsContact OE1-CE1 3.29Å; E622-Y839 WeakPolarHBondContact OE1-CE1 3.43Å; E622-Y839 PolarHBondContact OE1-OH 3.14Å
623	L	91.6	Very high	83.2	Confident	79 Å²	79	48.6 Å²	48.6	41%	0.414	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	130.9	172.4	-66.3	176.4	0	0	0	110.2	L722 F728	L623-L722 CarbonylContact C-O 3.59Å; L623-L722 WeakPolarHBondContact CA-O 3.34Å; L623-F728 HydrophobicContact CD2-CE2 4Å; L623-F728 HydrophobicContact CD2-CZ 4.33Å
624	G	88.6	Confident	84.6	Confident	52 Å²	52	47.9 Å²	47.9	54%	0.536	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.6	-13.2	-172	0	0	0	0	0	114.6	E622 L722	E622-G624 PolarHBondContact O-N 2.89Å; G624-L722 PolarHBondContact N-O 2.9Å
625	Q	90.8	Very high	86.2	Confident	74 Å²	74	44.8 Å²	44.8	35%	0.346	25%	0.248	S	C	.	.			trans	-84	159.8	177.1	-62.6	-179.4	-5.4	0	0	112.4	G621 E622 L722	G621-Q625 VanDerWaalsContact CA-OE1 3.26Å; E622-Q625 HydrophobicContact CB-CG 4.11Å; E622-Q625 VanDerWaalsContact CD-NE2 3.29Å; E622-Q625 WeakPolarHBondContact O-CB 3.4Å; E622-Q625 PolarHBondContact O-N 3.39Å; E622-Q625 PolarHBondContact OE1-NE2 2.76Å; E622-Q625 PolarHBondContact OE2-NE2 3.48Å; Q625-L722 PolarHBondContact O-N 2.9Å
626	I	90.6	Very high	87.8	Confident	95 Å²	95	44.9 Å²	44.9	49%	0.487	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.8	175.6	-57.8	175	0	0	0	108.8	K719 L720 H721	I626-K719 HydrophobicContact CG2-CB 4.01Å; I626-L720 CarbonylContact C-O 3.58Å; I626-L720 WeakPolarHBondContact CA-O 3.39Å; I626-H721 HydrophobicContact CG1-CB 4.26Å
627	I	89.5	Confident	89	Confident	13 Å²	13	42.3 Å²	42.3	7%	0.067	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	139.9	175	-67.6	-179.8	0	0	0	109.6	L619 L720 L722 V749	L619-I627 HydrophobicContact CB-CD1 4.43Å; L619-I627 HydrophobicContact CB-CG2 4.1Å; L619-I627 HydrophobicContact CD1-CG2 3.65Å; L619-I627 HydrophobicContact CG-CG2 4.43Å; I627-L720 PolarHBondContact N-O 2.85Å; I627-L720 PolarHBondContact O-N 2.84Å; I627-L722 HydrophobicContact CD1-CD1 3.68Å; I627-L722 HydrophobicContact CD1-CG 4.36Å; I627-L722 HydrophobicContact CG1-CD1 4.16Å; I627-V749 HydrophobicContact CD1-CG1 3.61Å
628	H	89.1	Confident	89.4	Confident	88 Å²	88	45.7 Å²	45.7	41%	0.407	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	113.3	173.4	-78	-130	0	0	0	110	E630	H628-E630 HydrophobicContact CB-CG 4.16Å; H628-E630 IonicContact ND1-OE1 2.74Å
629	L	88.7	Confident	89.6	Confident	4 Å²	4	45.2 Å²	45.2	2%	0.021	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	102.7	172.2	-68.4	175.9	0	0	0	108.9	L619 L643 S717 H718 L720 Y731 V747 V749	L619-L629 HydrophobicContact CD1-CD2 3.63Å; L629-L643 HydrophobicContact CB-CD2 3.72Å; L629-L643 HydrophobicContact CD1-CD2 4.04Å; L629-S717 WeakPolarHBondContact O-CA 3.36Å; L629-H718 HydrophobicContact CB-CB 4.4Å; L629-H718 PolarHBondContact N-O 3.11Å; L629-H718 PolarHBondContact O-N 3.24Å; L629-L720 HydrophobicContact CD1-CB 4.31Å; L629-L720 HydrophobicContact CD1-CD2 4.22Å; L629-Y731 HydrophobicContact CD1-CD1 3.49Å; L629-Y731 VanDerWaalsContact CD1-CD1 3.49Å; L629-Y731 HydrophobicContact CD1-CD2 4.43Å; L629-Y731 HydrophobicContact CD1-CE1 3.7Å; L629-Y731 HydrophobicContact CD1-CG 3.9Å; L629-V747 HydrophobicContact CD2-CG1 4.27Å; L629-V749 HydrophobicContact CD2-CG2 3.83Å
630	E	87.2	Confident	89.7	Confident	103 Å²	103	46 Å²	46	48%	0.481	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	138.4	-176.2	-50	-154.1	141.9	0	0	111.7	S615 H628 V716 S717 R745	S615-E630 PolarHBondContact OG-O 3.15Å; H628-E630 HydrophobicContact CB-CG 4.16Å; H628-E630 IonicContact ND1-OE1 2.74Å; E630-V716 WeakPolarHBondContact CA-O 3.26Å; E630-S717 WeakPolarHBondContact OE1-CB 3.32Å; E630-S717 PolarHBondContact OE1-OG 2.88Å; E630-R745 PolarHBondContact O-NH2 3.39Å
631	C	88.1	Confident	89.7	Confident	5 Å²	5	43.9 Å²	43.9	3%	0.034	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	131.8	177.8	-173.3	0	0	0	0	109.8	F611 V641 Q715 V716 C733	F611-C631 VanDerWaalsContact CD1-SG 3.56Å; F611-C631 WeakPolarHBondContact CE1-SG 3.41Å; C631-V641 HydrophobicContact CB-CG1 4.23Å; C631-Q715 CarbonylContact O-C 3.57Å; C631-Q715 VanDerWaalsContact O-CA 3.26Å; C631-Q715 WeakPolarHBondContact O-CA 3.4Å; C631-V716 PolarHBondContact N-O 3.4Å; C631-V716 PolarHBondContact O-N 3.32Å; C631-C733 HydrophobicContact CB-CB 3.78Å; C631-C733 WeakPolarHBondContact CB-SG 3.27Å; C631-C733 WeakPolarHBondContact SG-CB 3.1Å; C631-C733 CovalentContact SG-SG 2.02Å; C631-C733 PolarHBondContact SG-SG 3.4Å
632	S	88.3	Confident	89.8	Confident	37 Å²	37	44.1 Å²	44.1	26%	0.259	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	147.4	172.6	64.3	0	0	0	0	110.7	F611 S612 K714	F611-S632 WeakPolarHBondContact CA-O 3.4Å; S612-S632 VanDerWaalsContact CB-OG 3.28Å; S612-S632 WeakPolarHBondContact CB-OG 3.3Å; S612-S632 PolarHBondContact N-O 3.23Å; S612-S632 PolarHBondContact OG-O 3.14Å; S612-S632 PolarHBondContact OG-OG 2.92Å; S632-K714 CarbonylContact C-O 3.58Å; S632-K714 WeakPolarHBondContact CA-O 3.24Å; S632-K714 WeakPolarHBondContact CB-O 3.38Å
633	A	88.4	Confident	89.9	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.008	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	122.7	-178.8	0	0	0	0	0	111.9	P609 E610 F611 V641 K714 A735	P609-A633 HydrophobicContact CB-CB 4.47Å; E610-A633 CarbonylContact O-C 3.59Å; E610-A633 WeakPolarHBondContact O-CA 3.17Å; F611-A633 HydrophobicContact CD1-CB 4.13Å; F611-A633 HydrophobicContact CE1-CB 4.41Å; A633-V641 HydrophobicContact CB-CG2 3.93Å; A633-K714 PolarHBondContact N-O 3.21Å; A633-A735 HydrophobicContact CB-CB 3.55Å
634	N	89.5	Confident	89.9	Confident	59 Å²	59	39.1 Å²	39.1	32%	0.316	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	127.2	172.6	-175.1	17.6	0	0	0	109.7	Y607 P609 E610	Y607-N634 WeakPolarHBondContact CE2-OD1 3.33Å; Y607-N634 PolarHBondContact OH-OD1 2.98Å; P609-N634 CarbonylContact C-O 3.59Å; P609-N634 WeakPolarHBondContact CA-O 3.25Å; E610-N634 PolarHBondContact N-O 3.41Å; E610-N634 PolarHBondContact O-N 3.07Å
635	S	90.2	Very high	90.1	Very high	1 Å²	1	38 Å²	38	1%	0.007	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	148.9	-173.4	45.9	0	0	0	0	110.6	Y607 P637 A639	Y607-S635 VanDerWaalsContact CE2-C 3.5Å; Y607-S635 VanDerWaalsContact CE2-CA 3.46Å; S635-P637 CarbonylContact C-O 3.59Å; S635-P637 VanDerWaalsContact C-O 3.31Å; S635-P637 VanDerWaalsContact CB-O 3.27Å; S635-P637 WeakPolarHBondContact CB-O 3.3Å; S635-P637 PolarHBondContact OG-O 3.43Å; S635-A639 WeakPolarHBondContact OG-CB 3.36Å; S635-A639 PolarHBondContact OG-N 3.45Å
636	N	91.5	Very high	90.1	Very high	40 Å²	40	34.4 Å²	34.4	21%	0.214	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	112.5	164	-177.8	47.3	0	0	0	111	H541 V605 T606 Y607	H541-N636 VanDerWaalsContact CE1-CG 3.49Å; H541-N636 PolarHBondContact CE1-ND2 2.68Å; V605-N636 PolarHBondContact O-ND2 3.05Å; T606-N636 CarbonylContact C-O 3.53Å; T606-N636 VanDerWaalsContact CA-O 3.23Å; T606-N636 WeakPolarHBondContact CA-O 3.4Å; Y607-N636 HydrophobicContact CD1-CB 3.92Å; Y607-N636 HydrophobicContact CE1-CB 3.51Å; Y607-N636 HydrophobicContact CE2-CB 4.45Å; Y607-N636 PolarHBondContact N-O 3.46Å; Y607-N636 CarbonylContact O-C 3.57Å; Y607-N636 PolarHBondContact O-N 3.13Å; Y607-N636 VanDerWaalsContact O-O 3.09Å
637	P	89.8	Confident	90	Very high	56 Å²	56	30 Å²	30	36%	0.364	15%	0.153	S	C	.	.	S	Bend	cis	-60.6	161.6	2.7	-24.4	35.5	0	0	0	114.7	S635 T737	S635-P637 CarbonylContact C-O 3.59Å; S635-P637 VanDerWaalsContact C-O 3.31Å; S635-P637 VanDerWaalsContact CB-O 3.27Å; S635-P637 WeakPolarHBondContact CB-O 3.3Å; S635-P637 PolarHBondContact OG-O 3.43Å; P637-T737 HydrophobicContact CB-CG2 4.15Å; P637-T737 WeakPolarHBondContact O-CG2 3.39Å
638	E	89	Confident	90.1	Very high	87 Å²	87	33 Å²	33	41%	0.407	17%	0.174	S	C	.	.	P	Polyproline II helix	trans	-61.4	135.5	-179.9	-178.2	140.3	-179.3	0	0	111.8	I713 K714	E638-I713 WeakPolarHBondContact OE1-CA 3.2Å; E638-K714 VanDerWaalsContact CD-CE 3.43Å; E638-K714 HydrophobicContact CG-CD 4.33Å; E638-K714 HydrophobicContact CG-CG 3.9Å; E638-K714 WeakPolarHBondContact OE1-CD 3.34Å; E638-K714 VanDerWaalsContact OE1-CG 3.31Å; E638-K714 WeakPolarHBondContact OE1-CG 3.42Å; E638-K714 PolarHBondContact OE1-N 2.97Å; E638-K714 WeakPolarHBondContact OE2-CE 3.38Å; E638-K714 IonicContact OE2-NZ 3.44Å; E638-K714 PolarHBondContact OE2-NZ 3.48Å
639	A	90.4	Very high	90.1	Very high	2 Å²	2	34.3 Å²	34.3	2%	0.017	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-86.5	144.6	-177.4	0	0	0	0	0	113.4	P609 S635 V641 A735 Q736 T737	P609-A639 HydrophobicContact CB-CB 4.29Å; S635-A639 WeakPolarHBondContact OG-CB 3.36Å; S635-A639 PolarHBondContact OG-N 3.45Å; A639-V641 PolarHBondContact O-N 3.23Å; A639-A735 HydrophobicContact CB-CB 4.36Å; A639-Q736 CarbonylContact C-O 3.57Å; A639-Q736 WeakPolarHBondContact CA-O 3.4Å; A639-Q736 WeakPolarHBondContact CB-O 3.36Å; A639-T737 WeakPolarHBondContact CB-OG1 3.37Å
640	D	91.3	Very high	90.2	Very high	48 Å²	48	34.1 Å²	34.1	26%	0.257	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	120.1	156	170.3	-1.8	0	0	0	107.4	S642 K707 A735 Q736	D640-S642 PolarHBondContact OD1-OG 2.65Å; D640-K707 IonicContact OD2-NZ 3.84Å; D640-A735 CarbonylContact O-C 3.55Å; D640-A735 WeakPolarHBondContact O-CA 3.38Å; D640-Q736 PolarHBondContact N-O 3.11Å; D640-Q736 PolarHBondContact O-N 2.96Å
641	V	91	Very high	90.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	129.4	172.3	-177.5	0	0	0	0	108.5	C631 A633 A639 S711 V716 A735	C631-V641 HydrophobicContact CB-CG1 4.23Å; A633-V641 HydrophobicContact CB-CG2 3.93Å; A639-V641 PolarHBondContact O-N 3.23Å; V641-S711 PolarHBondContact N-O 3.38Å; V641-S711 PolarHBondContact O-N 3.36Å; V641-V716 HydrophobicContact CB-CG2 4.05Å; V641-V716 HydrophobicContact CG1-CB 4.27Å; V641-V716 HydrophobicContact CG1-CG2 3.86Å; V641-V716 WeakPolarHBondContact O-CG2 3.49Å; V641-A735 HydrophobicContact CG2-CB 4.3Å
642	S	92	Very high	90.4	Very high	5 Å²	5	34.8 Å²	34.8	4%	0.035	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	130.7	-171.1	-77.2	0	0	0	0	112.2	D640 K707 L709 C733 I734	D640-S642 PolarHBondContact OD1-OG 2.65Å; S642-K707 WeakPolarHBondContact OG-CE 3.37Å; S642-K707 PolarHBondContact OG-NZ 2.99Å; S642-L709 WeakPolarHBondContact CA-O 3.47Å; S642-C733 CarbonylContact O-C 3.4Å; S642-C733 WeakPolarHBondContact O-CA 3.15Å; S642-I734 PolarHBondContact N-O 2.9Å; S642-I734 PolarHBondContact O-N 3.21Å
643	L	91.5	Very high	90.3	Very high	8 Å²	8	36.6 Å²	36.6	4%	0.042	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	133	-179.1	-176.9	71.5	0	0	0	110.9	L629 L708 L709 V716 H718	L629-L643 HydrophobicContact CB-CD2 3.72Å; L629-L643 HydrophobicContact CD1-CD2 4.04Å; L643-L708 HydrophobicContact CD2-CD1 4.19Å; L643-L708 HydrophobicContact CG-CD1 4.32Å; L643-L708 PolarHBondContact O-N 2.74Å; L643-L709 PolarHBondContact N-O 2.89Å; L643-L709 PolarHBondContact O-N 2.94Å; L643-V716 HydrophobicContact CB-CG1 3.97Å; L643-H718 HydrophobicContact CD2-CB 3.59Å
644	Y	92.5	Very high	90.2	Very high	44 Å²	44	36.6 Å²	36.6	17%	0.173	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	139.9	-177.9	-68.6	-103.8	0	0	0	111.3	I701 R706 K707 Y731 A732 I734	Y644-I701 HydrophobicContact CD1-CG2 3.76Å; Y644-I701 HydrophobicContact CE1-CG2 4.15Å; Y644-I701 HydrophobicContact CG-CG2 4.24Å; Y644-R706 VanDerWaalsContact CA-O 3.32Å; Y644-R706 WeakPolarHBondContact CA-O 3.39Å; Y644-K707 HydrophobicContact CD1-CB 3.98Å; Y644-K707 HydrophobicContact CE1-CB 3.6Å; Y644-K707 HydrophobicContact CE1-CG 4.15Å; Y644-K707 HydrophobicContact CE2-CG 4.3Å; Y644-Y731 CarbonylContact O-C 3.58Å; Y644-Y731 WeakPolarHBondContact O-CA 3.3Å; Y644-A732 PolarHBondContact N-O 3.2Å; Y644-A732 PolarHBondContact O-N 3.19Å; Y644-I734 HydrophobicContact CD2-CD1 3.73Å; Y644-I734 HydrophobicContact CD2-CG1 3.87Å; Y644-I734 HydrophobicContact CE2-CB 4.36Å; Y644-I734 HydrophobicContact CE2-CD1 3.33Å; Y644-I734 HydrophobicContact CE2-CG1 3.76Å
645	Y	92.3	Very high	90	Very high	27 Å²	27	36.7 Å²	36.7	11%	0.106	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	131.1	157	173.8	-114.5	0	0	0	107.7	G647 G705 R706 E726 Y731	Y645-G647 VanDerWaalsContact C-N 3.3Å; Y645-G647 VanDerWaalsContact CE1-CA 3.47Å; Y645-G647 PolarHBondContact O-N 2.96Å; Y645-G705 CarbonylContact O-C 3.55Å; Y645-G705 WeakPolarHBondContact O-CA 3.48Å; Y645-R706 HydrophobicContact CD1-CG 4.19Å; Y645-R706 PolarHBondContact N-O 2.96Å; Y645-R706 PolarHBondContact O-N 2.82Å; Y645-E726 PolarHBondContact OH-O 3.43Å; Y645-Y731 HydrophobicContact CD2-CD1 4.09Å; Y645-Y731 AromaticContact CD2-CE1 3.58Å; Y645-Y731 HydrophobicContact CD2-CE1 3.58Å; Y645-Y731 HydrophobicContact CD2-CE2 4.14Å; Y645-Y731 AromaticContact CD2-CZ 3.58Å; Y645-Y731 HydrophobicContact CE2-CE2 4.47Å; Y645-Y731 HydrophobicContact CG-CE1 4.23Å
646	I	90.8	Very high	89.7	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.219	C	C	.	.			trans	-75.7	-19.7	-170.2	-65.8	-172.5	0	0	0	112.8	G650 L654 A700 I701 S704 G705 F730 A732 T746	I646-G650 VanDerWaalsContact CG2-C 3.47Å; I646-L654 HydrophobicContact CD1-CD1 3.47Å; I646-L654 VanDerWaalsContact CD1-CD1 3.47Å; I646-L654 HydrophobicContact CG2-CD1 4.18Å; I646-A700 HydrophobicContact CG2-CB 3.75Å; I646-I701 HydrophobicContact CG1-CG1 4.38Å; I646-S704 CarbonylContact O-C 3.52Å; I646-S704 PolarHBondContact O-OG 3.32Å; I646-S704 VanDerWaalsContact O-OG 3.06Å; I646-G705 VanDerWaalsContact O-CA 3.3Å; I646-G705 WeakPolarHBondContact O-CA 3.31Å; I646-G705 PolarHBondContact O-N 2.77Å; I646-F730 WeakPolarHBondContact CB-O 3.39Å; I646-F730 HydrophobicContact CD1-CB 3.7Å; I646-A732 HydrophobicContact CD1-CB 3.97Å; I646-A732 HydrophobicContact CG1-CB 4.12Å; I646-T746 HydrophobicContact CD1-CG2 4.46Å
647	G	89.6	Confident	89.2	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	75.6	163.7	179.5	0	0	0	0	0	113.3	Y645 E649 G650 Q651 S704	Y645-G647 VanDerWaalsContact C-N 3.3Å; Y645-G647 VanDerWaalsContact CE1-CA 3.47Å; Y645-G647 PolarHBondContact O-N 2.96Å; G647-E649 PolarHBondContact O-N 2.9Å; G647-G650 PolarHBondContact O-N 3.22Å; G647-Q651 WeakPolarHBondContact O-CG 3.19Å; G647-Q651 PolarHBondContact O-N 2.79Å; G647-S704 VanDerWaalsContact CA-OG 3.24Å; G647-S704 WeakPolarHBondContact CA-OG 3.43Å; G647-S704 PolarHBondContact O-OG 3.12Å
648	P	90.5	Very high	88.6	Confident	78 Å²	78	41 Å²	41	51%	0.506	21%	0.207	S	C	.	.	H	α-helix	trans	-60.8	-44.6	-167.5	23.1	-34	0	0	0	114.1	G650 Q651 I652	P648-G650 VanDerWaalsContact C-N 3.33Å; P648-G650 PolarHBondContact O-N 3.43Å; P648-Q651 WeakPolarHBondContact O-CB 3.15Å; P648-Q651 PolarHBondContact O-N 2.99Å; P648-I652 WeakPolarHBondContact O-CG1 3.34Å; P648-I652 PolarHBondContact O-N 3.07Å; P648-I652 VanDerWaalsContact O-N 3.1Å
649	E	89.9	Confident	88	Confident	114 Å²	114	42.5 Å²	42.5	53%	0.533	21%	0.212	S	C	.	.	H	α-helix	trans	-63.4	-42.3	178.7	-57.4	-56.4	135	0	0	110.9	G647 Q651 I652 L653 S704	G647-E649 PolarHBondContact O-N 2.9Å; E649-Q651 VanDerWaalsContact C-N 3.35Å; E649-Q651 PolarHBondContact O-N 2.89Å; E649-I652 PolarHBondContact O-N 3.11Å; E649-L653 WeakPolarHBondContact O-CG 3.04Å; E649-L653 PolarHBondContact O-N 3.09Å; E649-S704 PolarHBondContact N-OG 3.01Å
650	G	89.6	Confident	86.6	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-68.5	-30.4	175.7	0	0	0	0	0	113.4	I646 G647 P648 L654 S703 S704	I646-G650 VanDerWaalsContact CG2-C 3.47Å; G647-G650 PolarHBondContact O-N 3.22Å; P648-G650 VanDerWaalsContact C-N 3.33Å; P648-G650 PolarHBondContact O-N 3.43Å; G650-L654 WeakPolarHBondContact O-CG 3.31Å; G650-L654 PolarHBondContact O-N 3.09Å; G650-L654 VanDerWaalsContact O-N 3.11Å; G650-S703 WeakPolarHBondContact CA-OG 3.31Å; G650-S703 PolarHBondContact N-OG 3.42Å; G650-S703 VanDerWaalsContact N-OG 3.15Å; G650-S704 PolarHBondContact N-OG 2.03Å
651	Q	90.2	Very high	85.2	Confident	22 Å²	22	46 Å²	46	10%	0.103	23%	0.232	C	C	.	.	H	α-helix	trans	-63.1	-43.4	170.6	-61.6	-49.5	-14.8	0	0	111	G647 P648 E649 L654 E655 F730	G647-Q651 WeakPolarHBondContact O-CG 3.19Å; G647-Q651 PolarHBondContact O-N 2.79Å; P648-Q651 WeakPolarHBondContact O-CB 3.15Å; P648-Q651 PolarHBondContact O-N 2.99Å; E649-Q651 VanDerWaalsContact C-N 3.35Å; E649-Q651 PolarHBondContact O-N 2.89Å; Q651-L654 PolarHBondContact O-N 3.37Å; Q651-E655 WeakPolarHBondContact O-CB 3.4Å; Q651-E655 PolarHBondContact O-N 2.87Å; Q651-F730 PolarHBondContact NE2-O 2.88Å
652	I	89.4	Confident	83.6	Confident	100 Å²	100	48.9 Å²	48.9	51%	0.513	25%	0.247	S	C	.	.	H	α-helix	trans	-62.9	-47.7	179.5	-65.2	165	0	0	0	110.1	P648 E649 L654 E655 E656	P648-I652 WeakPolarHBondContact O-CG1 3.34Å; P648-I652 PolarHBondContact O-N 3.07Å; P648-I652 VanDerWaalsContact O-N 3.1Å; E649-I652 PolarHBondContact O-N 3.11Å; I652-L654 PolarHBondContact O-N 2.88Å; I652-E655 PolarHBondContact O-N 2.84Å; I652-E656 PolarHBondContact O-N 2.93Å
653	L	87.4	Confident	81.8	Confident	76 Å²	76	53.1 Å²	53.1	40%	0.398	27%	0.273	S	S	.	.	H	α-helix	trans	-57	-48.3	177.8	-71.4	171.2	0	0	0	112.4	E649 E656 V657	E649-L653 WeakPolarHBondContact O-CG 3.04Å; E649-L653 PolarHBondContact O-N 3.09Å; L653-E656 PolarHBondContact O-N 3.22Å; L653-V657 WeakPolarHBondContact O-CG2 3.45Å; L653-V657 PolarHBondContact O-N 3.31Å
654	L	86.8	Confident	79.7	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-69.1	-36.1	177.9	-67	178.7	0	0	0	112	I646 G650 Q651 I652 V657 T658 F692 I696 A700 F730	I646-L654 HydrophobicContact CD1-CD1 3.47Å; I646-L654 VanDerWaalsContact CD1-CD1 3.47Å; I646-L654 HydrophobicContact CG2-CD1 4.18Å; G650-L654 WeakPolarHBondContact O-CG 3.31Å; G650-L654 PolarHBondContact O-N 3.09Å; G650-L654 VanDerWaalsContact O-N 3.11Å; Q651-L654 PolarHBondContact O-N 3.37Å; I652-L654 PolarHBondContact O-N 2.88Å; L654-V657 PolarHBondContact O-N 3Å; L654-T658 WeakPolarHBondContact O-CG2 2.96Å; L654-T658 PolarHBondContact O-N 3.41Å; L654-F692 HydrophobicContact CB-CE1 4.27Å; L654-F692 HydrophobicContact CB-CE2 4.46Å; L654-F692 HydrophobicContact CB-CZ 3.97Å; L654-F692 HydrophobicContact CD1-CE2 4.28Å; L654-F692 HydrophobicContact CD2-CB 4.48Å; L654-F692 HydrophobicContact CD2-CD1 3.83Å; L654-F692 HydrophobicContact CD2-CD2 3.98Å; L654-F692 HydrophobicContact CD2-CE1 3.92Å; L654-F692 HydrophobicContact CD2-CE2 4.06Å; L654-F692 HydrophobicContact CD2-CG 3.86Å; L654-F692 HydrophobicContact CD2-CZ 4.02Å; L654-F692 HydrophobicContact CG-CZ 4.42Å; L654-I696 HydrophobicContact CD2-CG2 3.79Å; L654-A700 HydrophobicContact CD1-CB 4.18Å; L654-A700 HydrophobicContact CD2-CB 4.21Å; L654-A700 HydrophobicContact CG-CB 3.93Å; L654-F730 HydrophobicContact CB-CD2 3.69Å; L654-F730 HydrophobicContact CB-CE2 3.78Å; L654-F730 HydrophobicContact CB-CG 4.49Å; L654-F730 HydrophobicContact CD1-CB 3.77Å; L654-F730 HydrophobicContact CD1-CD2 3.81Å; L654-F730 HydrophobicContact CD1-CG 3.83Å; L654-F730 HydrophobicContact CG-CD2 4.43Å
655	E	84.6	Confident	77.5	Confident	62 Å²	62	61.4 Å²	61.4	29%	0.29	31%	0.31	S	S	.	.	H	α-helix	trans	-64.5	-39.8	176.5	-178.3	161.2	132.7	0	0	112.4	Q651 I652 V657 T658 K659 R812	Q651-E655 WeakPolarHBondContact O-CB 3.4Å; Q651-E655 PolarHBondContact O-N 2.87Å; I652-E655 PolarHBondContact O-N 2.84Å; E655-V657 VanDerWaalsContact C-N 3.33Å; E655-V657 PolarHBondContact O-N 3.15Å; E655-T658 WeakPolarHBondContact CA-OG1 3.38Å; E655-T658 PolarHBondContact O-N 3.05Å; E655-T658 PolarHBondContact O-OG1 2.99Å; E655-K659 HydrophobicContact CG-CD 4.19Å; E655-K659 WeakPolarHBondContact O-CG 3.47Å; E655-K659 PolarHBondContact O-N 3.06Å; E655-K659 WeakPolarHBondContact OE1-CE 3.27Å; E655-K659 IonicContact OE1-NZ 2.65Å; E655-K659 PolarHBondContact OE1-NZ 2.86Å; E655-R812 IonicContact OE2-CZ 3.23Å; E655-R812 VanDerWaalsContact OE2-CZ 3.23Å; E655-R812 IonicContact OE2-NH1 2.74Å; E655-R812 PolarHBondContact OE2-NH1 2.63Å; E655-R812 IonicContact OE2-NH2 2.78Å; E655-R812 PolarHBondContact OE2-NH2 2.93Å
656	E	83.7	Confident	75.1	Confident	135 Å²	135	66.9 Å²	66.9	63%	0.631	34%	0.336	S	S	*	.	H	α-helix	trans	-63	-39.3	175.8	-171.9	155.7	-155.4	0	0	111.9	I652 L653 K659 S660	I652-E656 PolarHBondContact O-N 2.93Å; L653-E656 PolarHBondContact O-N 3.22Å; E656-K659 PolarHBondContact O-N 3.41Å; E656-S660 PolarHBondContact O-N 2.9Å
657	V	80.7	Confident	72.7	Confident	42 Å²	42	75.1 Å²	75.1	26%	0.255	37%	0.374	S	S	.	.	H	α-helix	trans	-61.4	-48.5	171.3	176.9	0	0	0	0	111.2	L653 L654 E655 K659 S660 E661 F692 I696	L653-V657 WeakPolarHBondContact O-CG2 3.45Å; L653-V657 PolarHBondContact O-N 3.31Å; L654-V657 PolarHBondContact O-N 3Å; E655-V657 VanDerWaalsContact C-N 3.33Å; E655-V657 PolarHBondContact O-N 3.15Å; V657-K659 PolarHBondContact O-N 2.91Å; V657-S660 WeakPolarHBondContact O-CB 3.48Å; V657-S660 PolarHBondContact O-N 2.78Å; V657-E661 PolarHBondContact O-N 2.95Å; V657-E661 VanDerWaalsContact O-N 3.17Å; V657-F692 HydrophobicContact CB-CD1 4.46Å; V657-F692 HydrophobicContact CB-CE1 4.2Å; V657-F692 HydrophobicContact CG1-CD1 3.93Å; V657-F692 HydrophobicContact CG1-CE1 3.98Å; V657-I696 HydrophobicContact CG1-CD1 4.47Å; V657-I696 HydrophobicContact CG2-CD1 4.07Å; V657-I696 HydrophobicContact CG2-CG2 4.09Å
658	T	78.5	Confident	70.5	Confident	11 Å²	11	82.3 Å²	82.3	7%	0.067	41%	0.407	C	S	.	.	H	α-helix	trans	-62.3	-27.6	176.4	63.6	0	0	0	0	113.6	L654 E655 L662 F692 F730 H811	L654-T658 WeakPolarHBondContact O-CG2 2.96Å; L654-T658 PolarHBondContact O-N 3.41Å; E655-T658 WeakPolarHBondContact CA-OG1 3.38Å; E655-T658 PolarHBondContact O-N 3.05Å; E655-T658 PolarHBondContact O-OG1 2.99Å; T658-L662 WeakPolarHBondContact O-CD1 3.34Å; T658-F692 HydrophobicContact CG2-CE1 3.85Å; T658-F692 HydrophobicContact CG2-CZ 3.7Å; T658-F730 HydrophobicContact CG2-CZ 4.01Å; T658-H811 HydrophobicContact CG2-CB 3.65Å
659	K	74.7	Confident	68.4	Low	118 Å²	118	84.8 Å²	84.8	51%	0.513	41%	0.408	S	S	.	.	H	α-helix	trans	-74.7	-36.4	174	-74	168.5	-177.2	162.7	0	111.7	E655 E656 V657 E661 L662	E655-K659 HydrophobicContact CG-CD 4.19Å; E655-K659 WeakPolarHBondContact O-CG 3.47Å; E655-K659 PolarHBondContact O-N 3.06Å; E655-K659 WeakPolarHBondContact OE1-CE 3.27Å; E655-K659 IonicContact OE1-NZ 2.65Å; E655-K659 PolarHBondContact OE1-NZ 2.86Å; E656-K659 PolarHBondContact O-N 3.41Å; V657-K659 PolarHBondContact O-N 2.91Å; K659-E661 VanDerWaalsContact C-N 3.31Å; K659-E661 PolarHBondContact O-N 3.24Å; K659-L662 PolarHBondContact O-N 3.36Å
660	S	62.7	Low	65.8	Low	54 Å²	54	87 Å²	87	38%	0.378	42%	0.423	S	S	.	.	H	α-helix	trans	-61.6	-38.8	175.1	-169.3	0	0	0	0	111.8	E656 V657 L662 T663 Q664	E656-S660 PolarHBondContact O-N 2.9Å; V657-S660 WeakPolarHBondContact O-CB 3.48Å; V657-S660 PolarHBondContact O-N 2.78Å; S660-L662 VanDerWaalsContact C-N 3.29Å; S660-L662 PolarHBondContact O-N 3.05Å; S660-T663 PolarHBondContact O-N 3.1Å; S660-T663 PolarHBondContact O-OG1 2.93Å; S660-Q664 PolarHBondContact O-N 3.3Å
661	E	61.9	Low	63.2	Low	68 Å²	68	96.8 Å²	96.8	32%	0.318	46%	0.46	S	S	.	.	H	α-helix	trans	-56	-39.6	175.8	-68.4	174	169.6	0	0	113	V657 K659 T663 Q664 H811	V657-E661 PolarHBondContact O-N 2.95Å; V657-E661 VanDerWaalsContact O-N 3.17Å; K659-E661 VanDerWaalsContact C-N 3.31Å; K659-E661 PolarHBondContact O-N 3.24Å; E661-T663 PolarHBondContact O-N 3.32Å; E661-Q664 PolarHBondContact O-N 2.76Å; E661-H811 IonicContact OE1-CD2 3.26Å; E661-H811 PolarHBondContact OE1-CD2 2.91Å; E661-H811 IonicContact OE1-NE2 2.64Å; E661-H811 PolarHBondContact OE1-NE2 3.49Å; E661-H811 IonicContact OE2-CD2 3.29Å; E661-H811 PolarHBondContact OE2-CD2 2.85Å
662	L	56.6	Low	60.6	Low	61 Å²	61	101.2 Å²	101.2	32%	0.319	49%	0.49	S	S	.	.	H	α-helix	trans	-66.7	-21.1	176.2	-86.8	107.7	0	0	0	113.8	T658 K659 S660 L758 T776	T658-L662 WeakPolarHBondContact O-CD1 3.34Å; K659-L662 PolarHBondContact O-N 3.36Å; S660-L662 VanDerWaalsContact C-N 3.29Å; S660-L662 PolarHBondContact O-N 3.05Å; L662-L758 HydrophobicContact CD1-CD1 4.22Å; L662-L758 HydrophobicContact CD2-CB 3.69Å; L662-L758 HydrophobicContact CD2-CD1 3.66Å; L662-L758 HydrophobicContact CD2-CG 4.35Å; L662-T776 HydrophobicContact CD2-CG2 4.23Å; L662-T776 HydrophobicContact CG-CG2 4.46Å
663	T	53.6	Low	58.1	Low	94 Å²	94	102.3 Å²	102.3	58%	0.577	50%	0.502	S	S	*	.	H	α-helix	trans	-95.3	-29.6	178.7	64.8	0	0	0	0	113.3	S660 E661 Y665	S660-T663 PolarHBondContact O-N 3.1Å; S660-T663 PolarHBondContact O-OG1 2.93Å; E661-T663 PolarHBondContact O-N 3.32Å; T663-Y665 PolarHBondContact O-N 3.04Å
664	Q	48.7	Very low	55.8	Low	131 Å²	131	105.9 Å²	105.9	61%	0.612	52%	0.521	S	S	*	.	H	α-helix	trans	-79.7	-10.6	-166.8	-163	165.2	-4.8	0	0	115.5	S660 E661 Q666 H667	S660-Q664 PolarHBondContact O-N 3.3Å; E661-Q664 PolarHBondContact O-N 2.76Å; Q664-Q666 PolarHBondContact O-N 2.02Å; Q664-H667 PolarHBondContact O-N 2.87Å
