A0A077Z0J0_TRITR Loading...

Fatty acid synthase

Fatty acid synthetase is a multifunctional enzyme that catalyzes the de novo biosynthesis of long-chain saturated fatty acids starting from acetyl-CoA and malonyl-CoA in the presence of NADPH. This multifunctional protein contains 7 catalytic activities and a site for the binding of the prosthetic group 4'-phosphopantetheine of the acyl carrier protein ([ACP]) domain.

AlphaFold DB , UniProt , Accession A0A077Z0J0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 2,664 aa.

						>A0A077Z0J0_TRITR|A0A077Z0J0
MPIKTEKEGRLANGTCPPEPWERLTSSGESTDYSNTSTNSVNMNDVSDGQWIQSSVNDVTESQVSFESEETMPWWKGQEDIVISGISARLPESDNMQEFAEHLLNGDDLITEDNRRWEPGLFGLPRRHGKVKQLAKFDAAFFGVHPKQAKNMDPQLRILLEVAFEALLDAGVNPVKVRGSRTGVFVGCSGSETAAWLTRDPELVTGYSLTGCVRSMFANRLSYFLDFRGPSFAVDTACSSSLLALQLAVDAIRKDECEAALVAGSHLTLTPTTALQFMRLGLLSQKGMCQTFDANGEGYVRSEGIVAIFLQKVSIARRSYATVVHAMSNTDGYKEQGVTFPSGQQQAQLLKSVYKEAGVDPNTVVYVETHGTGTKVGDPEEANALCEVYCTNRIGPLLVGSVKSNMGHAEPASGLAAIAKMLIAMQTGYLPPNLHFEEPNPYIPGLADGRLKVVTEKTPWNGGIVGVNSFGFGGSNTHVVLRSFHRSEQPMEQPYGRNQRLFLTSGRTELSVKRILDEAEKRSNDEAFLSILSGVANVPASMYPFRAYAILNRGDQPPLRNIQACLYGLFAKQYAYMVFQKYSSVADRPVWFIYSGMGSQWIGMGRDLIEMFPVFARTIVRCSEVLKPFGLSPMGMIMTEDKKVFVNNPLNCFVCISAIQIALTSMLKMMGVEPDGIVGHSTGEMVAGFCDNCFSLEETILTAYFRGKAMVDAKFPLGGMAAVGLTADEVASRCGKGVYVACHNAEDSTSISGLYEEVERTVSKLQKEGIFAKMIDSSGMAFHSPLIQSIGNSLRKTLNQVIPQPKLRSSRWISSSVPESEWDSDLGKYCSAEYHVNNTLSPVLFYEALLHVPENAIIIEVAPHCLLQSIIRRVVPSSCTYQGLMNSREESNVDFFLQSLGRLHQAGLSLDVHNIYGTVPLPVPLETPMISPLIEWDHGADWPVVSMKDMLAGGTGGLAASCSINIDPFNPEMKDQFYLEHVIDGRVLFPFTGHLINAWRAVCKIRGLEMEKTPVLIEDVHVYRATILSHPSEQAQQDRFALGDQPCLQHHILVKFNILVGWTTGNFEILEGDSLAASGRITIIQDEERSSLYENFAHVPLREECERIELTTVDVYKELLLRGYEYGKSFRCIYQACNAGDRTSILWNGNWVTFLDALLQTALLMEKMDTLKLPTRMRYLRIDPEKHLKSVIRLDDKEIVEARCDATTNGFAAGGVEVRELVAQTVPRRLHHGVKPTLEQVKFFYYKNDHCMQDTPSRKAQLDKYTTFCEDLLNRCIDVRGALLTSRLSLSKIRASKKSVLLDGEYLQQCIADKKCAIVHLLNKLIEEPEHLASEQALSELSKWFIEHADSDILWNCSTMEDIVKPILDIVLENNSGHSDHIVMFEPRTTAFAELCSNLQVSHPLVKVAWTLGGPNVTQLKEADQQFNLYTTNMDEEEVNPSGDQLNHDLAILDRVLCKKKNIIAYLHETKKFLRPDGFLFVNEFTSNFALASVLMAIGSPGAGDPQDQSRYEGMFLEHDNWLKLFDQAGFNLISYQRDDMMQTVYLIRKRPEMENIPHVVVANDVTSFDWLQPLQSTLENYAFKASEDTVWVVSNRVRNGIPGLALCLREEHSINKIRSIMDTSFKRSETGNALDLESDEVRQVMELDLHSNMYRNGKWGCYRHLRLKSDQTFCCEETEHAFINTLTRGDLNSLTWIGSPNKYWTKDSPTRELCSVYYASINFRDIMLATGRLSIDSIPGMFIDKDCLLGMEYAGRLPTGERVMGLLPCQAMATTVVADTNFMWKVPDHWKMHEAATVPVVFTTAFYALVVRGRIRKGEKVLIHSGSGGVGMAAISIALSYGCEVFTTVGSDEKKEFLKSVFPELKDHHFSNSRTSEFEFHIMHRTGGRGVDLVLNSLSEEKLHASVRCLAQHGRFLEIGKYDLAADSKLGMSIFLKNATFHGILLDSLFEPNNHEWQMVKNLLDRGIEDGLVKPLPMTIFPYDRVEEAFRFMATGKHKGKVLLKIREEEEAKLCPPSPLKVMAATRSYCCPAHVYLITGGLGGLGLELANWLITRGARKLVLTSRSGVRTGYQARCLYFWRRMGVTVSISTLDIGNEQQTERLFKETREIGPIGGIFHLAMVLRDCLFENQTVENFVQSSSPKCAGTEHLDKFSRKYCGPELKWFVAFSSQSCARGNSGQTNYGWANSYMERIVEYRIMDNLPGIVIQWGAIGDVGIIVEKLGDNTTIVGGTHAQRIPSCLQSLDSFLSWKQGIFSCFIRAETNRPGGDGKNANIMQTIAHILGISDLKQVDQDSRLGNLGLDSLMGVEIKQTLERDYDVVLSMKEIRGLTLNKLVEIVSNPKGKGTVTELAKSMEEDLKTIMAMFQLYFEADDLRPDLPVVKLNAIEEGPPVFLVHPIEGVKSPLEMLGSKLPFPAYCFQCTPAVPLTSMESIALYYIKCMEGIQPSPPYRIIGYSYGANIAFEMATLLQQKYGDGKESVQSLILLDSSHRYMRLYRNAYRLAYGVAAQNLAHDTNFECEILLAFSQRFAEIDYRALRDQLASLSSWDDRVNLTKKTLMQAGSFKDAESIDFGVNSLRQKFLVADRYKPTRKYQGDAVLIKSSKGGTRPEDVGNDYGLKEVVSGNVFVHVVDGDHYSFIHDDGVDKTVSIITDAFNALTVC
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.3	Very low	33	Very low	242 Å²	242	158.1 Å²	158.1	100%	1.192	80%	0.797	S	S	*	*				0	154.1	0	-86.8	-167.5	-178.7	0	0	108.6
2	P	35.2	Very low	32.9	Very low	122 Å²	122	151.2 Å²	151.2	79%	0.792	78%	0.783	S	S	*	*			cis	-113.3	167.6	15.6	39.2	-30.2	0	0	0	115.6
3	I	49.1	Very low	32.6	Very low	164 Å²	164	151.5 Å²	151.5	84%	0.841	79%	0.787	S	S	*	*			trans	-119.6	129.8	159.1	-65.8	175.3	0	0	0	107.2
4	K	32.4	Very low	32.4	Very low	191 Å²	191	145.5 Å²	145.5	83%	0.83	78%	0.78	S	S	*	*			trans	168.5	145.9	163.4	-99.6	174	-177.4	-173.5	0	106.4
5	T	30.2	Very low	32.2	Very low	104 Å²	104	144.4 Å²	144.4	64%	0.638	78%	0.78	S	S	*	*			cis	-152.6	128.2	9.9	11.3	0	0	0	0	106.6
6	E	31.5	Very low	32	Very low	174 Å²	174	143 Å²	143	81%	0.813	78%	0.783	S	S	*	*				82.5	158.2	88.2	-75.8	-170	151.2	0	0	117
7	K	30.1	Very low	32.8	Very low	163 Å²	163	141.7 Å²	141.7	71%	0.709	78%	0.783	S	S	*	*			trans	84.7	141.2	170.2	-66.3	-175.6	166.1	-74.3	0	118.3
8	E	29.2	Very low	32.5	Very low	149 Å²	149	140.6 Å²	140.6	70%	0.696	78%	0.783	S	S	*	*			cis	-166.4	153.6	-17.4	-126	160.2	-166.6	0	0	112
9	G	28.5	Very low	32.9	Very low	66 Å²	66	142.5 Å²	142.5	68%	0.68	79%	0.786	S	S	*	*			trans	130.2	113.6	165.9	0	0	0	0	0	113.8
10	R	29	Very low	33.1	Very low	224 Å²	224	141.7 Å²	141.7	85%	0.845	79%	0.787	S	S	*	*			cis	76.8	136.5	46.1	-64	-169	173.2	-167.1	-0.2	113.3
11	L	28.9	Very low	32.8	Very low	140 Å²	140	146.2 Å²	146.2	73%	0.733	79%	0.793	S	S	*	*			cis	-165.2	170.3	9.4	-126	171.3	0	0	0	112.7
12	A	31.5	Very low	32.1	Very low	75 Å²	75	144 Å²	144	62%	0.62	78%	0.779	S	S	*	*			trans	72.7	150.9	149.1	0	0	0	0	0	119.7
13	N	29.6	Very low	31.7	Very low	156 Å²	156	149 Å²	149	83%	0.834	78%	0.782	S	S	*	*			cis	-164.3	163	-14.7	-99	-13.3	0	0	0	107.6
14	G	29.9	Very low	31	Very low	67 Å²	67	148 Å²	148	69%	0.691	78%	0.778	S	S	*	*			cis	-166.5	-159.5	-0.8	0	0	0	0	0	107.6
15	T	29.4	Very low	30.7	Very low	129 Å²	129	145.1 Å²	145.1	79%	0.791	78%	0.777	S	S	*	*			cis	-158.9	127.2	2.6	45	0	0	0	0	106.9
16	C	28.9	Very low	30.9	Very low	122 Å²	122	145 Å²	145	82%	0.824	78%	0.78	S	S	*	*				58.6	148.3	77.4	-65.4	0	0	0	0	116.2
17	P	44.7	Very low	30.8	Very low	121 Å²	121	142.8 Å²	142.8	79%	0.786	78%	0.784	S	S	*	*			cis	-124	-140.5	-23.6	39.6	-19.1	0	0	0	109.9
18	P	27.7	Very low	30.7	Very low	121 Å²	121	138.4 Å²	138.4	79%	0.786	79%	0.785	S	S	*	*			cis	-134.5	-156.4	-19.3	41.9	-20.4	0	0	0	115.1
19	E	40.4	Very low	30.7	Very low	178 Å²	178	140.7 Å²	140.7	83%	0.832	80%	0.796	S	S	*	*			trans	-84	167.1	168.4	-62.1	-169.4	157.8	0	0	112.8
20	P	36.1	Very low	30.8	Very low	125 Å²	125	142.5 Å²	142.5	81%	0.812	80%	0.798	S	S	*	*			cis	-150.1	-154.8	48.4	44.1	-19.9	0	0	0	117.8
21	W	27.8	Very low	31.2	Very low	238 Å²	238	137.3 Å²	137.3	90%	0.902	79%	0.791	S	S	*	*			trans	-74.5	156.3	-172.3	-48.2	-28.4	0	0	0	117
22	E	23.8	Very low	31.4	Very low	194 Å²	194	136.4 Å²	136.4	91%	0.907	79%	0.787	S	S	*	*				169.9	-168.7	122.8	-91.2	-166	160.6	0	0	114.6
23	R	28.2	Very low	31.6	Very low	228 Å²	228	142.5 Å²	142.5	86%	0.86	80%	0.795	S	S	*	*			trans	-143.3	151.5	-157.5	-110.9	-175.1	-178.6	-178.9	1.8	116.1
24	L	32.7	Very low	31.6	Very low	144 Å²	144	139.8 Å²	139.8	75%	0.754	79%	0.789	S	S	*	*			trans	83.4	157.4	144.9	-74.7	166	0	0	0	123.8
25	T	27.7	Very low	31.5	Very low	130 Å²	130	143.4 Å²	143.4	80%	0.798	79%	0.792	S	S	*	*			trans	83.9	145.5	168.6	70.5	0	0	0	0	119.4
26	S	32.4	Very low	31.4	Very low	100 Å²	100	143 Å²	143	70%	0.699	79%	0.79	S	S	*	*			cis	-174.8	151.5	-49.6	42.6	0	0	0	0	112.5
27	S	30.4	Very low	31.5	Very low	129 Å²	129	141.8 Å²	141.8	90%	0.902	78%	0.783	S	S	*	*			trans	64.5	143.6	176.6	69.1	0	0	0	0	116.2
28	G	28.6	Very low	30.9	Very low	71 Å²	71	142.3 Å²	142.3	73%	0.732	78%	0.783	S	S	*	*			cis	156.7	163.6	2.3	0	0	0	0	0	108.3
29	E	28.3	Very low	30.8	Very low	197 Å²	197	144.1 Å²	144.1	92%	0.921	79%	0.787	S	S	*	*			cis	-155.3	166.2	-6.4	-55.6	-174.9	109.4	0	0	105.5
30	S	31.2	Very low	30.1	Very low	104 Å²	104	141.2 Å²	141.2	73%	0.727	79%	0.786	S	S	*	*			cis	-139.1	-150.9	0.9	55.2	0	0	0	0	107.3
31	T	37	Very low	29.7	Very low	115 Å²	115	142.2 Å²	142.2	71%	0.706	79%	0.789	S	S	*	*			cis	-167.2	148	-4.6	9	0	0	0	0	104.2
32	D	34.1	Very low	29.6	Very low	120 Å²	120	138.1 Å²	138.1	64%	0.642	79%	0.785	S	S	*	*			cis	-163.3	172.3	-12.9	-147.9	-28.4	0	0	0	109.6
33	Y	35.4	Very low	30.4	Very low	204 Å²	204	136.6 Å²	136.6	80%	0.8	78%	0.78	S	S	*	*			trans	58.6	129.3	173.7	-58	-76.9	0	0	0	119.4
34	S	29.2	Very low	30.4	Very low	99 Å²	99	133.1 Å²	133.1	69%	0.692	78%	0.778	S	S	*	*			cis	-168.9	127.3	-23.8	48.5	0	0	0	0	113.5
35	N	27	Very low	30	Very low	143 Å²	143	133.9 Å²	133.9	77%	0.765	78%	0.783	S	S	*	*			trans	68.7	115.1	141.1	-82.3	5.6	0	0	0	127
36	T	28.4	Very low	30.4	Very low	120 Å²	120	134.6 Å²	134.6	74%	0.736	79%	0.787	S	S	*	*				62.8	162.1	124.9	61.5	0	0	0	0	123.8
37	S	30.7	Very low	30	Very low	97 Å²	97	134.7 Å²	134.7	68%	0.678	79%	0.788	S	S	*	*			cis	-178.4	-171	-32.8	70.6	0	0	0	0	111.2
38	T	32.3	Very low	29.7	Very low	131 Å²	131	136.6 Å²	136.6	80%	0.804	79%	0.788	S	S	*	*			trans	81.4	127.7	180	71	0	0	0	0	115.5
39	N	25.9	Very low	29.3	Very low	160 Å²	160	136.3 Å²	136.3	86%	0.856	79%	0.785	S	S	*	*			cis	83.8	124.7	11.8	-108.8	20.6	0	0	0	118.8
40	S	25.5	Very low	29.4	Very low	116 Å²	116	135.9 Å²	135.9	81%	0.811	78%	0.783	S	S	*	*			trans	-95	163.2	171.4	52.7	0	0	0	0	112.3
41	V	26.7	Very low	28.9	Very low	146 Å²	146	141.4 Å²	141.4	89%	0.885	79%	0.788	S	S	*	*			trans	-132.9	149.1	-177.5	-179.6	0	0	0	0	110.5
42	N	25.8	Very low	28.3	Very low	153 Å²	153	141.4 Å²	141.4	82%	0.818	78%	0.782	S	S	*	*			trans	-101.7	169.1	-172.5	-159.2	3.9	0	0	0	112.6
43	M	41.9	Very low	28	Very low	162 Å²	162	144.6 Å²	144.6	80%	0.798	79%	0.794	S	S	*	*			trans	-75.2	168.7	-178.3	-66.8	-176.3	173	0	0	114.4
44	N	27.3	Very low	27.4	Very low	154 Å²	154	139.5 Å²	139.5	82%	0.824	79%	0.788	S	S	*	*			trans	81	82.7	167.2	-55.5	-18.8	0	0	0	117.5
45	D	25	Very low	27.4	Very low	160 Å²	160	139.6 Å²	139.6	86%	0.856	79%	0.789	S	S	*	*				-149.9	144.5	112.3	-133.1	-23.5	0	0	0	109.9
46	V	34.6	Very low	27.4	Very low	146 Å²	146	139.1 Å²	139.1	89%	0.885	79%	0.791	S	S	*	*			trans	-135.8	80.6	-175.2	-173.4	0	0	0	0	109.8
47	S	24.1	Very low	27.5	Very low	102 Å²	102	139.2 Å²	139.2	71%	0.713	79%	0.787	S	S	*	*			trans	-106.7	149	-177.7	60.3	0	0	0	0	112.8
48	D	23.9	Very low	27.3	Very low	168 Å²	168	141.4 Å²	141.4	90%	0.898	79%	0.791	S	S	*	*			trans	-53.2	137.7	172.4	-70.3	-70.1	0	0	0	113.2
49	G	22.1	Very low	27	Very low	65 Å²	65	142.2 Å²	142.2	67%	0.67	80%	0.795	S	S	*	*			trans	-137.8	53.8	-168.8	0	0	0	0	0	114.6	W51	G49-W51 PolarHBondContact O-N 3.31Å; G49-W51 VanDerWaalsContact O-N 3.1Å
50	Q	29.4	Very low	26.9	Very low	188 Å²	188	140 Å²	140	88%	0.879	79%	0.787	S	S	*	*			trans	-65.9	102.5	166.4	-76.4	-171.7	-33.5	0	0	110.9
51	W	21.5	Very low	27	Very low	221 Å²	221	143.7 Å²	143.7	84%	0.837	79%	0.792	S	S	*	*			trans	-134.3	87.7	165.4	-76.6	96.2	0	0	0	112.8	G49	G49-W51 PolarHBondContact O-N 3.31Å; G49-W51 VanDerWaalsContact O-N 3.1Å
52	I	24.2	Very low	26.9	Very low	114 Å²	114	141.9 Å²	141.9	59%	0.585	79%	0.786	S	S	*	*			trans	45.1	104.5	130.4	-58	-179.4	0	0	0	114.4	S54	I52-S54 PolarHBondContact O-N 3.34Å
53	Q	26.5	Very low	27.2	Very low	188 Å²	188	144.2 Å²	144.2	88%	0.879	79%	0.792	S	S	*	*				50.1	36.8	54.3	-149.4	-173.8	12.2	0	0	114	S55	Q53-S55 PolarHBondContact O-N 3.3Å
54	S	22.6	Very low	26.4	Very low	97 Å²	97	141.9 Å²	141.9	68%	0.678	79%	0.786	S	S	*	*			trans	-77.8	72.6	171	53.4	0	0	0	0	111.3	I52 V56	I52-S54 PolarHBondContact O-N 3.34Å; S54-V56 PolarHBondContact O-N 2.97Å
55	S	30	Very low	26.7	Very low	101 Å²	101	139.9 Å²	139.9	71%	0.706	78%	0.784	S	S	*	*			trans	-64.1	113.6	162.9	54.4	0	0	0	0	109.4	Q53	Q53-S55 PolarHBondContact O-N 3.3Å
56	V	26.7	Very low	26.9	Very low	133 Å²	133	140.7 Å²	140.7	81%	0.806	78%	0.781	S	S	*	*			trans	-121.3	112	166.6	180	0	0	0	0	107	S54	S54-V56 PolarHBondContact O-N 2.97Å
57	N	30.7	Very low	26.8	Very low	122 Å²	122	143.1 Å²	143.1	65%	0.652	78%	0.782	S	S	*	*			trans	-78.4	177.8	174	-64.1	-10.1	0	0	0	110.8
58	D	26.1	Very low	27.2	Very low	143 Å²	143	143.3 Å²	143.3	77%	0.765	78%	0.783	S	S	*	*			trans	61.8	82.5	148.9	-52.2	-35	0	0	0	117.5
59	V	26.1	Very low	27.7	Very low	148 Å²	148	143.9 Å²	143.9	90%	0.897	78%	0.781	S	S	*	*				-124.8	123.1	129.3	-177.8	0	0	0	0	109.4
60	T	25	Very low	28.7	Very low	113 Å²	113	149.9 Å²	149.9	69%	0.693	79%	0.791	S	S	*	*			trans	-63.6	148.3	177.7	47.2	0	0	0	0	113.8	S62	T60-S62 PolarHBondContact O-N 3.4Å
61	E	26.7	Very low	29.7	Very low	194 Å²	194	147.4 Å²	147.4	91%	0.907	79%	0.789	S	S	*	*			trans	8	100.3	138.9	-58	-179.5	130.1	0	0	116.9
62	S	24.9	Very low	31.5	Very low	108 Å²	108	142.6 Å²	142.6	76%	0.755	78%	0.778	S	S	*	*			trans	-132.5	110.2	152.2	68.2	0	0	0	0	109.1	T60 V64	T60-S62 PolarHBondContact O-N 3.4Å; S62-V64 PolarHBondContact O-N 3.24Å
63	Q	31.3	Very low	33.6	Very low	201 Å²	201	139 Å²	139	94%	0.939	76%	0.762	S	S	*	*			trans	-67.3	119.8	-178.4	-66.7	173	-28.7	0	0	111
64	V	25.8	Very low	36.2	Very low	113 Å²	113	137.6 Å²	137.6	69%	0.685	75%	0.748	S	S	*	*			trans	-126.1	109.2	153.3	-177.4	0	0	0	0	107	S62 F66	S62-V64 PolarHBondContact O-N 3.24Å; V64-F66 HydrophobicContact CG1-CD2 3.87Å; V64-F66 HydrophobicContact CG1-CE2 3.81Å; V64-F66 PolarHBondContact O-N 3.21Å
65	S	33.9	Very low	38.9	Very low	112 Å²	112	134.5 Å²	134.5	78%	0.783	72%	0.722	S	S	*	*			trans	-72	113.8	173.4	50.9	0	0	0	0	109.8
66	F	28.7	Very low	40.9	Very low	178 Å²	178	135.3 Å²	135.3	78%	0.781	71%	0.713	S	S	*	*			trans	-111.5	110.8	156.3	-90.4	-82.1	0	0	0	108.8	V64 S68	V64-F66 HydrophobicContact CG1-CD2 3.87Å; V64-F66 HydrophobicContact CG1-CE2 3.81Å; V64-F66 PolarHBondContact O-N 3.21Å; F66-S68 PolarHBondContact O-N 3.1Å
67	E	32.4	Very low	43.2	Very low	197 Å²	197	133 Å²	133	92%	0.921	72%	0.715	S	S	*	*			trans	-67.1	105.4	157	-63.1	173.2	142	0	0	106.1
68	S	32.9	Very low	45.9	Very low	105 Å²	105	131.4 Å²	131.4	73%	0.734	70%	0.704	S	S	*	*			trans	-105.5	131.2	-179.9	61.2	0	0	0	0	110.4	F66	F66-S68 PolarHBondContact O-N 3.1Å
69	E	34.1	Very low	48.7	Very low	180 Å²	180	129.1 Å²	129.1	84%	0.841	69%	0.689	S	S	*	*			trans	-55.5	153.6	-177.9	-59.4	172	125.7	0	0	112.8	T71	E69-T71 PolarHBondContact O-N 2.86Å
70	E	43.7	Very low	51.8	Low	191 Å²	191	125.6 Å²	125.6	89%	0.893	67%	0.665	S	S	*	*			trans	-63.9	95.2	173.1	-68.3	-170.3	130.2	0	0	110.2	M72	E70-M72 PolarHBondContact O-N 2.97Å
71	T	49.5	Very low	55.1	Low	136 Å²	136	120.5 Å²	120.5	83%	0.834	63%	0.633	S	S	*	*			trans	-60.1	108	177.6	53	0	0	0	0	109.9	E69	E69-T71 PolarHBondContact O-N 2.86Å
72	M	60.1	Low	58.4	Low	121 Å²	121	111.3 Å²	111.3	60%	0.596	59%	0.59	S	S	*	*			trans	-58.8	144.7	173.1	-70.3	-150.3	-67.4	0	0	110.5	E70 K76	E70-M72 PolarHBondContact O-N 2.97Å; M72-K76 HydrophobicContact CB-CB 4.32Å; M72-K76 HydrophobicContact CB-CD 4.11Å; M72-K76 HydrophobicContact CG-CD 4.19Å; M72-K76 HydrophobicContact SD-CD 3.59Å; M72-K76 VanDerWaalsContact SD-CD 3.59Å; M72-K76 VanDerWaalsContact SD-CE 3.51Å; M72-K76 HydrophobicContact SD-CG 4.08Å
73	P	67.4	Low	61.9	Low	38 Å²	38	106.2 Å²	106.2	25%	0.247	55%	0.554	C	S	.	*			trans	-52.9	143.5	176.2	-22.8	29.6	0	0	0	111.8	W75 K76 E356	P73-W75 HydrophobicContact CB-CD2 4.04Å; P73-W75 HydrophobicContact CB-CE3 4.13Å; P73-W75 HydrophobicContact CB-CH2 3.56Å; P73-W75 HydrophobicContact CB-CZ2 3.43Å; P73-W75 VanDerWaalsContact CB-CZ2 3.43Å; P73-W75 HydrophobicContact CB-CZ3 3.9Å; P73-W75 HydrophobicContact CG-CZ2 4.24Å; P73-W75 PolarHBondContact O-N 2.83Å; P73-K76 HydrophobicContact CB-CB 4.41Å; P73-K76 VanDerWaalsContact O-CB 3.23Å; P73-K76 WeakPolarHBondContact O-CB 3.23Å; P73-K76 PolarHBondContact O-N 2.99Å; P73-E356 WeakPolarHBondContact CG-O 3.38Å
74	W	81.8	Confident	64.9	Low	158 Å²	158	96.6 Å²	96.6	60%	0.598	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-16.6	-164.7	65.5	-100	0	0	0	115.2	R253 K254	W74-R253 HydrophobicContact CH2-CB 3.62Å; W74-R253 HydrophobicContact CZ3-CB 4.08Å; W74-R253 WeakPolarHBondContact CZ3-O 3.45Å; W74-K254 HydrophobicContact CH2-CG 3.83Å; W74-K254 HydrophobicContact CZ2-CG 4.48Å
75	W	79.5	Confident	68.3	Low	32 Å²	32	91.2 Å²	91.2	12%	0.121	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-4.7	173.1	60.8	90.6	0	0	0	114	P73 G77 Q78 R253 H325 E356	P73-W75 HydrophobicContact CB-CD2 4.04Å; P73-W75 HydrophobicContact CB-CE3 4.13Å; P73-W75 HydrophobicContact CB-CH2 3.56Å; P73-W75 HydrophobicContact CB-CZ2 3.43Å; P73-W75 VanDerWaalsContact CB-CZ2 3.43Å; P73-W75 HydrophobicContact CB-CZ3 3.9Å; P73-W75 HydrophobicContact CG-CZ2 4.24Å; P73-W75 PolarHBondContact O-N 2.83Å; W75-G77 PolarHBondContact O-N 3.18Å; W75-Q78 HydrophobicContact CB-CG 4.37Å; W75-Q78 VanDerWaalsContact O-CB 3.3Å; W75-Q78 WeakPolarHBondContact O-CB 3.25Å; W75-Q78 WeakPolarHBondContact O-CG 3.29Å; W75-Q78 PolarHBondContact O-N 3.29Å; W75-R253 HydrophobicContact CB-CB 4.45Å; W75-R253 HydrophobicContact CB-CG 4.14Å; W75-H325 AromaticContact CE2-CE1 3.4Å; W75-H325 VanDerWaalsContact CE2-CE1 3.4Å; W75-H325 AromaticContact CE2-NE2 3.92Å; W75-H325 AromaticContact CH2-NE2 2.99Å; W75-H325 WeakPolarHBondContact CH2-NE2 3.49Å; W75-H325 AromaticContact CZ2-CE1 3.25Å; W75-H325 WeakPolarHBondContact CZ2-CE1 3.21Å; W75-H325 AromaticContact CZ2-ND1 3.57Å; W75-H325 AromaticContact CZ2-NE2 3.02Å; W75-H325 WeakPolarHBondContact CZ2-NE2 3.44Å; W75-H325 AromaticContact CZ3-NE2 3.9Å; W75-H325 AromaticContact NE1-CE1 3.5Å; W75-H325 PolarHBondContact NE1-CE1 3.26Å; W75-E356 HydrophobicContact CH2-CG 3.53Å; W75-E356 WeakPolarHBondContact CH2-OE1 3.28Å; W75-E356 HydrophobicContact CZ2-CG 3.78Å
76	K	72.7	Confident	71.3	Confident	119 Å²	119	85.9 Å²	85.9	52%	0.517	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	99.1	-173.8	-171.6	170.9	173.8	-168.2	0	110.2	M72 P73	M72-K76 HydrophobicContact CB-CB 4.32Å; M72-K76 HydrophobicContact CB-CD 4.11Å; M72-K76 HydrophobicContact CG-CD 4.19Å; M72-K76 HydrophobicContact SD-CD 3.59Å; M72-K76 VanDerWaalsContact SD-CD 3.59Å; M72-K76 VanDerWaalsContact SD-CE 3.51Å; M72-K76 HydrophobicContact SD-CG 4.08Å; P73-K76 HydrophobicContact CB-CB 4.41Å; P73-K76 VanDerWaalsContact O-CB 3.23Å; P73-K76 WeakPolarHBondContact O-CB 3.23Å; P73-K76 PolarHBondContact O-N 2.99Å
77	G	74.9	Confident	74.6	Confident	83 Å²	83	77.4 Å²	77.4	86%	0.856	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	128.8	-10.3	-168.5	0	0	0	0	0	113.2	W75	W75-G77 PolarHBondContact O-N 3.18Å
78	Q	85.8	Confident	77.7	Confident	90 Å²	90	68 Å²	68	42%	0.421	36%	0.359	S	S	.	.	S	Bend	trans	-72.9	168.8	162.9	-61.3	-177.7	-13.3	0	0	111.3	W75 R253	W75-Q78 HydrophobicContact CB-CG 4.37Å; W75-Q78 VanDerWaalsContact O-CB 3.3Å; W75-Q78 WeakPolarHBondContact O-CB 3.25Å; W75-Q78 WeakPolarHBondContact O-CG 3.29Å; W75-Q78 PolarHBondContact O-N 3.29Å; Q78-R253 PolarHBondContact NE2-O 2.89Å; Q78-R253 PolarHBondContact OE1-O 2.81Å
79	E	86	Confident	80.7	Confident	95 Å²	95	64 Å²	64	44%	0.444	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-65.7	148.9	173.9	-66.5	-172.9	-175.7	0	0	112.8	K312 V313 S314	E79-K312 HydrophobicContact CB-CB 4.46Å; E79-K312 WeakPolarHBondContact OE2-CB 3.23Å; E79-V313 HydrophobicContact CB-CG1 4.42Å; E79-S314 WeakPolarHBondContact OE1-CB 3.39Å; E79-S314 PolarHBondContact OE1-OG 2.64Å; E79-S314 WeakPolarHBondContact OE2-CB 3.19Å; E79-S314 PolarHBondContact OE2-N 3.41Å; E79-S314 PolarHBondContact OE2-OG 2.91Å
80	D	90.7	Very high	83.7	Confident	74 Å²	74	55.5 Å²	55.5	40%	0.396	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-61.4	135.5	171	-91.8	-22.2	0	0	0	110.8	V313 T322 R482	D80-V313 HydrophobicContact CB-CB 4.35Å; D80-V313 HydrophobicContact CB-CG1 4.15Å; D80-V313 WeakPolarHBondContact O-CB 3.34Å; D80-V313 PolarHBondContact O-N 2.82Å; D80-T322 HydrophobicContact CB-CG2 3.81Å; D80-R482 IonicContact OD1-NH2 3.72Å; D80-R482 IonicContact OD2-CZ 2.73Å; D80-R482 IonicContact OD2-NH2 2.73Å; D80-R482 PolarHBondContact OD2-NH2 3.5Å
81	I	95.3	Very high	86.2	Confident	6 Å²	6	46.4 Å²	46.4	3%	0.031	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	128.1	172.3	-63.7	169.4	0	0	0	108	V249 I252 R253 L310 Q311 T322 V323	I81-V249 HydrophobicContact CD1-CG1 4.11Å; I81-I252 HydrophobicContact CD1-CB 3.88Å; I81-I252 HydrophobicContact CD1-CG2 3.68Å; I81-I252 HydrophobicContact CG1-CG2 3.91Å; I81-I252 HydrophobicContact CG2-CD1 4.3Å; I81-R253 HydrophobicContact CD1-CG 3.85Å; I81-L310 HydrophobicContact CG2-CB 4.39Å; I81-Q311 WeakPolarHBondContact CA-O 3.02Å; I81-T322 WeakPolarHBondContact O-CA 3.38Å; I81-T322 WeakPolarHBondContact O-CG2 3.38Å; I81-V323 PolarHBondContact O-N 3.1Å
82	V	95.6	Very high	88.4	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	145.9	-176.6	-63.1	0	0	0	0	111.8	S84 L310 Q311 V313 A316 S319 A321	V82-S84 PolarHBondContact O-N 2.94Å; V82-L310 WeakPolarHBondContact O-CA 3.41Å; V82-Q311 PolarHBondContact N-O 3.43Å; V82-Q311 PolarHBondContact O-N 2.79Å; V82-V313 HydrophobicContact CG1-CB 4.13Å; V82-V313 HydrophobicContact CG1-CG2 4.1Å; V82-A316 HydrophobicContact CG2-CB 3.5Å; V82-A316 VanDerWaalsContact CG2-CB 3.5Å; V82-S319 WeakPolarHBondContact CG1-OG 2.99Å; V82-A321 CarbonylContact C-O 3.57Å; V82-A321 VanDerWaalsContact CA-O 3.29Å; V82-A321 WeakPolarHBondContact CA-O 3.4Å
83	I	97.3	Very high	90.1	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	107.4	164.2	-51.9	173.1	0	0	0	106.7	I308 L310 Y320 A321 V323 I418 L422 L481	I83-I308 HydrophobicContact CD1-CD1 4.15Å; I83-I308 HydrophobicContact CG1-CD1 4.32Å; I83-I308 HydrophobicContact CG2-CB 3.95Å; I83-I308 HydrophobicContact CG2-CD1 4.23Å; I83-I308 HydrophobicContact CG2-CG2 4.26Å; I83-L310 HydrophobicContact CB-CD2 4.43Å; I83-L310 HydrophobicContact CG1-CD2 3.75Å; I83-Y320 PolarHBondContact O-N 3.02Å; I83-A321 HydrophobicContact CD1-CB 4.44Å; I83-A321 PolarHBondContact N-O 2.92Å; I83-V323 HydrophobicContact CD1-CG2 4.04Å; I83-V323 HydrophobicContact CG1-CG2 3.63Å; I83-I418 HydrophobicContact CD1-CG2 3.89Å; I83-L422 HydrophobicContact CB-CD1 4.47Å; I83-L422 HydrophobicContact CD1-CD2 4.22Å; I83-L422 HydrophobicContact CG2-CD1 3.74Å; I83-L481 HydrophobicContact CD1-CD1 4.35Å; I83-L481 HydrophobicContact CD1-CD2 4.08Å
84	S	95.2	Very high	91.3	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	-32.3	-172.8	57.6	0	0	0	0	113.6	V82 A170 F309 Q311 R318 Y320	V82-S84 PolarHBondContact O-N 2.94Å; S84-A170 WeakPolarHBondContact O-CA 3.46Å; S84-A170 WeakPolarHBondContact OG-CB 3.17Å; S84-F309 PolarHBondContact N-O 2.83Å; S84-F309 PolarHBondContact OG-O 2.81Å; S84-Q311 VanDerWaalsContact CB-OE1 3.31Å; S84-Q311 PolarHBondContact OG-OE1 3.4Å; S84-R318 VanDerWaalsContact CA-O 3.27Å; S84-R318 WeakPolarHBondContact CA-O 3.25Å; S84-R318 WeakPolarHBondContact CB-O 3.42Å; S84-R318 WeakPolarHBondContact O-CB 3.27Å; S84-R318 WeakPolarHBondContact O-CD 3.41Å; S84-R318 VanDerWaalsContact O-CG 3.23Å; S84-R318 WeakPolarHBondContact O-CG 3.48Å; S84-Y320 WeakPolarHBondContact O-CE2 3.47Å
85	G	96	Very high	91.9	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	154.4	-178.8	0	0	0	0	0	113.5	A166 D169 I308 F309	G85-A166 WeakPolarHBondContact CA-O 3.44Å; G85-D169 WeakPolarHBondContact CA-OD2 3.44Å; G85-I308 CarbonylContact O-C 3.52Å; G85-I308 VanDerWaalsContact O-CA 3.28Å; G85-I308 WeakPolarHBondContact O-CA 3.46Å; G85-F309 PolarHBondContact O-N 3.05Å
86	I	97.5	Very high	92.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	144.9	178.9	-177	161.1	0	0	0	112.6	M96 D169 A307 I308 Y320 A419 L422 M929 S931	I86-M96 HydrophobicContact CD1-CE 3.66Å; I86-M96 HydrophobicContact CD1-SD 4.12Å; I86-M96 HydrophobicContact CG1-CE 4Å; I86-M96 HydrophobicContact CG1-CG 4.48Å; I86-M96 HydrophobicContact CG1-SD 4.07Å; I86-M96 HydrophobicContact CG2-CE 4.14Å; I86-D169 PolarHBondContact N-OD2 3.14Å; I86-A307 WeakPolarHBondContact CA-O 3.41Å; I86-I308 HydrophobicContact CB-CG2 4.11Å; I86-I308 HydrophobicContact CD1-CG2 3.83Å; I86-I308 HydrophobicContact CG1-CG2 3.85Å; I86-Y320 HydrophobicContact CG2-CE2 3.97Å; I86-A419 HydrophobicContact CD1-CB 3.73Å; I86-L422 HydrophobicContact CB-CD1 4.16Å; I86-L422 HydrophobicContact CD1-CD1 3.83Å; I86-L422 HydrophobicContact CD1-CG 4.48Å; I86-L422 HydrophobicContact CG2-CD1 4.19Å; I86-M929 HydrophobicContact CG2-CE 4.13Å; I86-M929 HydrophobicContact CG2-SD 3.89Å; I86-S931 WeakPolarHBondContact O-CB 3.47Å; I86-S931 PolarHBondContact O-OG 3.45Å
87	S	98	Very high	93.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	163.3	156.4	-163.8	0	0	0	0	112.3	E165 A307 S931	S87-E165 VanDerWaalsContact CB-CB 3.48Å; S87-E165 WeakPolarHBondContact CB-OE2 3.32Å; S87-E165 PolarHBondContact OG-OE2 2.91Å; S87-A307 PolarHBondContact N-O 2.84Å; S87-A307 PolarHBondContact O-N 2.84Å; S87-A307 VanDerWaalsContact O-O 3.14Å; S87-S931 WeakPolarHBondContact OG-CB 3.3Å
88	A	97.3	Very high	94.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	162.1	179	0	0	0	0	0	113.7	L90 M96 I305 V306	A88-L90 HydrophobicContact CB-CD1 3.71Å; A88-L90 HydrophobicContact CB-CG 3.86Å; A88-M96 HydrophobicContact CB-CG 4.38Å; A88-M96 HydrophobicContact CB-SD 3.71Å; A88-I305 CarbonylContact C-O 3.6Å; A88-I305 WeakPolarHBondContact CA-O 3.44Å; A88-V306 HydrophobicContact CB-CB 4.37Å; A88-V306 HydrophobicContact CB-CG1 4.23Å; A88-V306 HydrophobicContact CB-CG2 4.01Å
89	R	97.2	Very high	95.1	Very high	21 Å²	21	20 Å²	20	8%	0.079	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	123.9	153.5	-59.5	-60.4	-178.4	-87.8	-9.4	107.4	D94 V131 I158 E161 V162 E165 I305	R89-D94 WeakPolarHBondContact CD-O 3.33Å; R89-D94 PolarHBondContact NE-O 2.84Å; R89-D94 VanDerWaalsContact NE-O 3.07Å; R89-D94 PolarHBondContact NH1-O 3.38Å; R89-V131 HydrophobicContact CB-CG1 4.01Å; R89-V131 HydrophobicContact CB-CG2 4.36Å; R89-I158 HydrophobicContact CB-CG2 3.93Å; R89-I158 HydrophobicContact CG-CG2 3.41Å; R89-I158 VanDerWaalsContact CG-CG2 3.41Å; R89-E161 IonicContact NH2-OE2 3.57Å; R89-V162 HydrophobicContact CG-CG1 4.05Å; R89-E165 IonicContact CZ-OE1 2.73Å; R89-E165 IonicContact CZ-OE2 3.64Å; R89-E165 IonicContact NH1-OE1 2.9Å; R89-E165 PolarHBondContact NH1-OE1 2.81Å; R89-E165 IonicContact NH1-OE2 3.37Å; R89-E165 PolarHBondContact NH1-OE2 3.14Å; R89-E165 IonicContact NH2-OE1 3.85Å; R89-E165 PolarHBondContact NH2-OE1 3.4Å; R89-E165 IonicContact NH2-OE2 2.69Å; R89-I305 PolarHBondContact N-O 2.75Å; R89-I305 PolarHBondContact O-N 2.89Å
90	L	97.2	Very high	95.6	Very high	1 Å²	1	16 Å²	16	1%	0.005	8%	0.08	C	C	.	.	B	Isolated β-bridge	trans	-135.5	172.9	-170.3	-70.6	169	0	0	0	109.5	A88 E92 S93 F99 V306 M406 A416	A88-L90 HydrophobicContact CB-CD1 3.71Å; A88-L90 HydrophobicContact CB-CG 3.86Å; L90-E92 PolarHBondContact O-N 3.45Å; L90-S93 PolarHBondContact N-O 2.93Å; L90-S93 PolarHBondContact O-N 3.44Å; L90-S93 VanDerWaalsContact O-O 3.1Å; L90-F99 HydrophobicContact CB-CD2 4.05Å; L90-F99 HydrophobicContact CB-CE2 4.29Å; L90-F99 HydrophobicContact CB-CG 4.44Å; L90-F99 HydrophobicContact CD1-CB 4.39Å; L90-F99 HydrophobicContact CD1-CD1 3.42Å; L90-F99 VanDerWaalsContact CD1-CD1 3.42Å; L90-F99 HydrophobicContact CD1-CD2 3.83Å; L90-F99 HydrophobicContact CD1-CE1 3.46Å; L90-F99 VanDerWaalsContact CD1-CE1 3.46Å; L90-F99 HydrophobicContact CD1-CE2 3.87Å; L90-F99 HydrophobicContact CD1-CG 3.62Å; L90-F99 HydrophobicContact CD1-CZ 3.69Å; L90-V306 HydrophobicContact CD2-CG2 3.91Å; L90-V306 HydrophobicContact CG-CG2 4.49Å; L90-M406 HydrophobicContact CD2-CE 3.94Å; L90-M406 HydrophobicContact CD2-SD 3.96Å; L90-A416 HydrophobicContact CD2-CB 4.37Å
91	P	96.3	Very high	95.8	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	129.3	-178.1	-29.5	39.6	0	0	0	111.9	S93 L109 K130 S302 E303 M406	P91-S93 PolarHBondContact O-N 3.12Å; P91-S93 PolarHBondContact O-OG 3.41Å; P91-L109 HydrophobicContact CB-CB 3.88Å; P91-L109 WeakPolarHBondContact CB-O 3.21Å; P91-K130 WeakPolarHBondContact CA-O 3.35Å; P91-S302 WeakPolarHBondContact CG-OG 3.36Å; P91-E303 WeakPolarHBondContact CD-O 3.3Å; P91-M406 HydrophobicContact CB-CB 4.47Å; P91-M406 HydrophobicContact CG-CB 4.07Å; P91-M406 HydrophobicContact CG-CE 3.95Å
92	E	95.7	Very high	95.8	Very high	32 Å²	32	19.4 Å²	19.4	15%	0.15	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	14.2	-172.7	-39.7	-46.5	156.3	0	0	116.5	L90 L109 T111 R115 K130 K132	L90-E92 PolarHBondContact O-N 3.45Å; E92-L109 HydrophobicContact CB-CD2 4.2Å; E92-L109 HydrophobicContact CG-CD2 4.48Å; E92-T111 HydrophobicContact CG-CG2 4.01Å; E92-T111 WeakPolarHBondContact OE1-CB 3.33Å; E92-T111 WeakPolarHBondContact OE1-CG2 3.26Å; E92-T111 PolarHBondContact OE1-OG1 3.36Å; E92-R115 VanDerWaalsContact CD-NH2 3.33Å; E92-R115 IonicContact OE1-CZ 3.26Å; E92-R115 IonicContact OE1-NH1 3.6Å; E92-R115 IonicContact OE1-NH2 2.87Å; E92-R115 PolarHBondContact OE1-NH2 3.37Å; E92-R115 IonicContact OE2-CZ 3.62Å; E92-R115 IonicContact OE2-NH1 3.65Å; E92-R115 PolarHBondContact OE2-NH1 3.39Å; E92-R115 IonicContact OE2-NH2 3Å; E92-R115 PolarHBondContact OE2-NH2 2.68Å; E92-R115 VanDerWaalsContact OE2-NH2 3.15Å; E92-K130 PolarHBondContact N-O 2.91Å; E92-K130 VanDerWaalsContact N-O 3.14Å; E92-K132 HydrophobicContact CB-CD 4.48Å; E92-K132 WeakPolarHBondContact O-CD 3.49Å
93	S	96	Very high	95.8	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.093	C	C	.	.	B	Isolated β-bridge	trans	-129	105.7	-171.9	-51.3	0	0	0	0	111.2	L90 P91 N95	L90-S93 PolarHBondContact N-O 2.93Å; L90-S93 PolarHBondContact O-N 3.44Å; L90-S93 VanDerWaalsContact O-O 3.1Å; P91-S93 PolarHBondContact O-N 3.12Å; P91-S93 PolarHBondContact O-OG 3.41Å; S93-N95 PolarHBondContact O-N 3.23Å
94	D	92.2	Very high	95.7	Very high	38 Å²	38	20.5 Å²	20.5	20%	0.203	10%	0.099	C	C	.	.	S	Bend	trans	-81.6	0.3	178.8	-73.4	-46	0	0	0	113.1	R89 E98 K132	R89-D94 WeakPolarHBondContact CD-O 3.33Å; R89-D94 PolarHBondContact NE-O 2.84Å; R89-D94 VanDerWaalsContact NE-O 3.07Å; R89-D94 PolarHBondContact NH1-O 3.38Å; D94-E98 PolarHBondContact N-OE2 2.97Å; D94-K132 WeakPolarHBondContact OD2-CD 3.47Å; D94-K132 WeakPolarHBondContact OD2-CE 3.39Å; D94-K132 IonicContact OD2-NZ 3.36Å; D94-K132 PolarHBondContact OD2-NZ 3.5Å
95	N	93.9	Very high	95.7	Very high	15 Å²	15	26.1 Å²	26.1	8%	0.08	13%	0.129	C	C	.	.	S	Bend	trans	-163.8	173.5	175.3	53.1	76	0	0	0	111.3	S93 Q97 E98 F99 P932	S93-N95 PolarHBondContact O-N 3.23Å; N95-Q97 VanDerWaalsContact C-N 3.3Å; N95-Q97 PolarHBondContact O-N 2.9Å; N95-Q97 WeakPolarHBondContact OD1-CB 3.42Å; N95-Q97 PolarHBondContact OD1-N 3.37Å; N95-Q97 VanDerWaalsContact OD1-N 3.08Å; N95-E98 PolarHBondContact ND2-OE1 3.28Å; N95-E98 PolarHBondContact OD1-N 3.01Å; N95-F99 PolarHBondContact O-N 3.23Å; N95-P932 HydrophobicContact CB-CB 4.09Å
96	M	95.3	Very high	95.6	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-66.5	-23.7	179.4	-74.7	-67	-64.6	0	0	114.6	I86 A88 A100 A419 I423 M929 P932	I86-M96 HydrophobicContact CD1-CE 3.66Å; I86-M96 HydrophobicContact CD1-SD 4.12Å; I86-M96 HydrophobicContact CG1-CE 4Å; I86-M96 HydrophobicContact CG1-CG 4.48Å; I86-M96 HydrophobicContact CG1-SD 4.07Å; I86-M96 HydrophobicContact CG2-CE 4.14Å; A88-M96 HydrophobicContact CB-CG 4.38Å; A88-M96 HydrophobicContact CB-SD 3.71Å; M96-A100 VanDerWaalsContact O-CB 3.3Å; M96-A100 WeakPolarHBondContact O-CB 3.46Å; M96-A100 PolarHBondContact O-N 2.91Å; M96-A419 HydrophobicContact CE-CB 4.07Å; M96-A419 HydrophobicContact SD-CB 4.25Å; M96-I423 HydrophobicContact CE-CD1 3.71Å; M96-I423 HydrophobicContact CE-CG1 3.84Å; M96-M929 HydrophobicContact CB-SD 3.61Å; M96-M929 HydrophobicContact CE-CE 3.82Å; M96-M929 HydrophobicContact CE-SD 3.79Å; M96-M929 HydrophobicContact CG-SD 4.1Å; M96-P932 HydrophobicContact CB-CG 4.12Å
97	Q	93.6	Very high	95.5	Very high	86 Å²	86	30.1 Å²	30.1	40%	0.402	16%	0.156	S	C	.	.	H	α-helix	trans	-74.5	-47.8	178.3	-179.4	66.1	28	0	0	110.7	N95 F99 A100 E101 P932	N95-Q97 VanDerWaalsContact C-N 3.3Å; N95-Q97 PolarHBondContact O-N 2.9Å; N95-Q97 WeakPolarHBondContact OD1-CB 3.42Å; N95-Q97 PolarHBondContact OD1-N 3.37Å; N95-Q97 VanDerWaalsContact OD1-N 3.08Å; Q97-F99 VanDerWaalsContact C-N 3.27Å; Q97-F99 PolarHBondContact O-N 3.33Å; Q97-A100 PolarHBondContact O-N 3.09Å; Q97-A100 VanDerWaalsContact O-N 3.14Å; Q97-E101 WeakPolarHBondContact CG-OE1 3.48Å; Q97-E101 PolarHBondContact NE2-OE1 3.08Å; Q97-E101 WeakPolarHBondContact O-CG 3.37Å; Q97-E101 PolarHBondContact O-N 2.98Å; Q97-P932 HydrophobicContact CB-CB 3.57Å; Q97-P932 HydrophobicContact CB-CG 3.74Å
98	E	95	Very high	95.3	Very high	48 Å²	48	32.6 Å²	32.6	22%	0.224	17%	0.169	C	C	.	.	H	α-helix	trans	-54.9	-44.6	172.1	-74.7	169.4	-140.9	0	0	111.1	D94 N95 A100 E101 H102 K132	D94-E98 PolarHBondContact N-OE2 2.97Å; N95-E98 PolarHBondContact ND2-OE1 3.28Å; N95-E98 PolarHBondContact OD1-N 3.01Å; E98-A100 PolarHBondContact O-N 3.07Å; E98-E101 PolarHBondContact O-N 2.89Å; E98-H102 WeakPolarHBondContact O-CB 3.49Å; E98-H102 PolarHBondContact O-CD2 3.43Å; E98-H102 PolarHBondContact O-N 3.21Å; E98-K132 IonicContact OE1-NZ 3.34Å; E98-K132 IonicContact OE2-NZ 3.42Å; E98-K132 PolarHBondContact OE2-NZ 3.37Å
99	F	96.9	Very high	95.3	Very high	1 Å²	1	32.8 Å²	32.8	0%	0.004	17%	0.17	C	C	.	.	H	α-helix	trans	-65.6	-37.8	177.9	-170.5	-122.8	0	0	0	112.9	L90 N95 Q97 L103 L109 V402 M406 A419 I423	L90-F99 HydrophobicContact CB-CD2 4.05Å; L90-F99 HydrophobicContact CB-CE2 4.29Å; L90-F99 HydrophobicContact CB-CG 4.44Å; L90-F99 HydrophobicContact CD1-CB 4.39Å; L90-F99 HydrophobicContact CD1-CD1 3.42Å; L90-F99 VanDerWaalsContact CD1-CD1 3.42Å; L90-F99 HydrophobicContact CD1-CD2 3.83Å; L90-F99 HydrophobicContact CD1-CE1 3.46Å; L90-F99 VanDerWaalsContact CD1-CE1 3.46Å; L90-F99 HydrophobicContact CD1-CE2 3.87Å; L90-F99 HydrophobicContact CD1-CG 3.62Å; L90-F99 HydrophobicContact CD1-CZ 3.69Å; N95-F99 PolarHBondContact O-N 3.23Å; Q97-F99 VanDerWaalsContact C-N 3.27Å; Q97-F99 PolarHBondContact O-N 3.33Å; F99-L103 HydrophobicContact CD1-CD1 3.74Å; F99-L103 HydrophobicContact CD1-CG 4.42Å; F99-L103 HydrophobicContact CD2-CD1 4.5Å; F99-L103 HydrophobicContact CD2-CG 4.34Å; F99-L103 HydrophobicContact CE1-CD1 3.37Å; F99-L103 HydrophobicContact CE1-CG 4.14Å; F99-L103 HydrophobicContact CE2-CD1 4.19Å; F99-L103 HydrophobicContact CE2-CD2 4.33Å; F99-L103 HydrophobicContact CE2-CG 4.04Å; F99-L103 HydrophobicContact CG-CD1 4.29Å; F99-L103 HydrophobicContact CZ-CD1 3.62Å; F99-L103 HydrophobicContact CZ-CD2 4.15Å; F99-L103 HydrophobicContact CZ-CG 3.94Å; F99-L103 VanDerWaalsContact O-CB 3.26Å; F99-L103 WeakPolarHBondContact O-CB 3.48Å; F99-L103 VanDerWaalsContact O-CG 3.26Å; F99-L103 WeakPolarHBondContact O-CG 3.41Å; F99-L103 PolarHBondContact O-N 3.23Å; F99-L109 HydrophobicContact CD2-CD1 4.03Å; F99-L109 HydrophobicContact CE2-CD1 4.02Å; F99-V402 HydrophobicContact CZ-CG2 3.86Å; F99-M406 HydrophobicContact CE2-CB 4.33Å; F99-M406 HydrophobicContact CE2-CG 4.31Å; F99-M406 HydrophobicContact CE2-SD 3.92Å; F99-M406 HydrophobicContact CZ-CG 4.42Å; F99-M406 HydrophobicContact CZ-SD 3.81Å; F99-A419 HydrophobicContact CE1-CB 4.28Å; F99-I423 HydrophobicContact CD1-CD1 3.68Å; F99-I423 HydrophobicContact CE1-CD1 4.26Å
100	A	94.9	Very high	95.2	Very high	12 Å²	12	32 Å²	32	10%	0.099	17%	0.167	C	C	.	.	H	α-helix	trans	-67.9	-40.1	176.2	0	0	0	0	0	112.7	M96 Q97 E98 L104 I423	M96-A100 VanDerWaalsContact O-CB 3.3Å; M96-A100 WeakPolarHBondContact O-CB 3.46Å; M96-A100 PolarHBondContact O-N 2.91Å; Q97-A100 PolarHBondContact O-N 3.09Å; Q97-A100 VanDerWaalsContact O-N 3.14Å; E98-A100 PolarHBondContact O-N 3.07Å; A100-L104 VanDerWaalsContact O-CB 3.32Å; A100-L104 WeakPolarHBondContact O-CB 3Å; A100-L104 VanDerWaalsContact O-CG 3.24Å; A100-L104 WeakPolarHBondContact O-CG 3.41Å; A100-L104 PolarHBondContact O-N 2.96Å; A100-I423 HydrophobicContact CB-CD1 3.88Å; A100-I423 HydrophobicContact CB-CG1 4.01Å; A100-I423 HydrophobicContact CB-CG2 3.72Å
101	E	95	Very high	95.1	Very high	99 Å²	99	33.8 Å²	33.8	46%	0.463	18%	0.178	S	C	.	.	H	α-helix	trans	-63.1	-52.1	175.3	-72.7	173.2	-165.6	0	0	110.5	Q97 E98 L103 L104 N105	Q97-E101 WeakPolarHBondContact CG-OE1 3.48Å; Q97-E101 PolarHBondContact NE2-OE1 3.08Å; Q97-E101 WeakPolarHBondContact O-CG 3.37Å; Q97-E101 PolarHBondContact O-N 2.98Å; E98-E101 PolarHBondContact O-N 2.89Å; E101-L103 PolarHBondContact O-N 3.48Å; E101-L104 PolarHBondContact O-N 3.04Å; E101-N105 WeakPolarHBondContact O-CB 3.45Å; E101-N105 PolarHBondContact O-N 3.46Å; E101-N105 PolarHBondContact O-ND2 3.43Å
102	H	96.3	Very high	94.9	Very high	52 Å²	52	38.3 Å²	38.3	24%	0.241	20%	0.199	C	C	.	.	H	α-helix	trans	-58.8	-46.3	177.3	-75.7	-47.9	0	0	0	113.4	E98 L104 N105 G106 D107 L109	E98-H102 WeakPolarHBondContact O-CB 3.49Å; E98-H102 PolarHBondContact O-CD2 3.43Å; E98-H102 PolarHBondContact O-N 3.21Å; H102-L104 PolarHBondContact O-N 3.13Å; H102-N105 PolarHBondContact O-N 3.23Å; H102-G106 PolarHBondContact O-N 3.36Å; H102-D107 WeakPolarHBondContact CA-OD2 3.34Å; H102-D107 HydrophobicContact CB-CB 4.14Å; H102-D107 IonicContact CE1-OD2 3.18Å; H102-D107 IonicContact CG-OD2 2.76Å; H102-D107 IonicContact ND1-OD2 3.18Å; H102-D107 PolarHBondContact ND1-OD2 2.68Å; H102-D107 PolarHBondContact O-N 2.96Å; H102-L109 HydrophobicContact CB-CD1 4.08Å; H102-L109 HydrophobicContact CB-CD2 3.77Å; H102-L109 HydrophobicContact CB-CG 4.39Å
103	L	96	Very high	94.6	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-59.8	-44.7	176.7	-82	177.8	0	0	0	112.3	F99 E101 G106 V402 N405 K420 I423 P431 P432	F99-L103 HydrophobicContact CD1-CD1 3.74Å; F99-L103 HydrophobicContact CD1-CG 4.42Å; F99-L103 HydrophobicContact CD2-CD1 4.5Å; F99-L103 HydrophobicContact CD2-CG 4.34Å; F99-L103 HydrophobicContact CE1-CD1 3.37Å; F99-L103 HydrophobicContact CE1-CG 4.14Å; F99-L103 HydrophobicContact CE2-CD1 4.19Å; F99-L103 HydrophobicContact CE2-CD2 4.33Å; F99-L103 HydrophobicContact CE2-CG 4.04Å; F99-L103 HydrophobicContact CG-CD1 4.29Å; F99-L103 HydrophobicContact CZ-CD1 3.62Å; F99-L103 HydrophobicContact CZ-CD2 4.15Å; F99-L103 HydrophobicContact CZ-CG 3.94Å; F99-L103 VanDerWaalsContact O-CB 3.26Å; F99-L103 WeakPolarHBondContact O-CB 3.48Å; F99-L103 VanDerWaalsContact O-CG 3.26Å; F99-L103 WeakPolarHBondContact O-CG 3.41Å; F99-L103 PolarHBondContact O-N 3.23Å; E101-L103 PolarHBondContact O-N 3.48Å; L103-G106 PolarHBondContact O-N 2.83Å; L103-V402 HydrophobicContact CD2-CG2 4.49Å; L103-N405 HydrophobicContact CD2-CB 3.7Å; L103-K420 HydrophobicContact CD1-CB 3.99Å; L103-K420 HydrophobicContact CD1-CG 3.95Å; L103-K420 HydrophobicContact CD2-CG 4.44Å; L103-I423 HydrophobicContact CD1-CD1 3.91Å; L103-P431 HydrophobicContact CB-CB 4.05Å; L103-P431 HydrophobicContact CB-CG 4.25Å; L103-P432 WeakPolarHBondContact O-CD 3.22Å
104	L	95	Very high	94.1	Very high	24 Å²	24	43.2 Å²	43.2	13%	0.126	23%	0.227	C	C	.	.	H	α-helix	trans	-77.7	-23.2	-176.2	-69.1	174.4	0	0	0	113.4	A100 E101 H102 T427 P431 K457	A100-L104 VanDerWaalsContact O-CB 3.32Å; A100-L104 WeakPolarHBondContact O-CB 3Å; A100-L104 VanDerWaalsContact O-CG 3.24Å; A100-L104 WeakPolarHBondContact O-CG 3.41Å; A100-L104 PolarHBondContact O-N 2.96Å; E101-L104 PolarHBondContact O-N 3.04Å; H102-L104 PolarHBondContact O-N 3.13Å; L104-T427 HydrophobicContact CD1-CG2 4.13Å; L104-P431 HydrophobicContact CD2-CB 4.48Å; L104-P431 HydrophobicContact CD2-CG 4.09Å; L104-K457 HydrophobicContact CB-CD 4.27Å; L104-K457 HydrophobicContact CD2-CD 4.22Å; L104-K457 HydrophobicContact CD2-CG 4.24Å
105	N	94.9	Very high	93.8	Very high	117 Å²	117	45.5 Å²	45.5	63%	0.626	23%	0.233	S	C	*	.	H	α-helix	trans	-75.9	-30.4	169.6	-67.4	-18.7	0	0	0	112.2	E101 H102 D107	E101-N105 WeakPolarHBondContact O-CB 3.45Å; E101-N105 PolarHBondContact O-N 3.46Å; E101-N105 PolarHBondContact O-ND2 3.43Å; H102-N105 PolarHBondContact O-N 3.23Å; N105-D107 PolarHBondContact ND2-OD2 3.19Å
106	G	93.4	Very high	93.5	Very high	22 Å²	22	46 Å²	46	23%	0.227	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	30.3	-172.2	0	0	0	0	0	113.5	H102 L103 L434	H102-G106 PolarHBondContact O-N 3.36Å; L103-G106 PolarHBondContact O-N 2.83Å; G106-L434 WeakPolarHBondContact O-CD2 3.49Å
107	D	95.6	Very high	93	Very high	63 Å²	63	46.6 Å²	46.6	34%	0.337	24%	0.235	S	C	.	.			trans	-72.6	138.3	179.3	-63.4	-41	0	0	0	111.5	H102 N105 L109	H102-D107 WeakPolarHBondContact CA-OD2 3.34Å; H102-D107 HydrophobicContact CB-CB 4.14Å; H102-D107 IonicContact CE1-OD2 3.18Å; H102-D107 IonicContact CG-OD2 2.76Å; H102-D107 IonicContact ND1-OD2 3.18Å; H102-D107 PolarHBondContact ND1-OD2 2.68Å; H102-D107 PolarHBondContact O-N 2.96Å; N105-D107 PolarHBondContact ND2-OD2 3.19Å; D107-L109 HydrophobicContact CB-CD2 4.27Å