665	Y	46	Very low	53.4	Low	96 Å²	96	111.1 Å²	111.1	38%	0.376	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.1	-17.5	174	-89.3	-93.5	0	0	0	114	T663 H667 F774 E808	T663-Y665 PolarHBondContact O-N 3.04Å; Y665-H667 PolarHBondContact O-N 3.39Å; Y665-F774 HydrophobicContact CD1-CE1 4.49Å; Y665-F774 HydrophobicContact CE1-CD1 4.4Å; Y665-F774 HydrophobicContact CE1-CE1 4.28Å; Y665-E808 PolarHBondContact OH-OE2 2.9Å
666	Q	40.6	Very low	51	Low	141 Å²	141	117 Å²	117	66%	0.659	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-0.3	-177.9	-75.1	-174	-37.4	0	0	115.7	Q664	Q664-Q666 PolarHBondContact O-N 2.02Å
667	H	42.1	Very low	48.8	Very low	173 Å²	173	118.5 Å²	118.5	80%	0.801	59%	0.589	S	S	*	*	S	Bend	trans	-127.3	-5.2	-176.2	-85.5	26.8	0	0	0	116.4	Q664 Y665	Q664-H667 PolarHBondContact O-N 2.87Å; Y665-H667 PolarHBondContact O-N 3.39Å
668	H	43.3	Very low	46.6	Very low	153 Å²	153	120.2 Å²	120.2	71%	0.708	60%	0.601	S	S	*	*	S	Bend	trans	-84.3	-12.2	-176.5	-155.2	79.2	0	0	0	114.9	N670	H668-N670 PolarHBondContact O-N 3.28Å
669	Y	44.9	Very low	44.4	Very low	130 Å²	130	129.5 Å²	129.5	51%	0.51	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.5	13.8	-163.9	-118.9	-70	0	0	0	116.8	E772	Y669-E772 WeakPolarHBondContact CE2-OE2 3.27Å; Y669-E772 VanDerWaalsContact CZ-OE2 3.29Å; Y669-E772 PolarHBondContact OH-OE2 3.13Å
670	N	35.4	Very low	42.6	Very low	159 Å²	159	127.6 Å²	127.6	85%	0.85	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	16.3	177.6	-80.8	-19.4	0	0	0	114.3	H668	H668-N670 PolarHBondContact O-N 3.28Å
671	R	36	Very low	41.1	Very low	206 Å²	206	129.9 Å²	129.9	78%	0.777	64%	0.638	S	S	*	*	S	Bend	trans	-83.5	133.3	174.8	-133.3	176.3	-166.2	173.9	4.3	109.9	V673	R671-V673 PolarHBondContact O-N 3.39Å
672	P	34.6	Very low	39.5	Very low	115 Å²	115	132 Å²	132	75%	0.747	66%	0.656	S	S	*	*			trans	-58	131.8	174.3	-21.8	32.6	0	0	0	110.3	D674	P672-D674 VanDerWaalsContact C-N 3.29Å; P672-D674 PolarHBondContact O-N 2.84Å
673	V	37.4	Very low	38	Very low	124 Å²	124	137.1 Å²	137.1	75%	0.752	67%	0.671	S	S	*	*			trans	-73	89.1	173.1	179.8	0	0	0	0	107.8	R671 S675	R671-V673 PolarHBondContact O-N 3.39Å; V673-S675 PolarHBondContact O-N 2.86Å
674	D	39.6	Very low	36.7	Very low	150 Å²	150	138.8 Å²	138.8	80%	0.802	68%	0.676	S	S	*	*			trans	-63.4	120.7	172.8	-118	-21.4	0	0	0	108.9	P672 K676	P672-D674 VanDerWaalsContact C-N 3.29Å; P672-D674 PolarHBondContact O-N 2.84Å; D674-K676 VanDerWaalsContact C-N 3.32Å; D674-K676 PolarHBondContact O-N 2.83Å
675	S	36.8	Very low	35.9	Very low	111 Å²	111	136.2 Å²	136.2	78%	0.776	67%	0.672	S	S	*	*	S	Bend	trans	-80.4	71.5	-160.5	47.6	0	0	0	0	112.8	V673	V673-S675 PolarHBondContact O-N 2.86Å
676	K	34	Very low	35.4	Very low	184 Å²	184	136.5 Å²	136.5	80%	0.8	68%	0.677	S	S	*	*	S	Bend	trans	-161.1	93.6	163.4	-104.7	152.3	-172.6	-179.7	0	111.3	D674	D674-K676 VanDerWaalsContact C-N 3.32Å; D674-K676 PolarHBondContact O-N 2.83Å
677	H	37.4	Very low	35.3	Very low	167 Å²	167	133.3 Å²	133.3	77%	0.773	67%	0.667	S	S	*	*			trans	56	94.8	171.7	-54.8	-75.7	0	0	0	115.9	K679	H677-K679 PolarHBondContact O-N 2.87Å; H677-K679 VanDerWaalsContact O-N 3.15Å
678	P	34.4	Very low	35.7	Very low	78 Å²	78	132 Å²	132	51%	0.506	66%	0.662	S	S	.	*			trans	-52.1	123.9	152.2	24.5	-34.4	0	0	0	109.1	Y680	P678-Y680 HydrophobicContact CB-CD2 4.12Å; P678-Y680 HydrophobicContact CB-CE1 4.12Å; P678-Y680 HydrophobicContact CB-CE2 3.65Å; P678-Y680 HydrophobicContact CG-CD2 3.9Å; P678-Y680 HydrophobicContact CG-CE2 3.29Å; P678-Y680 PolarHBondContact O-N 2.78Å
679	K	32.5	Very low	36.4	Very low	207 Å²	207	127 Å²	127	90%	0.9	64%	0.637	S	S	*	*			trans	-71.4	70	174.7	-88	-173.2	171.2	-177	0	110.1	H677 L681	H677-K679 PolarHBondContact O-N 2.87Å; H677-K679 VanDerWaalsContact O-N 3.15Å; K679-L681 PolarHBondContact O-N 3.22Å
680	Y	35.7	Very low	37	Very low	78 Å²	78	121.8 Å²	121.8	31%	0.306	62%	0.621	S	S	.	*			trans	-71.8	110.1	160.4	-53.8	-56.7	0	0	0	107.6	P678 V682 F770 Y806	P678-Y680 HydrophobicContact CB-CD2 4.12Å; P678-Y680 HydrophobicContact CB-CE1 4.12Å; P678-Y680 HydrophobicContact CB-CE2 3.65Å; P678-Y680 HydrophobicContact CG-CD2 3.9Å; P678-Y680 HydrophobicContact CG-CE2 3.29Å; P678-Y680 PolarHBondContact O-N 2.78Å; Y680-V682 PolarHBondContact O-N 2.86Å; Y680-V682 VanDerWaalsContact O-N 3.15Å; Y680-F770 WeakPolarHBondContact OH-CZ 3.41Å; Y680-Y806 WeakPolarHBondContact CB-OH 3.35Å; Y680-Y806 HydrophobicContact CD1-CE2 4.42Å; Y680-Y806 HydrophobicContact CG-CE2 4.39Å; Y680-Y806 AromaticContact CG-CZ 3.94Å
681	L	31.7	Very low	38.7	Very low	101 Å²	101	120.7 Å²	120.7	53%	0.529	61%	0.61	S	S	.	*			trans	-56.3	118.1	172	-86.8	152.6	0	0	0	109.2	K679	K679-L681 PolarHBondContact O-N 3.22Å
682	V	29.5	Very low	40.8	Very low	113 Å²	113	111.5 Å²	111.5	69%	0.685	58%	0.576	S	S	*	*			trans	-64.5	131.9	160.3	-172.4	0	0	0	0	105.9	Y680 N684	Y680-V682 PolarHBondContact O-N 2.86Å; Y680-V682 VanDerWaalsContact O-N 3.15Å; V682-N684 WeakPolarHBondContact CG1-OD1 3.46Å; V682-N684 PolarHBondContact O-N 3.5Å
683	W	24.6	Very low	43	Very low	169 Å²	169	110.9 Å²	110.9	64%	0.64	57%	0.567	S	S	*	*	S	Bend	trans	-74.8	69.8	-165	-134.7	78.6	0	0	0	112.3	V785	W683-V785 HydrophobicContact CH2-CG2 4.07Å; W683-V785 HydrophobicContact CZ2-CG2 4.49Å; W683-V785 HydrophobicContact CZ3-CG2 4.28Å
684	N	25.5	Very low	45.2	Very low	129 Å²	129	108.8 Å²	108.8	69%	0.69	55%	0.551	S	S	*	*			trans	-126.8	43.1	-175.7	-64.8	36.3	0	0	0	110.8	V682	V682-N684 WeakPolarHBondContact CG1-OD1 3.46Å; V682-N684 PolarHBondContact O-N 3.5Å
685	S	32.3	Very low	47.3	Very low	76 Å²	76	104.9 Å²	104.9	53%	0.531	54%	0.535	S	S	.	.			trans	-160.4	125.5	166.9	37.7	0	0	0	0	113.6	T687	S685-T687 PolarHBondContact O-N 3.38Å; S685-T687 VanDerWaalsContact O-N 3.16Å
686	E	34.8	Very low	49.6	Very low	103 Å²	103	102.1 Å²	102.1	48%	0.481	51%	0.511	S	S	.	.	S	Bend	trans	-69.2	91.1	161.7	-62.6	163	-163.2	0	0	108.6	R246	R246-E686 IonicContact CZ-OE1 2.65Å; R246-E686 IonicContact NH1-OE1 2.68Å; R246-E686 PolarHBondContact NH1-OE1 3.02Å; R246-E686 IonicContact NH2-OE1 2.95Å; R246-E686 PolarHBondContact NH2-OE1 2.86Å; R246-E686 IonicContact NH2-OE2 2.92Å
687	T	38.6	Very low	52.1	Low	73 Å²	73	93.6 Å²	93.6	45%	0.448	47%	0.474	S	S	.	.			trans	-173.3	-21.7	157.5	12.4	0	0	0	0	119.3	S685 Y689	S685-T687 PolarHBondContact O-N 3.38Å; S685-T687 VanDerWaalsContact O-N 3.16Å; T687-Y689 WeakPolarHBondContact O-CD2 3.38Å; T687-Y689 PolarHBondContact O-N 2.85Å
688	E	51.7	Low	54.5	Low	147 Å²	147	89.7 Å²	89.7	69%	0.687	46%	0.455	S	S	*	.			trans	-70.3	115.2	-171.3	-153.6	162	-142	0	0	111.1	K809	E688-K809 VanDerWaalsContact O-CD 3.32Å; E688-K809 WeakPolarHBondContact O-CD 3.44Å; E688-K809 WeakPolarHBondContact O-CE 3.49Å; E688-K809 PolarHBondContact O-NZ 2.91Å
689	Y	56.4	Low	57.1	Low	47 Å²	47	88.5 Å²	88.5	18%	0.184	45%	0.451	C	S	.	.			trans	-112.9	155.1	-179.2	-70.7	-77.9	0	0	0	109.9	P614 S615 D617 T687 E691	P614-Y689 WeakPolarHBondContact CA-OH 3.45Å; P614-Y689 WeakPolarHBondContact CB-OH 3.49Å; S615-Y689 PolarHBondContact N-OH 2.91Å; S615-Y689 PolarHBondContact O-OH 3.34Å; D617-Y689 HydrophobicContact CB-CD1 3.75Å; D617-Y689 HydrophobicContact CB-CE1 3.82Å; D617-Y689 VanDerWaalsContact CG-CD1 3.44Å; T687-Y689 WeakPolarHBondContact O-CD2 3.38Å; T687-Y689 PolarHBondContact O-N 2.85Å; Y689-E691 PolarHBondContact O-N 2.85Å; Y689-E691 VanDerWaalsContact O-N 3.14Å
690	A	58.1	Low	59.8	Low	21 Å²	21	78.6 Å²	78.6	17%	0.174	41%	0.409	C	S	.	.			trans	-73.7	102.7	163.6	0	0	0	0	0	108.3	H811	A690-H811 WeakPolarHBondContact CB-ND1 3.36Å; A690-H811 PolarHBondContact O-CE1 2.75Å; A690-H811 PolarHBondContact O-ND1 2.63Å
691	E	72	Confident	62.3	Low	135 Å²	135	75.6 Å²	75.6	63%	0.631	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-103.3	126.2	177.6	-66.3	-164.8	162.7	0	0	111.3	Y689	Y689-E691 PolarHBondContact O-N 2.85Å; Y689-E691 VanDerWaalsContact O-N 3.14Å
692	F	78.5	Confident	65	Low	13 Å²	13	78.5 Å²	78.5	6%	0.057	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-69.9	148	170.6	-68.5	-75.9	0	0	0	109.8	L654 V657 T658 I694 V697 F730 T746 H811	L654-F692 HydrophobicContact CB-CE1 4.27Å; L654-F692 HydrophobicContact CB-CE2 4.46Å; L654-F692 HydrophobicContact CB-CZ 3.97Å; L654-F692 HydrophobicContact CD1-CE2 4.28Å; L654-F692 HydrophobicContact CD2-CB 4.48Å; L654-F692 HydrophobicContact CD2-CD1 3.83Å; L654-F692 HydrophobicContact CD2-CD2 3.98Å; L654-F692 HydrophobicContact CD2-CE1 3.92Å; L654-F692 HydrophobicContact CD2-CE2 4.06Å; L654-F692 HydrophobicContact CD2-CG 3.86Å; L654-F692 HydrophobicContact CD2-CZ 4.02Å; L654-F692 HydrophobicContact CG-CZ 4.42Å; V657-F692 HydrophobicContact CB-CD1 4.46Å; V657-F692 HydrophobicContact CB-CE1 4.2Å; V657-F692 HydrophobicContact CG1-CD1 3.93Å; V657-F692 HydrophobicContact CG1-CE1 3.98Å; T658-F692 HydrophobicContact CG2-CE1 3.85Å; T658-F692 HydrophobicContact CG2-CZ 3.7Å; F692-I694 PolarHBondContact O-N 3.09Å; F692-V697 HydrophobicContact CB-CG2 3.48Å; F692-V697 VanDerWaalsContact CB-CG2 3.48Å; F692-V697 HydrophobicContact CG-CG2 4.41Å; F692-F730 AromaticContact CE2-CD1 3.96Å; F692-F730 HydrophobicContact CE2-CD1 3.96Å; F692-F730 AromaticContact CE2-CE1 3.63Å; F692-F730 HydrophobicContact CE2-CE1 3.63Å; F692-F730 HydrophobicContact CE2-CE2 4.48Å; F692-F730 AromaticContact CE2-CZ 3.93Å; F692-F730 HydrophobicContact CE2-CZ 3.93Å; F692-F730 HydrophobicContact CZ-CD1 4.48Å; F692-F730 AromaticContact CZ-CE1 3.84Å; F692-F730 HydrophobicContact CZ-CE1 3.84Å; F692-F730 HydrophobicContact CZ-CE2 4.1Å; F692-F730 AromaticContact CZ-CZ 3.63Å; F692-F730 HydrophobicContact CZ-CZ 3.63Å; F692-T746 HydrophobicContact CD2-CG2 3.96Å; F692-T746 HydrophobicContact CE2-CG2 4.5Å; F692-H811 AromaticContact CD1-CE1 3.75Å; F692-H811 AromaticContact CD1-NE2 3.42Å; F692-H811 WeakPolarHBondContact CD1-NE2 3.43Å; F692-H811 AromaticContact CD2-CE1 3.48Å; F692-H811 VanDerWaalsContact CD2-CE1 3.48Å; F692-H811 WeakPolarHBondContact CD2-CE1 3.4Å; F692-H811 AromaticContact CD2-ND1 3.84Å; F692-H811 AromaticContact CE1-CD2 3.55Å; F692-H811 AromaticContact CE1-CE1 3.85Å; F692-H811 AromaticContact CE1-NE2 3.43Å; F692-H811 WeakPolarHBondContact CE1-NE2 3.14Å; F692-H811 AromaticContact CE2-CE1 3.58Å; F692-H811 AromaticContact CE2-CG 3.91Å; F692-H811 AromaticContact CE2-ND1 3.51Å; F692-H811 AromaticContact CG-CE1 3.57Å; F692-H811 AromaticContact CG-NE2 3.73Å; F692-H811 HydrophobicContact CZ-CB 4.18Å; F692-H811 AromaticContact CZ-CD2 3.64Å; F692-H811 AromaticContact CZ-CE1 3.77Å; F692-H811 AromaticContact CZ-CG 3.62Å; F692-H811 AromaticContact CZ-ND1 3.72Å; F692-H811 AromaticContact CZ-NE2 3.74Å; F692-H811 PolarHBondContact N-CE1 3.43Å
693	N	82.7	Confident	67.8	Low	102 Å²	102	75.8 Å²	75.8	55%	0.545	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-55.2	130	171.3	-176.6	-33.4	0	0	0	110.4	S695 I696 V697	N693-S695 PolarHBondContact O-N 2.89Å; N693-S695 PolarHBondContact OD1-N 2.86Å; N693-S695 PolarHBondContact OD1-OG 2.95Å; N693-I696 HydrophobicContact CB-CD1 4Å; N693-I696 HydrophobicContact CB-CG1 4.13Å; N693-I696 WeakPolarHBondContact O-CA 3.28Å; N693-I696 WeakPolarHBondContact O-CB 3.39Å; N693-I696 PolarHBondContact O-N 3.31Å; N693-V697 PolarHBondContact O-N 3.49Å; N693-V697 VanDerWaalsContact O-N 3.1Å
694	I	81.8	Confident	70.8	Confident	81 Å²	81	69.6 Å²	69.6	42%	0.415	38%	0.376	S	S	.	.	H	α-helix	trans	-50.6	-35.7	-178.1	-64.6	170.8	0	0	0	112.3	F692 V697 K698 Y744	F692-I694 PolarHBondContact O-N 3.09Å; I694-V697 PolarHBondContact O-N 3.42Å; I694-K698 HydrophobicContact CG2-CD 4Å; I694-K698 HydrophobicContact CG2-CG 4.35Å; I694-K698 WeakPolarHBondContact O-CB 3.38Å; I694-K698 VanDerWaalsContact O-CG 3.27Å; I694-K698 WeakPolarHBondContact O-CG 3.03Å; I694-K698 PolarHBondContact O-N 2.91Å; I694-Y744 HydrophobicContact CG1-CD2 4.5Å; I694-Y744 HydrophobicContact CG2-CD2 3.65Å; I694-Y744 HydrophobicContact CG2-CE2 3.84Å; I694-Y744 HydrophobicContact CG2-CG 4.38Å
695	S	85.1	Confident	73.6	Confident	68 Å²	68	64.7 Å²	64.7	48%	0.476	36%	0.357	S	S	.	.	H	α-helix	trans	-62	-41.6	176.3	57.5	0	0	0	0	112.8	N693 A699	N693-S695 PolarHBondContact O-N 2.89Å; N693-S695 PolarHBondContact OD1-N 2.86Å; N693-S695 PolarHBondContact OD1-OG 2.95Å; S695-A699 WeakPolarHBondContact O-CB 3.06Å; S695-A699 PolarHBondContact O-N 2.81Å
696	I	85.5	Confident	76.4	Confident	53 Å²	53	68.5 Å²	68.5	27%	0.272	36%	0.36	S	S	.	.	H	α-helix	trans	-69.7	-44.4	177.8	-55.8	176.5	0	0	0	109.9	L654 V657 N693 K698 A699 A700	L654-I696 HydrophobicContact CD2-CG2 3.79Å; V657-I696 HydrophobicContact CG1-CD1 4.47Å; V657-I696 HydrophobicContact CG2-CD1 4.07Å; V657-I696 HydrophobicContact CG2-CG2 4.09Å; N693-I696 HydrophobicContact CB-CD1 4Å; N693-I696 HydrophobicContact CB-CG1 4.13Å; N693-I696 WeakPolarHBondContact O-CA 3.28Å; N693-I696 WeakPolarHBondContact O-CB 3.39Å; N693-I696 PolarHBondContact O-N 3.31Å; I696-K698 VanDerWaalsContact C-N 3.34Å; I696-K698 PolarHBondContact O-N 2.95Å; I696-A699 PolarHBondContact O-N 3.31Å; I696-A700 WeakPolarHBondContact O-CB 3.3Å; I696-A700 PolarHBondContact O-N 3.03Å
697	V	86	Confident	79	Confident	4 Å²	4	68.4 Å²	68.4	2%	0.024	36%	0.357	C	S	.	.	H	α-helix	trans	-61.4	-43.7	177	-178.3	0	0	0	0	111.1	F692 N693 I694 A700 I701 A732 Y744 T746	F692-V697 HydrophobicContact CB-CG2 3.48Å; F692-V697 VanDerWaalsContact CB-CG2 3.48Å; F692-V697 HydrophobicContact CG-CG2 4.41Å; N693-V697 PolarHBondContact O-N 3.49Å; N693-V697 VanDerWaalsContact O-N 3.1Å; I694-V697 PolarHBondContact O-N 3.42Å; V697-A700 PolarHBondContact O-N 3.25Å; V697-I701 HydrophobicContact CG1-CD1 3.85Å; V697-I701 HydrophobicContact CG1-CG1 4.49Å; V697-I701 VanDerWaalsContact O-CG1 3.27Å; V697-I701 WeakPolarHBondContact O-CG1 3.1Å; V697-I701 PolarHBondContact O-N 2.93Å; V697-A732 HydrophobicContact CG1-CB 4.34Å; V697-Y744 HydrophobicContact CG1-CD1 4.08Å; V697-T746 HydrophobicContact CG1-CG2 4.05Å; V697-T746 HydrophobicContact CG2-CG2 4.01Å
698	K	87.6	Confident	81.3	Confident	86 Å²	86	67.1 Å²	67.1	37%	0.374	35%	0.347	S	S	.	.	H	α-helix	trans	-58.1	-50.5	172.7	-76.4	171.7	177	176.8	0	111.2	I694 I696 A700 I701 H702 Y744	I694-K698 HydrophobicContact CG2-CD 4Å; I694-K698 HydrophobicContact CG2-CG 4.35Å; I694-K698 WeakPolarHBondContact O-CB 3.38Å; I694-K698 VanDerWaalsContact O-CG 3.27Å; I694-K698 WeakPolarHBondContact O-CG 3.03Å; I694-K698 PolarHBondContact O-N 2.91Å; I696-K698 VanDerWaalsContact C-N 3.34Å; I696-K698 PolarHBondContact O-N 2.95Å; K698-A700 VanDerWaalsContact C-N 3.34Å; K698-A700 PolarHBondContact O-N 3.33Å; K698-I701 PolarHBondContact O-N 3.31Å; K698-H702 WeakPolarHBondContact O-CB 3.28Å; K698-H702 PolarHBondContact O-CD2 2.95Å; K698-H702 PolarHBondContact O-N 3.3Å; K698-Y744 VanDerWaalsContact CE-CZ 3.46Å; K698-Y744 WeakPolarHBondContact CE-OH 3.1Å; K698-Y744 HydrophobicContact CG-CE1 3.84Å; K698-Y744 HydrophobicContact CG-CE2 4.45Å
699	A	89	Confident	82.9	Confident	52 Å²	52	63.4 Å²	63.4	43%	0.43	33%	0.332	S	S	.	.	H	α-helix	trans	-59.2	-43.6	179	0	0	0	0	0	112.4	S695 I696 H702 S703	S695-A699 WeakPolarHBondContact O-CB 3.06Å; S695-A699 PolarHBondContact O-N 2.81Å; I696-A699 PolarHBondContact O-N 3.31Å; A699-H702 PolarHBondContact O-N 3.45Å; A699-S703 WeakPolarHBondContact O-CB 3.39Å; A699-S703 PolarHBondContact O-N 2.88Å
700	A	88.8	Confident	84	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-62.5	-43.9	177.3	0	0	0	0	0	111.9	I646 L654 I696 V697 K698 S703	I646-A700 HydrophobicContact CG2-CB 3.75Å; L654-A700 HydrophobicContact CD1-CB 4.18Å; L654-A700 HydrophobicContact CD2-CB 4.21Å; L654-A700 HydrophobicContact CG-CB 3.93Å; I696-A700 WeakPolarHBondContact O-CB 3.3Å; I696-A700 PolarHBondContact O-N 3.03Å; V697-A700 PolarHBondContact O-N 3.25Å; K698-A700 VanDerWaalsContact C-N 3.34Å; K698-A700 PolarHBondContact O-N 3.33Å; A700-S703 PolarHBondContact O-N 2.96Å; A700-S703 PolarHBondContact O-OG 2.87Å
701	I	88.4	Confident	84.7	Confident	14 Å²	14	63 Å²	63	7%	0.072	34%	0.34	C	S	.	.	H	α-helix	trans	-65.8	-39.6	174.9	-64.5	166.7	0	0	0	111.4	Y644 I646 V697 K698 G705 A732 I734 Y744	Y644-I701 HydrophobicContact CD1-CG2 3.76Å; Y644-I701 HydrophobicContact CE1-CG2 4.15Å; Y644-I701 HydrophobicContact CG-CG2 4.24Å; I646-I701 HydrophobicContact CG1-CG1 4.38Å; V697-I701 HydrophobicContact CG1-CD1 3.85Å; V697-I701 HydrophobicContact CG1-CG1 4.49Å; V697-I701 VanDerWaalsContact O-CG1 3.27Å; V697-I701 WeakPolarHBondContact O-CG1 3.1Å; V697-I701 PolarHBondContact O-N 2.93Å; K698-I701 PolarHBondContact O-N 3.31Å; I701-G705 WeakPolarHBondContact O-CA 3.48Å; I701-G705 PolarHBondContact O-N 2.79Å; I701-A732 HydrophobicContact CD1-CB 3.59Å; I701-A732 HydrophobicContact CG1-CB 4.08Å; I701-I734 HydrophobicContact CD1-CD1 4.04Å; I701-I734 HydrophobicContact CD1-CG1 4.36Å; I701-Y744 HydrophobicContact CD1-CD1 4.29Å; I701-Y744 HydrophobicContact CD1-CE1 4.49Å
702	H	88.9	Confident	84.5	Confident	162 Å²	162	63.6 Å²	63.6	75%	0.75	35%	0.348	S	S	*	.	H	α-helix	trans	-73.3	-22.4	179.7	-77.3	-62.9	0	0	0	114.3	K698 A699	K698-H702 WeakPolarHBondContact O-CB 3.28Å; K698-H702 PolarHBondContact O-CD2 2.95Å; K698-H702 PolarHBondContact O-N 3.3Å; A699-H702 PolarHBondContact O-N 3.45Å
703	S	87.8	Confident	84.1	Confident	56 Å²	56	67.5 Å²	67.5	39%	0.392	37%	0.368	S	S	.	.	H	α-helix	trans	-70.1	-51.7	-178.8	66.7	0	0	0	0	113.3	G650 A699 A700	G650-S703 WeakPolarHBondContact CA-OG 3.31Å; G650-S703 PolarHBondContact N-OG 3.42Å; G650-S703 VanDerWaalsContact N-OG 3.15Å; A699-S703 WeakPolarHBondContact O-CB 3.39Å; A699-S703 PolarHBondContact O-N 2.88Å; A700-S703 PolarHBondContact O-N 2.96Å; A700-S703 PolarHBondContact O-OG 2.87Å
704	S	87.6	Confident	84	Confident	39 Å²	39	66.8 Å²	66.8	27%	0.273	36%	0.36	S	S	.	.	H	α-helix	trans	-148.3	9.5	-175.7	59.2	0	0	0	0	113.7	I646 G647 E649 G650	I646-S704 CarbonylContact O-C 3.52Å; I646-S704 PolarHBondContact O-OG 3.32Å; I646-S704 VanDerWaalsContact O-OG 3.06Å; G647-S704 VanDerWaalsContact CA-OG 3.24Å; G647-S704 WeakPolarHBondContact CA-OG 3.43Å; G647-S704 PolarHBondContact O-OG 3.12Å; E649-S704 PolarHBondContact N-OG 3.01Å; G650-S704 PolarHBondContact N-OG 2.03Å
705	G	84.9	Confident	84.2	Confident	27 Å²	27	69.2 Å²	69.2	28%	0.278	37%	0.37	S	S	.	.			trans	-73.5	145.1	-171.8	0	0	0	0	0	113.2	Y645 I646 I701	Y645-G705 CarbonylContact O-C 3.55Å; Y645-G705 WeakPolarHBondContact O-CA 3.48Å; I646-G705 VanDerWaalsContact O-CA 3.3Å; I646-G705 WeakPolarHBondContact O-CA 3.31Å; I646-G705 PolarHBondContact O-N 2.77Å; I701-G705 WeakPolarHBondContact O-CA 3.48Å; I701-G705 PolarHBondContact O-N 2.79Å
706	R	89.9	Confident	84.3	Confident	156 Å²	156	66.3 Å²	66.3	59%	0.589	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	132.6	174.2	63.5	-179.8	-178.3	178.8	-2.8	110.9	Y644 Y645 L708	Y644-R706 VanDerWaalsContact CA-O 3.32Å; Y644-R706 WeakPolarHBondContact CA-O 3.39Å; Y645-R706 HydrophobicContact CD1-CG 4.19Å; Y645-R706 PolarHBondContact N-O 2.96Å; Y645-R706 PolarHBondContact O-N 2.82Å; R706-L708 HydrophobicContact CG-CD2 4.28Å; R706-L708 PolarHBondContact O-N 3.29Å
707	K	89.8	Confident	84.3	Confident	100 Å²	100	66.6 Å²	66.6	44%	0.435	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	117.7	169.2	-169.7	170.5	177.7	165.2	0	107.9	D640 S642 Y644	D640-K707 IonicContact OD2-NZ 3.84Å; S642-K707 WeakPolarHBondContact OG-CE 3.37Å; S642-K707 PolarHBondContact OG-NZ 2.99Å; Y644-K707 HydrophobicContact CD1-CB 3.98Å; Y644-K707 HydrophobicContact CE1-CB 3.6Å; Y644-K707 HydrophobicContact CE1-CG 4.15Å; Y644-K707 HydrophobicContact CE2-CG 4.3Å
708	L	87	Confident	84.5	Confident	46 Å²	46	68.8 Å²	68.8	24%	0.241	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-40.7	176.6	-63.5	176.9	0	0	0	111.1	L643 R706 Y731	L643-L708 HydrophobicContact CD2-CD1 4.19Å; L643-L708 HydrophobicContact CG-CD1 4.32Å; L643-L708 PolarHBondContact O-N 2.74Å; R706-L708 HydrophobicContact CG-CD2 4.28Å; R706-L708 PolarHBondContact O-N 3.29Å; L708-Y731 HydrophobicContact CD1-CD1 3.76Å; L708-Y731 HydrophobicContact CD1-CE1 3.74Å
709	L	86	Confident	84.6	Confident	69 Å²	69	71.6 Å²	71.6	36%	0.361	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	143.1	-176.2	-168	51.8	0	0	0	109.1	S642 L643 V716 H718	S642-L709 WeakPolarHBondContact CA-O 3.47Å; L643-L709 PolarHBondContact N-O 2.89Å; L643-L709 PolarHBondContact O-N 2.94Å; L709-V716 HydrophobicContact CB-CG1 3.94Å; L709-V716 HydrophobicContact CD2-CG1 3.7Å; L709-V716 HydrophobicContact CG-CG1 3.83Å; L709-H718 HydrophobicContact CD2-CB 4.32Å
710	G	78.1	Confident	84.6	Confident	34 Å²	34	69.6 Å²	69.6	35%	0.351	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	152.7	169.1	0	0	0	0	0	109.3
711	S	74.3	Confident	84.8	Confident	26 Å²	26	73.9 Å²	73.9	18%	0.182	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	126.4	-176.3	-171.7	0	0	0	0	109	V641 I713 Q715	V641-S711 PolarHBondContact N-O 3.38Å; V641-S711 PolarHBondContact O-N 3.36Å; S711-I713 PolarHBondContact O-N 2.75Å; S711-I713 WeakPolarHBondContact OG-CB 3.38Å; S711-Q715 WeakPolarHBondContact CB-O 3.37Å; S711-Q715 PolarHBondContact OG-O 3.22Å; S711-Q715 VanDerWaalsContact OG-O 3.13Å
712	D	66.8	Low	84.9	Confident	148 Å²	148	73.2 Å²	73.2	79%	0.791	38%	0.376	S	S	*	.	S	Bend	trans	-73.9	31	172.6	-50.5	-45.2	0	0	0	111.5
713	I	69.2	Low	85	Confident	94 Å²	94	70.4 Å²	70.4	48%	0.482	37%	0.371	S	S	.	.	S	Bend	trans	-144	149.2	-169.3	-46.5	175.4	0	0	0	107.6	E638 S711 Q715	E638-I713 WeakPolarHBondContact OE1-CA 3.2Å; S711-I713 PolarHBondContact O-N 2.75Å; S711-I713 WeakPolarHBondContact OG-CB 3.38Å; I713-Q715 PolarHBondContact O-N 3.06Å
714	K	81.2	Confident	85.2	Confident	87 Å²	87	69.6 Å²	69.6	38%	0.378	37%	0.365	S	S	.	.	S	Bend	trans	-41.4	-11.3	175	-83.3	156	-171.3	164.8	0	118.6	S632 A633 E638	S632-K714 CarbonylContact C-O 3.58Å; S632-K714 WeakPolarHBondContact CA-O 3.24Å; S632-K714 WeakPolarHBondContact CB-O 3.38Å; A633-K714 PolarHBondContact N-O 3.21Å; E638-K714 VanDerWaalsContact CD-CE 3.43Å; E638-K714 HydrophobicContact CG-CD 4.33Å; E638-K714 HydrophobicContact CG-CG 3.9Å; E638-K714 WeakPolarHBondContact OE1-CD 3.34Å; E638-K714 VanDerWaalsContact OE1-CG 3.31Å; E638-K714 WeakPolarHBondContact OE1-CG 3.42Å; E638-K714 PolarHBondContact OE1-N 2.97Å; E638-K714 WeakPolarHBondContact OE2-CE 3.38Å; E638-K714 IonicContact OE2-NZ 3.44Å; E638-K714 PolarHBondContact OE2-NZ 3.48Å
715	Q	85.2	Confident	85.2	Confident	132 Å²	132	73 Å²	73	62%	0.617	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.2	154.2	-176.7	66.9	-177.7	6.1	0	0	115.1	C631 S711 I713	C631-Q715 CarbonylContact O-C 3.57Å; C631-Q715 VanDerWaalsContact O-CA 3.26Å; C631-Q715 WeakPolarHBondContact O-CA 3.4Å; S711-Q715 WeakPolarHBondContact CB-O 3.37Å; S711-Q715 PolarHBondContact OG-O 3.22Å; S711-Q715 VanDerWaalsContact OG-O 3.13Å; I713-Q715 PolarHBondContact O-N 3.06Å
716	V	87.3	Confident	85.3	Confident	7 Å²	7	79 Å²	79	4%	0.042	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	134.8	173.7	174.2	0	0	0	0	108.9	E630 C631 V641 L643 L709	E630-V716 WeakPolarHBondContact CA-O 3.26Å; C631-V716 PolarHBondContact N-O 3.4Å; C631-V716 PolarHBondContact O-N 3.32Å; V641-V716 HydrophobicContact CB-CG2 4.05Å; V641-V716 HydrophobicContact CG1-CB 4.27Å; V641-V716 HydrophobicContact CG1-CG2 3.86Å; V641-V716 WeakPolarHBondContact O-CG2 3.49Å; L643-V716 HydrophobicContact CB-CG1 3.97Å; L709-V716 HydrophobicContact CB-CG1 3.94Å; L709-V716 HydrophobicContact CD2-CG1 3.7Å; L709-V716 HydrophobicContact CG-CG1 3.83Å
717	S	87.1	Confident	85.3	Confident	59 Å²	59	73.4 Å²	73.4	41%	0.413	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	126.2	169.2	177.2	0	0	0	0	109.4	L629 E630	L629-S717 WeakPolarHBondContact O-CA 3.36Å; E630-S717 WeakPolarHBondContact OE1-CB 3.32Å; E630-S717 PolarHBondContact OE1-OG 2.88Å
718	H	88.9	Confident	85.4	Confident	51 Å²	51	70 Å²	70	24%	0.236	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	128.5	-178.1	179.9	80.9	0	0	0	111.2	L629 L643 L709 L720	L629-H718 HydrophobicContact CB-CB 4.4Å; L629-H718 PolarHBondContact N-O 3.11Å; L629-H718 PolarHBondContact O-N 3.24Å; L643-H718 HydrophobicContact CD2-CB 3.59Å; L709-H718 HydrophobicContact CD2-CB 4.32Å; H718-L720 PolarHBondContact O-N 2.9Å
719	K	90.1	Very high	85.6	Confident	145 Å²	145	68 Å²	68	63%	0.63	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	100.1	178	-63.5	-174	-179	-174.4	0	110.4	I626	I626-K719 HydrophobicContact CG2-CB 4.01Å
720	L	90.3	Very high	85.9	Confident	10 Å²	10	64.8 Å²	64.8	5%	0.052	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	108.3	176.5	179.8	68.7	0	0	0	110.2	I626 I627 L629 H718 L722 Q727 Y731 V749	I626-L720 CarbonylContact C-O 3.58Å; I626-L720 WeakPolarHBondContact CA-O 3.39Å; I627-L720 PolarHBondContact N-O 2.85Å; I627-L720 PolarHBondContact O-N 2.84Å; L629-L720 HydrophobicContact CD1-CB 4.31Å; L629-L720 HydrophobicContact CD1-CD2 4.22Å; H718-L720 PolarHBondContact O-N 2.9Å; L720-L722 HydrophobicContact CD2-CD2 4.01Å; L720-L722 HydrophobicContact CG-CD2 4.28Å; L720-Q727 HydrophobicContact CD1-CB 4.46Å; L720-Y731 HydrophobicContact CD2-CE1 4.31Å; L720-Y731 HydrophobicContact CD2-CE2 4.18Å; L720-Y731 VanDerWaalsContact CD2-OH 3.31Å; L720-Y731 WeakPolarHBondContact CD2-OH 3.38Å; L720-V749 HydrophobicContact CD2-CG1 4.17Å; L720-V749 HydrophobicContact CD2-CG2 4.32Å
721	H	91.8	Very high	86.5	Confident	89 Å²	89	63.5 Å²	63.5	41%	0.412	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	115.7	172.5	-169.8	-59.4	0	0	0	110.2	I626 T723 Q727	I626-H721 HydrophobicContact CG1-CB 4.26Å; H721-T723 VanDerWaalsContact ND1-CG2 3.3Å; H721-T723 WeakPolarHBondContact ND1-CG2 3.45Å; H721-T723 PolarHBondContact O-N 3.47Å; H721-Q727 PolarHBondContact O-NE2 3.1Å; H721-Q727 PolarHBondContact O-OE1 2.62Å
722	L	91	Very high	87.4	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.313	C	S	.	.			trans	-77.5	85.6	-176.6	-65.8	176.8	0	0	0	111.4	E622 L623 G624 Q625 I627 L720 Q727 F728 V749	E622-L722 WeakPolarHBondContact O-CD1 3.36Å; L623-L722 CarbonylContact C-O 3.59Å; L623-L722 WeakPolarHBondContact CA-O 3.34Å; G624-L722 PolarHBondContact N-O 2.9Å; Q625-L722 PolarHBondContact O-N 2.9Å; I627-L722 HydrophobicContact CD1-CD1 3.68Å; I627-L722 HydrophobicContact CD1-CG 4.36Å; I627-L722 HydrophobicContact CG1-CD1 4.16Å; L720-L722 HydrophobicContact CD2-CD2 4.01Å; L720-L722 HydrophobicContact CG-CD2 4.28Å; L722-Q727 HydrophobicContact CD2-CB 4.09Å; L722-F728 HydrophobicContact CD1-CE1 3.69Å; L722-F728 HydrophobicContact CD1-CZ 4.03Å; L722-F728 HydrophobicContact CD2-CD1 4.32Å; L722-F728 HydrophobicContact CD2-CE1 3.98Å; L722-F728 HydrophobicContact CD2-CZ 4.42Å; L722-F728 HydrophobicContact CG-CE1 4.43Å; L722-V749 HydrophobicContact CD2-CG1 4.15Å
723	T	91.2	Very high	88.5	Confident	103 Å²	103	55.3 Å²	55.3	63%	0.632	28%	0.276	S	S	*	.			trans	-93.2	-26.5	175.8	58.5	0	0	0	0	114.2	H721 Q727	H721-T723 VanDerWaalsContact ND1-CG2 3.3Å; H721-T723 WeakPolarHBondContact ND1-CG2 3.45Å; H721-T723 PolarHBondContact O-N 3.47Å; T723-Q727 PolarHBondContact OG1-OE1 2.84Å
724	S	91.1	Very high	89.6	Confident	40 Å²	40	51.3 Å²	51.3	28%	0.28	26%	0.256	S	S	.	.	S	Bend	trans	-136.6	148.2	-173.2	176.7	0	0	0	0	110.9	E726 Q727	S724-E726 PolarHBondContact O-N 3.41Å; S724-E726 PolarHBondContact OG-N 3.33Å; S724-Q727 WeakPolarHBondContact O-CB 3.46Å; S724-Q727 PolarHBondContact O-N 2.98Å; S724-Q727 VanDerWaalsContact O-N 3.11Å
725	H	89	Confident	90.1	Very high	111 Å²	111	47.1 Å²	47.1	51%	0.514	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-59.8	-24	173.5	-72.1	-80	0	0	0	112.9	Q727 F728 Q751	H725-Q727 PolarHBondContact O-N 2.82Å; H725-Q727 VanDerWaalsContact O-N 3.14Å; H725-F728 HydrophobicContact CB-CD2 4.38Å; H725-F728 AromaticContact ND1-CE2 3.84Å; H725-F728 WeakPolarHBondContact O-CD2 3.35Å; H725-F728 PolarHBondContact O-N 2.9Å; H725-F728 VanDerWaalsContact O-N 3.16Å; H725-Q751 PolarHBondContact CE1-OE1 2.86Å; H725-Q751 VanDerWaalsContact CE1-OE1 3.24Å; H725-Q751 PolarHBondContact ND1-OE1 2.84Å
726	E	86.3	Confident	90.4	Very high	153 Å²	153	45 Å²	45	72%	0.715	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-63.1	-15.7	175.8	-62.8	177.5	166.5	0	0	113.8	Y645 S724	Y645-E726 PolarHBondContact OH-O 3.43Å; S724-E726 PolarHBondContact O-N 3.41Å; S724-E726 PolarHBondContact OG-N 3.33Å
727	Q	89.9	Confident	90.5	Very high	38 Å²	38	45 Å²	45	18%	0.178	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-86.2	-12.1	178.8	-62.1	175.1	-85.7	0	0	113.1	L720 H721 L722 T723 S724 H725 Y731	L720-Q727 HydrophobicContact CD1-CB 4.46Å; H721-Q727 PolarHBondContact O-NE2 3.1Å; H721-Q727 PolarHBondContact O-OE1 2.62Å; L722-Q727 HydrophobicContact CD2-CB 4.09Å; T723-Q727 PolarHBondContact OG1-OE1 2.84Å; S724-Q727 WeakPolarHBondContact O-CB 3.46Å; S724-Q727 PolarHBondContact O-N 2.98Å; S724-Q727 VanDerWaalsContact O-N 3.11Å; H725-Q727 PolarHBondContact O-N 2.82Å; H725-Q727 VanDerWaalsContact O-N 3.14Å; Q727-Y731 WeakPolarHBondContact O-CE2 3.25Å; Q727-Y731 PolarHBondContact O-OH 3.12Å
728	F	91.5	Very high	90.6	Very high	27 Å²	27	48.1 Å²	48.1	12%	0.118	24%	0.244	C	C	.	.			trans	-75.8	151.6	168.9	-61.6	-64.2	0	0	0	110.5	L623 L722 H725 V749 Q751	L623-F728 HydrophobicContact CD2-CE2 4Å; L623-F728 HydrophobicContact CD2-CZ 4.33Å; L722-F728 HydrophobicContact CD1-CE1 3.69Å; L722-F728 HydrophobicContact CD1-CZ 4.03Å; L722-F728 HydrophobicContact CD2-CD1 4.32Å; L722-F728 HydrophobicContact CD2-CE1 3.98Å; L722-F728 HydrophobicContact CD2-CZ 4.42Å; L722-F728 HydrophobicContact CG-CE1 4.43Å; H725-F728 HydrophobicContact CB-CD2 4.38Å; H725-F728 AromaticContact ND1-CE2 3.84Å; H725-F728 WeakPolarHBondContact O-CD2 3.35Å; H725-F728 PolarHBondContact O-N 2.9Å; H725-F728 VanDerWaalsContact O-N 3.16Å; F728-V749 CarbonylContact C-O 3.51Å; F728-V749 VanDerWaalsContact CA-O 3.31Å; F728-V749 WeakPolarHBondContact CA-O 3.26Å; F728-V749 WeakPolarHBondContact CB-O 3.41Å; F728-V749 HydrophobicContact CD1-CG1 4.11Å; F728-Q751 HydrophobicContact CD1-CB 4.4Å; F728-Q751 HydrophobicContact CD2-CB 4.34Å; F728-Q751 HydrophobicContact CE1-CB 4.02Å; F728-Q751 HydrophobicContact CE2-CB 3.97Å; F728-Q751 HydrophobicContact CE2-CG 4.37Å; F728-Q751 HydrophobicContact CZ-CB 3.8Å; F728-Q751 HydrophobicContact CZ-CG 4.15Å
729	G	91.3	Very high	90.4	Very high	5 Å²	5	49.5 Å²	49.5	5%	0.052	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	128.7	-171.3	-176.6	0	0	0	0	0	113.2	Y731 V749	G729-Y731 WeakPolarHBondContact O-CD2 3.45Å; G729-V749 PolarHBondContact N-O 3.42Å; G729-V749 PolarHBondContact O-N 3.02Å
730	F	91.5	Very high	90.5	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.009	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	140.5	177.7	-62.1	-77.2	0	0	0	112.7	I646 Q651 L654 T658 F692 V747 Y748 H811 R812	I646-F730 WeakPolarHBondContact CB-O 3.39Å; I646-F730 HydrophobicContact CD1-CB 3.7Å; Q651-F730 PolarHBondContact NE2-O 2.88Å; L654-F730 HydrophobicContact CB-CD2 3.69Å; L654-F730 HydrophobicContact CB-CE2 3.78Å; L654-F730 HydrophobicContact CB-CG 4.49Å; L654-F730 HydrophobicContact CD1-CB 3.77Å; L654-F730 HydrophobicContact CD1-CD2 3.81Å; L654-F730 HydrophobicContact CD1-CG 3.83Å; L654-F730 HydrophobicContact CG-CD2 4.43Å; T658-F730 HydrophobicContact CG2-CZ 4.01Å; F692-F730 AromaticContact CE2-CD1 3.96Å; F692-F730 HydrophobicContact CE2-CD1 3.96Å; F692-F730 AromaticContact CE2-CE1 3.63Å; F692-F730 HydrophobicContact CE2-CE1 3.63Å; F692-F730 HydrophobicContact CE2-CE2 4.48Å; F692-F730 AromaticContact CE2-CZ 3.93Å; F692-F730 HydrophobicContact CE2-CZ 3.93Å; F692-F730 HydrophobicContact CZ-CD1 4.48Å; F692-F730 AromaticContact CZ-CE1 3.84Å; F692-F730 HydrophobicContact CZ-CE1 3.84Å; F692-F730 HydrophobicContact CZ-CE2 4.1Å; F692-F730 AromaticContact CZ-CZ 3.63Å; F692-F730 HydrophobicContact CZ-CZ 3.63Å; F730-V747 CarbonylContact C-O 3.25Å; F730-V747 WeakPolarHBondContact CA-O 3.46Å; F730-Y748 AromaticContact CD1-CD2 3.54Å; F730-Y748 HydrophobicContact CD1-CD2 3.54Å; F730-Y748 HydrophobicContact CD1-CG 4.14Å; F730-Y748 AromaticContact CD2-CD2 3.94Å; F730-Y748 HydrophobicContact CD2-CD2 3.94Å; F730-Y748 HydrophobicContact CD2-CE2 4.26Å; F730-Y748 AromaticContact CE1-CD2 3.45Å; F730-Y748 HydrophobicContact CE1-CD2 3.45Å; F730-Y748 VanDerWaalsContact CE1-CD2 3.45Å; F730-Y748 HydrophobicContact CE1-CE2 4.37Å; F730-Y748 AromaticContact CE1-CG 3.93Å; F730-Y748 HydrophobicContact CE1-CG 3.93Å; F730-Y748 AromaticContact CE2-CD2 3.89Å; F730-Y748 HydrophobicContact CE2-CD2 3.89Å; F730-Y748 HydrophobicContact CE2-CE2 4.08Å; F730-Y748 AromaticContact CG-CD2 3.77Å; F730-Y748 HydrophobicContact CG-CD2 3.77Å; F730-Y748 AromaticContact CZ-CD2 3.63Å; F730-Y748 HydrophobicContact CZ-CD2 3.63Å; F730-Y748 HydrophobicContact CZ-CE2 4.12Å; F730-Y748 HydrophobicContact CZ-CG 4.39Å; F730-H811 HydrophobicContact CE1-CB 4.33Å; F730-H811 HydrophobicContact CZ-CB 4.32Å; F730-R812 HydrophobicContact CZ-CG 4.36Å
731	Y	92.4	Very high	90.5	Very high	6 Å²	6	49.3 Å²	49.3	2%	0.024	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	155.9	167.8	-67.1	-105.5	0	0	0	107.5	L629 Y644 Y645 L708 L720 Q727 G729 T746 V747 V749	L629-Y731 HydrophobicContact CD1-CD1 3.49Å; L629-Y731 VanDerWaalsContact CD1-CD1 3.49Å; L629-Y731 HydrophobicContact CD1-CD2 4.43Å; L629-Y731 HydrophobicContact CD1-CE1 3.7Å; L629-Y731 HydrophobicContact CD1-CG 3.9Å; Y644-Y731 CarbonylContact O-C 3.58Å; Y644-Y731 WeakPolarHBondContact O-CA 3.3Å; Y645-Y731 HydrophobicContact CD2-CD1 4.09Å; Y645-Y731 AromaticContact CD2-CE1 3.58Å; Y645-Y731 HydrophobicContact CD2-CE1 3.58Å; Y645-Y731 HydrophobicContact CD2-CE2 4.14Å; Y645-Y731 AromaticContact CD2-CZ 3.58Å; Y645-Y731 HydrophobicContact CE2-CE2 4.47Å; Y645-Y731 HydrophobicContact CG-CE1 4.23Å; L708-Y731 HydrophobicContact CD1-CD1 3.76Å; L708-Y731 HydrophobicContact CD1-CE1 3.74Å; L720-Y731 HydrophobicContact CD2-CE1 4.31Å; L720-Y731 HydrophobicContact CD2-CE2 4.18Å; L720-Y731 VanDerWaalsContact CD2-OH 3.31Å; L720-Y731 WeakPolarHBondContact CD2-OH 3.38Å; Q727-Y731 WeakPolarHBondContact O-CE2 3.25Å; Q727-Y731 PolarHBondContact O-OH 3.12Å; G729-Y731 WeakPolarHBondContact O-CD2 3.45Å; Y731-T746 CarbonylContact O-C 3.54Å; Y731-T746 VanDerWaalsContact O-CA 3.29Å; Y731-T746 WeakPolarHBondContact O-CA 3.41Å; Y731-V747 PolarHBondContact N-O 3.3Å; Y731-V747 PolarHBondContact O-N 2.94Å; Y731-V749 HydrophobicContact CD2-CB 4.18Å; Y731-V749 HydrophobicContact CD2-CG2 3.6Å; Y731-V749 HydrophobicContact CE2-CB 3.85Å; Y731-V749 HydrophobicContact CE2-CG2 3.6Å
732	A	91.6	Very high	90.4	Very high	1 Å²	1	47 Å²	47	1%	0.008	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	135.6	177.9	0	0	0	0	0	111.1	Y644 I646 V697 I701 T746	Y644-A732 PolarHBondContact N-O 3.2Å; Y644-A732 PolarHBondContact O-N 3.19Å; I646-A732 HydrophobicContact CD1-CB 3.97Å; I646-A732 HydrophobicContact CG1-CB 4.12Å; V697-A732 HydrophobicContact CG1-CB 4.34Å; I701-A732 HydrophobicContact CD1-CB 3.59Å; I701-A732 HydrophobicContact CG1-CB 4.08Å; A732-T746 HydrophobicContact CB-CG2 4.47Å
733	C	91.3	Very high	90.3	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.014	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	140.5	164.4	-171.2	0	0	0	0	109.8	F611 C631 S642 Y744 R745	F611-C733 HydrophobicContact CE1-CB 4.22Å; F611-C733 HydrophobicContact CZ-CB 4.41Å; C631-C733 HydrophobicContact CB-CB 3.78Å; C631-C733 WeakPolarHBondContact CB-SG 3.27Å; C631-C733 WeakPolarHBondContact SG-CB 3.1Å; C631-C733 CovalentContact SG-SG 2.02Å; C631-C733 PolarHBondContact SG-SG 3.4Å; S642-C733 CarbonylContact O-C 3.4Å; S642-C733 WeakPolarHBondContact O-CA 3.15Å; C733-Y744 CarbonylContact O-C 3.57Å; C733-Y744 WeakPolarHBondContact O-CA 3.3Å; C733-R745 PolarHBondContact N-O 2.79Å; C733-R745 PolarHBondContact O-N 3.31Å
734	I	91.9	Very high	90.3	Very high	9 Å²	9	45.9 Å²	45.9	5%	0.046	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	135.1	173.2	-45.5	-179.3	0	0	0	107.7	S642 Y644 I701 Q736 I743 Y744	S642-I734 PolarHBondContact N-O 2.9Å; S642-I734 PolarHBondContact O-N 3.21Å; Y644-I734 HydrophobicContact CD2-CD1 3.73Å; Y644-I734 HydrophobicContact CD2-CG1 3.87Å; Y644-I734 HydrophobicContact CE2-CB 4.36Å; Y644-I734 HydrophobicContact CE2-CD1 3.33Å; Y644-I734 HydrophobicContact CE2-CG1 3.76Å; I701-I734 HydrophobicContact CD1-CD1 4.04Å; I701-I734 HydrophobicContact CD1-CG1 4.36Å; I734-Q736 HydrophobicContact CG2-CG 3.89Å; I734-I743 WeakPolarHBondContact CA-O 3.25Å; I734-Y744 HydrophobicContact CD1-CD1 4.23Å; I734-Y744 HydrophobicContact CD1-CE1 3.76Å; I734-Y744 HydrophobicContact CG1-CD1 3.9Å; I734-Y744 HydrophobicContact CG1-CE1 3.9Å; I734-Y744 HydrophobicContact CG2-CD1 4.29Å; I734-Y744 HydrophobicContact CG2-CE1 3.93Å
735	A	91.5	Very high	90.1	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	132.8	168.2	0	0	0	0	0	110.6	P609 F611 A633 A639 D640 V641 S742 I743	P609-A735 HydrophobicContact CB-CB 3.97Å; F611-A735 HydrophobicContact CE1-CB 3.79Å; F611-A735 HydrophobicContact CZ-CB 4.07Å; A633-A735 HydrophobicContact CB-CB 3.55Å; A639-A735 HydrophobicContact CB-CB 4.36Å; D640-A735 CarbonylContact O-C 3.55Å; D640-A735 WeakPolarHBondContact O-CA 3.38Å; V641-A735 HydrophobicContact CG2-CB 4.3Å; A735-S742 WeakPolarHBondContact O-CA 3.34Å; A735-I743 HydrophobicContact CB-CD1 4.23Å; A735-I743 HydrophobicContact CB-CG1 3.82Å; A735-I743 PolarHBondContact N-O 3.25Å; A735-I743 PolarHBondContact O-N 3.13Å; A735-I743 VanDerWaalsContact O-N 3.11Å
736	Q	91	Very high	90	Very high	86 Å²	86	40.5 Å²	40.5	40%	0.402	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	125.3	-174.5	-50.7	-166.5	-2.2	0	0	111.4	A639 D640 I734	A639-Q736 CarbonylContact C-O 3.57Å; A639-Q736 WeakPolarHBondContact CA-O 3.4Å; A639-Q736 WeakPolarHBondContact CB-O 3.36Å; D640-Q736 PolarHBondContact N-O 3.11Å; D640-Q736 PolarHBondContact O-N 2.96Å; I734-Q736 HydrophobicContact CG2-CG 3.89Å
737	T	90.7	Very high	90.2	Very high	9 Å²	9	33.7 Å²	33.7	6%	0.055	20%	0.202	C	C	.	.			trans	-123.1	139.7	173.2	-55.2	0	0	0	0	109.3	P637 A639 G739 Y740	P637-T737 HydrophobicContact CB-CG2 4.15Å; P637-T737 WeakPolarHBondContact O-CG2 3.39Å; A639-T737 WeakPolarHBondContact CB-OG1 3.37Å; T737-G739 PolarHBondContact O-N 2.93Å; T737-Y740 HydrophobicContact CG2-CD2 3.87Å; T737-Y740 HydrophobicContact CG2-CE2 4.48Å; T737-Y740 PolarHBondContact O-N 2.88Å; T737-Y740 VanDerWaalsContact O-N 3.17Å
738	T	87.8	Confident	90.2	Very high	123 Å²	123	33 Å²	33	76%	0.755	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	129.5	176.5	46.6	0	0	0	0	111.5	Y740	T738-Y740 VanDerWaalsContact C-N 3.34Å; T738-Y740 WeakPolarHBondContact O-CD2 3.39Å; T738-Y740 PolarHBondContact O-N 2.82Å
739	G	86.3	Confident	90.3	Very high	81 Å²	81	31.7 Å²	31.7	84%	0.835	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.8	0.1	-178.7	0	0	0	0	0	116.1	T737	T737-G739 PolarHBondContact O-N 2.93Å
740	Y	90.1	Very high	90.3	Very high	44 Å²	44	31.4 Å²	31.4	17%	0.173	19%	0.19	C	C	.	.	S	Bend	trans	-125	152.4	178.3	-65.2	-87.2	0	0	0	111.7	T606 Y607 G608 T737 T738	T606-Y740 WeakPolarHBondContact CB-OH 3.19Å; T606-Y740 PolarHBondContact O-OH 2.98Å; T606-Y740 PolarHBondContact OG1-OH 2.61Å; Y607-Y740 PolarHBondContact N-OH 3.04Å; G608-Y740 VanDerWaalsContact CA-CG 3.41Å; G608-Y740 VanDerWaalsContact N-CE1 3.27Å; T737-Y740 HydrophobicContact CG2-CD2 3.87Å; T737-Y740 HydrophobicContact CG2-CE2 4.48Å; T737-Y740 PolarHBondContact O-N 2.88Å; T737-Y740 VanDerWaalsContact O-N 3.17Å; T738-Y740 VanDerWaalsContact C-N 3.34Å; T738-Y740 WeakPolarHBondContact O-CD2 3.39Å; T738-Y740 PolarHBondContact O-N 2.82Å
741	P	90.6	Very high	90.3	Very high	106 Å²	106	35.2 Å²	35.2	69%	0.688	21%	0.207	S	C	*	.			trans	-65.3	141.6	175.2	28.1	-34.8	0	0	0	111.1
742	S	90.3	Very high	90.3	Very high	40 Å²	40	35.5 Å²	35.5	28%	0.28	21%	0.211	S	C	.	.			trans	-70.5	138.7	174.3	-43.4	0	0	0	0	111.3	A735 Y744	A735-S742 WeakPolarHBondContact O-CA 3.34Å; S742-Y744 WeakPolarHBondContact O-CE2 3.31Å
743	I	90.1	Very high	90.3	Very high	40 Å²	40	38 Å²	38	21%	0.205	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	154.1	175.5	61.4	167.2	0	0	0	111.3	P609 F611 I734 A735	P609-I743 HydrophobicContact CB-CD1 3.92Å; P609-I743 HydrophobicContact CB-CG1 4.05Å; P609-I743 HydrophobicContact CG-CD1 4.36Å; P609-I743 HydrophobicContact CG-CG1 4.05Å; P609-I743 HydrophobicContact CG-CG2 4.48Å; P609-I743 WeakPolarHBondContact O-CD1 3.37Å; F611-I743 HydrophobicContact CD1-CD1 4.26Å; F611-I743 HydrophobicContact CD2-CD1 3.48Å; F611-I743 VanDerWaalsContact CD2-CD1 3.48Å; F611-I743 HydrophobicContact CD2-CG1 4.11Å; F611-I743 HydrophobicContact CE1-CD1 4.21Å; F611-I743 HydrophobicContact CE1-CG1 4.39Å; F611-I743 HydrophobicContact CE2-CB 3.96Å; F611-I743 HydrophobicContact CE2-CD1 3.42Å; F611-I743 VanDerWaalsContact CE2-CD1 3.42Å; F611-I743 HydrophobicContact CE2-CG1 3.5Å; F611-I743 HydrophobicContact CG-CD1 3.92Å; F611-I743 HydrophobicContact CZ-CB 4.47Å; F611-I743 HydrophobicContact CZ-CD1 3.83Å; F611-I743 HydrophobicContact CZ-CG1 3.68Å; I734-I743 WeakPolarHBondContact CA-O 3.25Å; A735-I743 HydrophobicContact CB-CD1 4.23Å; A735-I743 HydrophobicContact CB-CG1 3.82Å; A735-I743 PolarHBondContact N-O 3.25Å; A735-I743 PolarHBondContact O-N 3.13Å; A735-I743 VanDerWaalsContact O-N 3.11Å
744	Y	89.5	Confident	90.4	Very high	40 Å²	40	40.4 Å²	40.4	16%	0.157	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	137.7	-172.1	-62.9	-102.6	0	0	0	109.5	I694 V697 K698 I701 C733 I734 S742	I694-Y744 HydrophobicContact CG1-CD2 4.5Å; I694-Y744 HydrophobicContact CG2-CD2 3.65Å; I694-Y744 HydrophobicContact CG2-CE2 3.84Å; I694-Y744 HydrophobicContact CG2-CG 4.38Å; V697-Y744 HydrophobicContact CG1-CD1 4.08Å; K698-Y744 VanDerWaalsContact CE-CZ 3.46Å; K698-Y744 WeakPolarHBondContact CE-OH 3.1Å; K698-Y744 HydrophobicContact CG-CE1 3.84Å; K698-Y744 HydrophobicContact CG-CE2 4.45Å; I701-Y744 HydrophobicContact CD1-CD1 4.29Å; I701-Y744 HydrophobicContact CD1-CE1 4.49Å; C733-Y744 CarbonylContact O-C 3.57Å; C733-Y744 WeakPolarHBondContact O-CA 3.3Å; I734-Y744 HydrophobicContact CD1-CD1 4.23Å; I734-Y744 HydrophobicContact CD1-CE1 3.76Å; I734-Y744 HydrophobicContact CG1-CD1 3.9Å; I734-Y744 HydrophobicContact CG1-CE1 3.9Å; I734-Y744 HydrophobicContact CG2-CD1 4.29Å; I734-Y744 HydrophobicContact CG2-CE1 3.93Å; S742-Y744 WeakPolarHBondContact O-CE2 3.31Å
745	R	86.9	Confident	90.6	Very high	23 Å²	23	40.2 Å²	40.2	9%	0.087	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	120.2	177	-170.4	-84.6	-67.3	-126.4	15.2	110.5	F611 S615 E630 C733	F611-R745 HydrophobicContact CD2-CB 3.48Å; F611-R745 VanDerWaalsContact CD2-CB 3.48Å; F611-R745 HydrophobicContact CD2-CG 4.15Å; F611-R745 HydrophobicContact CE2-CB 3.36Å; F611-R745 HydrophobicContact CE2-CG 4.49Å; F611-R745 HydrophobicContact CG-CB 4.15Å; F611-R745 HydrophobicContact CZ-CB 3.94Å; S615-R745 PolarHBondContact O-NH1 2.93Å; S615-R745 VanDerWaalsContact O-NH1 3.12Å; S615-R745 PolarHBondContact OG-NH1 3.29Å; S615-R745 PolarHBondContact OG-NH2 2.81Å; E630-R745 PolarHBondContact O-NH2 3.39Å; C733-R745 PolarHBondContact N-O 2.79Å; C733-R745 PolarHBondContact O-N 3.31Å
746	T	88.3	Confident	90.7	Very high	16 Å²	16	44.5 Å²	44.5	10%	0.098	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	146.6	-179.6	47.6	0	0	0	0	112.2	I646 F692 V697 Y731 A732	I646-T746 HydrophobicContact CD1-CG2 4.46Å; F692-T746 HydrophobicContact CD2-CG2 3.96Å; F692-T746 HydrophobicContact CE2-CG2 4.5Å; V697-T746 HydrophobicContact CG1-CG2 4.05Å; V697-T746 HydrophobicContact CG2-CG2 4.01Å; Y731-T746 CarbonylContact O-C 3.54Å; Y731-T746 VanDerWaalsContact O-CA 3.29Å; Y731-T746 WeakPolarHBondContact O-CA 3.41Å; A732-T746 HydrophobicContact CB-CG2 4.47Å
747	V	89.5	Confident	90.8	Very high	10 Å²	10	41 Å²	41	6%	0.061	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	127.7	174.6	178.6	0	0	0	0	108.2	D617 L619 L629 F730 Y731	D617-V747 CarbonylContact O-C 3.55Å; D617-V747 WeakPolarHBondContact O-CA 3.39Å; L619-V747 HydrophobicContact CD1-CG1 3.66Å; L619-V747 HydrophobicContact CG-CG1 3.91Å; L629-V747 HydrophobicContact CD2-CG1 4.27Å; F730-V747 CarbonylContact C-O 3.25Å; F730-V747 WeakPolarHBondContact CA-O 3.46Å; Y731-V747 PolarHBondContact N-O 3.3Å; Y731-V747 PolarHBondContact O-N 2.94Å
748	Y	91	Very high	90.7	Very high	22 Å²	22	44.7 Å²	44.7	9%	0.086	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	120.6	176	-171.4	-106.5	0	0	0	110.7	D617 I618 L619 F730 I780 R812	D617-Y748 PolarHBondContact O-N 3.26Å; I618-Y748 WeakPolarHBondContact CA-O 3.29Å; L619-Y748 PolarHBondContact N-O 2.85Å; F730-Y748 AromaticContact CD1-CD2 3.54Å; F730-Y748 HydrophobicContact CD1-CD2 3.54Å; F730-Y748 HydrophobicContact CD1-CG 4.14Å; F730-Y748 AromaticContact CD2-CD2 3.94Å; F730-Y748 HydrophobicContact CD2-CD2 3.94Å; F730-Y748 HydrophobicContact CD2-CE2 4.26Å; F730-Y748 AromaticContact CE1-CD2 3.45Å; F730-Y748 HydrophobicContact CE1-CD2 3.45Å; F730-Y748 VanDerWaalsContact CE1-CD2 3.45Å; F730-Y748 HydrophobicContact CE1-CE2 4.37Å; F730-Y748 AromaticContact CE1-CG 3.93Å; F730-Y748 HydrophobicContact CE1-CG 3.93Å; F730-Y748 AromaticContact CE2-CD2 3.89Å; F730-Y748 HydrophobicContact CE2-CD2 3.89Å; F730-Y748 HydrophobicContact CE2-CE2 4.08Å; F730-Y748 AromaticContact CG-CD2 3.77Å; F730-Y748 HydrophobicContact CG-CD2 3.77Å; F730-Y748 AromaticContact CZ-CD2 3.63Å; F730-Y748 HydrophobicContact CZ-CD2 3.63Å; F730-Y748 HydrophobicContact CZ-CE2 4.12Å; F730-Y748 HydrophobicContact CZ-CG 4.39Å; Y748-I780 HydrophobicContact CD1-CD1 4.17Å; Y748-I780 HydrophobicContact CE1-CD1 3.58Å; Y748-R812 HydrophobicContact CD1-CG 4.17Å; Y748-R812 HydrophobicContact CD2-CG 4.47Å; Y748-R812 HydrophobicContact CE1-CG 4.03Å; Y748-R812 HydrophobicContact CE2-CG 4.33Å; Y748-R812 VanDerWaalsContact CE2-NE 3.34Å; Y748-R812 HydrophobicContact CG-CG 4.38Å
749	V	92.3	Very high	90.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	111.8	171.9	180	0	0	0	0	107.9	L619 I627 L629 L720 L722 F728 G729 Y731	L619-V749 HydrophobicContact CB-CG2 4.45Å; L619-V749 HydrophobicContact CD1-CG2 4.48Å; L619-V749 WeakPolarHBondContact O-CA 3.06Å; I627-V749 HydrophobicContact CD1-CG1 3.61Å; L629-V749 HydrophobicContact CD2-CG2 3.83Å; L720-V749 HydrophobicContact CD2-CG1 4.17Å; L720-V749 HydrophobicContact CD2-CG2 4.32Å; L722-V749 HydrophobicContact CD2-CG1 4.15Å; F728-V749 CarbonylContact C-O 3.51Å; F728-V749 VanDerWaalsContact CA-O 3.31Å; F728-V749 WeakPolarHBondContact CA-O 3.26Å; F728-V749 WeakPolarHBondContact CB-O 3.41Å; F728-V749 HydrophobicContact CD1-CG1 4.11Å; G729-V749 PolarHBondContact N-O 3.42Å; G729-V749 PolarHBondContact O-N 3.02Å; Y731-V749 HydrophobicContact CD2-CB 4.18Å; Y731-V749 HydrophobicContact CD2-CG2 3.6Å; Y731-V749 HydrophobicContact CE2-CB 3.85Å; Y731-V749 HydrophobicContact CE2-CG2 3.6Å
750	G	91.1	Very high	91	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	155	-176.3	0	0	0	0	0	113.4	L619 G621	L619-G750 PolarHBondContact O-N 2.84Å; G621-G750 PolarHBondContact N-O 2.98Å; G621-G750 VanDerWaalsContact N-O 3.08Å
751	Q	92.5	Very high	90.9	Very high	82 Å²	82	38.9 Å²	38.9	38%	0.383	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	131.9	171.1	-173.8	168.8	-5.7	0	0	109.3	G621 H725 F728 E753 I780	G621-Q751 WeakPolarHBondContact O-CA 3.41Å; H725-Q751 PolarHBondContact CE1-OE1 2.86Å; H725-Q751 VanDerWaalsContact CE1-OE1 3.24Å; H725-Q751 PolarHBondContact ND1-OE1 2.84Å; F728-Q751 HydrophobicContact CD1-CB 4.4Å; F728-Q751 HydrophobicContact CD2-CB 4.34Å; F728-Q751 HydrophobicContact CE1-CB 4.02Å; F728-Q751 HydrophobicContact CE2-CB 3.97Å; F728-Q751 HydrophobicContact CE2-CG 4.37Å; F728-Q751 HydrophobicContact CZ-CB 3.8Å; F728-Q751 HydrophobicContact CZ-CG 4.15Å; Q751-E753 PolarHBondContact O-N 2.89Å; Q751-I780 WeakPolarHBondContact O-CG2 3.21Å
752	A	91.7	Very high	90.8	Very high	11 Å²	11	36.3 Å²	36.3	9%	0.091	19%	0.185	C	C	.	.			trans	-68.8	127.6	178.4	0	0	0	0	0	111.1	G621 E622 I780 Y839	G621-A752 PolarHBondContact O-N 2.9Å; E622-A752 HydrophobicContact CG-CB 4.25Å; A752-I780 WeakPolarHBondContact CA-O 3.29Å; A752-Y839 HydrophobicContact CB-CD1 4.45Å; A752-Y839 HydrophobicContact CB-CD2 4.24Å; A752-Y839 HydrophobicContact CB-CE1 3.86Å; A752-Y839 HydrophobicContact CB-CE2 3.64Å; A752-Y839 VanDerWaalsContact CB-CZ 3.41Å; A752-Y839 WeakPolarHBondContact CB-OH 3.39Å
753	E	91.8	Very high	90.6	Very high	54 Å²	54	35.5 Å²	35.5	25%	0.252	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	160.9	-176.1	61.9	179.4	149.8	0	0	113.1	Q751 K756 Y778 I780 N837	Q751-E753 PolarHBondContact O-N 2.89Å; E753-K756 IonicContact OE1-NZ 2.82Å; E753-K756 WeakPolarHBondContact OE2-CE 3.35Å; E753-K756 IonicContact OE2-NZ 3.18Å; E753-K756 PolarHBondContact OE2-NZ 2.88Å; E753-Y778 HydrophobicContact CG-CE1 4.21Å; E753-Y778 WeakPolarHBondContact OE1-CE1 3.23Å; E753-Y778 VanDerWaalsContact OE1-CZ 3.3Å; E753-Y778 PolarHBondContact OE1-OH 2.92Å; E753-I780 PolarHBondContact N-O 2.85Å; E753-N837 PolarHBondContact O-ND2 3.1Å
754	S	94.3	Very high	90.3	Very high	53 Å²	53	36.6 Å²	36.6	37%	0.371	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57	147.8	175	-38.3	0	0	0	0	111.3	Y839	S754-Y839 PolarHBondContact OG-O 2.93Å