108	D	94.5	Very high	92.5	Very high	51 Å²	51	47.5 Å²	47.5	27%	0.273	24%	0.24	S	C	.	.			trans	-87.4	110.3	173.9	176.9	-7.9	0	0	0	109.5	I110 R127 L434 H435	D108-I110 PolarHBondContact O-N 3.02Å; D108-I110 WeakPolarHBondContact OD1-CB 3.4Å; D108-I110 WeakPolarHBondContact OD1-CG1 3.3Å; D108-I110 PolarHBondContact OD1-N 3.3Å; D108-R127 IonicContact OD1-NH1 2.67Å; D108-R127 IonicContact OD1-NH2 2.78Å; D108-R127 PolarHBondContact OD1-NH2 3.44Å; D108-R127 IonicContact OD2-CZ 2.77Å; D108-R127 VanDerWaalsContact OD2-CZ 3.25Å; D108-R127 IonicContact OD2-NH1 3.79Å; D108-R127 PolarHBondContact OD2-NH1 2.39Å; D108-R127 IonicContact OD2-NH2 3.71Å; D108-R127 PolarHBondContact OD2-NH2 3.2Å; D108-L434 HydrophobicContact CB-CD1 3.9Å; D108-H435 IonicContact OD2-CE1 2.73Å; D108-H435 PolarHBondContact OD2-CE1 2.9Å; D108-H435 VanDerWaalsContact OD2-CE1 3.26Å; D108-H435 IonicContact OD2-NE2 3.06Å
109	L	96.8	Very high	92.2	Very high	5 Å²	5	46.8 Å²	46.8	3%	0.026	24%	0.239	C	C	.	.			trans	-88.8	17.4	-173.6	-52.5	174.5	0	0	0	112.8	P91 E92 F99 H102 D107 N405 M406	P91-L109 HydrophobicContact CB-CB 3.88Å; P91-L109 WeakPolarHBondContact CB-O 3.21Å; E92-L109 HydrophobicContact CB-CD2 4.2Å; E92-L109 HydrophobicContact CG-CD2 4.48Å; F99-L109 HydrophobicContact CD2-CD1 4.03Å; F99-L109 HydrophobicContact CE2-CD1 4.02Å; H102-L109 HydrophobicContact CB-CD1 4.08Å; H102-L109 HydrophobicContact CB-CD2 3.77Å; H102-L109 HydrophobicContact CB-CG 4.39Å; D107-L109 HydrophobicContact CB-CD2 4.27Å; L109-N405 PolarHBondContact N-O 3.48Å; L109-M406 HydrophobicContact CB-CB 4.36Å; L109-M406 HydrophobicContact CD1-CB 4.21Å
110	I	95.2	Very high	91.7	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.021	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	103.2	178.9	-58.8	-60	0	0	0	110.5	D108 R127 G287 V300 M406	D108-I110 PolarHBondContact O-N 3.02Å; D108-I110 WeakPolarHBondContact OD1-CB 3.4Å; D108-I110 WeakPolarHBondContact OD1-CG1 3.3Å; D108-I110 PolarHBondContact OD1-N 3.3Å; I110-R127 HydrophobicContact CG2-CB 3.41Å; I110-R127 VanDerWaalsContact CG2-CB 3.41Å; I110-R127 PolarHBondContact O-NE 2.82Å; I110-R127 VanDerWaalsContact O-NE 3.11Å; I110-R127 PolarHBondContact O-NH2 3.34Å; I110-G287 VanDerWaalsContact CG2-O 3.32Å; I110-G287 WeakPolarHBondContact CG2-O 3.49Å; I110-V300 HydrophobicContact CD1-CG1 4.29Å; I110-V300 HydrophobicContact CG2-CG1 4.09Å; I110-M406 WeakPolarHBondContact CD1-O 3.32Å
111	T	94	Very high	91.1	Very high	38 Å²	38	49 Å²	49	23%	0.233	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	149.9	-169.6	41.8	0	0	0	0	113.6	E92 D113 R115 R127 H128 K130	E92-T111 HydrophobicContact CG-CG2 4.01Å; E92-T111 WeakPolarHBondContact OE1-CB 3.33Å; E92-T111 WeakPolarHBondContact OE1-CG2 3.26Å; E92-T111 PolarHBondContact OE1-OG1 3.36Å; T111-D113 WeakPolarHBondContact CB-OD2 3.34Å; T111-D113 PolarHBondContact OG1-OD2 2.94Å; T111-D113 VanDerWaalsContact OG1-OD2 3.07Å; T111-R115 PolarHBondContact OG1-NH2 3.4Å; T111-R127 WeakPolarHBondContact O-CA 3.16Å; T111-H128 PolarHBondContact N-O 2.9Å; T111-H128 PolarHBondContact O-N 2.82Å; T111-H128 VanDerWaalsContact O-N 3.16Å; T111-K130 PolarHBondContact O-NZ 3.02Å; T111-K130 PolarHBondContact OG1-NZ 3.34Å
112	E	92.7	Very high	90.6	Very high	95 Å²	95	50.1 Å²	50.1	44%	0.444	26%	0.26	S	S	.	.			trans	-104.3	90.2	172.8	-173.3	171.2	135.3	0	0	109.7	P119 R126 R127	E112-P119 HydrophobicContact CG-CB 3.8Å; E112-P119 HydrophobicContact CG-CG 3.84Å; E112-R126 VanDerWaalsContact CD-NE 3.29Å; E112-R126 HydrophobicContact CG-CB 4.12Å; E112-R126 IonicContact OE1-CZ 3.6Å; E112-R126 IonicContact OE1-NE 2.7Å; E112-R126 PolarHBondContact OE1-NE 2.71Å; E112-R126 IonicContact OE1-NH2 3.52Å; E112-R126 PolarHBondContact OE1-NH2 3.39Å; E112-R126 WeakPolarHBondContact OE2-CB 3.46Å; E112-R126 IonicContact OE2-NE 2.78Å; E112-R126 PolarHBondContact OE2-NE 2.83Å; E112-R126 VanDerWaalsContact OE2-NE 3.13Å; E112-R127 HydrophobicContact CB-CG 4.3Å
113	D	88.4	Confident	90	Very high	31 Å²	31	49.5 Å²	49.5	17%	0.166	27%	0.268	C	S	.	.	S	Bend	trans	-154.9	165.2	-175.9	73.2	81.6	0	0	0	112.3	T111 R115 K130	T111-D113 WeakPolarHBondContact CB-OD2 3.34Å; T111-D113 PolarHBondContact OG1-OD2 2.94Å; T111-D113 VanDerWaalsContact OG1-OD2 3.07Å; D113-R115 VanDerWaalsContact CG-NE 3.32Å; D113-R115 PolarHBondContact O-N 3.15Å; D113-R115 WeakPolarHBondContact OD1-CB 3.21Å; D113-R115 WeakPolarHBondContact OD1-CG 3.23Å; D113-R115 IonicContact OD1-CZ 2.73Å; D113-R115 PolarHBondContact OD1-N 2.93Å; D113-R115 IonicContact OD1-NE 3.98Å; D113-R115 PolarHBondContact OD1-NE 3.44Å; D113-R115 IonicContact OD1-NH2 3.59Å; D113-R115 IonicContact OD2-CZ 3.88Å; D113-R115 IonicContact OD2-NE 2.76Å; D113-R115 PolarHBondContact OD2-NE 3.08Å; D113-R115 IonicContact OD2-NH2 2.71Å; D113-R115 PolarHBondContact OD2-NH2 2.81Å; D113-K130 IonicContact OD1-NZ 3.07Å; D113-K130 VanDerWaalsContact OD2-CE 3.23Å; D113-K130 WeakPolarHBondContact OD2-CE 3.5Å; D113-K130 IonicContact OD2-NZ 3.26Å; D113-K130 PolarHBondContact OD2-NZ 2.86Å
114	N	86.4	Confident	89.7	Confident	105 Å²	105	49.7 Å²	49.7	56%	0.561	27%	0.269	S	S	*	.	S	Bend	trans	-89.8	12.5	-169.7	-59.8	30.3	0	0	0	114.5	R116 W117 P119	N114-R116 PolarHBondContact O-N 2.96Å; N114-W117 WeakPolarHBondContact CA-O 3.09Å; N114-P119 WeakPolarHBondContact OD1-CD 3.29Å
115	R	85.9	Confident	89.5	Confident	86 Å²	86	49.2 Å²	49.2	33%	0.325	27%	0.267	S	S	.	.	S	Bend	trans	-62.8	-7.5	-174.8	-75.3	175.9	-67.9	175.1	-1	115.5	E92 T111 D113 K130	E92-R115 VanDerWaalsContact CD-NH2 3.33Å; E92-R115 IonicContact OE1-CZ 3.26Å; E92-R115 IonicContact OE1-NH1 3.6Å; E92-R115 IonicContact OE1-NH2 2.87Å; E92-R115 PolarHBondContact OE1-NH2 3.37Å; E92-R115 IonicContact OE2-CZ 3.62Å; E92-R115 IonicContact OE2-NH1 3.65Å; E92-R115 PolarHBondContact OE2-NH1 3.39Å; E92-R115 IonicContact OE2-NH2 3Å; E92-R115 PolarHBondContact OE2-NH2 2.68Å; E92-R115 VanDerWaalsContact OE2-NH2 3.15Å; T111-R115 PolarHBondContact OG1-NH2 3.4Å; D113-R115 VanDerWaalsContact CG-NE 3.32Å; D113-R115 PolarHBondContact O-N 3.15Å; D113-R115 WeakPolarHBondContact OD1-CB 3.21Å; D113-R115 WeakPolarHBondContact OD1-CG 3.23Å; D113-R115 IonicContact OD1-CZ 2.73Å; D113-R115 PolarHBondContact OD1-N 2.93Å; D113-R115 IonicContact OD1-NE 3.98Å; D113-R115 PolarHBondContact OD1-NE 3.44Å; D113-R115 IonicContact OD1-NH2 3.59Å; D113-R115 IonicContact OD2-CZ 3.88Å; D113-R115 IonicContact OD2-NE 2.76Å; D113-R115 PolarHBondContact OD2-NE 3.08Å; D113-R115 IonicContact OD2-NH2 2.71Å; D113-R115 PolarHBondContact OD2-NH2 2.81Å; R115-K130 HydrophobicContact CB-CD 4.01Å
116	R	86.8	Confident	89.4	Confident	25 Å²	25	50.3 Å²	50.3	9%	0.094	26%	0.263	C	S	.	.	S	Bend	trans	-128.8	-54.3	173.8	-55.8	-65.1	176.1	-94.7	-7	111.3	N114 K130 V131 L134 T268 E303	N114-R116 PolarHBondContact O-N 2.96Å; R116-K130 HydrophobicContact CG-CD 4.24Å; R116-K130 HydrophobicContact CG-CG 4.4Å; R116-V131 PolarHBondContact NH2-O 2.92Å; R116-L134 VanDerWaalsContact NH2-CD1 3.34Å; R116-T268 VanDerWaalsContact CD-O 3.32Å; R116-T268 WeakPolarHBondContact CD-O 3.36Å; R116-T268 VanDerWaalsContact CG-O 3.31Å; R116-T268 WeakPolarHBondContact CG-O 3.48Å; R116-E303 IonicContact CZ-OE1 2.65Å; R116-E303 IonicContact CZ-OE2 3.05Å; R116-E303 IonicContact NE-OE1 3.52Å; R116-E303 PolarHBondContact NE-OE1 3Å; R116-E303 IonicContact NE-OE2 3.34Å; R116-E303 PolarHBondContact NE-OE2 3.41Å; R116-E303 IonicContact NH2-OE1 2.68Å; R116-E303 IonicContact NH2-OE2 2.83Å; R116-E303 PolarHBondContact NH2-OE2 3.02Å
117	W	86.7	Confident	89.4	Confident	13 Å²	13	51.8 Å²	51.8	5%	0.049	26%	0.261	C	S	.	.	S	Bend	trans	-153.2	171.4	174.5	56.1	75.5	0	0	0	110.4	N114 L121 L124 H128 T268 T270 P271 A274 M947	N114-W117 WeakPolarHBondContact CA-O 3.09Å; W117-L121 HydrophobicContact CB-CD2 3.98Å; W117-L121 HydrophobicContact CG-CD2 4.41Å; W117-L124 HydrophobicContact CZ2-CD1 4.43Å; W117-H128 AromaticContact CE2-CE1 3.82Å; W117-H128 AromaticContact CZ2-CE1 3.96Å; W117-H128 AromaticContact CZ2-NE2 3.98Å; W117-H128 AromaticContact NE1-CE1 3.78Å; W117-T268 WeakPolarHBondContact CZ3-O 3.31Å; W117-T270 VanDerWaalsContact CZ3-O 3.31Å; W117-T270 WeakPolarHBondContact CZ3-O 3.37Å; W117-P271 HydrophobicContact CD2-CB 4Å; W117-P271 HydrophobicContact CE3-CB 4.18Å; W117-P271 HydrophobicContact CG-CB 4.27Å; W117-A274 HydrophobicContact CH2-CB 4.15Å; W117-A274 HydrophobicContact CZ2-CB 4.04Å; W117-M947 HydrophobicContact CB-CB 4.28Å; W117-M947 HydrophobicContact CB-CG 4.29Å
118	E	82.8	Confident	89.2	Confident	105 Å²	105	49.2 Å²	49.2	49%	0.491	25%	0.248	S	C	.	.			trans	-69.4	132.6	-178.3	-61	-179.2	156.4	0	0	112.1	G120 L121	E118-G120 PolarHBondContact O-N 3.46Å; E118-L121 WeakPolarHBondContact O-CB 3.42Å; E118-L121 PolarHBondContact O-N 3.29Å; E118-L121 VanDerWaalsContact O-N 3.12Å
119	P	87.4	Confident	89.2	Confident	33 Å²	33	46.8 Å²	46.8	21%	0.214	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	128.2	177.2	-30.4	36.7	0	0	0	113.6	E112 N114 R126	E112-P119 HydrophobicContact CG-CB 3.8Å; E112-P119 HydrophobicContact CG-CG 3.84Å; N114-P119 WeakPolarHBondContact OD1-CD 3.29Å; P119-R126 HydrophobicContact CB-CB 4.12Å
120	G	86	Confident	89.1	Confident	30 Å²	30	46.6 Å²	46.6	31%	0.309	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.6	0	-178.7	0	0	0	0	0	115.5	E118 F122 G123 L124	E118-G120 PolarHBondContact O-N 3.46Å; G120-F122 PolarHBondContact O-N 3.34Å; G120-G123 PolarHBondContact O-N 3.17Å; G120-L124 WeakPolarHBondContact CA-O 3.3Å
121	L	82.3	Confident	89.1	Confident	30 Å²	30	46.4 Å²	46.4	16%	0.157	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-52.6	131.3	177.1	-176.7	70.4	0	0	0	111.4	W117 E118 G123 L124 P271 M947	W117-L121 HydrophobicContact CB-CD2 3.98Å; W117-L121 HydrophobicContact CG-CD2 4.41Å; E118-L121 WeakPolarHBondContact O-CB 3.42Å; E118-L121 PolarHBondContact O-N 3.29Å; E118-L121 VanDerWaalsContact O-N 3.12Å; L121-G123 PolarHBondContact O-N 3.41Å; L121-G123 VanDerWaalsContact O-N 3.08Å; L121-L124 VanDerWaalsContact O-CB 3.26Å; L121-L124 WeakPolarHBondContact O-CB 3.41Å; L121-L124 WeakPolarHBondContact O-CG 3.46Å; L121-L124 PolarHBondContact O-N 3.17Å; L121-P271 HydrophobicContact CD2-CB 4.2Å; L121-P271 HydrophobicContact CD2-CG 4.08Å; L121-M947 HydrophobicContact CD1-CE 3.96Å; L121-M947 HydrophobicContact CD2-CE 3.62Å; L121-M947 HydrophobicContact CD2-CG 4.24Å; L121-M947 HydrophobicContact CG-CE 4.46Å
122	F	84.7	Confident	88.9	Confident	122 Å²	122	47.7 Å²	47.7	54%	0.535	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	55.5	15.6	-173.8	-50.4	-58.3	0	0	0	116	G120 L124 P271 L275	G120-F122 PolarHBondContact O-N 3.34Å; F122-L124 VanDerWaalsContact C-N 3.34Å; F122-P271 HydrophobicContact CD2-CB 4.26Å; F122-P271 HydrophobicContact CE2-CB 4.32Å; F122-P271 HydrophobicContact CE2-CG 4.09Å; F122-L275 HydrophobicContact CB-CD1 4.42Å
123	G	84.5	Confident	88.7	Confident	40 Å²	40	47.8 Å²	47.8	41%	0.412	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	79.8	13.9	-173.6	0	0	0	0	0	114.2	G120 L121	G120-G123 PolarHBondContact O-N 3.17Å; L121-G123 PolarHBondContact O-N 3.41Å; L121-G123 VanDerWaalsContact O-N 3.08Å
124	L	90.2	Very high	88.8	Confident	5 Å²	5	46.7 Å²	46.7	3%	0.026	23%	0.229	C	C	.	.			trans	-63.3	154	172.3	-67.3	173.9	0	0	0	111.4	W117 G120 L121 F122 R126 P271 A274 L275 M278	W117-L124 HydrophobicContact CZ2-CD1 4.43Å; G120-L124 WeakPolarHBondContact CA-O 3.3Å; L121-L124 VanDerWaalsContact O-CB 3.26Å; L121-L124 WeakPolarHBondContact O-CB 3.41Å; L121-L124 WeakPolarHBondContact O-CG 3.46Å; L121-L124 PolarHBondContact O-N 3.17Å; F122-L124 VanDerWaalsContact C-N 3.34Å; L124-R126 PolarHBondContact O-N 3.33Å; L124-P271 HydrophobicContact CD1-CB 3.67Å; L124-A274 HydrophobicContact CD1-CB 4Å; L124-A274 HydrophobicContact CD2-CB 3.84Å; L124-L275 HydrophobicContact CD2-CB 4.24Å; L124-L275 HydrophobicContact CD2-CD1 4.48Å; L124-M278 HydrophobicContact CD2-CB 4.25Å; L124-M278 HydrophobicContact CD2-SD 4.02Å
125	P	90.1	Very high	89.1	Confident	14 Å²	14	42.9 Å²	42.9	9%	0.091	21%	0.212	C	C	.	.			trans	-51.2	133.6	171	-26.1	35.1	0	0	0	111.4	R127 L283 S284	P125-R127 VanDerWaalsContact C-N 3.28Å; P125-R127 PolarHBondContact O-N 2.83Å; P125-L283 HydrophobicContact CG-CB 4.28Å; P125-S284 WeakPolarHBondContact CB-O 3.38Å; P125-S284 WeakPolarHBondContact CG-O 3.04Å
126	R	92.6	Very high	89.4	Confident	139 Å²	139	40.6 Å²	40.6	53%	0.525	21%	0.205	S	C	.	.	S	Bend	trans	-66.3	-32.4	-176.2	-63.1	175.4	68.2	103.9	0.5	112.4	E112 P119 L124	E112-R126 VanDerWaalsContact CD-NE 3.29Å; E112-R126 HydrophobicContact CG-CB 4.12Å; E112-R126 IonicContact OE1-CZ 3.6Å; E112-R126 IonicContact OE1-NE 2.7Å; E112-R126 PolarHBondContact OE1-NE 2.71Å; E112-R126 IonicContact OE1-NH2 3.52Å; E112-R126 PolarHBondContact OE1-NH2 3.39Å; E112-R126 WeakPolarHBondContact OE2-CB 3.46Å; E112-R126 IonicContact OE2-NE 2.78Å; E112-R126 PolarHBondContact OE2-NE 2.83Å; E112-R126 VanDerWaalsContact OE2-NE 3.13Å; P119-R126 HydrophobicContact CB-CB 4.12Å; L124-R126 PolarHBondContact O-N 3.33Å
127	R	93.5	Very high	89.8	Confident	53 Å²	53	39.5 Å²	39.5	20%	0.2	20%	0.201	C	C	.	.			trans	-103.2	140.3	-178.1	-37.1	173.6	63.6	-153.7	13	111.6	D108 I110 T111 E112 P125 G287	D108-R127 IonicContact OD1-NH1 2.67Å; D108-R127 IonicContact OD1-NH2 2.78Å; D108-R127 PolarHBondContact OD1-NH2 3.44Å; D108-R127 IonicContact OD2-CZ 2.77Å; D108-R127 VanDerWaalsContact OD2-CZ 3.25Å; D108-R127 IonicContact OD2-NH1 3.79Å; D108-R127 PolarHBondContact OD2-NH1 2.39Å; D108-R127 IonicContact OD2-NH2 3.71Å; D108-R127 PolarHBondContact OD2-NH2 3.2Å; I110-R127 HydrophobicContact CG2-CB 3.41Å; I110-R127 VanDerWaalsContact CG2-CB 3.41Å; I110-R127 PolarHBondContact O-NE 2.82Å; I110-R127 VanDerWaalsContact O-NE 3.11Å; I110-R127 PolarHBondContact O-NH2 3.34Å; T111-R127 WeakPolarHBondContact O-CA 3.16Å; E112-R127 HydrophobicContact CB-CG 4.3Å; P125-R127 VanDerWaalsContact C-N 3.28Å; P125-R127 PolarHBondContact O-N 2.83Å; R127-G287 WeakPolarHBondContact CD-O 3.47Å; R127-G287 PolarHBondContact NH1-O 3.21Å
128	H	92.6	Very high	90.1	Very high	10 Å²	10	39.1 Å²	39.1	5%	0.046	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	154.5	168.2	56.3	-78.4	0	0	0	110.8	T111 W117 K130 V300 R301	T111-H128 PolarHBondContact N-O 2.9Å; T111-H128 PolarHBondContact O-N 2.82Å; T111-H128 VanDerWaalsContact O-N 3.16Å; W117-H128 AromaticContact CE2-CE1 3.82Å; W117-H128 AromaticContact CZ2-CE1 3.96Å; W117-H128 AromaticContact CZ2-NE2 3.98Å; W117-H128 AromaticContact NE1-CE1 3.78Å; H128-K130 VanDerWaalsContact CE1-CE 3.47Å; H128-K130 WeakPolarHBondContact CE1-CE 3.46Å; H128-K130 VanDerWaalsContact NE2-CE 3.3Å; H128-K130 WeakPolarHBondContact NE2-CE 3.45Å; H128-K130 PolarHBondContact O-NZ 2.97Å; H128-V300 HydrophobicContact CB-CG1 4.29Å; H128-R301 WeakPolarHBondContact CB-O 3.4Å
129	G	93.9	Very high	90.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	133.2	-179.1	0	0	0	0	0	111.5	R301 S302 E303	G129-R301 PolarHBondContact N-O 3.17Å; G129-S302 WeakPolarHBondContact CA-OG 3.23Å; G129-E303 PolarHBondContact O-N 2.77Å
130	K	94.1	Very high	90.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.2	C	C	.	.			trans	-135.9	134.9	-170.7	-58.5	173.3	-142.4	68.2	0	111.6	P91 E92 T111 D113 R115 R116 H128 E303	P91-K130 WeakPolarHBondContact CA-O 3.35Å; E92-K130 PolarHBondContact N-O 2.91Å; E92-K130 VanDerWaalsContact N-O 3.14Å; T111-K130 PolarHBondContact O-NZ 3.02Å; T111-K130 PolarHBondContact OG1-NZ 3.34Å; D113-K130 IonicContact OD1-NZ 3.07Å; D113-K130 VanDerWaalsContact OD2-CE 3.23Å; D113-K130 WeakPolarHBondContact OD2-CE 3.5Å; D113-K130 IonicContact OD2-NZ 3.26Å; D113-K130 PolarHBondContact OD2-NZ 2.86Å; R115-K130 HydrophobicContact CB-CD 4.01Å; R116-K130 HydrophobicContact CG-CD 4.24Å; R116-K130 HydrophobicContact CG-CG 4.4Å; H128-K130 VanDerWaalsContact CE1-CE 3.47Å; H128-K130 WeakPolarHBondContact CE1-CE 3.46Å; H128-K130 VanDerWaalsContact NE2-CE 3.3Å; H128-K130 WeakPolarHBondContact NE2-CE 3.45Å; H128-K130 PolarHBondContact O-NZ 2.97Å; K130-E303 WeakPolarHBondContact CA-OE2 3.41Å
131	V	94.9	Very high	90.5	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.189	C	C	.	.			trans	-69.7	134.5	168.7	172.6	0	0	0	0	109.2	R89 R116 L134 I158 L267 E303 I305	R89-V131 HydrophobicContact CB-CG1 4.01Å; R89-V131 HydrophobicContact CB-CG2 4.36Å; R116-V131 PolarHBondContact NH2-O 2.92Å; V131-L134 HydrophobicContact CB-CD2 4.14Å; V131-L134 HydrophobicContact CG1-CD2 4.09Å; V131-I158 HydrophobicContact CG1-CD1 4.46Å; V131-L267 HydrophobicContact CG2-CD2 4.46Å; V131-E303 HydrophobicContact CG2-CB 3.95Å; V131-E303 PolarHBondContact N-OE2 3.11Å; V131-I305 HydrophobicContact CG2-CD1 4.37Å
132	K	90.7	Very high	90.9	Very high	66 Å²	66	35.1 Å²	35.1	29%	0.287	18%	0.183	S	C	.	.	S	Bend	trans	-58.9	-53.3	-173.9	-79.4	152.7	69.5	-154.2	0	112.5	E92 D94 E98	E92-K132 HydrophobicContact CB-CD 4.48Å; E92-K132 WeakPolarHBondContact O-CD 3.49Å; D94-K132 WeakPolarHBondContact OD2-CD 3.47Å; D94-K132 WeakPolarHBondContact OD2-CE 3.39Å; D94-K132 IonicContact OD2-NZ 3.36Å; D94-K132 PolarHBondContact OD2-NZ 3.5Å; E98-K132 IonicContact OE1-NZ 3.34Å; E98-K132 IonicContact OE2-NZ 3.42Å; E98-K132 PolarHBondContact OE2-NZ 3.37Å
133	Q	87.5	Confident	91	Very high	97 Å²	97	32.5 Å²	32.5	45%	0.453	19%	0.191	S	C	.	.			trans	-116.9	112.7	-172.7	-63	-64.3	-9.6	0	0	112.4	K136	Q133-K136 HydrophobicContact CB-CG 4.04Å; Q133-K136 HydrophobicContact CG-CG 4.44Å
134	L	92	Very high	91.2	Very high	8 Å²	8	30.9 Å²	30.9	4%	0.042	17%	0.173	C	C	.	.	S	Bend	trans	-107.7	-15.4	172.1	-64	-168.9	0	0	0	114.1	R116 V131 K136 P154 R157 I158 L267 L269 V944	R116-L134 VanDerWaalsContact NH2-CD1 3.34Å; V131-L134 HydrophobicContact CB-CD2 4.14Å; V131-L134 HydrophobicContact CG1-CD2 4.09Å; L134-K136 VanDerWaalsContact C-N 3.3Å; L134-P154 HydrophobicContact CB-CB 4.27Å; L134-P154 HydrophobicContact CD2-CB 4.47Å; L134-R157 PolarHBondContact O-NH1 3.02Å; L134-R157 VanDerWaalsContact O-NH1 3.09Å; L134-I158 HydrophobicContact CD2-CD1 3.71Å; L134-L267 HydrophobicContact CD1-CD1 3.95Å; L134-L267 HydrophobicContact CD1-CD2 4.36Å; L134-L267 HydrophobicContact CD2-CD1 3.73Å; L134-L267 HydrophobicContact CD2-CD2 3.71Å; L134-L267 HydrophobicContact CD2-CG 4.42Å; L134-L267 HydrophobicContact CG-CD1 4.48Å; L134-L269 HydrophobicContact CD1-CD2 3.56Å; L134-V944 HydrophobicContact CB-CG1 4.09Å; L134-V944 HydrophobicContact CB-CG2 3.76Å; L134-V944 HydrophobicContact CD1-CG1 4.02Å; L134-V944 WeakPolarHBondContact O-CG2 3.5Å
135	A	91.3	Very high	90.9	Very high	24 Å²	24	36 Å²	36	20%	0.198	20%	0.197	C	C	.	.	S	Bend	trans	-79.5	-14.1	-179.8	0	0	0	0	0	112.8	D941 W942 V944	A135-D941 HydrophobicContact CB-CB 4.24Å; A135-W942 WeakPolarHBondContact CA-O 3.37Å; A135-W942 WeakPolarHBondContact O-CB 3.47Å; A135-W942 VanDerWaalsContact O-CD1 3.27Å; A135-W942 PolarHBondContact O-N 3.4Å; A135-V944 HydrophobicContact CB-CG2 4.38Å
136	K	93	Very high	90.4	Very high	39 Å²	39	38.7 Å²	38.7	17%	0.17	21%	0.214	C	C	.	.			trans	-91.2	144.7	-170.3	-58.9	-50.4	-165.9	179.3	0	113.3	Q133 L134 H938 D941	Q133-K136 HydrophobicContact CB-CG 4.04Å; Q133-K136 HydrophobicContact CG-CG 4.44Å; L134-K136 VanDerWaalsContact C-N 3.3Å; K136-H938 HydrophobicContact CB-CB 4.08Å; K136-H938 WeakPolarHBondContact CB-ND1 3.14Å; K136-H938 HydrophobicContact CD-CB 4Å; K136-H938 WeakPolarHBondContact CD-O 3.41Å; K136-H938 VanDerWaalsContact CE-O 3.3Å; K136-H938 WeakPolarHBondContact CE-O 3.46Å; K136-H938 HydrophobicContact CG-CB 4.11Å; K136-H938 PolarHBondContact NZ-O 3.31Å; K136-D941 WeakPolarHBondContact CD-OD1 3.35Å; K136-D941 WeakPolarHBondContact CE-OD1 3.27Å; K136-D941 IonicContact NZ-OD1 2.83Å; K136-D941 PolarHBondContact NZ-OD1 3.23Å; K136-D941 IonicContact NZ-OD2 3.43Å
137	F	94.8	Very high	89.7	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.009	21%	0.209	C	C	.	.			trans	-174.9	130.3	173.3	179.4	-128	0	0	0	111.6	A139 F142 V144 A149 M152 R157 L160 E161 W942	F137-A139 VanDerWaalsContact C-N 3.29Å; F137-A139 HydrophobicContact CD1-CB 3.73Å; F137-A139 HydrophobicContact CE1-CB 3.84Å; F137-A139 PolarHBondContact O-N 3.34Å; F137-F142 HydrophobicContact CD2-CD2 4.15Å; F137-F142 HydrophobicContact CD2-CE2 4.45Å; F137-F142 HydrophobicContact CE2-CB 4.34Å; F137-F142 AromaticContact CE2-CD2 3.29Å; F137-F142 HydrophobicContact CE2-CD2 3.29Å; F137-F142 AromaticContact CE2-CE2 3.83Å; F137-F142 HydrophobicContact CE2-CE2 3.83Å; F137-F142 AromaticContact CE2-CG 3.97Å; F137-F142 HydrophobicContact CE2-CG 3.97Å; F137-F142 HydrophobicContact CZ-CB 3.79Å; F137-F142 AromaticContact CZ-CD2 3.63Å; F137-F142 HydrophobicContact CZ-CD2 3.63Å; F137-F142 AromaticContact CZ-CG 3.93Å; F137-F142 HydrophobicContact CZ-CG 3.93Å; F137-V144 HydrophobicContact CE1-CB 4.21Å; F137-V144 HydrophobicContact CE1-CG2 4.08Å; F137-V144 HydrophobicContact CZ-CG2 4.2Å; F137-A149 HydrophobicContact CD1-CB 4.41Å; F137-M152 HydrophobicContact CE1-CE 4.29Å; F137-M152 HydrophobicContact CE1-SD 4.5Å; F137-M152 HydrophobicContact CZ-CE 4.23Å; F137-R157 HydrophobicContact CB-CB 3.97Å; F137-R157 HydrophobicContact CB-CG 4Å; F137-R157 HydrophobicContact CD1-CB 4.31Å; F137-R157 HydrophobicContact CD1-CG 3.72Å; F137-R157 HydrophobicContact CD2-CB 3.66Å; F137-R157 HydrophobicContact CD2-CG 4Å; F137-R157 HydrophobicContact CE1-CG 4.12Å; F137-R157 HydrophobicContact CE2-CB 4.17Å; F137-R157 HydrophobicContact CE2-CG 4.37Å; F137-R157 WeakPolarHBondContact CE2-O 3.43Å; F137-R157 HydrophobicContact CG-CB 3.74Å; F137-R157 HydrophobicContact CG-CG 3.66Å; F137-R157 HydrophobicContact CZ-CG 4.43Å; F137-L160 HydrophobicContact CE2-CB 4.15Å; F137-L160 HydrophobicContact CE2-CD1 4.04Å; F137-L160 HydrophobicContact CZ-CD1 3.81Å; F137-E161 WeakPolarHBondContact CA-OE1 3.46Å; F137-E161 HydrophobicContact CD2-CG 4.44Å; F137-W942 PolarHBondContact O-NE1 3.46Å
138	D	93.3	Very high	89.4	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.021	21%	0.212	C	C	.	.			trans	-80.6	72.4	172.7	-170.9	-22.2	0	0	0	111.6	A140 F141 F142 E161 R507 W936 D937	D138-A140 PolarHBondContact O-N 2.73Å; D138-A140 VanDerWaalsContact O-N 3.14Å; D138-F141 HydrophobicContact CB-CB 4.24Å; D138-F141 PolarHBondContact O-N 3.23Å; D138-F141 WeakPolarHBondContact OD1-CB 3.45Å; D138-F141 PolarHBondContact OD1-N 2.83Å; D138-F142 VanDerWaalsContact O-CD2 3.28Å; D138-F142 WeakPolarHBondContact O-CD2 3.31Å; D138-F142 PolarHBondContact O-N 3.2Å; D138-E161 PolarHBondContact N-OE1 2.67Å; D138-R507 IonicContact OD1-CZ 2.78Å; D138-R507 IonicContact OD1-NE 2.72Å; D138-R507 IonicContact OD1-NH2 2.79Å; D138-R507 PolarHBondContact OD1-NH2 2.83Å; D138-R507 IonicContact OD2-CZ 3.98Å; D138-R507 VanDerWaalsContact OD2-CZ 3.31Å; D138-R507 IonicContact OD2-NE 2.83Å; D138-R507 PolarHBondContact OD2-NE 2.72Å; D138-R507 IonicContact OD2-NH2 3.71Å; D138-R507 PolarHBondContact OD2-NH2 2.8Å; D138-W936 HydrophobicContact CB-CB 4.07Å; D138-W936 HydrophobicContact CB-CE3 4.08Å; D138-D937 WeakPolarHBondContact OD2-CB 3.47Å; D138-D937 PolarHBondContact OD2-N 3.15Å; D138-D937 VanDerWaalsContact OD2-N 3.07Å
139	A	90.1	Very high	89.1	Confident	6 Å²	6	36.2 Å²	36.2	5%	0.05	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-28.1	-177.1	0	0	0	0	0	113.5	F137 G143 V144 A149 W942	F137-A139 VanDerWaalsContact C-N 3.29Å; F137-A139 HydrophobicContact CD1-CB 3.73Å; F137-A139 HydrophobicContact CE1-CB 3.84Å; F137-A139 PolarHBondContact O-N 3.34Å; A139-G143 PolarHBondContact O-N 2.95Å; A139-V144 HydrophobicContact CB-CB 4.26Å; A139-V144 PolarHBondContact O-N 2.84Å; A139-A149 HydrophobicContact CB-CB 3.96Å; A139-W942 HydrophobicContact CB-CH2 3.97Å; A139-W942 HydrophobicContact CB-CZ2 3.42Å; A139-W942 VanDerWaalsContact CB-CZ2 3.42Å
140	A	85.2	Confident	88.7	Confident	81 Å²	81	42.4 Å²	42.4	67%	0.669	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-44.4	178.7	0	0	0	0	0	111.6	D138 G143	D138-A140 PolarHBondContact O-N 2.73Å; D138-A140 VanDerWaalsContact O-N 3.14Å; A140-G143 PolarHBondContact O-N 3.32Å
141	F	89.2	Confident	88.4	Confident	17 Å²	17	43.3 Å²	43.3	8%	0.075	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-44.6	175.5	-176.7	-99.4	0	0	0	112.6	D138 G143 F164 F224 R507 M542 Y543 W936	D138-F141 HydrophobicContact CB-CB 4.24Å; D138-F141 PolarHBondContact O-N 3.23Å; D138-F141 WeakPolarHBondContact OD1-CB 3.45Å; D138-F141 PolarHBondContact OD1-N 2.83Å; F141-G143 PolarHBondContact O-N 3.18Å; F141-F164 HydrophobicContact CE1-CD1 4.31Å; F141-F164 HydrophobicContact CE1-CD2 4.06Å; F141-F164 HydrophobicContact CE1-CE1 4.19Å; F141-F164 AromaticContact CE1-CE2 3.93Å; F141-F164 HydrophobicContact CE1-CE2 3.93Å; F141-F164 HydrophobicContact CE1-CG 4.25Å; F141-F164 HydrophobicContact CE1-CZ 4Å; F141-F164 HydrophobicContact CZ-CD1 4.32Å; F141-F164 HydrophobicContact CZ-CD2 4.41Å; F141-F164 AromaticContact CZ-CE1 3.77Å; F141-F164 HydrophobicContact CZ-CE1 3.77Å; F141-F164 AromaticContact CZ-CE2 3.86Å; F141-F164 HydrophobicContact CZ-CE2 3.86Å; F141-F164 AromaticContact CZ-CZ 3.51Å; F141-F164 HydrophobicContact CZ-CZ 3.51Å; F141-F224 HydrophobicContact CD1-CE1 4.43Å; F141-F224 AromaticContact CD1-CZ 3.93Å; F141-F224 HydrophobicContact CD1-CZ 3.93Å; F141-F224 AromaticContact CE1-CE1 3.93Å; F141-F224 HydrophobicContact CE1-CE1 3.93Å; F141-F224 AromaticContact CE1-CZ 3.68Å; F141-F224 HydrophobicContact CE1-CZ 3.68Å; F141-F224 HydrophobicContact CZ-CZ 4.42Å; F141-F224 WeakPolarHBondContact O-CE2 3.5Å; F141-R507 VanDerWaalsContact CD2-CD 3.47Å; F141-M542 HydrophobicContact CE2-CB 4.01Å; F141-M542 HydrophobicContact CE2-CG 4.26Å; F141-Y543 HydrophobicContact CD2-CE1 4.44Å; F141-Y543 AromaticContact CE2-CD1 3.99Å; F141-Y543 HydrophobicContact CE2-CD1 3.99Å; F141-Y543 AromaticContact CE2-CE1 3.67Å; F141-Y543 HydrophobicContact CE2-CE1 3.67Å; F141-Y543 HydrophobicContact CZ-CE1 4.11Å; F141-W936 HydrophobicContact CB-CZ3 4.48Å; F141-W936 HydrophobicContact CD1-CE3 4.39Å; F141-W936 HydrophobicContact CD1-CH2 4.07Å; F141-W936 AromaticContact CD1-CZ3 3.43Å; F141-W936 HydrophobicContact CD1-CZ3 3.43Å; F141-W936 VanDerWaalsContact CD1-CZ3 3.43Å; F141-W936 HydrophobicContact CD2-CZ3 4.41Å; F141-W936 AromaticContact CE1-CH2 3.84Å; F141-W936 HydrophobicContact CE1-CH2 3.84Å; F141-W936 AromaticContact CE1-CZ3 3.58Å; F141-W936 HydrophobicContact CE1-CZ3 3.58Å; F141-W936 AromaticContact CG-CZ3 3.86Å; F141-W936 HydrophobicContact CG-CZ3 3.86Å; F141-W936 HydrophobicContact CZ-CH2 4.46Å; F141-W936 HydrophobicContact CZ-CZ3 4.13Å
142	F	91.2	Very high	88.3	Confident	10 Å²	10	43.4 Å²	43.4	4%	0.044	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	6.4	-178.4	-66.7	-71.8	0	0	0	114.3	F137 D138 V144 L160 E161 F224 W936	F137-F142 HydrophobicContact CD2-CD2 4.15Å; F137-F142 HydrophobicContact CD2-CE2 4.45Å; F137-F142 HydrophobicContact CE2-CB 4.34Å; F137-F142 AromaticContact CE2-CD2 3.29Å; F137-F142 HydrophobicContact CE2-CD2 3.29Å; F137-F142 AromaticContact CE2-CE2 3.83Å; F137-F142 HydrophobicContact CE2-CE2 3.83Å; F137-F142 AromaticContact CE2-CG 3.97Å; F137-F142 HydrophobicContact CE2-CG 3.97Å; F137-F142 HydrophobicContact CZ-CB 3.79Å; F137-F142 AromaticContact CZ-CD2 3.63Å; F137-F142 HydrophobicContact CZ-CD2 3.63Å; F137-F142 AromaticContact CZ-CG 3.93Å; F137-F142 HydrophobicContact CZ-CG 3.93Å; D138-F142 VanDerWaalsContact O-CD2 3.28Å; D138-F142 WeakPolarHBondContact O-CD2 3.31Å; D138-F142 PolarHBondContact O-N 3.2Å; F142-V144 VanDerWaalsContact C-N 3.25Å; F142-V144 HydrophobicContact CB-CG2 4.03Å; F142-V144 PolarHBondContact O-N 3.01Å; F142-L160 HydrophobicContact CD1-CB 3.92Å; F142-L160 HydrophobicContact CD1-CD2 3.89Å; F142-L160 HydrophobicContact CD1-CG 4.33Å; F142-L160 HydrophobicContact CD2-CB 4.43Å; F142-L160 HydrophobicContact CE1-CB 3.77Å; F142-L160 HydrophobicContact CE1-CD2 4.23Å; F142-L160 HydrophobicContact CE2-CB 4.31Å; F142-L160 HydrophobicContact CG-CB 4.26Å; F142-L160 HydrophobicContact CG-CD1 4.44Å; F142-L160 HydrophobicContact CZ-CB 3.99Å; F142-L160 WeakPolarHBondContact CZ-O 3.31Å; F142-E161 HydrophobicContact CE2-CG 3.65Å; F142-E161 HydrophobicContact CZ-CG 4.01Å; F142-F224 HydrophobicContact CB-CE2 4.41Å; F142-F224 AromaticContact CD1-CD1 3.63Å; F142-F224 HydrophobicContact CD1-CD1 3.63Å; F142-F224 HydrophobicContact CD1-CD2 4.1Å; F142-F224 AromaticContact CD1-CE1 3.46Å; F142-F224 HydrophobicContact CD1-CE1 3.46Å; F142-F224 VanDerWaalsContact CD1-CE1 3.46Å; F142-F224 AromaticContact CD1-CE2 3.97Å; F142-F224 HydrophobicContact CD1-CE2 3.97Å; F142-F224 AromaticContact CD1-CG 3.94Å; F142-F224 HydrophobicContact CD1-CG 3.94Å; F142-F224 AromaticContact CD1-CZ 3.64Å; F142-F224 HydrophobicContact CD1-CZ 3.64Å; F142-F224 AromaticContact CE1-CD1 3.88Å; F142-F224 HydrophobicContact CE1-CD1 3.88Å; F142-F224 AromaticContact CE1-CE1 3.56Å; F142-F224 HydrophobicContact CE1-CE1 3.56Å; F142-F224 HydrophobicContact CE1-CZ 4.08Å; F142-W936 HydrophobicContact CE2-CE3 4.32Å; F142-W936 HydrophobicContact CE2-CH2 4.15Å; F142-W936 HydrophobicContact CE2-CZ3 4Å; F142-W936 AromaticContact CZ-CH2 3.65Å; F142-W936 HydrophobicContact CZ-CH2 3.65Å; F142-W936 HydrophobicContact CZ-CZ2 4.17Å; F142-W936 AromaticContact CZ-CZ3 3.92Å; F142-W936 HydrophobicContact CZ-CZ3 3.92Å
143	G	86.6	Confident	88.5	Confident	67 Å²	67	40.2 Å²	40.2	69%	0.691	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.8	24.8	179.2	0	0	0	0	0	114	A139 A140 F141	A139-G143 PolarHBondContact O-N 2.95Å; A140-G143 PolarHBondContact O-N 3.32Å; F141-G143 PolarHBondContact O-N 3.18Å
144	V	89	Confident	88.8	Confident	7 Å²	7	35.7 Å²	35.7	4%	0.042	21%	0.207	C	C	.	.			trans	-97.3	112.6	-175.3	-175.9	0	0	0	0	110.2	F137 A139 F142 Q148 A149 M152	F137-V144 HydrophobicContact CE1-CB 4.21Å; F137-V144 HydrophobicContact CE1-CG2 4.08Å; F137-V144 HydrophobicContact CZ-CG2 4.2Å; A139-V144 HydrophobicContact CB-CB 4.26Å; A139-V144 PolarHBondContact O-N 2.84Å; F142-V144 VanDerWaalsContact C-N 3.25Å; F142-V144 HydrophobicContact CB-CG2 4.03Å; F142-V144 PolarHBondContact O-N 3.01Å; V144-Q148 HydrophobicContact CG1-CB 3.78Å; V144-A149 HydrophobicContact CG1-CB 3.76Å; V144-M152 HydrophobicContact CG1-SD 3.63Å; V144-M152 HydrophobicContact CG2-SD 4.18Å
145	H	83.2	Confident	88.9	Confident	112 Å²	112	35.5 Å²	35.5	52%	0.519	21%	0.206	S	C	.	.			trans	-59.4	139.5	174.6	-175.5	-99.6	0	0	0	111.2	K147 Q148 A149	H145-K147 VanDerWaalsContact C-N 3.25Å; H145-K147 PolarHBondContact ND1-N 3.09Å; H145-K147 PolarHBondContact O-N 3.48Å; H145-Q148 WeakPolarHBondContact O-CA 3.48Å; H145-Q148 WeakPolarHBondContact O-CB 3.4Å; H145-Q148 PolarHBondContact O-N 2.9Å; H145-A149 PolarHBondContact O-N 3.48Å; H145-A149 VanDerWaalsContact O-N 3.15Å
146	P	80.5	Confident	89.1	Confident	71 Å²	71	34.4 Å²	34.4	46%	0.461	20%	0.196	S	C	.	.	H	α-helix	trans	-52.7	-36.3	-173.1	-32.1	36.9	0	0	0	115.5	Q148 A149 K150 W942	P146-Q148 PolarHBondContact O-N 2.96Å; P146-A149 PolarHBondContact O-N 3.46Å; P146-K150 WeakPolarHBondContact O-CB 3.36Å; P146-K150 PolarHBondContact O-N 2.8Å; P146-W942 HydrophobicContact CB-CH2 3.8Å; P146-W942 HydrophobicContact CB-CZ3 3.9Å; P146-W942 HydrophobicContact CG-CH2 4.21Å
147	K	77.9	Confident	89.2	Confident	95 Å²	95	32.7 Å²	32.7	41%	0.413	19%	0.189	S	C	.	.	H	α-helix	trans	-66.7	-23.2	176.9	-61.4	-174.6	179.3	-178.4	0	113.3	H145 N151 E972	H145-K147 VanDerWaalsContact C-N 3.25Å; H145-K147 PolarHBondContact ND1-N 3.09Å; H145-K147 PolarHBondContact O-N 3.48Å; K147-N151 PolarHBondContact O-ND2 3.12Å; K147-E972 VanDerWaalsContact CE-OE2 3.24Å; K147-E972 WeakPolarHBondContact CE-OE2 3.4Å; K147-E972 IonicContact NZ-OE1 2.85Å; K147-E972 PolarHBondContact NZ-OE1 3.29Å; K147-E972 IonicContact NZ-OE2 3.19Å; K147-E972 PolarHBondContact NZ-OE2 3.02Å
148	Q	86.1	Confident	89.3	Confident	54 Å²	54	32.9 Å²	32.9	25%	0.252	19%	0.19	S	C	.	.	H	α-helix	trans	-81.8	-46.8	169.2	-64.8	-174.3	-4.6	0	0	111.9	V144 H145 P146 K150 N151 M152 Y207	V144-Q148 HydrophobicContact CG1-CB 3.78Å; H145-Q148 WeakPolarHBondContact O-CA 3.48Å; H145-Q148 WeakPolarHBondContact O-CB 3.4Å; H145-Q148 PolarHBondContact O-N 2.9Å; P146-Q148 PolarHBondContact O-N 2.96Å; Q148-K150 VanDerWaalsContact C-N 3.26Å; Q148-K150 PolarHBondContact O-N 3.03Å; Q148-N151 CarbonylContact O-C 3.49Å; Q148-N151 WeakPolarHBondContact O-CA 3.32Å; Q148-N151 PolarHBondContact O-N 2.74Å; Q148-M152 PolarHBondContact O-N 3.25Å; Q148-Y207 HydrophobicContact CG-CD1 3.7Å; Q148-Y207 HydrophobicContact CG-CE1 4.02Å; Q148-Y207 HydrophobicContact CG-CG 3.99Å
149	A	87.6	Confident	89.4	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.5	-37.1	-179.6	0	0	0	0	0	112.4	F137 A139 V144 H145 P146 N151 M152 W942	F137-A149 HydrophobicContact CD1-CB 4.41Å; A139-A149 HydrophobicContact CB-CB 3.96Å; V144-A149 HydrophobicContact CG1-CB 3.76Å; H145-A149 PolarHBondContact O-N 3.48Å; H145-A149 VanDerWaalsContact O-N 3.15Å; P146-A149 PolarHBondContact O-N 3.46Å; A149-N151 PolarHBondContact O-N 3.12Å; A149-N151 VanDerWaalsContact O-N 3.13Å; A149-M152 PolarHBondContact O-N 3.17Å; A149-M152 VanDerWaalsContact O-N 3.12Å; A149-W942 HydrophobicContact CB-CD2 4Å; A149-W942 HydrophobicContact CB-CE3 3.62Å; A149-W942 HydrophobicContact CB-CH2 3.8Å; A149-W942 HydrophobicContact CB-CZ2 4.15Å; A149-W942 HydrophobicContact CB-CZ3 3.53Å
150	K	84	Confident	89.7	Confident	131 Å²	131	32.6 Å²	32.6	57%	0.57	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-23.7	171.2	-164.4	178.5	-179	175.4	0	114	P146 Q148 P943	P146-K150 WeakPolarHBondContact O-CB 3.36Å; P146-K150 PolarHBondContact O-N 2.8Å; Q148-K150 VanDerWaalsContact C-N 3.26Å; Q148-K150 PolarHBondContact O-N 3.03Å; K150-P943 HydrophobicContact CG-CG 3.85Å
151	N	88.8	Confident	90.2	Very high	19 Å²	19	28.9 Å²	28.9	10%	0.102	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	17.2	-178.8	-68.7	-92.6	0	0	0	112.7	K147 Q148 A149 L197 T205 C212	K147-N151 PolarHBondContact O-ND2 3.12Å; Q148-N151 CarbonylContact O-C 3.49Å; Q148-N151 WeakPolarHBondContact O-CA 3.32Å; Q148-N151 PolarHBondContact O-N 2.74Å; A149-N151 PolarHBondContact O-N 3.12Å; A149-N151 VanDerWaalsContact O-N 3.13Å; N151-L197 HydrophobicContact CB-CD1 4.43Å; N151-T205 VanDerWaalsContact CG-OG1 3.25Å; N151-T205 PolarHBondContact ND2-OG1 2.59Å; N151-T205 PolarHBondContact OD1-OG1 3.33Å; N151-C212 PolarHBondContact O-SG 3.41Å
152	M	92.6	Very high	90.6	Very high	1 Å²	1	28 Å²	28	1%	0.005	15%	0.153	C	C	.	.	S	Bend	trans	-100.1	139.5	174.4	-75.6	175	59.9	0	0	111.7	F137 V144 Q148 A149 L156 R157 L160	F137-M152 HydrophobicContact CE1-CE 4.29Å; F137-M152 HydrophobicContact CE1-SD 4.5Å; F137-M152 HydrophobicContact CZ-CE 4.23Å; V144-M152 HydrophobicContact CG1-SD 3.63Å; V144-M152 HydrophobicContact CG2-SD 4.18Å; Q148-M152 PolarHBondContact O-N 3.25Å; A149-M152 PolarHBondContact O-N 3.17Å; A149-M152 VanDerWaalsContact O-N 3.12Å; M152-L156 HydrophobicContact CE-CD2 4.07Å; M152-L156 HydrophobicContact CE-CG 3.89Å; M152-R157 HydrophobicContact CB-CG 4.1Å; M152-R157 HydrophobicContact CE-CG 4.19Å; M152-R157 PolarHBondContact O-NE 2.83Å; M152-R157 VanDerWaalsContact O-NE 3.1Å; M152-R157 PolarHBondContact O-NH2 3.26Å; M152-L160 HydrophobicContact CE-CD1 3.86Å
153	D	93.8	Very high	90.9	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.151	C	C	.	.			trans	-60.8	134.8	172.2	-164.9	-62.1	0	0	0	110.1	Q155 L156 R157 S191 T193 G211 C212 F217	D153-Q155 PolarHBondContact O-N 3.11Å; D153-Q155 WeakPolarHBondContact OD1-CB 3.4Å; D153-Q155 VanDerWaalsContact OD1-CG 3.3Å; D153-Q155 WeakPolarHBondContact OD1-CG 3.47Å; D153-Q155 PolarHBondContact OD1-N 2.94Å; D153-Q155 PolarHBondContact OD1-NE2 3.16Å; D153-Q155 PolarHBondContact OD2-NE2 3.28Å; D153-L156 HydrophobicContact CB-CB 4.48Å; D153-L156 PolarHBondContact O-N 3.1Å; D153-R157 PolarHBondContact O-N 2.9Å; D153-R157 VanDerWaalsContact O-N 3.12Å; D153-S191 WeakPolarHBondContact OD2-CB 3.36Å; D153-S191 PolarHBondContact OD2-OG 3.37Å; D153-T193 WeakPolarHBondContact OD2-CB 3.47Å; D153-T193 PolarHBondContact OD2-OG1 3.03Å; D153-G211 PolarHBondContact N-O 3.14Å; D153-C212 HydrophobicContact CB-CB 4.47Å; D153-C212 PolarHBondContact N-SG 3.36Å; D153-F217 HydrophobicContact CB-CZ 4.47Å
154	P	94.3	Very high	91.3	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-55.1	-31	174.5	-23.4	32.1	0	0	0	113.4	L134 L156 R157 I158 T193 L267 V944	L134-P154 HydrophobicContact CB-CB 4.27Å; L134-P154 HydrophobicContact CD2-CB 4.47Å; P154-L156 PolarHBondContact O-N 3.14Å; P154-R157 PolarHBondContact O-N 2.84Å; P154-I158 WeakPolarHBondContact O-CG1 3.46Å; P154-I158 PolarHBondContact O-N 3Å; P154-T193 WeakPolarHBondContact CD-OG1 3.38Å; P154-L267 HydrophobicContact CB-CD1 3.77Å; P154-V944 HydrophobicContact CG-CG1 4.32Å; P154-V944 HydrophobicContact CG-CG2 4.26Å
155	Q	94.5	Very high	91.6	Very high	5 Å²	5	24.3 Å²	24.3	2%	0.023	12%	0.117	C	C	.	.	H	α-helix	trans	-54.2	-51.9	170.6	-72.2	169.8	105.5	0	0	111.1	D153 R157 I158 L159 F217 S265 L267	D153-Q155 PolarHBondContact O-N 3.11Å; D153-Q155 WeakPolarHBondContact OD1-CB 3.4Å; D153-Q155 VanDerWaalsContact OD1-CG 3.3Å; D153-Q155 WeakPolarHBondContact OD1-CG 3.47Å; D153-Q155 PolarHBondContact OD1-N 2.94Å; D153-Q155 PolarHBondContact OD1-NE2 3.16Å; D153-Q155 PolarHBondContact OD2-NE2 3.28Å; Q155-R157 VanDerWaalsContact C-N 3.35Å; Q155-R157 PolarHBondContact O-N 3.46Å; Q155-I158 PolarHBondContact O-N 3.11Å; Q155-L159 WeakPolarHBondContact O-CB 3.36Å; Q155-L159 PolarHBondContact O-N 3.04Å; Q155-F217 HydrophobicContact CB-CE1 3.56Å; Q155-F217 HydrophobicContact CB-CZ 4Å; Q155-F217 HydrophobicContact CG-CE1 4.28Å; Q155-S265 WeakPolarHBondContact CB-OG 3.36Å; Q155-L267 HydrophobicContact CG-CB 4.06Å; Q155-L267 HydrophobicContact CG-CD1 3.7Å; Q155-L267 HydrophobicContact CG-CG 3.61Å
156	L	95	Very high	92.2	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-70.2	-31.1	-176.5	177.4	57.8	0	0	0	112.6	M152 D153 P154 L159 L160 G211 M216 R220	M152-L156 HydrophobicContact CE-CD2 4.07Å; M152-L156 HydrophobicContact CE-CG 3.89Å; D153-L156 HydrophobicContact CB-CB 4.48Å; D153-L156 PolarHBondContact O-N 3.1Å; P154-L156 PolarHBondContact O-N 3.14Å; L156-L159 HydrophobicContact CD1-CD2 4.48Å; L156-L160 PolarHBondContact O-N 2.87Å; L156-G211 WeakPolarHBondContact CD2-O 3.42Å; L156-M216 HydrophobicContact CD2-CB 4.19Å; L156-R220 HydrophobicContact CD1-CB 4.17Å
157	R	95.7	Very high	92.9	Very high	3 Å²	3	15.6 Å²	15.6	1%	0.011	7%	0.07	C	C	.	.	H	α-helix	trans	-63.5	-54.2	172	-73.7	-177.8	-107.6	149.8	-14.1	111.4	L134 F137 M152 D153 P154 Q155 L159 L160 E161 P943	L134-R157 PolarHBondContact O-NH1 3.02Å; L134-R157 VanDerWaalsContact O-NH1 3.09Å; F137-R157 HydrophobicContact CB-CB 3.97Å; F137-R157 HydrophobicContact CB-CG 4Å; F137-R157 HydrophobicContact CD1-CB 4.31Å; F137-R157 HydrophobicContact CD1-CG 3.72Å; F137-R157 HydrophobicContact CD2-CB 3.66Å; F137-R157 HydrophobicContact CD2-CG 4Å; F137-R157 HydrophobicContact CE1-CG 4.12Å; F137-R157 HydrophobicContact CE2-CB 4.17Å; F137-R157 HydrophobicContact CE2-CG 4.37Å; F137-R157 WeakPolarHBondContact CE2-O 3.43Å; F137-R157 HydrophobicContact CG-CB 3.74Å; F137-R157 HydrophobicContact CG-CG 3.66Å; F137-R157 HydrophobicContact CZ-CG 4.43Å; M152-R157 HydrophobicContact CB-CG 4.1Å; M152-R157 HydrophobicContact CE-CG 4.19Å; M152-R157 PolarHBondContact O-NE 2.83Å; M152-R157 VanDerWaalsContact O-NE 3.1Å; M152-R157 PolarHBondContact O-NH2 3.26Å; D153-R157 PolarHBondContact O-N 2.9Å; D153-R157 VanDerWaalsContact O-N 3.12Å; P154-R157 PolarHBondContact O-N 2.84Å; Q155-R157 VanDerWaalsContact C-N 3.35Å; Q155-R157 PolarHBondContact O-N 3.46Å; R157-L159 VanDerWaalsContact C-N 3.3Å; R157-L159 PolarHBondContact O-N 3.05Å; R157-L160 PolarHBondContact O-N 3Å; R157-E161 PolarHBondContact O-N 2.98Å; R157-P943 PolarHBondContact NH2-O 2.74Å