755	P	94.9	Very high	89.9	Confident	4 Å²	4	36.2 Å²	36.2	3%	0.026	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	157.9	-175.2	33.7	-35.6	0	0	0	111.2	I777 V835 N837 G840 D842	P755-I777 HydrophobicContact CB-CG2 4.4Å; P755-V835 HydrophobicContact CB-CB 4.48Å; P755-V835 HydrophobicContact CB-CG1 3.74Å; P755-V835 HydrophobicContact CB-CG2 3.98Å; P755-V835 HydrophobicContact CG-CG1 3.87Å; P755-V835 HydrophobicContact CG-CG2 4.23Å; P755-N837 WeakPolarHBondContact CD-OD1 3.43Å; P755-G840 WeakPolarHBondContact CD-O 3.5Å; P755-D842 HydrophobicContact CG-CB 4.42Å; P755-D842 WeakPolarHBondContact O-CB 3.47Å
756	K	94.1	Very high	89.3	Confident	91 Å²	91	44 Å²	44	40%	0.396	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	124.8	-179.2	-60	173.4	-167.1	161	0	110.9	E753 L758 Y778 D842	E753-K756 IonicContact OE1-NZ 2.82Å; E753-K756 WeakPolarHBondContact OE2-CE 3.35Å; E753-K756 IonicContact OE2-NZ 3.18Å; E753-K756 PolarHBondContact OE2-NZ 2.88Å; K756-L758 PolarHBondContact O-N 2.81Å; K756-Y778 HydrophobicContact CB-CD1 4.39Å; K756-Y778 HydrophobicContact CD-CD1 4.35Å; K756-Y778 PolarHBondContact N-O 2.94Å; K756-Y778 PolarHBondContact O-N 3.42Å; K756-D842 WeakPolarHBondContact CA-OD2 3.24Å
757	I	92.9	Very high	88.6	Confident	13 Å²	13	48.4 Å²	48.4	7%	0.067	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	96.5	177.5	-59.6	171	0	0	0	109.2	I760 I777 C833 V835 D842 K844	I757-I760 HydrophobicContact CG2-CD1 4.22Å; I757-I760 HydrophobicContact CG2-CG1 3.88Å; I757-I777 HydrophobicContact CG1-CG1 4.24Å; I757-C833 WeakPolarHBondContact CD1-O 3.26Å; I757-V835 HydrophobicContact CD1-CG1 4.32Å; I757-V835 HydrophobicContact CG1-CG1 4.04Å; I757-D842 HydrophobicContact CD1-CB 4.48Å; I757-D842 HydrophobicContact CG1-CB 4.36Å; I757-D842 PolarHBondContact N-OD2 3.21Å; I757-K844 HydrophobicContact CB-CB 4.4Å; I757-K844 HydrophobicContact CB-CD 4.29Å; I757-K844 HydrophobicContact CD1-CB 3.79Å; I757-K844 HydrophobicContact CG2-CB 4.12Å; I757-K844 HydrophobicContact CG2-CD 3.77Å
758	L	89.9	Confident	87.9	Confident	85 Å²	85	49.8 Å²	49.8	45%	0.445	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	-51.3	-176.2	-59.6	-174.2	0	0	0	111.9	L662 K756 T776	L662-L758 HydrophobicContact CD1-CD1 4.22Å; L662-L758 HydrophobicContact CD2-CB 3.69Å; L662-L758 HydrophobicContact CD2-CD1 3.66Å; L662-L758 HydrophobicContact CD2-CG 4.35Å; K756-L758 PolarHBondContact O-N 2.81Å; L758-T776 PolarHBondContact N-O 2.72Å
759	K	88.8	Confident	87.5	Confident	43 Å²	43	51.5 Å²	51.5	19%	0.187	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	144.9	-175.4	-163.6	-172.1	176.1	-164	0	110.8	D761 T776	K759-D761 WeakPolarHBondContact CE-OD2 2.91Å; K759-D761 IonicContact NZ-OD2 2.82Å; K759-D761 PolarHBondContact NZ-OD2 3.28Å; K759-T776 PolarHBondContact N-O 3.44Å; K759-T776 PolarHBondContact O-N 2.83Å
760	I	90.5	Very high	87.1	Confident	36 Å²	36	53.1 Å²	53.1	19%	0.185	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	137.1	166.1	-86.7	-165.2	0	0	0	107.3	I757 F774 C775 C833 K844 I846	I757-I760 HydrophobicContact CG2-CD1 4.22Å; I757-I760 HydrophobicContact CG2-CG1 3.88Å; I760-F774 VanDerWaalsContact CA-O 3.32Å; I760-F774 WeakPolarHBondContact CA-O 3.13Å; I760-C775 HydrophobicContact CG1-CB 4.47Å; I760-C833 HydrophobicContact CD1-CB 4.43Å; I760-K844 HydrophobicContact CB-CD 4.48Å; I760-K844 HydrophobicContact CD1-CB 3.6Å; I760-K844 HydrophobicContact CD1-CD 3.91Å; I760-K844 HydrophobicContact CD1-CG 3.76Å; I760-K844 WeakPolarHBondContact CD1-O 3.36Å; I760-K844 HydrophobicContact CG1-CD 4.11Å; I760-K844 HydrophobicContact CG1-CG 4.5Å; I760-I846 HydrophobicContact CG2-CB 3.57Å; I760-I846 HydrophobicContact CG2-CD1 3.42Å; I760-I846 VanDerWaalsContact CG2-CD1 3.42Å; I760-I846 HydrophobicContact CG2-CG1 3.69Å
761	D	88.3	Confident	87	Confident	48 Å²	48	53.1 Å²	53.1	26%	0.257	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	161.8	-175.5	-145	-20	0	0	0	111.2	K759 F774 I846	K759-D761 WeakPolarHBondContact CE-OD2 2.91Å; K759-D761 IonicContact NZ-OD2 2.82Å; K759-D761 PolarHBondContact NZ-OD2 3.28Å; D761-F774 HydrophobicContact CB-CB 4.23Å; D761-F774 HydrophobicContact CB-CD2 4.46Å; D761-F774 PolarHBondContact N-O 2.94Å; D761-F774 VanDerWaalsContact N-O 3.14Å; D761-F774 PolarHBondContact O-N 2.88Å; D761-I846 WeakPolarHBondContact O-CD1 3.31Å
762	Q	89.1	Confident	86.8	Confident	52 Å²	52	49.7 Å²	49.7	24%	0.243	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	142.8	176.9	63.9	178.4	0.2	0	0	112	E772 L773 I846 T847 S849	Q762-E772 CarbonylContact C-O 3.54Å; Q762-E772 WeakPolarHBondContact CA-O 3.29Å; Q762-L773 HydrophobicContact CB-CD2 3.94Å; Q762-I846 HydrophobicContact CB-CD1 4.1Å; Q762-T847 PolarHBondContact OE1-O 2.92Å; Q762-S849 PolarHBondContact NE2-OG 3.49Å
763	S	85.4	Confident	86.8	Confident	22 Å²	22	49.2 Å²	49.2	15%	0.154	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	146.3	165	73.5	0	0	0	0	110	A771 E772	S763-A771 CarbonylContact O-C 3.54Å; S763-A771 WeakPolarHBondContact O-CA 3.34Å; S763-A771 WeakPolarHBondContact O-CB 3.32Å; S763-E772 PolarHBondContact N-O 2.92Å; S763-E772 PolarHBondContact O-N 2.91Å; S763-E772 WeakPolarHBondContact OG-CB 3.34Å; S763-E772 WeakPolarHBondContact OG-CG 3.25Å; S763-E772 PolarHBondContact OG-OE2 3.05Å
764	I	84.1	Confident	86.8	Confident	63 Å²	63	47.5 Å²	47.5	32%	0.323	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	132.4	170.2	-52.8	-179.6	0	0	0	106.7	A771 L823 L848 S849	I764-A771 HydrophobicContact CG1-CB 4.06Å; I764-L823 HydrophobicContact CG2-CD1 4.2Å; I764-L848 HydrophobicContact CD1-CD1 3.74Å; I764-L848 HydrophobicContact CG1-CD1 4.03Å; I764-S849 WeakPolarHBondContact CD1-O 3.15Å
765	S	80.3	Confident	86.8	Confident	33 Å²	33	45 Å²	45	23%	0.231	24%	0.243	C	C	.	.			trans	-60.4	150.9	174.5	48.9	0	0	0	0	112.9	D767 G768 T769 F770	S765-D767 VanDerWaalsContact CB-OD1 3.23Å; S765-D767 WeakPolarHBondContact CB-OD1 3.48Å; S765-D767 PolarHBondContact O-N 3.38Å; S765-D767 PolarHBondContact OG-OD1 2.63Å; S765-G768 PolarHBondContact O-N 2.99Å; S765-T769 PolarHBondContact OG-N 3.12Å; S765-F770 PolarHBondContact N-O 3.12Å; S765-F770 WeakPolarHBondContact OG-CA 3.41Å; S765-F770 WeakPolarHBondContact OG-CB 3.3Å; S765-F770 PolarHBondContact OG-N 3.2Å; S765-F770 PolarHBondContact OG-O 3.48Å
766	L	74.8	Confident	86.6	Confident	186 Å²	186	45.5 Å²	45.5	97%	0.974	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-25.6	-179.6	-86.5	92.6	0	0	0	114.1	G768	L766-G768 VanDerWaalsContact C-N 3.31Å
767	D	73.7	Confident	86.5	Confident	109 Å²	109	41.2 Å²	41.2	58%	0.583	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-6.6	176	70.7	-17.1	0	0	0	112.9	S765 T769	S765-D767 VanDerWaalsContact CB-OD1 3.23Å; S765-D767 WeakPolarHBondContact CB-OD1 3.48Å; S765-D767 PolarHBondContact O-N 3.38Å; S765-D767 PolarHBondContact OG-OD1 2.63Å; D767-T769 HydrophobicContact CB-CG2 4.28Å; D767-T769 VanDerWaalsContact CG-OG1 3.22Å; D767-T769 PolarHBondContact O-N 2.84Å; D767-T769 PolarHBondContact OD1-N 3.31Å; D767-T769 VanDerWaalsContact OD1-N 3.1Å; D767-T769 PolarHBondContact OD1-OG1 3.25Å; D767-T769 WeakPolarHBondContact OD2-CB 3.5Å; D767-T769 WeakPolarHBondContact OD2-CG2 3.33Å; D767-T769 PolarHBondContact OD2-OG1 3.31Å
768	G	74.9	Confident	86.5	Confident	38 Å²	38	42.5 Å²	42.5	39%	0.392	23%	0.232	S	C	.	.	S	Bend	trans	66.9	17.7	-178.6	0	0	0	0	0	114.2	S765 L766	S765-G768 PolarHBondContact O-N 2.99Å; L766-G768 VanDerWaalsContact C-N 3.31Å
769	T	81.5	Confident	86.5	Confident	59 Å²	59	38.4 Å²	38.4	36%	0.362	21%	0.21	S	C	.	.	S	Bend	trans	-95.4	-19.8	-178.6	72.4	0	0	0	0	113.5	S765 D767 N821 N822 L823	S765-T769 PolarHBondContact OG-N 3.12Å; D767-T769 HydrophobicContact CB-CG2 4.28Å; D767-T769 VanDerWaalsContact CG-OG1 3.22Å; D767-T769 PolarHBondContact O-N 2.84Å; D767-T769 PolarHBondContact OD1-N 3.31Å; D767-T769 VanDerWaalsContact OD1-N 3.1Å; D767-T769 PolarHBondContact OD1-OG1 3.25Å; D767-T769 WeakPolarHBondContact OD2-CB 3.5Å; D767-T769 WeakPolarHBondContact OD2-CG2 3.33Å; D767-T769 PolarHBondContact OD2-OG1 3.31Å; T769-N821 CarbonylContact O-C 3.58Å; T769-N822 CarbonylContact O-C 3.57Å; T769-N822 VanDerWaalsContact O-CA 3.26Å; T769-N822 WeakPolarHBondContact O-CA 3.22Å; T769-N822 PolarHBondContact O-N 2.89Å; T769-L823 PolarHBondContact O-N 2.9Å
770	F	84.6	Confident	86.6	Confident	33 Å²	33	36.4 Å²	36.4	15%	0.145	20%	0.202	C	C	.	.			trans	-130.7	138.6	-175.4	176.9	-106.1	0	0	0	112	Y680 S765 E772 T819 L820 N821	Y680-F770 WeakPolarHBondContact OH-CZ 3.41Å; S765-F770 PolarHBondContact N-O 3.12Å; S765-F770 WeakPolarHBondContact OG-CA 3.41Å; S765-F770 WeakPolarHBondContact OG-CB 3.3Å; S765-F770 PolarHBondContact OG-N 3.2Å; S765-F770 PolarHBondContact OG-O 3.48Å; F770-E772 HydrophobicContact CD1-CG 4.26Å; F770-E772 HydrophobicContact CE1-CG 3.34Å; F770-E772 HydrophobicContact CE2-CG 4.46Å; F770-E772 HydrophobicContact CZ-CG 3.47Å; F770-E772 VanDerWaalsContact CZ-CG 3.47Å; F770-E772 WeakPolarHBondContact CZ-OE1 3.3Å; F770-T819 HydrophobicContact CE2-CG2 4.41Å; F770-T819 HydrophobicContact CZ-CG2 4.12Å; F770-L820 WeakPolarHBondContact CA-O 3.27Å; F770-N821 WeakPolarHBondContact CD2-OD1 3.48Å; F770-N821 WeakPolarHBondContact CE2-OD1 3.33Å
771	A	88.5	Confident	86.6	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	154.7	169.4	0	0	0	0	0	112.1	S763 I764 T819 L820 L823 L848	S763-A771 CarbonylContact O-C 3.54Å; S763-A771 WeakPolarHBondContact O-CA 3.34Å; S763-A771 WeakPolarHBondContact O-CB 3.32Å; I764-A771 HydrophobicContact CG1-CB 4.06Å; A771-T819 WeakPolarHBondContact O-CA 3.39Å; A771-L820 PolarHBondContact N-O 2.73Å; A771-L820 VanDerWaalsContact N-O 3.1Å; A771-L820 PolarHBondContact O-N 2.85Å; A771-L823 HydrophobicContact CB-CD1 3.87Å; A771-L823 HydrophobicContact CB-CD2 3.95Å; A771-L823 HydrophobicContact CB-CG 4.42Å; A771-L848 HydrophobicContact CB-CD1 4.01Å; A771-L848 HydrophobicContact CB-CD2 4.16Å
772	E	89.5	Confident	86.6	Confident	11 Å²	11	35.7 Å²	35.7	5%	0.051	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	137.7	172.2	-44.1	-176.1	116.5	0	0	110.3	Y669 Q762 S763 F770 F774 I817 L818 T819	Y669-E772 WeakPolarHBondContact CE2-OE2 3.27Å; Y669-E772 VanDerWaalsContact CZ-OE2 3.29Å; Y669-E772 PolarHBondContact OH-OE2 3.13Å; Q762-E772 CarbonylContact C-O 3.54Å; Q762-E772 WeakPolarHBondContact CA-O 3.29Å; S763-E772 PolarHBondContact N-O 2.92Å; S763-E772 PolarHBondContact O-N 2.91Å; S763-E772 WeakPolarHBondContact OG-CB 3.34Å; S763-E772 WeakPolarHBondContact OG-CG 3.25Å; S763-E772 PolarHBondContact OG-OE2 3.05Å; F770-E772 HydrophobicContact CD1-CG 4.26Å; F770-E772 HydrophobicContact CE1-CG 3.34Å; F770-E772 HydrophobicContact CE2-CG 4.46Å; F770-E772 HydrophobicContact CZ-CG 3.47Å; F770-E772 VanDerWaalsContact CZ-CG 3.47Å; F770-E772 WeakPolarHBondContact CZ-OE1 3.3Å; E772-F774 HydrophobicContact CB-CD2 4.5Å; E772-F774 HydrophobicContact CB-CE2 3.71Å; E772-F774 HydrophobicContact CB-CZ 3.86Å; E772-F774 WeakPolarHBondContact OE2-CZ 3.39Å; E772-I817 HydrophobicContact CB-CG2 4.1Å; E772-L818 CarbonylContact C-O 3.57Å; E772-L818 WeakPolarHBondContact CA-O 3.4Å; E772-T819 HydrophobicContact CB-CG2 4.5Å; E772-T819 HydrophobicContact CG-CG2 4.03Å
773	L	92	Very high	86.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	120.6	176.5	-54.9	173.4	0	0	0	108.2	Q762 W790 I817 L818 L820 Y831 I846 L848	Q762-L773 HydrophobicContact CB-CD2 3.94Å; L773-W790 HydrophobicContact CB-CH2 3.8Å; L773-W790 HydrophobicContact CB-CZ3 4.07Å; L773-W790 WeakPolarHBondContact O-CZ2 3.43Å; L773-I817 WeakPolarHBondContact O-CA 3.25Å; L773-L818 HydrophobicContact CB-CB 4.34Å; L773-L818 HydrophobicContact CD1-CD2 4.14Å; L773-L818 PolarHBondContact N-O 3.45Å; L773-L818 PolarHBondContact O-N 3.47Å; L773-L820 HydrophobicContact CD1-CD1 4.04Å; L773-L820 HydrophobicContact CG-CD1 4.12Å; L773-Y831 HydrophobicContact CD1-CD1 3.94Å; L773-Y831 HydrophobicContact CD1-CD2 3.46Å; L773-Y831 VanDerWaalsContact CD1-CD2 3.46Å; L773-Y831 HydrophobicContact CD1-CE1 4.31Å; L773-Y831 HydrophobicContact CD1-CE2 3.88Å; L773-Y831 HydrophobicContact CD1-CG 3.52Å; L773-I846 HydrophobicContact CB-CD1 4.24Å; L773-I846 HydrophobicContact CB-CG2 4.44Å; L773-I846 HydrophobicContact CD1-CG2 4.21Å; L773-I846 HydrophobicContact CD2-CD1 3.78Å; L773-I846 HydrophobicContact CD2-CG1 4.17Å; L773-I846 HydrophobicContact CD2-CG2 4.43Å; L773-L848 HydrophobicContact CD2-CB 4.34Å; L773-L848 HydrophobicContact CD2-CD1 4.19Å
774	F	91.6	Very high	86.6	Confident	18 Å²	18	36.3 Å²	36.3	8%	0.079	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	134	-175.6	-60	-94.5	0	0	0	110.4	Y665 I760 D761 E772 T815 I817	Y665-F774 HydrophobicContact CD1-CE1 4.49Å; Y665-F774 HydrophobicContact CE1-CD1 4.4Å; Y665-F774 HydrophobicContact CE1-CE1 4.28Å; I760-F774 VanDerWaalsContact CA-O 3.32Å; I760-F774 WeakPolarHBondContact CA-O 3.13Å; D761-F774 HydrophobicContact CB-CB 4.23Å; D761-F774 HydrophobicContact CB-CD2 4.46Å; D761-F774 PolarHBondContact N-O 2.94Å; D761-F774 VanDerWaalsContact N-O 3.14Å; D761-F774 PolarHBondContact O-N 2.88Å; E772-F774 HydrophobicContact CB-CD2 4.5Å; E772-F774 HydrophobicContact CB-CE2 3.71Å; E772-F774 HydrophobicContact CB-CZ 3.86Å; E772-F774 WeakPolarHBondContact OE2-CZ 3.39Å; F774-T815 HydrophobicContact CD1-CG2 4.33Å; F774-I817 HydrophobicContact CD1-CD1 4.01Å; F774-I817 HydrophobicContact CD1-CG1 3.8Å; F774-I817 HydrophobicContact CD1-CG2 4.27Å; F774-I817 HydrophobicContact CE1-CD1 3.78Å; F774-I817 HydrophobicContact CE1-CG1 4.01Å; F774-I817 HydrophobicContact CE1-CG2 4.04Å; F774-I817 HydrophobicContact CZ-CG2 4.48Å
775	C	93.4	Very high	86.4	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	97.9	174.8	-177.4	0	0	0	0	109.3	I760 W790 T815 S816 C833	I760-C775 HydrophobicContact CG1-CB 4.47Å; C775-W790 HydrophobicContact CB-CH2 3.75Å; C775-W790 HydrophobicContact CB-CZ2 3.52Å; C775-T815 WeakPolarHBondContact O-CA 3.45Å; C775-S816 PolarHBondContact N-O 2.81Å; C775-S816 PolarHBondContact O-N 3.12Å; C775-C833 HydrophobicContact CB-CB 3.71Å; C775-C833 WeakPolarHBondContact CB-SG 3.25Å; C775-C833 WeakPolarHBondContact SG-CB 3.49Å; C775-C833 CovalentContact SG-SG 2.04Å; C775-C833 PolarHBondContact SG-SG 2.61Å
776	T	91.6	Very high	86.5	Confident	15 Å²	15	43.3 Å²	43.3	9%	0.092	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	112.9	-179.2	-55.2	0	0	0	0	109.8	L662 L758 K759 T815	L662-T776 HydrophobicContact CD2-CG2 4.23Å; L662-T776 HydrophobicContact CG-CG2 4.46Å; L758-T776 PolarHBondContact N-O 2.72Å; K759-T776 PolarHBondContact N-O 3.44Å; K759-T776 PolarHBondContact O-N 2.83Å; T776-T815 PolarHBondContact OG1-OG1 2.79Å
777	I	92	Very high	87.1	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129.6	-173.6	-59.7	152.2	0	0	0	109.5	P755 I757 I788 G813 V814 V835	P755-I777 HydrophobicContact CB-CG2 4.4Å; I757-I777 HydrophobicContact CG1-CG1 4.24Å; I777-I788 HydrophobicContact CD1-CD1 3.72Å; I777-I788 HydrophobicContact CD1-CG1 3.94Å; I777-I788 HydrophobicContact CD1-CG2 3.94Å; I777-G813 WeakPolarHBondContact O-CA 3.22Å; I777-V814 WeakPolarHBondContact CA-O 3.45Å; I777-V814 WeakPolarHBondContact CB-O 3.21Å; I777-V814 PolarHBondContact N-O 3.29Å; I777-V814 PolarHBondContact O-N 3.24Å; I777-V835 HydrophobicContact CD1-CB 4.01Å; I777-V835 HydrophobicContact CD1-CG1 4.29Å; I777-V835 HydrophobicContact CD1-CG2 4.29Å; I777-V835 HydrophobicContact CG1-CB 4.46Å; I777-V835 HydrophobicContact CG1-CG1 4.21Å; I777-V835 HydrophobicContact CG2-CB 4.38Å; I777-V835 HydrophobicContact CG2-CG1 3.93Å; I777-V835 HydrophobicContact CG2-CG2 4.08Å
778	Y	91.8	Very high	87.9	Confident	40 Å²	40	31.8 Å²	31.8	16%	0.157	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	131.5	160.9	167.1	-82.7	0	0	0	108.6	E753 K756 I780 R812	E753-Y778 HydrophobicContact CG-CE1 4.21Å; E753-Y778 WeakPolarHBondContact OE1-CE1 3.23Å; E753-Y778 VanDerWaalsContact OE1-CZ 3.3Å; E753-Y778 PolarHBondContact OE1-OH 2.92Å; K756-Y778 HydrophobicContact CB-CD1 4.39Å; K756-Y778 HydrophobicContact CD-CD1 4.35Å; K756-Y778 PolarHBondContact N-O 2.94Å; K756-Y778 PolarHBondContact O-N 3.42Å; Y778-I780 HydrophobicContact CE1-CG1 4.45Å; Y778-I780 HydrophobicContact CE2-CD1 3.99Å; Y778-I780 HydrophobicContact CE2-CG1 4.37Å; Y778-I780 WeakPolarHBondContact OH-CD1 3.49Å; Y778-R812 HydrophobicContact CD2-CB 3.81Å; Y778-R812 WeakPolarHBondContact CD2-O 3.47Å; Y778-R812 HydrophobicContact CE2-CB 3.97Å
779	S	91.2	Very high	88.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.5	136	-179	173.2	0	0	0	0	110.7	P781 R812 N837	S779-P781 CarbonylContact C-O 3.57Å; S779-P781 CarbonylContact O-C 3.53Å; S779-P781 PolarHBondContact OG-O 2.92Å; S779-R812 PolarHBondContact N-O 2.91Å; S779-N837 PolarHBondContact OG-ND2 3.36Å
780	I	90.6	Very high	89.3	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	107.2	-179	-53	-171.2	0	0	0	107.4	I618 Y748 Q751 A752 E753 Y778	I618-I780 HydrophobicContact CG2-CG2 4.41Å; Y748-I780 HydrophobicContact CD1-CD1 4.17Å; Y748-I780 HydrophobicContact CE1-CD1 3.58Å; Q751-I780 WeakPolarHBondContact O-CG2 3.21Å; A752-I780 WeakPolarHBondContact CA-O 3.29Å; E753-I780 PolarHBondContact N-O 2.85Å; Y778-I780 HydrophobicContact CE1-CG1 4.45Å; Y778-I780 HydrophobicContact CE2-CD1 3.99Å; Y778-I780 HydrophobicContact CE2-CG1 4.37Å; Y778-I780 WeakPolarHBondContact OH-CD1 3.49Å
781	P	90.8	Very high	89.7	Confident	26 Å²	26	29 Å²	29	17%	0.169	15%	0.151	C	C	.	.	S	Bend	cis	-65.7	161.5	5.4	28	-35.9	0	0	0	114.4	S779	S779-P781 CarbonylContact C-O 3.57Å; S779-P781 CarbonylContact O-C 3.53Å; S779-P781 PolarHBondContact OG-O 2.92Å
782	R	88	Confident	89.7	Confident	43 Å²	43	31 Å²	31	16%	0.162	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-64.4	129.3	173.8	-171.9	-173.8	-84.8	133.6	-5	109.1	D617 I618 T810 G813 V814	D617-R782 IonicContact OD1-CZ 2.7Å; D617-R782 IonicContact OD1-NH1 3.1Å; D617-R782 PolarHBondContact OD1-NH1 3.35Å; D617-R782 IonicContact OD1-NH2 3.7Å; D617-R782 IonicContact OD2-CZ 2.91Å; D617-R782 VanDerWaalsContact OD2-CZ 3.27Å; D617-R782 IonicContact OD2-NH1 3.21Å; D617-R782 PolarHBondContact OD2-NH1 3.48Å; D617-R782 IonicContact OD2-NH2 3.37Å; D617-R782 PolarHBondContact OD2-NH2 3.36Å; I618-R782 HydrophobicContact CD1-CB 4.38Å; R782-T810 PolarHBondContact NH2-O 3.2Å; R782-G813 PolarHBondContact NE-O 3.24Å; R782-V814 HydrophobicContact CG-CG2 3.44Å; R782-V814 VanDerWaalsContact CG-CG2 3.44Å
783	P	88.6	Confident	89.4	Confident	8 Å²	8	36.7 Å²	36.7	5%	0.052	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-67.2	142	-178.9	28.4	-37	0	0	0	111	Q787 I788 V814 V835	P783-Q787 HydrophobicContact CB-CB 3.82Å; P783-I788 HydrophobicContact CB-CD1 4.36Å; P783-I788 HydrophobicContact CB-CG1 4.05Å; P783-I788 HydrophobicContact CG-CD1 3.85Å; P783-I788 HydrophobicContact CG-CG1 4.01Å; P783-V814 HydrophobicContact CG-CG2 4.11Å; P783-V835 HydrophobicContact CB-CG2 4.05Å; P783-V835 HydrophobicContact CG-CG2 4.16Å
784	T	84.5	Confident	88.8	Confident	80 Å²	80	40 Å²	40	49%	0.491	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-73.9	167.6	170.3	60.6	0	0	0	0	111.5	H786 Q787	T784-H786 PolarHBondContact O-N 3.14Å; T784-H786 VanDerWaalsContact O-N 3.13Å; T784-Q787 WeakPolarHBondContact O-CB 3.4Å; T784-Q787 PolarHBondContact O-N 3.09Å; T784-Q787 PolarHBondContact OG1-OE1 2.83Å
785	V	80.3	Confident	88.6	Confident	70 Å²	70	45 Å²	45	42%	0.424	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-55.4	-36.1	-177.7	-177.8	0	0	0	0	112.5	W683 Q807	W683-V785 HydrophobicContact CH2-CG2 4.07Å; W683-V785 HydrophobicContact CZ2-CG2 4.49Å; W683-V785 HydrophobicContact CZ3-CG2 4.28Å; V785-Q807 PolarHBondContact O-NE2 2.75Å
786	H	82.3	Confident	88.3	Confident	172 Å²	172	48.8 Å²	48.8	80%	0.796	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-81.1	-13.2	-179.7	-56.3	-55.3	0	0	0	114.5	T784	T784-H786 PolarHBondContact O-N 3.14Å; T784-H786 VanDerWaalsContact O-N 3.13Å
787	Q	88.5	Confident	88.2	Confident	41 Å²	41	49.3 Å²	49.3	19%	0.192	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-85.9	-8.2	-179.3	-91.5	170.4	-32.6	0	0	113.2	P783 T784 V835 V836	P783-Q787 HydrophobicContact CB-CB 3.82Å; T784-Q787 WeakPolarHBondContact O-CB 3.4Å; T784-Q787 PolarHBondContact O-N 3.09Å; T784-Q787 PolarHBondContact OG1-OE1 2.83Å; Q787-V835 WeakPolarHBondContact O-CA 3.48Å; Q787-V836 WeakPolarHBondContact CB-O 3.25Å; Q787-V836 WeakPolarHBondContact CG-O 3.4Å; Q787-V836 PolarHBondContact O-N 2.62Å
788	I	90.6	Very high	87.7	Confident	12 Å²	12	57.7 Å²	57.7	6%	0.062	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	126.8	172.2	-53.2	170	0	0	0	108.7	I777 P783 V814 V835	I777-I788 HydrophobicContact CD1-CD1 3.72Å; I777-I788 HydrophobicContact CD1-CG1 3.94Å; I777-I788 HydrophobicContact CD1-CG2 3.94Å; P783-I788 HydrophobicContact CB-CD1 4.36Å; P783-I788 HydrophobicContact CB-CG1 4.05Å; P783-I788 HydrophobicContact CG-CD1 3.85Å; P783-I788 HydrophobicContact CG-CG1 4.01Å; I788-V814 HydrophobicContact CD1-CB 4.16Å; I788-V814 HydrophobicContact CD1-CG1 3.86Å; I788-V835 HydrophobicContact CG1-CB 4.44Å; I788-V835 HydrophobicContact CG1-CG2 4.03Å
789	T	91.8	Very high	87.3	Confident	57 Å²	57	60.1 Å²	60.1	35%	0.35	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	131.4	-177.7	56.5	0	0	0	0	111.5	T834	T789-T834 PolarHBondContact N-O 2.92Å; T789-T834 PolarHBondContact O-N 2.91Å; T789-T834 PolarHBondContact OG1-O 3.19Å
790	W	92.8	Very high	86.8	Confident	4 Å²	4	65 Å²	65	2%	0.015	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	134.5	169.5	-73.6	93.8	0	0	0	109.5	L773 C775 I797 I805 S816 L818 N832 C833 I846	L773-W790 HydrophobicContact CB-CH2 3.8Å; L773-W790 HydrophobicContact CB-CZ3 4.07Å; L773-W790 WeakPolarHBondContact O-CZ2 3.43Å; C775-W790 HydrophobicContact CB-CH2 3.75Å; C775-W790 HydrophobicContact CB-CZ2 3.52Å; W790-I797 HydrophobicContact CB-CD1 4.34Å; W790-I797 PolarHBondContact O-N 2.84Å; W790-I805 HydrophobicContact CB-CD1 4.28Å; W790-I805 HydrophobicContact CG-CD1 4.47Å; W790-S816 PolarHBondContact NE1-OG 3.13Å; W790-L818 HydrophobicContact CB-CD2 4.07Å; W790-L818 HydrophobicContact CD2-CB 3.79Å; W790-L818 HydrophobicContact CD2-CD2 3.94Å; W790-L818 HydrophobicContact CE3-CB 4.26Å; W790-L818 HydrophobicContact CE3-CD2 3.92Å; W790-L818 HydrophobicContact CG-CB 4.09Å; W790-L818 HydrophobicContact CG-CD2 4.04Å; W790-L818 HydrophobicContact CH2-CB 4.49Å; W790-L818 HydrophobicContact CZ2-CB 4.06Å; W790-N832 CarbonylContact C-O 3.55Å; W790-N832 WeakPolarHBondContact CA-O 3.49Å; W790-C833 HydrophobicContact CD2-CB 4.36Å; W790-C833 HydrophobicContact CE3-CB 4.08Å; W790-C833 HydrophobicContact CH2-CB 4.02Å; W790-C833 HydrophobicContact CZ2-CB 4.28Å; W790-C833 HydrophobicContact CZ3-CB 3.89Å; W790-I846 HydrophobicContact CH2-CG2 4.43Å; W790-I846 HydrophobicContact CZ3-CG2 3.82Å
791	S	92.6	Very high	86.2	Confident	10 Å²	10	73.5 Å²	73.5	7%	0.07	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	155.3	175	57.8	0	0	0	0	112.1	I795 Y831 N832	S791-I795 CarbonylContact C-O 3.52Å; S791-I795 WeakPolarHBondContact CA-O 3.46Å; S791-I795 VanDerWaalsContact CB-O 3.29Å; S791-I795 WeakPolarHBondContact CB-O 3.32Å; S791-Y831 CarbonylContact O-C 3.55Å; S791-Y831 VanDerWaalsContact O-CA 3.31Å; S791-Y831 WeakPolarHBondContact O-CA 3.42Å; S791-N832 PolarHBondContact N-O 3.4Å; S791-N832 PolarHBondContact O-N 2.91Å
792	I	89.9	Confident	86	Confident	42 Å²	42	74 Å²	74	22%	0.215	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	124.7	176.4	-176.7	172.8	0	0	0	107.8	G794 I795 I797 Y831	I792-G794 PolarHBondContact O-N 3.34Å; I792-G794 VanDerWaalsContact O-N 3.11Å; I792-I795 PolarHBondContact N-O 2.78Å; I792-I795 PolarHBondContact O-N 2.87Å; I792-I797 HydrophobicContact CB-CD1 4.21Å; I792-I797 HydrophobicContact CB-CG1 4.44Å; I792-I797 HydrophobicContact CG2-CD1 4.16Å; I792-I797 HydrophobicContact CG2-CG1 3.92Å; I792-Y831 HydrophobicContact CB-CD1 4.25Å; I792-Y831 HydrophobicContact CB-CE1 4.33Å; I792-Y831 HydrophobicContact CD1-CE1 4Å
793	N	82.3	Confident	86	Confident	132 Å²	132	73 Å²	73	71%	0.706	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	35	-174.1	-59.3	-29.6	0	0	0	114.1	I795	N793-I795 VanDerWaalsContact C-N 3.34Å
794	G	80.6	Confident	85.9	Confident	69 Å²	69	77.7 Å²	77.7	71%	0.711	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	-0.7	-177.6	0	0	0	0	0	115.7	I792	I792-G794 PolarHBondContact O-N 3.34Å; I792-G794 VanDerWaalsContact O-N 3.11Å
795	I	87	Confident	85.9	Confident	123 Å²	123	76.3 Å²	76.3	63%	0.631	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.2	120.4	178.1	-55.4	175.3	0	0	0	109.4	S791 I792 N793 I797	S791-I795 CarbonylContact C-O 3.52Å; S791-I795 WeakPolarHBondContact CA-O 3.46Å; S791-I795 VanDerWaalsContact CB-O 3.29Å; S791-I795 WeakPolarHBondContact CB-O 3.32Å; I792-I795 PolarHBondContact N-O 2.78Å; I792-I795 PolarHBondContact O-N 2.87Å; N793-I795 VanDerWaalsContact C-N 3.34Å; I795-I797 PolarHBondContact O-N 3.09Å