158	I	96.3	Very high	93.7	Very high	6 Å²	6	11.1 Å²	11.1	3%	0.031	5%	0.051	C	C	.	.	H	α-helix	trans	-64.1	-37.6	178.6	-65.9	167.4	0	0	0	111	R89 V131 L134 P154 Q155 L160 E161 V162 I305	R89-I158 HydrophobicContact CB-CG2 3.93Å; R89-I158 HydrophobicContact CG-CG2 3.41Å; R89-I158 VanDerWaalsContact CG-CG2 3.41Å; V131-I158 HydrophobicContact CG1-CD1 4.46Å; L134-I158 HydrophobicContact CD2-CD1 3.71Å; P154-I158 WeakPolarHBondContact O-CG1 3.46Å; P154-I158 PolarHBondContact O-N 3Å; Q155-I158 PolarHBondContact O-N 3.11Å; I158-L160 VanDerWaalsContact C-N 3.3Å; I158-L160 PolarHBondContact O-N 3.35Å; I158-E161 PolarHBondContact O-N 3.41Å; I158-E161 VanDerWaalsContact O-N 3.11Å; I158-V162 HydrophobicContact CG2-CG1 4.14Å; I158-V162 WeakPolarHBondContact O-CG2 3.16Å; I158-V162 PolarHBondContact O-N 2.92Å; I158-I305 HydrophobicContact CB-CD1 4.39Å; I158-I305 HydrophobicContact CB-CG1 4.4Å; I158-I305 HydrophobicContact CD1-CD1 4.02Å; I158-I305 HydrophobicContact CG2-CB 3.82Å; I158-I305 HydrophobicContact CG2-CD1 4.04Å; I158-I305 HydrophobicContact CG2-CG1 4.05Å; I158-I305 HydrophobicContact CG2-CG2 4.07Å
159	L	96	Very high	94.1	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-61.3	-35.7	179.7	-170.5	70	0	0	0	112.6	Q155 L156 R157 A163 V186 F217 L221 A263 I305	Q155-L159 WeakPolarHBondContact O-CB 3.36Å; Q155-L159 PolarHBondContact O-N 3.04Å; L156-L159 HydrophobicContact CD1-CD2 4.48Å; R157-L159 VanDerWaalsContact C-N 3.3Å; R157-L159 PolarHBondContact O-N 3.05Å; L159-A163 WeakPolarHBondContact O-CB 3.46Å; L159-A163 PolarHBondContact O-N 3.4Å; L159-V186 HydrophobicContact CD1-CG1 4.39Å; L159-V186 HydrophobicContact CD2-CG1 3.96Å; L159-V186 HydrophobicContact CD2-CG2 4.46Å; L159-F217 HydrophobicContact CD2-CB 4.05Å; L159-F217 HydrophobicContact CD2-CD1 4.25Å; L159-F217 WeakPolarHBondContact CD2-O 3.48Å; L159-L221 HydrophobicContact CD2-CD1 3.98Å; L159-L221 HydrophobicContact CD2-CG 4.42Å; L159-L221 HydrophobicContact CG-CD1 3.97Å; L159-L221 HydrophobicContact CG-CD2 4.18Å; L159-L221 HydrophobicContact CG-CG 4.46Å; L159-A263 HydrophobicContact CD1-CB 3.62Å; L159-I305 HydrophobicContact CB-CG2 4.22Å; L159-I305 HydrophobicContact CD1-CG2 3.79Å
160	L	96.8	Very high	94.4	Very high	5 Å²	5	8.6 Å²	8.6	3%	0.026	4%	0.039	C	C	.	.	H	α-helix	trans	-64.9	-41.7	172.9	-81.8	160	0	0	0	112	F137 F142 M152 L156 R157 I158 F164 R220 L221 F224	F137-L160 HydrophobicContact CE2-CB 4.15Å; F137-L160 HydrophobicContact CE2-CD1 4.04Å; F137-L160 HydrophobicContact CZ-CD1 3.81Å; F142-L160 HydrophobicContact CD1-CB 3.92Å; F142-L160 HydrophobicContact CD1-CD2 3.89Å; F142-L160 HydrophobicContact CD1-CG 4.33Å; F142-L160 HydrophobicContact CD2-CB 4.43Å; F142-L160 HydrophobicContact CE1-CB 3.77Å; F142-L160 HydrophobicContact CE1-CD2 4.23Å; F142-L160 HydrophobicContact CE2-CB 4.31Å; F142-L160 HydrophobicContact CG-CB 4.26Å; F142-L160 HydrophobicContact CG-CD1 4.44Å; F142-L160 HydrophobicContact CZ-CB 3.99Å; F142-L160 WeakPolarHBondContact CZ-O 3.31Å; M152-L160 HydrophobicContact CE-CD1 3.86Å; L156-L160 PolarHBondContact O-N 2.87Å; R157-L160 PolarHBondContact O-N 3Å; I158-L160 VanDerWaalsContact C-N 3.3Å; I158-L160 PolarHBondContact O-N 3.35Å; L160-F164 PolarHBondContact O-N 2.63Å; L160-R220 HydrophobicContact CD1-CG 4.39Å; L160-L221 HydrophobicContact CB-CD2 4.5Å; L160-L221 HydrophobicContact CD2-CD2 3.81Å; L160-L221 HydrophobicContact CG-CD2 4.01Å; L160-F224 HydrophobicContact CD2-CB 4.04Å; L160-F224 HydrophobicContact CD2-CD1 4.49Å; L160-F224 HydrophobicContact CD2-CG 4.4Å
161	E	96.2	Very high	94.8	Very high	2 Å²	2	2.4 Å²	2.4	1%	0.009	1%	0.013	C	C	.	.	H	α-helix	trans	-66.5	-55.5	177.3	-70.1	-178.5	-177.4	0	0	111.7	R89 F137 D138 F142 R157 I158 A163 F164 E165 W936 H938	R89-E161 IonicContact NH2-OE2 3.57Å; F137-E161 WeakPolarHBondContact CA-OE1 3.46Å; F137-E161 HydrophobicContact CD2-CG 4.44Å; D138-E161 PolarHBondContact N-OE1 2.67Å; F142-E161 HydrophobicContact CE2-CG 3.65Å; F142-E161 HydrophobicContact CZ-CG 4.01Å; R157-E161 PolarHBondContact O-N 2.98Å; I158-E161 PolarHBondContact O-N 3.41Å; I158-E161 VanDerWaalsContact O-N 3.11Å; E161-A163 VanDerWaalsContact C-N 3.28Å; E161-A163 PolarHBondContact O-N 3.03Å; E161-F164 PolarHBondContact O-N 2.58Å; E161-F164 VanDerWaalsContact O-N 3.13Å; E161-E165 WeakPolarHBondContact O-CG 3.4Å; E161-E165 PolarHBondContact O-N 2.87Å; E161-W936 HydrophobicContact CB-CZ2 4.06Å; E161-W936 HydrophobicContact CG-CD2 4.06Å; E161-W936 HydrophobicContact CG-CG 4.28Å; E161-W936 HydrophobicContact CG-CZ2 4.1Å; E161-H938 VanDerWaalsContact CD-NE2 3.29Å; E161-H938 IonicContact OE1-CD2 3.33Å; E161-H938 IonicContact OE1-CE1 2.68Å; E161-H938 IonicContact OE1-NE2 2.67Å; E161-H938 PolarHBondContact OE1-NE2 3.05Å; E161-H938 IonicContact OE2-CE1 2.73Å; E161-H938 PolarHBondContact OE2-CE1 3.26Å; E161-H938 VanDerWaalsContact OE2-CE1 3.27Å; E161-H938 IonicContact OE2-NE2 3.27Å; E161-H938 PolarHBondContact OE2-NE2 3.41Å; E161-H938 VanDerWaalsContact OE2-NE2 3.1Å
162	V	97.1	Very high	94.9	Very high	0 Å²	0	2.1 Å²	2.1	0%	0	1%	0.011	C	C	.	.	H	α-helix	trans	-66.3	-28.7	-178.6	-59.6	0	0	0	0	113	R89 I158 A166 I305 A307	R89-V162 HydrophobicContact CG-CG1 4.05Å; I158-V162 HydrophobicContact CG2-CG1 4.14Å; I158-V162 WeakPolarHBondContact O-CG2 3.16Å; I158-V162 PolarHBondContact O-N 2.92Å; V162-A166 VanDerWaalsContact O-CB 3.28Å; V162-A166 WeakPolarHBondContact O-CB 3.35Å; V162-A166 PolarHBondContact O-N 3.01Å; V162-I305 HydrophobicContact CG2-CG2 3.82Å; V162-A307 HydrophobicContact CB-CB 4.33Å; V162-A307 HydrophobicContact CG2-CB 3.89Å
163	A	96.2	Very high	94.7	Very high	1 Å²	1	2.6 Å²	2.6	1%	0.008	1%	0.014	C	C	.	.	H	α-helix	trans	-65.3	-43.9	172.7	0	0	0	0	0	112.1	L159 E161 L167 L221 L261	L159-A163 WeakPolarHBondContact O-CB 3.46Å; L159-A163 PolarHBondContact O-N 3.4Å; E161-A163 VanDerWaalsContact C-N 3.28Å; E161-A163 PolarHBondContact O-N 3.03Å; A163-L167 WeakPolarHBondContact O-CD1 3.14Å; A163-L167 PolarHBondContact O-N 3.49Å; A163-L221 HydrophobicContact CB-CD1 4.43Å; A163-L221 HydrophobicContact CB-CD2 3.81Å; A163-L261 HydrophobicContact CB-CD1 4.32Å; A163-L261 HydrophobicContact CB-CD2 3.68Å
164	F	95.2	Very high	94.4	Very high	5 Å²	5	2.8 Å²	2.8	2%	0.022	2%	0.016	C	C	.	.	H	α-helix	trans	-67.2	-45.2	177.6	-159.3	-90.6	0	0	0	110.6	F141 L160 E161 A166 L167 L168 P174 F224 L225 W936	F141-F164 HydrophobicContact CE1-CD1 4.31Å; F141-F164 HydrophobicContact CE1-CD2 4.06Å; F141-F164 HydrophobicContact CE1-CE1 4.19Å; F141-F164 AromaticContact CE1-CE2 3.93Å; F141-F164 HydrophobicContact CE1-CE2 3.93Å; F141-F164 HydrophobicContact CE1-CG 4.25Å; F141-F164 HydrophobicContact CE1-CZ 4Å; F141-F164 HydrophobicContact CZ-CD1 4.32Å; F141-F164 HydrophobicContact CZ-CD2 4.41Å; F141-F164 AromaticContact CZ-CE1 3.77Å; F141-F164 HydrophobicContact CZ-CE1 3.77Å; F141-F164 AromaticContact CZ-CE2 3.86Å; F141-F164 HydrophobicContact CZ-CE2 3.86Å; F141-F164 AromaticContact CZ-CZ 3.51Å; F141-F164 HydrophobicContact CZ-CZ 3.51Å; L160-F164 PolarHBondContact O-N 2.63Å; E161-F164 PolarHBondContact O-N 2.58Å; E161-F164 VanDerWaalsContact O-N 3.13Å; F164-A166 VanDerWaalsContact C-N 3.35Å; F164-A166 PolarHBondContact O-N 3.08Å; F164-L167 PolarHBondContact O-N 3.03Å; F164-L167 VanDerWaalsContact O-N 3.17Å; F164-L168 HydrophobicContact CD1-CD1 3.67Å; F164-L168 HydrophobicContact CD1-CD2 4.5Å; F164-L168 HydrophobicContact CD1-CG 4.05Å; F164-L168 HydrophobicContact CE1-CD1 3.82Å; F164-L168 HydrophobicContact CE1-CD2 4.05Å; F164-L168 HydrophobicContact CE1-CG 4.1Å; F164-L168 WeakPolarHBondContact O-CG 3.39Å; F164-L168 PolarHBondContact O-N 3.41Å; F164-L168 VanDerWaalsContact O-N 3.11Å; F164-P174 HydrophobicContact CD1-CG 4.44Å; F164-P174 HydrophobicContact CD2-CB 4.22Å; F164-P174 HydrophobicContact CD2-CG 4.19Å; F164-P174 HydrophobicContact CE1-CG 3.96Å; F164-P174 HydrophobicContact CE2-CB 3.53Å; F164-P174 HydrophobicContact CE2-CG 3.68Å; F164-P174 HydrophobicContact CZ-CB 3.78Å; F164-P174 HydrophobicContact CZ-CG 3.54Å; F164-F224 AromaticContact CD2-CE1 3.86Å; F164-F224 HydrophobicContact CD2-CE1 3.86Å; F164-F224 HydrophobicContact CE2-CE1 4Å; F164-L225 HydrophobicContact CD2-CD2 3.91Å; F164-L225 HydrophobicContact CE2-CD2 4.34Å; F164-W936 HydrophobicContact CB-CH2 4.04Å; F164-W936 HydrophobicContact CB-CZ2 4.26Å; F164-W936 AromaticContact CD1-CH2 3.78Å; F164-W936 HydrophobicContact CD1-CH2 3.78Å; F164-W936 HydrophobicContact CD1-CZ2 4.43Å; F164-W936 HydrophobicContact CG-CH2 4.07Å
165	E	95.6	Very high	93.9	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-58.3	-40.8	174.8	-71.3	160.7	-154.8	0	0	113.2	S87 R89 E161 L167 L168 D169 I934 W936	S87-E165 VanDerWaalsContact CB-CB 3.48Å; S87-E165 WeakPolarHBondContact CB-OE2 3.32Å; S87-E165 PolarHBondContact OG-OE2 2.91Å; R89-E165 IonicContact CZ-OE1 2.73Å; R89-E165 IonicContact CZ-OE2 3.64Å; R89-E165 IonicContact NH1-OE1 2.9Å; R89-E165 PolarHBondContact NH1-OE1 2.81Å; R89-E165 IonicContact NH1-OE2 3.37Å; R89-E165 PolarHBondContact NH1-OE2 3.14Å; R89-E165 IonicContact NH2-OE1 3.85Å; R89-E165 PolarHBondContact NH2-OE1 3.4Å; R89-E165 IonicContact NH2-OE2 2.69Å; E161-E165 WeakPolarHBondContact O-CG 3.4Å; E161-E165 PolarHBondContact O-N 2.87Å; E165-L167 VanDerWaalsContact C-N 3.28Å; E165-L167 PolarHBondContact O-N 2.88Å; E165-L168 PolarHBondContact O-N 3.34Å; E165-D169 WeakPolarHBondContact O-CB 3.36Å; E165-D169 PolarHBondContact O-N 3.3Å; E165-I934 HydrophobicContact CG-CB 4.16Å; E165-I934 HydrophobicContact CG-CG2 4.2Å; E165-W936 HydrophobicContact CG-CZ2 4.2Å; E165-W936 PolarHBondContact OE1-NE1 3.49Å
166	A	96.7	Very high	93.5	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-64.6	-30.4	177.9	0	0	0	0	0	112.7	G85 V162 F164 A170 A307	G85-A166 WeakPolarHBondContact CA-O 3.44Å; V162-A166 VanDerWaalsContact O-CB 3.28Å; V162-A166 WeakPolarHBondContact O-CB 3.35Å; V162-A166 PolarHBondContact O-N 3.01Å; F164-A166 VanDerWaalsContact C-N 3.35Å; F164-A166 PolarHBondContact O-N 3.08Å; A166-A170 PolarHBondContact O-N 3.04Å; A166-A170 VanDerWaalsContact O-N 3.13Å; A166-A307 HydrophobicContact CB-CB 4.08Å
167	L	95.4	Very high	93.2	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-72.6	-42.7	170.7	-93	88.6	0	0	0	112.5	A163 F164 E165 D169 A170 G171 V172 P174 V177 F227 L261 F309	A163-L167 WeakPolarHBondContact O-CD1 3.14Å; A163-L167 PolarHBondContact O-N 3.49Å; F164-L167 PolarHBondContact O-N 3.03Å; F164-L167 VanDerWaalsContact O-N 3.17Å; E165-L167 VanDerWaalsContact C-N 3.28Å; E165-L167 PolarHBondContact O-N 2.88Å; L167-D169 PolarHBondContact O-N 2.94Å; L167-A170 WeakPolarHBondContact O-CB 3.44Å; L167-A170 PolarHBondContact O-N 2.78Å; L167-A170 VanDerWaalsContact O-N 3.16Å; L167-G171 PolarHBondContact O-N 3.35Å; L167-V172 CarbonylContact C-O 3.46Å; L167-V172 HydrophobicContact CB-CB 4.47Å; L167-V172 HydrophobicContact CD2-CB 4.4Å; L167-V172 HydrophobicContact CD2-CG1 3.9Å; L167-V172 WeakPolarHBondContact O-CB 3.36Å; L167-V172 PolarHBondContact O-N 2.78Å; L167-P174 HydrophobicContact CB-CG 4.05Å; L167-P174 HydrophobicContact CD2-CB 4.3Å; L167-P174 HydrophobicContact CD2-CG 4.31Å; L167-V177 HydrophobicContact CD2-CG2 3.95Å; L167-F227 HydrophobicContact CD1-CE2 4.41Å; L167-F227 HydrophobicContact CD1-CZ 4.33Å; L167-F227 HydrophobicContact CD2-CZ 3.73Å; L167-L261 HydrophobicContact CD1-CD1 4.17Å; L167-F309 HydrophobicContact CD1-CD2 3.73Å; L167-F309 HydrophobicContact CD1-CE2 3.91Å; L167-F309 HydrophobicContact CD1-CG 4.31Å; L167-F309 HydrophobicContact CD2-CE2 4.4Å; L167-F309 HydrophobicContact CD2-CZ 4.38Å; L167-F309 HydrophobicContact CG-CD1 4.5Å; L167-F309 HydrophobicContact CG-CD2 4.07Å; L167-F309 HydrophobicContact CG-CE2 4.08Å; L167-F309 HydrophobicContact CG-CG 4.3Å; L167-F309 HydrophobicContact CG-CZ 4.31Å
168	L	93.7	Very high	92.9	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.005	8%	0.084	C	C	.	.	H	α-helix	trans	-61.4	-37.1	175.8	-60.3	173	0	0	0	111	F164 E165 G171 P174 V535 I934	F164-L168 HydrophobicContact CD1-CD1 3.67Å; F164-L168 HydrophobicContact CD1-CD2 4.5Å; F164-L168 HydrophobicContact CD1-CG 4.05Å; F164-L168 HydrophobicContact CE1-CD1 3.82Å; F164-L168 HydrophobicContact CE1-CD2 4.05Å; F164-L168 HydrophobicContact CE1-CG 4.1Å; F164-L168 WeakPolarHBondContact O-CG 3.39Å; F164-L168 PolarHBondContact O-N 3.41Å; F164-L168 VanDerWaalsContact O-N 3.11Å; E165-L168 PolarHBondContact O-N 3.34Å; L168-G171 WeakPolarHBondContact O-CA 3.48Å; L168-G171 PolarHBondContact O-N 2.83Å; L168-P174 HydrophobicContact CD2-CG 4.06Å; L168-V535 HydrophobicContact CB-CG2 4.42Å; L168-V535 HydrophobicContact CD2-CB 3.77Å; L168-V535 HydrophobicContact CD2-CG1 4.48Å; L168-V535 HydrophobicContact CD2-CG2 4.25Å; L168-I934 HydrophobicContact CD1-CD1 3.76Å; L168-I934 HydrophobicContact CD1-CG1 3.75Å; L168-I934 HydrophobicContact CD1-CG2 4.08Å
169	D	95.2	Very high	92.6	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-68.4	-33.1	174.6	-170.7	64.9	0	0	0	113.6	G85 I86 E165 L167 G171 R318 Y320 M929 I930	G85-D169 WeakPolarHBondContact CA-OD2 3.44Å; I86-D169 PolarHBondContact N-OD2 3.14Å; E165-D169 WeakPolarHBondContact O-CB 3.36Å; E165-D169 PolarHBondContact O-N 3.3Å; L167-D169 PolarHBondContact O-N 2.94Å; D169-G171 PolarHBondContact O-N 3.15Å; D169-G171 VanDerWaalsContact O-N 3.14Å; D169-R318 WeakPolarHBondContact O-CD 3.49Å; D169-R318 IonicContact OD1-NH1 2.77Å; D169-R318 PolarHBondContact OD1-NH1 2.93Å; D169-Y320 PolarHBondContact OD1-OH 3.41Å; D169-Y320 VanDerWaalsContact OD1-OH 3.08Å; D169-Y320 VanDerWaalsContact OD2-CE2 3.23Å; D169-Y320 WeakPolarHBondContact OD2-CE2 3.41Å; D169-Y320 PolarHBondContact OD2-OH 2.99Å; D169-M929 VanDerWaalsContact OD1-CA 3.31Å; D169-M929 WeakPolarHBondContact OD1-CA 3.43Å; D169-I930 HydrophobicContact CB-CB 4.5Å; D169-I930 PolarHBondContact OD1-N 2.9Å
170	A	94.4	Very high	92.5	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-4.5	168.3	0	0	0	0	0	113.7	S84 A166 L167 V172 F309	S84-A170 WeakPolarHBondContact O-CA 3.46Å; S84-A170 WeakPolarHBondContact OG-CB 3.17Å; A166-A170 PolarHBondContact O-N 3.04Å; A166-A170 VanDerWaalsContact O-N 3.13Å; L167-A170 WeakPolarHBondContact O-CB 3.44Å; L167-A170 PolarHBondContact O-N 2.78Å; L167-A170 VanDerWaalsContact O-N 3.16Å; A170-V172 HydrophobicContact CB-CB 4.44Å; A170-V172 HydrophobicContact CB-CG2 3.87Å; A170-V172 PolarHBondContact O-N 2.93Å; A170-F309 HydrophobicContact CB-CB 4.28Å; A170-F309 HydrophobicContact CB-CD1 3.88Å; A170-F309 HydrophobicContact CB-CG 4.49Å
171	G	91.2	Very high	92.4	Very high	2 Å²	2	24.8 Å²	24.8	2%	0.021	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	14.1	-170.4	0	0	0	0	0	113.6	L167 L168 D169 R317	L167-G171 PolarHBondContact O-N 3.35Å; L168-G171 WeakPolarHBondContact O-CA 3.48Å; L168-G171 PolarHBondContact O-N 2.83Å; D169-G171 PolarHBondContact O-N 3.15Å; D169-G171 VanDerWaalsContact O-N 3.14Å; G171-R317 WeakPolarHBondContact O-CD 3.47Å
172	V	91.5	Very high	92.4	Very high	12 Å²	12	24.9 Å²	24.9	7%	0.073	12%	0.123	C	C	.	.			trans	-90.3	119.4	-178.9	178.5	0	0	0	0	109	L167 A170 P174 V177 F309	L167-V172 CarbonylContact C-O 3.46Å; L167-V172 HydrophobicContact CB-CB 4.47Å; L167-V172 HydrophobicContact CD2-CB 4.4Å; L167-V172 HydrophobicContact CD2-CG1 3.9Å; L167-V172 WeakPolarHBondContact O-CB 3.36Å; L167-V172 PolarHBondContact O-N 2.78Å; A170-V172 HydrophobicContact CB-CB 4.44Å; A170-V172 HydrophobicContact CB-CG2 3.87Å; A170-V172 PolarHBondContact O-N 2.93Å; V172-P174 WeakPolarHBondContact O-CD 3.45Å; V172-V177 HydrophobicContact CG1-CB 4.4Å; V172-V177 HydrophobicContact CG1-CG1 3.65Å; V172-V177 HydrophobicContact CG1-CG2 3.83Å; V172-F309 HydrophobicContact CG2-CD1 4.35Å; V172-F309 HydrophobicContact CG2-CE1 4.03Å
173	N	88.3	Confident	92.4	Very high	12 Å²	12	24.9 Å²	24.9	6%	0.064	12%	0.123	C	C	.	.			trans	-72.5	112	171.1	-178.2	-48.7	0	0	0	108.9	V175 K176 G534 N537	N173-V175 PolarHBondContact O-N 3.35Å; N173-V175 VanDerWaalsContact O-N 3.09Å; N173-V175 WeakPolarHBondContact OD1-CB 3.44Å; N173-V175 PolarHBondContact OD1-N 2.83Å; N173-V175 VanDerWaalsContact OD1-N 3.16Å; N173-K176 HydrophobicContact CB-CB 4.32Å; N173-K176 HydrophobicContact CB-CD 4.34Å; N173-K176 HydrophobicContact CB-CG 4.27Å; N173-K176 PolarHBondContact O-N 2.91Å; N173-K176 PolarHBondContact OD1-N 3.23Å; N173-G534 PolarHBondContact ND2-O 2.87Å; N173-N537 PolarHBondContact ND2-O 3.01Å
174	P	87.3	Confident	92.5	Very high	4 Å²	4	24.9 Å²	24.9	3%	0.026	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-18.6	-170.1	-26	39.1	0	0	0	114.1	F164 L167 L168 V172 V177 R178	F164-P174 HydrophobicContact CD1-CG 4.44Å; F164-P174 HydrophobicContact CD2-CB 4.22Å; F164-P174 HydrophobicContact CD2-CG 4.19Å; F164-P174 HydrophobicContact CE1-CG 3.96Å; F164-P174 HydrophobicContact CE2-CB 3.53Å; F164-P174 HydrophobicContact CE2-CG 3.68Å; F164-P174 HydrophobicContact CZ-CB 3.78Å; F164-P174 HydrophobicContact CZ-CG 3.54Å; L167-P174 HydrophobicContact CB-CG 4.05Å; L167-P174 HydrophobicContact CD2-CB 4.3Å; L167-P174 HydrophobicContact CD2-CG 4.31Å; L168-P174 HydrophobicContact CD2-CG 4.06Å; V172-P174 WeakPolarHBondContact O-CD 3.45Å; P174-V177 WeakPolarHBondContact O-CG2 3.47Å; P174-R178 WeakPolarHBondContact O-CG 3.27Å
175	V	84.6	Confident	92.7	Very high	46 Å²	46	24.8 Å²	24.8	28%	0.279	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-37.4	176.1	-173.2	0	0	0	0	111	N173 V177 V538 P539 M542	N173-V175 PolarHBondContact O-N 3.35Å; N173-V175 VanDerWaalsContact O-N 3.09Å; N173-V175 WeakPolarHBondContact OD1-CB 3.44Å; N173-V175 PolarHBondContact OD1-N 2.83Å; N173-V175 VanDerWaalsContact OD1-N 3.16Å; V175-V177 PolarHBondContact O-N 2.68Å; V175-V538 HydrophobicContact CG2-CB 4.3Å; V175-V538 HydrophobicContact CG2-CG1 4.05Å; V175-P539 HydrophobicContact CG1-CG 4.36Å; V175-M542 HydrophobicContact CG2-SD 3.67Å
176	K	85	Confident	92.8	Very high	135 Å²	135	24.8 Å²	24.8	59%	0.587	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-4.8	179.2	-65.7	-174.4	176.8	-179.6	0	113.7	N173 D911	N173-K176 HydrophobicContact CB-CB 4.32Å; N173-K176 HydrophobicContact CB-CD 4.34Å; N173-K176 HydrophobicContact CB-CG 4.27Å; N173-K176 PolarHBondContact O-N 2.91Å; N173-K176 PolarHBondContact OD1-N 3.23Å; K176-D911 IonicContact NZ-OD1 3.1Å; K176-D911 IonicContact NZ-OD2 2.96Å; K176-D911 PolarHBondContact NZ-OD2 2.71Å
177	V	88.7	Confident	92.8	Very high	37 Å²	37	24.8 Å²	24.8	22%	0.224	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.8	8.3	178.6	-65.6	0	0	0	0	114.8	L167 V172 P174 V175 S180 F227	L167-V177 HydrophobicContact CD2-CG2 3.95Å; V172-V177 HydrophobicContact CG1-CB 4.4Å; V172-V177 HydrophobicContact CG1-CG1 3.65Å; V172-V177 HydrophobicContact CG1-CG2 3.83Å; P174-V177 WeakPolarHBondContact O-CG2 3.47Å; V175-V177 PolarHBondContact O-N 2.68Å; V177-S180 WeakPolarHBondContact O-CB 3.31Å; V177-S180 PolarHBondContact O-N 2.86Å; V177-S180 PolarHBondContact O-OG 2.97Å; V177-F227 HydrophobicContact CG2-CE1 4.05Å; V177-F227 HydrophobicContact CG2-CZ 4.43Å
178	R	90	Very high	92.8	Very high	104 Å²	104	24.8 Å²	24.8	39%	0.392	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	137.4	172.6	-61.3	-170.9	74.5	82.1	5.5	110.6	P174 S180 F224 D226	P174-R178 WeakPolarHBondContact O-CG 3.27Å; R178-S180 VanDerWaalsContact C-N 3.3Å; R178-F224 VanDerWaalsContact CZ-O 3.28Å; R178-F224 PolarHBondContact NH1-O 3.06Å; R178-F224 PolarHBondContact NH2-O 2.97Å; R178-D226 HydrophobicContact CB-CB 4.15Å
179	G	90.2	Very high	92.5	Very high	29 Å²	29	26.4 Å²	26.4	30%	0.299	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	-2.3	-177.3	0	0	0	0	0	115.2	D226	G179-D226 VanDerWaalsContact CA-O 3.29Å; G179-D226 WeakPolarHBondContact CA-O 3.48Å; G179-D226 PolarHBondContact N-O 3.19Å; G179-D226 PolarHBondContact N-OD2 2.96Å
180	S	92.9	Very high	91.8	Very high	21 Å²	21	28.5 Å²	28.5	15%	0.147	16%	0.156	C	C	.	.	S	Bend	trans	-67.2	161.8	-179.7	61.3	0	0	0	0	113.7	V177 R178 T182 R228 E258	V177-S180 WeakPolarHBondContact O-CB 3.31Å; V177-S180 PolarHBondContact O-N 2.86Å; V177-S180 PolarHBondContact O-OG 2.97Å; R178-S180 VanDerWaalsContact C-N 3.3Å; S180-T182 PolarHBondContact O-N 2.91Å; S180-T182 PolarHBondContact OG-OG1 2.92Å; S180-R228 PolarHBondContact O-N 2.77Å; S180-E258 WeakPolarHBondContact CB-OE1 3.12Å
181	R	94.7	Very high	91.4	Very high	110 Å²	110	29.5 Å²	29.5	42%	0.415	16%	0.163	S	C	.	.			trans	-80.4	51	169.6	-60.5	-171	-60.6	148.4	1.9	110.1	D255 C257 E258	R181-D255 IonicContact CZ-OD2 3.46Å; R181-D255 VanDerWaalsContact CZ-OD2 3.3Å; R181-D255 PolarHBondContact NH1-O 3.18Å; R181-D255 IonicContact NH1-OD2 3.3Å; R181-D255 PolarHBondContact NH1-OD2 2.77Å; R181-D255 IonicContact NH2-OD1 2.72Å; R181-D255 IonicContact NH2-OD2 3.62Å; R181-D255 PolarHBondContact NH2-OD2 2.72Å; R181-C257 CarbonylContact O-C 3.55Å; R181-C257 WeakPolarHBondContact O-CA 3.38Å; R181-C257 WeakPolarHBondContact O-CB 3.35Å; R181-E258 PolarHBondContact N-OE1 3.03Å; R181-E258 PolarHBondContact O-N 2.77Å
182	T	97	Very high	91.3	Very high	4 Å²	4	30.6 Å²	30.6	3%	0.025	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	132.2	173.6	-62.1	0	0	0	0	109.7	S180 F227 G229 A259 F309	S180-T182 PolarHBondContact O-N 2.91Å; S180-T182 PolarHBondContact OG-OG1 2.92Å; T182-F227 HydrophobicContact CG2-CD1 4.3Å; T182-F227 HydrophobicContact CG2-CD2 3.5Å; T182-F227 VanDerWaalsContact CG2-CD2 3.5Å; T182-F227 HydrophobicContact CG2-CE1 4.32Å; T182-F227 HydrophobicContact CG2-CE2 3.52Å; T182-F227 HydrophobicContact CG2-CG 3.92Å; T182-F227 HydrophobicContact CG2-CZ 3.97Å; T182-G229 VanDerWaalsContact O-CA 3.28Å; T182-G229 WeakPolarHBondContact O-CA 3.4Å; T182-G229 PolarHBondContact O-N 2.92Å; T182-A259 WeakPolarHBondContact CA-O 3.39Å; T182-A259 HydrophobicContact CG2-CB 4.31Å; T182-F309 HydrophobicContact CG2-CE2 3.8Å; T182-F309 HydrophobicContact CG2-CZ 4.14Å
183	G	97	Very high	91.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	162.8	174.8	0	0	0	0	0	113.5	P230 A259 A260 L261	G183-P230 CarbonylContact C-O 3.56Å; G183-P230 VanDerWaalsContact CA-O 3.3Å; G183-P230 WeakPolarHBondContact CA-O 3.26Å; G183-A259 PolarHBondContact N-O 2.88Å; G183-A260 CarbonylContact O-C 3.58Å; G183-A260 WeakPolarHBondContact O-CA 3.4Å; G183-L261 PolarHBondContact O-N 3.04Å
184	V	98.5	Very high	91	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	118.3	177.2	179	0	0	0	0	110	V186 A218 L221 S222 F227 P230 S231 F232 L261	V184-V186 HydrophobicContact CG1-CG2 4.03Å; V184-A218 HydrophobicContact CG1-CB 4.02Å; V184-L221 HydrophobicContact CG1-CB 4.11Å; V184-L221 HydrophobicContact CG1-CD1 3.88Å; V184-S222 VanDerWaalsContact CG2-OG 3.28Å; V184-S222 WeakPolarHBondContact CG2-OG 3.11Å; V184-F227 HydrophobicContact CG2-CB 4.34Å; V184-F227 HydrophobicContact CG2-CD2 3.83Å; V184-P230 PolarHBondContact N-O 3.12Å; V184-S231 CarbonylContact O-C 3.49Å; V184-S231 VanDerWaalsContact O-CA 3.31Å; V184-S231 WeakPolarHBondContact O-CA 3.22Å; V184-F232 PolarHBondContact O-N 2.82Å; V184-L261 CarbonylContact C-O 3.55Å; V184-L261 WeakPolarHBondContact CA-O 3.39Å; V184-L261 HydrophobicContact CG1-CD2 4.49Å; V184-L261 HydrophobicContact CG2-CB 4.39Å; V184-L261 HydrophobicContact CG2-CD2 4.49Å
185	F	98.3	Very high	90.6	Very high	3 Å²	3	34 Å²	34	1%	0.013	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	111	-175.6	-58	-101.3	0	0	0	110	P230 F232 A244 L247 A248 A251 A260 L261 V262 A263	F185-P230 HydrophobicContact CE1-CB 4.39Å; F185-P230 HydrophobicContact CZ-CB 3.95Å; F185-P230 HydrophobicContact CZ-CG 4.37Å; F185-F232 WeakPolarHBondContact CA-O 3.36Å; F185-F232 HydrophobicContact CD1-CB 4.48Å; F185-F232 AromaticContact CD1-CD2 3.96Å; F185-F232 HydrophobicContact CD1-CD2 3.96Å; F185-F232 AromaticContact CE1-CD2 3.68Å; F185-F232 HydrophobicContact CE1-CD2 3.68Å; F185-F232 HydrophobicContact CE1-CE2 4.19Å; F185-A244 HydrophobicContact CB-CB 4Å; F185-L247 HydrophobicContact CD1-CB 3.79Å; F185-L247 HydrophobicContact CE1-CB 3.89Å; F185-A248 HydrophobicContact CB-CB 4.46Å; F185-A248 HydrophobicContact CD2-CB 3.52Å; F185-A248 HydrophobicContact CE2-CB 3.78Å; F185-A248 HydrophobicContact CG-CB 3.95Å; F185-A248 HydrophobicContact CZ-CB 4.39Å; F185-A251 HydrophobicContact CE2-CB 4.49Å; F185-A251 HydrophobicContact CZ-CB 3.76Å; F185-A260 HydrophobicContact CD2-CB 4.14Å; F185-A260 HydrophobicContact CE2-CB 3.99Å; F185-L261 PolarHBondContact N-O 3.2Å; F185-V262 HydrophobicContact CB-CG1 4.44Å; F185-V262 CarbonylContact O-C 2.99Å; F185-V262 VanDerWaalsContact O-CA 3.31Å; F185-V262 WeakPolarHBondContact O-CA 3.48Å; F185-A263 PolarHBondContact O-N 2.87Å
186	V	98.2	Very high	90.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	113.6	-172.4	-172.6	0	0	0	0	111.6	L159 V184 C188 F217 A218 L221 F232 A233 V234 A263	L159-V186 HydrophobicContact CD1-CG1 4.39Å; L159-V186 HydrophobicContact CD2-CG1 3.96Å; L159-V186 HydrophobicContact CD2-CG2 4.46Å; V184-V186 HydrophobicContact CG1-CG2 4.03Å; V186-C188 HydrophobicContact CG1-CB 4.26Å; V186-C188 PolarHBondContact O-N 2.86Å; V186-F217 HydrophobicContact CG1-CB 4.19Å; V186-A218 HydrophobicContact CG2-CB 4.05Å; V186-L221 HydrophobicContact CG2-CD1 3.93Å; V186-F232 PolarHBondContact N-O 2.71Å; V186-A233 CarbonylContact O-C 3.58Å; V186-A233 WeakPolarHBondContact O-CA 3.35Å; V186-V234 PolarHBondContact O-N 3.38Å; V186-A263 CarbonylContact C-O 3.59Å; V186-A263 WeakPolarHBondContact CA-O 3.43Å; V186-A263 HydrophobicContact CG1-CB 4.3Å; V186-A263 HydrophobicContact CG2-CB 4.27Å
187	G	97.2	Very high	90	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	103.3	170.3	0	0	0	0	0	111.9	V234 A263 G264 S265	G187-V234 CarbonylContact C-O 3.59Å; G187-V234 WeakPolarHBondContact CA-O 3.36Å; G187-A263 PolarHBondContact N-O 2.93Å; G187-G264 CarbonylContact O-C 3.57Å; G187-G264 VanDerWaalsContact O-CA 3.3Å; G187-G264 WeakPolarHBondContact O-CA 3.41Å; G187-S265 PolarHBondContact O-N 2.99Å
188	C	94.7	Very high	89.6	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	151.9	-178.5	62.7	0	0	0	0	111.7	V186 F217 V234 D235	V186-C188 HydrophobicContact CG1-CB 4.26Å; V186-C188 PolarHBondContact O-N 2.86Å; C188-F217 HydrophobicContact CB-CD1 3.81Å; C188-F217 HydrophobicContact CB-CE1 4.21Å; C188-V234 PolarHBondContact N-O 3.35Å; C188-V234 VanDerWaalsContact O-O 3.13Å; C188-D235 WeakPolarHBondContact O-CB 3.45Å
189	S	87.6	Confident	88.8	Confident	36 Å²	36	31.6 Å²	31.6	25%	0.252	19%	0.186	S	C	.	.			trans	-110.7	-135.6	-178.3	-163.8	0	0	0	0	112	R214 D235	S189-R214 PolarHBondContact O-NE 3.17Å; S189-R214 PolarHBondContact O-NH2 2.93Å; S189-R214 PolarHBondContact OG-NH2 2.73Å; S189-D235 PolarHBondContact OG-OD1 2.71Å; S189-D235 PolarHBondContact OG-OD2 3.12Å
190	G	79.8	Confident	87.6	Confident	44 Å²	44	32.5 Å²	32.5	45%	0.454	18%	0.184	S	C	.	.			trans	-69.4	145.3	-178.8	0	0	0	0	0	113.7
191	S	87.7	Confident	86.4	Confident	21 Å²	21	36.8 Å²	36.8	15%	0.147	21%	0.211	C	C	.	.			trans	-88.5	111.2	165.7	169.2	0	0	0	0	109.3	D153 T193 A194 C212	D153-S191 WeakPolarHBondContact OD2-CB 3.36Å; D153-S191 PolarHBondContact OD2-OG 3.37Å; S191-T193 PolarHBondContact OG-N 2.94Å; S191-A194 PolarHBondContact O-N 3.2Å; S191-A194 PolarHBondContact OG-N 3.44Å; S191-C212 WeakPolarHBondContact CB-O 3.42Å
192	E	87.3	Confident	84.8	Confident	25 Å²	25	38 Å²	38	12%	0.117	22%	0.222	C	C	.	.	H	α-helix	trans	-69.3	-27	171.6	-60	-166.7	142.6	0	0	111.4	A195 W196 L269 T270 T273	E192-A195 PolarHBondContact O-N 3.15Å; E192-W196 PolarHBondContact O-N 3.34Å; E192-L269 HydrophobicContact CB-CB 4.37Å; E192-L269 WeakPolarHBondContact OE2-CA 3.45Å; E192-L269 WeakPolarHBondContact OE2-CB 3.28Å; E192-L269 PolarHBondContact OE2-N 3.4Å; E192-T270 HydrophobicContact CB-CG2 4.02Å; E192-T270 HydrophobicContact CG-CG2 4.47Å; E192-T270 PolarHBondContact OE1-OG1 3.23Å; E192-T270 PolarHBondContact OE2-N 3.26Å; E192-T270 PolarHBondContact OE2-OG1 3.09Å; E192-T273 VanDerWaalsContact OE1-CB 3.23Å; E192-T273 WeakPolarHBondContact OE1-CB 3.42Å; E192-T273 PolarHBondContact OE1-OG1 3.14Å
193	T	88.5	Confident	83.2	Confident	8 Å²	8	43.9 Å²	43.9	5%	0.049	25%	0.253	C	S	.	.	H	α-helix	trans	-63.4	-41.1	174.5	-47.5	0	0	0	0	112.2	D153 P154 S191 A195 W196 L197 V945	D153-T193 WeakPolarHBondContact OD2-CB 3.47Å; D153-T193 PolarHBondContact OD2-OG1 3.03Å; P154-T193 WeakPolarHBondContact CD-OG1 3.38Å; S191-T193 PolarHBondContact OG-N 2.94Å; T193-A195 VanDerWaalsContact C-N 3.33Å; T193-A195 PolarHBondContact O-N 2.94Å; T193-W196 PolarHBondContact O-N 2.86Å; T193-L197 HydrophobicContact CG2-CD1 3.94Å; T193-L197 HydrophobicContact CG2-CG 4.27Å; T193-L197 PolarHBondContact O-N 2.96Å; T193-V945 HydrophobicContact CG2-CG2 4.13Å
194	A	86.7	Confident	82.1	Confident	28 Å²	28	46.9 Å²	46.9	23%	0.231	27%	0.271	C	S	.	.	H	α-helix	trans	-55.9	-48.1	177	0	0	0	0	0	111.3	S191 W196 L197 T198 C212	S191-A194 PolarHBondContact O-N 3.2Å; S191-A194 PolarHBondContact OG-N 3.44Å; A194-W196 PolarHBondContact O-N 3.39Å; A194-L197 PolarHBondContact O-N 2.84Å; A194-T198 WeakPolarHBondContact O-CG2 3.32Å; A194-T198 PolarHBondContact O-N 3.01Å; A194-T198 PolarHBondContact O-OG1 2.89Å; A194-C212 HydrophobicContact CB-CB 3.75Å
195	A	78.7	Confident	81	Confident	62 Å²	62	49.3 Å²	49.3	51%	0.512	29%	0.285	S	S	.	.	H	α-helix	trans	-63.6	-27.7	-177.2	0	0	0	0	0	113.5	E192 T193	E192-A195 PolarHBondContact O-N 3.15Å; T193-A195 VanDerWaalsContact C-N 3.33Å; T193-A195 PolarHBondContact O-N 2.94Å
196	W	77.7	Confident	80	Confident	70 Å²	70	52.2 Å²	52.2	27%	0.265	32%	0.317	S	S	.	.	H	α-helix	trans	-78.7	-49.3	172.4	-178.6	80.2	0	0	0	111.9	E192 T193 A194 T198 R199 V945 D949	E192-W196 PolarHBondContact O-N 3.34Å; T193-W196 PolarHBondContact O-N 2.86Å; A194-W196 PolarHBondContact O-N 3.39Å; W196-T198 PolarHBondContact O-N 2.96Å; W196-R199 PolarHBondContact O-N 2.78Å; W196-R199 VanDerWaalsContact O-N 3.15Å; W196-V945 HydrophobicContact CB-CB 4.5Å; W196-V945 HydrophobicContact CB-CG1 3.89Å; W196-V945 HydrophobicContact CB-CG2 3.72Å; W196-V945 HydrophobicContact CD2-CG1 4.26Å; W196-V945 HydrophobicContact CD2-CG2 3.92Å; W196-V945 HydrophobicContact CE3-CG2 3.89Å; W196-V945 HydrophobicContact CG-CB 4.42Å; W196-V945 HydrophobicContact CG-CG1 3.73Å; W196-V945 HydrophobicContact CG-CG2 3.87Å; W196-D949 HydrophobicContact CZ2-CB 4.05Å
197	L	78.3	Confident	79.4	Confident	26 Å²	26	57.2 Å²	57.2	14%	0.136	34%	0.336	C	S	.	.	H	α-helix	trans	-61.6	-23.4	180	-73.7	176.4	0	0	0	113.6	N151 T193 A194	N151-L197 HydrophobicContact CB-CD1 4.43Å; T193-L197 HydrophobicContact CG2-CD1 3.94Å; T193-L197 HydrophobicContact CG2-CG 4.27Å; T193-L197 PolarHBondContact O-N 2.96Å; A194-L197 PolarHBondContact O-N 2.84Å
198	T	80.8	Confident	78.8	Confident	77 Å²	77	57.8 Å²	57.8	47%	0.472	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	5.1	178.5	62.4	0	0	0	0	114.7	A194 W196 V204	A194-T198 WeakPolarHBondContact O-CG2 3.32Å; A194-T198 PolarHBondContact O-N 3.01Å; A194-T198 PolarHBondContact O-OG1 2.89Å; W196-T198 PolarHBondContact O-N 2.96Å; T198-V204 HydrophobicContact CG2-CG1 4.44Å
199	R	72.6	Confident	78.4	Confident	99 Å²	99	63.2 Å²	63.2	37%	0.374	37%	0.369	S	S	.	.	S	Bend	trans	-73.2	-40	-173.8	-173.8	-179.1	63.7	174.7	-11.5	114.2	W196 D949 M950	W196-R199 PolarHBondContact O-N 2.78Å; W196-R199 VanDerWaalsContact O-N 3.15Å; R199-D949 PolarHBondContact NH2-O 2.93Å; R199-M950 PolarHBondContact NH1-O 3.34Å
200	D	65.9	Low	78.4	Confident	48 Å²	48	63.9 Å²	63.9	26%	0.257	37%	0.371	S	S	.	.	S	Bend	trans	-105.8	108.5	179	-170.9	-21.1	0	0	0	109.4	E202 L203 V204 K1004	D200-E202 PolarHBondContact O-N 2.8Å; D200-E202 PolarHBondContact OD1-N 2.92Å; D200-L203 HydrophobicContact CB-CB 4.37Å; D200-L203 HydrophobicContact CB-CD1 4.15Å; D200-L203 HydrophobicContact CB-CG 4.23Å; D200-L203 PolarHBondContact O-N 3.17Å; D200-V204 WeakPolarHBondContact O-CG2 3.41Å; D200-V204 PolarHBondContact O-N 2.86Å; D200-K1004 VanDerWaalsContact CG-NZ 3.26Å; D200-K1004 IonicContact OD1-NZ 3.42Å; D200-K1004 PolarHBondContact OD1-NZ 2.55Å; D200-K1004 IonicContact OD2-NZ 2.82Å; D200-K1004 PolarHBondContact OD2-NZ 3.34Å
201	P	66.6	Low	78.9	Confident	111 Å²	111	61.8 Å²	61.8	72%	0.721	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-27.8	-178.2	-29.6	37.2	0	0	0	114.9	L203	P201-L203 VanDerWaalsContact C-N 3.29Å; P201-L203 PolarHBondContact O-N 3.03Å
202	E	61.1	Low	79.1	Confident	137 Å²	137	61 Å²	61	64%	0.64	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-18.5	179.3	-64	-179.9	171	0	0	113.3	D200 K1004	D200-E202 PolarHBondContact O-N 2.8Å; D200-E202 PolarHBondContact OD1-N 2.92Å; E202-K1004 WeakPolarHBondContact OE2-CE 3.41Å; E202-K1004 IonicContact OE2-NZ 2.77Å; E202-K1004 PolarHBondContact OE2-NZ 3.26Å
203	L	65	Low	79.2	Confident	127 Å²	127	62.6 Å²	62.6	67%	0.665	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	-6.3	-177	-59	-179.5	0	0	0	113.5	D200 P201 T205	D200-L203 HydrophobicContact CB-CB 4.37Å; D200-L203 HydrophobicContact CB-CD1 4.15Å; D200-L203 HydrophobicContact CB-CG 4.23Å; D200-L203 PolarHBondContact O-N 3.17Å; P201-L203 VanDerWaalsContact C-N 3.29Å; P201-L203 PolarHBondContact O-N 3.03Å; L203-T205 PolarHBondContact O-N 2.9Å
204	V	73.3	Confident	79.3	Confident	63 Å²	63	66.5 Å²	66.5	38%	0.382	37%	0.369	S	S	.	.			trans	-69.9	118.7	-176.5	-172.2	0	0	0	0	110.8	T198 D200	T198-V204 HydrophobicContact CG2-CG1 4.44Å; D200-V204 WeakPolarHBondContact O-CG2 3.41Å; D200-V204 PolarHBondContact O-N 2.86Å
205	T	74.8	Confident	79.6	Confident	50 Å²	50	67.7 Å²	67.7	31%	0.307	38%	0.376	S	S	.	.			trans	-99.8	146.8	170	80.8	0	0	0	0	111	N151 L203 Y207 S208	N151-T205 VanDerWaalsContact CG-OG1 3.25Å; N151-T205 PolarHBondContact ND2-OG1 2.59Å; N151-T205 PolarHBondContact OD1-OG1 3.33Å; L203-T205 PolarHBondContact O-N 2.9Å; T205-Y207 PolarHBondContact O-N 3.45Å; T205-Y207 VanDerWaalsContact O-N 3.08Å; T205-S208 WeakPolarHBondContact O-CB 3.37Å; T205-S208 PolarHBondContact O-N 3Å; T205-S208 VanDerWaalsContact O-N 3.16Å; T205-S208 PolarHBondContact O-OG 2.95Å
206	G	78.1	Confident	80.3	Confident	65 Å²	65	66.9 Å²	66.9	67%	0.67	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-15.5	175.4	0	0	0	0	0	114.6	S208	G206-S208 VanDerWaalsContact C-N 3.32Å; G206-S208 PolarHBondContact O-N 3.47Å
207	Y	84.3	Confident	81.2	Confident	104 Å²	104	63.6 Å²	63.6	41%	0.408	35%	0.349	S	S	.	.	H	α-helix	trans	-70.1	-28.3	176.6	-57	-52.5	0	0	0	113	Q148 T205 L209 T210 G211	Q148-Y207 HydrophobicContact CG-CD1 3.7Å; Q148-Y207 HydrophobicContact CG-CE1 4.02Å; Q148-Y207 HydrophobicContact CG-CG 3.99Å; T205-Y207 PolarHBondContact O-N 3.45Å; T205-Y207 VanDerWaalsContact O-N 3.08Å; Y207-L209 PolarHBondContact O-N 3.2Å; Y207-T210 CarbonylContact O-C 3.56Å; Y207-T210 WeakPolarHBondContact O-CA 3.38Å; Y207-T210 PolarHBondContact O-N 3.29Å; Y207-T210 PolarHBondContact O-OG1 3.46Å; Y207-G211 PolarHBondContact O-N 2.88Å
208	S	84.6	Confident	82	Confident	12 Å²	12	62.3 Å²	62.3	8%	0.084	34%	0.343	C	S	.	.	H	α-helix	trans	-53.9	-39.1	175.9	61.2	0	0	0	0	112.6	T205 G206 T210 G211 C212	T205-S208 WeakPolarHBondContact O-CB 3.37Å; T205-S208 PolarHBondContact O-N 3Å; T205-S208 VanDerWaalsContact O-N 3.16Å; T205-S208 PolarHBondContact O-OG 2.95Å; G206-S208 VanDerWaalsContact C-N 3.32Å; G206-S208 PolarHBondContact O-N 3.47Å; S208-T210 PolarHBondContact O-N 2.87Å; S208-G211 PolarHBondContact O-N 3.05Å; S208-C212 WeakPolarHBondContact O-CB 3.22Å; S208-C212 PolarHBondContact O-N 3.3Å
209	L	86.2	Confident	82.7	Confident	114 Å²	114	61.9 Å²	61.9	60%	0.597	34%	0.338	S	S	*	.	H	α-helix	trans	-57.9	-51.7	173.5	-175.7	68.8	0	0	0	110.6	Y207 G211 V213	Y207-L209 PolarHBondContact O-N 3.2Å; L209-G211 PolarHBondContact O-N 3.43Å; L209-V213 HydrophobicContact CD1-CB 4.23Å; L209-V213 HydrophobicContact CD1-CG1 4.4Å; L209-V213 HydrophobicContact CD1-CG2 4.44Å; L209-V213 WeakPolarHBondContact O-CB 3.39Å; L209-V213 WeakPolarHBondContact O-CG1 3.22Å; L209-V213 PolarHBondContact O-N 3.03Å
210	T	89	Confident	83.8	Confident	51 Å²	51	58.5 Å²	58.5	31%	0.313	33%	0.325	S	S	.	.	H	α-helix	trans	-72.7	-8	-179.5	67.9	0	0	0	0	114.7	Y207 S208 R220	Y207-T210 CarbonylContact O-C 3.56Å; Y207-T210 WeakPolarHBondContact O-CA 3.38Å; Y207-T210 PolarHBondContact O-N 3.29Å; Y207-T210 PolarHBondContact O-OG1 3.46Å; S208-T210 PolarHBondContact O-N 2.87Å; T210-R220 PolarHBondContact O-NE 3.26Å; T210-R220 PolarHBondContact O-NH2 2.92Å
211	G	89.9	Confident	85.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-116.2	-16.9	-175	0	0	0	0	0	115.4	D153 L156 Y207 S208 L209	D153-G211 PolarHBondContact N-O 3.14Å; L156-G211 WeakPolarHBondContact CD2-O 3.42Å; Y207-G211 PolarHBondContact O-N 2.88Å; S208-G211 PolarHBondContact O-N 3.05Å; L209-G211 PolarHBondContact O-N 3.43Å
212	C	90.8	Very high	86.6	Confident	4 Å²	4	51.6 Å²	51.6	3%	0.027	28%	0.283	C	S	.	.	H	α-helix	trans	-135.9	-12.3	-174.6	-55.7	0	0	0	0	115.3	N151 D153 S191 A194 S208	N151-C212 PolarHBondContact O-SG 3.41Å; D153-C212 HydrophobicContact CB-CB 4.47Å; D153-C212 PolarHBondContact N-SG 3.36Å; S191-C212 WeakPolarHBondContact CB-O 3.42Å; A194-C212 HydrophobicContact CB-CB 3.75Å; S208-C212 WeakPolarHBondContact O-CB 3.22Å; S208-C212 PolarHBondContact O-N 3.3Å
213	V	90.6	Very high	88.2	Confident	58 Å²	58	53.8 Å²	53.8	35%	0.352	29%	0.286	S	S	.	.	S	Bend	trans	-70.9	138.5	177.4	79.6	0	0	0	0	111	L209 S215 M216	L209-V213 HydrophobicContact CD1-CB 4.23Å; L209-V213 HydrophobicContact CD1-CG1 4.4Å; L209-V213 HydrophobicContact CD1-CG2 4.44Å; L209-V213 WeakPolarHBondContact O-CB 3.39Å; L209-V213 WeakPolarHBondContact O-CG1 3.22Å; L209-V213 PolarHBondContact O-N 3.03Å; V213-S215 VanDerWaalsContact C-N 3.29Å; V213-S215 PolarHBondContact O-N 3.25Å; V213-S215 VanDerWaalsContact O-N 3.12Å; V213-M216 HydrophobicContact CG1-CB 4.37Å; V213-M216 HydrophobicContact CG1-CG 3.62Å; V213-M216 WeakPolarHBondContact O-CB 3.45Å; V213-M216 PolarHBondContact O-N 3.09Å
214	R	91.1	Very high	89.6	Confident	91 Å²	91	48.9 Å²	48.9	34%	0.343	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-39.4	-168.8	-169.6	-175.6	-69.1	-179.5	-10.6	114.1	S189 M216 F217 A233 D235	S189-R214 PolarHBondContact O-NE 3.17Å; S189-R214 PolarHBondContact O-NH2 2.93Å; S189-R214 PolarHBondContact OG-NH2 2.73Å; R214-M216 PolarHBondContact O-N 2.87Å; R214-F217 VanDerWaalsContact O-CB 3.29Å; R214-F217 WeakPolarHBondContact O-CB 3.39Å; R214-F217 WeakPolarHBondContact O-CD2 3.29Å; R214-F217 PolarHBondContact O-N 3.47Å; R214-F217 VanDerWaalsContact O-N 3.1Å; R214-A233 HydrophobicContact CG-CB 4Å; R214-A233 WeakPolarHBondContact O-CB 3.34Å; R214-D235 IonicContact CZ-OD2 2.68Å; R214-D235 IonicContact NH1-OD2 3.68Å; R214-D235 PolarHBondContact NH1-OD2 3.08Å; R214-D235 IonicContact NH2-OD2 2.71Å; R214-D235 PolarHBondContact NH2-OD2 2.88Å
215	S	92	Very high	90.5	Very high	53 Å²	53	46 Å²	46	37%	0.371	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-26.2	178.7	52.1	0	0	0	0	113.8	V213 F217 A218 N219	V213-S215 VanDerWaalsContact C-N 3.29Å; V213-S215 PolarHBondContact O-N 3.25Å; V213-S215 VanDerWaalsContact O-N 3.12Å; S215-F217 PolarHBondContact O-N 3.07Å; S215-A218 PolarHBondContact O-N 3.28Å; S215-N219 WeakPolarHBondContact O-CB 3.45Å; S215-N219 VanDerWaalsContact O-CG 3.25Å; S215-N219 PolarHBondContact O-N 3.4Å; S215-N219 PolarHBondContact O-OD1 3.09Å
216	M	94.2	Very high	91.5	Very high	44 Å²	44	45.8 Å²	45.8	22%	0.217	24%	0.239	C	C	.	.	H	α-helix	trans	-67.8	-17.1	176	-66.1	-65.9	106.9	0	0	113.1	L156 V213 R214 A218 N219 R220	L156-M216 HydrophobicContact CD2-CB 4.19Å; V213-M216 HydrophobicContact CG1-CB 4.37Å; V213-M216 HydrophobicContact CG1-CG 3.62Å; V213-M216 WeakPolarHBondContact O-CB 3.45Å; V213-M216 PolarHBondContact O-N 3.09Å; R214-M216 PolarHBondContact O-N 2.87Å; M216-A218 VanDerWaalsContact C-N 3.3Å; M216-A218 PolarHBondContact O-N 3.34Å; M216-N219 HydrophobicContact CE-CB 3.77Å; M216-N219 HydrophobicContact SD-CB 4.49Å; M216-R220 WeakPolarHBondContact O-CB 3.48Å; M216-R220 PolarHBondContact O-N 3.44Å