796	S	87.4	Confident	86.1	Confident	80 Å²	80	75 Å²	75	56%	0.559	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.2	131.2	178.5	-51.9	0	0	0	0	112.2
797	I	87.8	Confident	86.1	Confident	25 Å²	25	68.5 Å²	68.5	13%	0.128	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-78.7	126	-178.8	-65.2	172.3	0	0	0	109.1	W790 I792 I795 L803 L818 Y831	W790-I797 HydrophobicContact CB-CD1 4.34Å; W790-I797 PolarHBondContact O-N 2.84Å; I792-I797 HydrophobicContact CB-CD1 4.21Å; I792-I797 HydrophobicContact CB-CG1 4.44Å; I792-I797 HydrophobicContact CG2-CD1 4.16Å; I792-I797 HydrophobicContact CG2-CG1 3.92Å; I795-I797 PolarHBondContact O-N 3.09Å; I797-L803 HydrophobicContact CG2-CB 4.39Å; I797-L803 HydrophobicContact CG2-CD2 4.07Å; I797-L818 HydrophobicContact CD1-CD2 3.66Å; I797-L818 HydrophobicContact CG2-CD1 4.47Å; I797-Y831 HydrophobicContact CD1-CD1 3.49Å; I797-Y831 VanDerWaalsContact CD1-CD1 3.49Å; I797-Y831 HydrophobicContact CD1-CE1 3.6Å
798	K	82.3	Confident	85.8	Confident	178 Å²	178	70.6 Å²	70.6	77%	0.774	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-94.4	133.2	169.7	-65	-175.3	179.1	-177.6	0	109.1
799	P	82.4	Confident	85.3	Confident	90 Å²	90	73.5 Å²	73.5	58%	0.584	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-58.3	144.4	172.9	-25	34.7	0	0	0	112.4	L803 I805	P799-L803 CarbonylContact C-O 3.42Å; P799-L803 WeakPolarHBondContact CA-O 3.47Å; P799-I805 HydrophobicContact CG-CD1 4.34Å
800	D	81.1	Confident	84.9	Confident	103 Å²	103	72.2 Å²	72.2	55%	0.551	38%	0.375	S	S	*	.			trans	-149	-179.9	178.3	179.4	30.3	0	0	0	108.8	R802 L803	D800-R802 PolarHBondContact O-N 3.09Å; D800-L803 PolarHBondContact N-O 2.91Å
801	K	79.4	Confident	84.3	Confident	179 Å²	179	72.5 Å²	72.5	78%	0.778	38%	0.376	S	S	*	.	S	Bend	trans	-51.1	-28.7	172.8	-64.2	-176.3	179.9	-178.3	0	113
802	R	86.4	Confident	84	Confident	35 Å²	35	73.9 Å²	73.9	13%	0.132	38%	0.38	C	S	.	.	S	Bend	trans	-97.3	-42.2	-175.1	-161.8	-176.9	73.1	89.1	-9.4	114.9	D800 N821 D827	D800-R802 PolarHBondContact O-N 3.09Å; R802-N821 WeakPolarHBondContact CD-O 3.47Å; R802-N821 HydrophobicContact CG-CB 4.31Å; R802-N821 WeakPolarHBondContact CG-O 3.45Å; R802-N821 PolarHBondContact NH1-O 2.84Å; R802-N821 WeakPolarHBondContact O-CB 3.34Å; R802-N821 PolarHBondContact O-N 2.81Å; R802-D827 IonicContact CZ-OD1 2.72Å; R802-D827 IonicContact CZ-OD2 2.62Å; R802-D827 IonicContact NH1-OD1 3.78Å; R802-D827 PolarHBondContact NH1-OD1 2.87Å; R802-D827 IonicContact NH1-OD2 3.06Å; R802-D827 PolarHBondContact NH1-OD2 3.41Å; R802-D827 IonicContact NH2-OD1 2.61Å; R802-D827 PolarHBondContact NH2-OD1 2.78Å; R802-D827 IonicContact NH2-OD2 3.61Å; R802-D827 PolarHBondContact NH2-OD2 2.85Å
803	L	86.6	Confident	83.8	Confident	24 Å²	24	71.9 Å²	71.9	13%	0.126	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	125.7	177.8	-61.5	106.3	0	0	0	109.7	I797 P799 D800 L818 T819 L820	I797-L803 HydrophobicContact CG2-CB 4.39Å; I797-L803 HydrophobicContact CG2-CD2 4.07Å; P799-L803 CarbonylContact C-O 3.42Å; P799-L803 WeakPolarHBondContact CA-O 3.47Å; D800-L803 PolarHBondContact N-O 2.91Å; L803-L818 HydrophobicContact CB-CD1 4.36Å; L803-L818 HydrophobicContact CD2-CD1 4.28Å; L803-T819 WeakPolarHBondContact CA-O 3.37Å; L803-L820 HydrophobicContact CD2-CD2 3.63Å; L803-L820 HydrophobicContact CD2-CG 4.01Å; L803-L820 HydrophobicContact CG-CD2 4.43Å
804	R	87.3	Confident	84.1	Confident	105 Å²	105	65.8 Å²	65.8	40%	0.396	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	140.2	176.2	-55.5	177.5	179.5	179.2	-4.1	110.6	Y806 T819	R804-Y806 HydrophobicContact CB-CD2 4.46Å; R804-Y806 HydrophobicContact CB-CE2 3.73Å; R804-Y806 WeakPolarHBondContact CD-OH 3.03Å; R804-Y806 PolarHBondContact NH1-OH 2.78Å; R804-T819 WeakPolarHBondContact CB-OG1 3.34Å; R804-T819 PolarHBondContact N-O 3.16Å; R804-T819 PolarHBondContact O-N 3.45Å; R804-T819 PolarHBondContact O-OG1 3.13Å
805	I	85.2	Confident	84.5	Confident	51 Å²	51	62.6 Å²	62.6	26%	0.262	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	125	177.5	-60.4	166.6	0	0	0	107.4	W790 P799 I817 L818	W790-I805 HydrophobicContact CB-CD1 4.28Å; W790-I805 HydrophobicContact CG-CD1 4.47Å; P799-I805 HydrophobicContact CG-CD1 4.34Å; I805-I817 CarbonylContact C-O 3.58Å; I805-I817 WeakPolarHBondContact CA-O 3.42Å; I805-L818 HydrophobicContact CG1-CD1 3.85Å
806	Y	83.5	Confident	84.7	Confident	44 Å²	44	56.7 Å²	56.7	17%	0.173	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	160.5	174.2	-58.1	-79.7	0	0	0	109.9	Y680 R804 I817 T819	Y680-Y806 WeakPolarHBondContact CB-OH 3.35Å; Y680-Y806 HydrophobicContact CD1-CE2 4.42Å; Y680-Y806 HydrophobicContact CG-CE2 4.39Å; Y680-Y806 AromaticContact CG-CZ 3.94Å; R804-Y806 HydrophobicContact CB-CD2 4.46Å; R804-Y806 HydrophobicContact CB-CE2 3.73Å; R804-Y806 WeakPolarHBondContact CD-OH 3.03Å; R804-Y806 PolarHBondContact NH1-OH 2.78Å; Y806-I817 PolarHBondContact N-O 3.44Å; Y806-I817 PolarHBondContact O-N 2.94Å; Y806-T819 HydrophobicContact CD2-CG2 3.76Å; Y806-T819 HydrophobicContact CE2-CG2 3.79Å
807	Q	82.6	Confident	84.9	Confident	34 Å²	34	53.2 Å²	53.2	16%	0.159	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	119.3	178.5	-67.6	-175.3	3.5	0	0	109.5	V785 V814 T815	V785-Q807 PolarHBondContact O-NE2 2.75Å; Q807-V814 HydrophobicContact CB-CG1 3.9Å; Q807-V814 HydrophobicContact CG-CG1 4.23Å; Q807-T815 WeakPolarHBondContact CA-O 3.43Å
808	E	81.3	Confident	85	Confident	85 Å²	85	52 Å²	52	40%	0.397	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124.5	174.1	-64.8	176.6	168.9	0	0	108.1	Y665 V814 T815 I817	Y665-E808 PolarHBondContact OH-OE2 2.9Å; E808-V814 CarbonylContact O-C 3.56Å; E808-V814 WeakPolarHBondContact O-CA 3.41Å; E808-V814 WeakPolarHBondContact O-CG1 3Å; E808-T815 PolarHBondContact N-O 3.14Å; E808-T815 PolarHBondContact O-N 2.82Å; E808-I817 VanDerWaalsContact CD-CD1 3.44Å; E808-I817 HydrophobicContact CG-CD1 4.01Å; E808-I817 WeakPolarHBondContact OE1-CD1 3.49Å
809	K	81	Confident	85.4	Confident	74 Å²	74	43.6 Å²	43.6	32%	0.322	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	135.7	175.1	-66.7	179.2	-163.5	154.4	0	109.2	E688	E688-K809 VanDerWaalsContact O-CD 3.32Å; E688-K809 WeakPolarHBondContact O-CD 3.44Å; E688-K809 WeakPolarHBondContact O-CE 3.49Å; E688-K809 PolarHBondContact O-NZ 2.91Å
810	T	82.4	Confident	85.8	Confident	29 Å²	29	39.3 Å²	39.3	18%	0.178	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	161.4	169.6	69.8	0	0	0	0	109.9	R782 R812 G813 V814	R782-T810 PolarHBondContact NH2-O 3.2Å; T810-R812 PolarHBondContact O-N 3.37Å; T810-G813 PolarHBondContact N-O 2.81Å; T810-G813 PolarHBondContact O-N 2.74Å; T810-G813 WeakPolarHBondContact OG1-CA 3.39Å; T810-G813 PolarHBondContact OG1-N 2.82Å; T810-G813 VanDerWaalsContact OG1-N 3.12Å; T810-G813 PolarHBondContact OG1-O 3.14Å; T810-V814 PolarHBondContact OG1-N 2.7Å
811	H	81.8	Confident	86	Confident	10 Å²	10	36.6 Å²	36.6	5%	0.046	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-20.8	-177.6	-70.1	-61	0	0	0	115	T658 E661 A690 F692 F730	T658-H811 HydrophobicContact CG2-CB 3.65Å; E661-H811 IonicContact OE1-CD2 3.26Å; E661-H811 PolarHBondContact OE1-CD2 2.91Å; E661-H811 IonicContact OE1-NE2 2.64Å; E661-H811 PolarHBondContact OE1-NE2 3.49Å; E661-H811 IonicContact OE2-CD2 3.29Å; E661-H811 PolarHBondContact OE2-CD2 2.85Å; A690-H811 WeakPolarHBondContact CB-ND1 3.36Å; A690-H811 PolarHBondContact O-CE1 2.75Å; A690-H811 PolarHBondContact O-ND1 2.63Å; F692-H811 AromaticContact CD1-CE1 3.75Å; F692-H811 AromaticContact CD1-NE2 3.42Å; F692-H811 WeakPolarHBondContact CD1-NE2 3.43Å; F692-H811 AromaticContact CD2-CE1 3.48Å; F692-H811 VanDerWaalsContact CD2-CE1 3.48Å; F692-H811 WeakPolarHBondContact CD2-CE1 3.4Å; F692-H811 AromaticContact CD2-ND1 3.84Å; F692-H811 AromaticContact CE1-CD2 3.55Å; F692-H811 AromaticContact CE1-CE1 3.85Å; F692-H811 AromaticContact CE1-NE2 3.43Å; F692-H811 WeakPolarHBondContact CE1-NE2 3.14Å; F692-H811 AromaticContact CE2-CE1 3.58Å; F692-H811 AromaticContact CE2-CG 3.91Å; F692-H811 AromaticContact CE2-ND1 3.51Å; F692-H811 AromaticContact CG-CE1 3.57Å; F692-H811 AromaticContact CG-NE2 3.73Å; F692-H811 HydrophobicContact CZ-CB 4.18Å; F692-H811 AromaticContact CZ-CD2 3.64Å; F692-H811 AromaticContact CZ-CE1 3.77Å; F692-H811 AromaticContact CZ-CG 3.62Å; F692-H811 AromaticContact CZ-ND1 3.72Å; F692-H811 AromaticContact CZ-NE2 3.74Å; F692-H811 PolarHBondContact N-CE1 3.43Å; F730-H811 HydrophobicContact CE1-CB 4.33Å; F730-H811 HydrophobicContact CZ-CB 4.32Å
812	R	85.2	Confident	86.3	Confident	40 Å²	40	33.8 Å²	33.8	15%	0.151	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.8	21.2	178.6	-60.5	-176.4	177.7	-179	-0.1	113.4	E655 F730 Y748 Y778 S779 T810	E655-R812 IonicContact OE2-CZ 3.23Å; E655-R812 VanDerWaalsContact OE2-CZ 3.23Å; E655-R812 IonicContact OE2-NH1 2.74Å; E655-R812 PolarHBondContact OE2-NH1 2.63Å; E655-R812 IonicContact OE2-NH2 2.78Å; E655-R812 PolarHBondContact OE2-NH2 2.93Å; F730-R812 HydrophobicContact CZ-CG 4.36Å; Y748-R812 HydrophobicContact CD1-CG 4.17Å; Y748-R812 HydrophobicContact CD2-CG 4.47Å; Y748-R812 HydrophobicContact CE1-CG 4.03Å; Y748-R812 HydrophobicContact CE2-CG 4.33Å; Y748-R812 VanDerWaalsContact CE2-NE 3.34Å; Y748-R812 HydrophobicContact CG-CG 4.38Å; Y778-R812 HydrophobicContact CD2-CB 3.81Å; Y778-R812 WeakPolarHBondContact CD2-O 3.47Å; Y778-R812 HydrophobicContact CE2-CB 3.97Å; S779-R812 PolarHBondContact N-O 2.91Å; T810-R812 PolarHBondContact O-N 3.37Å
813	G	86.8	Confident	86.2	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.6	-141	-176	0	0	0	0	0	115.2	I777 R782 T810	I777-G813 WeakPolarHBondContact O-CA 3.22Å; R782-G813 PolarHBondContact NE-O 3.24Å; T810-G813 PolarHBondContact N-O 2.81Å; T810-G813 PolarHBondContact O-N 2.74Å; T810-G813 WeakPolarHBondContact OG1-CA 3.39Å; T810-G813 PolarHBondContact OG1-N 2.82Å; T810-G813 VanDerWaalsContact OG1-N 3.12Å; T810-G813 PolarHBondContact OG1-O 3.14Å
814	V	88.6	Confident	86.2	Confident	4 Å²	4	39.3 Å²	39.3	2%	0.024	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	139.6	-178.7	180	0	0	0	0	110.1	I777 R782 P783 I788 Q807 E808 T810	I777-V814 WeakPolarHBondContact CA-O 3.45Å; I777-V814 WeakPolarHBondContact CB-O 3.21Å; I777-V814 PolarHBondContact N-O 3.29Å; I777-V814 PolarHBondContact O-N 3.24Å; R782-V814 HydrophobicContact CG-CG2 3.44Å; R782-V814 VanDerWaalsContact CG-CG2 3.44Å; P783-V814 HydrophobicContact CG-CG2 4.11Å; I788-V814 HydrophobicContact CD1-CB 4.16Å; I788-V814 HydrophobicContact CD1-CG1 3.86Å; Q807-V814 HydrophobicContact CB-CG1 3.9Å; Q807-V814 HydrophobicContact CG-CG1 4.23Å; E808-V814 CarbonylContact O-C 3.56Å; E808-V814 WeakPolarHBondContact O-CA 3.41Å; E808-V814 WeakPolarHBondContact O-CG1 3Å; T810-V814 PolarHBondContact OG1-N 2.7Å
815	T	89.3	Confident	86	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	119.2	160.5	-62.9	0	0	0	0	108.7	F774 C775 T776 Q807 E808 I817	F774-T815 HydrophobicContact CD1-CG2 4.33Å; C775-T815 WeakPolarHBondContact O-CA 3.45Å; T776-T815 PolarHBondContact OG1-OG1 2.79Å; Q807-T815 WeakPolarHBondContact CA-O 3.43Å; E808-T815 PolarHBondContact N-O 3.14Å; E808-T815 PolarHBondContact O-N 2.82Å; T815-I817 HydrophobicContact CG2-CG1 4.06Å
816	S	90.8	Very high	86	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	133	171.8	-171.4	0	0	0	0	110.1	C775 W790	C775-S816 PolarHBondContact N-O 2.81Å; C775-S816 PolarHBondContact O-N 3.12Å; W790-S816 PolarHBondContact NE1-OG 3.13Å
817	I	90.4	Very high	86.1	Confident	7 Å²	7	42.5 Å²	42.5	4%	0.036	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	116.3	-175.4	-51.9	176.9	0	0	0	108.6	E772 L773 F774 I805 Y806 E808 T815 T819	E772-I817 HydrophobicContact CB-CG2 4.1Å; L773-I817 WeakPolarHBondContact O-CA 3.25Å; F774-I817 HydrophobicContact CD1-CD1 4.01Å; F774-I817 HydrophobicContact CD1-CG1 3.8Å; F774-I817 HydrophobicContact CD1-CG2 4.27Å; F774-I817 HydrophobicContact CE1-CD1 3.78Å; F774-I817 HydrophobicContact CE1-CG1 4.01Å; F774-I817 HydrophobicContact CE1-CG2 4.04Å; F774-I817 HydrophobicContact CZ-CG2 4.48Å; I805-I817 CarbonylContact C-O 3.58Å; I805-I817 WeakPolarHBondContact CA-O 3.42Å; Y806-I817 PolarHBondContact N-O 3.44Å; Y806-I817 PolarHBondContact O-N 2.94Å; E808-I817 VanDerWaalsContact CD-CD1 3.44Å; E808-I817 HydrophobicContact CG-CD1 4.01Å; E808-I817 WeakPolarHBondContact OE1-CD1 3.49Å; T815-I817 HydrophobicContact CG2-CG1 4.06Å; I817-T819 HydrophobicContact CG2-CG2 3.95Å
818	L	91	Very high	86.4	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	111	170.6	170	59.7	0	0	0	109	E772 L773 W790 I797 L803 I805 L820 Y831	E772-L818 CarbonylContact C-O 3.57Å; E772-L818 WeakPolarHBondContact CA-O 3.4Å; L773-L818 HydrophobicContact CB-CB 4.34Å; L773-L818 HydrophobicContact CD1-CD2 4.14Å; L773-L818 PolarHBondContact N-O 3.45Å; L773-L818 PolarHBondContact O-N 3.47Å; W790-L818 HydrophobicContact CB-CD2 4.07Å; W790-L818 HydrophobicContact CD2-CB 3.79Å; W790-L818 HydrophobicContact CD2-CD2 3.94Å; W790-L818 HydrophobicContact CE3-CB 4.26Å; W790-L818 HydrophobicContact CE3-CD2 3.92Å; W790-L818 HydrophobicContact CG-CB 4.09Å; W790-L818 HydrophobicContact CG-CD2 4.04Å; W790-L818 HydrophobicContact CH2-CB 4.49Å; W790-L818 HydrophobicContact CZ2-CB 4.06Å; I797-L818 HydrophobicContact CD1-CD2 3.66Å; I797-L818 HydrophobicContact CG2-CD1 4.47Å; L803-L818 HydrophobicContact CB-CD1 4.36Å; L803-L818 HydrophobicContact CD2-CD1 4.28Å; I805-L818 HydrophobicContact CG1-CD1 3.85Å; L818-L820 HydrophobicContact CG-CD1 4.14Å; L818-Y831 HydrophobicContact CD2-CD1 3.65Å; L818-Y831 HydrophobicContact CD2-CE1 3.95Å
819	T	89.5	Confident	86.8	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	140.2	178.1	63.1	0	0	0	0	110.8	F770 A771 E772 L803 R804 Y806 I817	F770-T819 HydrophobicContact CE2-CG2 4.41Å; F770-T819 HydrophobicContact CZ-CG2 4.12Å; A771-T819 WeakPolarHBondContact O-CA 3.39Å; E772-T819 HydrophobicContact CB-CG2 4.5Å; E772-T819 HydrophobicContact CG-CG2 4.03Å; L803-T819 WeakPolarHBondContact CA-O 3.37Å; R804-T819 WeakPolarHBondContact CB-OG1 3.34Å; R804-T819 PolarHBondContact N-O 3.16Å; R804-T819 PolarHBondContact O-N 3.45Å; R804-T819 PolarHBondContact O-OG1 3.13Å; Y806-T819 HydrophobicContact CD2-CG2 3.76Å; Y806-T819 HydrophobicContact CE2-CG2 3.79Å; I817-T819 HydrophobicContact CG2-CG2 3.95Å
820	L	90.6	Very high	87.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	105.3	-179.1	-60.4	100.6	0	0	0	109.9	F770 A771 L773 L803 L818 L823 D827 Y831	F770-L820 WeakPolarHBondContact CA-O 3.27Å; A771-L820 PolarHBondContact N-O 2.73Å; A771-L820 VanDerWaalsContact N-O 3.1Å; A771-L820 PolarHBondContact O-N 2.85Å; L773-L820 HydrophobicContact CD1-CD1 4.04Å; L773-L820 HydrophobicContact CG-CD1 4.12Å; L803-L820 HydrophobicContact CD2-CD2 3.63Å; L803-L820 HydrophobicContact CD2-CG 4.01Å; L803-L820 HydrophobicContact CG-CD2 4.43Å; L818-L820 HydrophobicContact CG-CD1 4.14Å; L820-L823 HydrophobicContact CB-CD2 3.71Å; L820-D827 HydrophobicContact CD2-CB 4.28Å; L820-Y831 HydrophobicContact CD2-CE1 4.19Å; L820-Y831 WeakPolarHBondContact CD2-OH 3.31Å
821	N	86.7	Confident	87.8	Confident	45 Å²	45	38.9 Å²	38.9	24%	0.241	20%	0.199	C	C	.	.	S	Bend	trans	-79.1	155.2	170.6	-59.7	-37	0	0	0	110.7	T769 F770 R802 L823	T769-N821 CarbonylContact O-C 3.58Å; F770-N821 WeakPolarHBondContact CD2-OD1 3.48Å; F770-N821 WeakPolarHBondContact CE2-OD1 3.33Å; R802-N821 WeakPolarHBondContact CD-O 3.47Å; R802-N821 HydrophobicContact CG-CB 4.31Å; R802-N821 WeakPolarHBondContact CG-O 3.45Å; R802-N821 PolarHBondContact NH1-O 2.84Å; R802-N821 WeakPolarHBondContact O-CB 3.34Å; R802-N821 PolarHBondContact O-N 2.81Å; N821-L823 PolarHBondContact O-N 2.86Å
822	N	85.1	Confident	88.4	Confident	120 Å²	120	39.8 Å²	39.8	64%	0.642	20%	0.204	S	C	*	.	S	Bend	trans	44.5	64.2	176.1	-64.7	-9.8	0	0	0	112.7	T769 R824	T769-N822 CarbonylContact O-C 3.57Å; T769-N822 VanDerWaalsContact O-CA 3.26Å; T769-N822 WeakPolarHBondContact O-CA 3.22Å; T769-N822 PolarHBondContact O-N 2.89Å; N822-R824 PolarHBondContact O-N 3.38Å
823	L	84.7	Confident	88.9	Confident	28 Å²	28	37.9 Å²	37.9	15%	0.147	20%	0.197	C	C	.	.			trans	-51.2	131.3	-179.1	-68.9	178.3	0	0	0	112.4	I764 T769 A771 L820 N821 D827 F828 L848	I764-L823 HydrophobicContact CG2-CD1 4.2Å; T769-L823 PolarHBondContact O-N 2.9Å; A771-L823 HydrophobicContact CB-CD1 3.87Å; A771-L823 HydrophobicContact CB-CD2 3.95Å; A771-L823 HydrophobicContact CB-CG 4.42Å; L820-L823 HydrophobicContact CB-CD2 3.71Å; N821-L823 PolarHBondContact O-N 2.86Å; L823-D827 HydrophobicContact CD2-CB 4.25Å; L823-F828 HydrophobicContact CD1-CZ 4.33Å; L823-L848 HydrophobicContact CD2-CD2 4.2Å
824	R	86.2	Confident	89.3	Confident	148 Å²	148	39.3 Å²	39.3	56%	0.558	21%	0.206	S	C	*	.			trans	-108.8	156.5	177.5	-57.5	177.1	176.6	178.9	-2.4	109.2	N822 N826 D827	N822-R824 PolarHBondContact O-N 3.38Å; R824-N826 PolarHBondContact O-N 3.01Å; R824-D827 WeakPolarHBondContact CB-OD2 3.29Å; R824-D827 PolarHBondContact N-OD2 2.91Å; R824-D827 WeakPolarHBondContact O-CB 3.41Å; R824-D827 PolarHBondContact O-N 3.5Å
825	P	83	Confident	89.5	Confident	114 Å²	114	39.1 Å²	39.1	74%	0.74	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-52.1	-33.1	173.2	-29	36.4	0	0	0	113.9	D827	P825-D827 VanDerWaalsContact C-N 3.31Å; P825-D827 PolarHBondContact O-N 2.97Å
826	N	84.7	Confident	89.7	Confident	142 Å²	142	42.2 Å²	42.2	76%	0.759	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-77.2	-9.3	179	-64.8	15	0	0	0	114.4	R824	R824-N826 PolarHBondContact O-N 3.01Å
827	D	87.1	Confident	89.7	Confident	10 Å²	10	42.5 Å²	42.5	5%	0.053	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-82	-20.9	175.8	-62.7	-42.1	0	0	0	112.2	R802 L820 L823 R824 P825 S829 Y831	R802-D827 IonicContact CZ-OD1 2.72Å; R802-D827 IonicContact CZ-OD2 2.62Å; R802-D827 IonicContact NH1-OD1 3.78Å; R802-D827 PolarHBondContact NH1-OD1 2.87Å; R802-D827 IonicContact NH1-OD2 3.06Å; R802-D827 PolarHBondContact NH1-OD2 3.41Å; R802-D827 IonicContact NH2-OD1 2.61Å; R802-D827 PolarHBondContact NH2-OD1 2.78Å; R802-D827 IonicContact NH2-OD2 3.61Å; R802-D827 PolarHBondContact NH2-OD2 2.85Å; L820-D827 HydrophobicContact CD2-CB 4.28Å; L823-D827 HydrophobicContact CD2-CB 4.25Å; R824-D827 WeakPolarHBondContact CB-OD2 3.29Å; R824-D827 PolarHBondContact N-OD2 2.91Å; R824-D827 WeakPolarHBondContact O-CB 3.41Å; R824-D827 PolarHBondContact O-N 3.5Å; P825-D827 VanDerWaalsContact C-N 3.31Å; P825-D827 PolarHBondContact O-N 2.97Å; D827-S829 PolarHBondContact O-N 2.03Å; D827-Y831 VanDerWaalsContact O-CE2 3.32Å; D827-Y831 WeakPolarHBondContact O-CE2 3.44Å; D827-Y831 PolarHBondContact O-OH 2.91Å
828	F	87.8	Confident	89.6	Confident	78 Å²	78	48.5 Å²	48.5	34%	0.342	26%	0.257	S	S	.	.	S	Bend	trans	-71.7	78.4	173.1	-64.1	-77.5	0	0	0	110	L823 L848	L823-F828 HydrophobicContact CD1-CZ 4.33Å; F828-L848 WeakPolarHBondContact CA-O 3.42Å; F828-L848 HydrophobicContact CD1-CG 4.01Å; F828-L848 HydrophobicContact CE1-CG 4.37Å
829	S	89.8	Confident	89.6	Confident	20 Å²	20	52.8 Å²	52.8	14%	0.14	27%	0.274	C	S	.	.	S	Bend	trans	-142.4	175.3	-167.1	-169.6	0	0	0	0	111	D827 Y831 L848	D827-S829 PolarHBondContact O-N 2.03Å; S829-Y831 WeakPolarHBondContact O-CD2 3.31Å; S829-L848 PolarHBondContact O-N 3.47Å
830	T	92	Very high	89.8	Confident	47 Å²	47	54 Å²	54	29%	0.288	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	115.3	174.8	-55.7	0	0	0	0	110.7	L845 I846 T847	T830-L845 HydrophobicContact CG2-CB 3.88Å; T830-L845 HydrophobicContact CG2-CD1 4.47Å; T830-L845 HydrophobicContact CG2-CD2 3.95Å; T830-L845 HydrophobicContact CG2-CG 4.31Å; T830-I846 CarbonylContact C-O 3.53Å; T830-I846 WeakPolarHBondContact CA-O 3.28Å; T830-T847 PolarHBondContact OG1-OG1 3.32Å
831	Y	93.3	Very high	90	Very high	1 Å²	1	57.8 Å²	57.8	0%	0.004	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	154.2	174	-60.6	-102.5	0	0	0	109.4	L773 S791 I792 I797 L818 L820 D827 S829 L845 I846 L848	L773-Y831 HydrophobicContact CD1-CD1 3.94Å; L773-Y831 HydrophobicContact CD1-CD2 3.46Å; L773-Y831 VanDerWaalsContact CD1-CD2 3.46Å; L773-Y831 HydrophobicContact CD1-CE1 4.31Å; L773-Y831 HydrophobicContact CD1-CE2 3.88Å; L773-Y831 HydrophobicContact CD1-CG 3.52Å; S791-Y831 CarbonylContact O-C 3.55Å; S791-Y831 VanDerWaalsContact O-CA 3.31Å; S791-Y831 WeakPolarHBondContact O-CA 3.42Å; I792-Y831 HydrophobicContact CB-CD1 4.25Å; I792-Y831 HydrophobicContact CB-CE1 4.33Å; I792-Y831 HydrophobicContact CD1-CE1 4Å; I797-Y831 HydrophobicContact CD1-CD1 3.49Å; I797-Y831 VanDerWaalsContact CD1-CD1 3.49Å; I797-Y831 HydrophobicContact CD1-CE1 3.6Å; L818-Y831 HydrophobicContact CD2-CD1 3.65Å; L818-Y831 HydrophobicContact CD2-CE1 3.95Å; L820-Y831 HydrophobicContact CD2-CE1 4.19Å; L820-Y831 WeakPolarHBondContact CD2-OH 3.31Å; D827-Y831 VanDerWaalsContact O-CE2 3.32Å; D827-Y831 WeakPolarHBondContact O-CE2 3.44Å; D827-Y831 PolarHBondContact O-OH 2.91Å; S829-Y831 WeakPolarHBondContact O-CD2 3.31Å; Y831-L845 CarbonylContact O-C 3.57Å; Y831-L845 VanDerWaalsContact O-CA 3.32Å; Y831-L845 WeakPolarHBondContact O-CA 3.47Å; Y831-I846 PolarHBondContact N-O 3.15Å; Y831-I846 PolarHBondContact O-N 2.96Å; Y831-L848 HydrophobicContact CD2-CB 4.39Å; Y831-L848 HydrophobicContact CE2-CB 4Å; Y831-L848 HydrophobicContact CE2-CD2 4.41Å
832	N	94.6	Very high	90.4	Very high	29 Å²	29	58.1 Å²	58.1	16%	0.155	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	123.3	175.7	-173.5	22	0	0	0	109	W790 S791 T834 K844 L845	W790-N832 CarbonylContact C-O 3.55Å; W790-N832 WeakPolarHBondContact CA-O 3.49Å; S791-N832 PolarHBondContact N-O 3.4Å; S791-N832 PolarHBondContact O-N 2.91Å; N832-T834 PolarHBondContact ND2-OG1 2.93Å; N832-K844 PolarHBondContact OD1-N 3.11Å; N832-K844 PolarHBondContact OD1-O 2.91Å; N832-L845 HydrophobicContact CB-CD2 3.62Å
833	C	94.7	Very high	90.9	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	115.8	168.1	176.7	0	0	0	0	107.9	I757 I760 C775 W790 W843 K844	I757-C833 WeakPolarHBondContact CD1-O 3.26Å; I760-C833 HydrophobicContact CD1-CB 4.43Å; C775-C833 HydrophobicContact CB-CB 3.71Å; C775-C833 WeakPolarHBondContact CB-SG 3.25Å; C775-C833 WeakPolarHBondContact SG-CB 3.49Å; C775-C833 CovalentContact SG-SG 2.04Å; C775-C833 PolarHBondContact SG-SG 2.61Å; W790-C833 HydrophobicContact CD2-CB 4.36Å; W790-C833 HydrophobicContact CE3-CB 4.08Å; W790-C833 HydrophobicContact CH2-CB 4.02Å; W790-C833 HydrophobicContact CZ2-CB 4.28Å; W790-C833 HydrophobicContact CZ3-CB 3.89Å; C833-W843 CarbonylContact O-C 3.59Å; C833-W843 VanDerWaalsContact O-CA 3.24Å; C833-W843 WeakPolarHBondContact O-CA 3.13Å; C833-K844 PolarHBondContact N-O 2.97Å; C833-K844 PolarHBondContact O-N 3.46Å
834	T	94.5	Very high	91.4	Very high	31 Å²	31	62.5 Å²	62.5	19%	0.19	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	129	175.9	-58.5	0	0	0	0	109.2	T789 N832 V836 W843	T789-T834 PolarHBondContact N-O 2.92Å; T789-T834 PolarHBondContact O-N 2.91Å; T789-T834 PolarHBondContact OG1-O 3.19Å; N832-T834 PolarHBondContact ND2-OG1 2.93Å; T834-V836 HydrophobicContact CG2-CG2 4.45Å; T834-W843 HydrophobicContact CG2-CB 4.2Å
835	V	94.4	Very high	91.7	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	141.6	173.8	56.3	0	0	0	0	110.9	P755 I757 I777 P783 Q787 I788 S841 D842	P755-V835 HydrophobicContact CB-CB 4.48Å; P755-V835 HydrophobicContact CB-CG1 3.74Å; P755-V835 HydrophobicContact CB-CG2 3.98Å; P755-V835 HydrophobicContact CG-CG1 3.87Å; P755-V835 HydrophobicContact CG-CG2 4.23Å; I757-V835 HydrophobicContact CD1-CG1 4.32Å; I757-V835 HydrophobicContact CG1-CG1 4.04Å; I777-V835 HydrophobicContact CD1-CB 4.01Å; I777-V835 HydrophobicContact CD1-CG1 4.29Å; I777-V835 HydrophobicContact CD1-CG2 4.29Å; I777-V835 HydrophobicContact CG1-CB 4.46Å; I777-V835 HydrophobicContact CG1-CG1 4.21Å; I777-V835 HydrophobicContact CG2-CB 4.38Å; I777-V835 HydrophobicContact CG2-CG1 3.93Å; I777-V835 HydrophobicContact CG2-CG2 4.08Å; P783-V835 HydrophobicContact CB-CG2 4.05Å; P783-V835 HydrophobicContact CG-CG2 4.16Å; Q787-V835 WeakPolarHBondContact O-CA 3.48Å; I788-V835 HydrophobicContact CG1-CB 4.44Å; I788-V835 HydrophobicContact CG1-CG2 4.03Å; V835-S841 CarbonylContact O-C 3.59Å; V835-S841 WeakPolarHBondContact O-CA 3.47Å; V835-S841 VanDerWaalsContact O-CB 3.22Å; V835-S841 WeakPolarHBondContact O-CB 3.38Å; V835-D842 HydrophobicContact CG1-CB 4.32Å; V835-D842 PolarHBondContact N-O 2.84Å; V835-D842 PolarHBondContact O-N 2.7Å
836	V	92.6	Very high	92.1	Very high	65 Å²	65	55.1 Å²	55.1	39%	0.394	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	135.9	178.9	-171.6	0	0	0	0	108.6	Q787 T834 G840	Q787-V836 WeakPolarHBondContact CB-O 3.25Å; Q787-V836 WeakPolarHBondContact CG-O 3.4Å; Q787-V836 PolarHBondContact O-N 2.62Å; T834-V836 HydrophobicContact CG2-CG2 4.45Å; V836-G840 CarbonylContact C-O 3.59Å; V836-G840 WeakPolarHBondContact CA-O 3.19Å
837	N	90.9	Very high	92.4	Very high	7 Å²	7	52.3 Å²	52.3	4%	0.037	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	-179	163.9	76	13	0	0	0	109.2	E753 P755 S779 Y839 G840	E753-N837 PolarHBondContact O-ND2 3.1Å; P755-N837 WeakPolarHBondContact CD-OD1 3.43Å; S779-N837 PolarHBondContact OG-ND2 3.36Å; N837-Y839 PolarHBondContact O-N 2.89Å; N837-Y839 WeakPolarHBondContact OD1-CA 3.18Å; N837-Y839 WeakPolarHBondContact OD1-CB 2.99Å; N837-Y839 PolarHBondContact OD1-N 3.44Å; N837-G840 PolarHBondContact N-O 3.33Å; N837-G840 PolarHBondContact O-N 3.09Å; N837-G840 VanDerWaalsContact O-O 3.09Å; N837-G840 PolarHBondContact OD1-N 3.23Å; N837-G840 VanDerWaalsContact OD1-N 3.15Å
838	D	88.5	Confident	92.5	Very high	132 Å²	132	52 Å²	52	71%	0.706	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-11.3	-175.9	-51.4	-42.6	0	0	0	113.6
839	Y	91.1	Very high	92.2	Very high	90 Å²	90	50 Å²	50	35%	0.353	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-1.7	-178	-64.6	-90.9	0	0	0	113.6	E622 A752 S754 N837	E622-Y839 VanDerWaalsContact OE1-CE1 3.29Å; E622-Y839 WeakPolarHBondContact OE1-CE1 3.43Å; E622-Y839 PolarHBondContact OE1-OH 3.14Å; A752-Y839 HydrophobicContact CB-CD1 4.45Å; A752-Y839 HydrophobicContact CB-CD2 4.24Å; A752-Y839 HydrophobicContact CB-CE1 3.86Å; A752-Y839 HydrophobicContact CB-CE2 3.64Å; A752-Y839 VanDerWaalsContact CB-CZ 3.41Å; A752-Y839 WeakPolarHBondContact CB-OH 3.39Å; S754-Y839 PolarHBondContact OG-O 2.93Å; N837-Y839 PolarHBondContact O-N 2.89Å; N837-Y839 WeakPolarHBondContact OD1-CA 3.18Å; N837-Y839 WeakPolarHBondContact OD1-CB 2.99Å; N837-Y839 PolarHBondContact OD1-N 3.44Å
840	G	93.4	Very high	91.2	Very high	28 Å²	28	52.2 Å²	52.2	29%	0.289	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	147.8	-162.1	175.7	0	0	0	0	0	114.3	P755 V836 N837	P755-G840 WeakPolarHBondContact CD-O 3.5Å; V836-G840 CarbonylContact C-O 3.59Å; V836-G840 WeakPolarHBondContact CA-O 3.19Å; N837-G840 PolarHBondContact N-O 3.33Å; N837-G840 PolarHBondContact O-N 3.09Å; N837-G840 VanDerWaalsContact O-O 3.09Å; N837-G840 PolarHBondContact OD1-N 3.23Å; N837-G840 VanDerWaalsContact OD1-N 3.15Å
841	S	94.8	Very high	89.8	Confident	79 Å²	79	53.7 Å²	53.7	55%	0.552	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.5	157	-179.1	57.9	0	0	0	0	112.8	V835	V835-S841 CarbonylContact O-C 3.59Å; V835-S841 WeakPolarHBondContact O-CA 3.47Å; V835-S841 VanDerWaalsContact O-CB 3.22Å; V835-S841 WeakPolarHBondContact O-CB 3.38Å
842	D	96	Very high	87.9	Confident	51 Å²	51	59.8 Å²	59.8	27%	0.273	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	152.6	172.3	-171.6	20.3	0	0	0	109.3	P755 K756 I757 V835	P755-D842 HydrophobicContact CG-CB 4.42Å; P755-D842 WeakPolarHBondContact O-CB 3.47Å; K756-D842 WeakPolarHBondContact CA-OD2 3.24Å; I757-D842 HydrophobicContact CD1-CB 4.48Å; I757-D842 HydrophobicContact CG1-CB 4.36Å; I757-D842 PolarHBondContact N-OD2 3.21Å; V835-D842 HydrophobicContact CG1-CB 4.32Å; V835-D842 PolarHBondContact N-O 2.84Å; V835-D842 PolarHBondContact O-N 2.7Å
843	W	94.6	Very high	85.9	Confident	153 Å²	153	66 Å²	66	58%	0.58	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.5	146.8	-178.7	65.4	-86.6	0	0	0	111.6	C833 T834 L845	C833-W843 CarbonylContact O-C 3.59Å; C833-W843 VanDerWaalsContact O-CA 3.24Å; C833-W843 WeakPolarHBondContact O-CA 3.13Å; T834-W843 HydrophobicContact CG2-CB 4.2Å; W843-L845 HydrophobicContact CE3-CG 4.37Å; W843-L845 HydrophobicContact CZ3-CD1 4.05Å; W843-L845 HydrophobicContact CZ3-CD2 4.5Å; W843-L845 HydrophobicContact CZ3-CG 3.92Å
844	K	94.5	Very high	84.2	Confident	87 Å²	87	75.4 Å²	75.4	38%	0.378	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	138.7	-177.8	-162.4	177.4	-174.9	171.5	0	111.5	I757 I760 N832 C833	I757-K844 HydrophobicContact CB-CB 4.4Å; I757-K844 HydrophobicContact CB-CD 4.29Å; I757-K844 HydrophobicContact CD1-CB 3.79Å; I757-K844 HydrophobicContact CG2-CB 4.12Å; I757-K844 HydrophobicContact CG2-CD 3.77Å; I760-K844 HydrophobicContact CB-CD 4.48Å; I760-K844 HydrophobicContact CD1-CB 3.6Å; I760-K844 HydrophobicContact CD1-CD 3.91Å; I760-K844 HydrophobicContact CD1-CG 3.76Å; I760-K844 WeakPolarHBondContact CD1-O 3.36Å; I760-K844 HydrophobicContact CG1-CD 4.11Å; I760-K844 HydrophobicContact CG1-CG 4.5Å; N832-K844 PolarHBondContact OD1-N 3.11Å; N832-K844 PolarHBondContact OD1-O 2.91Å; C833-K844 PolarHBondContact N-O 2.97Å; C833-K844 PolarHBondContact O-N 3.46Å
845	L	93.4	Very high	82.7	Confident	96 Å²	96	77.1 Å²	77.1	50%	0.503	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	143.9	-177	-62.2	168.4	0	0	0	111.6	T830 Y831 N832 W843	T830-L845 HydrophobicContact CG2-CB 3.88Å; T830-L845 HydrophobicContact CG2-CD1 4.47Å; T830-L845 HydrophobicContact CG2-CD2 3.95Å; T830-L845 HydrophobicContact CG2-CG 4.31Å; Y831-L845 CarbonylContact O-C 3.57Å; Y831-L845 VanDerWaalsContact O-CA 3.32Å; Y831-L845 WeakPolarHBondContact O-CA 3.47Å; N832-L845 HydrophobicContact CB-CD2 3.62Å; W843-L845 HydrophobicContact CE3-CG 4.37Å; W843-L845 HydrophobicContact CZ3-CD1 4.05Å; W843-L845 HydrophobicContact CZ3-CD2 4.5Å; W843-L845 HydrophobicContact CZ3-CG 3.92Å
846	I	91.4	Very high	81.3	Confident	12 Å²	12	83.8 Å²	83.8	6%	0.062	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	127	170	-173.7	165.1	0	0	0	109.3	I760 D761 Q762 L773 W790 T830 Y831	I760-I846 HydrophobicContact CG2-CB 3.57Å; I760-I846 HydrophobicContact CG2-CD1 3.42Å; I760-I846 VanDerWaalsContact CG2-CD1 3.42Å; I760-I846 HydrophobicContact CG2-CG1 3.69Å; D761-I846 WeakPolarHBondContact O-CD1 3.31Å; Q762-I846 HydrophobicContact CB-CD1 4.1Å; L773-I846 HydrophobicContact CB-CD1 4.24Å; L773-I846 HydrophobicContact CB-CG2 4.44Å; L773-I846 HydrophobicContact CD1-CG2 4.21Å; L773-I846 HydrophobicContact CD2-CD1 3.78Å; L773-I846 HydrophobicContact CD2-CG1 4.17Å; L773-I846 HydrophobicContact CD2-CG2 4.43Å; W790-I846 HydrophobicContact CH2-CG2 4.43Å; W790-I846 HydrophobicContact CZ3-CG2 3.82Å; T830-I846 CarbonylContact C-O 3.53Å; T830-I846 WeakPolarHBondContact CA-O 3.28Å; Y831-I846 PolarHBondContact N-O 3.15Å; Y831-I846 PolarHBondContact O-N 2.96Å
847	T	90.5	Very high	80.4	Confident	83 Å²	83	84.6 Å²	84.6	51%	0.509	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	115.8	177.3	-56.8	0	0	0	0	109.1	Q762 T830 S849	Q762-T847 PolarHBondContact OE1-O 2.92Å; T830-T847 PolarHBondContact OG1-OG1 3.32Å; T847-S849 PolarHBondContact O-N 2.89Å; T847-S849 VanDerWaalsContact O-N 3.12Å
848	L	89.1	Confident	79.7	Confident	2 Å²	2	90 Å²	90	1%	0.01	46%	0.462	C	S	.	.			trans	-72	103.7	175.4	179.8	55	0	0	0	109.2	I764 A771 L773 L823 F828 S829 Y831	I764-L848 HydrophobicContact CD1-CD1 3.74Å; I764-L848 HydrophobicContact CG1-CD1 4.03Å; A771-L848 HydrophobicContact CB-CD1 4.01Å; A771-L848 HydrophobicContact CB-CD2 4.16Å; L773-L848 HydrophobicContact CD2-CB 4.34Å; L773-L848 HydrophobicContact CD2-CD1 4.19Å; L823-L848 HydrophobicContact CD2-CD2 4.2Å; F828-L848 WeakPolarHBondContact CA-O 3.42Å; F828-L848 HydrophobicContact CD1-CG 4.01Å; F828-L848 HydrophobicContact CE1-CG 4.37Å; S829-L848 PolarHBondContact O-N 3.47Å; Y831-L848 HydrophobicContact CD2-CB 4.39Å; Y831-L848 HydrophobicContact CE2-CB 4Å; Y831-L848 HydrophobicContact CE2-CD2 4.41Å
849	S	81.6	Confident	79.2	Confident	37 Å²	37	87 Å²	87	26%	0.259	45%	0.454	S	S	.	.			trans	-100.6	134.5	-180	61.2	0	0	0	0	111.7	Q762 I764 T847 D851	Q762-S849 PolarHBondContact NE2-OG 3.49Å; I764-S849 WeakPolarHBondContact CD1-O 3.15Å; T847-S849 PolarHBondContact O-N 2.89Å; T847-S849 VanDerWaalsContact O-N 3.12Å; S849-D851 WeakPolarHBondContact CB-OD1 3.08Å; S849-D851 PolarHBondContact O-N 2.92Å; S849-D851 PolarHBondContact OG-OD1 2.88Å
850	S	70.5	Confident	78.8	Confident	67 Å²	67	86 Å²	86	47%	0.469	46%	0.457	S	S	.	.			trans	-72.9	82.6	163.3	-176.3	0	0	0	0	108.1	N852	S850-N852 PolarHBondContact O-N 2.84Å
851	D	60.7	Low	78.3	Confident	77 Å²	77	89.8 Å²	89.8	41%	0.412	47%	0.47	S	S	.	.			trans	-72.3	67.8	175.8	-92.8	28	0	0	0	110.3	S849 K853	S849-D851 WeakPolarHBondContact CB-OD1 3.08Å; S849-D851 PolarHBondContact O-N 2.92Å; S849-D851 PolarHBondContact OG-OD1 2.88Å; D851-K853 HydrophobicContact CB-CD 4.37Å; D851-K853 HydrophobicContact CB-CG 4.44Å; D851-K853 PolarHBondContact O-N 3.03Å; D851-K853 WeakPolarHBondContact OD2-CD 3.4Å; D851-K853 WeakPolarHBondContact OD2-CE 3.08Å; D851-K853 IonicContact OD2-NZ 2.71Å; D851-K853 PolarHBondContact OD2-NZ 3.38Å
852	N	53.9	Low	77.8	Confident	129 Å²	129	89.9 Å²	89.9	69%	0.69	47%	0.471	S	S	*	.			trans	-68.9	51.1	159.4	-74.7	-18.4	0	0	0	110	S850 W854	S850-N852 PolarHBondContact O-N 2.84Å; N852-W854 PolarHBondContact O-N 2.89Å
853	K	53	Low	77.5	Confident	159 Å²	159	89.3 Å²	89.3	69%	0.691	48%	0.477	S	S	*	.			trans	-67.9	86.7	164.5	-76.1	171.4	175.7	156.1	0	106.3	D851 P855	D851-K853 HydrophobicContact CB-CD 4.37Å; D851-K853 HydrophobicContact CB-CG 4.44Å; D851-K853 PolarHBondContact O-N 3.03Å; D851-K853 WeakPolarHBondContact OD2-CD 3.4Å; D851-K853 WeakPolarHBondContact OD2-CE 3.08Å; D851-K853 IonicContact OD2-NZ 2.71Å; D851-K853 PolarHBondContact OD2-NZ 3.38Å; K853-P855 WeakPolarHBondContact O-CD 3.45Å
854	W	58.4	Low	77.3	Confident	198 Å²	198	88.5 Å²	88.5	75%	0.75	48%	0.478	S	S	*	.			trans	-43.8	114.8	161.9	-74	82.3	0	0	0	106.8	N852 L856 F858	N852-W854 PolarHBondContact O-N 2.89Å; W854-L856 PolarHBondContact O-N 2.87Å; W854-F858 HydrophobicContact CE3-CB 4.31Å; W854-F858 HydrophobicContact CE3-CD2 4.29Å; W854-F858 HydrophobicContact CE3-CG 4.27Å
855	P	63.2	Low	77.1	Confident	67 Å²	67	87 Å²	87	44%	0.435	48%	0.482	S	S	.	.			trans	-60.5	139.6	-172.5	25.9	-35.4	0	0	0	107.1	K853 T857 F858	K853-P855 WeakPolarHBondContact O-CD 3.45Å; P855-T857 WeakPolarHBondContact CB-OG1 3.4Å; P855-T857 CarbonylContact O-C 3.49Å; P855-T857 PolarHBondContact O-N 2.78Å; P855-F858 HydrophobicContact CG-CD2 3.79Å; P855-F858 HydrophobicContact CG-CE2 4.48Å; P855-F858 PolarHBondContact O-N 2.68Å
856	L	66.2	Low	77	Confident	141 Å²	141	85.3 Å²	85.3	74%	0.738	48%	0.482	S	S	*	.	H	α-helix	trans	-57.2	-22	-171.3	-144.4	147.1	0	0	0	111.2	W854 F858 A859 V860	W854-L856 PolarHBondContact O-N 2.87Å; L856-F858 PolarHBondContact O-N 3.01Å; L856-A859 PolarHBondContact O-N 2.9Å; L856-V860 HydrophobicContact CD2-CG2 3.96Å; L856-V860 VanDerWaalsContact O-CG2 3.31Å; L856-V860 WeakPolarHBondContact O-CG2 3.21Å; L856-V860 PolarHBondContact O-N 3.33Å
857	T	72.7	Confident	77.1	Confident	82 Å²	82	90 Å²	90	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-52.9	-42.9	166	58.1	0	0	0	0	114.5	P855 A859 V860 I861	P855-T857 WeakPolarHBondContact CB-OG1 3.4Å; P855-T857 CarbonylContact O-C 3.49Å; P855-T857 PolarHBondContact O-N 2.78Å; T857-A859 PolarHBondContact O-N 3Å; T857-V860 PolarHBondContact O-N 2.85Å; T857-I861 VanDerWaalsContact O-CB 3.26Å; T857-I861 WeakPolarHBondContact O-CB 3.07Å; T857-I861 WeakPolarHBondContact O-CD1 2.95Å; T857-I861 WeakPolarHBondContact O-CG1 3.3Å; T857-I861 PolarHBondContact O-N 3.39Å
858	F	76.7	Confident	77.2	Confident	121 Å²	121	91.3 Å²	91.3	53%	0.531	51%	0.51	S	S	.	.	H	α-helix	trans	-65.1	-39.4	176.7	-97.8	-67.9	0	0	0	112	W854 P855 L856 S862	W854-F858 HydrophobicContact CE3-CB 4.31Å; W854-F858 HydrophobicContact CE3-CD2 4.29Å; W854-F858 HydrophobicContact CE3-CG 4.27Å; P855-F858 HydrophobicContact CG-CD2 3.79Å; P855-F858 HydrophobicContact CG-CE2 4.48Å; P855-F858 PolarHBondContact O-N 2.68Å; L856-F858 PolarHBondContact O-N 3.01Å; F858-S862 WeakPolarHBondContact O-CB 2.98Å; F858-S862 PolarHBondContact O-N 2.91Å
859	A	77.2	Confident	77.4	Confident	67 Å²	67	92.9 Å²	92.9	55%	0.554	53%	0.526	S	S	*	.	H	α-helix	trans	-66.6	-41.8	174.7	0	0	0	0	0	111.5	L856 T857 G863	L856-A859 PolarHBondContact O-N 2.9Å; T857-A859 PolarHBondContact O-N 3Å; A859-G863 PolarHBondContact O-N 3.46Å
860	V	83.5	Confident	77.9	Confident	69 Å²	69	95.6 Å²	95.6	42%	0.418	54%	0.541	S	S	.	.	H	α-helix	trans	-66.6	-46.3	176.6	170.9	0	0	0	0	111.6	L856 T857 G863 F864	L856-V860 HydrophobicContact CD2-CG2 3.96Å; L856-V860 VanDerWaalsContact O-CG2 3.31Å; L856-V860 WeakPolarHBondContact O-CG2 3.21Å; L856-V860 PolarHBondContact O-N 3.33Å; T857-V860 PolarHBondContact O-N 2.85Å; V860-G863 PolarHBondContact O-N 2.98Å; V860-F864 HydrophobicContact CG1-CD2 3.74Å; V860-F864 HydrophobicContact CG1-CE2 3.91Å; V860-F864 WeakPolarHBondContact O-CD2 3.23Å; V860-F864 PolarHBondContact O-N 3.05Å
861	I	83.2	Confident	79	Confident	109 Å²	109	96.3 Å²	96.3	56%	0.559	54%	0.539	S	S	*	.	H	α-helix	trans	-64.3	-43.3	178.3	-68.9	162.4	0	0	0	110.5	T857 G863 F864 A865	T857-I861 VanDerWaalsContact O-CB 3.26Å; T857-I861 WeakPolarHBondContact O-CB 3.07Å; T857-I861 WeakPolarHBondContact O-CD1 2.95Å; T857-I861 WeakPolarHBondContact O-CG1 3.3Å; T857-I861 PolarHBondContact O-N 3.39Å; I861-G863 PolarHBondContact O-N 2.83Å; I861-F864 PolarHBondContact O-N 2.85Å; I861-A865 VanDerWaalsContact O-CB 3.27Å; I861-A865 WeakPolarHBondContact O-CB 3.12Å; I861-A865 PolarHBondContact O-N 2.82Å
862	S	84.4	Confident	80.5	Confident	81 Å²	81	99.1 Å²	99.1	57%	0.566	55%	0.548	S	S	*	.	H	α-helix	trans	-60.2	-44.4	173.3	-178	0	0	0	0	111.6	F858 A865 A866	F858-S862 WeakPolarHBondContact O-CB 2.98Å; F858-S862 PolarHBondContact O-N 2.91Å; S862-A865 PolarHBondContact O-N 2.72Å; S862-A866 WeakPolarHBondContact O-CB 3.11Å; S862-A866 PolarHBondContact O-N 2.7Å
863	G	88.7	Confident	82.3	Confident	39 Å²	39	97.1 Å²	97.1	40%	0.402	54%	0.54	S	S	.	.	H	α-helix	trans	-59.5	-48.8	174.3	0	0	0	0	0	113	A859 V860 I861 A866 L867	A859-G863 PolarHBondContact O-N 3.46Å; V860-G863 PolarHBondContact O-N 2.98Å; I861-G863 PolarHBondContact O-N 2.83Å; G863-A866 PolarHBondContact O-N 3.08Å; G863-L867 WeakPolarHBondContact O-CB 3.31Å; G863-L867 PolarHBondContact O-N 3.1Å
864	F	90.4	Very high	84.1	Confident	135 Å²	135	92.7 Å²	92.7	59%	0.592	53%	0.527	S	S	*	.	H	α-helix	trans	-63.8	-41.4	176.3	-92.8	-80.4	0	0	0	112.5	V860 I861 L867 L868	V860-F864 HydrophobicContact CG1-CD2 3.74Å; V860-F864 HydrophobicContact CG1-CE2 3.91Å; V860-F864 WeakPolarHBondContact O-CD2 3.23Å; V860-F864 PolarHBondContact O-N 3.05Å; I861-F864 PolarHBondContact O-N 2.85Å; F864-L867 PolarHBondContact O-N 2.91Å; F864-L868 WeakPolarHBondContact O-CB 3.4Å; F864-L868 VanDerWaalsContact O-CG 3.32Å; F864-L868 WeakPolarHBondContact O-CG 3.2Å; F864-L868 PolarHBondContact O-N 2.77Å
865	A	90.6	Very high	85.7	Confident	57 Å²	57	87.8 Å²	87.8	47%	0.471	51%	0.514	S	S	.	.	H	α-helix	trans	-64.5	-41.5	177.1	0	0	0	0	0	111.8	I861 S862 G869	I861-A865 VanDerWaalsContact O-CB 3.27Å; I861-A865 WeakPolarHBondContact O-CB 3.12Å; I861-A865 PolarHBondContact O-N 2.82Å; S862-A865 PolarHBondContact O-N 2.72Å; A865-G869 PolarHBondContact O-N 2.96Å
866	A	91.6	Very high	87	Confident	60 Å²	60	88.1 Å²	88.1	50%	0.496	51%	0.512	S	S	.	.	H	α-helix	trans	-64	-43	173.5	0	0	0	0	0	111.8	S862 G863 G869 V870	S862-A866 WeakPolarHBondContact O-CB 3.11Å; S862-A866 PolarHBondContact O-N 2.7Å; G863-A866 PolarHBondContact O-N 3.08Å; A866-G869 PolarHBondContact O-N 3.44Å; A866-V870 WeakPolarHBondContact O-CG2 3.45Å; A866-V870 PolarHBondContact O-N 2.93Å
867	L	92.8	Very high	88	Confident	111 Å²	111	84.5 Å²	84.5	58%	0.581	50%	0.497	S	S	*	.	H	α-helix	trans	-66.1	-44.6	179.5	-149.8	164.1	0	0	0	111	G863 F864 G869 V870 L871	G863-L867 WeakPolarHBondContact O-CB 3.31Å; G863-L867 PolarHBondContact O-N 3.1Å; F864-L867 PolarHBondContact O-N 2.91Å; L867-G869 VanDerWaalsContact C-N 3.35Å; L867-G869 PolarHBondContact O-N 2.66Å; L867-V870 PolarHBondContact O-N 3.36Å; L867-L871 WeakPolarHBondContact O-CB 3.17Å; L867-L871 PolarHBondContact O-N 3.02Å
868	L	93.4	Very high	88.8	Confident	110 Å²	110	84.5 Å²	84.5	58%	0.576	50%	0.5	S	S	*	.	H	α-helix	trans	-62.7	-38.5	172.1	-73.5	172.3	0	0	0	112.2	F864 L871 F872	F864-L868 WeakPolarHBondContact O-CB 3.4Å; F864-L868 VanDerWaalsContact O-CG 3.32Å; F864-L868 WeakPolarHBondContact O-CG 3.2Å; F864-L868 PolarHBondContact O-N 2.77Å; L868-L871 PolarHBondContact O-N 2.83Å; L868-F872 VanDerWaalsContact O-CB 3.32Å; L868-F872 WeakPolarHBondContact O-CB 3.44Å; L868-F872 PolarHBondContact O-N 3.04Å
869	G	92.3	Very high	89.2	Confident	35 Å²	35	85.3 Å²	85.3	36%	0.361	50%	0.503	S	S	.	.	H	α-helix	trans	-60.9	-46.6	173.9	0	0	0	0	0	112.3	A865 A866 L867 F872 V873	A865-G869 PolarHBondContact O-N 2.96Å; A866-G869 PolarHBondContact O-N 3.44Å; L867-G869 VanDerWaalsContact C-N 3.35Å; L867-G869 PolarHBondContact O-N 2.66Å; G869-F872 PolarHBondContact O-N 3.29Å; G869-V873 WeakPolarHBondContact O-CB 3.24Å; G869-V873 VanDerWaalsContact O-CG2 3.3Å; G869-V873 WeakPolarHBondContact O-CG2 3.49Å; G869-V873 PolarHBondContact O-N 3.12Å
870	V	93.3	Very high	89.5	Confident	94 Å²	94	85.5 Å²	85.5	57%	0.57	49%	0.494	S	S	*	.	H	α-helix	trans	-64.2	-39.8	174.4	172.6	0	0	0	0	111.3	A866 L867 V873 T874	A866-V870 WeakPolarHBondContact O-CG2 3.45Å; A866-V870 PolarHBondContact O-N 2.93Å; L867-V870 PolarHBondContact O-N 3.36Å; V870-V873 PolarHBondContact O-N 3.13Å; V870-T874 HydrophobicContact CG1-CG2 4.4Å; V870-T874 WeakPolarHBondContact O-CB 3.09Å; V870-T874 WeakPolarHBondContact O-CG2 3.08Å; V870-T874 PolarHBondContact O-N 3.35Å; V870-T874 PolarHBondContact O-OG1 2.91Å
871	L	92.4	Very high	89.5	Confident	82 Å²	82	91 Å²	91	43%	0.429	51%	0.507	S	S	.	.	H	α-helix	trans	-65.8	-41.3	177.7	-148.1	164.1	0	0	0	111.1	L867 L868 T874 I875	L867-L871 WeakPolarHBondContact O-CB 3.17Å; L867-L871 PolarHBondContact O-N 3.02Å; L868-L871 PolarHBondContact O-N 2.83Å; L871-T874 WeakPolarHBondContact CA-OG1 3.43Å; L871-T874 PolarHBondContact O-N 2.88Å; L871-T874 PolarHBondContact O-OG1 2.83Å; L871-I875 HydrophobicContact CD2-CD1 3.41Å; L871-I875 VanDerWaalsContact CD2-CD1 3.41Å; L871-I875 HydrophobicContact CD2-CG1 3.96Å; L871-I875 WeakPolarHBondContact O-CB 3.16Å; L871-I875 WeakPolarHBondContact O-CG1 3.49Å; L871-I875 PolarHBondContact O-N 2.67Å
872	F	92.7	Very high	89.2	Confident	136 Å²	136	92.1 Å²	92.1	60%	0.596	51%	0.505	S	S	*	.	H	α-helix	trans	-66	-44.6	175.2	-168.9	-108.3	0	0	0	112	L868 G869 T874 I875 I876	L868-F872 VanDerWaalsContact O-CB 3.32Å; L868-F872 WeakPolarHBondContact O-CB 3.44Å; L868-F872 PolarHBondContact O-N 3.04Å; G869-F872 PolarHBondContact O-N 3.29Å; F872-T874 VanDerWaalsContact C-N 3.34Å; F872-T874 PolarHBondContact O-N 2.69Å; F872-I875 PolarHBondContact O-N 2.7Å; F872-I876 HydrophobicContact CD1-CD1 3.7Å; F872-I876 HydrophobicContact CE1-CD1 3.36Å; F872-I876 HydrophobicContact CE1-CG1 4.44Å; F872-I876 HydrophobicContact CG-CD1 4.45Å; F872-I876 HydrophobicContact CZ-CD1 3.85Å; F872-I876 WeakPolarHBondContact O-CB 3.22Å; F872-I876 WeakPolarHBondContact O-CG1 3.48Å; F872-I876 PolarHBondContact O-N 2.84Å
873	V	92.4	Very high	88.7	Confident	86 Å²	86	91.4 Å²	91.4	52%	0.521	50%	0.498	S	S	.	.	H	α-helix	trans	-63.9	-37.7	175.3	169.9	0	0	0	0	111.7	G869 V870 I876 C877	G869-V873 WeakPolarHBondContact O-CB 3.24Å; G869-V873 VanDerWaalsContact O-CG2 3.3Å; G869-V873 WeakPolarHBondContact O-CG2 3.49Å; G869-V873 PolarHBondContact O-N 3.12Å; V870-V873 PolarHBondContact O-N 3.13Å; V873-I876 PolarHBondContact O-N 3.15Å; V873-C877 WeakPolarHBondContact O-CB 3.43Å; V873-C877 PolarHBondContact O-N 2.79Å; V873-C877 PolarHBondContact O-SG 3.13Å
874	T	90.8	Very high	87.7	Confident	67 Å²	67	98.1 Å²	98.1	41%	0.411	51%	0.511	S	S	.	.	H	α-helix	trans	-72.9	-37.3	176.4	49.4	0	0	0	0	112.3	V870 L871 F872 C877 C878	V870-T874 HydrophobicContact CG1-CG2 4.4Å; V870-T874 WeakPolarHBondContact O-CB 3.09Å; V870-T874 WeakPolarHBondContact O-CG2 3.08Å; V870-T874 PolarHBondContact O-N 3.35Å; V870-T874 PolarHBondContact O-OG1 2.91Å; L871-T874 WeakPolarHBondContact CA-OG1 3.43Å; L871-T874 PolarHBondContact O-N 2.88Å; L871-T874 PolarHBondContact O-OG1 2.83Å; F872-T874 VanDerWaalsContact C-N 3.34Å; F872-T874 PolarHBondContact O-N 2.69Å; T874-C877 PolarHBondContact O-N 3.33Å; T874-C878 WeakPolarHBondContact O-CB 3.4Å; T874-C878 PolarHBondContact O-N 2.7Å; T874-C878 PolarHBondContact O-SG 3.14Å
875	I	90.5	Very high	86.3	Confident	95 Å²	95	98.4 Å²	98.4	49%	0.487	52%	0.518	S	S	.	.	H	α-helix	trans	-60.6	-47.5	169.4	-74.2	171.6	0	0	0	110.4	L871 F872 C877 C878 F879	L871-I875 HydrophobicContact CD2-CD1 3.41Å; L871-I875 VanDerWaalsContact CD2-CD1 3.41Å; L871-I875 HydrophobicContact CD2-CG1 3.96Å; L871-I875 WeakPolarHBondContact O-CB 3.16Å; L871-I875 WeakPolarHBondContact O-CG1 3.49Å; L871-I875 PolarHBondContact O-N 2.67Å; F872-I875 PolarHBondContact O-N 2.7Å; I875-C877 PolarHBondContact O-N 2.76Å; I875-C878 CarbonylContact O-C 3.56Å; I875-C878 PolarHBondContact O-N 2.73Å; I875-C878 VanDerWaalsContact O-N 3.15Å; I875-F879 WeakPolarHBondContact O-CB 3Å; I875-F879 PolarHBondContact O-N 3.37Å
876	I	90.4	Very high	84.6	Confident	74 Å²	74	103.1 Å²	103.1	38%	0.379	53%	0.528	S	S	.	.	H	α-helix	trans	-60	-45.6	175.9	-74.7	174.4	0	0	0	110.7	F872 V873 C878 F879 I880	F872-I876 HydrophobicContact CD1-CD1 3.7Å; F872-I876 HydrophobicContact CE1-CD1 3.36Å; F872-I876 HydrophobicContact CE1-CG1 4.44Å; F872-I876 HydrophobicContact CG-CD1 4.45Å; F872-I876 HydrophobicContact CZ-CD1 3.85Å; F872-I876 WeakPolarHBondContact O-CB 3.22Å; F872-I876 WeakPolarHBondContact O-CG1 3.48Å; F872-I876 PolarHBondContact O-N 2.84Å; V873-I876 PolarHBondContact O-N 3.15Å; I876-C878 VanDerWaalsContact C-N 3.32Å; I876-C878 PolarHBondContact O-N 2.74Å; I876-F879 PolarHBondContact O-N 2.93Å; I876-I880 HydrophobicContact CG2-CD1 3.61Å; I876-I880 HydrophobicContact CG2-CG1 4.32Å; I876-I880 WeakPolarHBondContact O-CB 3.18Å; I876-I880 VanDerWaalsContact O-CG1 3.23Å; I876-I880 WeakPolarHBondContact O-CG1 3.27Å; I876-I880 PolarHBondContact O-N 2.82Å
877	C	88.9	Confident	82.5	Confident	65 Å²	65	102.7 Å²	102.7	44%	0.439	53%	0.53	S	S	.	.	H	α-helix	trans	-60.8	-38.9	174.9	-72.9	0	0	0	0	112.6	V873 T874 I875 R881	V873-C877 WeakPolarHBondContact O-CB 3.43Å; V873-C877 PolarHBondContact O-N 2.79Å; V873-C877 PolarHBondContact O-SG 3.13Å; T874-C877 PolarHBondContact O-N 3.33Å; I875-C877 PolarHBondContact O-N 2.76Å; C877-R881 WeakPolarHBondContact O-CB 3.05Å; C877-R881 WeakPolarHBondContact O-CG 3.43Å; C877-R881 PolarHBondContact O-N 2.74Å
878	C	87.7	Confident	80.1	Confident	82 Å²	82	102.1 Å²	102.1	55%	0.554	53%	0.531	S	S	*	.	H	α-helix	trans	-69.6	-38.3	175.7	-71.4	0	0	0	0	111.9	T874 I875 I876 R881 Y882	T874-C878 WeakPolarHBondContact O-CB 3.4Å; T874-C878 PolarHBondContact O-N 2.7Å; T874-C878 PolarHBondContact O-SG 3.14Å; I875-C878 CarbonylContact O-C 3.56Å; I875-C878 PolarHBondContact O-N 2.73Å; I875-C878 VanDerWaalsContact O-N 3.15Å; I876-C878 VanDerWaalsContact C-N 3.32Å; I876-C878 PolarHBondContact O-N 2.74Å; C878-R881 CarbonylContact O-C 3.53Å; C878-R881 PolarHBondContact O-N 3Å; C878-Y882 VanDerWaalsContact O-CB 3.26Å; C878-Y882 WeakPolarHBondContact O-CB 3.46Å; C878-Y882 PolarHBondContact O-N 2.67Å
879	F	85.8	Confident	77.6	Confident	137 Å²	137	105.4 Å²	105.4	60%	0.601	55%	0.549	S	S	*	.	H	α-helix	trans	-70	-40.6	176.6	-156.3	-89	0	0	0	111.2	I875 I876 Y882 T883	I875-F879 WeakPolarHBondContact O-CB 3Å; I875-F879 PolarHBondContact O-N 3.37Å; I876-F879 PolarHBondContact O-N 2.93Å; F879-Y882 PolarHBondContact O-N 3.45Å; F879-T883 HydrophobicContact CD1-CG2 3.91Å; F879-T883 HydrophobicContact CE1-CG2 3.79Å; F879-T883 WeakPolarHBondContact O-CB 2.89Å; F879-T883 WeakPolarHBondContact O-CG2 3.27Å; F879-T883 PolarHBondContact O-N 3.27Å; F879-T883 PolarHBondContact O-OG1 3.48Å
880	I	84.5	Confident	75.5	Confident	71 Å²	71	108.7 Å²	108.7	36%	0.364	57%	0.566	S	S	.	*	H	α-helix	trans	-62.5	-41.2	170.3	-68.7	169	0	0	0	110.7	I876 T883 R884	I876-I880 HydrophobicContact CG2-CD1 3.61Å; I876-I880 HydrophobicContact CG2-CG1 4.32Å; I876-I880 WeakPolarHBondContact O-CB 3.18Å; I876-I880 VanDerWaalsContact O-CG1 3.23Å; I876-I880 WeakPolarHBondContact O-CG1 3.27Å; I876-I880 PolarHBondContact O-N 2.82Å; I880-T883 WeakPolarHBondContact CA-OG1 3.42Å; I880-T883 PolarHBondContact O-OG1 3.05Å; I880-T883 VanDerWaalsContact O-OG1 3.1Å; I880-R884 VanDerWaalsContact O-CB 3.25Å; I880-R884 WeakPolarHBondContact O-CB 3.08Å; I880-R884 WeakPolarHBondContact O-CD 3.4Å; I880-R884 WeakPolarHBondContact O-CG 3.43Å; I880-R884 PolarHBondContact O-N 2.8Å
881	R	82	Confident	72.7	Confident	185 Å²	185	113.3 Å²	113.3	70%	0.698	58%	0.579	S	S	*	*	H	α-helix	trans	-67.6	-41.7	173.8	-81.1	-174.7	173.9	-169.4	-0.6	112.4	C877 C878 R884 L885	C877-R881 WeakPolarHBondContact O-CB 3.05Å; C877-R881 WeakPolarHBondContact O-CG 3.43Å; C877-R881 PolarHBondContact O-N 2.74Å; C878-R881 CarbonylContact O-C 3.53Å; C878-R881 PolarHBondContact O-N 3Å; R881-R884 PolarHBondContact O-N 3.49Å; R881-L885 VanDerWaalsContact O-CB 3.31Å; R881-L885 WeakPolarHBondContact O-CB 3.21Å; R881-L885 PolarHBondContact O-N 3.21Å