217	F	95.2	Very high	92.4	Very high	1 Å²	1	43.1 Å²	43.1	0%	0.004	21%	0.209	C	C	.	.	H	α-helix	trans	-63.8	-36.1	175.8	-72.6	-126.7	0	0	0	111.4	D153 Q155 L159 V186 C188 R214 S215 L221	D153-F217 HydrophobicContact CB-CZ 4.47Å; Q155-F217 HydrophobicContact CB-CE1 3.56Å; Q155-F217 HydrophobicContact CB-CZ 4Å; Q155-F217 HydrophobicContact CG-CE1 4.28Å; L159-F217 HydrophobicContact CD2-CB 4.05Å; L159-F217 HydrophobicContact CD2-CD1 4.25Å; L159-F217 WeakPolarHBondContact CD2-O 3.48Å; V186-F217 HydrophobicContact CG1-CB 4.19Å; C188-F217 HydrophobicContact CB-CD1 3.81Å; C188-F217 HydrophobicContact CB-CE1 4.21Å; R214-F217 VanDerWaalsContact O-CB 3.29Å; R214-F217 WeakPolarHBondContact O-CB 3.39Å; R214-F217 WeakPolarHBondContact O-CD2 3.29Å; R214-F217 PolarHBondContact O-N 3.47Å; R214-F217 VanDerWaalsContact O-N 3.1Å; S215-F217 PolarHBondContact O-N 3.07Å; F217-L221 VanDerWaalsContact O-CD1 3.31Å; F217-L221 WeakPolarHBondContact O-CD1 3.01Å; F217-L221 WeakPolarHBondContact O-CG 3.3Å
218	A	96	Very high	92.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-90	-51.3	169.3	0	0	0	0	0	111.3	V184 V186 S215 M216 R220 L221 S222 S231 F232	V184-A218 HydrophobicContact CG1-CB 4.02Å; V186-A218 HydrophobicContact CG2-CB 4.05Å; S215-A218 PolarHBondContact O-N 3.28Å; M216-A218 VanDerWaalsContact C-N 3.3Å; M216-A218 PolarHBondContact O-N 3.34Å; A218-R220 VanDerWaalsContact C-N 3.33Å; A218-R220 PolarHBondContact O-N 2.72Å; A218-L221 WeakPolarHBondContact O-CB 3.42Å; A218-L221 PolarHBondContact O-N 3.42Å; A218-L221 VanDerWaalsContact O-N 3.08Å; A218-S222 PolarHBondContact O-N 3.02Å; A218-S222 VanDerWaalsContact O-N 3.11Å; A218-S231 WeakPolarHBondContact CB-OG 3.43Å; A218-S231 PolarHBondContact O-OG 2.69Å; A218-F232 WeakPolarHBondContact CB-O 3.38Å
219	N	95.7	Very high	93.3	Very high	67 Å²	67	46.5 Å²	46.5	36%	0.358	23%	0.225	S	C	.	.	H	α-helix	trans	-64	-32.1	-168.8	-64.2	26	0	0	0	113.7	S215 M216 Y223	S215-N219 WeakPolarHBondContact O-CB 3.45Å; S215-N219 VanDerWaalsContact O-CG 3.25Å; S215-N219 PolarHBondContact O-N 3.4Å; S215-N219 PolarHBondContact O-OD1 3.09Å; M216-N219 HydrophobicContact CE-CB 3.77Å; M216-N219 HydrophobicContact SD-CB 4.49Å; N219-Y223 VanDerWaalsContact O-CB 3.3Å; N219-Y223 WeakPolarHBondContact O-CB 3.28Å; N219-Y223 PolarHBondContact O-N 3.47Å
220	R	95.1	Very high	93.8	Very high	29 Å²	29	42.2 Å²	42.2	11%	0.109	20%	0.204	C	C	.	.	H	α-helix	trans	-75.3	-28.6	178.1	-172.5	178.2	-77.5	-97.2	4.8	112.2	L156 L160 T210 M216 A218 F224	L156-R220 HydrophobicContact CD1-CB 4.17Å; L160-R220 HydrophobicContact CD1-CG 4.39Å; T210-R220 PolarHBondContact O-NE 3.26Å; T210-R220 PolarHBondContact O-NH2 2.92Å; M216-R220 WeakPolarHBondContact O-CB 3.48Å; M216-R220 PolarHBondContact O-N 3.44Å; A218-R220 VanDerWaalsContact C-N 3.33Å; A218-R220 PolarHBondContact O-N 2.72Å; R220-F224 PolarHBondContact O-N 2.92Å
221	L	95.6	Very high	94.2	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-65.2	-51.5	169.2	-57.3	176	0	0	0	110	L159 L160 A163 V184 V186 F217 A218 Y223 F224 L225 L261	L159-L221 HydrophobicContact CD2-CD1 3.98Å; L159-L221 HydrophobicContact CD2-CG 4.42Å; L159-L221 HydrophobicContact CG-CD1 3.97Å; L159-L221 HydrophobicContact CG-CD2 4.18Å; L159-L221 HydrophobicContact CG-CG 4.46Å; L160-L221 HydrophobicContact CB-CD2 4.5Å; L160-L221 HydrophobicContact CD2-CD2 3.81Å; L160-L221 HydrophobicContact CG-CD2 4.01Å; A163-L221 HydrophobicContact CB-CD1 4.43Å; A163-L221 HydrophobicContact CB-CD2 3.81Å; V184-L221 HydrophobicContact CG1-CB 4.11Å; V184-L221 HydrophobicContact CG1-CD1 3.88Å; V186-L221 HydrophobicContact CG2-CD1 3.93Å; F217-L221 VanDerWaalsContact O-CD1 3.31Å; F217-L221 WeakPolarHBondContact O-CD1 3.01Å; F217-L221 WeakPolarHBondContact O-CG 3.3Å; A218-L221 WeakPolarHBondContact O-CB 3.42Å; A218-L221 PolarHBondContact O-N 3.42Å; A218-L221 VanDerWaalsContact O-N 3.08Å; L221-Y223 VanDerWaalsContact C-N 3.29Å; L221-Y223 PolarHBondContact O-N 3.34Å; L221-F224 PolarHBondContact O-N 2.95Å; L221-L225 WeakPolarHBondContact O-CB 3.41Å; L221-L225 WeakPolarHBondContact O-CG 3.2Å; L221-L225 PolarHBondContact O-N 2.85Å; L221-L261 HydrophobicContact CB-CD2 4.48Å; L221-L261 HydrophobicContact CD1-CD2 3.96Å
222	S	95.9	Very high	94.5	Very high	13 Å²	13	46.4 Å²	46.4	9%	0.091	22%	0.222	C	C	.	.	H	α-helix	trans	-56.5	-42	176.3	-61.9	0	0	0	0	112.3	V184 A218 D226 F227 S231	V184-S222 VanDerWaalsContact CG2-OG 3.28Å; V184-S222 WeakPolarHBondContact CG2-OG 3.11Å; A218-S222 PolarHBondContact O-N 3.02Å; A218-S222 VanDerWaalsContact O-N 3.11Å; S222-D226 VanDerWaalsContact O-CA 3.28Å; S222-D226 WeakPolarHBondContact O-CA 3.45Å; S222-D226 PolarHBondContact O-N 3.33Å; S222-F227 PolarHBondContact O-N 2.85Å; S222-S231 WeakPolarHBondContact OG-CB 3.49Å; S222-S231 PolarHBondContact OG-OG 3.47Å
223	Y	95	Very high	94.7	Very high	182 Å²	182	47.9 Å²	47.9	71%	0.714	23%	0.234	S	C	*	.	H	α-helix	trans	-62.2	-50.5	175.9	172.5	-94.4	0	0	0	112.6	N219 L221	N219-Y223 VanDerWaalsContact O-CB 3.3Å; N219-Y223 WeakPolarHBondContact O-CB 3.28Å; N219-Y223 PolarHBondContact O-N 3.47Å; L221-Y223 VanDerWaalsContact C-N 3.29Å; L221-Y223 PolarHBondContact O-N 3.34Å
224	F	94	Very high	95	Very high	25 Å²	25	45.8 Å²	45.8	11%	0.11	22%	0.221	C	C	.	.	H	α-helix	trans	-66.5	-41.6	-177.7	179.5	-107.2	0	0	0	111.9	F141 F142 L160 F164 R178 R220 L221	F141-F224 HydrophobicContact CD1-CE1 4.43Å; F141-F224 AromaticContact CD1-CZ 3.93Å; F141-F224 HydrophobicContact CD1-CZ 3.93Å; F141-F224 AromaticContact CE1-CE1 3.93Å; F141-F224 HydrophobicContact CE1-CE1 3.93Å; F141-F224 AromaticContact CE1-CZ 3.68Å; F141-F224 HydrophobicContact CE1-CZ 3.68Å; F141-F224 HydrophobicContact CZ-CZ 4.42Å; F141-F224 WeakPolarHBondContact O-CE2 3.5Å; F142-F224 HydrophobicContact CB-CE2 4.41Å; F142-F224 AromaticContact CD1-CD1 3.63Å; F142-F224 HydrophobicContact CD1-CD1 3.63Å; F142-F224 HydrophobicContact CD1-CD2 4.1Å; F142-F224 AromaticContact CD1-CE1 3.46Å; F142-F224 HydrophobicContact CD1-CE1 3.46Å; F142-F224 VanDerWaalsContact CD1-CE1 3.46Å; F142-F224 AromaticContact CD1-CE2 3.97Å; F142-F224 HydrophobicContact CD1-CE2 3.97Å; F142-F224 AromaticContact CD1-CG 3.94Å; F142-F224 HydrophobicContact CD1-CG 3.94Å; F142-F224 AromaticContact CD1-CZ 3.64Å; F142-F224 HydrophobicContact CD1-CZ 3.64Å; F142-F224 AromaticContact CE1-CD1 3.88Å; F142-F224 HydrophobicContact CE1-CD1 3.88Å; F142-F224 AromaticContact CE1-CE1 3.56Å; F142-F224 HydrophobicContact CE1-CE1 3.56Å; F142-F224 HydrophobicContact CE1-CZ 4.08Å; L160-F224 HydrophobicContact CD2-CB 4.04Å; L160-F224 HydrophobicContact CD2-CD1 4.49Å; L160-F224 HydrophobicContact CD2-CG 4.4Å; F164-F224 AromaticContact CD2-CE1 3.86Å; F164-F224 HydrophobicContact CD2-CE1 3.86Å; F164-F224 HydrophobicContact CE2-CE1 4Å; R178-F224 VanDerWaalsContact CZ-O 3.28Å; R178-F224 PolarHBondContact NH1-O 3.06Å; R178-F224 PolarHBondContact NH2-O 2.97Å; R220-F224 PolarHBondContact O-N 2.92Å; L221-F224 PolarHBondContact O-N 2.95Å
225	L	93.1	Very high	95.2	Very high	3 Å²	3	44.2 Å²	44.2	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-83.6	-10.1	-176.8	-60.3	170.8	0	0	0	113.7	F164 L221 F227 L261	F164-L225 HydrophobicContact CD2-CD2 3.91Å; F164-L225 HydrophobicContact CE2-CD2 4.34Å; L221-L225 WeakPolarHBondContact O-CB 3.41Å; L221-L225 WeakPolarHBondContact O-CG 3.2Å; L221-L225 PolarHBondContact O-N 2.85Å; L225-F227 HydrophobicContact CB-CD1 3.77Å; L225-F227 HydrophobicContact CB-CD2 3.92Å; L225-F227 HydrophobicContact CB-CE1 3.73Å; L225-F227 HydrophobicContact CB-CE2 3.88Å; L225-F227 HydrophobicContact CB-CG 3.86Å; L225-F227 HydrophobicContact CB-CZ 3.77Å; L225-F227 HydrophobicContact CD1-CD2 3.93Å; L225-F227 HydrophobicContact CD1-CE2 3.44Å; L225-F227 VanDerWaalsContact CD1-CE2 3.44Å; L225-F227 HydrophobicContact CD1-CZ 3.85Å; L225-F227 HydrophobicContact CG-CE2 4.24Å; L225-F227 HydrophobicContact CG-CZ 4.28Å; L225-L261 HydrophobicContact CD1-CD2 4.19Å
226	D	94.7	Very high	95.3	Very high	44 Å²	44	43.4 Å²	43.4	24%	0.235	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	51.4	-168.7	-170.9	14.3	0	0	0	112.1	R178 G179 S222 R228	R178-D226 HydrophobicContact CB-CB 4.15Å; G179-D226 VanDerWaalsContact CA-O 3.29Å; G179-D226 WeakPolarHBondContact CA-O 3.48Å; G179-D226 PolarHBondContact N-O 3.19Å; G179-D226 PolarHBondContact N-OD2 2.96Å; S222-D226 VanDerWaalsContact O-CA 3.28Å; S222-D226 WeakPolarHBondContact O-CA 3.45Å; S222-D226 PolarHBondContact O-N 3.33Å; D226-R228 VanDerWaalsContact CG-NH2 3.34Å; D226-R228 IonicContact OD1-CZ 2.92Å; D226-R228 IonicContact OD1-NE 3.87Å; D226-R228 PolarHBondContact OD1-NE 2.83Å; D226-R228 IonicContact OD1-NH2 3.35Å; D226-R228 PolarHBondContact OD1-NH2 2.76Å; D226-R228 IonicContact OD2-CZ 3.96Å; D226-R228 IonicContact OD2-NE 2.63Å; D226-R228 IonicContact OD2-NH2 3.7Å; D226-R228 PolarHBondContact OD2-NH2 3.23Å
227	F	96.7	Very high	95.2	Very high	10 Å²	10	42.1 Å²	42.1	4%	0.044	21%	0.209	C	C	.	.			trans	-94.6	126	176.3	-71.4	-7.1	0	0	0	110.8	L167 V177 T182 V184 S222 L225	L167-F227 HydrophobicContact CD1-CE2 4.41Å; L167-F227 HydrophobicContact CD1-CZ 4.33Å; L167-F227 HydrophobicContact CD2-CZ 3.73Å; V177-F227 HydrophobicContact CG2-CE1 4.05Å; V177-F227 HydrophobicContact CG2-CZ 4.43Å; T182-F227 HydrophobicContact CG2-CD1 4.3Å; T182-F227 HydrophobicContact CG2-CD2 3.5Å; T182-F227 VanDerWaalsContact CG2-CD2 3.5Å; T182-F227 HydrophobicContact CG2-CE1 4.32Å; T182-F227 HydrophobicContact CG2-CE2 3.52Å; T182-F227 HydrophobicContact CG2-CG 3.92Å; T182-F227 HydrophobicContact CG2-CZ 3.97Å; V184-F227 HydrophobicContact CG2-CB 4.34Å; V184-F227 HydrophobicContact CG2-CD2 3.83Å; S222-F227 PolarHBondContact O-N 2.85Å; L225-F227 HydrophobicContact CB-CD1 3.77Å; L225-F227 HydrophobicContact CB-CD2 3.92Å; L225-F227 HydrophobicContact CB-CE1 3.73Å; L225-F227 HydrophobicContact CB-CE2 3.88Å; L225-F227 HydrophobicContact CB-CG 3.86Å; L225-F227 HydrophobicContact CB-CZ 3.77Å; L225-F227 HydrophobicContact CD1-CD2 3.93Å; L225-F227 HydrophobicContact CD1-CE2 3.44Å; L225-F227 VanDerWaalsContact CD1-CE2 3.44Å; L225-F227 HydrophobicContact CD1-CZ 3.85Å; L225-F227 HydrophobicContact CG-CE2 4.24Å; L225-F227 HydrophobicContact CG-CZ 4.28Å
228	R	94.3	Very high	95.1	Very high	168 Å²	168	42.3 Å²	42.3	63%	0.634	21%	0.21	S	C	*	.			trans	-112.3	7.6	-167.2	-55	-172.6	-177.9	176	8.5	114.4	S180 D226	S180-R228 PolarHBondContact O-N 2.77Å; D226-R228 VanDerWaalsContact CG-NH2 3.34Å; D226-R228 IonicContact OD1-CZ 2.92Å; D226-R228 IonicContact OD1-NE 3.87Å; D226-R228 PolarHBondContact OD1-NE 2.83Å; D226-R228 IonicContact OD1-NH2 3.35Å; D226-R228 PolarHBondContact OD1-NH2 2.76Å; D226-R228 IonicContact OD2-CZ 3.96Å; D226-R228 IonicContact OD2-NE 2.63Å; D226-R228 IonicContact OD2-NH2 3.7Å; D226-R228 PolarHBondContact OD2-NH2 3.23Å
229	G	94.4	Very high	95.1	Very high	18 Å²	18	42.3 Å²	42.3	19%	0.186	21%	0.21	C	C	.	.	S	Bend	trans	-79.1	-170.8	167	0	0	0	0	0	112.7	T182	T182-G229 VanDerWaalsContact O-CA 3.28Å; T182-G229 WeakPolarHBondContact O-CA 3.4Å; T182-G229 PolarHBondContact O-N 2.92Å
230	P	96.1	Very high	95.2	Very high	24 Å²	24	39.1 Å²	39.1	16%	0.156	19%	0.193	C	C	.	.			trans	-57.3	140.3	177.8	-23.2	33.6	0	0	0	112.2	G183 V184 F185 F232 E256	G183-P230 CarbonylContact C-O 3.56Å; G183-P230 VanDerWaalsContact CA-O 3.3Å; G183-P230 WeakPolarHBondContact CA-O 3.26Å; V184-P230 PolarHBondContact N-O 3.12Å; F185-P230 HydrophobicContact CE1-CB 4.39Å; F185-P230 HydrophobicContact CZ-CB 3.95Å; F185-P230 HydrophobicContact CZ-CG 4.37Å; P230-F232 HydrophobicContact CB-CD2 4.27Å; P230-F232 HydrophobicContact CB-CE2 3.76Å; P230-F232 HydrophobicContact CB-CZ 4.12Å; P230-E256 HydrophobicContact CG-CB 4.33Å
231	S	97.1	Very high	95.3	Very high	30 Å²	30	37.7 Å²	37.7	21%	0.21	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	106.7	179	-164.9	0	0	0	0	110	V184 A218 S222	V184-S231 CarbonylContact O-C 3.49Å; V184-S231 VanDerWaalsContact O-CA 3.31Å; V184-S231 WeakPolarHBondContact O-CA 3.22Å; A218-S231 WeakPolarHBondContact CB-OG 3.43Å; A218-S231 PolarHBondContact O-OG 2.69Å; S222-S231 WeakPolarHBondContact OG-CB 3.49Å; S222-S231 PolarHBondContact OG-OG 3.47Å
232	F	96.2	Very high	95.4	Very high	110 Å²	110	37.7 Å²	37.7	48%	0.482	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	136.7	-171.3	-60.2	-43.7	0	0	0	113.1	V184 F185 V186 A218 P230	V184-F232 PolarHBondContact O-N 2.82Å; F185-F232 WeakPolarHBondContact CA-O 3.36Å; F185-F232 HydrophobicContact CD1-CB 4.48Å; F185-F232 AromaticContact CD1-CD2 3.96Å; F185-F232 HydrophobicContact CD1-CD2 3.96Å; F185-F232 AromaticContact CE1-CD2 3.68Å; F185-F232 HydrophobicContact CE1-CD2 3.68Å; F185-F232 HydrophobicContact CE1-CE2 4.19Å; V186-F232 PolarHBondContact N-O 2.71Å; A218-F232 WeakPolarHBondContact CB-O 3.38Å; P230-F232 HydrophobicContact CB-CD2 4.27Å; P230-F232 HydrophobicContact CB-CE2 3.76Å; P230-F232 HydrophobicContact CB-CZ 4.12Å
233	A	95.9	Very high	95.4	Very high	34 Å²	34	38.3 Å²	38.3	28%	0.281	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	126.2	164.3	0	0	0	0	0	109.3	V186 R214	V186-A233 CarbonylContact O-C 3.58Å; V186-A233 WeakPolarHBondContact O-CA 3.35Å; R214-A233 HydrophobicContact CG-CB 4Å; R214-A233 WeakPolarHBondContact O-CB 3.34Å
234	V	96.2	Very high	95.6	Very high	14 Å²	14	29.7 Å²	29.7	9%	0.085	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.8	-169	-177	0	0	0	0	109.3	V186 G187 C188 L243 A244 L247	V186-V234 PolarHBondContact O-N 3.38Å; G187-V234 CarbonylContact C-O 3.59Å; G187-V234 WeakPolarHBondContact CA-O 3.36Å; C188-V234 PolarHBondContact N-O 3.35Å; C188-V234 VanDerWaalsContact O-O 3.13Å; V234-L243 HydrophobicContact CG1-CB 4.39Å; V234-L243 HydrophobicContact CG1-CD2 3.9Å; V234-L243 HydrophobicContact CG1-CG 4.13Å; V234-A244 HydrophobicContact CB-CB 4.38Å; V234-A244 HydrophobicContact CG2-CB 4.14Å; V234-L247 HydrophobicContact CG2-CD1 3.95Å
235	D	95.7	Very high	95.7	Very high	59 Å²	59	28.5 Å²	28.5	32%	0.316	15%	0.151	S	C	.	.			trans	-134.9	107.1	174	-172.2	6.8	0	0	0	111.1	C188 S189 R214 A237 S240	C188-D235 WeakPolarHBondContact O-CB 3.45Å; S189-D235 PolarHBondContact OG-OD1 2.71Å; S189-D235 PolarHBondContact OG-OD2 3.12Å; R214-D235 IonicContact CZ-OD2 2.68Å; R214-D235 IonicContact NH1-OD2 3.68Å; R214-D235 PolarHBondContact NH1-OD2 3.08Å; R214-D235 IonicContact NH2-OD2 2.71Å; R214-D235 PolarHBondContact NH2-OD2 2.88Å; D235-A237 PolarHBondContact OD1-N 3.11Å; D235-S240 WeakPolarHBondContact CA-OG 3.39Å
236	T	93.6	Very high	95.9	Very high	36 Å²	36	29.7 Å²	29.7	22%	0.221	16%	0.157	C	C	.	.			trans	-126.1	35.7	166.1	55.1	0	0	0	0	110.1	C238 S239 S240 L243 G471	T236-C238 PolarHBondContact O-N 3.35Å; T236-S239 WeakPolarHBondContact CB-OG 3.4Å; T236-S239 PolarHBondContact O-OG 2.81Å; T236-S239 PolarHBondContact OG1-OG 3.18Å; T236-S240 PolarHBondContact N-OG 3Å; T236-S240 WeakPolarHBondContact OG1-CA 3.48Å; T236-S240 PolarHBondContact OG1-N 3.23Å; T236-L243 HydrophobicContact CG2-CD2 3.45Å; T236-L243 VanDerWaalsContact CG2-CD2 3.45Å; T236-G471 WeakPolarHBondContact O-CA 3.36Å
237	A	92.3	Very high	96	Very high	17 Å²	17	30.6 Å²	30.6	14%	0.14	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	52.2	-127.3	-168.9	0	0	0	0	0	111.4	D235 S239 S240 P411 F472	D235-A237 PolarHBondContact OD1-N 3.11Å; A237-S239 PolarHBondContact O-N 3.24Å; A237-S239 VanDerWaalsContact O-N 3.09Å; A237-S240 PolarHBondContact N-OG 2.96Å; A237-S240 WeakPolarHBondContact O-CB 3.33Å; A237-S240 PolarHBondContact O-N 3.1Å; A237-S240 PolarHBondContact O-OG 2.85Å; A237-P411 VanDerWaalsContact O-CA 3.31Å; A237-P411 WeakPolarHBondContact O-CA 3.31Å; A237-F472 HydrophobicContact CB-CD1 3.56Å; A237-F472 HydrophobicContact CB-CE1 3.43Å; A237-F472 VanDerWaalsContact CB-CE1 3.43Å; A237-F472 HydrophobicContact CB-CZ 4.29Å
238	C	94.3	Very high	96.1	Very high	4 Å²	4	30.1 Å²	30.1	3%	0.027	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-63.5	-18.6	-169.7	-53.4	0	0	0	0	115.9	T236 H408 E410 S469 F470	T236-C238 PolarHBondContact O-N 3.35Å; C238-H408 VanDerWaalsContact SG-CE1 3.52Å; C238-H408 PolarHBondContact SG-NE2 3.44Å; C238-E410 WeakPolarHBondContact CA-O 3.49Å; C238-S469 PolarHBondContact O-OG 3Å; C238-F470 WeakPolarHBondContact CB-O 3.43Å
239	S	95.5	Very high	96.1	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-86.5	-9.3	174.8	50.4	0	0	0	0	114.5	T236 A237 S241 L242 L243 S469 S475	T236-S239 WeakPolarHBondContact CB-OG 3.4Å; T236-S239 PolarHBondContact O-OG 2.81Å; T236-S239 PolarHBondContact OG1-OG 3.18Å; A237-S239 PolarHBondContact O-N 3.24Å; A237-S239 VanDerWaalsContact O-N 3.09Å; S239-S241 PolarHBondContact O-N 3.3Å; S239-L242 WeakPolarHBondContact O-CA 3.43Å; S239-L242 PolarHBondContact O-N 2.79Å; S239-L243 PolarHBondContact O-N 3.3Å; S239-S469 VanDerWaalsContact CB-O 3.31Å; S239-S469 WeakPolarHBondContact CB-O 3.29Å; S239-S475 VanDerWaalsContact CB-O 3.27Å; S239-S475 WeakPolarHBondContact CB-O 3.31Å; S239-S475 PolarHBondContact OG-O 3.38Å
240	S	96.9	Very high	96.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-48.7	-50.7	-165.7	-57.7	0	0	0	0	115.4	D235 T236 A237 L242 L243 A244	D235-S240 WeakPolarHBondContact CA-OG 3.39Å; T236-S240 PolarHBondContact N-OG 3Å; T236-S240 WeakPolarHBondContact OG1-CA 3.48Å; T236-S240 PolarHBondContact OG1-N 3.23Å; A237-S240 PolarHBondContact N-OG 2.96Å; A237-S240 WeakPolarHBondContact O-CB 3.33Å; A237-S240 PolarHBondContact O-N 3.1Å; A237-S240 PolarHBondContact O-OG 2.85Å; S240-L242 VanDerWaalsContact C-N 3.32Å; S240-L242 PolarHBondContact O-N 3.29Å; S240-L243 PolarHBondContact O-N 2.77Å; S240-A244 WeakPolarHBondContact O-CB 3.35Å; S240-A244 PolarHBondContact O-N 3Å
241	S	97.4	Very high	96.1	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-74.5	-20.8	-177.7	58.7	0	0	0	0	113.8	S239 L245 P411 G414 L415	S239-S241 PolarHBondContact O-N 3.3Å; S241-L245 PolarHBondContact O-N 2.76Å; S241-P411 WeakPolarHBondContact CB-O 3.48Å; S241-P411 PolarHBondContact N-O 3.24Å; S241-P411 VanDerWaalsContact N-O 3.08Å; S241-P411 PolarHBondContact OG-O 3.4Å; S241-G414 PolarHBondContact OG-N 2.94Å; S241-L415 PolarHBondContact OG-N 2.98Å
242	L	97.2	Very high	96	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-83.6	-34.6	173.8	-148.4	71.4	0	0	0	111.3	S239 S240 L245 Q246 I418 V467 T477 V479	S239-L242 WeakPolarHBondContact O-CA 3.43Å; S239-L242 PolarHBondContact O-N 2.79Å; S240-L242 VanDerWaalsContact C-N 3.32Å; S240-L242 PolarHBondContact O-N 3.29Å; L242-L245 HydrophobicContact CD1-CD2 4.13Å; L242-L245 WeakPolarHBondContact O-CB 3.44Å; L242-L245 PolarHBondContact O-N 2.81Å; L242-Q246 PolarHBondContact O-N 2.69Å; L242-I418 HydrophobicContact CD1-CD1 4.31Å; L242-I418 HydrophobicContact CD1-CG1 4.12Å; L242-V467 HydrophobicContact CD1-CG1 4.37Å; L242-T477 HydrophobicContact CB-CG2 3.95Å; L242-T477 HydrophobicContact CD2-CG2 3.95Å; L242-T477 HydrophobicContact CG-CG2 3.88Å; L242-V479 HydrophobicContact CD1-CG2 3.84Å; L242-V479 HydrophobicContact CD2-CG2 4.05Å; L242-V479 HydrophobicContact CG-CG2 3.66Å
243	L	97.4	Very high	95.8	Very high	27 Å²	27	16 Å²	16	14%	0.141	9%	0.093	C	C	.	.	H	α-helix	trans	-67	-38.1	168.2	177.6	62.1	0	0	0	111.4	V234 T236 S239 S240 L245 Q246 L247 S328	V234-L243 HydrophobicContact CG1-CB 4.39Å; V234-L243 HydrophobicContact CG1-CD2 3.9Å; V234-L243 HydrophobicContact CG1-CG 4.13Å; T236-L243 HydrophobicContact CG2-CD2 3.45Å; T236-L243 VanDerWaalsContact CG2-CD2 3.45Å; S239-L243 PolarHBondContact O-N 3.3Å; S240-L243 PolarHBondContact O-N 2.77Å; L243-L245 VanDerWaalsContact C-N 3.27Å; L243-L245 PolarHBondContact O-N 3.02Å; L243-Q246 WeakPolarHBondContact O-CB 3.45Å; L243-Q246 PolarHBondContact O-N 3.12Å; L243-Q246 VanDerWaalsContact O-N 3.14Å; L243-L247 HydrophobicContact CD1-CG 4.42Å; L243-L247 HydrophobicContact CG-CD1 4.33Å; L243-L247 WeakPolarHBondContact O-CG 3.21Å; L243-L247 PolarHBondContact O-N 3.49Å; L243-S328 WeakPolarHBondContact CD1-OG 3.34Å
244	A	97.7	Very high	95.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-59	-38.3	171.4	0	0	0	0	0	112	F185 V234 S240 L247 A248 V262	F185-A244 HydrophobicContact CB-CB 4Å; V234-A244 HydrophobicContact CB-CB 4.38Å; V234-A244 HydrophobicContact CG2-CB 4.14Å; S240-A244 WeakPolarHBondContact O-CB 3.35Å; S240-A244 PolarHBondContact O-N 3Å; A244-L247 PolarHBondContact O-N 2.73Å; A244-A248 WeakPolarHBondContact O-CB 3.29Å; A244-A248 PolarHBondContact O-N 2.8Å; A244-V262 HydrophobicContact CB-CG1 3.89Å
245	L	97.9	Very high	95.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.2	-42.8	172	172.6	53.6	0	0	0	111.9	S241 L242 L243 A248 V249 V262 I308 L310 L415 I418 V479	S241-L245 PolarHBondContact O-N 2.76Å; L242-L245 HydrophobicContact CD1-CD2 4.13Å; L242-L245 WeakPolarHBondContact O-CB 3.44Å; L242-L245 PolarHBondContact O-N 2.81Å; L243-L245 VanDerWaalsContact C-N 3.27Å; L243-L245 PolarHBondContact O-N 3.02Å; L245-A248 PolarHBondContact O-N 2.84Å; L245-V249 HydrophobicContact CD1-CG2 4.2Å; L245-V249 WeakPolarHBondContact O-CG2 3.39Å; L245-V249 PolarHBondContact O-N 2.88Å; L245-V262 HydrophobicContact CB-CG1 4.08Å; L245-I308 HydrophobicContact CD1-CD1 4.15Å; L245-I308 HydrophobicContact CD2-CD1 4.34Å; L245-L310 HydrophobicContact CD1-CD1 3.62Å; L245-L310 HydrophobicContact CD1-CD2 3.89Å; L245-L310 HydrophobicContact CD1-CG 4.29Å; L245-L415 HydrophobicContact CD2-CD2 4.39Å; L245-I418 HydrophobicContact CD2-CD1 4.13Å; L245-I418 HydrophobicContact CD2-CG1 4.34Å; L245-V479 HydrophobicContact CD2-CG1 4.25Å; L245-V479 HydrophobicContact CD2-CG2 4.11Å; L245-V479 HydrophobicContact CG-CG2 4.45Å
246	Q	96.4	Very high	95.2	Very high	29 Å²	29	24.2 Å²	24.2	14%	0.136	12%	0.122	C	C	.	.	H	α-helix	trans	-60.2	-50.6	173.7	-168	-149.4	-54.1	0	0	111.8	L242 L243 A248 V249 D250 A326 S328	L242-Q246 PolarHBondContact O-N 2.69Å; L243-Q246 WeakPolarHBondContact O-CB 3.45Å; L243-Q246 PolarHBondContact O-N 3.12Å; L243-Q246 VanDerWaalsContact O-N 3.14Å; Q246-A248 PolarHBondContact O-N 3.33Å; Q246-V249 WeakPolarHBondContact O-CB 3.4Å; Q246-V249 PolarHBondContact O-N 2.9Å; Q246-V249 VanDerWaalsContact O-N 3.08Å; Q246-D250 PolarHBondContact NE2-OD2 3.42Å; Q246-D250 PolarHBondContact O-N 2.85Å; Q246-A326 HydrophobicContact CB-CB 4.03Å; Q246-A326 HydrophobicContact CG-CB 3.88Å; Q246-S328 VanDerWaalsContact OE1-CB 3.3Å; Q246-S328 PolarHBondContact OE1-OG 3.26Å
247	L	97.4	Very high	95.2	Very high	63 Å²	63	22.5 Å²	22.5	33%	0.33	11%	0.112	S	C	.	.	H	α-helix	trans	-59.4	-35.8	-179.3	-69	171.5	0	0	0	112.3	F185 V234 L243 A244 A251	F185-L247 HydrophobicContact CD1-CB 3.79Å; F185-L247 HydrophobicContact CE1-CB 3.89Å; V234-L247 HydrophobicContact CG2-CD1 3.95Å; L243-L247 HydrophobicContact CD1-CG 4.42Å; L243-L247 HydrophobicContact CG-CD1 4.33Å; L243-L247 WeakPolarHBondContact O-CG 3.21Å; L243-L247 PolarHBondContact O-N 3.49Å; A244-L247 PolarHBondContact O-N 2.73Å; L247-A251 WeakPolarHBondContact O-CB 3.24Å; L247-A251 PolarHBondContact O-N 2.94Å
248	A	97.3	Very high	95.2	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-68.2	-42.3	174.4	0	0	0	0	0	112.9	F185 A244 L245 Q246 A251 I252 A260 V262 L310	F185-A248 HydrophobicContact CB-CB 4.46Å; F185-A248 HydrophobicContact CD2-CB 3.52Å; F185-A248 HydrophobicContact CE2-CB 3.78Å; F185-A248 HydrophobicContact CG-CB 3.95Å; F185-A248 HydrophobicContact CZ-CB 4.39Å; A244-A248 WeakPolarHBondContact O-CB 3.29Å; A244-A248 PolarHBondContact O-N 2.8Å; L245-A248 PolarHBondContact O-N 2.84Å; Q246-A248 PolarHBondContact O-N 3.33Å; A248-A251 PolarHBondContact O-N 2.97Å; A248-I252 WeakPolarHBondContact O-CG1 3.42Å; A248-I252 PolarHBondContact O-N 2.79Å; A248-A260 HydrophobicContact CB-CB 3.8Å; A248-V262 HydrophobicContact CB-CG2 3.37Å; A248-L310 HydrophobicContact CB-CD1 3.73Å
249	V	96.1	Very high	95.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62.3	-43.3	173.7	167.9	0	0	0	0	111	I81 L245 Q246 I252 R253 L310 V323	I81-V249 HydrophobicContact CD1-CG1 4.11Å; L245-V249 HydrophobicContact CD1-CG2 4.2Å; L245-V249 WeakPolarHBondContact O-CG2 3.39Å; L245-V249 PolarHBondContact O-N 2.88Å; Q246-V249 WeakPolarHBondContact O-CB 3.4Å; Q246-V249 PolarHBondContact O-N 2.9Å; Q246-V249 VanDerWaalsContact O-N 3.08Å; V249-I252 PolarHBondContact O-N 2.88Å; V249-R253 WeakPolarHBondContact O-CG 3Å; V249-R253 PolarHBondContact O-N 2.8Å; V249-L310 HydrophobicContact CG2-CD1 4.21Å; V249-V323 HydrophobicContact CG2-CB 4.36Å; V249-V323 HydrophobicContact CG2-CG1 3.83Å
250	D	94	Very high	95.4	Very high	31 Å²	31	24.7 Å²	24.7	17%	0.166	12%	0.12	C	C	.	.	H	α-helix	trans	-65.1	-39.2	178.4	-68.9	-26.8	0	0	0	111.7	Q246 K254	Q246-D250 PolarHBondContact NE2-OD2 3.42Å; Q246-D250 PolarHBondContact O-N 2.85Å; D250-K254 WeakPolarHBondContact O-CD 3.4Å; D250-K254 WeakPolarHBondContact O-CG 3.28Å; D250-K254 PolarHBondContact O-N 3.36Å; D250-K254 VanDerWaalsContact O-N 3.17Å
251	A	95.5	Very high	95.4	Very high	2 Å²	2	24.8 Å²	24.8	2%	0.017	12%	0.12	C	C	.	.	H	α-helix	trans	-66.6	-41.4	175.6	0	0	0	0	0	112.7	F185 L247 A248 K254 D255 E256 C257	F185-A251 HydrophobicContact CE2-CB 4.49Å; F185-A251 HydrophobicContact CZ-CB 3.76Å; L247-A251 WeakPolarHBondContact O-CB 3.24Å; L247-A251 PolarHBondContact O-N 2.94Å; A248-A251 PolarHBondContact O-N 2.97Å; A251-K254 PolarHBondContact O-N 2.82Å; A251-D255 PolarHBondContact O-N 3.26Å; A251-E256 HydrophobicContact CB-CB 4.17Å; A251-E256 PolarHBondContact O-N 3.13Å; A251-C257 VanDerWaalsContact CB-SG 3.59Å
252	I	95	Very high	95.5	Very high	4 Å²	4	24.8 Å²	24.8	2%	0.021	12%	0.12	C	C	.	.	H	α-helix	trans	-65.6	-40.5	176.4	-65.2	168	0	0	0	111	I81 A248 V249 K254 D255 C257 A260 L310 K312	I81-I252 HydrophobicContact CD1-CB 3.88Å; I81-I252 HydrophobicContact CD1-CG2 3.68Å; I81-I252 HydrophobicContact CG1-CG2 3.91Å; I81-I252 HydrophobicContact CG2-CD1 4.3Å; A248-I252 WeakPolarHBondContact O-CG1 3.42Å; A248-I252 PolarHBondContact O-N 2.79Å; V249-I252 PolarHBondContact O-N 2.88Å; I252-K254 VanDerWaalsContact C-N 3.3Å; I252-K254 PolarHBondContact O-N 3.1Å; I252-D255 PolarHBondContact O-N 2.9Å; I252-C257 WeakPolarHBondContact CA-O 3.48Å; I252-C257 VanDerWaalsContact CG1-SG 3.56Å; I252-A260 HydrophobicContact CD1-CB 3.96Å; I252-A260 HydrophobicContact CG1-CB 4.4Å; I252-L310 HydrophobicContact CD1-CB 3.83Å; I252-L310 HydrophobicContact CD1-CD1 4.37Å; I252-K312 HydrophobicContact CG2-CD 4.38Å; I252-K312 HydrophobicContact CG2-CG 3.75Å
253	R	92.6	Very high	95.5	Very high	17 Å²	17	24.8 Å²	24.8	6%	0.064	12%	0.12	C	C	.	.	H	α-helix	trans	-65.6	-29.7	177.3	-74.2	177.7	170	152.1	3.1	113.4	W74 W75 Q78 I81 V249 D255 V324 H325	W74-R253 HydrophobicContact CH2-CB 3.62Å; W74-R253 HydrophobicContact CZ3-CB 4.08Å; W74-R253 WeakPolarHBondContact CZ3-O 3.45Å; W75-R253 HydrophobicContact CB-CB 4.45Å; W75-R253 HydrophobicContact CB-CG 4.14Å; Q78-R253 PolarHBondContact NE2-O 2.89Å; Q78-R253 PolarHBondContact OE1-O 2.81Å; I81-R253 HydrophobicContact CD1-CG 3.85Å; V249-R253 WeakPolarHBondContact O-CG 3Å; V249-R253 PolarHBondContact O-N 2.8Å; R253-D255 VanDerWaalsContact C-N 3.32Å; R253-V324 PolarHBondContact NH2-O 2.87Å; R253-H325 PolarHBondContact NH1-CE1 3.25Å; R253-H325 PolarHBondContact NH1-ND1 2.89Å; R253-H325 VanDerWaalsContact NH1-ND1 3.2Å; R253-H325 PolarHBondContact NH2-CE1 2.81Å
254	K	92.5	Very high	95.5	Very high	119 Å²	119	23.5 Å²	23.5	52%	0.517	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-4.1	175.5	-66.5	167.9	-168.1	169.3	0	114	W74 D250 A251 I252 E256	W74-K254 HydrophobicContact CH2-CG 3.83Å; W74-K254 HydrophobicContact CZ2-CG 4.48Å; D250-K254 WeakPolarHBondContact O-CD 3.4Å; D250-K254 WeakPolarHBondContact O-CG 3.28Å; D250-K254 PolarHBondContact O-N 3.36Å; D250-K254 VanDerWaalsContact O-N 3.17Å; A251-K254 PolarHBondContact O-N 2.82Å; I252-K254 VanDerWaalsContact C-N 3.3Å; I252-K254 PolarHBondContact O-N 3.1Å; K254-E256 HydrophobicContact CB-CG 3.99Å; K254-E256 HydrophobicContact CD-CG 4.44Å; K254-E256 WeakPolarHBondContact CD-OE1 3.27Å; K254-E256 IonicContact NZ-OE1 3.94Å; K254-E256 PolarHBondContact NZ-OE1 3.29Å; K254-E256 PolarHBondContact O-N 2.77Å
255	D	90.2	Very high	95.5	Very high	66 Å²	66	23.5 Å²	23.5	35%	0.353	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	26	-168	-148.3	75.6	0	0	0	114.4	R181 A251 I252 R253 K312	R181-D255 IonicContact CZ-OD2 3.46Å; R181-D255 VanDerWaalsContact CZ-OD2 3.3Å; R181-D255 PolarHBondContact NH1-O 3.18Å; R181-D255 IonicContact NH1-OD2 3.3Å; R181-D255 PolarHBondContact NH1-OD2 2.77Å; R181-D255 IonicContact NH2-OD1 2.72Å; R181-D255 IonicContact NH2-OD2 3.62Å; R181-D255 PolarHBondContact NH2-OD2 2.72Å; A251-D255 PolarHBondContact O-N 3.26Å; I252-D255 PolarHBondContact O-N 2.9Å; R253-D255 VanDerWaalsContact C-N 3.32Å; D255-K312 IonicContact OD1-NZ 3.04Å; D255-K312 PolarHBondContact OD1-NZ 2.63Å
256	E	92.7	Very high	95.4	Very high	93 Å²	93	24.1 Å²	24.1	44%	0.435	12%	0.116	S	C	.	.	S	Bend	trans	-65.8	-31.3	166.3	-67.5	175.6	-155.8	0	0	110.4	P230 A251 K254	P230-E256 HydrophobicContact CG-CB 4.33Å; A251-E256 HydrophobicContact CB-CB 4.17Å; A251-E256 PolarHBondContact O-N 3.13Å; K254-E256 HydrophobicContact CB-CG 3.99Å; K254-E256 HydrophobicContact CD-CG 4.44Å; K254-E256 WeakPolarHBondContact CD-OE1 3.27Å; K254-E256 IonicContact NZ-OE1 3.94Å; K254-E256 PolarHBondContact NZ-OE1 3.29Å; K254-E256 PolarHBondContact O-N 2.77Å
257	C	94.1	Very high	95.2	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.111	C	C	.	.			trans	-141.8	158.5	171.5	56.4	0	0	0	0	112.2	R181 A251 I252 A259	R181-C257 CarbonylContact O-C 3.55Å; R181-C257 WeakPolarHBondContact O-CA 3.38Å; R181-C257 WeakPolarHBondContact O-CB 3.35Å; A251-C257 VanDerWaalsContact CB-SG 3.59Å; I252-C257 WeakPolarHBondContact CA-O 3.48Å; I252-C257 VanDerWaalsContact CG1-SG 3.56Å; C257-A259 WeakPolarHBondContact CB-O 3.38Å
258	E	90.7	Very high	94.9	Very high	64 Å²	64	20 Å²	20	30%	0.299	10%	0.095	S	C	.	.	S	Bend	trans	-97.6	-22.2	177.8	65.6	-144.7	149.4	0	0	113.3	S180 R181	S180-E258 WeakPolarHBondContact CB-OE1 3.12Å; R181-E258 PolarHBondContact N-OE1 3.03Å; R181-E258 PolarHBondContact O-N 2.77Å
259	A	96.3	Very high	94.5	Very high	4 Å²	4	20 Å²	20	3%	0.033	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	164.6	173.7	0	0	0	0	0	109	T182 G183 C257 F309 L310 Q311	T182-A259 WeakPolarHBondContact CA-O 3.39Å; T182-A259 HydrophobicContact CG2-CB 4.31Å; G183-A259 PolarHBondContact N-O 2.88Å; C257-A259 WeakPolarHBondContact CB-O 3.38Å; A259-F309 HydrophobicContact CB-CE1 4.15Å; A259-F309 HydrophobicContact CB-CE2 4.39Å; A259-F309 HydrophobicContact CB-CZ 3.7Å; A259-L310 CarbonylContact C-O 3.21Å; A259-L310 VanDerWaalsContact CA-O 3.26Å; A259-L310 WeakPolarHBondContact CA-O 3.41Å; A259-L310 WeakPolarHBondContact CB-O 3.26Å; A259-Q311 HydrophobicContact CB-CG 4.13Å
260	A	97.7	Very high	93.9	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	132.1	175.4	0	0	0	0	0	112.5	G183 F185 A248 I252 L310	G183-A260 CarbonylContact O-C 3.58Å; G183-A260 WeakPolarHBondContact O-CA 3.4Å; F185-A260 HydrophobicContact CD2-CB 4.14Å; F185-A260 HydrophobicContact CE2-CB 3.99Å; A248-A260 HydrophobicContact CB-CB 3.8Å; I252-A260 HydrophobicContact CD1-CB 3.96Å; I252-A260 HydrophobicContact CG1-CB 4.4Å; A260-L310 HydrophobicContact CB-CB 4.41Å; A260-L310 PolarHBondContact N-O 3Å; A260-L310 WeakPolarHBondContact O-CB 3.2Å; A260-L310 PolarHBondContact O-N 2.91Å
261	L	98.3	Very high	93.5	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.005	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	123.2	164.5	179.6	69.5	0	0	0	108.7	A163 L167 G183 V184 F185 L221 L225 A307 F309	A163-L261 HydrophobicContact CB-CD1 4.32Å; A163-L261 HydrophobicContact CB-CD2 3.68Å; L167-L261 HydrophobicContact CD1-CD1 4.17Å; G183-L261 PolarHBondContact O-N 3.04Å; V184-L261 CarbonylContact C-O 3.55Å; V184-L261 WeakPolarHBondContact CA-O 3.39Å; V184-L261 HydrophobicContact CG1-CD2 4.49Å; V184-L261 HydrophobicContact CG2-CB 4.39Å; V184-L261 HydrophobicContact CG2-CD2 4.49Å; F185-L261 PolarHBondContact N-O 3.2Å; L221-L261 HydrophobicContact CB-CD2 4.48Å; L221-L261 HydrophobicContact CD1-CD2 3.96Å; L225-L261 HydrophobicContact CD1-CD2 4.19Å; L261-A307 HydrophobicContact CD1-CB 4.32Å; L261-F309 HydrophobicContact CB-CD2 4.19Å; L261-F309 HydrophobicContact CB-CE2 4.44Å; L261-F309 HydrophobicContact CD1-CD2 4.33Å
262	V	98.5	Very high	93	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	130.7	175.1	-168.9	0	0	0	0	109.1	F185 A244 L245 A248 A307 I308 L310 L415	F185-V262 HydrophobicContact CB-CG1 4.44Å; F185-V262 CarbonylContact O-C 2.99Å; F185-V262 VanDerWaalsContact O-CA 3.31Å; F185-V262 WeakPolarHBondContact O-CA 3.48Å; A244-V262 HydrophobicContact CB-CG1 3.89Å; L245-V262 HydrophobicContact CB-CG1 4.08Å; A248-V262 HydrophobicContact CB-CG2 3.37Å; V262-A307 CarbonylContact O-C 3.51Å; V262-A307 WeakPolarHBondContact O-CA 3.42Å; V262-I308 HydrophobicContact CB-CG1 3.97Å; V262-I308 PolarHBondContact N-O 3.42Å; V262-I308 PolarHBondContact O-N 3.49Å; V262-L310 HydrophobicContact CG2-CD1 3.68Å; V262-L310 HydrophobicContact CG2-CG 4.01Å; V262-L415 HydrophobicContact CG1-CD1 4.25Å
263	A	98.2	Very high	92.5	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	165.1	-178.6	0	0	0	0	0	113.1	L159 F185 V186 G187 V306 A307	L159-A263 HydrophobicContact CD1-CB 3.62Å; F185-A263 PolarHBondContact O-N 2.87Å; V186-A263 CarbonylContact C-O 3.59Å; V186-A263 WeakPolarHBondContact CA-O 3.43Å; V186-A263 HydrophobicContact CG1-CB 4.3Å; V186-A263 HydrophobicContact CG2-CB 4.27Å; G187-A263 PolarHBondContact N-O 2.93Å; A263-V306 CarbonylContact C-O 3.56Å; A263-V306 WeakPolarHBondContact CA-O 3.32Å; A263-V306 WeakPolarHBondContact CB-O 3.43Å; A263-A307 HydrophobicContact CB-CB 4.04Å
264	G	97	Very high	92.3	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	136	177	0	0	0	0	0	108.9	G187 I305 V306	G187-G264 CarbonylContact O-C 3.57Å; G187-G264 VanDerWaalsContact O-CA 3.3Å; G187-G264 WeakPolarHBondContact O-CA 3.41Å; G264-I305 CarbonylContact O-C 3.57Å; G264-I305 WeakPolarHBondContact O-CA 3.43Å; G264-V306 PolarHBondContact N-O 2.98Å; G264-V306 PolarHBondContact O-N 2.78Å
265	S	96.3	Very high	92.2	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	128.6	-174.8	-161.9	0	0	0	0	112.6	Q155 G187 I305 P411	Q155-S265 WeakPolarHBondContact CB-OG 3.36Å; G187-S265 PolarHBondContact O-N 2.99Å; S265-I305 WeakPolarHBondContact OG-CG1 3.38Å; S265-P411 WeakPolarHBondContact O-CG 3.48Å
266	H	95.8	Very high	92.2	Very high	14 Å²	14	22.2 Å²	22.2	7%	0.065	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	139.1	173.9	-167.7	75.8	0	0	0	112	R301 S302 G304 E410 P411 A412	H266-R301 PolarHBondContact CE1-NH2 3.02Å; H266-R301 VanDerWaalsContact CE1-NH2 3.32Å; H266-R301 PolarHBondContact NE2-NH2 3.48Å; H266-S302 PolarHBondContact CD2-O 2.77Å; H266-S302 VanDerWaalsContact CD2-O 3.31Å; H266-G304 PolarHBondContact N-O 3.15Å; H266-G304 PolarHBondContact O-N 2.79Å; H266-E410 IonicContact CE1-OE2 2.64Å; H266-E410 PolarHBondContact CE1-OE2 3.25Å; H266-E410 IonicContact NE2-OE2 3Å; H266-E410 PolarHBondContact NE2-OE2 3.24Å; H266-P411 HydrophobicContact CB-CG 3.99Å; H266-P411 WeakPolarHBondContact ND1-CD 3.37Å; H266-A412 HydrophobicContact CB-CB 4.48Å
267	L	93.9	Very high	92.1	Very high	4 Å²	4	18.8 Å²	18.8	2%	0.021	10%	0.099	C	C	.	.			trans	-133.1	157.4	167.9	-69.6	-179.4	0	0	0	110.7	V131 L134 P154 Q155 L269 E303 I305	V131-L267 HydrophobicContact CG2-CD2 4.46Å; L134-L267 HydrophobicContact CD1-CD1 3.95Å; L134-L267 HydrophobicContact CD1-CD2 4.36Å; L134-L267 HydrophobicContact CD2-CD1 3.73Å; L134-L267 HydrophobicContact CD2-CD2 3.71Å; L134-L267 HydrophobicContact CD2-CG 4.42Å; L134-L267 HydrophobicContact CG-CD1 4.48Å; P154-L267 HydrophobicContact CB-CD1 3.77Å; Q155-L267 HydrophobicContact CG-CB 4.06Å; Q155-L267 HydrophobicContact CG-CD1 3.7Å; Q155-L267 HydrophobicContact CG-CG 3.61Å; L267-L269 HydrophobicContact CB-CD2 4.07Å; L267-L269 HydrophobicContact CB-CG 4.2Å; L267-L269 HydrophobicContact CD1-CD2 4.29Å; L267-E303 HydrophobicContact CD2-CB 3.95Å; L267-E303 HydrophobicContact CD2-CG 4.07Å; L267-I305 HydrophobicContact CD2-CD1 3.79Å; L267-I305 HydrophobicContact CG-CD1 4.27Å
268	T	90.9	Very high	91.9	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.109	C	C	.	.			trans	-120.7	81.8	-179.7	60.9	0	0	0	0	109.5	R116 W117 R301 E303	R116-T268 VanDerWaalsContact CD-O 3.32Å; R116-T268 WeakPolarHBondContact CD-O 3.36Å; R116-T268 VanDerWaalsContact CG-O 3.31Å; R116-T268 WeakPolarHBondContact CG-O 3.48Å; W117-T268 WeakPolarHBondContact CZ3-O 3.31Å; T268-R301 HydrophobicContact CG2-CB 4.27Å; T268-E303 HydrophobicContact CG2-CG 4.18Å; T268-E303 PolarHBondContact N-OE1 3.35Å; T268-E303 WeakPolarHBondContact OG1-CG 3.26Å; T268-E303 PolarHBondContact OG1-OE1 3.42Å
269	L	87.9	Confident	91.8	Very high	2 Å²	2	27 Å²	27	1%	0.01	13%	0.13	C	C	.	.			trans	-91.4	-30	-173.8	-52.1	-177.3	0	0	0	112.2	L134 E192 L267 V944	L134-L269 HydrophobicContact CD1-CD2 3.56Å; E192-L269 HydrophobicContact CB-CB 4.37Å; E192-L269 WeakPolarHBondContact OE2-CA 3.45Å; E192-L269 WeakPolarHBondContact OE2-CB 3.28Å; E192-L269 PolarHBondContact OE2-N 3.4Å; L267-L269 HydrophobicContact CB-CD2 4.07Å; L267-L269 HydrophobicContact CB-CG 4.2Å; L267-L269 HydrophobicContact CD1-CD2 4.29Å; L269-V944 HydrophobicContact CD2-CG1 4.31Å
270	T	83.9	Confident	91.4	Very high	9 Å²	9	31.6 Å²	31.6	6%	0.055	15%	0.153	C	C	.	.			trans	-118	138.7	-174.6	80.7	0	0	0	0	113.5	W117 E192 T272 M950	W117-T270 VanDerWaalsContact CZ3-O 3.31Å; W117-T270 WeakPolarHBondContact CZ3-O 3.37Å; E192-T270 HydrophobicContact CB-CG2 4.02Å; E192-T270 HydrophobicContact CG-CG2 4.47Å; E192-T270 PolarHBondContact OE1-OG1 3.23Å; E192-T270 PolarHBondContact OE2-N 3.26Å; E192-T270 PolarHBondContact OE2-OG1 3.09Å; T270-T272 PolarHBondContact O-N 3.39Å; T270-M950 HydrophobicContact CG2-CE 4.22Å; T270-M950 HydrophobicContact CG2-SD 3.48Å; T270-M950 WeakPolarHBondContact CG2-SD 3.22Å
271	P	86	Confident	90.9	Very high	9 Å²	9	34.3 Å²	34.3	6%	0.058	18%	0.181	C	C	.	.	H	α-helix	trans	-70.6	-14.7	176.8	29.1	-35.2	0	0	0	112.7	W117 L121 F122 L124 A274 L275	W117-P271 HydrophobicContact CD2-CB 4Å; W117-P271 HydrophobicContact CE3-CB 4.18Å; W117-P271 HydrophobicContact CG-CB 4.27Å; L121-P271 HydrophobicContact CD2-CB 4.2Å; L121-P271 HydrophobicContact CD2-CG 4.08Å; F122-P271 HydrophobicContact CD2-CB 4.26Å; F122-P271 HydrophobicContact CE2-CB 4.32Å; F122-P271 HydrophobicContact CE2-CG 4.09Å; L124-P271 HydrophobicContact CD1-CB 3.67Å; P271-A274 PolarHBondContact O-N 3.14Å; P271-L275 WeakPolarHBondContact O-CB 3.29Å; P271-L275 PolarHBondContact O-N 3.43Å
272	T	84.1	Confident	90.5	Very high	80 Å²	80	35.6 Å²	35.6	49%	0.491	19%	0.188	S	C	.	.	H	α-helix	trans	-61.5	-47.6	-177.9	-56.4	0	0	0	0	112.1	T270 L275 Q276	T270-T272 PolarHBondContact O-N 3.39Å; T272-L275 PolarHBondContact O-N 3.2Å; T272-Q276 WeakPolarHBondContact O-CG 3.34Å; T272-Q276 PolarHBondContact O-N 3.39Å; T272-Q276 VanDerWaalsContact O-N 3.16Å
273	T	85.5	Confident	90.3	Very high	35 Å²	35	36.3 Å²	36.3	22%	0.215	19%	0.191	C	C	.	.	H	α-helix	trans	-68.4	-39.5	179.1	-49.5	0	0	0	0	111	E192 L275 Q276 F277	E192-T273 VanDerWaalsContact OE1-CB 3.23Å; E192-T273 WeakPolarHBondContact OE1-CB 3.42Å; E192-T273 PolarHBondContact OE1-OG1 3.14Å; T273-L275 VanDerWaalsContact C-N 3.31Å; T273-L275 PolarHBondContact O-N 2.96Å; T273-Q276 WeakPolarHBondContact O-CB 3.41Å; T273-Q276 PolarHBondContact O-N 3.16Å; T273-F277 HydrophobicContact CG2-CD2 4.21Å; T273-F277 HydrophobicContact CG2-CE2 3.87Å; T273-F277 VanDerWaalsContact O-CD2 3.3Å; T273-F277 WeakPolarHBondContact O-CD2 3.34Å; T273-F277 PolarHBondContact O-N 3.18Å