882	Y	77.3	Confident	70	Confident	132 Å²	132	115.9 Å²	115.9	52%	0.518	60%	0.598	S	S	.	*	H	α-helix	trans	-65.5	-46.3	179.2	-178.1	-97.3	0	0	0	111.6	C878 F879 R884 L885 K886	C878-Y882 VanDerWaalsContact O-CB 3.26Å; C878-Y882 WeakPolarHBondContact O-CB 3.46Å; C878-Y882 PolarHBondContact O-N 2.67Å; F879-Y882 PolarHBondContact O-N 3.45Å; Y882-R884 VanDerWaalsContact C-N 3.34Å; Y882-R884 PolarHBondContact O-N 2.69Å; Y882-L885 PolarHBondContact O-N 2.71Å; Y882-K886 HydrophobicContact CE1-CD 3.85Å; Y882-K886 VanDerWaalsContact O-CB 3.3Å; Y882-K886 WeakPolarHBondContact O-CB 3.22Å; Y882-K886 PolarHBondContact O-N 3.37Å; Y882-K886 PolarHBondContact OH-NZ 2.95Å
883	T	74.7	Confident	67.2	Low	67 Å²	67	118.8 Å²	118.8	41%	0.411	61%	0.606	S	S	.	*	H	α-helix	trans	-63.7	-37.9	174.3	50.1	0	0	0	0	112	F879 I880 G887	F879-T883 HydrophobicContact CD1-CG2 3.91Å; F879-T883 HydrophobicContact CE1-CG2 3.79Å; F879-T883 WeakPolarHBondContact O-CB 2.89Å; F879-T883 WeakPolarHBondContact O-CG2 3.27Å; F879-T883 PolarHBondContact O-N 3.27Å; F879-T883 PolarHBondContact O-OG1 3.48Å; I880-T883 WeakPolarHBondContact CA-OG1 3.42Å; I880-T883 PolarHBondContact O-OG1 3.05Å; I880-T883 VanDerWaalsContact O-OG1 3.1Å; T883-G887 PolarHBondContact O-N 3.43Å
884	R	67.2	Low	64.6	Low	180 Å²	180	123.8 Å²	123.8	68%	0.679	62%	0.617	S	S	*	*	H	α-helix	trans	-67.4	-43.2	172.6	-73.5	174.4	-177.4	-170.3	2.5	112.8	I880 R881 Y882 G887 T888	I880-R884 VanDerWaalsContact O-CB 3.25Å; I880-R884 WeakPolarHBondContact O-CB 3.08Å; I880-R884 WeakPolarHBondContact O-CD 3.4Å; I880-R884 WeakPolarHBondContact O-CG 3.43Å; I880-R884 PolarHBondContact O-N 2.8Å; R881-R884 PolarHBondContact O-N 3.49Å; Y882-R884 VanDerWaalsContact C-N 3.34Å; Y882-R884 PolarHBondContact O-N 2.69Å; R884-G887 PolarHBondContact O-N 3.29Å; R884-T888 PolarHBondContact O-N 2.73Å; R884-T888 PolarHBondContact O-OG1 2.67Å; R884-T888 VanDerWaalsContact O-OG1 3.09Å
885	L	60.7	Low	61.9	Low	141 Å²	141	130.1 Å²	130.1	74%	0.738	64%	0.639	S	S	*	*	H	α-helix	trans	-68.7	-35	178.5	-93	146.6	0	0	0	113.2	R881 Y882	R881-L885 VanDerWaalsContact O-CB 3.31Å; R881-L885 WeakPolarHBondContact O-CB 3.21Å; R881-L885 PolarHBondContact O-N 3.21Å; Y882-L885 PolarHBondContact O-N 2.71Å
886	K	54.3	Low	59.3	Low	155 Å²	155	131.7 Å²	131.7	67%	0.674	66%	0.658	S	S	*	*	H	α-helix	trans	-82.9	-17.6	176.7	-153.2	173.3	-171.4	177.7	0	112.8	Y882	Y882-K886 HydrophobicContact CE1-CD 3.85Å; Y882-K886 VanDerWaalsContact O-CB 3.3Å; Y882-K886 WeakPolarHBondContact O-CB 3.22Å; Y882-K886 PolarHBondContact O-N 3.37Å; Y882-K886 PolarHBondContact OH-NZ 2.95Å
887	G	47.5	Very low	56.5	Low	52 Å²	52	136.2 Å²	136.2	54%	0.536	68%	0.675	S	S	.	*	H	α-helix	trans	-92.2	-8.5	-178.6	0	0	0	0	0	116.3	T883 R884	T883-G887 PolarHBondContact O-N 3.43Å; R884-G887 PolarHBondContact O-N 3.29Å
888	T	44.1	Very low	53.7	Low	99 Å²	99	141 Å²	141	61%	0.607	69%	0.691	S	S	*	*			trans	-124.6	57.8	-174.2	59.5	0	0	0	0	114.5	R884	R884-T888 PolarHBondContact O-N 2.73Å; R884-T888 PolarHBondContact O-OG1 2.67Å; R884-T888 VanDerWaalsContact O-OG1 3.09Å
889	N	40.4	Very low	51.5	Low	178 Å²	178	145.5 Å²	145.5	95%	0.952	70%	0.704	S	S	*	*	S	Bend	trans	-107.4	35.4	146.5	-103.8	-16.1	0	0	0	111
890	S	47.3	Very low	48.8	Very low	104 Å²	104	144.6 Å²	144.6	73%	0.727	71%	0.705	S	S	*	*	S	Bend	trans	-140.1	135.8	161.9	-170.7	0	0	0	0	108.1
891	K	34.8	Very low	46.6	Very low	191 Å²	191	148.7 Å²	148.7	83%	0.83	73%	0.728	S	S	*	*			trans	-101.6	136	-155.6	-69.3	172.6	178.8	172.3	0	113
892	V	35.5	Very low	44.2	Very low	136 Å²	136	145.7 Å²	145.7	82%	0.824	73%	0.725	S	S	*	*			trans	36.5	89.1	133	-170.2	0	0	0	0	116.2
893	Y	34.1	Very low	42.1	Very low	198 Å²	198	146.7 Å²	146.7	78%	0.776	74%	0.735	S	S	*	*			trans	-162.9	141.2	141.5	-128.4	-137.8	0	0	0	112
894	Y	38	Very low	40	Very low	190 Å²	190	150.7 Å²	150.7	75%	0.745	75%	0.753	S	S	*	*			trans	67.1	63.1	159.9	-80.4	-120.3	0	0	0	119.2	S896	Y894-S896 PolarHBondContact O-N 3.23Å
895	K	35	Very low	38.5	Very low	200 Å²	200	148 Å²	148	87%	0.87	75%	0.752	S	S	*	*				35.6	89	117.1	-160.9	170.4	-173.6	175.7	0	115.9	K897	K895-K897 PolarHBondContact O-N 2.82Å
896	S	35.4	Very low	37.5	Very low	128 Å²	128	148.9 Å²	148.9	90%	0.895	75%	0.753	S	S	*	*			trans	-46.8	104	176.9	54.7	0	0	0	0	114.5	Y894	Y894-S896 PolarHBondContact O-N 3.23Å
897	K	31.3	Very low	36.6	Very low	169 Å²	169	149 Å²	149	74%	0.735	76%	0.756	S	S	*	*			trans	-136.8	106.7	165.9	-176.9	177.3	-179.5	-175	0	105.2	K895 E899	K895-K897 PolarHBondContact O-N 2.82Å; K897-E899 PolarHBondContact O-N 3.49Å
898	Q	30.4	Very low	35.9	Very low	165 Å²	165	151.3 Å²	151.3	77%	0.771	76%	0.756	S	S	*	*				67.1	48.1	95.8	-145.5	177.1	19.4	0	0	113.5
899	E	40.8	Very low	35.4	Very low	178 Å²	178	154 Å²	154	83%	0.832	76%	0.759	S	S	*	*			trans	-118.3	114.1	150.5	-71.3	176.7	151.4	0	0	104.2	K897	K897-E899 PolarHBondContact O-N 3.49Å
900	N	29.8	Very low	35	Very low	118 Å²	118	152.1 Å²	152.1	63%	0.631	75%	0.745	S	S	*	*			cis	56	89.1	45.4	-71.9	-4.9	0	0	0	113.2
901	N	38.3	Very low	34.2	Very low	156 Å²	156	154.3 Å²	154.3	83%	0.834	75%	0.746	S	S	*	*			trans	-161.2	90	146.5	-83.1	-38.6	0	0	0	105.1
902	L	31.7	Very low	34.1	Very low	123 Å²	123	149.2 Å²	149.2	64%	0.644	74%	0.735	S	S	*	*			cis	59.5	124.9	40.1	-150.3	88.3	0	0	0	109.7
903	Q	33.6	Very low	33.8	Very low	153 Å²	153	150 Å²	150	72%	0.715	74%	0.735	S	S	*	*			cis	-157.5	151.3	-9.6	-117.5	165.4	-37.1	0	0	104.9
904	N	30.6	Very low	33.6	Very low	150 Å²	150	143.7 Å²	143.7	80%	0.802	73%	0.73	S	S	*	*			trans	177	137.6	147.3	-93.6	-14.2	0	0	0	111.9
905	N	35.5	Very low	33.2	Very low	123 Å²	123	141 Å²	141	66%	0.658	73%	0.733	S	S	*	*			trans	63.5	124.5	149.3	-60.6	26.6	0	0	0	119.1
906	E	38.4	Very low	33	Very low	160 Å²	160	139.3 Å²	139.3	75%	0.748	73%	0.728	S	S	*	*	S	Bend	cis	-154	148	-2.5	-89.3	136.1	-136.5	0	0	105.2
907	E	36.1	Very low	32.7	Very low	159 Å²	159	139 Å²	139	74%	0.743	72%	0.716	S	S	*	*			cis	-167.6	155.1	-8.7	-106.2	-117	143.9	0	0	106
908	N	32.8	Very low	32.8	Very low	100 Å²	100	138.8 Å²	138.8	54%	0.535	72%	0.717	S	S	.	*			cis	-159.8	174.6	-1.1	-153	-11	0	0	0	112.1
909	K	32.7	Very low	32.9	Very low	154 Å²	154	135.4 Å²	135.4	67%	0.67	71%	0.712	S	S	*	*			trans	29.6	139.3	140.1	-90.6	168.5	153.7	167.5	0	122
910	Q	33.5	Very low	32.5	Very low	140 Å²	140	133.5 Å²	133.5	65%	0.654	71%	0.706	S	S	*	*			cis	-177.8	135	-2.4	-122.8	-178.5	-25.9	0	0	106.8
911	I	30.8	Very low	32.7	Very low	149 Å²	149	134 Å²	134	76%	0.764	71%	0.708	S	S	*	*				80.8	157.1	112.3	-72.3	-179.6	0	0	0	116.9
912	S	32.4	Very low	32.7	Very low	85 Å²	85	134.6 Å²	134.6	59%	0.594	70%	0.703	S	S	*	*			trans	-91.3	178.7	-156.6	53.5	0	0	0	0	116.6
913	D	29.6	Very low	32.8	Very low	152 Å²	152	134 Å²	134	81%	0.813	70%	0.701	S	S	*	*			trans	77.6	152	154.7	-51.9	-48.7	0	0	0	119.1
914	G	29.5	Very low	32.6	Very low	66 Å²	66	134.6 Å²	134.6	68%	0.68	70%	0.701	S	S	*	*			trans	82.5	119.7	178.9	0	0	0	0	0	112.4
915	V	29.8	Very low	32.5	Very low	132 Å²	132	134.6 Å²	134.6	80%	0.8	70%	0.7	S	S	*	*				61.6	117.7	53.5	-172.4	0	0	0	0	112.4
916	E	30	Very low	32	Very low	166 Å²	166	135.5 Å²	135.5	78%	0.776	71%	0.705	S	S	*	*			trans	82.5	135.2	158.3	-85.3	-176.6	124.5	0	0	123.4
917	L	29.1	Very low	31.5	Very low	121 Å²	121	136.8 Å²	136.8	63%	0.634	71%	0.711	S	S	*	*			trans	75.3	104	140	-70.9	163.6	0	0	0	121.6
918	Q	33.1	Very low	31.1	Very low	164 Å²	164	136 Å²	136	77%	0.766	72%	0.717	S	S	*	*				62.7	105.2	125.8	-76.7	-179.4	5.2	0	0	118.5
919	S	33	Very low	30.8	Very low	94 Å²	94	134.6 Å²	134.6	66%	0.657	73%	0.727	S	S	*	*				107.2	136.7	90.5	76.8	0	0	0	0	109.7
920	I	32.2	Very low	30.4	Very low	138 Å²	138	135.4 Å²	135.4	71%	0.708	74%	0.737	S	S	*	*				-174.4	127.5	70.6	-109.2	160.4	0	0	0	107.2
921	L	33.3	Very low	30.1	Very low	130 Å²	130	133.2 Å²	133.2	68%	0.681	74%	0.738	S	S	*	*			trans	52.9	134	130.3	-64.4	172.3	0	0	0	119.5
922	K	38	Very low	29.8	Very low	167 Å²	167	135.8 Å²	135.8	73%	0.726	74%	0.743	S	S	*	*			cis	-162.9	161.9	22.8	-96.2	145.8	177.3	-175.6	0	107.3
923	N	34	Very low	29.8	Very low	110 Å²	110	135.7 Å²	135.7	59%	0.588	75%	0.748	S	S	*	*			cis	-171	162.4	-1.5	-106	-4.6	0	0	0	105.5
924	K	30.7	Very low	29.7	Very low	167 Å²	167	136.1 Å²	136.1	73%	0.726	75%	0.75	S	S	*	*			cis	-167.8	148.2	-5.2	-117.4	172.7	177.6	-168.6	0	104.6
925	L	27.9	Very low	29.9	Very low	150 Å²	150	138.2 Å²	138.2	79%	0.785	75%	0.752	S	S	*	*			cis	-155.7	142.4	-6.2	-164.4	85.6	0	0	0	106.6
926	N	25.5	Very low	29.9	Very low	142 Å²	142	138.5 Å²	138.5	76%	0.759	75%	0.748	S	S	*	*			trans	-64.4	166.7	158	-72.1	-28.7	0	0	0	108.7
927	Q	27.4	Very low	29.9	Very low	186 Å²	186	138.1 Å²	138.1	87%	0.869	75%	0.746	S	S	*	*				-169.4	140	58.6	-79.7	176.8	-33.1	0	0	112
928	T	27.1	Very low	29.9	Very low	142 Å²	142	139 Å²	139	87%	0.871	75%	0.751	S	S	*	*			trans	-68.7	139.2	148	48.3	0	0	0	0	110.8
929	G	26.8	Very low	29.5	Very low	72 Å²	72	136.5 Å²	136.5	74%	0.742	75%	0.747	S	S	*	*			trans	171.9	74.3	175.5	0	0	0	0	0	112.8
930	L	24.7	Very low	29.3	Very low	170 Å²	170	138 Å²	138	89%	0.89	75%	0.752	S	S	*	*				70.2	92.8	98.3	-161.3	90.9	0	0	0	114.6
931	S	26.3	Very low	29	Very low	95 Å²	95	138.6 Å²	138.6	66%	0.664	76%	0.756	S	S	*	*				153.4	139.1	116.5	65.7	0	0	0	0	112.5
932	K	26.5	Very low	28.7	Very low	202 Å²	202	137.8 Å²	137.8	88%	0.878	76%	0.757	S	S	*	*			trans	55.5	137.1	151.3	-62.4	167	-177.8	178	0	118.8
933	A	30.9	Very low	28.5	Very low	84 Å²	84	136.3 Å²	136.3	69%	0.694	76%	0.757	S	S	*	*			cis	-165.1	144	-12.4	0	0	0	0	0	109
934	N	28.7	Very low	28.2	Very low	160 Å²	160	138 Å²	138	86%	0.856	77%	0.765	S	S	*	*			trans	62	154.2	150.4	-80.2	13.2	0	0	0	121.3
935	P	32.3	Very low	28.1	Very low	110 Å²	110	138.3 Å²	138.3	71%	0.714	77%	0.769	S	S	*	*			trans	-90.7	179.3	-175.8	40.4	-37.2	0	0	0	111.1
936	I	29.9	Very low	28	Very low	139 Å²	139	135.6 Å²	135.6	71%	0.713	76%	0.762	S	S	*	*			trans	175.1	126.2	142.9	-95.2	155	0	0	0	107.9
937	E	30.6	Very low	28	Very low	158 Å²	158	139.4 Å²	139.4	74%	0.738	77%	0.767	S	S	*	*				42.2	146.1	129.2	-52.2	161.6	-173.5	0	0	119.2
938	D	28.2	Very low	28.1	Very low	139 Å²	139	135.9 Å²	135.9	74%	0.743	76%	0.761	S	S	*	*			cis	-162.6	170.6	-2.6	-119.8	-13.5	0	0	0	112.4
939	V	26.2	Very low	28.1	Very low	112 Å²	112	135.1 Å²	135.1	68%	0.679	76%	0.756	S	S	*	*			trans	-13.3	128.3	153.6	-151.1	0	0	0	0	115.8
940	T	29.1	Very low	28.1	Very low	126 Å²	126	139.7 Å²	139.7	77%	0.773	76%	0.758	S	S	*	*				177.6	128	92	31.4	0	0	0	0	108.4
941	L	24.9	Very low	28.4	Very low	150 Å²	150	139.1 Å²	139.1	79%	0.785	76%	0.756	S	S	*	*				53.2	100	81.3	-139.9	92.1	0	0	0	114.7
942	T	27.7	Very low	28.4	Very low	113 Å²	113	140.5 Å²	140.5	69%	0.693	76%	0.76	S	S	*	*				158.8	154	116.3	44.5	0	0	0	0	114.7
943	N	32.7	Very low	28.7	Very low	136 Å²	136	141.1 Å²	141.1	73%	0.727	76%	0.758	S	S	*	*			trans	74	101	155.4	-59.3	-14.1	0	0	0	121
944	N	28.6	Very low	28.4	Very low	144 Å²	144	146.8 Å²	146.8	77%	0.77	77%	0.767	S	S	*	*				25.5	114.4	111.3	-64.2	5.9	0	0	0	117.7
945	E	29	Very low	28.5	Very low	174 Å²	174	143.3 Å²	143.3	81%	0.813	76%	0.755	S	S	*	*				178	123.5	95.3	-108.1	162	-147.2	0	0	114.2
946	C	24.4	Very low	28.4	Very low	94 Å²	94	144.8 Å²	144.8	64%	0.635	76%	0.757	S	S	*	*			trans	56.5	116.9	132.2	-70.9	0	0	0	0	124.7
947	Y	26.8	Very low	28.4	Very low	221 Å²	221	144 Å²	144	87%	0.867	76%	0.758	S	S	*	*			trans	103.3	145.6	138.1	-63.3	-53.9	0	0	0	121.1
948	P	29.5	Very low	28.5	Very low	112 Å²	112	144.3 Å²	144.3	73%	0.727	77%	0.765	S	S	*	*			trans	-126	160.6	-155.2	41.6	-25.7	0	0	0	114.5
949	V	27.2	Very low	28.6	Very low	127 Å²	127	144.5 Å²	144.5	77%	0.77	77%	0.766	S	S	*	*			trans	-144.8	129.8	153	170	0	0	0	0	110.4
950	Q	26.3	Very low	28.9	Very low	167 Å²	167	145.7 Å²	145.7	78%	0.78	77%	0.774	S	S	*	*			trans	12	137	150.6	-57	161.6	-26.6	0	0	119.4
951	N	30.1	Very low	29	Very low	158 Å²	158	143.4 Å²	143.4	85%	0.845	78%	0.776	S	S	*	*				-154	130.2	111.3	-102.1	-35	0	0	0	113.5
952	V	27.5	Very low	29.1	Very low	124 Å²	124	144.2 Å²	144.2	75%	0.752	78%	0.779	S	S	*	*			trans	-86.1	130.4	169.4	170.6	0	0	0	0	108.1
953	Y	31.2	Very low	29.3	Very low	216 Å²	216	142.4 Å²	142.4	85%	0.847	78%	0.783	S	S	*	*			trans	-148.7	123.6	152	-103.4	-77.1	0	0	0	110.4
954	K	26	Very low	29.1	Very low	203 Å²	203	145 Å²	145	88%	0.883	79%	0.788	S	S	*	*			trans	-141	103.1	178.5	-173.3	-177.8	-176.9	-177.6	0	109.5
955	S	29.6	Very low	29.1	Very low	86 Å²	86	143.9 Å²	143.9	60%	0.601	79%	0.79	S	S	*	*			trans	175.4	137.2	176.7	51.1	0	0	0	0	106.2
956	N	31	Very low	29.2	Very low	142 Å²	142	141.8 Å²	141.8	76%	0.759	79%	0.789	S	S	*	*			cis	-145.5	148.5	3.5	-85.1	-24.7	0	0	0	107.5
957	V	30.4	Very low	29.4	Very low	122 Å²	122	141.6 Å²	141.6	74%	0.739	79%	0.789	S	S	*	*				40.2	109.3	107.9	-167.7	0	0	0	0	114.4
958	D	32.6	Very low	29.6	Very low	164 Å²	164	139 Å²	139	88%	0.877	78%	0.784	S	S	*	*				-157.8	156	120.2	-106	-20.4	0	0	0	111.6
959	D	30.4	Very low	29.7	Very low	143 Å²	143	141.1 Å²	141.1	77%	0.765	79%	0.79	S	S	*	*			trans	-110.8	-178.2	-155.2	-149.5	-21.3	0	0	0	112.8
960	T	31.9	Very low	29.8	Very low	137 Å²	137	143.5 Å²	143.5	84%	0.84	80%	0.797	S	S	*	*			trans	81.1	133.5	166.6	74.2	0	0	0	0	119.8
961	G	31.1	Very low	29.9	Very low	79 Å²	79	139.4 Å²	139.4	81%	0.814	80%	0.8	S	S	*	*			trans	165.3	16.8	173.3	0	0	0	0	0	118.3
962	I	28	Very low	29.7	Very low	166 Å²	166	137 Å²	137	85%	0.851	80%	0.796	S	S	*	*			trans	-75.6	127.4	179.1	-64.7	174.4	0	0	0	110.9
963	G	31.9	Very low	29.8	Very low	76 Å²	76	139.1 Å²	139.1	78%	0.784	80%	0.801	S	S	*	*			trans	-140.3	100	170.1	0	0	0	0	0	112.1
964	K	27.4	Very low	29.6	Very low	191 Å²	191	135 Å²	135	83%	0.83	79%	0.793	S	S	*	*			trans	-83.6	149.3	171.3	-68	176.4	175.5	177.3	0	110.8
965	C	29.3	Very low	29.6	Very low	119 Å²	119	133.1 Å²	133.1	80%	0.804	79%	0.785	S	S	*	*			trans	172.9	150.2	146.3	-92.1	0	0	0	0	108.3
966	T	30.7	Very low	29.7	Very low	131 Å²	131	139.3 Å²	139.3	80%	0.804	80%	0.797	S	S	*	*			cis	-165	172.3	-29.4	23.6	0	0	0	0	107.2
967	S	28.3	Very low	29.5	Very low	90 Å²	90	137 Å²	137	63%	0.629	79%	0.788	S	S	*	*			trans	-77.2	179.8	-177	50.2	0	0	0	0	115.7
968	H	30.4	Very low	29.4	Very low	165 Å²	165	137.9 Å²	137.9	76%	0.764	79%	0.789	S	S	*	*			trans	84.9	136.6	176.8	-51.6	-81.1	0	0	0	114
969	D	33.4	Very low	29.4	Very low	158 Å²	158	138.2 Å²	138.2	85%	0.845	79%	0.79	S	S	*	*			cis	-127.5	157.3	28.7	-83	-50.7	0	0	0	117.4
970	L	27.5	Very low	29.3	Very low	176 Å²	176	138.3 Å²	138.3	92%	0.921	79%	0.789	S	S	*	*			trans	-92.6	141	165.1	-127.1	79.8	0	0	0	109.3
971	G	29.1	Very low	29.2	Very low	81 Å²	81	139.7 Å²	139.7	84%	0.835	79%	0.792	S	S	*	*			trans	-162.2	90.4	179.8	0	0	0	0	0	115.4
972	S	26.3	Very low	28.9	Very low	109 Å²	109	143.2 Å²	143.2	76%	0.762	79%	0.791	S	S	*	*			trans	-69.3	157.9	171.6	54.4	0	0	0	0	114.1
973	I	30.3	Very low	29.1	Very low	168 Å²	168	140.3 Å²	140.3	86%	0.862	79%	0.786	S	S	*	*			trans	-168	148.1	134.6	-97.7	147	0	0	0	111
974	N	26.4	Very low	29	Very low	128 Å²	128	143 Å²	143	68%	0.684	79%	0.787	S	S	*	*			trans	-106.4	174.7	-169.2	-75	-34.2	0	0	0	114.7
975	F	26	Very low	29	Very low	164 Å²	164	141.4 Å²	141.4	72%	0.719	79%	0.788	S	S	*	*			trans	84.7	124.3	150	-67.3	-65.2	0	0	0	120.7	T977	F975-T977 HydrophobicContact CD1-CG2 4.4Å
976	Y	30.5	Very low	28.8	Very low	217 Å²	217	144 Å²	144	85%	0.851	79%	0.793	S	S	*	*				176.4	92.2	107.1	-90.7	-72.9	0	0	0	107.2
977	T	27.8	Very low	28.7	Very low	93 Å²	93	145.9 Å²	145.9	57%	0.571	80%	0.796	S	S	*	*				54.8	121.2	96.7	63.8	0	0	0	0	117.4	F975	F975-T977 HydrophobicContact CD1-CG2 4.4Å
978	N	28	Very low	28.7	Very low	141 Å²	141	150.8 Å²	150.8	75%	0.754	81%	0.809	S	S	*	*			trans	67.6	114.7	152.4	-55.3	-0.2	0	0	0	118.7
979	D	32.9	Very low	28.6	Very low	170 Å²	170	151.1 Å²	151.1	91%	0.909	81%	0.811	S	S	*	*				-149.4	155.8	97.9	-100.9	-28.9	0	0	0	111.4
980	I	27.9	Very low	28.3	Very low	145 Å²	145	149.9 Å²	149.9	74%	0.744	80%	0.804	S	S	*	*			trans	-102.1	136.2	-174	-65.1	162.5	0	0	0	108.5
981	D	30	Very low	28.3	Very low	166 Å²	166	152.9 Å²	152.9	89%	0.888	81%	0.805	S	S	*	*			trans	-147.2	155.2	143.9	-134.5	-23.4	0	0	0	113.3
982	L	25.2	Very low	28.2	Very low	153 Å²	153	156.7 Å²	156.7	80%	0.801	81%	0.805	S	S	*	*			trans	-118.5	114.6	-149	-157.4	89.4	0	0	0	112.7
983	S	31	Very low	28.3	Very low	106 Å²	106	159.1 Å²	159.1	74%	0.741	81%	0.81	S	S	*	*			trans	-155.6	101.7	162.4	58.1	0	0	0	0	115.3
984	T	29.8	Very low	28.1	Very low	132 Å²	132	158 Å²	158	81%	0.81	80%	0.795	S	S	*	*			trans	60.4	92.7	137.9	55.8	0	0	0	0	121.3
985	N	27.9	Very low	28.2	Very low	157 Å²	157	159 Å²	159	84%	0.84	80%	0.799	S	S	*	*			trans	-12.5	130	138.9	-53.2	-22.1	0	0	0	118
986	L	26.4	Very low	28.2	Very low	175 Å²	175	155.8 Å²	155.8	92%	0.916	80%	0.798	S	S	*	*				174.6	67.3	127.8	-103.4	151.8	0	0	0	112.4
987	I	28.4	Very low	27.9	Very low	170 Å²	170	150.7 Å²	150.7	87%	0.872	79%	0.792	S	S	*	*			trans	-142.1	91.7	165.7	-51.8	178.9	0	0	0	110.3
988	E	27.3	Very low	28	Very low	192 Å²	192	151.9 Å²	151.9	90%	0.897	80%	0.8	S	S	*	*			trans	-146.3	98.6	151.1	-98.6	-167.7	161.5	0	0	107.6
989	E	28.8	Very low	28	Very low	172 Å²	172	155.3 Å²	155.3	80%	0.804	80%	0.804	S	S	*	*	S	Bend	trans	-179.6	141	143.5	-106.7	-180	-155.4	0	0	111.4
990	N	27.2	Very low	27.8	Very low	132 Å²	132	152.6 Å²	152.6	71%	0.706	80%	0.795	S	S	*	*			trans	68.8	64.8	160.6	-56.8	-45.5	0	0	0	120
991	Y	27.7	Very low	28	Very low	240 Å²	240	153 Å²	153	94%	0.941	79%	0.794	S	S	*	*			trans	-144.1	53.7	150.1	-99.8	-74.8	0	0	0	112.4
992	L	26.5	Very low	28	Very low	161 Å²	161	151.2 Å²	151.2	84%	0.843	78%	0.784	S	S	*	*			trans	-155.9	84.3	174.4	-109.1	163.1	0	0	0	110.8
993	N	27.3	Very low	28.2	Very low	159 Å²	159	147.5 Å²	147.5	85%	0.85	77%	0.768	S	S	*	*	S	Bend	trans	-170.6	139.4	154.8	-94.4	-40.2	0	0	0	108.3
994	Y	27.4	Very low	28.2	Very low	144 Å²	144	146.7 Å²	146.7	57%	0.565	76%	0.759	S	S	*	*			trans	76.6	67.5	-169.1	-69.3	-85.7	0	0	0	117.2	R464	R464-Y994 PolarHBondContact NE-OH 2.76Å; R464-Y994 PolarHBondContact NH1-OH 2.84Å; R464-Y994 PolarHBondContact NH2-OH 2.94Å
995	I	28.2	Very low	28.1	Very low	149 Å²	149	142.9 Å²	142.9	76%	0.764	74%	0.738	S	S	*	*			trans	-118.9	110.4	140.5	-58.7	177.4	0	0	0	106.9	C997	I995-C997 PolarHBondContact O-N 2.66Å
996	S	26.4	Very low	28.3	Very low	98 Å²	98	143.1 Å²	143.1	69%	0.685	74%	0.738	S	S	*	*			trans	-86.1	96.7	171.5	-70.1	0	0	0	0	109.6
997	C	24.6	Very low	28.5	Very low	109 Å²	109	141.6 Å²	141.6	74%	0.736	73%	0.73	S	S	*	*			trans	-85	117.8	171.4	-65.2	0	0	0	0	110.8	I995	I995-C997 PolarHBondContact O-N 2.66Å
998	T	29.3	Very low	28.6	Very low	119 Å²	119	141.1 Å²	141.1	73%	0.73	73%	0.729	S	S	*	*			trans	-145.7	106.9	160	48.9	0	0	0	0	111.5
999	Y	28.4	Very low	28.9	Very low	213 Å²	213	138.1 Å²	138.1	84%	0.835	72%	0.719	S	S	*	*			trans	-128.2	151	151.9	-106.6	-96.4	0	0	0	107.2
1000	P	28.9	Very low	29.1	Very low	112 Å²	112	136.1 Å²	136.1	73%	0.727	71%	0.713	S	S	*	*			trans	-98.2	153	-157.3	37	-34	0	0	0	114
1001	Q	30.9	Very low	29.4	Very low	155 Å²	155	138.4 Å²	138.4	72%	0.724	72%	0.719	S	S	*	*			trans	-149.6	156.6	153.3	-78.8	-146.5	-13.5	0	0	111.6	N1120	Q1001-N1120 PolarHBondContact OE1-ND2 2.85Å; Q1001-N1120 VanDerWaalsContact OE1-ND2 3.17Å
1002	D	30.5	Very low	29.6	Very low	127 Å²	127	132.7 Å²	132.7	68%	0.679	71%	0.711	S	S	*	*			trans	-119.3	144.6	-173.3	-98.8	-47.8	0	0	0	112.3
1003	T	28.6	Very low	29.9	Very low	75 Å²	75	134 Å²	134	46%	0.46	72%	0.715	S	S	.	*			trans	78.2	121.2	142.6	55.7	0	0	0	0	124.2	D1118 L1119	T1003-D1118 VanDerWaalsContact C-CA 3.4Å; T1003-D1118 PolarHBondContact N-OD1 3.19Å; T1003-D1118 CarbonylContact O-C 3.6Å; T1003-D1118 WeakPolarHBondContact O-CA 3.42Å; T1003-L1119 CarbonylContact O-C 3.55Å; T1003-L1119 VanDerWaalsContact O-CA 3.22Å; T1003-L1119 WeakPolarHBondContact O-CA 3.17Å; T1003-L1119 PolarHBondContact O-N 3.19Å
1004	T	30.9	Very low	30	Very low	90 Å²	90	134.5 Å²	134.5	55%	0.552	72%	0.718	S	S	*	*			trans	79	83.8	139	58.7	0	0	0	0	126	D1118 L1119	T1004-D1118 VanDerWaalsContact N-CA 3.26Å; T1004-D1118 CarbonylContact O-C 3.49Å; T1004-L1119 PolarHBondContact O-N 2.91Å
1005	S	29.2	Very low	30.2	Very low	52 Å²	52	130.8 Å²	130.8	36%	0.364	72%	0.724	S	S	.	*				43	124.8	119.2	65.8	0	0	0	0	122.1	S1117 D1118	S1005-S1117 WeakPolarHBondContact CA-O 3.17Å; S1005-S1117 PolarHBondContact N-O 2.72Å; S1005-D1118 VanDerWaalsContact N-C 3.26Å; S1005-D1118 VanDerWaalsContact N-N 3.19Å; S1005-D1118 PolarHBondContact N-O 2.74Å
1006	L	31.2	Very low	30.5	Very low	161 Å²	161	131.2 Å²	131.2	84%	0.843	73%	0.727	S	S	*	*			trans	-157.9	121.7	142.1	-116.8	142.6	0	0	0	116
1007	L	31.8	Very low	30.7	Very low	143 Å²	143	131.1 Å²	131.1	75%	0.749	73%	0.732	S	S	*	*			trans	46	112.8	159	-99.3	67.4	0	0	0	122.1
1008	N	29	Very low	30.9	Very low	161 Å²	161	132.4 Å²	132.4	86%	0.861	74%	0.741	S	S	*	*			trans	-77.9	146	143.6	-111.3	-27.5	0	0	0	110.2
1009	N	33.8	Very low	30.8	Very low	129 Å²	129	133 Å²	133	69%	0.69	75%	0.745	S	S	*	*			trans	-160.8	123.9	152	-112.1	-19.8	0	0	0	114.1
1010	I	33.9	Very low	31.1	Very low	130 Å²	130	130.1 Å²	130.1	67%	0.667	74%	0.744	S	S	*	*			trans	94	114.4	140.5	-60.5	165.9	0	0	0	120.6
1011	H	33.2	Very low	31.2	Very low	180 Å²	180	132.4 Å²	132.4	83%	0.833	74%	0.743	S	S	*	*			trans	77.4	125.4	151.8	-70.1	-37.6	0	0	0	124
1012	P	31	Very low	31.1	Very low	119 Å²	119	132.9 Å²	132.9	77%	0.773	75%	0.747	S	S	*	*			trans	-104.4	162.3	166.1	39.8	-32.5	0	0	0	114
1013	M	32.5	Very low	31.1	Very low	189 Å²	189	131.1 Å²	131.1	93%	0.931	75%	0.745	S	S	*	*			trans	-145.2	147.5	166.6	-99.1	-72.5	-179.9	0	0	111.3
1014	N	30.3	Very low	31.3	Very low	169 Å²	169	133.3 Å²	133.3	90%	0.904	76%	0.758	S	S	*	*			trans	-80.4	161.4	-172.7	-69.8	-43	0	0	0	114.5
1015	G	32	Very low	31.2	Very low	67 Å²	67	134.9 Å²	134.9	69%	0.691	76%	0.763	S	S	*	*			trans	173.8	94.4	160	0	0	0	0	0	117.8
1016	N	34.5	Very low	31.4	Very low	157 Å²	157	141.9 Å²	141.9	84%	0.84	78%	0.783	S	S	*	*			trans	30.6	113.7	145.5	-53.8	-14.3	0	0	0	119.5
1017	A	29.6	Very low	31.5	Very low	96 Å²	96	139.7 Å²	139.7	79%	0.793	77%	0.772	S	S	*	*				71.2	112.3	71.7	0	0	0	0	0	115.9
1018	C	30	Very low	31.6	Very low	137 Å²	137	140.5 Å²	140.5	93%	0.926	77%	0.772	S	S	*	*			trans	-159	119.7	155.9	-120.8	0	0	0	0	110.8
1019	T	27.6	Very low	31.6	Very low	130 Å²	130	139.2 Å²	139.2	80%	0.798	76%	0.764	S	S	*	*			trans	-124.5	138.1	176.3	48.1	0	0	0	0	110.1
1020	N	33.4	Very low	31.8	Very low	153 Å²	153	138.6 Å²	138.6	82%	0.818	77%	0.767	S	S	*	*			trans	168.9	157.1	159.3	-90	-32.5	0	0	0	109.7
1021	K	30.5	Very low	31.7	Very low	161 Å²	161	140.7 Å²	140.7	70%	0.7	77%	0.768	S	S	*	*			cis	-178.5	143.6	-33.2	-146.5	178.5	-176.9	173.7	0	108.1
1022	M	30.1	Very low	31.5	Very low	164 Å²	164	138.7 Å²	138.7	81%	0.808	77%	0.773	S	S	*	*			trans	66	153	157.4	-78.6	155.1	161.8	0	0	117.9
1023	S	30.8	Very low	31.4	Very low	91 Å²	91	137.7 Å²	137.7	64%	0.636	77%	0.768	S	S	*	*			cis	-174.5	152.7	-3.4	43.5	0	0	0	0	113.6
1024	T	31.1	Very low	31.4	Very low	120 Å²	120	135.5 Å²	135.5	74%	0.736	77%	0.766	S	S	*	*			trans	63.6	151.8	145.8	53.2	0	0	0	0	120.7
1025	N	30.7	Very low	31.4	Very low	124 Å²	124	133 Å²	133	66%	0.663	76%	0.759	S	S	*	*			cis	-166.9	176.7	-5.3	-121.1	-7.6	0	0	0	112.2
1026	Y	32.1	Very low	31.4	Very low	199 Å²	199	137.1 Å²	137.1	78%	0.78	76%	0.764	S	S	*	*			trans	82.7	141	164.7	-56.4	-69.5	0	0	0	118.1
1027	N	34	Very low	31.2	Very low	115 Å²	115	136 Å²	136	62%	0.615	76%	0.757	S	S	*	*			cis	-161.9	148.6	-2.9	-123.3	-12.5	0	0	0	114.7
1028	Q	34	Very low	31.1	Very low	159 Å²	159	138.9 Å²	138.9	74%	0.743	76%	0.759	S	S	*	*			trans	54.4	118.8	149.9	-63.5	160.3	-40.2	0	0	121.3
1029	L	29	Very low	31.3	Very low	134 Å²	134	140.2 Å²	140.2	70%	0.702	75%	0.751	S	S	*	*				76.3	144	54.8	-79	164.4	0	0	0	115.7	Y1031	L1029-Y1031 HydrophobicContact CD1-CE2 4.22Å; L1029-Y1031 HydrophobicContact CD2-CD2 3.93Å; L1029-Y1031 HydrophobicContact CD2-CE2 3.81Å
1030	P	37	Very low	31.4	Very low	116 Å²	116	142.4 Å²	142.4	75%	0.753	75%	0.752	S	S	*	*			cis	-146	150.6	41.5	40.2	-19.2	0	0	0	122
1031	Y	31.8	Very low	31.3	Very low	175 Å²	175	144.3 Å²	144.3	69%	0.686	75%	0.754	S	S	*	*			trans	30.7	132.3	138.7	-67.8	-83.2	0	0	0	125.9	L1029	L1029-Y1031 HydrophobicContact CD1-CE2 4.22Å; L1029-Y1031 HydrophobicContact CD2-CD2 3.93Å; L1029-Y1031 HydrophobicContact CD2-CE2 3.81Å
1032	C	28.8	Very low	31.3	Very low	138 Å²	138	143.4 Å²	143.4	93%	0.932	76%	0.757	S	S	*	*				-152.7	143.6	112.8	-101.1	0	0	0	0	111.4
1033	S	28.9	Very low	31.3	Very low	97 Å²	97	141.2 Å²	141.2	68%	0.678	75%	0.753	S	S	*	*			trans	-153.2	139.7	-171.2	57.2	0	0	0	0	113.6
1034	T	32.7	Very low	31.3	Very low	144 Å²	144	143.4 Å²	143.4	88%	0.883	76%	0.756	S	S	*	*			trans	-140.9	135.8	162	43.6	0	0	0	0	110.8
1035	P	31.7	Very low	31.3	Very low	115 Å²	115	144.1 Å²	144.1	75%	0.747	75%	0.754	S	S	*	*			trans	-105.7	168	178.5	39.4	-33.5	0	0	0	112.6
1036	L	31	Very low	31.3	Very low	155 Å²	155	142.6 Å²	142.6	81%	0.812	75%	0.753	S	S	*	*			trans	-174.1	124.6	135.7	-120.5	74.4	0	0	0	113.6
1037	I	31.2	Very low	31.2	Very low	134 Å²	134	139.4 Å²	139.4	69%	0.687	75%	0.749	S	S	*	*			trans	70.2	105.9	145	-62.2	167.7	0	0	0	120.5	H1039	I1037-H1039 HydrophobicContact CG2-CB 4.44Å
1038	D	27.6	Very low	31.2	Very low	156 Å²	156	141 Å²	141	83%	0.834	76%	0.756	S	S	*	*			trans	-67.3	141.4	141.9	-86.8	-55.7	0	0	0	111.1
1039	H	33.5	Very low	31	Very low	165 Å²	165	138.2 Å²	138.2	76%	0.764	75%	0.754	S	S	*	*			trans	-149.9	101.9	150.8	-112.8	-63.1	0	0	0	112.6	I1037	I1037-H1039 HydrophobicContact CG2-CB 4.44Å
1040	Q	30.6	Very low	31.4	Very low	176 Å²	176	136.6 Å²	136.6	82%	0.822	75%	0.752	S	S	*	*			trans	-67.1	144.6	147.8	-64.5	176.6	-17.7	0	0	108.6
1041	F	30.2	Very low	30.9	Very low	193 Å²	193	138.7 Å²	138.7	85%	0.846	76%	0.756	S	S	*	*			trans	-163.5	136.4	133.1	-118	-78	0	0	0	111.6
1042	N	29.7	Very low	30.8	Very low	142 Å²	142	135.1 Å²	135.1	76%	0.759	76%	0.757	S	S	*	*			trans	-80.3	-178.8	174.5	-79.8	-50.3	0	0	0	111.7
1043	T	31	Very low	30.8	Very low	118 Å²	118	135 Å²	135	72%	0.724	75%	0.752	S	S	*	*			trans	74	140	148.6	35.8	0	0	0	0	117.3
1044	I	30.3	Very low	31	Very low	137 Å²	137	135.6 Å²	135.6	70%	0.703	76%	0.756	S	S	*	*			cis	-170.4	172.9	-5	-148.5	171	0	0	0	110.4
1045	I	31.5	Very low	30.8	Very low	135 Å²	135	137 Å²	137	69%	0.692	75%	0.752	S	S	*	*			trans	68.4	93.5	158.8	-70.3	169.8	0	0	0	116.8
1046	S	30.2	Very low	30.7	Very low	92 Å²	92	137.3 Å²	137.3	64%	0.643	76%	0.756	S	S	*	*				92.4	157.6	105.8	88.5	0	0	0	0	113.7
1047	N	31.6	Very low	30.7	Very low	131 Å²	131	137.9 Å²	137.9	70%	0.701	75%	0.752	S	S	*	*			cis	-162	162.7	22.2	-133.7	-15.2	0	0	0	111.2
1048	I	33.7	Very low	30.7	Very low	148 Å²	148	136.2 Å²	136.2	76%	0.759	75%	0.748	S	S	*	*			trans	69.9	101.8	150.1	-61.2	161.8	0	0	0	118.2
1049	S	28.8	Very low	30.7	Very low	101 Å²	101	135.2 Å²	135.2	71%	0.706	74%	0.743	S	S	*	*			trans	-78.5	-173	145.3	61.1	0	0	0	0	109.8
1050	P	37.3	Very low	30.7	Very low	101 Å²	101	133.8 Å²	133.8	66%	0.656	74%	0.741	S	S	*	*			cis	-142.1	-172.9	0.4	39.3	-17.7	0	0	0	116
1051	L	27.3	Very low	30.8	Very low	160 Å²	160	132.3 Å²	132.3	84%	0.838	74%	0.736	S	S	*	*			trans	73.5	163	139.8	-124.8	72.3	0	0	0	123.3
1052	S	29.9	Very low	30.7	Very low	100 Å²	100	130.1 Å²	130.1	70%	0.699	73%	0.731	S	S	*	*			trans	73.2	114.5	169.5	64.5	0	0	0	0	116.9
1053	T	27.6	Very low	30.6	Very low	135 Å²	135	127.7 Å²	127.7	83%	0.828	73%	0.725	S	S	*	*			cis	87.9	105	44.3	64.6	0	0	0	0	115.4
1054	S	32.7	Very low	30.5	Very low	110 Å²	110	128.8 Å²	128.8	77%	0.769	73%	0.727	S	S	*	*			trans	-176.8	107.7	149.2	54.3	0	0	0	0	107.4
1055	E	28.6	Very low	30.6	Very low	172 Å²	172	129.6 Å²	129.6	80%	0.804	73%	0.731	S	S	*	*				60.6	109.1	74.9	-68.6	-163.4	163.2	0	0	115.4
1056	C	31.4	Very low	30.5	Very low	122 Å²	122	131.4 Å²	131.4	82%	0.824	73%	0.734	S	S	*	*			trans	-157.8	106.3	143.9	-96.9	0	0	0	0	105.4
1057	F	30.4	Very low	30.5	Very low	167 Å²	167	134 Å²	134	73%	0.732	74%	0.736	S	S	*	*				55.3	128.3	86.8	-79.7	-98.7	0	0	0	112.9
1058	T	30.2	Very low	30.3	Very low	99 Å²	99	132.1 Å²	132.1	61%	0.607	73%	0.733	S	S	*	*			cis	-170.9	162.2	-4	5.7	0	0	0	0	108
1059	N	28.1	Very low	30.1	Very low	136 Å²	136	131 Å²	131	73%	0.727	73%	0.729	S	S	*	*			trans	51.2	129.3	153.1	-53.8	-12.3	0	0	0	118.4
1060	D	34.1	Very low	30.1	Very low	135 Å²	135	132.4 Å²	132.4	72%	0.722	73%	0.727	S	S	*	*				-166.2	154.1	81.8	-109.4	-22.6	0	0	0	115.5
1061	M	32.3	Very low	29.6	Very low	145 Å²	145	133.1 Å²	133.1	71%	0.714	73%	0.729	S	S	*	*			trans	42.2	117.9	146.3	-55.6	-153.5	-174.1	0	0	120.9
1062	I	28.5	Very low	29.5	Very low	146 Å²	146	130.1 Å²	130.1	75%	0.749	72%	0.722	S	S	*	*				78.7	125.1	61.8	-66.6	165.7	0	0	0	113.9
1063	S	28.2	Very low	29.5	Very low	91 Å²	91	132.1 Å²	132.1	64%	0.636	72%	0.723	S	S	*	*			trans	82.9	124.9	149.4	71.8	0	0	0	0	122.4
1064	N	27.1	Very low	29.4	Very low	141 Å²	141	131.8 Å²	131.8	75%	0.754	72%	0.715	S	S	*	*				56.5	129	122.2	-54.9	-19.8	0	0	0	121
1065	I	33	Very low	29.2	Very low	155 Å²	155	135 Å²	135	80%	0.795	72%	0.718	S	S	*	*				173.5	108.4	109.9	-87.7	154.2	0	0	0	105.2
1066	K	29.9	Very low	29.2	Very low	172 Å²	172	131.2 Å²	131.2	75%	0.748	71%	0.71	S	S	*	*				61.2	144.6	82.7	-76.8	-166.9	173	-174.7	0	114.1
1067	Q	29.1	Very low	29.2	Very low	148 Å²	148	133.5 Å²	133.5	69%	0.692	71%	0.708	S	S	*	*			cis	-174.9	138.7	-15.7	176.4	158.7	-5.7	0	0	107.7
1068	S	28.9	Very low	29.2	Very low	91 Å²	91	129.8 Å²	129.8	64%	0.636	70%	0.703	S	S	*	*			trans	62.5	171.4	155.3	80.8	0	0	0	0	118
1069	D	29.6	Very low	29.6	Very low	124 Å²	124	130.1 Å²	130.1	66%	0.663	71%	0.707	S	S	*	*			cis	-152.4	151.7	13.9	-116.3	-38.6	0	0	0	113.9
1070	I	28.3	Very low	29.9	Very low	131 Å²	131	133.2 Å²	133.2	67%	0.672	71%	0.714	S	S	*	*			trans	41.6	108.2	133	-70.1	170.4	0	0	0	121.4
1071	T	27.1	Very low	30	Very low	115 Å²	115	132 Å²	132	71%	0.706	71%	0.713	S	S	*	*			trans	66	128.4	136.7	66.5	0	0	0	0	124.9
1072	S	25.4	Very low	30	Very low	97 Å²	97	137.4 Å²	137.4	68%	0.678	73%	0.726	S	S	*	*				81.9	160.4	125.3	71.9	0	0	0	0	122.2
1073	I	28.6	Very low	30	Very low	143 Å²	143	137.8 Å²	137.8	73%	0.733	73%	0.727	S	S	*	*			trans	78.5	97.6	170.2	-52.6	166.9	0	0	0	112.2
1074	I	26.1	Very low	30.3	Very low	128 Å²	128	141.5 Å²	141.5	66%	0.656	74%	0.735	S	S	*	*				75	127.6	72.7	-68.2	170.3	0	0	0	113
1075	H	28.3	Very low	30.5	Very low	178 Å²	178	140.8 Å²	140.8	82%	0.824	73%	0.731	S	S	*	*			trans	68.1	146.9	173.9	-61.7	-35.9	0	0	0	116.2
1076	S	29.7	Very low	30.5	Very low	91 Å²	91	139.9 Å²	139.9	64%	0.636	73%	0.727	S	S	*	*			cis	-168.5	152.3	-5.3	39.6	0	0	0	0	112.2
1077	H	31.2	Very low	30.5	Very low	171 Å²	171	138.6 Å²	138.6	79%	0.792	73%	0.728	S	S	*	*			trans	49	106.6	147.2	-70.2	-66	0	0	0	122.1
1078	S	30.8	Very low	30.7	Very low	89 Å²	89	139.5 Å²	139.5	62%	0.622	73%	0.732	S	S	*	*				31.5	158.9	98.8	74.4	0	0	0	0	120.7
1079	P	37.6	Very low	30.9	Very low	106 Å²	106	142.3 Å²	142.3	69%	0.688	74%	0.739	S	S	*	*			cis	-148.4	-179.2	-13.9	30.4	-5.6	0	0	0	118.6
1080	K	34.1	Very low	30.8	Very low	201 Å²	201	145 Å²	145	87%	0.874	75%	0.745	S	S	*	*			trans	85.2	155.9	140.4	-86.6	174.3	177.6	-176.4	0	121
1081	P	35.9	Very low	31	Very low	108 Å²	108	145.4 Å²	145.4	70%	0.701	75%	0.748	S	S	*	*			trans	-131.5	-168.7	-143	44.3	-27.2	0	0	0	114.3
1082	W	32.4	Very low	31.2	Very low	260 Å²	260	145.9 Å²	145.9	99%	0.985	76%	0.756	S	S	*	*			trans	-155.5	171	153.5	-100.6	7.3	0	0	0	113.3
1083	I	28.7	Very low	31.2	Very low	153 Å²	153	150 Å²	150	79%	0.785	77%	0.767	S	S	*	*			trans	-102.5	145.7	-155.5	-64.5	152.2	0	0	0	112.8
1084	Q	34.9	Very low	31.3	Very low	170 Å²	170	150 Å²	150	79%	0.794	77%	0.774	S	S	*	*			trans	-176.8	140.8	137.3	-106.5	168	-0.9	0	0	116.4
1085	N	32.2	Very low	31.5	Very low	126 Å²	126	149.2 Å²	149.2	67%	0.674	78%	0.777	S	S	*	*			trans	47.7	118.2	146.8	-64.5	-6.5	0	0	0	121
1086	I	31.4	Very low	32.3	Very low	136 Å²	136	147 Å²	147	70%	0.697	78%	0.779	S	S	*	*				86.5	121.8	67.3	-74.4	172.2	0	0	0	113.6
1087	N	30.3	Very low	32.3	Very low	144 Å²	144	150.5 Å²	150.5	77%	0.77	79%	0.789	S	S	*	*			trans	63	132.9	169.4	-60	-11.8	0	0	0	116.1
1088	E	33.4	Very low	32.3	Very low	168 Å²	168	145.4 Å²	145.4	79%	0.785	78%	0.777	S	S	*	*				-172.1	175.3	53.3	-140.1	162.6	-128.7	0	0	113.1
1089	L	32.9	Very low	32.1	Very low	149 Å²	149	150.4 Å²	150.4	78%	0.78	79%	0.787	S	S	*	*			trans	73.1	87.4	155.4	-81.4	153.4	0	0	0	122.9
1090	K	28.5	Very low	31.8	Very low	182 Å²	182	150.9 Å²	150.9	79%	0.791	79%	0.793	S	S	*	*			trans	-8	151.4	134.7	-113.2	178.8	-179.5	-179.5	0	120.7
1091	N	31.6	Very low	31.6	Very low	138 Å²	138	146.1 Å²	146.1	74%	0.738	79%	0.785	S	S	*	*			trans	100.1	103	150.4	-58.6	-16.3	0	0	0	119.8
1092	S	30.4	Very low	31.4	Very low	125 Å²	125	151.9 Å²	151.9	87%	0.874	80%	0.795	S	S	*	*				176.2	143.2	106.7	44.7	0	0	0	0	112.5
1093	M	26.5	Very low	31.4	Very low	184 Å²	184	144.8 Å²	144.8	91%	0.906	78%	0.78	S	S	*	*			trans	-98.4	145	171.3	-64.5	164.3	79.5	0	0	109.7
1094	T	30.7	Very low	31.5	Very low	142 Å²	142	145.4 Å²	145.4	87%	0.871	79%	0.785	S	S	*	*			trans	-167.7	133	143.1	19.3	0	0	0	0	110.7
1095	P	30.1	Very low	31.3	Very low	112 Å²	112	145.7 Å²	145.7	73%	0.727	79%	0.786	S	S	*	*			trans	-99.5	157.1	174.2	37.8	-33	0	0	0	112.9
1096	P	44.4	Very low	31.3	Very low	133 Å²	133	145.6 Å²	145.6	86%	0.864	80%	0.795	S	S	*	*			trans	-91.5	101.5	171.8	33.3	-30.1	0	0	0	113
1097	L	30.4	Very low	31.2	Very low	164 Å²	164	145.5 Å²	145.5	86%	0.859	80%	0.802	S	S	*	*			trans	-70.9	161	145.2	-73.2	160.9	0	0	0	108.6
1098	A	30.3	Very low	31.3	Very low	63 Å²	63	143.9 Å²	143.9	52%	0.521	80%	0.802	S	S	.	*			cis	-174.5	-172.9	-15.8	0	0	0	0	0	108.6
1099	F	27.9	Very low	31.1	Very low	194 Å²	194	144.2 Å²	144.2	85%	0.851	81%	0.808	S	S	*	*			trans	70.7	121.4	160.5	-62.3	-74.7	0	0	0	120.3
1100	S	31.1	Very low	30.7	Very low	116 Å²	116	141.3 Å²	141.3	81%	0.811	81%	0.805	S	S	*	*				-156.8	139.8	89.6	56	0	0	0	0	111.3
1101	S	30.4	Very low	31	Very low	101 Å²	101	138.1 Å²	138.1	71%	0.706	80%	0.803	S	S	*	*			trans	-123.2	131.4	171.6	49.7	0	0	0	0	109
1102	Y	31.9	Very low	30.9	Very low	229 Å²	229	139.2 Å²	139.2	90%	0.898	81%	0.807	S	S	*	*			trans	-102.5	121.4	168.9	-104.4	-87.7	0	0	0	108.8
1103	T	30.7	Very low	30.7	Very low	112 Å²	112	141.7 Å²	141.7	69%	0.687	80%	0.802	S	S	*	*			trans	-82.8	147.4	176	44.4	0	0	0	0	111.1
1104	N	30.6	Very low	30.8	Very low	166 Å²	166	141.3 Å²	141.3	89%	0.888	80%	0.803	S	S	*	*			trans	-149.3	140.6	151.6	-107.7	-32.4	0	0	0	110.2
1105	H	31.8	Very low	30.5	Very low	175 Å²	175	142.1 Å²	142.1	81%	0.81	80%	0.799	S	S	*	*			trans	-83.3	143.2	-165.9	-66.7	-97.1	0	0	0	113.6
1106	S	32.1	Very low	30.5	Very low	124 Å²	124	143.2 Å²	143.2	87%	0.867	80%	0.804	S	S	*	*			trans	-155.9	138	138	57.7	0	0	0	0	111.1
1107	T	28.9	Very low	29.9	Very low	135 Å²	135	140.8 Å²	140.8	83%	0.828	79%	0.79	S	S	*	*			trans	-110.5	132.8	-172.7	47.8	0	0	0	0	111.9
1108	S	32	Very low	29.9	Very low	110 Å²	110	137 Å²	137	77%	0.769	77%	0.771	S	S	*	*			trans	-159.6	109.5	151.4	63.9	0	0	0	0	114.3
1109	L	30.7	Very low	30	Very low	174 Å²	174	139.9 Å²	139.9	91%	0.911	78%	0.776	S	S	*	*			trans	41.8	125.6	135.5	-66	160	0	0	0	121.4
1110	A	24.6	Very low	30.1	Very low	88 Å²	88	134.2 Å²	134.2	73%	0.727	76%	0.755	S	S	*	*			trans	-77.2	168.6	163.1	0	0	0	0	0	113
1111	P	32.9	Very low	30.1	Very low	115 Å²	115	139.6 Å²	139.6	75%	0.747	76%	0.759	S	S	*	*				-136	131.9	110.3	26.3	-9.2	0	0	0	112.7
1112	I	30.7	Very low	29.9	Very low	161 Å²	161	139.5 Å²	139.5	83%	0.826	76%	0.759	S	S	*	*				74.1	125.6	90.2	-62.5	168.2	0	0	0	114.4
1113	F	25.7	Very low	29.9	Very low	177 Å²	177	135.2 Å²	135.2	78%	0.776	76%	0.757	S	S	*	*			trans	-58.6	158.1	179.6	-80.6	-112.6	0	0	0	115.2
1114	L	28.9	Very low	29.8	Very low	177 Å²	177	133.4 Å²	133.4	93%	0.927	76%	0.76	S	S	*	*				-163.1	145	118.6	-102.3	168.1	0	0	0	112
1115	M	24.9	Very low	29.8	Very low	159 Å²	159	133.6 Å²	133.6	78%	0.783	76%	0.759	S	S	*	*			trans	-99.9	150.6	180	-63.3	165.6	156.3	0	0	111.6
1116	T	29.9	Very low	29.8	Very low	135 Å²	135	133.2 Å²	133.2	83%	0.828	76%	0.758	S	S	*	*			trans	-157.7	148.9	143.2	45.8	0	0	0	0	112
1117	S	32.4	Very low	29.8	Very low	81 Å²	81	136.6 Å²	136.6	57%	0.566	76%	0.76	S	S	*	*			trans	-112.5	148.7	-166.3	49.9	0	0	0	0	114.9	S1005	S1005-S1117 WeakPolarHBondContact CA-O 3.17Å; S1005-S1117 PolarHBondContact N-O 2.72Å
1118	D	30.1	Very low	29.8	Very low	86 Å²	86	136.3 Å²	136.3	46%	0.46	75%	0.753	S	S	.	*			trans	51.3	121.5	136.8	-46.1	-24.3	0	0	0	123.6	T1003 T1004 S1005	T1003-D1118 VanDerWaalsContact C-CA 3.4Å; T1003-D1118 PolarHBondContact N-OD1 3.19Å; T1003-D1118 CarbonylContact O-C 3.6Å; T1003-D1118 WeakPolarHBondContact O-CA 3.42Å; T1004-D1118 VanDerWaalsContact N-CA 3.26Å; T1004-D1118 CarbonylContact O-C 3.49Å; S1005-D1118 VanDerWaalsContact N-C 3.26Å; S1005-D1118 VanDerWaalsContact N-N 3.19Å; S1005-D1118 PolarHBondContact N-O 2.74Å
1119	L	32.1	Very low	29.9	Very low	122 Å²	122	141.5 Å²	141.5	64%	0.639	76%	0.762	S	S	*	*				176.8	131.9	102.5	-89.1	162.6	0	0	0	116.2	T1003 T1004	T1003-L1119 CarbonylContact O-C 3.55Å; T1003-L1119 VanDerWaalsContact O-CA 3.22Å; T1003-L1119 WeakPolarHBondContact O-CA 3.17Å; T1003-L1119 PolarHBondContact O-N 3.19Å; T1004-L1119 PolarHBondContact O-N 2.91Å
1120	N	29.5	Very low	29.9	Very low	76 Å²	76	139.5 Å²	139.5	41%	0.406	75%	0.753	S	S	.	*			trans	-18.9	148.7	161	-63.4	-65.6	0	0	0	121.1	Q1001	Q1001-N1120 PolarHBondContact OE1-ND2 2.85Å; Q1001-N1120 VanDerWaalsContact OE1-ND2 3.17Å
1121	Y	31	Very low	30.3	Very low	228 Å²	228	142 Å²	142	89%	0.894	75%	0.754	S	S	*	*				-176.6	159.5	98.5	-113.3	-87.4	0	0	0	115.7
1122	S	27	Very low	30.3	Very low	100 Å²	100	142.1 Å²	142.1	70%	0.699	76%	0.757	S	S	*	*			trans	-94.2	147.3	-177.7	159	0	0	0	0	114.1
1123	T	32.4	Very low	30.2	Very low	139 Å²	139	141.7 Å²	141.7	85%	0.853	76%	0.757	S	S	*	*			trans	-162.1	148.3	131.4	43.5	0	0	0	0	111.2
1124	G	28.1	Very low	30.4	Very low	74 Å²	74	140.3 Å²	140.3	76%	0.763	76%	0.763	S	S	*	*			trans	-123.9	144.9	169	0	0	0	0	0	111.7
1125	I	31	Very low	30.2	Very low	169 Å²	169	137 Å²	137	87%	0.867	76%	0.755	S	S	*	*			trans	-142.8	135.7	172.8	-63.6	-175.4	0	0	0	109.2
1126	H	30.8	Very low	30.3	Very low	168 Å²	168	136 Å²	136	78%	0.778	76%	0.758	S	S	*	*			trans	-76.1	154.5	175.2	-103.1	-107.6	0	0	0	113
1127	Q	33	Very low	30	Very low	194 Å²	194	135.6 Å²	135.6	91%	0.907	76%	0.755	S	S	*	*			trans	-146.1	124.8	150.9	-110.1	178.6	-2.4	0	0	111.2
1128	D	28.1	Very low	29.9	Very low	129 Å²	129	139 Å²	139	69%	0.69	77%	0.765	S	S	*	*			trans	-86.2	155.1	177.6	-61	-47.3	0	0	0	112.1
1129	F	33.1	Very low	29.7	Very low	219 Å²	219	142 Å²	142	96%	0.961	78%	0.78	S	S	*	*			trans	-147	145.2	146.8	-104.3	-75.7	0	0	0	112
1130	N	31.7	Very low	29.6	Very low	133 Å²	133	141.1 Å²	141.1	71%	0.711	78%	0.781	S	S	*	*			trans	-115.6	156.9	-159.3	-116.1	-32.3	0	0	0	113.7
1131	N	32.1	Very low	29.7	Very low	141 Å²	141	142.5 Å²	142.5	75%	0.754	79%	0.794	S	S	*	*			trans	61.3	131.4	155.7	-65.2	-29.2	0	0	0	119.2
1132	S	33.2	Very low	29.4	Very low	117 Å²	117	138.2 Å²	138.2	82%	0.818	79%	0.791	S	S	*	*				-178.4	166.9	64.3	41.4	0	0	0	0	113.2
1133	N	28.5	Very low	29.6	Very low	151 Å²	151	139.9 Å²	139.9	81%	0.807	79%	0.791	S	S	*	*			trans	-79.9	154.4	-169.7	-53.4	-45.7	0	0	0	114.9
1134	T	29.8	Very low	29.3	Very low	149 Å²	149	141 Å²	141	91%	0.914	79%	0.791	S	S	*	*				-175.2	150.9	116.1	21.8	0	0	0	0	112.6
1135	S	25	Very low	29.4	Very low	107 Å²	107	146.1 Å²	146.1	75%	0.748	79%	0.794	S	S	*	*			trans	-98.8	151.4	-175.5	49.1	0	0	0	0	113
1136	T	27.4	Very low	29.2	Very low	139 Å²	139	142.6 Å²	142.6	85%	0.853	79%	0.785	S	S	*	*			trans	-155.8	130.8	155.1	-6.4	0	0	0	0	110.9
1137	V	24.7	Very low	29.3	Very low	126 Å²	126	140.1 Å²	140.1	76%	0.764	78%	0.782	S	S	*	*			trans	-97.7	131.6	-179.5	173.2	0	0	0	0	109.1	I1139	V1137-I1139 HydrophobicContact CG1-CG1 4.45Å
1138	I	29.3	Very low	29.2	Very low	152 Å²	152	137 Å²	137	78%	0.779	77%	0.771	S	S	*	*			trans	-136.6	119.1	169.3	-55.5	-178.3	0	0	0	109.3
1139	I	26.6	Very low	29.4	Very low	150 Å²	150	137 Å²	137	77%	0.769	77%	0.771	S	S	*	*			trans	-105.4	127.9	171	-58.9	166.5	0	0	0	107.3	V1137	V1137-I1139 HydrophobicContact CG1-CG1 4.45Å
1140	P	30	Very low	29.3	Very low	103 Å²	103	135.9 Å²	135.9	67%	0.669	77%	0.769	S	S	*	*			trans	-151.7	-177	136.2	41.1	-22.9	0	0	0	112.5
1141	P	30.6	Very low	29.2	Very low	104 Å²	104	135.5 Å²	135.5	68%	0.675	77%	0.772	S	S	*	*				-127.9	165.4	-69.7	37.3	-21.6	0	0	0	112.9
1142	V	24.8	Very low	29	Very low	138 Å²	138	137.3 Å²	137.3	84%	0.836	78%	0.781	S	S	*	*			trans	-71.6	133.2	169.4	175.2	0	0	0	0	110.2
1143	I	31.5	Very low	28.8	Very low	136 Å²	136	139 Å²	139	70%	0.697	78%	0.779	S	S	*	*			trans	-121.8	110.7	168.8	-61	179.7	0	0	0	109.3
1144	L	25	Very low	28.9	Very low	161 Å²	161	137.4 Å²	137.4	84%	0.843	78%	0.779	S	S	*	*			trans	-79.5	136.6	159.1	-79.7	153.3	0	0	0	108.3
1145	H	30.9	Very low	29	Very low	182 Å²	182	135.4 Å²	135.4	84%	0.843	77%	0.771	S	S	*	*			trans	-135.9	136.5	160.6	-113.6	-76.3	0	0	0	110.5
1146	S	27.3	Very low	29.6	Very low	95 Å²	95	135.8 Å²	135.8	66%	0.664	77%	0.771	S	S	*	*			trans	-123.2	173.4	-178.2	57.9	0	0	0	0	111.1
1147	T	32.2	Very low	29.9	Very low	117 Å²	117	140.4 Å²	140.4	72%	0.718	78%	0.775	S	S	*	*			trans	75.4	108.5	162.7	59.3	0	0	0	0	119.6
1148	N	31	Very low	30.2	Very low	128 Å²	128	137.7 Å²	137.7	68%	0.684	77%	0.772	S	S	*	*				102.7	127.7	115.3	-82.4	48.4	0	0	0	122.3
1149	D	32	Very low	30.7	Very low	129 Å²	129	137 Å²	137	69%	0.69	78%	0.778	S	S	*	*			trans	63.2	105.8	142.4	-50.5	-28.3	0	0	0	119.5
1150	Q	31.4	Very low	30.9	Very low	195 Å²	195	138.6 Å²	138.6	91%	0.911	78%	0.784	S	S	*	*				-162.2	153.7	83.7	-96.9	178	14.7	0	0	113.2
1151	T	29.2	Very low	30.9	Very low	125 Å²	125	140.2 Å²	140.2	77%	0.767	79%	0.793	S	S	*	*			trans	-84.6	141	-171.1	44.9	0	0	0	0	113.3
1152	L	29.1	Very low	31	Very low	180 Å²	180	142.3 Å²	142.3	94%	0.942	80%	0.797	S	S	*	*			trans	-148.9	136.8	148.7	-112.1	158.6	0	0	0	109.9
1153	I	29.1	Very low	31.3	Very low	152 Å²	152	143.1 Å²	143.1	78%	0.779	80%	0.796	S	S	*	*			trans	-106.4	126.6	-158.4	-64	161.7	0	0	0	110.6
1154	S	30.5	Very low	31.6	Very low	117 Å²	117	144 Å²	144	82%	0.818	80%	0.802	S	S	*	*			trans	-159.8	114.5	149.2	58.7	0	0	0	0	110.9
1155	S	31.2	Very low	32.1	Very low	107 Å²	107	143 Å²	143	75%	0.748	80%	0.797	S	S	*	*			trans	-84	149.5	179.9	52.2	0	0	0	0	113.1
1156	P	37.2	Very low	32.4	Very low	115 Å²	115	141.6 Å²	141.6	75%	0.747	80%	0.796	S	S	*	*			trans	-94.9	136.9	175	35.5	-31.1	0	0	0	112.5
1157	Y	34.4	Very low	32.7	Very low	236 Å²	236	142 Å²	142	93%	0.925	80%	0.799	S	S	*	*			trans	-160.9	128.3	161.2	-98.1	-68.8	0	0	0	113.7
1158	G	31	Very low	32.9	Very low	69 Å²	69	140.7 Å²	140.7	71%	0.711	80%	0.795	S	S	*	*			trans	89	136.7	145.7	0	0	0	0	0	119.5
1159	P	38.7	Very low	33.2	Very low	138 Å²	138	141.2 Å²	141.2	90%	0.896	80%	0.798	S	S	*	*			trans	-96.7	112.5	145.7	32.4	-24.2	0	0	0	109.6
1160	M	31.8	Very low	33.3	Very low	184 Å²	184	141 Å²	141	91%	0.906	80%	0.796	S	S	*	*			trans	-79.7	137.7	176.2	-134.6	176.9	-173.6	0	0	110.5
1161	T	29.4	Very low	33.5	Very low	137 Å²	137	140.3 Å²	140.3	84%	0.84	79%	0.79	S	S	*	*			trans	-70.7	130	171.7	38	0	0	0	0	111
1162	I	34	Very low	33.6	Very low	148 Å²	148	141.8 Å²	141.8	76%	0.759	79%	0.794	S	S	*	*			trans	-127	102.2	165.8	-60.7	-178.6	0	0	0	108.7
1163	N	31.3	Very low	33.8	Very low	155 Å²	155	140.1 Å²	140.1	83%	0.829	79%	0.791	S	S	*	*			trans	-73.7	128.5	157.6	-106.3	-12.9	0	0	0	107.9
1164	N	35.8	Very low	33.7	Very low	153 Å²	153	137.9 Å²	137.9	82%	0.818	79%	0.789	S	S	*	*			trans	-149.4	110.7	154.2	-116.7	-13.9	0	0	0	111.2
1165	N	36.9	Very low	33.8	Very low	140 Å²	140	139.9 Å²	139.9	75%	0.749	79%	0.789	S	S	*	*			trans	-68.5	128.8	167.8	-68.6	-36	0	0	0	108.9
1166	N	35.9	Very low	33.6	Very low	153 Å²	153	143 Å²	143	82%	0.818	79%	0.794	S	S	*	*				168.3	142.2	109.1	-89.3	-34.1	0	0	0	114.3
1167	S	34.6	Very low	33.3	Very low	103 Å²	103	147.7 Å²	147.7	72%	0.72	80%	0.803	S	S	*	*			trans	70.1	106.1	139	-161	0	0	0	0	120.5
1168	S	36	Very low	33	Very low	91 Å²	91	143.1 Å²	143.1	64%	0.636	80%	0.795	S	S	*	*				96.7	120	121.4	68.8	0	0	0	0	121.7
1169	N	36.7	Very low	33.1	Very low	138 Å²	138	145.4 Å²	145.4	74%	0.738	80%	0.795	S	S	*	*			trans	82.1	104.3	130.7	-68	-10.4	0	0	0	121.5
1170	N	35.6	Very low	32.9	Very low	124 Å²	124	145.2 Å²	145.2	66%	0.663	79%	0.791	S	S	*	*				89.5	116.4	119.7	-77.2	-33.1	0	0	0	121.4
1171	K	35.2	Very low	32.8	Very low	181 Å²	181	144.1 Å²	144.1	79%	0.787	79%	0.789	S	S	*	*			trans	78.6	110.1	131.8	-66.7	178.9	179.5	-177.1	0	119.5
1172	N	31	Very low	33.2	Very low	157 Å²	157	143.2 Å²	143.2	84%	0.84	79%	0.788	S	S	*	*			trans	6.7	124.5	135.5	-53.3	1.9	0	0	0	117.5
1173	T	32.6	Very low	33.1	Very low	144 Å²	144	143.8 Å²	143.8	88%	0.883	79%	0.793	S	S	*	*				-162.2	141.5	120.9	10	0	0	0	0	110.8
1174	S	28.4	Very low	33.3	Very low	105 Å²	105	143.9 Å²	143.9	73%	0.734	79%	0.793	S	S	*	*			trans	-75	159.3	168.1	46.8	0	0	0	0	111.4
1175	I	32.3	Very low	33.2	Very low	160 Å²	160	146.9 Å²	146.9	82%	0.821	79%	0.793	S	S	*	*			trans	-169.3	135.9	145.4	-97.9	146.4	0	0	0	109
1176	M	26.3	Very low	33.1	Very low	173 Å²	173	148.2 Å²	148.2	85%	0.852	80%	0.8	S	S	*	*			trans	-69.8	159.1	168	-65.6	173.8	166.8	0	0	110.5
1177	F	31.9	Very low	33.1	Very low	212 Å²	212	149.2 Å²	149.2	93%	0.93	80%	0.8	S	S	*	*				-160.2	164.6	124.6	-105.4	-67.1	0	0	0	111.9
1178	N	27.8	Very low	33.1	Very low	141 Å²	141	152.2 Å²	152.2	75%	0.754	81%	0.806	S	S	*	*			trans	-116.1	-174.2	-161.8	-165.2	0.3	0	0	0	110.4
1179	T	33.6	Very low	33	Very low	117 Å²	117	153.2 Å²	153.2	72%	0.718	81%	0.81	S	S	*	*			trans	80	144.2	171.8	77	0	0	0	0	115.8
1180	T	33.9	Very low	32.7	Very low	134 Å²	134	154.1 Å²	154.1	82%	0.822	82%	0.815	S	S	*	*			cis	-155.9	164.9	4.8	-8.2	0	0	0	0	112.7
1181	N	30.6	Very low	32.4	Very low	161 Å²	161	155.8 Å²	155.8	86%	0.861	82%	0.822	S	S	*	*			trans	-62.8	150.4	179	-72.7	-24.3	0	0	0	116.4
1182	S	36.7	Very low	32.2	Very low	117 Å²	117	151.5 Å²	151.5	82%	0.818	82%	0.815	S	S	*	*			trans	-155.3	126.3	138	59.3	0	0	0	0	111.5
1183	N	32.8	Very low	32.2	Very low	160 Å²	160	151.3 Å²	151.3	86%	0.856	81%	0.813	S	S	*	*			trans	-71.8	147.3	173.1	-65.7	-37.3	0	0	0	111.1
1184	D	35.9	Very low	32.1	Very low	157 Å²	157	150.8 Å²	150.8	84%	0.84	80%	0.803	S	S	*	*				-156.5	163.2	122.1	-128.4	-32.3	0	0	0	113.9
1185	R	33	Very low	32.4	Very low	217 Å²	217	151.2 Å²	151.2	82%	0.819	80%	0.803	S	S	*	*			trans	-89	150.9	-162.6	-61.4	163.3	169.3	164.9	-5.1	114.3
1186	N	35.6	Very low	32.4	Very low	167 Å²	167	152.8 Å²	152.8	89%	0.893	80%	0.804	S	S	*	*				-160.2	146.6	129.1	-102.8	-32.3	0	0	0	113.4
1187	H	35.9	Very low	32.5	Very low	174 Å²	174	151.1 Å²	151.1	81%	0.806	80%	0.799	S	S	*	*			trans	-82.8	155.1	-173	-77.3	-82.6	0	0	0	114.3
1188	I	34.5	Very low	32.7	Very low	167 Å²	167	146.9 Å²	146.9	86%	0.856	79%	0.79	S	S	*	*				-171.2	145	126.6	-94.3	151.6	0	0	0	107.3
1189	P	32.9	Very low	32.8	Very low	112 Å²	112	150 Å²	150	73%	0.727	79%	0.791	S	S	*	*			trans	-100.9	153.6	-139.6	36.7	-35.4	0	0	0	117
1190	D	29.5	Very low	32.7	Very low	157 Å²	157	151.3 Å²	151.3	84%	0.84	79%	0.794	S	S	*	*			trans	-66.2	139.8	164.2	-70.6	-54.7	0	0	0	112.1
1191	I	31.2	Very low	32.4	Very low	159 Å²	159	155 Å²	155	82%	0.815	82%	0.823	S	S	*	*			trans	-101.9	91.2	164.4	-62.6	178.2	0	0	0	108.2	I1193	I1191-I1193 HydrophobicContact CG2-CG1 4.43Å
1192	S	29.7	Very low	32.5	Very low	90 Å²	90	154.7 Å²	154.7	63%	0.629	82%	0.821	S	S	*	*			trans	-82.8	118.1	167.9	57.6	0	0	0	0	110.3	I1194	S1192-I1194 PolarHBondContact O-N 3.45Å
1193	I	32.3	Very low	32.3	Very low	154 Å²	154	156.7 Å²	156.7	79%	0.79	82%	0.821	S	S	*	*			trans	-86.7	107.3	172.5	-60.5	177.8	0	0	0	109	I1191	I1191-I1193 HydrophobicContact CG2-CG1 4.43Å
1194	I	29	Very low	32.3	Very low	133 Å²	133	156.5 Å²	156.5	68%	0.682	82%	0.819	S	S	*	*			trans	-104.2	117.1	171.1	-61.9	167.6	0	0	0	107.9	S1192	S1192-I1194 PolarHBondContact O-N 3.45Å
1195	P	34.7	Very low	32.1	Very low	113 Å²	113	156.5 Å²	156.5	73%	0.734	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-76	137.6	164.3	-10.1	27.3	0	0	0	110.1
1196	F	31.9	Very low	32	Very low	193 Å²	193	152.7 Å²	152.7	85%	0.846	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-66.1	143.1	-175.5	-94.8	-115.6	0	0	0	113.6	V1198	F1196-V1198 HydrophobicContact CB-CG2 4.31Å
1197	N	29.1	Very low	31.8	Very low	138 Å²	138	151.7 Å²	151.7	74%	0.738	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-91.1	117.4	159.9	-175.9	-9.2	0	0	0	108.3
1198	V	35.3	Very low	31.5	Very low	123 Å²	123	150.1 Å²	150.1	75%	0.745	81%	0.813	S	S	*	*			trans	-117.9	117.4	173.6	-179	0	0	0	0	108.4	F1196	F1196-V1198 HydrophobicContact CB-CG2 4.31Å
1199	R	31	Very low	31.3	Very low	206 Å²	206	148.8 Å²	148.8	78%	0.777	81%	0.81	S	S	*	*			trans	-93	139.6	171	-81.8	-176.2	175.6	176.4	-2	110.7
1200	N	31.8	Very low	31.1	Very low	146 Å²	146	151.9 Å²	151.9	78%	0.781	82%	0.817	S	S	*	*			trans	59.8	107.4	153.5	-58.1	18.5	0	0	0	118.3
1201	C	27.9	Very low	31.3	Very low	211 Å²	211	151.5 Å²	151.5	100%	1.426	82%	0.815	S	S	*	*				-134.4	0	107.4	-96.2	0	0	0	0	108.3

Retrieved 1,201 of 1,201 residues in 609.8 ms (Link to these results)

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