274	A	88.6	Confident	90	Very high	4 Å²	4	36.3 Å²	36.3	3%	0.033	19%	0.191	C	C	.	.	H	α-helix	trans	-61.3	-38.3	173.5	0	0	0	0	0	112.5	W117 L124 P271 Q276 F277 M278 L283	W117-A274 HydrophobicContact CH2-CB 4.15Å; W117-A274 HydrophobicContact CZ2-CB 4.04Å; L124-A274 HydrophobicContact CD1-CB 4Å; L124-A274 HydrophobicContact CD2-CB 3.84Å; P271-A274 PolarHBondContact O-N 3.14Å; A274-Q276 VanDerWaalsContact C-N 3.32Å; A274-Q276 PolarHBondContact O-N 2.75Å; A274-F277 PolarHBondContact O-N 3.17Å; A274-M278 WeakPolarHBondContact O-CB 3.36Å; A274-M278 PolarHBondContact O-N 2.73Å; A274-L283 WeakPolarHBondContact O-CD1 3.4Å
275	L	88.9	Confident	89.6	Confident	32 Å²	32	41.2 Å²	41.2	17%	0.168	21%	0.214	C	C	.	.	H	α-helix	trans	-68.6	-29.6	177.4	-175.3	59.8	0	0	0	112.6	F122 L124 P271 T272 T273 M278 R279	F122-L275 HydrophobicContact CB-CD1 4.42Å; L124-L275 HydrophobicContact CD2-CB 4.24Å; L124-L275 HydrophobicContact CD2-CD1 4.48Å; P271-L275 WeakPolarHBondContact O-CB 3.29Å; P271-L275 PolarHBondContact O-N 3.43Å; T272-L275 PolarHBondContact O-N 3.2Å; T273-L275 VanDerWaalsContact C-N 3.31Å; T273-L275 PolarHBondContact O-N 2.96Å; L275-M278 HydrophobicContact CD1-CE 3.73Å; L275-R279 WeakPolarHBondContact O-CB 3.3Å; L275-R279 VanDerWaalsContact O-CG 3.22Å; L275-R279 WeakPolarHBondContact O-CG 3.16Å; L275-R279 PolarHBondContact O-N 3.08Å; L275-R279 VanDerWaalsContact O-N 3.09Å
276	Q	90.3	Very high	89.3	Confident	116 Å²	116	45.5 Å²	45.5	54%	0.542	23%	0.233	S	C	.	.	H	α-helix	trans	-66.9	-51	172	-68.8	172	-1.4	0	0	110.9	T272 T273 A274 M278 R279 L280	T272-Q276 WeakPolarHBondContact O-CG 3.34Å; T272-Q276 PolarHBondContact O-N 3.39Å; T272-Q276 VanDerWaalsContact O-N 3.16Å; T273-Q276 WeakPolarHBondContact O-CB 3.41Å; T273-Q276 PolarHBondContact O-N 3.16Å; A274-Q276 VanDerWaalsContact C-N 3.32Å; A274-Q276 PolarHBondContact O-N 2.75Å; Q276-M278 VanDerWaalsContact C-N 3.33Å; Q276-M278 PolarHBondContact O-N 2.7Å; Q276-R279 PolarHBondContact O-N 3.46Å; Q276-R279 VanDerWaalsContact O-N 3.14Å; Q276-L280 PolarHBondContact O-N 3.47Å; Q276-L280 VanDerWaalsContact O-N 3.09Å
277	F	90.6	Very high	89	Confident	20 Å²	20	44.9 Å²	44.9	9%	0.088	23%	0.23	C	C	.	.	H	α-helix	trans	-61.4	-38.1	176.4	-73.6	-66.9	0	0	0	113	T273 A274 R279 L280 G281 L282 L283 Y299 E410 F472	T273-F277 HydrophobicContact CG2-CD2 4.21Å; T273-F277 HydrophobicContact CG2-CE2 3.87Å; T273-F277 VanDerWaalsContact O-CD2 3.3Å; T273-F277 WeakPolarHBondContact O-CD2 3.34Å; T273-F277 PolarHBondContact O-N 3.18Å; A274-F277 PolarHBondContact O-N 3.17Å; F277-R279 PolarHBondContact O-N 3.01Å; F277-L280 PolarHBondContact O-N 3.35Å; F277-G281 PolarHBondContact O-N 2.99Å; F277-L282 HydrophobicContact CD1-CD1 4.1Å; F277-L282 PolarHBondContact O-N 2.86Å; F277-L283 HydrophobicContact CB-CD1 3.93Å; F277-L283 HydrophobicContact CB-CD2 3.92Å; F277-L283 HydrophobicContact CB-CG 3.79Å; F277-Y299 VanDerWaalsContact CD1-OH 3.23Å; F277-Y299 WeakPolarHBondContact CD1-OH 3.39Å; F277-Y299 WeakPolarHBondContact CE1-OH 3.22Å; F277-E410 VanDerWaalsContact CE2-OE1 3.23Å; F277-E410 WeakPolarHBondContact CE2-OE1 3.46Å; F277-E410 WeakPolarHBondContact CE2-OE2 3.49Å; F277-F472 HydrophobicContact CE1-CD1 4.25Å; F277-F472 HydrophobicContact CE1-CE1 4.02Å; F277-F472 HydrophobicContact CZ-CE1 4.28Å
278	M	90.2	Very high	88.9	Confident	41 Å²	41	46.9 Å²	46.9	20%	0.202	24%	0.24	C	C	.	.	H	α-helix	trans	-62.6	-40.9	174.2	-167.1	179.8	81.4	0	0	112.1	L124 A274 L275 Q276 L280 G281 L283 Q285	L124-M278 HydrophobicContact CD2-CB 4.25Å; L124-M278 HydrophobicContact CD2-SD 4.02Å; A274-M278 WeakPolarHBondContact O-CB 3.36Å; A274-M278 PolarHBondContact O-N 2.73Å; L275-M278 HydrophobicContact CD1-CE 3.73Å; Q276-M278 VanDerWaalsContact C-N 3.33Å; Q276-M278 PolarHBondContact O-N 2.7Å; M278-L280 VanDerWaalsContact C-N 3.27Å; M278-L280 PolarHBondContact O-N 2.81Å; M278-G281 PolarHBondContact O-N 3.42Å; M278-L283 HydrophobicContact CB-CD1 4.18Å; M278-Q285 PolarHBondContact SD-NE2 3.46Å; M278-Q285 VanDerWaalsContact SD-NE2 3.42Å
279	R	90	Very high	89.2	Confident	197 Å²	197	47 Å²	47	74%	0.743	24%	0.24	S	C	*	.	H	α-helix	trans	-71.7	-18.1	177.8	-74.6	173.8	179.1	-160.8	0.3	113.9	L275 Q276 F277 G281	L275-R279 WeakPolarHBondContact O-CB 3.3Å; L275-R279 VanDerWaalsContact O-CG 3.22Å; L275-R279 WeakPolarHBondContact O-CG 3.16Å; L275-R279 PolarHBondContact O-N 3.08Å; L275-R279 VanDerWaalsContact O-N 3.09Å; Q276-R279 PolarHBondContact O-N 3.46Å; Q276-R279 VanDerWaalsContact O-N 3.14Å; F277-R279 PolarHBondContact O-N 3.01Å; R279-G281 VanDerWaalsContact C-N 3.27Å
280	L	87.4	Confident	89.5	Confident	100 Å²	100	47.3 Å²	47.3	52%	0.524	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-3.1	168.2	-67.3	173.2	0	0	0	113	Q276 F277 M278 L282	Q276-L280 PolarHBondContact O-N 3.47Å; Q276-L280 VanDerWaalsContact O-N 3.09Å; F277-L280 PolarHBondContact O-N 3.35Å; M278-L280 VanDerWaalsContact C-N 3.27Å; M278-L280 PolarHBondContact O-N 2.81Å; L280-L282 VanDerWaalsContact C-N 3.29Å; L280-L282 HydrophobicContact CB-CD1 3.81Å; L280-L282 HydrophobicContact CB-CG 3.9Å; L280-L282 HydrophobicContact CD1-CD1 4.06Å; L280-L282 PolarHBondContact O-N 3.44Å
281	G	87	Confident	90.1	Very high	56 Å²	56	46.9 Å²	46.9	58%	0.577	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.4	21.3	-178.1	0	0	0	0	0	114	F277 M278 R279	F277-G281 PolarHBondContact O-N 2.99Å; M278-G281 PolarHBondContact O-N 3.42Å; R279-G281 VanDerWaalsContact C-N 3.27Å
282	L	90.1	Very high	90.5	Very high	28 Å²	28	46.6 Å²	46.6	15%	0.147	24%	0.237	C	C	.	.			trans	-93.6	-15.8	-174.3	-63.9	173.4	0	0	0	113.7	F277 L280 G298 Y299	F277-L282 HydrophobicContact CD1-CD1 4.1Å; F277-L282 PolarHBondContact O-N 2.86Å; L280-L282 VanDerWaalsContact C-N 3.29Å; L280-L282 HydrophobicContact CB-CD1 3.81Å; L280-L282 HydrophobicContact CB-CG 3.9Å; L280-L282 HydrophobicContact CD1-CD1 4.06Å; L280-L282 PolarHBondContact O-N 3.44Å; L282-G298 WeakPolarHBondContact O-CA 3.31Å; L282-Y299 HydrophobicContact CB-CD1 4.35Å; L282-Y299 HydrophobicContact CB-CE1 3.87Å; L282-Y299 VanDerWaalsContact O-CD1 3.23Å; L282-Y299 WeakPolarHBondContact O-CD1 3.27Å; L282-Y299 PolarHBondContact O-N 3.31Å
283	L	93.2	Very high	91	Very high	15 Å²	15	42.9 Å²	42.9	8%	0.079	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-99.7	134.3	-175.3	-58.2	-171.6	0	0	0	113.6	P125 A274 F277 M278 Q285 Y299 R301	P125-L283 HydrophobicContact CG-CB 4.28Å; A274-L283 WeakPolarHBondContact O-CD1 3.4Å; F277-L283 HydrophobicContact CB-CD1 3.93Å; F277-L283 HydrophobicContact CB-CD2 3.92Å; F277-L283 HydrophobicContact CB-CG 3.79Å; M278-L283 HydrophobicContact CB-CD1 4.18Å; L283-Q285 PolarHBondContact O-N 3.18Å; L283-Y299 CarbonylContact C-O 3.6Å; L283-Y299 VanDerWaalsContact CA-O 3.26Å; L283-Y299 WeakPolarHBondContact CA-O 3.37Å; L283-Y299 HydrophobicContact CD2-CD1 4.5Å; L283-Y299 HydrophobicContact CD2-CD2 3.88Å; L283-Y299 HydrophobicContact CD2-CE1 4.23Å; L283-Y299 HydrophobicContact CD2-CE2 3.59Å; L283-Y299 HydrophobicContact CD2-CG 4.34Å; L283-R301 HydrophobicContact CD1-CG 4Å; L283-R301 HydrophobicContact CD2-CG 3.62Å; L283-R301 HydrophobicContact CG-CG 4.5Å
284	S	93.4	Very high	91.3	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.218	C	C	.	.			trans	-67.5	121.4	171.6	165	0	0	0	0	111	P125 K286 G287 M288 G298 Y299	P125-S284 WeakPolarHBondContact CB-O 3.38Å; P125-S284 WeakPolarHBondContact CG-O 3.04Å; S284-K286 VanDerWaalsContact C-N 3.33Å; S284-G287 PolarHBondContact O-N 2.86Å; S284-G287 PolarHBondContact OG-N 2.94Å; S284-M288 VanDerWaalsContact CB-O 3.3Å; S284-M288 WeakPolarHBondContact CB-O 3.45Å; S284-M288 PolarHBondContact OG-N 3.25Å; S284-M288 PolarHBondContact OG-O 3.26Å; S284-G298 WeakPolarHBondContact CB-O 3.45Å; S284-Y299 PolarHBondContact N-O 3.46Å
285	Q	88.6	Confident	91.5	Very high	104 Å²	104	46.4 Å²	46.4	49%	0.486	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-30.8	176.8	-77.7	-69.6	-28	0	0	111.5	M278 L283 G287 E297	M278-Q285 PolarHBondContact SD-NE2 3.46Å; M278-Q285 VanDerWaalsContact SD-NE2 3.42Å; L283-Q285 PolarHBondContact O-N 3.18Å; Q285-G287 PolarHBondContact O-N 3.25Å; Q285-E297 WeakPolarHBondContact CA-OE1 3.06Å; Q285-E297 PolarHBondContact N-OE1 3.48Å
286	K	88.3	Confident	91.6	Very high	90 Å²	90	45.2 Å²	45.2	39%	0.391	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-18.5	171.6	-62.3	179.8	-169.9	179.3	0	113.7	S284 M288 E297	S284-K286 VanDerWaalsContact C-N 3.33Å; K286-M288 HydrophobicContact CB-CE 4.43Å; K286-M288 HydrophobicContact CB-CG 3.76Å; K286-M288 HydrophobicContact CB-SD 4.24Å; K286-M288 HydrophobicContact CD-CG 4.46Å; K286-M288 HydrophobicContact CD-SD 4.26Å; K286-E297 PolarHBondContact N-OE1 3.39Å; K286-E297 VanDerWaalsContact N-OE1 3.11Å
287	G	89.6	Confident	91.6	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	66.4	42.6	-174.5	0	0	0	0	0	112.5	I110 R127 S284 Q285	I110-G287 VanDerWaalsContact CG2-O 3.32Å; I110-G287 WeakPolarHBondContact CG2-O 3.49Å; R127-G287 WeakPolarHBondContact CD-O 3.47Å; R127-G287 PolarHBondContact NH1-O 3.21Å; S284-G287 PolarHBondContact O-N 2.86Å; S284-G287 PolarHBondContact OG-N 2.94Å; Q285-G287 PolarHBondContact O-N 3.25Å
288	M	93.4	Very high	91.8	Very high	47 Å²	47	42.6 Å²	42.6	23%	0.232	22%	0.22	C	C	.	.	S	Bend	trans	-149.6	143.1	171.8	54.6	-176.3	66	0	0	110.9	S284 K286 Q290 V300	S284-M288 VanDerWaalsContact CB-O 3.3Å; S284-M288 WeakPolarHBondContact CB-O 3.45Å; S284-M288 PolarHBondContact OG-N 3.25Å; S284-M288 PolarHBondContact OG-O 3.26Å; K286-M288 HydrophobicContact CB-CE 4.43Å; K286-M288 HydrophobicContact CB-CG 3.76Å; K286-M288 HydrophobicContact CB-SD 4.24Å; K286-M288 HydrophobicContact CD-CG 4.46Å; K286-M288 HydrophobicContact CD-SD 4.26Å; M288-Q290 HydrophobicContact CG-CG 3.84Å; M288-Q290 PolarHBondContact O-N 3.24Å; M288-Q290 HydrophobicContact SD-CG 4.01Å; M288-V300 VanDerWaalsContact C-CG2 3.43Å; M288-V300 VanDerWaalsContact CA-CG2 3.42Å
289	C	95.6	Very high	92	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.007	21%	0.212	C	C	.	.			trans	-88.8	93.6	174.6	-59.4	0	0	0	0	109.1	T291 V300 K403	C289-T291 PolarHBondContact O-N 3.38Å; C289-T291 PolarHBondContact O-OG1 3.43Å; C289-V300 PolarHBondContact SG-N 3.49Å; C289-K403 WeakPolarHBondContact CB-O 3.44Å; C289-K403 PolarHBondContact SG-O 3.08Å
290	Q	95.6	Very high	92.2	Very high	10 Å²	10	32 Å²	32	5%	0.047	18%	0.178	C	C	.	.			trans	-79	68	-179.9	-57	-155	-112.5	0	0	111.5	M288 F292 D293 G373 H435	M288-Q290 HydrophobicContact CG-CG 3.84Å; M288-Q290 PolarHBondContact O-N 3.24Å; M288-Q290 HydrophobicContact SD-CG 4.01Å; Q290-F292 PolarHBondContact O-N 2.7Å; Q290-D293 HydrophobicContact CB-CB 3.86Å; Q290-D293 PolarHBondContact O-N 3.49Å; Q290-G373 WeakPolarHBondContact O-CA 3.03Å; Q290-H435 HydrophobicContact CB-CB 4.46Å; Q290-H435 HydrophobicContact CG-CB 4.09Å; Q290-H435 PolarHBondContact NE2-O 3.13Å
291	T	95	Very high	92.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	125.3	-174.7	-51.7	0	0	0	0	111.3	C289 D293 G371 D378	C289-T291 PolarHBondContact O-N 3.38Å; C289-T291 PolarHBondContact O-OG1 3.43Å; T291-D293 PolarHBondContact O-N 3.26Å; T291-D293 VanDerWaalsContact O-N 3.1Å; T291-G371 PolarHBondContact OG1-O 2.78Å; T291-D378 WeakPolarHBondContact CA-OD2 3.01Å
292	F	94.9	Very high	92.9	Very high	3 Å²	3	25 Å²	25	1%	0.013	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	5.6	-177.3	-53.3	-49.7	0	0	0	117.2	Q290 T369 D378 A382 V399 F436 N440 I443 L446 V453	Q290-F292 PolarHBondContact O-N 2.7Å; F292-T369 HydrophobicContact CE2-CG2 4.13Å; F292-T369 HydrophobicContact CZ-CG2 3.78Å; F292-T369 WeakPolarHBondContact CZ-OG1 3.36Å; F292-D378 HydrophobicContact CD1-CB 3.99Å; F292-D378 HydrophobicContact CE1-CB 4.17Å; F292-D378 PolarHBondContact N-OD2 3.49Å; F292-A382 HydrophobicContact CD1-CB 4.32Å; F292-A382 HydrophobicContact CE1-CB 4.01Å; F292-V399 HydrophobicContact CD2-CG2 4.42Å; F292-V399 HydrophobicContact CE2-CB 4.42Å; F292-V399 HydrophobicContact CE2-CG2 4.19Å; F292-F436 HydrophobicContact CB-CD2 4.03Å; F292-F436 HydrophobicContact CB-CE2 3.9Å; F292-F436 WeakPolarHBondContact O-CE2 3.17Å; F292-N440 WeakPolarHBondContact O-CB 3.18Å; F292-N440 PolarHBondContact O-N 3.04Å; F292-I443 HydrophobicContact CB-CD1 4.42Å; F292-I443 HydrophobicContact CD1-CD1 3.73Å; F292-I443 HydrophobicContact CG-CD1 4.5Å; F292-L446 HydrophobicContact CB-CD1 3.8Å; F292-L446 HydrophobicContact CG-CD1 4.37Å; F292-V453 HydrophobicContact CB-CG2 4.31Å; F292-V453 HydrophobicContact CD2-CG2 3.99Å
293	D	95.3	Very high	93.2	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	-80.4	153.2	177	-166.2	-90.6	0	0	0	111.7	Q290 T291 N295 G296 E437 E438 N440	Q290-D293 HydrophobicContact CB-CB 3.86Å; Q290-D293 PolarHBondContact O-N 3.49Å; T291-D293 PolarHBondContact O-N 3.26Å; T291-D293 VanDerWaalsContact O-N 3.1Å; D293-N295 PolarHBondContact O-N 2.99Å; D293-N295 WeakPolarHBondContact OD1-CA 3.13Å; D293-N295 WeakPolarHBondContact OD1-CB 3.28Å; D293-N295 PolarHBondContact OD1-N 3.3Å; D293-N295 PolarHBondContact OD1-ND2 3.29Å; D293-G296 PolarHBondContact O-N 2.91Å; D293-E437 PolarHBondContact OD2-N 3.08Å; D293-E438 CarbonylContact C-O 3.54Å; D293-E438 WeakPolarHBondContact CA-O 3.49Å; D293-E438 PolarHBondContact OD2-N 2.91Å; D293-N440 PolarHBondContact O-ND2 2.94Å; D293-N440 VanDerWaalsContact O-ND2 3.15Å
294	A	92.3	Very high	93.3	Very high	37 Å²	37	23 Å²	23	31%	0.306	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-24	173.7	0	0	0	0	0	113.2	E438	A294-E438 HydrophobicContact CB-CB 4.24Å; A294-E438 HydrophobicContact CB-CG 4.09Å; A294-E438 PolarHBondContact N-O 3.29Å
295	N	92.1	Very high	93.5	Very high	77 Å²	77	23 Å²	23	41%	0.412	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	9.2	179.2	-58.7	-91.5	0	0	0	114	D293 E297	D293-N295 PolarHBondContact O-N 2.99Å; D293-N295 WeakPolarHBondContact OD1-CA 3.13Å; D293-N295 WeakPolarHBondContact OD1-CB 3.28Å; D293-N295 PolarHBondContact OD1-N 3.3Å; D293-N295 PolarHBondContact OD1-ND2 3.29Å; N295-E297 PolarHBondContact O-N 3.49Å
296	G	90.4	Very high	94	Very high	6 Å²	6	18 Å²	18	6%	0.062	9%	0.094	C	C	.	.			trans	-57.9	103.4	175.2	0	0	0	0	0	112.9	D293 G373 K375	D293-G296 PolarHBondContact O-N 2.91Å; G296-G373 CarbonylContact C-O 3.56Å; G296-G373 WeakPolarHBondContact CA-O 3.34Å; G296-K375 WeakPolarHBondContact O-CA 3.4Å; G296-K375 WeakPolarHBondContact O-CB 3.46Å; G296-K375 PolarHBondContact O-N 3.36Å
297	E	91.6	Very high	94.5	Very high	81 Å²	81	13.7 Å²	13.7	38%	0.379	8%	0.075	S	C	.	.			trans	-106	-14.6	-179.7	60.7	171.5	-155.9	0	0	114.6	Q285 K286 N295 G373	Q285-E297 WeakPolarHBondContact CA-OE1 3.06Å; Q285-E297 PolarHBondContact N-OE1 3.48Å; K286-E297 PolarHBondContact N-OE1 3.39Å; K286-E297 VanDerWaalsContact N-OE1 3.11Å; N295-E297 PolarHBondContact O-N 3.49Å; E297-G373 PolarHBondContact N-O 3.4Å; E297-G373 VanDerWaalsContact N-O 3.12Å
298	G	92.9	Very high	94.9	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.01	8%	0.075	C	C	.	.			trans	163.5	-179	-174.8	0	0	0	0	0	112.8	L282 S284 G373	L282-G298 WeakPolarHBondContact O-CA 3.31Å; S284-G298 WeakPolarHBondContact CB-O 3.45Å; G298-G373 PolarHBondContact N-O 3.04Å
299	Y	94.9	Very high	95.1	Very high	10 Å²	10	11.6 Å²	11.6	4%	0.039	7%	0.065	C	C	.	.	B	Isolated β-bridge	trans	-101.7	168.4	176.7	75.3	-100.1	0	0	0	112.5	F277 L282 L283 S284 R301 T372 T374 H408 E410	F277-Y299 VanDerWaalsContact CD1-OH 3.23Å; F277-Y299 WeakPolarHBondContact CD1-OH 3.39Å; F277-Y299 WeakPolarHBondContact CE1-OH 3.22Å; L282-Y299 HydrophobicContact CB-CD1 4.35Å; L282-Y299 HydrophobicContact CB-CE1 3.87Å; L282-Y299 VanDerWaalsContact O-CD1 3.23Å; L282-Y299 WeakPolarHBondContact O-CD1 3.27Å; L282-Y299 PolarHBondContact O-N 3.31Å; L283-Y299 CarbonylContact C-O 3.6Å; L283-Y299 VanDerWaalsContact CA-O 3.26Å; L283-Y299 WeakPolarHBondContact CA-O 3.37Å; L283-Y299 HydrophobicContact CD2-CD1 4.5Å; L283-Y299 HydrophobicContact CD2-CD2 3.88Å; L283-Y299 HydrophobicContact CD2-CE1 4.23Å; L283-Y299 HydrophobicContact CD2-CE2 3.59Å; L283-Y299 HydrophobicContact CD2-CG 4.34Å; S284-Y299 PolarHBondContact N-O 3.46Å; Y299-R301 HydrophobicContact CE2-CG 4.09Å; Y299-T372 WeakPolarHBondContact CA-O 3.35Å; Y299-T372 WeakPolarHBondContact CB-O 3.23Å; Y299-T374 HydrophobicContact CD1-CG2 4.5Å; Y299-H408 HydrophobicContact CD2-CB 3.43Å; Y299-H408 VanDerWaalsContact CD2-CB 3.43Å; Y299-H408 AromaticContact CD2-CD2 3.72Å; Y299-H408 AromaticContact CD2-CG 3.91Å; Y299-H408 HydrophobicContact CE2-CB 3.96Å; Y299-H408 AromaticContact CE2-CD2 3.9Å; Y299-H408 HydrophobicContact CG-CB 4.07Å; Y299-H408 AromaticContact CG-CD2 3.78Å; Y299-E410 HydrophobicContact CE2-CG 4.48Å; Y299-E410 PolarHBondContact OH-OE1 3.19Å; Y299-E410 VanDerWaalsContact OH-OE1 3.14Å
300	V	95	Very high	95.2	Very high	4 Å²	4	11.6 Å²	11.6	2%	0.024	6%	0.064	C	C	.	.			trans	-108.4	129.2	171.2	-168	0	0	0	0	109.3	I110 H128 M288 C289 H408	I110-V300 HydrophobicContact CD1-CG1 4.29Å; I110-V300 HydrophobicContact CG2-CG1 4.09Å; H128-V300 HydrophobicContact CB-CG1 4.29Å; M288-V300 VanDerWaalsContact C-CG2 3.43Å; M288-V300 VanDerWaalsContact CA-CG2 3.42Å; C289-V300 PolarHBondContact SG-N 3.49Å; V300-H408 WeakPolarHBondContact O-CB 3.41Å; V300-H408 PolarHBondContact O-N 2.88Å
301	R	94.4	Very high	95.2	Very high	10 Å²	10	11.6 Å²	11.6	4%	0.038	6%	0.064	C	C	.	.	B	Isolated β-bridge	trans	-62	141.4	172.5	-56.2	-166.5	76.5	-136.1	-3.2	109.5	H128 G129 H266 T268 L283 Y299 E410	H128-R301 WeakPolarHBondContact CB-O 3.4Å; G129-R301 PolarHBondContact N-O 3.17Å; H266-R301 PolarHBondContact CE1-NH2 3.02Å; H266-R301 VanDerWaalsContact CE1-NH2 3.32Å; H266-R301 PolarHBondContact NE2-NH2 3.48Å; T268-R301 HydrophobicContact CG2-CB 4.27Å; L283-R301 HydrophobicContact CD1-CG 4Å; L283-R301 HydrophobicContact CD2-CG 3.62Å; L283-R301 HydrophobicContact CG-CG 4.5Å; Y299-R301 HydrophobicContact CE2-CG 4.09Å; R301-E410 IonicContact CZ-OE1 3.76Å; R301-E410 IonicContact CZ-OE2 2.62Å; R301-E410 IonicContact NE-OE1 2.67Å; R301-E410 PolarHBondContact NE-OE1 3.46Å; R301-E410 IonicContact NE-OE2 2.68Å; R301-E410 VanDerWaalsContact NH2-CD 3.32Å; R301-E410 IonicContact NH2-OE1 3.8Å; R301-E410 PolarHBondContact NH2-OE1 2.7Å; R301-E410 IonicContact NH2-OE2 2.69Å; R301-E410 PolarHBondContact NH2-OE2 3.4Å
302	S	95.1	Very high	95.1	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.074	C	C	.	.	B	Isolated β-bridge	trans	-144.1	164.1	179.4	-164	0	0	0	0	111.1	P91 G129 H266 M406 H408 A409	P91-S302 WeakPolarHBondContact CG-OG 3.36Å; G129-S302 WeakPolarHBondContact CA-OG 3.23Å; H266-S302 PolarHBondContact CD2-O 2.77Å; H266-S302 VanDerWaalsContact CD2-O 3.31Å; S302-M406 WeakPolarHBondContact CB-O 3.36Å; S302-M406 PolarHBondContact OG-O 3.05Å; S302-H408 PolarHBondContact N-O 3.39Å; S302-A409 WeakPolarHBondContact O-CA 3.23Å
303	E	95.6	Very high	94.9	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.087	C	C	.	.			trans	-102	153.5	177.6	-63.2	-170.1	146.7	0	0	110.9	P91 R116 G129 K130 V131 L267 T268	P91-E303 WeakPolarHBondContact CD-O 3.3Å; R116-E303 IonicContact CZ-OE1 2.65Å; R116-E303 IonicContact CZ-OE2 3.05Å; R116-E303 IonicContact NE-OE1 3.52Å; R116-E303 PolarHBondContact NE-OE1 3Å; R116-E303 IonicContact NE-OE2 3.34Å; R116-E303 PolarHBondContact NE-OE2 3.41Å; R116-E303 IonicContact NH2-OE1 2.68Å; R116-E303 IonicContact NH2-OE2 2.83Å; R116-E303 PolarHBondContact NH2-OE2 3.02Å; G129-E303 PolarHBondContact O-N 2.77Å; K130-E303 WeakPolarHBondContact CA-OE2 3.41Å; V131-E303 HydrophobicContact CG2-CB 3.95Å; V131-E303 PolarHBondContact N-OE2 3.11Å; L267-E303 HydrophobicContact CD2-CB 3.95Å; L267-E303 HydrophobicContact CD2-CG 4.07Å; T268-E303 HydrophobicContact CG2-CG 4.18Å; T268-E303 PolarHBondContact N-OE1 3.35Å; T268-E303 WeakPolarHBondContact OG1-CG 3.26Å; T268-E303 PolarHBondContact OG1-OE1 3.42Å
304	G	95.5	Very high	94.6	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.9	135	175.7	0	0	0	0	0	113	H266 A412	H266-G304 PolarHBondContact N-O 3.15Å; H266-G304 PolarHBondContact O-N 2.79Å; G304-A412 VanDerWaalsContact O-CB 3.32Å; G304-A412 WeakPolarHBondContact O-CB 3.36Å
305	I	98	Very high	94.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	119.4	169.5	-52.8	86.6	0	0	0	107.1	A88 R89 V131 I158 L159 V162 G264 S265 L267	A88-I305 CarbonylContact C-O 3.6Å; A88-I305 WeakPolarHBondContact CA-O 3.44Å; R89-I305 PolarHBondContact N-O 2.75Å; R89-I305 PolarHBondContact O-N 2.89Å; V131-I305 HydrophobicContact CG2-CD1 4.37Å; I158-I305 HydrophobicContact CB-CD1 4.39Å; I158-I305 HydrophobicContact CB-CG1 4.4Å; I158-I305 HydrophobicContact CD1-CD1 4.02Å; I158-I305 HydrophobicContact CG2-CB 3.82Å; I158-I305 HydrophobicContact CG2-CD1 4.04Å; I158-I305 HydrophobicContact CG2-CG1 4.05Å; I158-I305 HydrophobicContact CG2-CG2 4.07Å; L159-I305 HydrophobicContact CB-CG2 4.22Å; L159-I305 HydrophobicContact CD1-CG2 3.79Å; V162-I305 HydrophobicContact CG2-CG2 3.82Å; G264-I305 CarbonylContact O-C 3.57Å; G264-I305 WeakPolarHBondContact O-CA 3.43Å; S265-I305 WeakPolarHBondContact OG-CG1 3.38Å; L267-I305 HydrophobicContact CD2-CD1 3.79Å; L267-I305 HydrophobicContact CG-CD1 4.27Å
306	V	98.2	Very high	94.5	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	138.4	-175.8	-172.1	0	0	0	0	108.8	A88 L90 A263 G264 L415 A416 A419	A88-V306 HydrophobicContact CB-CB 4.37Å; A88-V306 HydrophobicContact CB-CG1 4.23Å; A88-V306 HydrophobicContact CB-CG2 4.01Å; L90-V306 HydrophobicContact CD2-CG2 3.91Å; L90-V306 HydrophobicContact CG-CG2 4.49Å; A263-V306 CarbonylContact C-O 3.56Å; A263-V306 WeakPolarHBondContact CA-O 3.32Å; A263-V306 WeakPolarHBondContact CB-O 3.43Å; G264-V306 PolarHBondContact N-O 2.98Å; G264-V306 PolarHBondContact O-N 2.78Å; V306-L415 HydrophobicContact CB-CB 3.86Å; V306-L415 HydrophobicContact CG1-CB 3.79Å; V306-A416 HydrophobicContact CG2-CB 4.48Å; V306-A419 HydrophobicContact CG1-CB 4.5Å
307	A	98.4	Very high	94.5	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	138.5	172	0	0	0	0	0	110.5	I86 S87 V162 A166 L261 V262 A263	I86-A307 WeakPolarHBondContact CA-O 3.41Å; S87-A307 PolarHBondContact N-O 2.84Å; S87-A307 PolarHBondContact O-N 2.84Å; S87-A307 VanDerWaalsContact O-O 3.14Å; V162-A307 HydrophobicContact CB-CB 4.33Å; V162-A307 HydrophobicContact CG2-CB 3.89Å; A166-A307 HydrophobicContact CB-CB 4.08Å; L261-A307 HydrophobicContact CD1-CB 4.32Å; V262-A307 CarbonylContact O-C 3.51Å; V262-A307 WeakPolarHBondContact O-CA 3.42Å; A263-A307 HydrophobicContact CB-CB 4.04Å
308	I	98.5	Very high	94.5	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	149.5	172.4	62.8	167.4	0	0	0	110.4	I83 G85 I86 L245 V262 L310 L415 I418	I83-I308 HydrophobicContact CD1-CD1 4.15Å; I83-I308 HydrophobicContact CG1-CD1 4.32Å; I83-I308 HydrophobicContact CG2-CB 3.95Å; I83-I308 HydrophobicContact CG2-CD1 4.23Å; I83-I308 HydrophobicContact CG2-CG2 4.26Å; G85-I308 CarbonylContact O-C 3.52Å; G85-I308 VanDerWaalsContact O-CA 3.28Å; G85-I308 WeakPolarHBondContact O-CA 3.46Å; I86-I308 HydrophobicContact CB-CG2 4.11Å; I86-I308 HydrophobicContact CD1-CG2 3.83Å; I86-I308 HydrophobicContact CG1-CG2 3.85Å; L245-I308 HydrophobicContact CD1-CD1 4.15Å; L245-I308 HydrophobicContact CD2-CD1 4.34Å; V262-I308 HydrophobicContact CB-CG1 3.97Å; V262-I308 PolarHBondContact N-O 3.42Å; V262-I308 PolarHBondContact O-N 3.49Å; I308-L310 HydrophobicContact CD1-CD2 4.06Å; I308-L415 HydrophobicContact CD1-CD2 3.53Å; I308-L415 HydrophobicContact CG1-CD1 4.45Å; I308-L415 HydrophobicContact CG1-CD2 3.86Å; I308-L415 HydrophobicContact CG2-CD2 4.5Å; I308-I418 HydrophobicContact CD1-CG2 4.5Å
309	F	98.2	Very high	94.5	Very high	3 Å²	3	19.4 Å²	19.4	1%	0.013	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	125.9	175.5	-160.4	-118.6	0	0	0	110.6	S84 G85 L167 A170 V172 T182 A259 L261 Q311	S84-F309 PolarHBondContact N-O 2.83Å; S84-F309 PolarHBondContact OG-O 2.81Å; G85-F309 PolarHBondContact O-N 3.05Å; L167-F309 HydrophobicContact CD1-CD2 3.73Å; L167-F309 HydrophobicContact CD1-CE2 3.91Å; L167-F309 HydrophobicContact CD1-CG 4.31Å; L167-F309 HydrophobicContact CD2-CE2 4.4Å; L167-F309 HydrophobicContact CD2-CZ 4.38Å; L167-F309 HydrophobicContact CG-CD1 4.5Å; L167-F309 HydrophobicContact CG-CD2 4.07Å; L167-F309 HydrophobicContact CG-CE2 4.08Å; L167-F309 HydrophobicContact CG-CG 4.3Å; L167-F309 HydrophobicContact CG-CZ 4.31Å; A170-F309 HydrophobicContact CB-CB 4.28Å; A170-F309 HydrophobicContact CB-CD1 3.88Å; A170-F309 HydrophobicContact CB-CG 4.49Å; V172-F309 HydrophobicContact CG2-CD1 4.35Å; V172-F309 HydrophobicContact CG2-CE1 4.03Å; T182-F309 HydrophobicContact CG2-CE2 3.8Å; T182-F309 HydrophobicContact CG2-CZ 4.14Å; A259-F309 HydrophobicContact CB-CE1 4.15Å; A259-F309 HydrophobicContact CB-CE2 4.39Å; A259-F309 HydrophobicContact CB-CZ 3.7Å; L261-F309 HydrophobicContact CB-CD2 4.19Å; L261-F309 HydrophobicContact CB-CE2 4.44Å; L261-F309 HydrophobicContact CD1-CD2 4.33Å; F309-Q311 HydrophobicContact CD1-CG 3.72Å; F309-Q311 HydrophobicContact CE1-CG 3.53Å; F309-Q311 HydrophobicContact CZ-CG 4.5Å
310	L	97.8	Very high	94.4	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	137	177	-55.8	-176.9	0	0	0	110.3	I81 V82 I83 L245 A248 V249 I252 A259 A260 V262 I308 V323	I81-L310 HydrophobicContact CG2-CB 4.39Å; V82-L310 WeakPolarHBondContact O-CA 3.41Å; I83-L310 HydrophobicContact CB-CD2 4.43Å; I83-L310 HydrophobicContact CG1-CD2 3.75Å; L245-L310 HydrophobicContact CD1-CD1 3.62Å; L245-L310 HydrophobicContact CD1-CD2 3.89Å; L245-L310 HydrophobicContact CD1-CG 4.29Å; A248-L310 HydrophobicContact CB-CD1 3.73Å; V249-L310 HydrophobicContact CG2-CD1 4.21Å; I252-L310 HydrophobicContact CD1-CB 3.83Å; I252-L310 HydrophobicContact CD1-CD1 4.37Å; A259-L310 CarbonylContact C-O 3.21Å; A259-L310 VanDerWaalsContact CA-O 3.26Å; A259-L310 WeakPolarHBondContact CA-O 3.41Å; A259-L310 WeakPolarHBondContact CB-O 3.26Å; A260-L310 HydrophobicContact CB-CB 4.41Å; A260-L310 PolarHBondContact N-O 3Å; A260-L310 WeakPolarHBondContact O-CB 3.2Å; A260-L310 PolarHBondContact O-N 2.91Å; V262-L310 HydrophobicContact CG2-CD1 3.68Å; V262-L310 HydrophobicContact CG2-CG 4.01Å; I308-L310 HydrophobicContact CD1-CD2 4.06Å; L310-V323 HydrophobicContact CD2-CG2 4.27Å
311	Q	95.2	Very high	94.3	Very high	10 Å²	10	18.9 Å²	18.9	5%	0.047	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	156.1	175.4	-67.3	-174.4	-92.4	0	0	111	I81 V82 S84 A259 F309 I315 A316	I81-Q311 WeakPolarHBondContact CA-O 3.02Å; V82-Q311 PolarHBondContact N-O 3.43Å; V82-Q311 PolarHBondContact O-N 2.79Å; S84-Q311 VanDerWaalsContact CB-OE1 3.31Å; S84-Q311 PolarHBondContact OG-OE1 3.4Å; A259-Q311 HydrophobicContact CB-CG 4.13Å; F309-Q311 HydrophobicContact CD1-CG 3.72Å; F309-Q311 HydrophobicContact CE1-CG 3.53Å; F309-Q311 HydrophobicContact CZ-CG 4.5Å; Q311-I315 HydrophobicContact CB-CD1 4.38Å; Q311-I315 HydrophobicContact CB-CG1 4.16Å; Q311-I315 PolarHBondContact NE2-O 3.33Å; Q311-A316 HydrophobicContact CB-CB 4.18Å
312	K	93.3	Very high	94.3	Very high	46 Å²	46	18.7 Å²	18.7	20%	0.2	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	140.5	158.5	-57.5	180	-174	176	0	108.8	E79 I252 D255 S314 I315	E79-K312 HydrophobicContact CB-CB 4.46Å; E79-K312 WeakPolarHBondContact OE2-CB 3.23Å; I252-K312 HydrophobicContact CG2-CD 4.38Å; I252-K312 HydrophobicContact CG2-CG 3.75Å; D255-K312 IonicContact OD1-NZ 3.04Å; D255-K312 PolarHBondContact OD1-NZ 2.63Å; K312-S314 PolarHBondContact O-N 3.07Å; K312-S314 VanDerWaalsContact O-N 3.14Å; K312-I315 HydrophobicContact CB-CG1 4.49Å; K312-I315 WeakPolarHBondContact O-CG1 3.26Å; K312-I315 PolarHBondContact O-N 2.61Å
313	V	90.6	Very high	94.4	Very high	47 Å²	47	18.7 Å²	18.7	29%	0.285	10%	0.097	S	C	.	.	G	3₁₀ helix	trans	-59.8	-29.4	-170.5	68.2	0	0	0	0	113.8	E79 D80 V82 I315 A316 P922	E79-V313 HydrophobicContact CB-CG1 4.42Å; D80-V313 HydrophobicContact CB-CB 4.35Å; D80-V313 HydrophobicContact CB-CG1 4.15Å; D80-V313 WeakPolarHBondContact O-CB 3.34Å; D80-V313 PolarHBondContact O-N 2.82Å; V82-V313 HydrophobicContact CG1-CB 4.13Å; V82-V313 HydrophobicContact CG1-CG2 4.1Å; V313-I315 VanDerWaalsContact C-N 3.26Å; V313-I315 PolarHBondContact O-N 2.9Å; V313-A316 PolarHBondContact O-N 2.79Å; V313-P922 HydrophobicContact CG2-CG 4.43Å
314	S	89.1	Confident	94.3	Very high	77 Å²	77	19.9 Å²	19.9	54%	0.538	10%	0.104	S	C	.	.	G	3₁₀ helix	trans	-59.8	-29.3	177.6	56.8	0	0	0	0	115.1	E79 K312	E79-S314 WeakPolarHBondContact OE1-CB 3.39Å; E79-S314 PolarHBondContact OE1-OG 2.64Å; E79-S314 WeakPolarHBondContact OE2-CB 3.19Å; E79-S314 PolarHBondContact OE2-N 3.41Å; E79-S314 PolarHBondContact OE2-OG 2.91Å; K312-S314 PolarHBondContact O-N 3.07Å; K312-S314 VanDerWaalsContact O-N 3.14Å
315	I	90.9	Very high	94.2	Very high	84 Å²	84	20.1 Å²	20.1	43%	0.431	11%	0.105	S	C	.	.	G	3₁₀ helix	trans	-106.9	2	-177.6	59.8	164.6	0	0	0	113.2	Q311 K312 V313	Q311-I315 HydrophobicContact CB-CD1 4.38Å; Q311-I315 HydrophobicContact CB-CG1 4.16Å; Q311-I315 PolarHBondContact NE2-O 3.33Å; K312-I315 HydrophobicContact CB-CG1 4.49Å; K312-I315 WeakPolarHBondContact O-CG1 3.26Å; K312-I315 PolarHBondContact O-N 2.61Å; V313-I315 VanDerWaalsContact C-N 3.26Å; V313-I315 PolarHBondContact O-N 2.9Å
316	A	91.4	Very high	94	Very high	4 Å²	4	20.2 Å²	20.2	3%	0.033	11%	0.105	C	C	.	.			trans	-86.6	119.6	-175.5	0	0	0	0	0	111.5	V82 Q311 V313 R318	V82-A316 HydrophobicContact CG2-CB 3.5Å; V82-A316 VanDerWaalsContact CG2-CB 3.5Å; Q311-A316 HydrophobicContact CB-CB 4.18Å; V313-A316 PolarHBondContact O-N 2.79Å; A316-R318 VanDerWaalsContact C-N 3.35Å
317	R	90.8	Very high	93.9	Very high	105 Å²	105	21.9 Å²	21.9	40%	0.396	11%	0.114	S	C	.	.	S	Bend	trans	-76.6	-25.9	174.2	-76.3	165.2	170.9	-101.2	-6.4	112.4	G171 L921 P922 V923	G171-R317 WeakPolarHBondContact O-CD 3.47Å; R317-L921 HydrophobicContact CB-CD2 4.28Å; R317-L921 HydrophobicContact CG-CD1 3.8Å; R317-L921 HydrophobicContact CG-CD2 4.33Å; R317-P922 WeakPolarHBondContact O-CA 3.41Å; R317-V923 PolarHBondContact O-N 3Å
318	R	91.1	Very high	93.7	Very high	5 Å²	5	23.3 Å²	23.3	2%	0.019	12%	0.124	C	C	.	.			trans	-135.2	152.5	177.5	176.1	172.6	-68.6	-166.8	-8.2	109.4	S84 D169 A316 Y320 I531 V923 P928	S84-R318 VanDerWaalsContact CA-O 3.27Å; S84-R318 WeakPolarHBondContact CA-O 3.25Å; S84-R318 WeakPolarHBondContact CB-O 3.42Å; S84-R318 WeakPolarHBondContact O-CB 3.27Å; S84-R318 WeakPolarHBondContact O-CD 3.41Å; S84-R318 VanDerWaalsContact O-CG 3.23Å; S84-R318 WeakPolarHBondContact O-CG 3.48Å; D169-R318 WeakPolarHBondContact O-CD 3.49Å; D169-R318 IonicContact OD1-NH1 2.77Å; D169-R318 PolarHBondContact OD1-NH1 2.93Å; A316-R318 VanDerWaalsContact C-N 3.35Å; R318-Y320 HydrophobicContact CG-CD2 4.41Å; R318-Y320 HydrophobicContact CG-CE2 4.19Å; R318-Y320 PolarHBondContact NH1-OH 3.47Å; R318-I531 HydrophobicContact CB-CD1 4.48Å; R318-V923 HydrophobicContact CB-CG2 3.99Å; R318-V923 HydrophobicContact CG-CG2 4.13Å; R318-P928 VanDerWaalsContact CZ-O 3.24Å; R318-P928 PolarHBondContact NH1-O 2.76Å; R318-P928 PolarHBondContact NH2-O 2.7Å
319	S	92.2	Very high	93.6	Very high	3 Å²	3	25 Å²	25	2%	0.021	13%	0.133	C	C	.	.			trans	-146.8	106.7	173.7	164.5	0	0	0	0	109	V82 F484	V82-S319 WeakPolarHBondContact CG1-OG 2.99Å; S319-F484 WeakPolarHBondContact O-CB 3.26Å; S319-F484 WeakPolarHBondContact O-CD1 3.45Å; S319-F484 WeakPolarHBondContact O-CG 3.3Å; S319-F484 WeakPolarHBondContact OG-CD2 3.39Å
320	Y	92.6	Very high	93.3	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.008	16%	0.158	C	C	.	.	S	Bend	trans	-75.3	-44.1	171.1	-63.8	-81.6	0	0	0	111.1	I83 S84 I86 D169 R318 L422 Q426 F484 L925 M929	I83-Y320 PolarHBondContact O-N 3.02Å; S84-Y320 WeakPolarHBondContact O-CE2 3.47Å; I86-Y320 HydrophobicContact CG2-CE2 3.97Å; D169-Y320 PolarHBondContact OD1-OH 3.41Å; D169-Y320 VanDerWaalsContact OD1-OH 3.08Å; D169-Y320 VanDerWaalsContact OD2-CE2 3.23Å; D169-Y320 WeakPolarHBondContact OD2-CE2 3.41Å; D169-Y320 PolarHBondContact OD2-OH 2.99Å; R318-Y320 HydrophobicContact CG-CD2 4.41Å; R318-Y320 HydrophobicContact CG-CE2 4.19Å; R318-Y320 PolarHBondContact NH1-OH 3.47Å; Y320-L422 HydrophobicContact CD2-CD1 4.12Å; Y320-L422 HydrophobicContact CG-CB 4.44Å; Y320-L422 HydrophobicContact CG-CD1 4.19Å; Y320-Q426 HydrophobicContact CD1-CB 4.5Å; Y320-F484 PolarHBondContact O-N 2.85Å; Y320-L925 HydrophobicContact CD1-CD1 4.4Å; Y320-M929 HydrophobicContact CE1-CE 4.14Å; Y320-M929 HydrophobicContact CE1-CG 4.45Å; Y320-M929 WeakPolarHBondContact OH-CG 3.39Å
321	A	94.2	Very high	93.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	143.8	-174.1	0	0	0	0	0	111.7	V82 I83 L422 M425 L481 R482	V82-A321 CarbonylContact C-O 3.57Å; V82-A321 VanDerWaalsContact CA-O 3.29Å; V82-A321 WeakPolarHBondContact CA-O 3.4Å; I83-A321 HydrophobicContact CD1-CB 4.44Å; I83-A321 PolarHBondContact N-O 2.92Å; A321-L422 HydrophobicContact CB-CD2 3.92Å; A321-M425 HydrophobicContact CB-CE 4.27Å; A321-M425 HydrophobicContact CB-SD 3.63Å; A321-L481 HydrophobicContact CB-CD1 4.31Å; A321-R482 CarbonylContact C-O 3.49Å; A321-R482 WeakPolarHBondContact CA-O 3.26Å
322	T	94.5	Very high	92.8	Very high	6 Å²	6	31.6 Å²	31.6	4%	0.037	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	133	160.5	-43.4	0	0	0	0	109.6	D80 I81 V324 L481 R482	D80-T322 HydrophobicContact CB-CG2 3.81Å; I81-T322 WeakPolarHBondContact O-CA 3.38Å; I81-T322 WeakPolarHBondContact O-CG2 3.38Å; T322-V324 PolarHBondContact O-N 3.45Å; T322-L481 WeakPolarHBondContact O-CA 3.26Å; T322-R482 PolarHBondContact N-O 2.92Å; T322-R482 PolarHBondContact O-N 3.16Å; T322-R482 PolarHBondContact OG1-NH2 3.3Å
323	V	95.4	Very high	92.6	Very high	1 Å²	1	39 Å²	39	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	95.1	165.5	-167.7	0	0	0	0	108.2	I81 I83 V249 L310 V479 L481	I81-V323 PolarHBondContact O-N 3.1Å; I83-V323 HydrophobicContact CD1-CG2 4.04Å; I83-V323 HydrophobicContact CG1-CG2 3.63Å; V249-V323 HydrophobicContact CG2-CB 4.36Å; V249-V323 HydrophobicContact CG2-CG1 3.83Å; L310-V323 HydrophobicContact CD2-CG2 4.27Å; V323-V479 HydrophobicContact CG1-CG1 3.94Å; V323-L481 HydrophobicContact CB-CD2 4.24Å; V323-L481 HydrophobicContact CG1-CD2 4.23Å; V323-L481 HydrophobicContact CG2-CD2 3.93Å
324	V	93.7	Very high	92.4	Very high	24 Å²	24	37.9 Å²	37.9	15%	0.145	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	-51.6	-174.4	-176.5	0	0	0	0	109.8	R253 T322 A357 V359 V480 R482	R253-V324 PolarHBondContact NH2-O 2.87Å; T322-V324 PolarHBondContact O-N 3.45Å; V324-A357 HydrophobicContact CG1-CB 4.25Å; V324-V359 HydrophobicContact CG1-CG2 4.26Å; V324-V480 HydrophobicContact CB-CB 4.29Å; V324-V480 HydrophobicContact CB-CG1 4.12Å; V324-V480 WeakPolarHBondContact CB-O 3.44Å; V324-V480 HydrophobicContact CG2-CG1 4.46Å; V324-V480 PolarHBondContact N-O 2.98Å; V324-R482 HydrophobicContact CG2-CB 3.66Å
325	H	93.2	Very high	92.2	Very high	6 Å²	6	42.1 Å²	42.1	3%	0.028	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	159.8	176.2	-166.8	59.1	0	0	0	110.6	W75 R253 V353 E356 A357 V480	W75-H325 AromaticContact CE2-CE1 3.4Å; W75-H325 VanDerWaalsContact CE2-CE1 3.4Å; W75-H325 AromaticContact CE2-NE2 3.92Å; W75-H325 AromaticContact CH2-NE2 2.99Å; W75-H325 WeakPolarHBondContact CH2-NE2 3.49Å; W75-H325 AromaticContact CZ2-CE1 3.25Å; W75-H325 WeakPolarHBondContact CZ2-CE1 3.21Å; W75-H325 AromaticContact CZ2-ND1 3.57Å; W75-H325 AromaticContact CZ2-NE2 3.02Å; W75-H325 WeakPolarHBondContact CZ2-NE2 3.44Å; W75-H325 AromaticContact CZ3-NE2 3.9Å; W75-H325 AromaticContact NE1-CE1 3.5Å; W75-H325 PolarHBondContact NE1-CE1 3.26Å; R253-H325 PolarHBondContact NH1-CE1 3.25Å; R253-H325 PolarHBondContact NH1-ND1 2.89Å; R253-H325 VanDerWaalsContact NH1-ND1 3.2Å; R253-H325 PolarHBondContact NH2-CE1 2.81Å; H325-V353 VanDerWaalsContact CD2-CG2 3.46Å; H325-V353 WeakPolarHBondContact CD2-CG2 3.41Å; H325-V353 PolarHBondContact CD2-O 3.21Å; H325-E356 IonicContact NE2-OE1 2.67Å; H325-E356 PolarHBondContact NE2-OE1 2.93Å; H325-A357 HydrophobicContact CB-CB 3.71Å; H325-V480 PolarHBondContact N-O 3.26Å; H325-V480 PolarHBondContact O-N 3.08Å
326	A	94.6	Very high	92.1	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.008	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	139.7	179.9	0	0	0	0	0	108	Q246 H478 V479	Q246-A326 HydrophobicContact CB-CB 4.03Å; Q246-A326 HydrophobicContact CG-CB 3.88Å; A326-H478 WeakPolarHBondContact CA-O 3.37Å; A326-V479 HydrophobicContact CB-CG1 4.5Å; A326-V479 HydrophobicContact CB-CG2 3.89Å
327	M	95.2	Very high	91.9	Very high	35 Å²	35	44.9 Å²	44.9	17%	0.172	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	154.4	179.1	-175.9	176.5	-79.4	0	0	110.4	L349 S352 V353 E356 H478	M327-L349 HydrophobicContact CB-CD1 3.97Å; M327-L349 HydrophobicContact CG-CD1 3.7Å; M327-L349 HydrophobicContact SD-CD1 4.17Å; M327-S352 VanDerWaalsContact SD-CB 3.57Å; M327-V353 HydrophobicContact CB-CB 3.97Å; M327-V353 HydrophobicContact CB-CG2 3.71Å; M327-E356 HydrophobicContact CE-CB 4.44Å; M327-E356 HydrophobicContact CE-CG 4.44Å; M327-E356 WeakPolarHBondContact CE-OE1 3.29Å; M327-E356 WeakPolarHBondContact CE-OE2 3.11Å; M327-H478 PolarHBondContact N-O 3.08Å; M327-H478 PolarHBondContact O-N 3.11Å
328	S	95.3	Very high	91.7	Very high	31 Å²	31	44.5 Å²	44.5	22%	0.217	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	153	173.9	-52.4	0	0	0	0	111.9	L243 Q246 N476 T477	L243-S328 WeakPolarHBondContact CD1-OG 3.34Å; Q246-S328 VanDerWaalsContact OE1-CB 3.3Å; Q246-S328 PolarHBondContact OE1-OG 3.26Å; S328-N476 CarbonylContact C-O 3.48Å; S328-N476 WeakPolarHBondContact CA-O 3.3Å; S328-N476 VanDerWaalsContact CB-O 3.23Å; S328-N476 WeakPolarHBondContact CB-O 3.38Å; S328-T477 WeakPolarHBondContact OG-CB 3.36Å; S328-T477 VanDerWaalsContact OG-CG2 3.29Å; S328-T477 WeakPolarHBondContact OG-CG2 3.41Å; S328-T477 PolarHBondContact OG-OG1 2.96Å
329	N	95.8	Very high	91.6	Very high	34 Å²	34	47.1 Å²	47.1	18%	0.182	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	-170.9	166.3	80.3	-6.6	0	0	0	111.3	Q345 L349 N476	N329-Q345 PolarHBondContact ND2-O 2.58Å; N329-L349 HydrophobicContact CB-CD1 4.34Å; N329-N476 PolarHBondContact N-O 3.26Å; N329-N476 PolarHBondContact O-N 2.96Å; N329-N476 WeakPolarHBondContact OD1-CB 3.16Å; N329-N476 PolarHBondContact OD1-ND2 3.45Å; N329-N476 VanDerWaalsContact OD1-ND2 3.15Å
330	T	93.1	Very high	91.5	Very high	90 Å²	90	49.8 Å²	49.8	55%	0.552	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.4	139.7	177.9	-51.1	0	0	0	0	110	G332 G474	T330-G332 PolarHBondContact O-N 3.1Å; T330-G332 VanDerWaalsContact O-N 3.14Å; T330-G474 CarbonylContact C-O 3.46Å; T330-G474 WeakPolarHBondContact CA-O 3.4Å; T330-G474 WeakPolarHBondContact CG2-O 3.44Å
331	D	92.1	Very high	91.5	Very high	8 Å²	8	50.9 Å²	50.9	4%	0.043	28%	0.279	C	S	.	.			trans	-57.1	-27	-179.2	-72.9	-12.8	0	0	0	114	K334 S342 G474 N476	D331-K334 HydrophobicContact CB-CD 3.74Å; D331-K334 HydrophobicContact CB-CG 4.38Å; D331-K334 IonicContact OD2-NZ 2.92Å; D331-K334 PolarHBondContact OD2-NZ 3.17Å; D331-S342 WeakPolarHBondContact OD1-CB 3.46Å; D331-S342 PolarHBondContact OD2-N 3.46Å; D331-G474 PolarHBondContact N-O 3Å; D331-G474 WeakPolarHBondContact OD2-CA 3.32Å; D331-N476 PolarHBondContact OD1-ND2 3.24Å
332	G	89	Confident	91.4	Very high	54 Å²	54	51.9 Å²	51.9	56%	0.557	29%	0.286	S	S	*	.			trans	73.1	-147.8	-173.4	0	0	0	0	0	113	T330	T330-G332 PolarHBondContact O-N 3.1Å; T330-G332 VanDerWaalsContact O-N 3.14Å
333	Y	89.3	Confident	91.3	Very high	202 Å²	202	52 Å²	52	79%	0.792	29%	0.288	S	S	*	.			trans	-79.5	133.8	177.9	176.3	-94.4	0	0	0	111.2	E335	Y333-E335 HydrophobicContact CE1-CG 4.08Å
334	K	87.1	Confident	91.1	Very high	23 Å²	23	59 Å²	59	10%	0.1	32%	0.32	C	S	.	.			trans	-132.8	126.3	-178.3	-66	169.3	-78.6	-172.4	0	109.3	D331 Q336 G337 V338 F340	D331-K334 HydrophobicContact CB-CD 3.74Å; D331-K334 HydrophobicContact CB-CG 4.38Å; D331-K334 IonicContact OD2-NZ 2.92Å; D331-K334 PolarHBondContact OD2-NZ 3.17Å; K334-Q336 PolarHBondContact O-N 3.39Å; K334-G337 PolarHBondContact O-N 3.38Å; K334-G337 VanDerWaalsContact O-N 3.12Å; K334-V338 PolarHBondContact NZ-O 3.13Å; K334-F340 WeakPolarHBondContact CD-O 3.3Å; K334-F340 VanDerWaalsContact CE-O 3.3Å; K334-F340 WeakPolarHBondContact CE-O 3.18Å; K334-F340 PolarHBondContact NZ-O 3.38Å
335	E	85.3	Confident	91.2	Very high	167 Å²	167	60.8 Å²	60.8	78%	0.78	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-26.6	179.3	-63.2	-171.1	153.9	0	0	112.5	Y333 G337	Y333-E335 HydrophobicContact CE1-CG 4.08Å; E335-G337 VanDerWaalsContact C-N 3.27Å; E335-G337 PolarHBondContact O-N 3.16Å
336	Q	88.2	Confident	91.3	Very high	114 Å²	114	60.6 Å²	60.6	53%	0.533	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-6.1	-179.9	-54.1	79	4.4	0	0	113.3	K334 F340	K334-Q336 PolarHBondContact O-N 3.39Å; Q336-F340 HydrophobicContact CB-CB 3.66Å; Q336-F340 HydrophobicContact CB-CD1 4.02Å; Q336-F340 HydrophobicContact CB-CD2 3.43Å; Q336-F340 VanDerWaalsContact CB-CD2 3.43Å; Q336-F340 HydrophobicContact CB-CE2 4.04Å; Q336-F340 HydrophobicContact CB-CG 3.43Å; Q336-F340 VanDerWaalsContact CB-CG 3.43Å; Q336-F340 HydrophobicContact CG-CD1 4.19Å; Q336-F340 HydrophobicContact CG-CD2 3.83Å; Q336-F340 HydrophobicContact CG-CE1 4.28Å; Q336-F340 HydrophobicContact CG-CE2 3.89Å; Q336-F340 HydrophobicContact CG-CG 3.99Å; Q336-F340 HydrophobicContact CG-CZ 4.13Å
337	G	87	Confident	91.3	Very high	31 Å²	31	60.6 Å²	60.6	32%	0.32	33%	0.326	S	S	.	.			trans	100.2	173.3	179.6	0	0	0	0	0	114.9	K334 E335 T339 F340	K334-G337 PolarHBondContact O-N 3.38Å; K334-G337 VanDerWaalsContact O-N 3.12Å; E335-G337 VanDerWaalsContact C-N 3.27Å; E335-G337 PolarHBondContact O-N 3.16Å; G337-T339 PolarHBondContact O-N 3.39Å; G337-F340 PolarHBondContact O-N 2.93Å
338	V	87.9	Confident	91.3	Very high	97 Å²	97	63.3 Å²	63.3	59%	0.588	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-34.5	-169.3	66.5	0	0	0	0	113.9	K334	K334-V338 PolarHBondContact NZ-O 3.13Å
339	T	88	Confident	91.4	Very high	60 Å²	60	62 Å²	62	37%	0.368	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-10.7	-177.2	45.6	0	0	0	0	114.8	G337 F472	G337-T339 PolarHBondContact O-N 3.39Å; T339-F472 WeakPolarHBondContact CA-O 3.33Å; T339-F472 HydrophobicContact CG2-CD2 4.22Å
340	F	90.3	Very high	91.4	Very high	59 Å²	59	60.6 Å²	60.6	26%	0.259	32%	0.321	S	S	.	.	S	Bend	trans	-75.2	128.1	176.9	-169.3	-83.1	0	0	0	109.4	K334 Q336 G337 V376	K334-F340 WeakPolarHBondContact CD-O 3.3Å; K334-F340 VanDerWaalsContact CE-O 3.3Å; K334-F340 WeakPolarHBondContact CE-O 3.18Å; K334-F340 PolarHBondContact NZ-O 3.38Å; Q336-F340 HydrophobicContact CB-CB 3.66Å; Q336-F340 HydrophobicContact CB-CD1 4.02Å; Q336-F340 HydrophobicContact CB-CD2 3.43Å; Q336-F340 VanDerWaalsContact CB-CD2 3.43Å; Q336-F340 HydrophobicContact CB-CE2 4.04Å; Q336-F340 HydrophobicContact CB-CG 3.43Å; Q336-F340 VanDerWaalsContact CB-CG 3.43Å; Q336-F340 HydrophobicContact CG-CD1 4.19Å; Q336-F340 HydrophobicContact CG-CD2 3.83Å; Q336-F340 HydrophobicContact CG-CE1 4.28Å; Q336-F340 HydrophobicContact CG-CE2 3.89Å; Q336-F340 HydrophobicContact CG-CG 3.99Å; Q336-F340 HydrophobicContact CG-CZ 4.13Å; G337-F340 PolarHBondContact O-N 2.93Å; F340-V376 HydrophobicContact CD2-CG1 3.87Å; F340-V376 HydrophobicContact CE2-CG1 3.45Å; F340-V376 VanDerWaalsContact CE2-CG1 3.45Å; F340-V376 HydrophobicContact CZ-CG1 3.8Å
341	P	91.7	Very high	91.4	Very high	26 Å²	26	60.1 Å²	60.1	17%	0.169	31%	0.312	C	S	.	.			trans	-79.6	146.5	177.7	27.6	-27.1	0	0	0	111.7	V376 E380	P341-V376 HydrophobicContact CG-CG1 4.47Å; P341-E380 HydrophobicContact CG-CB 4.27Å; P341-E380 HydrophobicContact CG-CG 4.33Å
342	S	93.3	Very high	91.5	Very high	21 Å²	21	61.5 Å²	61.5	15%	0.147	32%	0.322	C	S	.	.			trans	-101.4	101.1	175.5	-174.3	0	0	0	0	112.1	D331 Q344 Q345 Q346	D331-S342 WeakPolarHBondContact OD1-CB 3.46Å; D331-S342 PolarHBondContact OD2-N 3.46Å; S342-Q344 PolarHBondContact O-N 3.04Å; S342-Q345 PolarHBondContact O-N 3.14Å; S342-Q345 VanDerWaalsContact O-N 3.08Å; S342-Q345 PolarHBondContact OG-N 3.37Å; S342-Q346 WeakPolarHBondContact O-CG 3.42Å; S342-Q346 PolarHBondContact O-N 3.26Å
343	G	91.2	Very high	91.7	Very high	7 Å²	7	58.9 Å²	58.9	7%	0.072	30%	0.295	C	S	.	.	H	α-helix	trans	-57.5	-33.2	174.4	0	0	0	0	0	112.6	Q346 A347 E380 A384	G343-Q346 PolarHBondContact O-N 3.05Å; G343-A347 WeakPolarHBondContact O-CB 3.25Å; G343-A347 PolarHBondContact O-N 3.32Å; G343-E380 WeakPolarHBondContact CA-OE2 3.41Å; G343-E380 PolarHBondContact N-OE2 3.41Å; G343-A384 WeakPolarHBondContact O-CB 3.38Å
344	Q	93.1	Very high	92	Very high	149 Å²	149	49.3 Å²	49.3	70%	0.696	26%	0.258	S	S	*	.	H	α-helix	trans	-62.4	-44.6	174.2	-172.4	-176.9	10.8	0	0	112.4	S342 A347 Q348	S342-Q344 PolarHBondContact O-N 3.04Å; Q344-A347 PolarHBondContact O-N 2.95Å; Q344-Q348 WeakPolarHBondContact O-CB 3.27Å; Q344-Q348 PolarHBondContact O-N 3.31Å
345	Q	94.9	Very high	92.1	Very high	61 Å²	61	56.8 Å²	56.8	29%	0.285	29%	0.29	S	S	.	.	H	α-helix	trans	-75.5	-29.9	179.3	-64	-63.6	-11.3	0	0	112	N329 S342 Q348 L349	N329-Q345 PolarHBondContact ND2-O 2.58Å; S342-Q345 PolarHBondContact O-N 3.14Å; S342-Q345 VanDerWaalsContact O-N 3.08Å; S342-Q345 PolarHBondContact OG-N 3.37Å; Q345-Q348 PolarHBondContact O-N 3.16Å; Q345-L349 PolarHBondContact O-N 3.29Å
346	Q	95	Very high	92.3	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.009	27%	0.27	C	S	.	.	H	α-helix	trans	-65.1	-46.2	169.6	-68	169	6.7	0	0	111	S342 G343 Q348 L349 L350 A384 F470	S342-Q346 WeakPolarHBondContact O-CG 3.42Å; S342-Q346 PolarHBondContact O-N 3.26Å; G343-Q346 PolarHBondContact O-N 3.05Å; Q346-Q348 VanDerWaalsContact C-N 3.29Å; Q346-Q348 PolarHBondContact O-N 2.9Å; Q346-L349 WeakPolarHBondContact O-CB 3.31Å; Q346-L349 PolarHBondContact O-N 2.91Å; Q346-L350 VanDerWaalsContact O-CG 3.26Å; Q346-L350 WeakPolarHBondContact O-CG 3.37Å; Q346-L350 PolarHBondContact O-N 2.94Å; Q346-A384 HydrophobicContact CB-CB 4.15Å; Q346-F470 HydrophobicContact CB-CZ 4.35Å; Q346-F470 HydrophobicContact CG-CD2 4.3Å; Q346-F470 HydrophobicContact CG-CE1 4.29Å; Q346-F470 HydrophobicContact CG-CE2 3.93Å; Q346-F470 HydrophobicContact CG-CZ 3.92Å; Q346-F470 VanDerWaalsContact NE2-CD2 3.28Å
347	A	94.8	Very high	92.3	Very high	1 Å²	1	48 Å²	48	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-60.8	-36.9	173.5	0	0	0	0	0	112.2	G343 Q344 K351 A384 V388	G343-A347 WeakPolarHBondContact O-CB 3.25Å; G343-A347 PolarHBondContact O-N 3.32Å; Q344-A347 PolarHBondContact O-N 2.95Å; A347-K351 VanDerWaalsContact O-CG 3.25Å; A347-K351 WeakPolarHBondContact O-CG 3.21Å; A347-K351 PolarHBondContact O-N 2.93Å; A347-A384 HydrophobicContact CB-CB 3.96Å; A347-V388 HydrophobicContact CB-CG2 4.26Å
348	Q	95	Very high	92.3	Very high	93 Å²	93	49.3 Å²	49.3	44%	0.435	27%	0.266	S	S	.	.	H	α-helix	trans	-68.3	-40.3	175.1	-175.3	57.7	31.6	0	0	112.5	Q344 Q345 Q346 K351 S352	Q344-Q348 WeakPolarHBondContact O-CB 3.27Å; Q344-Q348 PolarHBondContact O-N 3.31Å; Q345-Q348 PolarHBondContact O-N 3.16Å; Q346-Q348 VanDerWaalsContact C-N 3.29Å; Q346-Q348 PolarHBondContact O-N 2.9Å; Q348-K351 PolarHBondContact O-N 2.97Å; Q348-S352 PolarHBondContact O-N 2.87Å; Q348-S352 PolarHBondContact O-OG 2.62Å
349	L	96.6	Very high	92.4	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-59.5	-48	173.2	177.4	57.5	0	0	0	111.1	M327 N329 Q345 Q346 S352 V353 N476 H478	M327-L349 HydrophobicContact CB-CD1 3.97Å; M327-L349 HydrophobicContact CG-CD1 3.7Å; M327-L349 HydrophobicContact SD-CD1 4.17Å; N329-L349 HydrophobicContact CB-CD1 4.34Å; Q345-L349 PolarHBondContact O-N 3.29Å; Q346-L349 WeakPolarHBondContact O-CB 3.31Å; Q346-L349 PolarHBondContact O-N 2.91Å; L349-S352 PolarHBondContact O-N 3.07Å; L349-V353 WeakPolarHBondContact O-CG1 3.33Å; L349-V353 PolarHBondContact O-N 2.82Å; L349-N476 HydrophobicContact CD2-CB 3.76Å; L349-H478 HydrophobicContact CD2-CB 4.1Å; L349-H478 HydrophobicContact CG-CB 4.21Å
350	L	95.9	Very high	92.6	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-60.4	-46.6	178	-67.2	168	0	0	0	111.4	Q346 S352 V353 Y354 L385 V388 Y389 H478	Q346-L350 VanDerWaalsContact O-CG 3.26Å; Q346-L350 WeakPolarHBondContact O-CG 3.37Å; Q346-L350 PolarHBondContact O-N 2.94Å; L350-S352 VanDerWaalsContact C-N 3.31Å; L350-S352 PolarHBondContact O-N 3.02Å; L350-V353 WeakPolarHBondContact O-CG1 3.19Å; L350-Y354 HydrophobicContact CD2-CE2 4.36Å; L350-Y354 VanDerWaalsContact O-CD2 3.3Å; L350-Y354 WeakPolarHBondContact O-CD2 3.4Å; L350-Y354 PolarHBondContact O-N 2.76Å; L350-L385 HydrophobicContact CD1-CD2 4.05Å; L350-V388 HydrophobicContact CB-CB 4.32Å; L350-V388 HydrophobicContact CB-CG1 4.07Å; L350-V388 HydrophobicContact CB-CG2 4.04Å; L350-Y389 HydrophobicContact CD1-CE2 4.08Å; L350-Y389 HydrophobicContact CD2-CE2 3.98Å; L350-H478 VanDerWaalsContact CD2-ND1 3.35Å; L350-H478 WeakPolarHBondContact CD2-ND1 3.45Å
351	K	94.4	Very high	92.7	Very high	81 Å²	81	45.2 Å²	45.2	35%	0.352	24%	0.244	S	C	.	.	H	α-helix	trans	-60	-40	175.5	-71.6	165.7	-169	171.2	0	112.6	A347 Q348 K355 E387 V388	A347-K351 VanDerWaalsContact O-CG 3.25Å; A347-K351 WeakPolarHBondContact O-CG 3.21Å; A347-K351 PolarHBondContact O-N 2.93Å; Q348-K351 PolarHBondContact O-N 2.97Å; K351-K355 WeakPolarHBondContact O-CB 3.3Å; K351-K355 PolarHBondContact O-N 2.87Å; K351-E387 IonicContact NZ-OE1 2.64Å; K351-E387 PolarHBondContact NZ-OE1 2.71Å; K351-V388 HydrophobicContact CG-CG1 4.38Å; K351-V388 HydrophobicContact CG-CG2 3.9Å
352	S	93.6	Very high	92.7	Very high	36 Å²	36	45.1 Å²	45.1	25%	0.252	24%	0.242	S	C	.	.	H	α-helix	trans	-68.1	-53.7	178.3	-67.6	0	0	0	0	112.2	M327 Q348 L349 L350 Y354 K355 E356	M327-S352 VanDerWaalsContact SD-CB 3.57Å; Q348-S352 PolarHBondContact O-N 2.87Å; Q348-S352 PolarHBondContact O-OG 2.62Å; L349-S352 PolarHBondContact O-N 3.07Å; L350-S352 VanDerWaalsContact C-N 3.31Å; L350-S352 PolarHBondContact O-N 3.02Å; S352-Y354 VanDerWaalsContact C-N 3.34Å; S352-Y354 PolarHBondContact O-N 3.09Å; S352-K355 PolarHBondContact O-N 3.46Å; S352-E356 VanDerWaalsContact O-CB 3.27Å; S352-E356 WeakPolarHBondContact O-CB 3.38Å; S352-E356 PolarHBondContact O-N 2.85Å
353	V	94	Very high	92.6	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.8	-37	-173.6	74	0	0	0	0	112.4	H325 M327 L349 L350 A357 H478 V480	H325-V353 VanDerWaalsContact CD2-CG2 3.46Å; H325-V353 WeakPolarHBondContact CD2-CG2 3.41Å; H325-V353 PolarHBondContact CD2-O 3.21Å; M327-V353 HydrophobicContact CB-CB 3.97Å; M327-V353 HydrophobicContact CB-CG2 3.71Å; L349-V353 WeakPolarHBondContact O-CG1 3.33Å; L349-V353 PolarHBondContact O-N 2.82Å; L350-V353 WeakPolarHBondContact O-CG1 3.19Å; V353-A357 WeakPolarHBondContact O-CB 3.27Å; V353-A357 PolarHBondContact O-N 3.39Å; V353-H478 HydrophobicContact CG1-CB 4.31Å; V353-H478 VanDerWaalsContact CG1-CD2 3.49Å; V353-H478 WeakPolarHBondContact CG1-CD2 3.34Å; V353-V480 HydrophobicContact CG1-CG2 4.46Å; V353-V480 HydrophobicContact CG2-CG2 4.21Å
354	Y	94	Very high	92.8	Very high	1 Å²	1	47.2 Å²	47.2	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-76.3	-38.7	177.1	-79.4	-76.7	0	0	0	113.4	L350 S352 E356 A357 G358 V359 P361 V364 Y389 H478 V480	L350-Y354 HydrophobicContact CD2-CE2 4.36Å; L350-Y354 VanDerWaalsContact O-CD2 3.3Å; L350-Y354 WeakPolarHBondContact O-CD2 3.4Å; L350-Y354 PolarHBondContact O-N 2.76Å; S352-Y354 VanDerWaalsContact C-N 3.34Å; S352-Y354 PolarHBondContact O-N 3.09Å; Y354-E356 VanDerWaalsContact C-N 3.3Å; Y354-E356 PolarHBondContact O-N 3.39Å; Y354-A357 PolarHBondContact O-N 3.01Å; Y354-G358 PolarHBondContact O-N 2.87Å; Y354-G358 VanDerWaalsContact O-N 3.07Å; Y354-V359 HydrophobicContact CD1-CB 4.04Å; Y354-V359 HydrophobicContact CD1-CG1 3.89Å; Y354-V359 HydrophobicContact CE1-CG1 4.16Å; Y354-V359 PolarHBondContact O-N 3.35Å; Y354-V359 VanDerWaalsContact O-N 3.09Å; Y354-P361 HydrophobicContact CD1-CG 4.49Å; Y354-P361 HydrophobicContact CD2-CG 4.37Å; Y354-P361 HydrophobicContact CG-CB 4.43Å; Y354-P361 HydrophobicContact CG-CG 3.94Å; Y354-V364 HydrophobicContact CD1-CG2 4.33Å; Y354-V364 HydrophobicContact CE1-CG2 3.42Å; Y354-V364 VanDerWaalsContact CE1-CG2 3.42Å; Y354-Y389 AromaticContact CE2-CE1 3.82Å; Y354-Y389 HydrophobicContact CE2-CE1 3.82Å; Y354-Y389 AromaticContact CE2-CZ 3.62Å; Y354-Y389 WeakPolarHBondContact CE2-OH 3.46Å; Y354-Y389 AromaticContact CZ-CE1 3.75Å; Y354-Y389 AromaticContact CZ-CZ 3.93Å; Y354-Y389 PolarHBondContact OH-OH 3.47Å; Y354-H478 AromaticContact CE2-NE2 3.5Å; Y354-H478 WeakPolarHBondContact CE2-NE2 3.2Å; Y354-H478 AromaticContact CZ-NE2 3.65Å; Y354-H478 PolarHBondContact OH-NE2 3.01Å; Y354-V480 HydrophobicContact CD1-CG2 4.22Å; Y354-V480 HydrophobicContact CE1-CB 4.42Å; Y354-V480 HydrophobicContact CE1-CG1 3.81Å; Y354-V480 HydrophobicContact CE1-CG2 3.66Å; Y354-V480 HydrophobicContact CE2-CG2 4.14Å
355	K	90.4	Very high	92.8	Very high	180 Å²	180	42.3 Å²	42.3	78%	0.783	23%	0.233	S	C	*	.	H	α-helix	trans	-59.2	-44.4	172.3	-179.2	-174.4	176.3	-171.7	0	110.9	K351 S352 G358	K351-K355 WeakPolarHBondContact O-CB 3.3Å; K351-K355 PolarHBondContact O-N 2.87Å; S352-K355 PolarHBondContact O-N 3.46Å; K355-G358 PolarHBondContact O-N 3.2Å
356	E	88.5	Confident	92.8	Very high	74 Å²	74	39.4 Å²	39.4	35%	0.346	22%	0.219	S	C	.	.	H	α-helix	trans	-76.2	-31.1	-177	-165.7	162.5	122.2	0	0	112.7	P73 W75 H325 M327 S352 Y354 G358	P73-E356 WeakPolarHBondContact CG-O 3.38Å; W75-E356 HydrophobicContact CH2-CG 3.53Å; W75-E356 WeakPolarHBondContact CH2-OE1 3.28Å; W75-E356 HydrophobicContact CZ2-CG 3.78Å; H325-E356 IonicContact NE2-OE1 2.67Å; H325-E356 PolarHBondContact NE2-OE1 2.93Å; M327-E356 HydrophobicContact CE-CB 4.44Å; M327-E356 HydrophobicContact CE-CG 4.44Å; M327-E356 WeakPolarHBondContact CE-OE1 3.29Å; M327-E356 WeakPolarHBondContact CE-OE2 3.11Å; S352-E356 VanDerWaalsContact O-CB 3.27Å; S352-E356 WeakPolarHBondContact O-CB 3.38Å; S352-E356 PolarHBondContact O-N 2.85Å; Y354-E356 VanDerWaalsContact C-N 3.3Å; Y354-E356 PolarHBondContact O-N 3.39Å; E356-G358 VanDerWaalsContact C-N 3.27Å; E356-G358 PolarHBondContact O-N 2.9Å
357	A	88.8	Confident	93	Very high	22 Å²	22	39.3 Å²	39.3	18%	0.182	22%	0.219	C	C	.	.	H	α-helix	trans	-68.5	-21.4	167.7	0	0	0	0	0	113.9	V324 H325 V353 Y354 V359	V324-A357 HydrophobicContact CG1-CB 4.25Å; H325-A357 HydrophobicContact CB-CB 3.71Å; V353-A357 WeakPolarHBondContact O-CB 3.27Å; V353-A357 PolarHBondContact O-N 3.39Å; Y354-A357 PolarHBondContact O-N 3.01Å; A357-V359 HydrophobicContact CB-CB 4.38Å; A357-V359 HydrophobicContact CB-CG2 4.16Å
358	G	87	Confident	93.1	Very high	58 Å²	58	39.3 Å²	39.3	60%	0.598	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.3	33.6	-171.7	0	0	0	0	0	113.5	Y354 K355 E356	Y354-G358 PolarHBondContact O-N 2.87Å; Y354-G358 VanDerWaalsContact O-N 3.07Å; K355-G358 PolarHBondContact O-N 3.2Å; E356-G358 VanDerWaalsContact C-N 3.27Å; E356-G358 PolarHBondContact O-N 2.9Å
359	V	90.1	Very high	93.2	Very high	24 Å²	24	34.9 Å²	34.9	15%	0.145	20%	0.197	C	C	.	.			trans	-120	130.3	-177.7	171.8	0	0	0	0	109.5	V324 Y354 A357 P361 I464	V324-V359 HydrophobicContact CG1-CG2 4.26Å; Y354-V359 HydrophobicContact CD1-CB 4.04Å; Y354-V359 HydrophobicContact CD1-CG1 3.89Å; Y354-V359 HydrophobicContact CE1-CG1 4.16Å; Y354-V359 PolarHBondContact O-N 3.35Å; Y354-V359 VanDerWaalsContact O-N 3.09Å; A357-V359 HydrophobicContact CB-CB 4.38Å; A357-V359 HydrophobicContact CB-CG2 4.16Å; V359-P361 WeakPolarHBondContact O-CD 3.41Å; V359-I464 HydrophobicContact CG1-CD1 3.66Å; V359-I464 HydrophobicContact CG1-CG2 4.44Å; V359-I464 HydrophobicContact CG2-CD1 4.34Å
360	D	91.8	Very high	93.2	Very high	83 Å²	83	35.8 Å²	35.8	44%	0.444	20%	0.202	S	C	.	.			trans	-69.1	119.5	171.4	170.5	16.6	0	0	0	110.3	N362 T363	D360-N362 PolarHBondContact O-N 3.44Å; D360-N362 VanDerWaalsContact O-N 3.13Å; D360-N362 WeakPolarHBondContact OD1-CB 3.19Å; D360-N362 PolarHBondContact OD1-N 3.12Å; D360-N362 PolarHBondContact OD1-ND2 2.81Å; D360-T363 HydrophobicContact CB-CG2 4.04Å; D360-T363 WeakPolarHBondContact O-CB 3.4Å; D360-T363 PolarHBondContact O-N 3.36Å; D360-T363 PolarHBondContact O-OG1 3.27Å
361	P	92.4	Very high	93	Very high	24 Å²	24	35.6 Å²	35.6	16%	0.156	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-52.6	-33.4	177	-25.7	33.2	0	0	0	114	Y354 V359 T363 V364 V388 Y389	Y354-P361 HydrophobicContact CD1-CG 4.49Å; Y354-P361 HydrophobicContact CD2-CG 4.37Å; Y354-P361 HydrophobicContact CG-CB 4.43Å; Y354-P361 HydrophobicContact CG-CG 3.94Å; V359-P361 WeakPolarHBondContact O-CD 3.41Å; P361-T363 PolarHBondContact O-N 3.46Å; P361-T363 VanDerWaalsContact O-N 3.08Å; P361-V364 WeakPolarHBondContact O-CB 3.39Å; P361-V364 WeakPolarHBondContact O-CG2 3.37Å; P361-V364 PolarHBondContact O-N 2.58Å; P361-V364 VanDerWaalsContact O-N 3.12Å; P361-V388 HydrophobicContact CB-CG1 3.95Å; P361-V388 HydrophobicContact CG-CG1 3.91Å; P361-Y389 HydrophobicContact CB-CD1 4.09Å; P361-Y389 HydrophobicContact CB-CG 4.5Å; P361-Y389 VanDerWaalsContact O-CD1 3.32Å; P361-Y389 WeakPolarHBondContact O-CD1 3.32Å
362	N	92.3	Very high	92.9	Very high	24 Å²	24	32 Å²	32	13%	0.128	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-64.3	-17.3	-177.8	-61.1	-90.5	0	0	0	112.6	D360 Y389 T391 N392 R393	D360-N362 PolarHBondContact O-N 3.44Å; D360-N362 VanDerWaalsContact O-N 3.13Å; D360-N362 WeakPolarHBondContact OD1-CB 3.19Å; D360-N362 PolarHBondContact OD1-N 3.12Å; D360-N362 PolarHBondContact OD1-ND2 2.81Å; N362-Y389 PolarHBondContact OD1-O 3.26Å; N362-T391 PolarHBondContact OD1-N 3.48Å; N362-T391 PolarHBondContact OD1-OG1 2.94Å; N362-N392 PolarHBondContact OD1-N 3.46Å; N362-R393 PolarHBondContact O-NH1 3.42Å; N362-R393 VanDerWaalsContact O-NH1 3.15Å; N362-R393 PolarHBondContact OD1-N 3.46Å
363	T	91	Very high	92.8	Very high	72 Å²	72	30.3 Å²	30.3	44%	0.442	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-84.3	-11.4	178	67.1	0	0	0	0	114.7	D360 P361 V365	D360-T363 HydrophobicContact CB-CG2 4.04Å; D360-T363 WeakPolarHBondContact O-CB 3.4Å; D360-T363 PolarHBondContact O-N 3.36Å; D360-T363 PolarHBondContact O-OG1 3.27Å; P361-T363 PolarHBondContact O-N 3.46Å; P361-T363 VanDerWaalsContact O-N 3.08Å; T363-V365 PolarHBondContact O-N 2.94Å
364	V	94.3	Very high	92.7	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.181	C	C	.	.			trans	-73	123.7	-175.6	178.6	0	0	0	0	110	Y354 P361 Y366 V367 Y389 R393 L397 I464	Y354-V364 HydrophobicContact CD1-CG2 4.33Å; Y354-V364 HydrophobicContact CE1-CG2 3.42Å; Y354-V364 VanDerWaalsContact CE1-CG2 3.42Å; P361-V364 WeakPolarHBondContact O-CB 3.39Å; P361-V364 WeakPolarHBondContact O-CG2 3.37Å; P361-V364 PolarHBondContact O-N 2.58Å; P361-V364 VanDerWaalsContact O-N 3.12Å; V364-Y366 WeakPolarHBondContact CG1-O 3.38Å; V364-V367 HydrophobicContact CG1-CG2 4.2Å; V364-Y389 HydrophobicContact CB-CD1 3.93Å; V364-Y389 HydrophobicContact CB-CE1 3.73Å; V364-Y389 HydrophobicContact CG1-CD1 4.36Å; V364-Y389 HydrophobicContact CG1-CE1 3.82Å; V364-Y389 HydrophobicContact CG2-CD1 4.3Å; V364-Y389 HydrophobicContact CG2-CE1 3.87Å; V364-R393 PolarHBondContact O-NH1 3.03Å; V364-R393 PolarHBondContact O-NH2 3.03Å; V364-L397 WeakPolarHBondContact O-CD1 3.11Å; V364-I464 HydrophobicContact CG2-CB 4.44Å; V364-I464 HydrophobicContact CG2-CG2 3.95Å
365	V	93.6	Very high	92.4	Very high	46 Å²	46	38.5 Å²	38.5	28%	0.279	21%	0.212	S	C	.	.			trans	-80.5	-43	-169.5	-176.9	0	0	0	0	111.6	T363 L398 I464	T363-V365 PolarHBondContact O-N 2.94Å; V365-L398 PolarHBondContact O-N 3Å; V365-I464 PolarHBondContact N-O 3.02Å
366	Y	96.2	Very high	92.4	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	146.4	-176.9	-171.6	-97.2	0	0	0	111	V364 E368 L398 G400 K420 M421 L430 V454 V465 G466	V364-Y366 WeakPolarHBondContact CG1-O 3.38Å; Y366-E368 HydrophobicContact CD1-CB 4.37Å; Y366-E368 HydrophobicContact CE1-CB 3.92Å; Y366-E368 WeakPolarHBondContact CE1-OE2 3.39Å; Y366-E368 PolarHBondContact OH-OE2 3.25Å; Y366-L398 CarbonylContact C-O 3.6Å; Y366-L398 VanDerWaalsContact CA-O 3.29Å; Y366-L398 WeakPolarHBondContact CA-O 3.46Å; Y366-L398 HydrophobicContact CD2-CB 3.58Å; Y366-L398 WeakPolarHBondContact CD2-O 3.23Å; Y366-L398 HydrophobicContact CE2-CB 4.29Å; Y366-G400 WeakPolarHBondContact OH-CA 3.5Å; Y366-G400 PolarHBondContact OH-N 3.24Å; Y366-K420 PolarHBondContact OH-NZ 3.3Å; Y366-K420 VanDerWaalsContact OH-NZ 3.11Å; Y366-M421 HydrophobicContact CD1-CE 4.05Å; Y366-M421 HydrophobicContact CD1-SD 3.62Å; Y366-M421 HydrophobicContact CE1-CE 3.48Å; Y366-M421 VanDerWaalsContact CE1-CE 3.48Å; Y366-M421 HydrophobicContact CE1-SD 3.68Å; Y366-L430 HydrophobicContact CD1-CD2 4.14Å; Y366-L430 HydrophobicContact CD2-CD1 3.68Å; Y366-L430 HydrophobicContact CD2-CD2 3.77Å; Y366-L430 HydrophobicContact CD2-CG 4.32Å; Y366-L430 HydrophobicContact CE1-CD2 4.33Å; Y366-L430 HydrophobicContact CE2-CD1 4.16Å; Y366-L430 HydrophobicContact CE2-CD2 4.01Å; Y366-L430 HydrophobicContact CG-CD1 4.33Å; Y366-L430 HydrophobicContact CG-CD2 3.85Å; Y366-V454 HydrophobicContact CD2-CG2 4.31Å; Y366-V454 HydrophobicContact CE2-CB 4.31Å; Y366-V454 HydrophobicContact CE2-CG2 3.76Å; Y366-V465 VanDerWaalsContact O-CA 3.22Å; Y366-V465 WeakPolarHBondContact O-CA 3.38Å; Y366-V465 WeakPolarHBondContact O-CB 3.42Å; Y366-G466 PolarHBondContact O-N 2.7Å
367	V	97.4	Very high	92.5	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	122	163	177.7	0	0	0	0	109.9	V364 T369 L385 Y389 L397 L398 V399 G400 G466	V364-V367 HydrophobicContact CG1-CG2 4.2Å; V367-T369 HydrophobicContact CG1-CG2 4.01Å; V367-L385 HydrophobicContact CG1-CD1 4.39Å; V367-L385 HydrophobicContact CG1-CD2 4.05Å; V367-Y389 HydrophobicContact CG2-CD1 4.47Å; V367-Y389 HydrophobicContact CG2-CE1 3.87Å; V367-Y389 HydrophobicContact CG2-CE2 4.14Å; V367-L397 HydrophobicContact CG2-CD1 4.2Å; V367-L397 HydrophobicContact CG2-CD2 4.03Å; V367-L398 PolarHBondContact N-O 2.88Å; V367-V399 WeakPolarHBondContact O-CA 3.5Å; V367-G400 PolarHBondContact O-N 2.71Å; V367-G466 WeakPolarHBondContact CA-O 3.41Å
368	E	97.8	Very high	92.8	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	109.5	167.9	-178.5	61.3	-161.6	0	0	108	Y366 S401 V402 A417 K420 M421 G466 V467 N468	Y366-E368 HydrophobicContact CD1-CB 4.37Å; Y366-E368 HydrophobicContact CE1-CB 3.92Å; Y366-E368 WeakPolarHBondContact CE1-OE2 3.39Å; Y366-E368 PolarHBondContact OH-OE2 3.25Å; E368-S401 WeakPolarHBondContact OE1-CA 3.22Å; E368-V402 WeakPolarHBondContact OE1-CB 3.37Å; E368-V402 PolarHBondContact OE1-N 3Å; E368-A417 HydrophobicContact CG-CB 3.62Å; E368-K420 IonicContact OE1-NZ 3.94Å; E368-K420 IonicContact OE2-NZ 2.96Å; E368-K420 PolarHBondContact OE2-NZ 2.77Å; E368-M421 HydrophobicContact CB-CE 4.23Å; E368-M421 HydrophobicContact CB-CG 4.01Å; E368-M421 HydrophobicContact CB-SD 3.97Å; E368-M421 HydrophobicContact CG-CE 4.32Å; E368-M421 HydrophobicContact CG-CG 4.24Å; E368-M421 WeakPolarHBondContact OE2-CE 3.49Å; E368-G466 PolarHBondContact N-O 2.82Å; E368-V467 HydrophobicContact CB-CG1 4.39Å; E368-V467 HydrophobicContact CB-CG2 4.28Å; E368-V467 HydrophobicContact CG-CG1 4.42Å; E368-V467 WeakPolarHBondContact O-CA 3.31Å; E368-N468 PolarHBondContact O-N 3.25Å
369	T	97.5	Very high	93.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.149	C	C	.	.			trans	-88.9	159.8	-164	59.2	0	0	0	0	112.8	F292 V367 G371 E381 L385 V399 G400 K403	F292-T369 HydrophobicContact CE2-CG2 4.13Å; F292-T369 HydrophobicContact CZ-CG2 3.78Å; F292-T369 WeakPolarHBondContact CZ-OG1 3.36Å; V367-T369 HydrophobicContact CG1-CG2 4.01Å; T369-G371 VanDerWaalsContact C-N 3.27Å; T369-E381 WeakPolarHBondContact CA-OE1 3.21Å; T369-E381 WeakPolarHBondContact CB-OE1 3.32Å; T369-L385 HydrophobicContact CG2-CD1 3.79Å; T369-V399 HydrophobicContact CG2-CB 4.26Å; T369-V399 HydrophobicContact CG2-CG1 4.44Å; T369-G400 PolarHBondContact N-O 3.39Å; T369-G400 PolarHBondContact OG1-O 3.22Å; T369-K403 PolarHBondContact O-NZ 3.35Å
370	H	95.6	Very high	93.3	Very high	23 Å²	23	28.5 Å²	28.5	11%	0.106	16%	0.155	C	C	.	.			trans	-64.7	-38.5	167.5	-177	61.8	0	0	0	109.7	T372 E381 K403 H408 N468 F470	H370-T372 VanDerWaalsContact NE2-CG2 3.29Å; H370-T372 WeakPolarHBondContact NE2-CG2 3.2Å; H370-T372 PolarHBondContact O-N 3.26Å; H370-E381 WeakPolarHBondContact CB-OE2 3.35Å; H370-E381 PolarHBondContact N-OE1 3.4Å; H370-E381 PolarHBondContact N-OE2 3.37Å; H370-K403 VanDerWaalsContact O-CD 3.24Å; H370-K403 WeakPolarHBondContact O-CD 3.31Å; H370-K403 WeakPolarHBondContact O-CE 3.49Å; H370-K403 PolarHBondContact O-NZ 3.25Å; H370-H408 AromaticContact CE1-CE1 3.97Å; H370-H408 AromaticContact CE1-NE2 3.56Å; H370-N468 HydrophobicContact CB-CB 4.18Å; H370-F470 HydrophobicContact CB-CB 4.42Å; H370-F470 HydrophobicContact CB-CD2 3.5Å; H370-F470 HydrophobicContact CB-CE2 3.92Å; H370-F470 HydrophobicContact CB-CG 4Å; H370-F470 PolarHBondContact CE1-O 3.36Å; H370-F470 AromaticContact CG-CD2 3.86Å; H370-F470 PolarHBondContact ND1-N 2.66Å; H370-F470 PolarHBondContact NE2-O 2.84Å
371	G	93.1	Very high	93.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.135	C	C	.	.			trans	38.4	81	150.1	0	0	0	0	0	114	T291 T369 E381 S401	T291-G371 PolarHBondContact OG1-O 2.78Å; T369-G371 VanDerWaalsContact C-N 3.27Å; G371-E381 PolarHBondContact N-OE2 2.72Å; G371-S401 VanDerWaalsContact O-CB 3.26Å; G371-S401 WeakPolarHBondContact O-CB 3.38Å; G371-S401 PolarHBondContact O-OG 3.35Å
372	T	92	Very high	93.6	Very high	5 Å²	5	23.6 Å²	23.6	3%	0.031	13%	0.127	C	C	.	.			trans	-106.8	-15	-165.9	51.4	0	0	0	0	114	Y299 H370 T374 D378	Y299-T372 WeakPolarHBondContact CA-O 3.35Å; Y299-T372 WeakPolarHBondContact CB-O 3.23Å; H370-T372 VanDerWaalsContact NE2-CG2 3.29Å; H370-T372 WeakPolarHBondContact NE2-CG2 3.2Å; H370-T372 PolarHBondContact O-N 3.26Å; T372-T374 WeakPolarHBondContact OG1-CB 3.49Å; T372-T374 VanDerWaalsContact OG1-CG2 3.27Å; T372-T374 WeakPolarHBondContact OG1-CG2 3.4Å; T372-T374 PolarHBondContact OG1-N 2.94Å; T372-T374 PolarHBondContact OG1-OG1 3.32Å; T372-D378 WeakPolarHBondContact CA-OD1 3.43Å; T372-D378 PolarHBondContact N-OD1 2.86Å; T372-D378 PolarHBondContact OG1-OD1 2.93Å
373	G	91.9	Very high	93.7	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.01	14%	0.136	C	C	.	.			trans	70.7	18.8	-163.3	0	0	0	0	0	112.9	Q290 G296 E297 G298 D378	Q290-G373 WeakPolarHBondContact O-CA 3.03Å; G296-G373 CarbonylContact C-O 3.56Å; G296-G373 WeakPolarHBondContact CA-O 3.34Å; E297-G373 PolarHBondContact N-O 3.4Å; E297-G373 VanDerWaalsContact N-O 3.12Å; G298-G373 PolarHBondContact N-O 3.04Å; G373-D378 WeakPolarHBondContact CA-OD2 3.49Å; G373-D378 VanDerWaalsContact N-CG 3.28Å; G373-D378 PolarHBondContact N-OD1 3.1Å; G373-D378 PolarHBondContact N-OD2 2.92Å
374	T	90.9	Very high	93.9	Very high	25 Å²	25	22 Å²	22	15%	0.153	12%	0.117	C	C	.	.			trans	-85.9	135.3	177	60.9	0	0	0	0	110.9	Y299 T372 V376 G377 D378	Y299-T374 HydrophobicContact CD1-CG2 4.5Å; T372-T374 WeakPolarHBondContact OG1-CB 3.49Å; T372-T374 VanDerWaalsContact OG1-CG2 3.27Å; T372-T374 WeakPolarHBondContact OG1-CG2 3.4Å; T372-T374 PolarHBondContact OG1-N 2.94Å; T372-T374 PolarHBondContact OG1-OG1 3.32Å; T374-V376 PolarHBondContact O-N 2.83Å; T374-G377 PolarHBondContact O-N 3.37Å; T374-G377 WeakPolarHBondContact OG1-CA 3.4Å; T374-G377 PolarHBondContact OG1-N 3.26Å; T374-D378 PolarHBondContact N-OD1 2.99Å; T374-D378 PolarHBondContact O-N 3.27Å
375	K	88.3	Confident	94	Very high	148 Å²	148	22 Å²	22	64%	0.643	12%	0.117	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-18	-175.3	-164.4	165.9	-176.3	168.2	0	115.7	G296	G296-K375 WeakPolarHBondContact O-CA 3.4Å; G296-K375 WeakPolarHBondContact O-CB 3.46Å; G296-K375 PolarHBondContact O-N 3.36Å
376	V	90	Very high	93.9	Very high	64 Å²	64	20.3 Å²	20.3	39%	0.388	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-41.7	-179.2	179.7	0	0	0	0	111.7	F340 P341 T374 P379 E380	F340-V376 HydrophobicContact CD2-CG1 3.87Å; F340-V376 HydrophobicContact CE2-CG1 3.45Å; F340-V376 VanDerWaalsContact CE2-CG1 3.45Å; F340-V376 HydrophobicContact CZ-CG1 3.8Å; P341-V376 HydrophobicContact CG-CG1 4.47Å; T374-V376 PolarHBondContact O-N 2.83Å; V376-P379 WeakPolarHBondContact O-CD 3.35Å; V376-E380 HydrophobicContact CG1-CG 4.48Å; V376-E380 WeakPolarHBondContact O-CG 3.32Å; V376-E380 PolarHBondContact O-N 3Å
377	G	91.1	Very high	93.8	Very high	11 Å²	11	25.2 Å²	25.2	11%	0.113	13%	0.129	C	C	.	.	H	α-helix	trans	-73.3	-40.4	-173.9	0	0	0	0	0	114.2	T374 E380 E381	T374-G377 PolarHBondContact O-N 3.37Å; T374-G377 WeakPolarHBondContact OG1-CA 3.4Å; T374-G377 PolarHBondContact OG1-N 3.26Å; G377-E380 PolarHBondContact O-N 2.75Å; G377-E381 WeakPolarHBondContact O-CB 3.28Å; G377-E381 PolarHBondContact O-N 2.84Å
378	D	94.6	Very high	93.7	Very high	2 Å²	2	25.6 Å²	25.6	1%	0.011	13%	0.132	C	C	.	.	H	α-helix	trans	-63.2	-40.4	178.4	-73.8	39.2	0	0	0	111.6	T291 F292 T372 G373 T374 A382	T291-D378 WeakPolarHBondContact CA-OD2 3.01Å; F292-D378 HydrophobicContact CD1-CB 3.99Å; F292-D378 HydrophobicContact CE1-CB 4.17Å; F292-D378 PolarHBondContact N-OD2 3.49Å; T372-D378 WeakPolarHBondContact CA-OD1 3.43Å; T372-D378 PolarHBondContact N-OD1 2.86Å; T372-D378 PolarHBondContact OG1-OD1 2.93Å; G373-D378 WeakPolarHBondContact CA-OD2 3.49Å; G373-D378 VanDerWaalsContact N-CG 3.28Å; G373-D378 PolarHBondContact N-OD1 3.1Å; G373-D378 PolarHBondContact N-OD2 2.92Å; T374-D378 PolarHBondContact N-OD1 2.99Å; T374-D378 PolarHBondContact O-N 3.27Å; D378-A382 WeakPolarHBondContact O-CB 3.42Å; D378-A382 PolarHBondContact O-N 3Å
379	P	93.7	Very high	93.4	Very high	11 Å²	11	25.6 Å²	25.6	7%	0.071	13%	0.132	C	C	.	.	H	α-helix	trans	-62.9	-46.9	168.1	-28.2	36.3	0	0	0	116.2	V376 E381 A382 N383 I443	V376-P379 WeakPolarHBondContact O-CD 3.35Å; P379-E381 PolarHBondContact O-N 2.76Å; P379-A382 PolarHBondContact O-N 2.88Å; P379-N383 VanDerWaalsContact O-CB 3.31Å; P379-N383 WeakPolarHBondContact O-CB 3.23Å; P379-N383 VanDerWaalsContact O-CG 3.31Å; P379-N383 PolarHBondContact O-N 3.25Å; P379-N383 PolarHBondContact O-ND2 2.73Å; P379-I443 HydrophobicContact CB-CG1 4.3Å; P379-I443 HydrophobicContact CG-CG1 4.33Å
380	E	94.7	Very high	93.1	Very high	60 Å²	60	26.4 Å²	26.4	28%	0.28	14%	0.137	S	C	.	.	H	α-helix	trans	-61.5	-44.7	-179.9	-74.2	-68.4	119.3	0	0	111.4	P341 G343 V376 G377 A384	P341-E380 HydrophobicContact CG-CB 4.27Å; P341-E380 HydrophobicContact CG-CG 4.33Å; G343-E380 WeakPolarHBondContact CA-OE2 3.41Å; G343-E380 PolarHBondContact N-OE2 3.41Å; V376-E380 HydrophobicContact CG1-CG 4.48Å; V376-E380 WeakPolarHBondContact O-CG 3.32Å; V376-E380 PolarHBondContact O-N 3Å; G377-E380 PolarHBondContact O-N 2.75Å; E380-A384 WeakPolarHBondContact O-CB 3.43Å; E380-A384 PolarHBondContact O-N 3.26Å; E380-A384 VanDerWaalsContact O-N 3.12Å
381	E	95.5	Very high	92.6	Very high	3 Å²	3	29.3 Å²	29.3	1%	0.014	16%	0.157	C	C	.	.	H	α-helix	trans	-63.5	-53	176.4	175.7	172.8	-157.2	0	0	111.4	T369 H370 G371 G377 P379 N383 A384 L385 N468 F470	T369-E381 WeakPolarHBondContact CA-OE1 3.21Å; T369-E381 WeakPolarHBondContact CB-OE1 3.32Å; H370-E381 WeakPolarHBondContact CB-OE2 3.35Å; H370-E381 PolarHBondContact N-OE1 3.4Å; H370-E381 PolarHBondContact N-OE2 3.37Å; G371-E381 PolarHBondContact N-OE2 2.72Å; G377-E381 WeakPolarHBondContact O-CB 3.28Å; G377-E381 PolarHBondContact O-N 2.84Å; P379-E381 PolarHBondContact O-N 2.76Å; E381-N383 VanDerWaalsContact C-N 3.27Å; E381-N383 PolarHBondContact O-N 3.4Å; E381-A384 WeakPolarHBondContact O-CB 3.34Å; E381-A384 PolarHBondContact O-N 2.99Å; E381-A384 VanDerWaalsContact O-N 3.09Å; E381-L385 HydrophobicContact CG-CD1 4.34Å; E381-L385 HydrophobicContact CG-CG 4.39Å; E381-L385 WeakPolarHBondContact O-CG 3.43Å; E381-L385 PolarHBondContact O-N 3.17Å; E381-N468 WeakPolarHBondContact OE1-CB 3.39Å; E381-N468 PolarHBondContact OE1-ND2 3.13Å; E381-F470 HydrophobicContact CB-CE2 4.24Å; E381-F470 HydrophobicContact CG-CE2 3.94Å
382	A	94.4	Very high	92.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.5	-31.2	-174.2	0	0	0	0	0	112.7	F292 D378 P379 L385 C386 I443 L451	F292-A382 HydrophobicContact CD1-CB 4.32Å; F292-A382 HydrophobicContact CE1-CB 4.01Å; D378-A382 WeakPolarHBondContact O-CB 3.42Å; D378-A382 PolarHBondContact O-N 3Å; P379-A382 PolarHBondContact O-N 2.88Å; A382-L385 PolarHBondContact O-N 2.79Å; A382-C386 PolarHBondContact O-N 2.82Å; A382-C386 PolarHBondContact O-SG 3.07Å; A382-I443 HydrophobicContact CB-CB 4.46Å; A382-I443 HydrophobicContact CB-CD1 3.8Å; A382-I443 HydrophobicContact CB-CG1 4.13Å; A382-I443 HydrophobicContact CB-CG2 3.49Å; A382-I443 VanDerWaalsContact CB-CG2 3.49Å; A382-L451 HydrophobicContact CB-CD1 4.05Å
383	N	94.5	Very high	91.9	Very high	60 Å²	60	38 Å²	38	32%	0.321	20%	0.2	S	C	.	.	H	α-helix	trans	-69.5	-40.7	172.2	-74.1	-49	0	0	0	111.8	P379 E381 L385 C386 E387 Y442 P444	P379-N383 VanDerWaalsContact O-CB 3.31Å; P379-N383 WeakPolarHBondContact O-CB 3.23Å; P379-N383 VanDerWaalsContact O-CG 3.31Å; P379-N383 PolarHBondContact O-N 3.25Å; P379-N383 PolarHBondContact O-ND2 2.73Å; E381-N383 VanDerWaalsContact C-N 3.27Å; E381-N383 PolarHBondContact O-N 3.4Å; N383-L385 VanDerWaalsContact C-N 3.31Å; N383-L385 PolarHBondContact O-N 2.69Å; N383-C386 WeakPolarHBondContact O-CB 3.23Å; N383-C386 PolarHBondContact O-N 2.99Å; N383-E387 PolarHBondContact O-N 3.5Å; N383-Y442 PolarHBondContact ND2-O 3.21Å; N383-P444 WeakPolarHBondContact OD1-CD 3.34Å
384	A	95	Very high	91.4	Very high	3 Å²	3	46.2 Å²	46.2	3%	0.025	24%	0.241	C	C	.	.	H	α-helix	trans	-61.2	-38.1	172	0	0	0	0	0	112.4	G343 Q346 A347 E380 E381 E387 V388	G343-A384 WeakPolarHBondContact O-CB 3.38Å; Q346-A384 HydrophobicContact CB-CB 4.15Å; A347-A384 HydrophobicContact CB-CB 3.96Å; E380-A384 WeakPolarHBondContact O-CB 3.43Å; E380-A384 PolarHBondContact O-N 3.26Å; E380-A384 VanDerWaalsContact O-N 3.12Å; E381-A384 WeakPolarHBondContact O-CB 3.34Å; E381-A384 PolarHBondContact O-N 2.99Å; E381-A384 VanDerWaalsContact O-N 3.09Å; A384-E387 PolarHBondContact O-N 3.25Å; A384-V388 PolarHBondContact O-N 2.93Å
385	L	95.3	Very high	91.3	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-62.4	-45.7	172.7	-63.4	179.3	0	0	0	111.4	L350 V367 T369 E381 A382 N383 E387 V388 Y389 V399	L350-L385 HydrophobicContact CD1-CD2 4.05Å; V367-L385 HydrophobicContact CG1-CD1 4.39Å; V367-L385 HydrophobicContact CG1-CD2 4.05Å; T369-L385 HydrophobicContact CG2-CD1 3.79Å; E381-L385 HydrophobicContact CG-CD1 4.34Å; E381-L385 HydrophobicContact CG-CG 4.39Å; E381-L385 WeakPolarHBondContact O-CG 3.43Å; E381-L385 PolarHBondContact O-N 3.17Å; A382-L385 PolarHBondContact O-N 2.79Å; N383-L385 VanDerWaalsContact C-N 3.31Å; N383-L385 PolarHBondContact O-N 2.69Å; L385-E387 VanDerWaalsContact C-N 3.29Å; L385-E387 PolarHBondContact O-N 3Å; L385-V388 PolarHBondContact O-N 2.74Å; L385-Y389 HydrophobicContact CB-CD2 4.27Å; L385-Y389 HydrophobicContact CD2-CD2 3.89Å; L385-Y389 HydrophobicContact CD2-CE2 3.45Å; L385-Y389 VanDerWaalsContact CD2-CE2 3.45Å; L385-Y389 WeakPolarHBondContact O-CB 3.48Å; L385-Y389 WeakPolarHBondContact O-CD2 3.45Å; L385-Y389 PolarHBondContact O-N 3.5Å; L385-V399 HydrophobicContact CD1-CG1 4.31Å
386	C	93.3	Very high	91.5	Very high	10 Å²	10	43 Å²	43	7%	0.068	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-35.6	178.2	-69.4	0	0	0	0	113.1	A382 N383 C390	A382-C386 PolarHBondContact O-N 2.82Å; A382-C386 PolarHBondContact O-SG 3.07Å; N383-C386 WeakPolarHBondContact O-CB 3.23Å; N383-C386 PolarHBondContact O-N 2.99Å; C386-C390 WeakPolarHBondContact O-CB 3.41Å
387	E	93.5	Very high	91.7	Very high	102 Å²	102	39.9 Å²	39.9	48%	0.477	23%	0.226	S	C	.	.	H	α-helix	trans	-69.1	-33.5	179.9	-158.2	-163.7	143.7	0	0	112.6	K351 N383 A384 L385 T391	K351-E387 IonicContact NZ-OE1 2.64Å; K351-E387 PolarHBondContact NZ-OE1 2.71Å; N383-E387 PolarHBondContact O-N 3.5Å; A384-E387 PolarHBondContact O-N 3.25Å; L385-E387 VanDerWaalsContact C-N 3.29Å; L385-E387 PolarHBondContact O-N 3Å; E387-T391 VanDerWaalsContact O-CG2 3.29Å; E387-T391 WeakPolarHBondContact O-CG2 3.49Å
388	V	94.4	Very high	92	Very high	9 Å²	9	40.9 Å²	40.9	6%	0.055	23%	0.229	C	C	.	.	H	α-helix	trans	-99.7	-44.4	-172.3	-177.2	0	0	0	0	113	A347 L350 K351 P361 A384 L385	A347-V388 HydrophobicContact CB-CG2 4.26Å; L350-V388 HydrophobicContact CB-CB 4.32Å; L350-V388 HydrophobicContact CB-CG1 4.07Å; L350-V388 HydrophobicContact CB-CG2 4.04Å; K351-V388 HydrophobicContact CG-CG1 4.38Å; K351-V388 HydrophobicContact CG-CG2 3.9Å; P361-V388 HydrophobicContact CB-CG1 3.95Å; P361-V388 HydrophobicContact CG-CG1 3.91Å; A384-V388 PolarHBondContact O-N 2.93Å; L385-V388 PolarHBondContact O-N 2.74Å
389	Y	93	Very high	92.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-93.6	-14.3	-170.4	-67.3	-91.2	0	0	0	115	L350 Y354 P361 N362 V364 V367 L385 L397 H478	L350-Y389 HydrophobicContact CD1-CE2 4.08Å; L350-Y389 HydrophobicContact CD2-CE2 3.98Å; Y354-Y389 AromaticContact CE2-CE1 3.82Å; Y354-Y389 HydrophobicContact CE2-CE1 3.82Å; Y354-Y389 AromaticContact CE2-CZ 3.62Å; Y354-Y389 WeakPolarHBondContact CE2-OH 3.46Å; Y354-Y389 AromaticContact CZ-CE1 3.75Å; Y354-Y389 AromaticContact CZ-CZ 3.93Å; Y354-Y389 PolarHBondContact OH-OH 3.47Å; P361-Y389 HydrophobicContact CB-CD1 4.09Å; P361-Y389 HydrophobicContact CB-CG 4.5Å; P361-Y389 VanDerWaalsContact O-CD1 3.32Å; P361-Y389 WeakPolarHBondContact O-CD1 3.32Å; N362-Y389 PolarHBondContact OD1-O 3.26Å; V364-Y389 HydrophobicContact CB-CD1 3.93Å; V364-Y389 HydrophobicContact CB-CE1 3.73Å; V364-Y389 HydrophobicContact CG1-CD1 4.36Å; V364-Y389 HydrophobicContact CG1-CE1 3.82Å; V364-Y389 HydrophobicContact CG2-CD1 4.3Å; V364-Y389 HydrophobicContact CG2-CE1 3.87Å; V367-Y389 HydrophobicContact CG2-CD1 4.47Å; V367-Y389 HydrophobicContact CG2-CE1 3.87Å; V367-Y389 HydrophobicContact CG2-CE2 4.14Å; L385-Y389 HydrophobicContact CB-CD2 4.27Å; L385-Y389 HydrophobicContact CD2-CD2 3.89Å; L385-Y389 HydrophobicContact CD2-CE2 3.45Å; L385-Y389 VanDerWaalsContact CD2-CE2 3.45Å; L385-Y389 WeakPolarHBondContact O-CB 3.48Å; L385-Y389 WeakPolarHBondContact O-CD2 3.45Å; L385-Y389 PolarHBondContact O-N 3.5Å; Y389-L397 HydrophobicContact CD1-CD2 4.41Å; Y389-L397 HydrophobicContact CD2-CD2 4.25Å; Y389-L397 HydrophobicContact CG-CD2 3.94Å; Y389-H478 PolarHBondContact OH-CE1 3.37Å
390	C	90.2	Very high	92.2	Very high	17 Å²	17	40.3 Å²	40.3	12%	0.115	23%	0.225	C	C	.	.	S	Bend	trans	-120.4	28.7	-167.4	-57.5	0	0	0	0	113.3	C386 R450	C386-C390 WeakPolarHBondContact O-CB 3.41Å; C390-R450 HydrophobicContact CB-CB 4.26Å; C390-R450 HydrophobicContact CB-CG 4.47Å
391	T	84.8	Confident	92.3	Very high	84 Å²	84	37.4 Å²	37.4	52%	0.515	21%	0.212	S	C	.	.	S	Bend	trans	-83	-39.2	-179.3	51.2	0	0	0	0	113.2	N362 E387	N362-T391 PolarHBondContact OD1-N 3.48Å; N362-T391 PolarHBondContact OD1-OG1 2.94Å; E387-T391 VanDerWaalsContact O-CG2 3.29Å; E387-T391 WeakPolarHBondContact O-CG2 3.49Å
392	N	85	Confident	92.4	Very high	138 Å²	138	37.3 Å²	37.3	74%	0.738	21%	0.211	S	C	*	.	S	Bend	trans	-137.3	28.1	-178.6	-68.1	-68.9	0	0	0	112.2	N362	N362-N392 PolarHBondContact OD1-N 3.46Å
393	R	86.6	Confident	92.5	Very high	50 Å²	50	37.4 Å²	37.4	19%	0.189	21%	0.212	C	C	.	.			trans	-78.5	141.6	-168.2	-167.1	-175.4	178.8	86.6	-0	113.7	N362 V364 G395 P396	N362-R393 PolarHBondContact O-NH1 3.42Å; N362-R393 VanDerWaalsContact O-NH1 3.15Å; N362-R393 PolarHBondContact OD1-N 3.46Å; V364-R393 PolarHBondContact O-NH1 3.03Å; V364-R393 PolarHBondContact O-NH2 3.03Å; R393-G395 WeakPolarHBondContact CD-O 3.14Å; R393-G395 WeakPolarHBondContact CG-O 3.13Å; R393-G395 PolarHBondContact NE-O 3.24Å; R393-P396 PolarHBondContact NE-O 3.21Å; R393-P396 PolarHBondContact NH2-O 2.97Å; R393-P396 VanDerWaalsContact NH2-O 3.11Å
394	I	81	Confident	92.6	Very high	172 Å²	172	34.6 Å²	34.6	88%	0.882	20%	0.197	S	C	*	.	S	Bend	trans	-95.9	107.7	169.4	-57.5	176.6	0	0	0	109
395	G	87.6	Confident	92.7	Very high	50 Å²	50	34.5 Å²	34.5	52%	0.515	20%	0.196	S	C	.	.	S	Bend	trans	83.7	174.5	-176.2	0	0	0	0	0	113.9	R393	R393-G395 WeakPolarHBondContact CD-O 3.14Å; R393-G395 WeakPolarHBondContact CG-O 3.13Å; R393-G395 PolarHBondContact NE-O 3.24Å
396	P	92.8	Very high	92.8	Very high	55 Å²	55	34.5 Å²	34.5	36%	0.357	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-68.6	157.2	-177.8	29	-35.8	0	0	0	112.5	R393 L398 R450 K452	R393-P396 PolarHBondContact NE-O 3.21Å; R393-P396 PolarHBondContact NH2-O 2.97Å; R393-P396 VanDerWaalsContact NH2-O 3.11Å; P396-L398 HydrophobicContact CG-CD2 4.49Å; P396-R450 CarbonylContact C-O 3.47Å; P396-R450 WeakPolarHBondContact CA-O 3.44Å; P396-K452 HydrophobicContact CB-CB 4Å; P396-K452 HydrophobicContact CG-CB 4.33Å
397	L	95.6	Very high	92.9	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	125.8	157.5	179.7	66	0	0	0	108.5	V364 V367 Y389 V399 R450 L451 K452	V364-L397 WeakPolarHBondContact O-CD1 3.11Å; V367-L397 HydrophobicContact CG2-CD1 4.2Å; V367-L397 HydrophobicContact CG2-CD2 4.03Å; Y389-L397 HydrophobicContact CD1-CD2 4.41Å; Y389-L397 HydrophobicContact CD2-CD2 4.25Å; Y389-L397 HydrophobicContact CG-CD2 3.94Å; L397-V399 HydrophobicContact CD2-CG1 4.07Å; L397-V399 HydrophobicContact CG-CG1 4.04Å; L397-R450 PolarHBondContact N-O 3.04Å; L397-L451 HydrophobicContact CB-CD2 3.92Å; L397-L451 HydrophobicContact CD2-CD2 3.96Å; L397-L451 HydrophobicContact CG-CD2 4.38Å; L397-L451 CarbonylContact O-C 3.6Å; L397-L451 WeakPolarHBondContact O-CA 3.46Å; L397-K452 PolarHBondContact O-N 3.18Å
398	L	96.4	Very high	93	Very high	31 Å²	31	29.3 Å²	29.3	16%	0.162	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	134.3	173.7	-58.4	-176.4	0	0	0	109.2	V365 Y366 V367 P396 L430 K452 V454	V365-L398 PolarHBondContact O-N 3Å; Y366-L398 CarbonylContact C-O 3.6Å; Y366-L398 VanDerWaalsContact CA-O 3.29Å; Y366-L398 WeakPolarHBondContact CA-O 3.46Å; Y366-L398 HydrophobicContact CD2-CB 3.58Å; Y366-L398 WeakPolarHBondContact CD2-O 3.23Å; Y366-L398 HydrophobicContact CE2-CB 4.29Å; V367-L398 PolarHBondContact N-O 2.88Å; P396-L398 HydrophobicContact CG-CD2 4.49Å; L398-L430 HydrophobicContact CD1-CD1 3.87Å; L398-K452 WeakPolarHBondContact CA-O 3.4Å; L398-K452 HydrophobicContact CD2-CB 4.1Å; L398-K452 HydrophobicContact CD2-CD 4.21Å; L398-K452 HydrophobicContact CD2-CG 4.45Å; L398-V454 HydrophobicContact CB-CG2 4.04Å; L398-V454 HydrophobicContact CD1-CG2 4.49Å; L398-V454 HydrophobicContact CD2-CG2 4.44Å
399	V	96.9	Very high	93	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.006	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	160.6	-177.7	-63.2	0	0	0	0	112.4	F292 V367 T369 L385 L397 L451 K452 V453 V454	F292-V399 HydrophobicContact CD2-CG2 4.42Å; F292-V399 HydrophobicContact CE2-CB 4.42Å; F292-V399 HydrophobicContact CE2-CG2 4.19Å; V367-V399 WeakPolarHBondContact O-CA 3.5Å; T369-V399 HydrophobicContact CG2-CB 4.26Å; T369-V399 HydrophobicContact CG2-CG1 4.44Å; L385-V399 HydrophobicContact CD1-CG1 4.31Å; L397-V399 HydrophobicContact CD2-CG1 4.07Å; L397-V399 HydrophobicContact CG-CG1 4.04Å; V399-L451 HydrophobicContact CG1-CD2 4.36Å; V399-L451 HydrophobicContact CG2-CB 4.47Å; V399-K452 PolarHBondContact N-O 2.82Å; V399-V453 HydrophobicContact CG2-CG2 4.09Å; V399-V453 WeakPolarHBondContact O-CA 3.3Å; V399-V454 PolarHBondContact O-N 2.93Å
400	G	96.4	Very high	93.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.2	-178.4	169.7	0	0	0	0	0	112	Y366 V367 T369 N433	Y366-G400 WeakPolarHBondContact OH-CA 3.5Å; Y366-G400 PolarHBondContact OH-N 3.24Å; V367-G400 PolarHBondContact O-N 2.71Å; T369-G400 PolarHBondContact N-O 3.39Å; T369-G400 PolarHBondContact OG1-O 3.22Å; G400-N433 WeakPolarHBondContact CA-OD1 3.36Å
401	S	97	Very high	93.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.166	C	C	.	.			trans	-147.3	127.7	177.2	176.2	0	0	0	0	111	E368 G371 K403 S404 N433	E368-S401 WeakPolarHBondContact OE1-CA 3.22Å; G371-S401 VanDerWaalsContact O-CB 3.26Å; G371-S401 WeakPolarHBondContact O-CB 3.38Å; G371-S401 PolarHBondContact O-OG 3.35Å; S401-K403 PolarHBondContact O-N 2.87Å; S401-K403 VanDerWaalsContact O-N 3.08Å; S401-K403 WeakPolarHBondContact OG-CB 3.48Å; S401-K403 PolarHBondContact OG-N 2.87Å; S401-K403 PolarHBondContact OG-NZ 3.08Å; S401-S404 WeakPolarHBondContact O-CB 3.15Å; S401-S404 PolarHBondContact O-N 3.34Å; S401-S404 PolarHBondContact O-OG 3.31Å; S401-N433 PolarHBondContact N-OD1 3.31Å; S401-N433 PolarHBondContact O-OD1 3.09Å
402	V	97.1	Very high	94	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.006	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-23	171	71.2	0	0	0	0	112.6	F99 L103 E368 S404 N405 M406 A417 K420	F99-V402 HydrophobicContact CZ-CG2 3.86Å; L103-V402 HydrophobicContact CD2-CG2 4.49Å; E368-V402 WeakPolarHBondContact OE1-CB 3.37Å; E368-V402 PolarHBondContact OE1-N 3Å; V402-S404 PolarHBondContact O-N 3.16Å; V402-N405 PolarHBondContact O-N 3.05Å; V402-M406 HydrophobicContact CG2-CG 3.91Å; V402-M406 HydrophobicContact CG2-SD 4.04Å; V402-M406 VanDerWaalsContact O-CG 3.23Å; V402-M406 WeakPolarHBondContact O-CG 3.24Å; V402-M406 PolarHBondContact O-N 3.47Å; V402-A417 HydrophobicContact CG1-CB 4.12Å; V402-K420 HydrophobicContact CB-CB 4.23Å; V402-K420 HydrophobicContact CB-CD 3.66Å; V402-K420 HydrophobicContact CG2-CB 3.92Å; V402-K420 HydrophobicContact CG2-CD 3.98Å; V402-K420 HydrophobicContact CG2-CG 4.41Å
403	K	97	Very high	94.5	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.009	11%	0.107	C	C	.	.	H	α-helix	trans	-71	-17.6	179.7	-53.2	171.6	-153.6	69	0	111.9	C289 T369 H370 S401 G407 H408	C289-K403 WeakPolarHBondContact CB-O 3.44Å; C289-K403 PolarHBondContact SG-O 3.08Å; T369-K403 PolarHBondContact O-NZ 3.35Å; H370-K403 VanDerWaalsContact O-CD 3.24Å; H370-K403 WeakPolarHBondContact O-CD 3.31Å; H370-K403 WeakPolarHBondContact O-CE 3.49Å; H370-K403 PolarHBondContact O-NZ 3.25Å; S401-K403 PolarHBondContact O-N 2.87Å; S401-K403 VanDerWaalsContact O-N 3.08Å; S401-K403 WeakPolarHBondContact OG-CB 3.48Å; S401-K403 PolarHBondContact OG-N 2.87Å; S401-K403 PolarHBondContact OG-NZ 3.08Å; K403-G407 WeakPolarHBondContact CA-O 3.39Å; K403-G407 WeakPolarHBondContact O-CA 3.16Å; K403-G407 PolarHBondContact O-N 3.14Å; K403-H408 HydrophobicContact CD-CB 4.27Å
404	S	96.4	Very high	94.9	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.007	10%	0.098	C	C	.	.	H	α-helix	trans	-69.9	-36.3	167.3	66.9	0	0	0	0	112.3	S401 V402 N433 L434 H435	S401-S404 WeakPolarHBondContact O-CB 3.15Å; S401-S404 PolarHBondContact O-N 3.34Å; S401-S404 PolarHBondContact O-OG 3.31Å; V402-S404 PolarHBondContact O-N 3.16Å; S404-N433 WeakPolarHBondContact OG-CA 3.49Å; S404-N433 PolarHBondContact OG-OD1 2.97Å; S404-L434 WeakPolarHBondContact CB-O 3.42Å; S404-L434 PolarHBondContact OG-N 3.43Å; S404-H435 PolarHBondContact O-CD2 3.08Å; S404-H435 PolarHBondContact O-NE2 3.02Å
405	N	97	Very high	95.7	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-80	-42.8	180	-52.4	92.1	0	0	0	112.9	L103 L109 V402 P432	L103-N405 HydrophobicContact CD2-CB 3.7Å; L109-N405 PolarHBondContact N-O 3.48Å; V402-N405 PolarHBondContact O-N 3.05Å; N405-P432 PolarHBondContact ND2-O 3.06Å
406	M	96	Very high	96.2	Very high	1 Å²	1	5.4 Å²	5.4	1%	0.005	3%	0.032	C	C	.	.	H	α-helix	trans	-128.7	5.1	-168.6	64	153.4	-76.9	0	0	114.9	L90 P91 F99 L109 I110 S302 V402 A409 A416	L90-M406 HydrophobicContact CD2-CE 3.94Å; L90-M406 HydrophobicContact CD2-SD 3.96Å; P91-M406 HydrophobicContact CB-CB 4.47Å; P91-M406 HydrophobicContact CG-CB 4.07Å; P91-M406 HydrophobicContact CG-CE 3.95Å; F99-M406 HydrophobicContact CE2-CB 4.33Å; F99-M406 HydrophobicContact CE2-CG 4.31Å; F99-M406 HydrophobicContact CE2-SD 3.92Å; F99-M406 HydrophobicContact CZ-CG 4.42Å; F99-M406 HydrophobicContact CZ-SD 3.81Å; L109-M406 HydrophobicContact CB-CB 4.36Å; L109-M406 HydrophobicContact CD1-CB 4.21Å; I110-M406 WeakPolarHBondContact CD1-O 3.32Å; S302-M406 WeakPolarHBondContact CB-O 3.36Å; S302-M406 PolarHBondContact OG-O 3.05Å; V402-M406 HydrophobicContact CG2-CG 3.91Å; V402-M406 HydrophobicContact CG2-SD 4.04Å; V402-M406 VanDerWaalsContact O-CG 3.23Å; V402-M406 WeakPolarHBondContact O-CG 3.24Å; V402-M406 PolarHBondContact O-N 3.47Å; M406-A409 HydrophobicContact CE-CB 3.79Å; M406-A416 HydrophobicContact CE-CB 4.4Å; M406-A416 HydrophobicContact SD-CB 4.04Å
407	G	95.1	Very high	96.4	Very high	1 Å²	1	2.8 Å²	2.8	1%	0.01	2%	0.015	C	C	.	.			trans	74.1	-177.4	-175.5	0	0	0	0	0	114.4	K403	K403-G407 WeakPolarHBondContact CA-O 3.39Å; K403-G407 WeakPolarHBondContact O-CA 3.16Å; K403-G407 PolarHBondContact O-N 3.14Å
408	H	96.2	Very high	96.5	Very high	2 Å²	2	2.8 Å²	2.8	1%	0.009	2%	0.015	C	C	.	.	B	Isolated β-bridge	trans	-94.5	102.5	-173.9	-166.2	-6.3	0	0	0	111.2	C238 Y299 V300 S302 H370 K403 E410 S413	C238-H408 VanDerWaalsContact SG-CE1 3.52Å; C238-H408 PolarHBondContact SG-NE2 3.44Å; Y299-H408 HydrophobicContact CD2-CB 3.43Å; Y299-H408 VanDerWaalsContact CD2-CB 3.43Å; Y299-H408 AromaticContact CD2-CD2 3.72Å; Y299-H408 AromaticContact CD2-CG 3.91Å; Y299-H408 HydrophobicContact CE2-CB 3.96Å; Y299-H408 AromaticContact CE2-CD2 3.9Å; Y299-H408 HydrophobicContact CG-CB 4.07Å; Y299-H408 AromaticContact CG-CD2 3.78Å; V300-H408 WeakPolarHBondContact O-CB 3.41Å; V300-H408 PolarHBondContact O-N 2.88Å; S302-H408 PolarHBondContact N-O 3.39Å; H370-H408 AromaticContact CE1-CE1 3.97Å; H370-H408 AromaticContact CE1-NE2 3.56Å; K403-H408 HydrophobicContact CD-CB 4.27Å; H408-E410 PolarHBondContact ND1-N 3.36Å; H408-E410 PolarHBondContact O-N 3.36Å; H408-S413 PolarHBondContact CE1-OG 3.01Å; H408-S413 PolarHBondContact ND1-OG 3.01Å
409	A	95.4	Very high	96.5	Very high	0 Å²	0	1.3 Å²	1.3	0%	0	1%	0.007	C	C	.	.			trans	-77.2	35.3	177	0	0	0	0	0	114.2	S302 M406 A412 S413	S302-A409 WeakPolarHBondContact O-CA 3.23Å; M406-A409 HydrophobicContact CE-CB 3.79Å; A409-A412 HydrophobicContact CB-CB 4.21Å; A409-A412 WeakPolarHBondContact O-CB 3.43Å; A409-A412 PolarHBondContact O-N 3.25Å; A409-S413 PolarHBondContact N-OG 2.82Å; A409-S413 PolarHBondContact O-N 2.55Å; A409-S413 PolarHBondContact O-OG 3.23Å
410	E	94.7	Very high	96.5	Very high	13 Å²	13	1.2 Å²	1.2	6%	0.061	1%	0.007	C	C	.	.	G	3₁₀ helix	trans	31.4	-111	-176.5	-67.6	171	-168.4	0	0	113.5	C238 H266 F277 Y299 R301 H408 A412 S413	C238-E410 WeakPolarHBondContact CA-O 3.49Å; H266-E410 IonicContact CE1-OE2 2.64Å; H266-E410 PolarHBondContact CE1-OE2 3.25Å; H266-E410 IonicContact NE2-OE2 3Å; H266-E410 PolarHBondContact NE2-OE2 3.24Å; F277-E410 VanDerWaalsContact CE2-OE1 3.23Å; F277-E410 WeakPolarHBondContact CE2-OE1 3.46Å; F277-E410 WeakPolarHBondContact CE2-OE2 3.49Å; Y299-E410 HydrophobicContact CE2-CG 4.48Å; Y299-E410 PolarHBondContact OH-OE1 3.19Å; Y299-E410 VanDerWaalsContact OH-OE1 3.14Å; R301-E410 IonicContact CZ-OE1 3.76Å; R301-E410 IonicContact CZ-OE2 2.62Å; R301-E410 IonicContact NE-OE1 2.67Å; R301-E410 PolarHBondContact NE-OE1 3.46Å; R301-E410 IonicContact NE-OE2 2.68Å; R301-E410 VanDerWaalsContact NH2-CD 3.32Å; R301-E410 IonicContact NH2-OE1 3.8Å; R301-E410 PolarHBondContact NH2-OE1 2.7Å; R301-E410 IonicContact NH2-OE2 2.69Å; R301-E410 PolarHBondContact NH2-OE2 3.4Å; H408-E410 PolarHBondContact ND1-N 3.36Å; H408-E410 PolarHBondContact O-N 3.36Å; E410-A412 VanDerWaalsContact C-N 3.29Å; E410-A412 PolarHBondContact O-N 3Å; E410-S413 PolarHBondContact N-OG 3Å; E410-S413 VanDerWaalsContact N-OG 3.08Å; E410-S413 VanDerWaalsContact O-CB 3.26Å; E410-S413 WeakPolarHBondContact O-CB 3.45Å; E410-S413 PolarHBondContact O-N 3.42Å; E410-S413 PolarHBondContact O-OG 3.12Å
411	P	96.1	Very high	96.5	Very high	2 Å²	2	1.2 Å²	1.2	1%	0.013	1%	0.007	C	C	.	.	G	3₁₀ helix	trans	-66.1	-23.6	-176.5	31	-37.8	0	0	0	114.8	A237 S241 S265 H266 S413	A237-P411 VanDerWaalsContact O-CA 3.31Å; A237-P411 WeakPolarHBondContact O-CA 3.31Å; S241-P411 WeakPolarHBondContact CB-O 3.48Å; S241-P411 PolarHBondContact N-O 3.24Å; S241-P411 VanDerWaalsContact N-O 3.08Å; S241-P411 PolarHBondContact OG-O 3.4Å; S265-P411 WeakPolarHBondContact O-CG 3.48Å; H266-P411 HydrophobicContact CB-CG 3.99Å; H266-P411 WeakPolarHBondContact ND1-CD 3.37Å; P411-S413 VanDerWaalsContact C-N 3.3Å
412	A	97	Very high	96.4	Very high	0 Å²	0	1.2 Å²	1.2	0%	0	1%	0.007	C	C	.	.	G	3₁₀ helix	trans	-80.1	-10.2	177.8	0	0	0	0	0	113.4	H266 G304 A409 E410 G414 L415 A416	H266-A412 HydrophobicContact CB-CB 4.48Å; G304-A412 VanDerWaalsContact O-CB 3.32Å; G304-A412 WeakPolarHBondContact O-CB 3.36Å; A409-A412 HydrophobicContact CB-CB 4.21Å; A409-A412 WeakPolarHBondContact O-CB 3.43Å; A409-A412 PolarHBondContact O-N 3.25Å; E410-A412 VanDerWaalsContact C-N 3.29Å; E410-A412 PolarHBondContact O-N 3Å; A412-G414 VanDerWaalsContact C-N 3.27Å; A412-G414 PolarHBondContact O-N 3.01Å; A412-L415 PolarHBondContact O-N 3.47Å; A412-L415 VanDerWaalsContact O-N 3.13Å; A412-A416 PolarHBondContact O-N 3.47Å
413	S	95.3	Very high	96.3	Very high	2 Å²	2	1.2 Å²	1.2	1%	0.014	1%	0.007	C	C	.	.	H	α-helix	trans	-61.7	-30.4	-171.1	-52.9	0	0	0	0	114.7	H408 A409 E410 P411 A416 A417	H408-S413 PolarHBondContact CE1-OG 3.01Å; H408-S413 PolarHBondContact ND1-OG 3.01Å; A409-S413 PolarHBondContact N-OG 2.82Å; A409-S413 PolarHBondContact O-N 2.55Å; A409-S413 PolarHBondContact O-OG 3.23Å; E410-S413 PolarHBondContact N-OG 3Å; E410-S413 VanDerWaalsContact N-OG 3.08Å; E410-S413 VanDerWaalsContact O-CB 3.26Å; E410-S413 WeakPolarHBondContact O-CB 3.45Å; E410-S413 PolarHBondContact O-N 3.42Å; E410-S413 PolarHBondContact O-OG 3.12Å; P411-S413 VanDerWaalsContact C-N 3.3Å; S413-A416 PolarHBondContact O-N 3.19Å; S413-A417 WeakPolarHBondContact O-CB 3.19Å; S413-A417 PolarHBondContact O-N 3.32Å
414	G	96	Very high	96.1	Very high	0 Å²	0	1.1 Å²	1.1	0%	0	1%	0.006	C	C	.	.	H	α-helix	trans	-60.7	-49.4	174.8	0	0	0	0	0	111.4	S241 A412 A417 I418	S241-G414 PolarHBondContact OG-N 2.94Å; A412-G414 VanDerWaalsContact C-N 3.27Å; A412-G414 PolarHBondContact O-N 3.01Å; G414-A417 WeakPolarHBondContact O-CB 3.35Å; G414-A417 PolarHBondContact O-N 3.36Å; G414-I418 WeakPolarHBondContact O-CG1 3.41Å; G414-I418 PolarHBondContact O-N 3.48Å; G414-I418 VanDerWaalsContact O-N 3.09Å
415	L	97.9	Very high	95.9	Very high	0 Å²	0	1.5 Å²	1.5	0%	0	1%	0.008	C	C	.	.	H	α-helix	trans	-76.8	-25.4	177.3	-67.7	-179.9	0	0	0	113.9	S241 L245 V262 V306 I308 A412 A417 I418 A419	S241-L415 PolarHBondContact OG-N 2.98Å; L245-L415 HydrophobicContact CD2-CD2 4.39Å; V262-L415 HydrophobicContact CG1-CD1 4.25Å; V306-L415 HydrophobicContact CB-CB 3.86Å; V306-L415 HydrophobicContact CG1-CB 3.79Å; I308-L415 HydrophobicContact CD1-CD2 3.53Å; I308-L415 HydrophobicContact CG1-CD1 4.45Å; I308-L415 HydrophobicContact CG1-CD2 3.86Å; I308-L415 HydrophobicContact CG2-CD2 4.5Å; A412-L415 PolarHBondContact O-N 3.47Å; A412-L415 VanDerWaalsContact O-N 3.13Å; L415-A417 VanDerWaalsContact C-N 3.31Å; L415-I418 HydrophobicContact CD2-CB 4.32Å; L415-I418 HydrophobicContact CD2-CG1 4.11Å; L415-I418 PolarHBondContact O-N 3.36Å; L415-A419 WeakPolarHBondContact O-CB 3.46Å; L415-A419 PolarHBondContact O-N 3.13Å
416	A	97.4	Very high	95.6	Very high	1 Å²	1	3 Å²	3	1%	0.008	2%	0.015	C	C	.	.	H	α-helix	trans	-64.1	-37.8	169.1	0	0	0	0	0	111.9	L90 V306 M406 A412 S413 A419 K420	L90-A416 HydrophobicContact CD2-CB 4.37Å; V306-A416 HydrophobicContact CG2-CB 4.48Å; M406-A416 HydrophobicContact CE-CB 4.4Å; M406-A416 HydrophobicContact SD-CB 4.04Å; A412-A416 PolarHBondContact O-N 3.47Å; S413-A416 PolarHBondContact O-N 3.19Å; A416-A419 WeakPolarHBondContact O-CB 3.42Å; A416-A419 PolarHBondContact O-N 3.38Å; A416-K420 PolarHBondContact O-N 3.26Å
417	A	97.4	Very high	95.3	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-64.8	-43.9	171.3	0	0	0	0	0	111.8	E368 V402 S413 G414 L415 A419 K420 M421 V467	E368-A417 HydrophobicContact CG-CB 3.62Å; V402-A417 HydrophobicContact CG1-CB 4.12Å; S413-A417 WeakPolarHBondContact O-CB 3.19Å; S413-A417 PolarHBondContact O-N 3.32Å; G414-A417 WeakPolarHBondContact O-CB 3.35Å; G414-A417 PolarHBondContact O-N 3.36Å; L415-A417 VanDerWaalsContact C-N 3.31Å; A417-A419 VanDerWaalsContact C-N 3.33Å; A417-A419 PolarHBondContact O-N 2.77Å; A417-K420 PolarHBondContact O-N 3.08Å; A417-M421 WeakPolarHBondContact O-CG 3.34Å; A417-M421 PolarHBondContact O-N 3.33Å; A417-M421 VanDerWaalsContact O-N 3.13Å; A417-V467 HydrophobicContact CB-CG1 3.94Å
418	I	97.6	Very high	95.1	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-58.1	-44.2	171.7	-61.9	-74.9	0	0	0	110.8	I83 L242 L245 I308 G414 L415 K420 M421 L422 V467 L481	I83-I418 HydrophobicContact CD1-CG2 3.89Å; L242-I418 HydrophobicContact CD1-CD1 4.31Å; L242-I418 HydrophobicContact CD1-CG1 4.12Å; L245-I418 HydrophobicContact CD2-CD1 4.13Å; L245-I418 HydrophobicContact CD2-CG1 4.34Å; I308-I418 HydrophobicContact CD1-CG2 4.5Å; G414-I418 WeakPolarHBondContact O-CG1 3.41Å; G414-I418 PolarHBondContact O-N 3.48Å; G414-I418 VanDerWaalsContact O-N 3.09Å; L415-I418 HydrophobicContact CD2-CB 4.32Å; L415-I418 HydrophobicContact CD2-CG1 4.11Å; L415-I418 PolarHBondContact O-N 3.36Å; I418-K420 PolarHBondContact O-N 3.49Å; I418-M421 CarbonylContact O-C 3.58Å; I418-M421 WeakPolarHBondContact O-CA 3.47Å; I418-M421 WeakPolarHBondContact O-CB 3.21Å; I418-M421 PolarHBondContact O-N 3.11Å; I418-L422 HydrophobicContact CG2-CD1 4.3Å; I418-L422 HydrophobicContact CG2-CD2 4.28Å; I418-L422 HydrophobicContact CG2-CG 4.07Å; I418-L422 WeakPolarHBondContact O-CG 3.3Å; I418-L422 PolarHBondContact O-N 3.22Å; I418-V467 HydrophobicContact CD1-CB 4.35Å; I418-V467 HydrophobicContact CD1-CG1 4.21Å; I418-V467 HydrophobicContact CD1-CG2 4.05Å; I418-L481 HydrophobicContact CD1-CD1 3.72Å; I418-L481 HydrophobicContact CD1-CG 4.37Å
419	A	97	Very high	95	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-57.5	-47.5	-179.8	0	0	0	0	0	112.5	I86 M96 F99 V306 L415 A416 A417 M421 L422 I423	I86-A419 HydrophobicContact CD1-CB 3.73Å; M96-A419 HydrophobicContact CE-CB 4.07Å; M96-A419 HydrophobicContact SD-CB 4.25Å; F99-A419 HydrophobicContact CE1-CB 4.28Å; V306-A419 HydrophobicContact CG1-CB 4.5Å; L415-A419 WeakPolarHBondContact O-CB 3.46Å; L415-A419 PolarHBondContact O-N 3.13Å; A416-A419 WeakPolarHBondContact O-CB 3.42Å; A416-A419 PolarHBondContact O-N 3.38Å; A417-A419 VanDerWaalsContact C-N 3.33Å; A417-A419 PolarHBondContact O-N 2.77Å; A419-M421 VanDerWaalsContact C-N 3.29Å; A419-M421 PolarHBondContact O-N 3.37Å; A419-L422 PolarHBondContact O-N 3.27Å; A419-I423 WeakPolarHBondContact O-CD1 3.48Å; A419-I423 WeakPolarHBondContact O-CG1 3.48Å; A419-I423 PolarHBondContact O-N 3.12Å; A419-I423 VanDerWaalsContact O-N 3.08Å
420	K	96.9	Very high	95.1	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-57.2	-40.8	172.1	-179.6	-169.5	168.3	-159.7	0	111.8	L103 Y366 E368 V402 A416 A417 I418 A424 P431	L103-K420 HydrophobicContact CD1-CB 3.99Å; L103-K420 HydrophobicContact CD1-CG 3.95Å; L103-K420 HydrophobicContact CD2-CG 4.44Å; Y366-K420 PolarHBondContact OH-NZ 3.3Å; Y366-K420 VanDerWaalsContact OH-NZ 3.11Å; E368-K420 IonicContact OE1-NZ 3.94Å; E368-K420 IonicContact OE2-NZ 2.96Å; E368-K420 PolarHBondContact OE2-NZ 2.77Å; V402-K420 HydrophobicContact CB-CB 4.23Å; V402-K420 HydrophobicContact CB-CD 3.66Å; V402-K420 HydrophobicContact CG2-CB 3.92Å; V402-K420 HydrophobicContact CG2-CD 3.98Å; V402-K420 HydrophobicContact CG2-CG 4.41Å; A416-K420 PolarHBondContact O-N 3.26Å; A417-K420 PolarHBondContact O-N 3.08Å; I418-K420 PolarHBondContact O-N 3.49Å; K420-A424 WeakPolarHBondContact O-CB 3.49Å; K420-A424 PolarHBondContact O-N 2.92Å; K420-P431 HydrophobicContact CG-CG 4.03Å
421	M	96	Very high	95.1	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-69.7	-37.3	178.3	-67.4	-61	97.3	0	0	113.4	Y366 E368 A417 I418 A419 A424 M425 V467	Y366-M421 HydrophobicContact CD1-CE 4.05Å; Y366-M421 HydrophobicContact CD1-SD 3.62Å; Y366-M421 HydrophobicContact CE1-CE 3.48Å; Y366-M421 VanDerWaalsContact CE1-CE 3.48Å; Y366-M421 HydrophobicContact CE1-SD 3.68Å; E368-M421 HydrophobicContact CB-CE 4.23Å; E368-M421 HydrophobicContact CB-CG 4.01Å; E368-M421 HydrophobicContact CB-SD 3.97Å; E368-M421 HydrophobicContact CG-CE 4.32Å; E368-M421 HydrophobicContact CG-CG 4.24Å; E368-M421 WeakPolarHBondContact OE2-CE 3.49Å; A417-M421 WeakPolarHBondContact O-CG 3.34Å; A417-M421 PolarHBondContact O-N 3.33Å; A417-M421 VanDerWaalsContact O-N 3.13Å; I418-M421 CarbonylContact O-C 3.58Å; I418-M421 WeakPolarHBondContact O-CA 3.47Å; I418-M421 WeakPolarHBondContact O-CB 3.21Å; I418-M421 PolarHBondContact O-N 3.11Å; A419-M421 VanDerWaalsContact C-N 3.29Å; A419-M421 PolarHBondContact O-N 3.37Å; M421-A424 WeakPolarHBondContact O-CB 3.45Å; M421-A424 PolarHBondContact O-N 3.37Å; M421-M425 VanDerWaalsContact O-CG 3.28Å; M421-M425 WeakPolarHBondContact O-CG 3.4Å; M421-M425 PolarHBondContact O-N 3.13Å; M421-V467 HydrophobicContact CG-CG2 4.34Å
422	L	95.1	Very high	95.2	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-68.9	-38.3	176.2	-56	-165.9	0	0	0	111.6	I83 I86 Y320 A321 I418 A419 A424 M425 Q426	I83-L422 HydrophobicContact CB-CD1 4.47Å; I83-L422 HydrophobicContact CD1-CD2 4.22Å; I83-L422 HydrophobicContact CG2-CD1 3.74Å; I86-L422 HydrophobicContact CB-CD1 4.16Å; I86-L422 HydrophobicContact CD1-CD1 3.83Å; I86-L422 HydrophobicContact CD1-CG 4.48Å; I86-L422 HydrophobicContact CG2-CD1 4.19Å; Y320-L422 HydrophobicContact CD2-CD1 4.12Å; Y320-L422 HydrophobicContact CG-CB 4.44Å; Y320-L422 HydrophobicContact CG-CD1 4.19Å; A321-L422 HydrophobicContact CB-CD2 3.92Å; I418-L422 HydrophobicContact CG2-CD1 4.3Å; I418-L422 HydrophobicContact CG2-CD2 4.28Å; I418-L422 HydrophobicContact CG2-CG 4.07Å; I418-L422 WeakPolarHBondContact O-CG 3.3Å; I418-L422 PolarHBondContact O-N 3.22Å; A419-L422 PolarHBondContact O-N 3.27Å; L422-A424 VanDerWaalsContact C-N 3.32Å; L422-A424 PolarHBondContact O-N 3.21Å; L422-M425 HydrophobicContact CD2-SD 4.32Å; L422-M425 PolarHBondContact O-N 3.12Å; L422-Q426 WeakPolarHBondContact O-CB 3.36Å; L422-Q426 PolarHBondContact O-N 3.44Å
423	I	94.5	Very high	95.2	Very high	1 Å²	1	11 Å²	11	1%	0.005	6%	0.06	C	C	.	.	H	α-helix	trans	-59.5	-44.3	170.3	-68.4	162.2	0	0	0	110.3	M96 F99 A100 L103 A419 M425 Q426 T427 M929	M96-I423 HydrophobicContact CE-CD1 3.71Å; M96-I423 HydrophobicContact CE-CG1 3.84Å; F99-I423 HydrophobicContact CD1-CD1 3.68Å; F99-I423 HydrophobicContact CE1-CD1 4.26Å; A100-I423 HydrophobicContact CB-CD1 3.88Å; A100-I423 HydrophobicContact CB-CG1 4.01Å; A100-I423 HydrophobicContact CB-CG2 3.72Å; L103-I423 HydrophobicContact CD1-CD1 3.91Å; A419-I423 WeakPolarHBondContact O-CD1 3.48Å; A419-I423 WeakPolarHBondContact O-CG1 3.48Å; A419-I423 PolarHBondContact O-N 3.12Å; A419-I423 VanDerWaalsContact O-N 3.08Å; I423-M425 VanDerWaalsContact C-N 3.35Å; I423-M425 PolarHBondContact O-N 3.45Å; I423-Q426 PolarHBondContact O-N 2.85Å; I423-T427 HydrophobicContact CG2-CG2 4.47Å; I423-T427 WeakPolarHBondContact O-CB 3.28Å; I423-T427 WeakPolarHBondContact O-CG2 3.45Å; I423-T427 PolarHBondContact O-N 3.07Å; I423-T427 PolarHBondContact O-OG1 3.46Å; I423-M929 HydrophobicContact CG1-CE 3.89Å
424	A	93.7	Very high	95.1	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-63.7	-38.5	177.9	0	0	0	0	0	112.9	K420 M421 L422 G428 Y429 L430 W460	K420-A424 WeakPolarHBondContact O-CB 3.49Å; K420-A424 PolarHBondContact O-N 2.92Å; M421-A424 WeakPolarHBondContact O-CB 3.45Å; M421-A424 PolarHBondContact O-N 3.37Å; L422-A424 VanDerWaalsContact C-N 3.32Å; L422-A424 PolarHBondContact O-N 3.21Å; A424-G428 PolarHBondContact O-N 3.02Å; A424-Y429 VanDerWaalsContact CA-O 3.25Å; A424-Y429 WeakPolarHBondContact CA-O 3.47Å; A424-Y429 WeakPolarHBondContact CB-O 3.17Å; A424-Y429 PolarHBondContact O-N 2.84Å; A424-L430 HydrophobicContact CB-CD2 4.19Å; A424-W460 HydrophobicContact CB-CE3 4.03Å; A424-W460 HydrophobicContact CB-CZ3 3.88Å
425	M	92.3	Very high	95.1	Very high	9 Å²	9	13.8 Å²	13.8	4%	0.044	7%	0.073	C	C	.	.	H	α-helix	trans	-68.1	-49.5	176.5	-70.6	173.4	-173.5	0	0	111.4	A321 M421 L422 I423 T427 W460 V465 L481 L925	A321-M425 HydrophobicContact CB-CE 4.27Å; A321-M425 HydrophobicContact CB-SD 3.63Å; M421-M425 VanDerWaalsContact O-CG 3.28Å; M421-M425 WeakPolarHBondContact O-CG 3.4Å; M421-M425 PolarHBondContact O-N 3.13Å; L422-M425 HydrophobicContact CD2-SD 4.32Å; L422-M425 PolarHBondContact O-N 3.12Å; I423-M425 VanDerWaalsContact C-N 3.35Å; I423-M425 PolarHBondContact O-N 3.45Å; M425-T427 VanDerWaalsContact C-N 3.32Å; M425-T427 PolarHBondContact O-N 3.33Å; M425-W460 HydrophobicContact CB-CZ3 4.36Å; M425-W460 HydrophobicContact CE-CH2 4Å; M425-W460 HydrophobicContact CG-CH2 3.65Å; M425-W460 HydrophobicContact CG-CZ3 3.58Å; M425-V465 HydrophobicContact CE-CG2 3.68Å; M425-L481 HydrophobicContact CE-CB 4.14Å; M425-L481 HydrophobicContact CE-CD1 4.33Å; M425-L925 HydrophobicContact CB-CD1 4.41Å; M425-L925 HydrophobicContact CB-CD2 4.36Å; M425-L925 WeakPolarHBondContact O-CD2 3.45Å
426	Q	90.5	Very high	95	Very high	31 Å²	31	15.9 Å²	15.9	15%	0.145	8%	0.083	C	C	.	.	H	α-helix	trans	-63.2	-34.5	179.7	178	173.7	58.6	0	0	113.3	Y320 L422 I423 L925 T927 M929	Y320-Q426 HydrophobicContact CD1-CB 4.5Å; L422-Q426 WeakPolarHBondContact O-CB 3.36Å; L422-Q426 PolarHBondContact O-N 3.44Å; I423-Q426 PolarHBondContact O-N 2.85Å; Q426-L925 WeakPolarHBondContact CG-O 3.44Å; Q426-T927 PolarHBondContact NE2-O 3.19Å; Q426-M929 VanDerWaalsContact OE1-CE 3.22Å
427	T	90.2	Very high	94.7	Very high	52 Å²	52	24 Å²	24	32%	0.319	12%	0.12	S	C	.	.	H	α-helix	trans	-96.8	-16.6	-174.9	62	0	0	0	0	114.5	L104 I423 M425 Y429	L104-T427 HydrophobicContact CD1-CG2 4.13Å; I423-T427 HydrophobicContact CG2-CG2 4.47Å; I423-T427 WeakPolarHBondContact O-CB 3.28Å; I423-T427 WeakPolarHBondContact O-CG2 3.45Å; I423-T427 PolarHBondContact O-N 3.07Å; I423-T427 PolarHBondContact O-OG1 3.46Å; M425-T427 VanDerWaalsContact C-N 3.32Å; M425-T427 PolarHBondContact O-N 3.33Å; T427-Y429 VanDerWaalsContact C-N 3.32Å; T427-Y429 WeakPolarHBondContact O-CD2 3.23Å
428	G	90.6	Very high	94.5	Very high	26 Å²	26	29.7 Å²	29.7	27%	0.268	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	21.2	-174.4	0	0	0	0	0	114.3	A424 W460	A424-G428 PolarHBondContact O-N 3.02Å; G428-W460 PolarHBondContact O-N 3.39Å
429	Y	94.6	Very high	94.3	Very high	94 Å²	94	32.7 Å²	32.7	37%	0.369	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	129.4	176.8	-65.6	-90.5	0	0	0	111.5	A424 T427 P431 K457 T458 P459	A424-Y429 VanDerWaalsContact CA-O 3.25Å; A424-Y429 WeakPolarHBondContact CA-O 3.47Å; A424-Y429 WeakPolarHBondContact CB-O 3.17Å; A424-Y429 PolarHBondContact O-N 2.84Å; T427-Y429 VanDerWaalsContact C-N 3.32Å; T427-Y429 WeakPolarHBondContact O-CD2 3.23Å; Y429-P431 WeakPolarHBondContact O-CD 3.39Å; Y429-K457 HydrophobicContact CD1-CD 4.26Å; Y429-K457 HydrophobicContact CD1-CG 3.72Å; Y429-K457 HydrophobicContact CG-CD 4.39Å; Y429-K457 VanDerWaalsContact CG-CE 3.5Å; Y429-K457 HydrophobicContact CG-CG 4Å; Y429-T458 CarbonylContact C-O 3.54Å; Y429-T458 WeakPolarHBondContact CA-O 3.49Å; Y429-P459 HydrophobicContact CD1-CB 4.48Å; Y429-P459 HydrophobicContact CD1-CG 4.27Å; Y429-P459 HydrophobicContact CE1-CB 4.32Å; Y429-P459 HydrophobicContact CE1-CG 3.96Å
430	L	95.8	Very high	94	Very high	1 Å²	1	33 Å²	33	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	123.1	166.9	-69.6	164.5	0	0	0	109.4	Y366 L398 A424 V454 T458 W460	Y366-L430 HydrophobicContact CD1-CD2 4.14Å; Y366-L430 HydrophobicContact CD2-CD1 3.68Å; Y366-L430 HydrophobicContact CD2-CD2 3.77Å; Y366-L430 HydrophobicContact CD2-CG 4.32Å; Y366-L430 HydrophobicContact CE1-CD2 4.33Å; Y366-L430 HydrophobicContact CE2-CD1 4.16Å; Y366-L430 HydrophobicContact CE2-CD2 4.01Å; Y366-L430 HydrophobicContact CG-CD1 4.33Å; Y366-L430 HydrophobicContact CG-CD2 3.85Å; L398-L430 HydrophobicContact CD1-CD1 3.87Å; A424-L430 HydrophobicContact CB-CD2 4.19Å; L430-V454 HydrophobicContact CB-CG1 4.05Å; L430-V454 HydrophobicContact CD1-CG2 4.42Å; L430-T458 PolarHBondContact N-O 3.08Å; L430-T458 PolarHBondContact O-N 2.75Å; L430-W460 HydrophobicContact CD1-CB 4.03Å; L430-W460 HydrophobicContact CD1-CD2 4.29Å; L430-W460 HydrophobicContact CD1-CG 3.86Å; L430-W460 HydrophobicContact CD2-CD2 3.98Å; L430-W460 HydrophobicContact CD2-CE3 3.89Å; L430-W460 HydrophobicContact CD2-CG 4.38Å; L430-W460 HydrophobicContact CD2-CZ3 4.34Å; L430-W460 HydrophobicContact CG-CB 3.82Å; L430-W460 HydrophobicContact CG-CD2 3.93Å; L430-W460 HydrophobicContact CG-CE3 4.11Å; L430-W460 HydrophobicContact CG-CG 3.81Å
431	P	96.4	Very high	93.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-67.8	146	178.5	-22.8	34.6	0	0	0	113.1	L103 L104 K420 Y429	L103-P431 HydrophobicContact CB-CB 4.05Å; L103-P431 HydrophobicContact CB-CG 4.25Å; L104-P431 HydrophobicContact CD2-CB 4.48Å; L104-P431 HydrophobicContact CD2-CG 4.09Å; K420-P431 HydrophobicContact CG-CG 4.03Å; Y429-P431 WeakPolarHBondContact O-CD 3.39Å
432	P	96.8	Very high	93.5	Very high	9 Å²	9	45.7 Å²	45.7	6%	0.058	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-61	136.2	175.7	26.4	-36.7	0	0	0	113	L103 N405 T455	L103-P432 WeakPolarHBondContact O-CD 3.22Å; N405-P432 PolarHBondContact ND2-O 3.06Å; P432-T455 WeakPolarHBondContact CB-O 3.3Å
433	N	96.4	Very high	93.4	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.021	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-84.2	126.3	165.9	-176.7	107.4	0	0	0	109	G400 S401 S404 V453 V454	G400-N433 WeakPolarHBondContact CA-OD1 3.36Å; S401-N433 PolarHBondContact N-OD1 3.31Å; S401-N433 PolarHBondContact O-OD1 3.09Å; S404-N433 WeakPolarHBondContact OG-CA 3.49Å; S404-N433 PolarHBondContact OG-OD1 2.97Å; N433-V453 HydrophobicContact CB-CG1 3.87Å; N433-V454 VanDerWaalsContact CB-O 3.27Å; N433-V454 WeakPolarHBondContact CB-O 3.25Å; N433-V454 PolarHBondContact N-O 3.44Å
434	L	95.2	Very high	93.1	Very high	25 Å²	25	48.7 Å²	48.7	13%	0.131	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-86	170	-176.6	-49.5	-172.1	0	0	0	112.6	G106 D108 S404 F436	G106-L434 WeakPolarHBondContact O-CD2 3.49Å; D108-L434 HydrophobicContact CB-CD1 3.9Å; S404-L434 WeakPolarHBondContact CB-O 3.42Å; S404-L434 PolarHBondContact OG-N 3.43Å; L434-F436 VanDerWaalsContact C-N 3.26Å; L434-F436 PolarHBondContact O-N 2.83Å; L434-F436 VanDerWaalsContact O-N 3.15Å
435	H	94.8	Very high	92.9	Very high	36 Å²	36	48.7 Å²	48.7	17%	0.167	25%	0.25	C	C	.	.	S	Bend	trans	58.4	25.5	168.6	-40.7	-60.6	0	0	0	116.9	D108 Q290 S404	D108-H435 IonicContact OD2-CE1 2.73Å; D108-H435 PolarHBondContact OD2-CE1 2.9Å; D108-H435 VanDerWaalsContact OD2-CE1 3.26Å; D108-H435 IonicContact OD2-NE2 3.06Å; Q290-H435 HydrophobicContact CB-CB 4.46Å; Q290-H435 HydrophobicContact CG-CB 4.09Å; Q290-H435 PolarHBondContact NE2-O 3.13Å; S404-H435 PolarHBondContact O-CD2 3.08Å; S404-H435 PolarHBondContact O-NE2 3.02Å
436	F	95.2	Very high	92.9	Very high	44 Å²	44	49.3 Å²	49.3	19%	0.193	25%	0.253	C	S	.	.			trans	-108.2	106.4	173.3	179.7	-96.8	0	0	0	109.4	F292 L434 P439 L446 V453 T455	F292-F436 HydrophobicContact CB-CD2 4.03Å; F292-F436 HydrophobicContact CB-CE2 3.9Å; F292-F436 WeakPolarHBondContact O-CE2 3.17Å; L434-F436 VanDerWaalsContact C-N 3.26Å; L434-F436 PolarHBondContact O-N 2.83Å; L434-F436 VanDerWaalsContact O-N 3.15Å; F436-P439 HydrophobicContact CE1-CG 4.45Å; F436-P439 HydrophobicContact CE2-CB 4.44Å; F436-P439 HydrophobicContact CZ-CB 4.06Å; F436-P439 HydrophobicContact CZ-CG 3.87Å; F436-L446 HydrophobicContact CE2-CD1 4.3Å; F436-V453 HydrophobicContact CB-CG1 4.4Å; F436-V453 HydrophobicContact CD1-CB 4.02Å; F436-V453 HydrophobicContact CD1-CG1 4.17Å; F436-V453 HydrophobicContact CD1-CG2 4.26Å; F436-V453 HydrophobicContact CD2-CG2 4Å; F436-V453 HydrophobicContact CE1-CB 3.95Å; F436-V453 HydrophobicContact CE1-CG2 3.96Å; F436-V453 HydrophobicContact CE2-CB 4.47Å; F436-V453 HydrophobicContact CE2-CG2 3.68Å; F436-V453 HydrophobicContact CG-CB 4.31Å; F436-V453 HydrophobicContact CG-CG1 4.12Å; F436-V453 HydrophobicContact CG-CG2 4.27Å; F436-V453 HydrophobicContact CZ-CB 4.18Å; F436-V453 HydrophobicContact CZ-CG2 3.65Å; F436-T455 HydrophobicContact CB-CG2 4.47Å; F436-T455 HydrophobicContact CD1-CG2 3.75Å
437	E	92.4	Very high	92.6	Very high	171 Å²	171	52 Å²	52	80%	0.799	28%	0.281	S	S	*	.			trans	-118.6	-45.6	-177.3	-65.9	179.8	-165	0	0	111.5	D293	D293-E437 PolarHBondContact OD2-N 3.08Å
438	E	92.9	Very high	92.6	Very high	121 Å²	121	53.7 Å²	53.7	57%	0.565	29%	0.288	S	S	*	.	S	Bend	trans	-123.7	118.1	179.9	-174	172.1	-155.2	0	0	110.4	D293 A294 N440	D293-E438 CarbonylContact C-O 3.54Å; D293-E438 WeakPolarHBondContact CA-O 3.49Å; D293-E438 PolarHBondContact OD2-N 2.91Å; A294-E438 HydrophobicContact CB-CB 4.24Å; A294-E438 HydrophobicContact CB-CG 4.09Å; A294-E438 PolarHBondContact N-O 3.29Å; E438-N440 PolarHBondContact O-N 2.91Å
439	P	92.3	Very high	92.4	Very high	62 Å²	62	54.4 Å²	54.4	40%	0.403	30%	0.295	S	S	.	.	B	Isolated β-bridge	trans	-59.2	131.6	-178.5	-24.5	33.2	0	0	0	113.3	F436 L446	F436-P439 HydrophobicContact CE1-CG 4.45Å; F436-P439 HydrophobicContact CE2-CB 4.44Å; F436-P439 HydrophobicContact CZ-CB 4.06Å; F436-P439 HydrophobicContact CZ-CG 3.87Å; P439-L446 HydrophobicContact CB-CB 4.13Å
440	N	92.3	Very high	92.4	Very high	8 Å²	8	54.4 Å²	54.4	4%	0.043	30%	0.295	C	S	.	.			trans	-61.7	121.7	-178.6	-170.8	-46.2	0	0	0	112.2	F292 D293 E438 Y442 I443	F292-N440 WeakPolarHBondContact O-CB 3.18Å; F292-N440 PolarHBondContact O-N 3.04Å; D293-N440 PolarHBondContact O-ND2 2.94Å; D293-N440 VanDerWaalsContact O-ND2 3.15Å; E438-N440 PolarHBondContact O-N 2.91Å; N440-Y442 PolarHBondContact O-N 3.41Å; N440-Y442 VanDerWaalsContact O-N 3.11Å; N440-Y442 WeakPolarHBondContact OD1-CB 3.24Å; N440-Y442 WeakPolarHBondContact OD1-CD2 3.34Å; N440-Y442 PolarHBondContact OD1-N 2.84Å; N440-I443 HydrophobicContact CB-CD1 3.97Å; N440-I443 HydrophobicContact CB-CG1 4.18Å; N440-I443 PolarHBondContact O-N 3.11Å
441	P	90	Very high	92.4	Very high	100 Å²	100	54.7 Å²	54.7	65%	0.649	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-10.9	-174	28.1	-36.3	0	0	0	114.4	I443	P441-I443 VanDerWaalsContact C-N 3.26Å
442	Y	91.2	Very high	92.3	Very high	165 Å²	165	58.9 Å²	58.9	65%	0.647	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	6	173.2	-59.5	-79.7	0	0	0	113.1	N383 N440	N383-Y442 PolarHBondContact ND2-O 3.21Å; N440-Y442 PolarHBondContact O-N 3.41Å; N440-Y442 VanDerWaalsContact O-N 3.11Å; N440-Y442 WeakPolarHBondContact OD1-CB 3.24Å; N440-Y442 WeakPolarHBondContact OD1-CD2 3.34Å; N440-Y442 PolarHBondContact OD1-N 2.84Å
443	I	92.8	Very high	92.3	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.314	C	S	.	.			trans	-120.5	86.9	177.9	-52.8	179.3	0	0	0	109.6	F292 P379 A382 N440 P441 G445 L446 L451	F292-I443 HydrophobicContact CB-CD1 4.42Å; F292-I443 HydrophobicContact CD1-CD1 3.73Å; F292-I443 HydrophobicContact CG-CD1 4.5Å; P379-I443 HydrophobicContact CB-CG1 4.3Å; P379-I443 HydrophobicContact CG-CG1 4.33Å; A382-I443 HydrophobicContact CB-CB 4.46Å; A382-I443 HydrophobicContact CB-CD1 3.8Å; A382-I443 HydrophobicContact CB-CG1 4.13Å; A382-I443 HydrophobicContact CB-CG2 3.49Å; A382-I443 VanDerWaalsContact CB-CG2 3.49Å; N440-I443 HydrophobicContact CB-CD1 3.97Å; N440-I443 HydrophobicContact CB-CG1 4.18Å; N440-I443 PolarHBondContact O-N 3.11Å; P441-I443 VanDerWaalsContact C-N 3.26Å; I443-G445 PolarHBondContact O-N 3.35Å; I443-G445 VanDerWaalsContact O-N 3.14Å; I443-L446 HydrophobicContact CB-CD1 3.9Å; I443-L446 HydrophobicContact CB-CG 4.33Å; I443-L446 HydrophobicContact CD1-CD1 3.93Å; I443-L446 HydrophobicContact CG1-CD1 4.49Å; I443-L446 HydrophobicContact CG2-CB 4.33Å; I443-L446 HydrophobicContact CG2-CD1 3.69Å; I443-L446 HydrophobicContact CG2-CG 3.75Å; I443-L446 PolarHBondContact O-N 3.17Å; I443-L446 VanDerWaalsContact O-N 3.1Å; I443-L451 HydrophobicContact CG2-CD1 4.24Å
444	P	88.2	Confident	92.3	Very high	64 Å²	64	58.7 Å²	58.7	42%	0.416	31%	0.313	S	S	.	.	H	α-helix	trans	-55.6	-35.2	-178	-27	36.1	0	0	0	113.6	N383 L446 A447 D448	N383-P444 WeakPolarHBondContact OD1-CD 3.34Å; P444-L446 PolarHBondContact O-N 3.09Å; P444-L446 VanDerWaalsContact O-N 3.16Å; P444-A447 PolarHBondContact O-N 3.4Å; P444-D448 PolarHBondContact O-N 3.07Å
445	G	89.4	Confident	92.3	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-60.5	-22.9	179.6	0	0	0	0	0	115.3	I443 D448 G449 R450 L451	I443-G445 PolarHBondContact O-N 3.35Å; I443-G445 VanDerWaalsContact O-N 3.14Å; G445-D448 WeakPolarHBondContact CA-OD1 3.48Å; G445-G449 CarbonylContact O-C 3.53Å; G445-G449 PolarHBondContact O-N 3.41Å; G445-R450 PolarHBondContact O-N 3.25Å; G445-L451 PolarHBondContact O-N 2.79Å
446	L	92.2	Very high	92.3	Very high	22 Å²	22	64.4 Å²	64.4	12%	0.115	34%	0.344	C	S	.	.	H	α-helix	trans	-85.3	-32.8	174.1	-67.5	168.9	0	0	0	112	F292 F436 P439 I443 P444 L451 V453	F292-L446 HydrophobicContact CB-CD1 3.8Å; F292-L446 HydrophobicContact CG-CD1 4.37Å; F436-L446 HydrophobicContact CE2-CD1 4.3Å; P439-L446 HydrophobicContact CB-CB 4.13Å; I443-L446 HydrophobicContact CB-CD1 3.9Å; I443-L446 HydrophobicContact CB-CG 4.33Å; I443-L446 HydrophobicContact CD1-CD1 3.93Å; I443-L446 HydrophobicContact CG1-CD1 4.49Å; I443-L446 HydrophobicContact CG2-CB 4.33Å; I443-L446 HydrophobicContact CG2-CD1 3.69Å; I443-L446 HydrophobicContact CG2-CG 3.75Å; I443-L446 PolarHBondContact O-N 3.17Å; I443-L446 VanDerWaalsContact O-N 3.1Å; P444-L446 PolarHBondContact O-N 3.09Å; P444-L446 VanDerWaalsContact O-N 3.16Å; L446-L451 HydrophobicContact CD2-CB 3.76Å; L446-L451 HydrophobicContact CG-CB 4.3Å; L446-V453 HydrophobicContact CD2-CG2 3.81Å
447	A	85.6	Confident	92.3	Very high	89 Å²	89	66.9 Å²	66.9	74%	0.736	36%	0.355	S	S	*	.	H	α-helix	trans	-76.8	-31.2	177.6	0	0	0	0	0	112.8	P444	P444-A447 PolarHBondContact O-N 3.4Å
448	D	88.8	Confident	92.4	Very high	86 Å²	86	59.9 Å²	59.9	46%	0.46	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-6	175.8	68.3	39.4	0	0	0	114.4	P444 G445 R450	P444-D448 PolarHBondContact O-N 3.07Å; G445-D448 WeakPolarHBondContact CA-OD1 3.48Å; D448-R450 VanDerWaalsContact CG-NE 3.29Å; D448-R450 VanDerWaalsContact OD1-CB 3.31Å; D448-R450 WeakPolarHBondContact OD1-CB 3.31Å; D448-R450 WeakPolarHBondContact OD1-CG 3.48Å; D448-R450 IonicContact OD1-CZ 3.23Å; D448-R450 PolarHBondContact OD1-N 2.94Å; D448-R450 IonicContact OD1-NE 2.96Å; D448-R450 PolarHBondContact OD1-NE 3.26Å; D448-R450 IonicContact OD1-NH2 2.68Å; D448-R450 IonicContact OD2-CZ 2.82Å; D448-R450 VanDerWaalsContact OD2-CZ 3.23Å; D448-R450 IonicContact OD2-NE 3.86Å; D448-R450 PolarHBondContact OD2-NE 3.5Å; D448-R450 IonicContact OD2-NH2 3.82Å; D448-R450 PolarHBondContact OD2-NH2 2.81Å
449	G	87.7	Confident	92.4	Very high	41 Å²	41	58.6 Å²	58.6	42%	0.423	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	10.3	174.6	0	0	0	0	0	115.7	G445 L451	G445-G449 CarbonylContact O-C 3.53Å; G445-G449 PolarHBondContact O-N 3.41Å; G449-L451 PolarHBondContact O-N 2.88Å
450	R	93.6	Very high	92.3	Very high	94 Å²	94	56.4 Å²	56.4	36%	0.355	31%	0.309	S	S	.	.	S	Bend	trans	-63.8	-29.7	168.8	-75	178.3	-66.4	153.4	-2.1	112.7	C390 P396 L397 G445 D448	C390-R450 HydrophobicContact CB-CB 4.26Å; C390-R450 HydrophobicContact CB-CG 4.47Å; P396-R450 CarbonylContact C-O 3.47Å; P396-R450 WeakPolarHBondContact CA-O 3.44Å; L397-R450 PolarHBondContact N-O 3.04Å; G445-R450 PolarHBondContact O-N 3.25Å; D448-R450 VanDerWaalsContact CG-NE 3.29Å; D448-R450 VanDerWaalsContact OD1-CB 3.31Å; D448-R450 WeakPolarHBondContact OD1-CB 3.31Å; D448-R450 WeakPolarHBondContact OD1-CG 3.48Å; D448-R450 IonicContact OD1-CZ 3.23Å; D448-R450 PolarHBondContact OD1-N 2.94Å; D448-R450 IonicContact OD1-NE 2.96Å; D448-R450 PolarHBondContact OD1-NE 3.26Å; D448-R450 IonicContact OD1-NH2 2.68Å; D448-R450 IonicContact OD2-CZ 2.82Å; D448-R450 VanDerWaalsContact OD2-CZ 3.23Å; D448-R450 IonicContact OD2-NE 3.86Å; D448-R450 PolarHBondContact OD2-NE 3.5Å; D448-R450 IonicContact OD2-NH2 3.82Å; D448-R450 PolarHBondContact OD2-NH2 2.81Å
451	L	95.3	Very high	91.9	Very high	7 Å²	7	64.2 Å²	64.2	4%	0.037	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	138.4	170.3	-56.1	-175.7	0	0	0	109.5	A382 L397 V399 I443 G445 L446 G449	A382-L451 HydrophobicContact CB-CD1 4.05Å; L397-L451 HydrophobicContact CB-CD2 3.92Å; L397-L451 HydrophobicContact CD2-CD2 3.96Å; L397-L451 HydrophobicContact CG-CD2 4.38Å; L397-L451 CarbonylContact O-C 3.6Å; L397-L451 WeakPolarHBondContact O-CA 3.46Å; V399-L451 HydrophobicContact CG1-CD2 4.36Å; V399-L451 HydrophobicContact CG2-CB 4.47Å; I443-L451 HydrophobicContact CG2-CD1 4.24Å; G445-L451 PolarHBondContact O-N 2.79Å; L446-L451 HydrophobicContact CD2-CB 3.76Å; L446-L451 HydrophobicContact CG-CB 4.3Å; G449-L451 PolarHBondContact O-N 2.88Å
452	K	95.4	Very high	91.6	Very high	89 Å²	89	60.1 Å²	60.1	39%	0.387	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	118.6	168.3	-178.6	-173.6	175.3	-167.3	0	109.7	P396 L397 L398 V399 E456	P396-K452 HydrophobicContact CB-CB 4Å; P396-K452 HydrophobicContact CG-CB 4.33Å; L397-K452 PolarHBondContact O-N 3.18Å; L398-K452 WeakPolarHBondContact CA-O 3.4Å; L398-K452 HydrophobicContact CD2-CB 4.1Å; L398-K452 HydrophobicContact CD2-CD 4.21Å; L398-K452 HydrophobicContact CD2-CG 4.45Å; V399-K452 PolarHBondContact N-O 2.82Å; K452-E456 IonicContact NZ-OE1 2.74Å
453	V	96.6	Very high	91.4	Very high	7 Å²	7	53.8 Å²	53.8	4%	0.042	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	133.1	168.5	-175.7	0	0	0	0	109.3	F292 V399 N433 F436 L446 T455	F292-V453 HydrophobicContact CB-CG2 4.31Å; F292-V453 HydrophobicContact CD2-CG2 3.99Å; V399-V453 HydrophobicContact CG2-CG2 4.09Å; V399-V453 WeakPolarHBondContact O-CA 3.3Å; N433-V453 HydrophobicContact CB-CG1 3.87Å; F436-V453 HydrophobicContact CB-CG1 4.4Å; F436-V453 HydrophobicContact CD1-CB 4.02Å; F436-V453 HydrophobicContact CD1-CG1 4.17Å; F436-V453 HydrophobicContact CD1-CG2 4.26Å; F436-V453 HydrophobicContact CD2-CG2 4Å; F436-V453 HydrophobicContact CE1-CB 3.95Å; F436-V453 HydrophobicContact CE1-CG2 3.96Å; F436-V453 HydrophobicContact CE2-CB 4.47Å; F436-V453 HydrophobicContact CE2-CG2 3.68Å; F436-V453 HydrophobicContact CG-CB 4.31Å; F436-V453 HydrophobicContact CG-CG1 4.12Å; F436-V453 HydrophobicContact CG-CG2 4.27Å; F436-V453 HydrophobicContact CZ-CB 4.18Å; F436-V453 HydrophobicContact CZ-CG2 3.65Å; L446-V453 HydrophobicContact CD2-CG2 3.81Å; V453-T455 HydrophobicContact CB-CG2 4.45Å; V453-T455 HydrophobicContact CG1-CG2 4.12Å; V453-T455 PolarHBondContact O-N 3.28Å
454	V	96.7	Very high	91.4	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.006	32%	0.32	C	S	.	.			trans	-82.7	97.2	174.9	174.6	0	0	0	0	109	Y366 L398 V399 L430 N433 E456	Y366-V454 HydrophobicContact CD2-CG2 4.31Å; Y366-V454 HydrophobicContact CE2-CB 4.31Å; Y366-V454 HydrophobicContact CE2-CG2 3.76Å; L398-V454 HydrophobicContact CB-CG2 4.04Å; L398-V454 HydrophobicContact CD1-CG2 4.49Å; L398-V454 HydrophobicContact CD2-CG2 4.44Å; V399-V454 PolarHBondContact O-N 2.93Å; L430-V454 HydrophobicContact CB-CG1 4.05Å; L430-V454 HydrophobicContact CD1-CG2 4.42Å; N433-V454 VanDerWaalsContact CB-O 3.27Å; N433-V454 WeakPolarHBondContact CB-O 3.25Å; N433-V454 PolarHBondContact N-O 3.44Å; V454-E456 VanDerWaalsContact CG1-O 3.31Å; V454-E456 WeakPolarHBondContact CG1-O 3.15Å
455	T	95.5	Very high	91.8	Very high	70 Å²	70	52.3 Å²	52.3	43%	0.429	30%	0.3	S	S	.	.			trans	-96	-4.3	-178.3	54.2	0	0	0	0	114.1	P432 F436 V453	P432-T455 WeakPolarHBondContact CB-O 3.3Å; F436-T455 HydrophobicContact CB-CG2 4.47Å; F436-T455 HydrophobicContact CD1-CG2 3.75Å; V453-T455 HydrophobicContact CB-CG2 4.45Å; V453-T455 HydrophobicContact CG1-CG2 4.12Å; V453-T455 PolarHBondContact O-N 3.28Å
456	E	93.9	Very high	92.2	Very high	112 Å²	112	52.3 Å²	52.3	52%	0.523	30%	0.3	S	S	.	.	S	Bend	trans	-134.8	154.5	-175.9	68	-165.6	145.2	0	0	109.9	K452 V454 T458	K452-E456 IonicContact NZ-OE1 2.74Å; V454-E456 VanDerWaalsContact CG1-O 3.31Å; V454-E456 WeakPolarHBondContact CG1-O 3.15Å; E456-T458 WeakPolarHBondContact CG-OG1 3.09Å; E456-T458 PolarHBondContact O-N 2.53Å; E456-T458 PolarHBondContact O-OG1 2.78Å
457	K	95.5	Very high	92.4	Very high	96 Å²	96	51.2 Å²	51.2	42%	0.417	30%	0.295	S	S	.	.			trans	-61.9	95.6	174.9	178.4	177.9	173.9	168	0	109.9	L104 Y429	L104-K457 HydrophobicContact CB-CD 4.27Å; L104-K457 HydrophobicContact CD2-CD 4.22Å; L104-K457 HydrophobicContact CD2-CG 4.24Å; Y429-K457 HydrophobicContact CD1-CD 4.26Å; Y429-K457 HydrophobicContact CD1-CG 3.72Å; Y429-K457 HydrophobicContact CG-CD 4.39Å; Y429-K457 VanDerWaalsContact CG-CE 3.5Å; Y429-K457 HydrophobicContact CG-CG 4Å
458	T	95.3	Very high	93	Very high	23 Å²	23	47 Å²	47	14%	0.141	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	122.6	-164.3	-64.3	0	0	0	0	110.7	Y429 L430 E456 W460	Y429-T458 CarbonylContact C-O 3.54Å; Y429-T458 WeakPolarHBondContact CA-O 3.49Å; L430-T458 PolarHBondContact N-O 3.08Å; L430-T458 PolarHBondContact O-N 2.75Å; E456-T458 WeakPolarHBondContact CG-OG1 3.09Å; E456-T458 PolarHBondContact O-N 2.53Å; E456-T458 PolarHBondContact O-OG1 2.78Å; T458-W460 PolarHBondContact O-N 3.01Å
459	P	93.4	Very high	93.4	Very high	94 Å²	94	43 Å²	43	61%	0.61	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-56.8	136.3	174.7	-22.9	32	0	0	0	112.1	Y429	Y429-P459 HydrophobicContact CD1-CB 4.48Å; Y429-P459 HydrophobicContact CD1-CG 4.27Å; Y429-P459 HydrophobicContact CE1-CB 4.32Å; Y429-P459 HydrophobicContact CE1-CG 3.96Å
460	W	89.6	Confident	93.7	Very high	16 Å²	16	41.5 Å²	41.5	6%	0.061	22%	0.22	C	C	.	.			trans	-144.7	119	-171.8	177.7	48.8	0	0	0	112.7	A424 M425 G428 L430 T458 G462 V465	A424-W460 HydrophobicContact CB-CE3 4.03Å; A424-W460 HydrophobicContact CB-CZ3 3.88Å; M425-W460 HydrophobicContact CB-CZ3 4.36Å; M425-W460 HydrophobicContact CE-CH2 4Å; M425-W460 HydrophobicContact CG-CH2 3.65Å; M425-W460 HydrophobicContact CG-CZ3 3.58Å; G428-W460 PolarHBondContact O-N 3.39Å; L430-W460 HydrophobicContact CD1-CB 4.03Å; L430-W460 HydrophobicContact CD1-CD2 4.29Å; L430-W460 HydrophobicContact CD1-CG 3.86Å; L430-W460 HydrophobicContact CD2-CD2 3.98Å; L430-W460 HydrophobicContact CD2-CE3 3.89Å; L430-W460 HydrophobicContact CD2-CG 4.38Å; L430-W460 HydrophobicContact CD2-CZ3 4.34Å; L430-W460 HydrophobicContact CG-CB 3.82Å; L430-W460 HydrophobicContact CG-CD2 3.93Å; L430-W460 HydrophobicContact CG-CE3 4.11Å; L430-W460 HydrophobicContact CG-CG 3.81Å; T458-W460 PolarHBondContact O-N 3.01Å; W460-G462 VanDerWaalsContact CE2-CA 3.44Å; W460-G462 PolarHBondContact NE1-O 3.41Å; W460-G462 PolarHBondContact O-N 3.16Å; W460-G462 VanDerWaalsContact O-N 3.12Å; W460-V465 HydrophobicContact CH2-CG1 3.73Å; W460-V465 HydrophobicContact CZ2-CG1 3.43Å; W460-V465 VanDerWaalsContact CZ2-CG1 3.43Å
461	N	82.5	Confident	93.6	Very high	172 Å²	172	37.2 Å²	37.2	92%	0.92	21%	0.205	S	C	*	.			trans	-83.7	27.4	-177.1	-59.5	-5.5	0	0	0	113.4
462	G	83.9	Confident	93.3	Very high	15 Å²	15	40.9 Å²	40.9	16%	0.155	22%	0.221	C	C	.	.			trans	68.8	-157.1	-174.9	0	0	0	0	0	114.3	W460	W460-G462 VanDerWaalsContact CE2-CA 3.44Å; W460-G462 PolarHBondContact NE1-O 3.41Å; W460-G462 PolarHBondContact O-N 3.16Å; W460-G462 VanDerWaalsContact O-N 3.12Å
463	G	87.6	Confident	92.9	Very high	31 Å²	31	38.6 Å²	38.6	32%	0.32	22%	0.223	S	C	.	.			trans	128.4	-158	-177.9	0	0	0	0	0	112.8	S483	G463-S483 PolarHBondContact O-N 3.01Å
464	I	94	Very high	92.5	Very high	33 Å²	33	38.4 Å²	38.4	17%	0.169	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	136.3	172.2	-54.1	179.1	0	0	0	108.7	V359 V364 V365 V480 L481	V359-I464 HydrophobicContact CG1-CD1 3.66Å; V359-I464 HydrophobicContact CG1-CG2 4.44Å; V359-I464 HydrophobicContact CG2-CD1 4.34Å; V364-I464 HydrophobicContact CG2-CB 4.44Å; V364-I464 HydrophobicContact CG2-CG2 3.95Å; V365-I464 PolarHBondContact N-O 3.02Å; I464-V480 HydrophobicContact CG2-CG1 3.61Å; I464-L481 CarbonylContact C-O 3.55Å; I464-L481 WeakPolarHBondContact CA-O 3.46Å; I464-L481 WeakPolarHBondContact CG2-O 3.32Å
465	V	96.1	Very high	92.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	147.5	175.7	-53.9	0	0	0	0	111.3	Y366 M425 W460 L481	Y366-V465 VanDerWaalsContact O-CA 3.22Å; Y366-V465 WeakPolarHBondContact O-CA 3.38Å; Y366-V465 WeakPolarHBondContact O-CB 3.42Å; M425-V465 HydrophobicContact CE-CG2 3.68Å; W460-V465 HydrophobicContact CH2-CG1 3.73Å; W460-V465 HydrophobicContact CZ2-CG1 3.43Å; W460-V465 VanDerWaalsContact CZ2-CG1 3.43Å; V465-L481 HydrophobicContact CG2-CB 3.8Å; V465-L481 PolarHBondContact N-O 3.29Å; V465-L481 PolarHBondContact O-N 2.81Å
466	G	96.6	Very high	92.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	148.2	170.3	0	0	0	0	0	111.3	Y366 V367 E368 V479	Y366-G466 PolarHBondContact O-N 2.7Å; V367-G466 WeakPolarHBondContact CA-O 3.41Å; E368-G466 PolarHBondContact N-O 2.82Å; G466-V479 CarbonylContact C-O 3.59Å
467	V	98	Very high	92.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	121.8	175.5	-173.6	0	0	0	0	109.8	L242 E368 A417 I418 M421 H478 V479 L481	L242-V467 HydrophobicContact CD1-CG1 4.37Å; E368-V467 HydrophobicContact CB-CG1 4.39Å; E368-V467 HydrophobicContact CB-CG2 4.28Å; E368-V467 HydrophobicContact CG-CG1 4.42Å; E368-V467 WeakPolarHBondContact O-CA 3.31Å; A417-V467 HydrophobicContact CB-CG1 3.94Å; I418-V467 HydrophobicContact CD1-CB 4.35Å; I418-V467 HydrophobicContact CD1-CG1 4.21Å; I418-V467 HydrophobicContact CD1-CG2 4.05Å; M421-V467 HydrophobicContact CG-CG2 4.34Å; V467-H478 WeakPolarHBondContact O-CA 3.37Å; V467-V479 PolarHBondContact N-O 3.4Å; V467-V479 PolarHBondContact O-N 3.23Å; V467-L481 HydrophobicContact CG2-CD1 4.42Å
468	N	97.5	Very high	92.7	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	138	179.4	-76.9	-20.3	0	0	0	111.7	E368 H370 E381 F470 H478	E368-N468 PolarHBondContact O-N 3.25Å; H370-N468 HydrophobicContact CB-CB 4.18Å; E381-N468 WeakPolarHBondContact OE1-CB 3.39Å; E381-N468 PolarHBondContact OE1-ND2 3.13Å; N468-F470 HydrophobicContact CB-CE1 3.93Å; N468-F470 HydrophobicContact CB-CE2 4.19Å; N468-F470 HydrophobicContact CB-CZ 3.67Å; N468-H478 PolarHBondContact OD1-ND1 2.94Å
469	S	96.3	Very high	92.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	128.1	154.4	-157.4	0	0	0	0	111.7	C238 S239 T477	C238-S469 PolarHBondContact O-OG 3Å; S239-S469 VanDerWaalsContact CB-O 3.31Å; S239-S469 WeakPolarHBondContact CB-O 3.29Å; S469-T477 PolarHBondContact N-O 2.89Å; S469-T477 PolarHBondContact O-N 3.26Å
470	F	94.9	Very high	93	Very high	11 Å²	11	20.6 Å²	20.6	5%	0.048	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	120	-172.4	-51.7	-34	0	0	0	109.5	C238 Q346 H370 E381 N468 N476	C238-F470 WeakPolarHBondContact CB-O 3.43Å; Q346-F470 HydrophobicContact CB-CZ 4.35Å; Q346-F470 HydrophobicContact CG-CD2 4.3Å; Q346-F470 HydrophobicContact CG-CE1 4.29Å; Q346-F470 HydrophobicContact CG-CE2 3.93Å; Q346-F470 HydrophobicContact CG-CZ 3.92Å; Q346-F470 VanDerWaalsContact NE2-CD2 3.28Å; H370-F470 HydrophobicContact CB-CB 4.42Å; H370-F470 HydrophobicContact CB-CD2 3.5Å; H370-F470 HydrophobicContact CB-CE2 3.92Å; H370-F470 HydrophobicContact CB-CG 4Å; H370-F470 PolarHBondContact CE1-O 3.36Å; H370-F470 AromaticContact CG-CD2 3.86Å; H370-F470 PolarHBondContact ND1-N 2.66Å; H370-F470 PolarHBondContact NE2-O 2.84Å; E381-F470 HydrophobicContact CB-CE2 4.24Å; E381-F470 HydrophobicContact CG-CE2 3.94Å; N468-F470 HydrophobicContact CB-CE1 3.93Å; N468-F470 HydrophobicContact CB-CE2 4.19Å; N468-F470 HydrophobicContact CB-CZ 3.67Å; F470-N476 WeakPolarHBondContact CB-OD1 3.37Å; F470-N476 HydrophobicContact CD1-CB 3.58Å; F470-N476 HydrophobicContact CE1-CB 4.01Å; F470-N476 HydrophobicContact CG-CB 4.39Å
471	G	90.9	Very high	93.3	Very high	4 Å²	4	19.9 Å²	19.9	4%	0.041	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	137	176.4	0	0	0	0	0	111	T236 G473 G474 S475	T236-G471 WeakPolarHBondContact O-CA 3.36Å; G471-G473 PolarHBondContact O-N 3.22Å; G471-G474 WeakPolarHBondContact O-CA 3.31Å; G471-G474 PolarHBondContact O-N 2.97Å; G471-S475 PolarHBondContact N-O 3.08Å; G471-S475 PolarHBondContact O-N 3.24Å
472	F	89.5	Confident	93.9	Very high	84 Å²	84	16 Å²	16	37%	0.368	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-15.3	-178.5	75.4	-101	0	0	0	114.6	A237 F277 T339 G474	A237-F472 HydrophobicContact CB-CD1 3.56Å; A237-F472 HydrophobicContact CB-CE1 3.43Å; A237-F472 VanDerWaalsContact CB-CE1 3.43Å; A237-F472 HydrophobicContact CB-CZ 4.29Å; F277-F472 HydrophobicContact CE1-CD1 4.25Å; F277-F472 HydrophobicContact CE1-CE1 4.02Å; F277-F472 HydrophobicContact CZ-CE1 4.28Å; T339-F472 WeakPolarHBondContact CA-O 3.33Å; T339-F472 HydrophobicContact CG2-CD2 4.22Å; F472-G474 PolarHBondContact O-N 3.26Å
473	G	86.5	Confident	93.9	Very high	41 Å²	41	16 Å²	16	42%	0.423	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-0.5	169.1	0	0	0	0	0	114.6	G471	G471-G473 PolarHBondContact O-N 3.22Å
474	G	89.6	Confident	93.4	Very high	2 Å²	2	16.1 Å²	16.1	2%	0.021	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.8	26.2	-173.8	0	0	0	0	0	114.7	T330 D331 G471 F472	T330-G474 CarbonylContact C-O 3.46Å; T330-G474 WeakPolarHBondContact CA-O 3.4Å; T330-G474 WeakPolarHBondContact CG2-O 3.44Å; D331-G474 PolarHBondContact N-O 3Å; D331-G474 WeakPolarHBondContact OD2-CA 3.32Å; G471-G474 WeakPolarHBondContact O-CA 3.31Å; G471-G474 PolarHBondContact O-N 2.97Å; F472-G474 PolarHBondContact O-N 3.26Å
475	S	94.3	Very high	92.2	Very high	22 Å²	22	22.7 Å²	22.7	15%	0.154	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	105.2	176.8	-178.4	0	0	0	0	109.9	S239 G471	S239-S475 VanDerWaalsContact CB-O 3.27Å; S239-S475 WeakPolarHBondContact CB-O 3.31Å; S239-S475 PolarHBondContact OG-O 3.38Å; G471-S475 PolarHBondContact N-O 3.08Å; G471-S475 PolarHBondContact O-N 3.24Å
476	N	96	Very high	90.6	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	135.8	-171	-50.7	-52.1	0	0	0	111.2	S328 N329 D331 L349 F470	S328-N476 CarbonylContact C-O 3.48Å; S328-N476 WeakPolarHBondContact CA-O 3.3Å; S328-N476 VanDerWaalsContact CB-O 3.23Å; S328-N476 WeakPolarHBondContact CB-O 3.38Å; N329-N476 PolarHBondContact N-O 3.26Å; N329-N476 PolarHBondContact O-N 2.96Å; N329-N476 WeakPolarHBondContact OD1-CB 3.16Å; N329-N476 PolarHBondContact OD1-ND2 3.45Å; N329-N476 VanDerWaalsContact OD1-ND2 3.15Å; D331-N476 PolarHBondContact OD1-ND2 3.24Å; L349-N476 HydrophobicContact CD2-CB 3.76Å; F470-N476 WeakPolarHBondContact CB-OD1 3.37Å; F470-N476 HydrophobicContact CD1-CB 3.58Å; F470-N476 HydrophobicContact CE1-CB 4.01Å; F470-N476 HydrophobicContact CG-CB 4.39Å
477	T	97.6	Very high	88.6	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	139.3	172.7	-55.6	0	0	0	0	110.6	L242 S328 S469	L242-T477 HydrophobicContact CB-CG2 3.95Å; L242-T477 HydrophobicContact CD2-CG2 3.95Å; L242-T477 HydrophobicContact CG-CG2 3.88Å; S328-T477 WeakPolarHBondContact OG-CB 3.36Å; S328-T477 VanDerWaalsContact OG-CG2 3.29Å; S328-T477 WeakPolarHBondContact OG-CG2 3.41Å; S328-T477 PolarHBondContact OG-OG1 2.96Å; S469-T477 PolarHBondContact N-O 2.89Å; S469-T477 PolarHBondContact O-N 3.26Å
478	H	97.7	Very high	86.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	140.8	172.9	-173.3	85.1	0	0	0	111	A326 M327 L349 L350 V353 Y354 Y389 V467 N468	A326-H478 WeakPolarHBondContact CA-O 3.37Å; M327-H478 PolarHBondContact N-O 3.08Å; M327-H478 PolarHBondContact O-N 3.11Å; L349-H478 HydrophobicContact CD2-CB 4.1Å; L349-H478 HydrophobicContact CG-CB 4.21Å; L350-H478 VanDerWaalsContact CD2-ND1 3.35Å; L350-H478 WeakPolarHBondContact CD2-ND1 3.45Å; V353-H478 HydrophobicContact CG1-CB 4.31Å; V353-H478 VanDerWaalsContact CG1-CD2 3.49Å; V353-H478 WeakPolarHBondContact CG1-CD2 3.34Å; Y354-H478 AromaticContact CE2-NE2 3.5Å; Y354-H478 WeakPolarHBondContact CE2-NE2 3.2Å; Y354-H478 AromaticContact CZ-NE2 3.65Å; Y354-H478 PolarHBondContact OH-NE2 3.01Å; Y389-H478 PolarHBondContact OH-CE1 3.37Å; V467-H478 WeakPolarHBondContact O-CA 3.37Å; N468-H478 PolarHBondContact OD1-ND1 2.94Å
479	V	97.5	Very high	84	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	130.6	175.2	179.4	0	0	0	0	110.2	L242 L245 V323 A326 G466 V467 L481	L242-V479 HydrophobicContact CD1-CG2 3.84Å; L242-V479 HydrophobicContact CD2-CG2 4.05Å; L242-V479 HydrophobicContact CG-CG2 3.66Å; L245-V479 HydrophobicContact CD2-CG1 4.25Å; L245-V479 HydrophobicContact CD2-CG2 4.11Å; L245-V479 HydrophobicContact CG-CG2 4.45Å; V323-V479 HydrophobicContact CG1-CG1 3.94Å; A326-V479 HydrophobicContact CB-CG1 4.5Å; A326-V479 HydrophobicContact CB-CG2 3.89Å; G466-V479 CarbonylContact C-O 3.59Å; V467-V479 PolarHBondContact N-O 3.4Å; V467-V479 PolarHBondContact O-N 3.23Å; V479-L481 HydrophobicContact CG1-CD2 3.78Å; V479-L481 HydrophobicContact CG1-CG 4.23Å
480	V	96.9	Very high	81.7	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	115.3	174.2	-173.1	0	0	0	0	108.7	V324 H325 V353 Y354 I464	V324-V480 HydrophobicContact CB-CB 4.29Å; V324-V480 HydrophobicContact CB-CG1 4.12Å; V324-V480 WeakPolarHBondContact CB-O 3.44Å; V324-V480 HydrophobicContact CG2-CG1 4.46Å; V324-V480 PolarHBondContact N-O 2.98Å; H325-V480 PolarHBondContact N-O 3.26Å; H325-V480 PolarHBondContact O-N 3.08Å; V353-V480 HydrophobicContact CG1-CG2 4.46Å; V353-V480 HydrophobicContact CG2-CG2 4.21Å; Y354-V480 HydrophobicContact CD1-CG2 4.22Å; Y354-V480 HydrophobicContact CE1-CB 4.42Å; Y354-V480 HydrophobicContact CE1-CG1 3.81Å; Y354-V480 HydrophobicContact CE1-CG2 3.66Å; Y354-V480 HydrophobicContact CE2-CG2 4.14Å; I464-V480 HydrophobicContact CG2-CG1 3.61Å
481	L	96.1	Very high	79.6	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	155.1	174.2	-60.9	-174.4	0	0	0	111.4	I83 A321 T322 V323 I418 M425 I464 V465 V467 V479	I83-L481 HydrophobicContact CD1-CD1 4.35Å; I83-L481 HydrophobicContact CD1-CD2 4.08Å; A321-L481 HydrophobicContact CB-CD1 4.31Å; T322-L481 WeakPolarHBondContact O-CA 3.26Å; V323-L481 HydrophobicContact CB-CD2 4.24Å; V323-L481 HydrophobicContact CG1-CD2 4.23Å; V323-L481 HydrophobicContact CG2-CD2 3.93Å; I418-L481 HydrophobicContact CD1-CD1 3.72Å; I418-L481 HydrophobicContact CD1-CG 4.37Å; M425-L481 HydrophobicContact CE-CB 4.14Å; M425-L481 HydrophobicContact CE-CD1 4.33Å; I464-L481 CarbonylContact C-O 3.55Å; I464-L481 WeakPolarHBondContact CA-O 3.46Å; I464-L481 WeakPolarHBondContact CG2-O 3.32Å; V465-L481 HydrophobicContact CG2-CB 3.8Å; V465-L481 PolarHBondContact N-O 3.29Å; V465-L481 PolarHBondContact O-N 2.81Å; V467-L481 HydrophobicContact CG2-CD1 4.42Å; V479-L481 HydrophobicContact CG1-CD2 3.78Å; V479-L481 HydrophobicContact CG1-CG 4.23Å
482	R	93.6	Very high	77.5	Confident	90 Å²	90	67.9 Å²	67.9	34%	0.34	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	127.7	170.7	178.4	-178.8	64.9	-162.4	-0.6	108.7	D80 A321 T322 V324	D80-R482 IonicContact OD1-NH2 3.72Å; D80-R482 IonicContact OD2-CZ 2.73Å; D80-R482 IonicContact OD2-NH2 2.73Å; D80-R482 PolarHBondContact OD2-NH2 3.5Å; A321-R482 CarbonylContact C-O 3.49Å; A321-R482 WeakPolarHBondContact CA-O 3.26Å; T322-R482 PolarHBondContact N-O 2.92Å; T322-R482 PolarHBondContact O-N 3.16Å; T322-R482 PolarHBondContact OG1-NH2 3.3Å; V324-R482 HydrophobicContact CG2-CB 3.66Å
483	S	84.8	Confident	75.5	Confident	15 Å²	15	71.9 Å²	71.9	11%	0.105	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	139.8	175.7	-163.1	0	0	0	0	110.5	G463 H485	G463-S483 PolarHBondContact O-N 3.01Å; S483-H485 PolarHBondContact O-N 2.9Å
484	F	77	Confident	73.8	Confident	34 Å²	34	73.1 Å²	73.1	15%	0.149	37%	0.365	C	S	.	.			trans	-69.6	127.3	175.8	-176.9	-113.8	0	0	0	110	S319 Y320 R486 P922 L925	S319-F484 WeakPolarHBondContact O-CB 3.26Å; S319-F484 WeakPolarHBondContact O-CD1 3.45Å; S319-F484 WeakPolarHBondContact O-CG 3.3Å; S319-F484 WeakPolarHBondContact OG-CD2 3.39Å; Y320-F484 PolarHBondContact O-N 2.85Å; F484-R486 HydrophobicContact CE1-CB 4.04Å; F484-R486 HydrophobicContact CZ-CB 4.21Å; F484-P922 HydrophobicContact CE1-CB 4.44Å; F484-P922 HydrophobicContact CE2-CG 4.5Å; F484-P922 HydrophobicContact CZ-CB 4.09Å; F484-P922 HydrophobicContact CZ-CG 4.13Å; F484-L925 WeakPolarHBondContact O-CD2 3.47Å
485	H	68.6	Low	71.6	Confident	171 Å²	171	83.6 Å²	83.6	79%	0.792	41%	0.405	S	S	*	.			trans	-133.7	111.9	175.8	-171.6	65.4	0	0	0	110.1	S483	S483-H485 PolarHBondContact O-N 2.9Å
486	R	63.7	Low	69.4	Low	93 Å²	93	84.4 Å²	84.4	35%	0.351	42%	0.417	S	S	.	.			trans	-102.8	124.1	176	178.5	174.1	173.5	177.2	-5.8	108	F484 E488 P920 P922	F484-R486 HydrophobicContact CE1-CB 4.04Å; F484-R486 HydrophobicContact CZ-CB 4.21Å; R486-E488 PolarHBondContact O-N 3.48Å; R486-P920 PolarHBondContact NH1-O 2.82Å; R486-P920 VanDerWaalsContact NH2-CG 3.33Å; R486-P922 PolarHBondContact NH1-O 3.44Å
487	S	54.5	Low	67.5	Low	84 Å²	84	92.6 Å²	92.6	59%	0.587	45%	0.448	S	S	*	.			trans	-61.1	128.9	172	59.1	0	0	0	0	109.7	Q489	S487-Q489 PolarHBondContact O-N 3.14Å
488	E	49.8	Very low	66.1	Low	194 Å²	194	97.3 Å²	97.3	91%	0.907	47%	0.473	S	S	*	.			trans	-61.8	94.3	173.5	-66.5	-173.7	149.3	0	0	110.5	R486	R486-E488 PolarHBondContact O-N 3.48Å
489	Q	48.8	Very low	65.3	Low	161 Å²	161	97.9 Å²	97.9	75%	0.752	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-83.1	121.4	152.6	-69.2	-160	-9.7	0	0	106.9	S487 M491	S487-Q489 PolarHBondContact O-N 3.14Å; Q489-M491 PolarHBondContact O-N 2.95Å
490	P	47.6	Very low	64.6	Low	121 Å²	121	99.8 Å²	99.8	79%	0.786	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-61.4	126.5	178	26	-33.4	0	0	0	108.6	E492	P490-E492 PolarHBondContact O-N 2.98Å
491	M	49.9	Very low	64.1	Low	126 Å²	126	99.9 Å²	99.9	62%	0.621	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-63.8	124	174.2	-67.5	-169.4	-70.7	0	0	108.8	Q489 Q493 P920	Q489-M491 PolarHBondContact O-N 2.95Å; M491-Q493 PolarHBondContact O-N 3.36Å; M491-Q493 VanDerWaalsContact O-N 3.12Å; M491-P920 HydrophobicContact SD-CG 4.08Å
492	E	48.4	Very low	63.8	Low	187 Å²	187	100 Å²	100	87%	0.874	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-58.9	116.4	165.4	-67.4	-169.2	140.4	0	0	107.7	P490 P494	P490-E492 PolarHBondContact O-N 2.98Å; E492-P494 WeakPolarHBondContact O-CD 3.41Å
493	Q	47.6	Very low	63.5	Low	167 Å²	167	95.9 Å²	95.9	78%	0.78	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-60.6	123.1	-176.6	-74.9	-173	-19	0	0	110	M491 Y495	M491-Q493 PolarHBondContact O-N 3.36Å; M491-Q493 VanDerWaalsContact O-N 3.12Å; Q493-Y495 PolarHBondContact O-N 3.21Å
494	P	50.1	Low	63.7	Low	68 Å²	68	95.2 Å²	95.2	44%	0.442	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-60.5	123.9	175.6	-23.6	34.4	0	0	0	110.6	E492 G496	E492-P494 WeakPolarHBondContact O-CD 3.41Å; P494-G496 PolarHBondContact O-N 2.99Å
495	Y	43.1	Very low	64.2	Low	222 Å²	222	93.7 Å²	93.7	87%	0.871	46%	0.458	S	S	*	.	S	Bend	trans	-54.9	122.2	180	-72.3	-95.4	0	0	0	112.1	Q493	Q493-Y495 PolarHBondContact O-N 3.21Å
496	G	48.9	Very low	65.1	Low	39 Å²	39	85.6 Å²	85.6	40%	0.402	42%	0.42	S	S	.	.	S	Bend	trans	149.9	174.3	174.8	0	0	0	0	0	112.3	P494	P494-G496 PolarHBondContact O-N 2.99Å
497	R	55.4	Low	66.2	Low	173 Å²	173	82.5 Å²	82.5	65%	0.653	41%	0.409	S	S	*	.			trans	-67.1	145	168.1	-71.3	176	173.1	162.8	0.1	109.1	Q499 M611	R497-Q499 PolarHBondContact O-N 3.39Å; R497-M611 HydrophobicContact CB-SD 4.03Å; R497-M611 VanDerWaalsContact O-CE 3.31Å; R497-M611 WeakPolarHBondContact O-CE 3.47Å
498	N	68.1	Low	67.6	Low	98 Å²	98	79.8 Å²	79.8	52%	0.524	39%	0.389	S	S	.	.	S	Bend	trans	-64.7	5.5	-177.9	-77.1	17.1	0	0	0	115.8	N552	N498-N552 HydrophobicContact CB-CB 4.09Å; N498-N552 WeakPolarHBondContact O-CB 3.37Å; N498-N552 PolarHBondContact O-ND2 2.98Å
499	Q	82.1	Confident	69.1	Low	12 Å²	12	75.4 Å²	75.4	6%	0.056	37%	0.368	C	S	.	.			trans	-65.2	133.1	-173.9	-169.5	170.3	-10.4	0	0	111.4	R497 I550 L551 R553 M611 D894 L897	R497-Q499 PolarHBondContact O-N 3.39Å; Q499-I550 HydrophobicContact CG-CG2 3.94Å; Q499-I550 VanDerWaalsContact NE2-CG2 3.27Å; Q499-L551 WeakPolarHBondContact CA-O 3.16Å; Q499-R553 HydrophobicContact CG-CG 4.36Å; Q499-M611 HydrophobicContact CB-CE 4.14Å; Q499-M611 WeakPolarHBondContact O-CE 3.44Å; Q499-D894 PolarHBondContact NE2-OD1 2.97Å; Q499-L897 HydrophobicContact CG-CD1 4.21Å
500	R	81.2	Confident	70.5	Confident	41 Å²	41	73.1 Å²	73.1	16%	0.155	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	139.9	-176.4	-69.2	-68.5	-172.9	-97.9	5	111	E526 I550 L551	R500-E526 IonicContact CZ-OE1 3.98Å; R500-E526 IonicContact NE-OE1 3.23Å; R500-E526 PolarHBondContact NE-OE1 3.01Å; R500-E526 IonicContact NH2-OE1 2.68Å; R500-E526 PolarHBondContact NH2-OE1 3.2Å; R500-I550 WeakPolarHBondContact O-CA 3.47Å; R500-L551 PolarHBondContact N-O 2.92Å; R500-L551 PolarHBondContact O-N 3.28Å
501	L	87.6	Confident	72.2	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.01	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	119.4	166.8	174	64.2	0	0	0	108.8	L503 Y548 I550 L897 L900 V912 Y916	L501-L503 HydrophobicContact CD1-CD2 3.98Å; L501-L503 HydrophobicContact CD2-CD2 4.04Å; L501-L503 HydrophobicContact CG-CD2 3.87Å; L501-L503 HydrophobicContact CG-CG 4.29Å; L501-Y548 HydrophobicContact CD1-CD2 3.77Å; L501-Y548 HydrophobicContact CD1-CG 4.23Å; L501-I550 HydrophobicContact CD1-CG1 4.13Å; L501-L897 HydrophobicContact CB-CB 4.32Å; L501-L897 HydrophobicContact CB-CD1 4.34Å; L501-L897 HydrophobicContact CB-CD2 3.92Å; L501-L897 HydrophobicContact CB-CG 4.41Å; L501-L897 HydrophobicContact CD2-CD2 4.25Å; L501-L900 HydrophobicContact CD2-CB 3.51Å; L501-L900 HydrophobicContact CD2-CD1 4.18Å; L501-V912 HydrophobicContact CD2-CG1 4.35Å; L501-Y916 PolarHBondContact N-OH 3.23Å
502	F	88.7	Confident	73.9	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.009	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	128.6	172.1	179	-106.5	0	0	0	109.5	T504 I515 L516 A519 L529 L532 Y548 A549 L551	F502-T504 HydrophobicContact CD1-CG2 4.44Å; F502-T504 HydrophobicContact CE1-CG2 3.83Å; F502-I515 HydrophobicContact CE1-CG2 4Å; F502-I515 HydrophobicContact CZ-CG2 3.83Å; F502-L516 HydrophobicContact CD1-CD2 4.04Å; F502-L516 HydrophobicContact CE1-CD2 4.22Å; F502-A519 HydrophobicContact CD1-CB 3.56Å; F502-A519 HydrophobicContact CD2-CB 4.34Å; F502-A519 HydrophobicContact CE1-CB 3.39Å; F502-A519 HydrophobicContact CE2-CB 4.2Å; F502-A519 HydrophobicContact CG-CB 4.04Å; F502-A519 HydrophobicContact CZ-CB 3.74Å; F502-L529 HydrophobicContact CD2-CB 4.36Å; F502-L529 HydrophobicContact CD2-CD2 3.67Å; F502-L529 HydrophobicContact CE2-CD2 3.95Å; F502-L529 HydrophobicContact CG-CD2 4.22Å; F502-L532 HydrophobicContact CE2-CB 3.68Å; F502-L532 HydrophobicContact CE2-CD1 4.23Å; F502-L532 HydrophobicContact CZ-CB 3.87Å; F502-L532 HydrophobicContact CZ-CD1 3.97Å; F502-L532 HydrophobicContact CZ-CG 4.49Å; F502-Y548 CarbonylContact O-C 3.55Å; F502-Y548 WeakPolarHBondContact O-CA 3.4Å; F502-Y548 WeakPolarHBondContact O-CB 3.32Å; F502-A549 PolarHBondContact N-O 3.16Å; F502-A549 PolarHBondContact O-N 3.36Å; F502-L551 HydrophobicContact CB-CD1 3.87Å; F502-L551 HydrophobicContact CB-CG 4.24Å
503	L	88.6	Confident	75.6	Confident	4 Å²	4	56.7 Å²	56.7	2%	0.021	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	138.2	178.7	-60.2	-176.5	0	0	0	109.7	L501 H904 L910 V912	L501-L503 HydrophobicContact CD1-CD2 3.98Å; L501-L503 HydrophobicContact CD2-CD2 4.04Å; L501-L503 HydrophobicContact CG-CD2 3.87Å; L501-L503 HydrophobicContact CG-CG 4.29Å; L503-H904 HydrophobicContact CD1-CB 4.14Å; L503-H904 HydrophobicContact CD2-CB 3.91Å; L503-L910 HydrophobicContact CD1-CB 3.71Å; L503-L910 HydrophobicContact CD1-CD1 4.11Å; L503-L910 HydrophobicContact CD1-CG 4.5Å; L503-V912 HydrophobicContact CD1-CG1 3.66Å; L503-V912 HydrophobicContact CD1-CG2 4.41Å; L503-V912 HydrophobicContact CG-CG1 4.41Å
504	T	89.1	Confident	77.4	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.006	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	150.3	177.4	-177.6	0	0	0	0	112.7	F502 V512 I515 L516 A547 H904	F502-T504 HydrophobicContact CD1-CG2 4.44Å; F502-T504 HydrophobicContact CE1-CG2 3.83Å; T504-V512 HydrophobicContact CG2-CG1 4.26Å; T504-I515 HydrophobicContact CG2-CG2 4.27Å; T504-I515 VanDerWaalsContact OG1-CG2 3.28Å; T504-I515 WeakPolarHBondContact OG1-CG2 3.36Å; T504-L516 HydrophobicContact CG2-CD2 3.58Å; T504-L516 HydrophobicContact CG2-CG 3.86Å; T504-A547 PolarHBondContact N-O 3.11Å; T504-A547 PolarHBondContact O-N 2.71Å; T504-A547 VanDerWaalsContact O-O 3.06Å; T504-H904 PolarHBondContact O-NE2 2.86Å
505	S	86.7	Confident	79.2	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.014	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	158.7	176.5	71.6	0	0	0	0	110.8	A536 Y543 F545	S505-A536 PolarHBondContact OG-O 3.24Å; S505-Y543 WeakPolarHBondContact O-CD2 3.44Å; S505-Y543 WeakPolarHBondContact OG-CB 3.45Å; S505-Y543 WeakPolarHBondContact OG-CD2 3.19Å; S505-F545 CarbonylContact C-O 3.52Å; S505-F545 WeakPolarHBondContact CA-O 3.23Å; S505-F545 VanDerWaalsContact CB-O 3.3Å; S505-F545 WeakPolarHBondContact CB-O 3.36Å
506	G	86.8	Confident	81.3	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	-174.9	-177.3	0	0	0	0	0	114.2	Y543 F545	G506-Y543 CarbonylContact O-C 3.58Å; G506-Y543 WeakPolarHBondContact O-CA 3.33Å; G506-F545 PolarHBondContact N-O 2.96Å; G506-F545 PolarHBondContact O-N 3.32Å
507	R	87.3	Confident	83.1	Confident	27 Å²	27	40.1 Å²	40.1	10%	0.102	18%	0.183	C	C	.	.	S	Bend	trans	-81.2	-28.4	-179	-63.9	-62.3	-62.8	148.2	4.6	113.8	D138 F141 M542 Y543 F545 W936	D138-R507 IonicContact OD1-CZ 2.78Å; D138-R507 IonicContact OD1-NE 2.72Å; D138-R507 IonicContact OD1-NH2 2.79Å; D138-R507 PolarHBondContact OD1-NH2 2.83Å; D138-R507 IonicContact OD2-CZ 3.98Å; D138-R507 VanDerWaalsContact OD2-CZ 3.31Å; D138-R507 IonicContact OD2-NE 2.83Å; D138-R507 PolarHBondContact OD2-NE 2.72Å; D138-R507 IonicContact OD2-NH2 3.71Å; D138-R507 PolarHBondContact OD2-NH2 2.8Å; F141-R507 VanDerWaalsContact CD2-CD 3.47Å; R507-M542 WeakPolarHBondContact CD-O 3.3Å; R507-M542 PolarHBondContact NH1-O 3.45Å; R507-Y543 HydrophobicContact CG-CD1 3.98Å; R507-Y543 HydrophobicContact CG-CE1 3.78Å; R507-F545 WeakPolarHBondContact O-CD2 2.94Å; R507-F545 WeakPolarHBondContact O-CE2 3.33Å; R507-W936 HydrophobicContact CG-CE3 4.04Å; R507-W936 HydrophobicContact CG-CZ3 4.41Å
508	T	83.2	Confident	84.7	Confident	28 Å²	28	34 Å²	34	17%	0.172	16%	0.162	C	C	.	.	S	Bend	trans	-135.8	160.7	-177.6	66.5	0	0	0	0	111.1	L510 S511 V512 D937	T508-L510 VanDerWaalsContact C-N 3.27Å; T508-L510 PolarHBondContact O-N 3.42Å; T508-S511 PolarHBondContact O-N 3.45Å; T508-S511 WeakPolarHBondContact OG1-CB 3.43Å; T508-S511 PolarHBondContact OG1-N 3.26Å; T508-S511 VanDerWaalsContact OG1-N 3.13Å; T508-V512 PolarHBondContact O-N 3.44Å; T508-D937 HydrophobicContact CG2-CB 4.32Å
509	E	81.3	Confident	85.6	Confident	102 Å²	102	29.4 Å²	29.4	48%	0.477	14%	0.137	S	C	.	.	H	α-helix	trans	-55.6	-41.5	169.4	171.7	170.3	159.9	0	0	112.2	V512 K513 F545 F579	E509-V512 PolarHBondContact O-N 3.01Å; E509-K513 WeakPolarHBondContact O-CB 3.46Å; E509-K513 PolarHBondContact O-N 2.94Å; E509-F545 HydrophobicContact CB-CD1 4.21Å; E509-F545 HydrophobicContact CB-CE1 4.17Å; E509-F579 HydrophobicContact CB-CG 4.45Å; E509-F579 HydrophobicContact CG-CB 4.32Å; E509-F579 HydrophobicContact CG-CD1 4.01Å; E509-F579 HydrophobicContact CG-CD2 3.46Å; E509-F579 VanDerWaalsContact CG-CD2 3.46Å; E509-F579 HydrophobicContact CG-CE1 4.1Å; E509-F579 HydrophobicContact CG-CE2 3.56Å; E509-F579 HydrophobicContact CG-CG 3.68Å; E509-F579 HydrophobicContact CG-CZ 3.87Å; E509-F579 WeakPolarHBondContact OE1-CD2 3.32Å; E509-F579 VanDerWaalsContact OE1-CE2 3.29Å; E509-F579 WeakPolarHBondContact OE1-CE2 3.33Å
510	L	79	Confident	85.8	Confident	112 Å²	112	31 Å²	31	59%	0.586	15%	0.145	S	C	*	.	H	α-helix	trans	-63.4	-45.2	-178.8	-168.8	68.4	0	0	0	111.8	T508 V512 K513 R514 E935	T508-L510 VanDerWaalsContact C-N 3.27Å; T508-L510 PolarHBondContact O-N 3.42Å; L510-V512 PolarHBondContact O-N 3.26Å; L510-K513 WeakPolarHBondContact O-CB 3.46Å; L510-K513 PolarHBondContact O-N 2.7Å; L510-R514 PolarHBondContact O-N 2.91Å; L510-E935 WeakPolarHBondContact CG-OE2 3.29Å
511	S	83.6	Confident	86	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-55.5	-52.4	175.8	-175	0	0	0	0	111.4	T508 K513 R514 I515 E935	T508-S511 PolarHBondContact O-N 3.45Å; T508-S511 WeakPolarHBondContact OG1-CB 3.43Å; T508-S511 PolarHBondContact OG1-N 3.26Å; T508-S511 VanDerWaalsContact OG1-N 3.13Å; S511-K513 VanDerWaalsContact C-N 3.3Å; S511-K513 PolarHBondContact O-N 3.04Å; S511-R514 PolarHBondContact O-N 3.45Å; S511-I515 WeakPolarHBondContact O-CG1 3.35Å; S511-I515 PolarHBondContact O-N 3.01Å; S511-E935 PolarHBondContact N-OE2 3.17Å; S511-E935 PolarHBondContact OG-N 3.03Å
512	V	85.8	Confident	86	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61	-41.1	-179.4	173.5	0	0	0	0	110.9	T504 T508 E509 L510 I515 L516 F545 A547 F579	T504-V512 HydrophobicContact CG2-CG1 4.26Å; T508-V512 PolarHBondContact O-N 3.44Å; E509-V512 PolarHBondContact O-N 3.01Å; L510-V512 PolarHBondContact O-N 3.26Å; V512-I515 PolarHBondContact O-N 2.82Å; V512-L516 HydrophobicContact CG1-CD1 4.5Å; V512-L516 WeakPolarHBondContact O-CG 3.35Å; V512-L516 PolarHBondContact O-N 2.74Å; V512-L516 VanDerWaalsContact O-N 3.12Å; V512-F545 HydrophobicContact CG2-CB 3.8Å; V512-A547 HydrophobicContact CG1-CB 3.43Å; V512-A547 VanDerWaalsContact CG1-CB 3.43Å; V512-F579 HydrophobicContact CB-CD1 4.4Å; V512-F579 HydrophobicContact CB-CE1 4.33Å; V512-F579 HydrophobicContact CG1-CD1 4.03Å; V512-F579 HydrophobicContact CG1-CE1 4.02Å
513	K	83.3	Confident	85.8	Confident	87 Å²	87	41.8 Å²	41.8	38%	0.378	19%	0.193	S	C	.	.	H	α-helix	trans	-62.6	-47.6	176.1	-170.1	-177	175.6	-175.9	0	112.3	E509 L510 S511 I515 L516 D517 M577 F579	E509-K513 WeakPolarHBondContact O-CB 3.46Å; E509-K513 PolarHBondContact O-N 2.94Å; L510-K513 WeakPolarHBondContact O-CB 3.46Å; L510-K513 PolarHBondContact O-N 2.7Å; S511-K513 VanDerWaalsContact C-N 3.3Å; S511-K513 PolarHBondContact O-N 3.04Å; K513-I515 VanDerWaalsContact C-N 3.31Å; K513-I515 PolarHBondContact O-N 3.34Å; K513-L516 PolarHBondContact O-N 2.85Å; K513-D517 VanDerWaalsContact O-CG 3.31Å; K513-D517 PolarHBondContact O-N 2.87Å; K513-M577 HydrophobicContact CG-CE 4.47Å; K513-F579 HydrophobicContact CB-CE1 4.14Å; K513-F579 HydrophobicContact CB-CZ 3.88Å; K513-F579 HydrophobicContact CD-CZ 4.49Å; K513-F579 HydrophobicContact CG-CZ 4.22Å
514	R	84.9	Confident	85.4	Confident	86 Å²	86	47.4 Å²	47.4	33%	0.325	22%	0.223	S	C	.	.	H	α-helix	trans	-59.8	-40.8	179.1	-176.5	174.9	177.4	171	-2.2	111.9	L510 S511 D517 E518 P932 E935	L510-R514 PolarHBondContact O-N 2.91Å; S511-R514 PolarHBondContact O-N 3.45Å; R514-D517 PolarHBondContact O-N 2.76Å; R514-E518 PolarHBondContact O-N 3Å; R514-E518 VanDerWaalsContact O-N 3.13Å; R514-P932 VanDerWaalsContact CZ-O 3.27Å; R514-P932 PolarHBondContact NH2-O 3.09Å; R514-E935 WeakPolarHBondContact CD-OE1 3.17Å; R514-E935 IonicContact CZ-OE1 2.94Å; R514-E935 IonicContact NE-OE1 2.69Å; R514-E935 IonicContact NH1-OE1 3.31Å; R514-E935 PolarHBondContact NH1-OE1 2.67Å
515	I	88.8	Confident	85.2	Confident	5 Å²	5	49.3 Å²	49.3	3%	0.026	23%	0.233	C	C	.	.	H	α-helix	trans	-66.4	-40.5	177	-61.8	160.8	0	0	0	111.4	F502 T504 S511 V512 K513 A519 L532 L933	F502-I515 HydrophobicContact CE1-CG2 4Å; F502-I515 HydrophobicContact CZ-CG2 3.83Å; T504-I515 HydrophobicContact CG2-CG2 4.27Å; T504-I515 VanDerWaalsContact OG1-CG2 3.28Å; T504-I515 WeakPolarHBondContact OG1-CG2 3.36Å; S511-I515 WeakPolarHBondContact O-CG1 3.35Å; S511-I515 PolarHBondContact O-N 3.01Å; V512-I515 PolarHBondContact O-N 2.82Å; K513-I515 VanDerWaalsContact C-N 3.31Å; K513-I515 PolarHBondContact O-N 3.34Å; I515-A519 VanDerWaalsContact O-CB 3.31Å; I515-A519 WeakPolarHBondContact O-CB 3.48Å; I515-A519 PolarHBondContact O-N 2.6Å; I515-L532 HydrophobicContact CG2-CD1 4.25Å; I515-L532 HydrophobicContact CG2-CD2 3.97Å; I515-L933 HydrophobicContact CG1-CB 4.11Å; I515-L933 WeakPolarHBondContact CG1-O 3.35Å
516	L	87.3	Confident	84.9	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-42.1	173.8	-69.3	174.6	0	0	0	112.4	F502 T504 V512 K513 E518 A519 E520 A547 A549 M577	F502-L516 HydrophobicContact CD1-CD2 4.04Å; F502-L516 HydrophobicContact CE1-CD2 4.22Å; T504-L516 HydrophobicContact CG2-CD2 3.58Å; T504-L516 HydrophobicContact CG2-CG 3.86Å; V512-L516 HydrophobicContact CG1-CD1 4.5Å; V512-L516 WeakPolarHBondContact O-CG 3.35Å; V512-L516 PolarHBondContact O-N 2.74Å; V512-L516 VanDerWaalsContact O-N 3.12Å; K513-L516 PolarHBondContact O-N 2.85Å; L516-E518 VanDerWaalsContact C-N 3.35Å; L516-E518 PolarHBondContact O-N 2.85Å; L516-A519 PolarHBondContact O-N 2.65Å; L516-E520 PolarHBondContact O-N 2.86Å; L516-A547 HydrophobicContact CD1-CB 3.88Å; L516-A549 HydrophobicContact CD2-CB 3.96Å; L516-M577 HydrophobicContact CD1-CE 3.97Å
517	D	86.5	Confident	84.7	Confident	54 Å²	54	52.3 Å²	52.3	29%	0.289	25%	0.249	S	C	.	.	H	α-helix	trans	-64.5	-36	-179.4	-69.8	-19.4	0	0	0	112.1	K513 R514 K521 R560	K513-D517 VanDerWaalsContact O-CG 3.31Å; K513-D517 PolarHBondContact O-N 2.87Å; R514-D517 PolarHBondContact O-N 2.76Å; D517-K521 VanDerWaalsContact O-CG 3.29Å; D517-K521 WeakPolarHBondContact O-CG 3.35Å; D517-K521 PolarHBondContact O-N 2.85Å; D517-R560 IonicContact OD1-CZ 2.77Å; D517-R560 IonicContact OD1-NH1 2.65Å; D517-R560 PolarHBondContact OD1-NH1 2.86Å; D517-R560 IonicContact OD1-NH2 2.84Å; D517-R560 PolarHBondContact OD1-NH2 2.91Å
518	E	88.7	Confident	84.8	Confident	46 Å²	46	51.1 Å²	51.1	22%	0.215	24%	0.244	C	C	.	.	H	α-helix	trans	-76.6	-36.9	172.4	-72.3	-55.5	131.2	0	0	113.5	R514 L516 E520 K521 R522 F528 L933	R514-E518 PolarHBondContact O-N 3Å; R514-E518 VanDerWaalsContact O-N 3.13Å; L516-E518 VanDerWaalsContact C-N 3.35Å; L516-E518 PolarHBondContact O-N 2.85Å; E518-E520 VanDerWaalsContact C-N 3.28Å; E518-E520 PolarHBondContact O-N 3.2Å; E518-K521 PolarHBondContact O-N 2.67Å; E518-K521 WeakPolarHBondContact OE1-CD 3.21Å; E518-K521 WeakPolarHBondContact OE1-CE 3.46Å; E518-K521 IonicContact OE1-NZ 2.74Å; E518-K521 PolarHBondContact OE1-NZ 2.93Å; E518-R522 WeakPolarHBondContact O-CB 3.49Å; E518-R522 PolarHBondContact O-N 3.35Å; E518-R522 IonicContact OE2-NE 2.82Å; E518-F528 HydrophobicContact CB-CE1 4.48Å; E518-F528 HydrophobicContact CB-CZ 4.28Å; E518-L933 HydrophobicContact CB-CD2 4.48Å; E518-L933 HydrophobicContact CG-CD2 3.84Å
519	A	86.9	Confident	84.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62	-35.3	176.2	0	0	0	0	0	112.5	F502 I515 L516 R522 S523 L529	F502-A519 HydrophobicContact CD1-CB 3.56Å; F502-A519 HydrophobicContact CD2-CB 4.34Å; F502-A519 HydrophobicContact CE1-CB 3.39Å; F502-A519 HydrophobicContact CE2-CB 4.2Å; F502-A519 HydrophobicContact CG-CB 4.04Å; F502-A519 HydrophobicContact CZ-CB 3.74Å; I515-A519 VanDerWaalsContact O-CB 3.31Å; I515-A519 WeakPolarHBondContact O-CB 3.48Å; I515-A519 PolarHBondContact O-N 2.6Å; L516-A519 PolarHBondContact O-N 2.65Å; A519-R522 CarbonylContact O-C 3.33Å; A519-R522 PolarHBondContact O-N 2.87Å; A519-S523 WeakPolarHBondContact O-CA 3.45Å; A519-S523 PolarHBondContact O-N 3.22Å; A519-S523 VanDerWaalsContact O-N 3.15Å; A519-L529 HydrophobicContact CB-CD2 3.72Å
520	E	86.1	Confident	85	Confident	45 Å²	45	46.1 Å²	46.1	21%	0.21	22%	0.221	C	C	.	.	H	α-helix	trans	-74	-38.9	174.8	-79.5	176.8	-166.1	0	0	113.1	L516 E518 R522 S523 L551 P558 R560	L516-E520 PolarHBondContact O-N 2.86Å; E518-E520 VanDerWaalsContact C-N 3.28Å; E518-E520 PolarHBondContact O-N 3.2Å; E520-R522 PolarHBondContact O-N 3.25Å; E520-S523 PolarHBondContact O-N 3.27Å; E520-L551 HydrophobicContact CG-CD2 3.49Å; E520-L551 VanDerWaalsContact CG-CD2 3.49Å; E520-P558 VanDerWaalsContact CD-CB 3.42Å; E520-P558 HydrophobicContact CG-CB 3.86Å; E520-P558 HydrophobicContact CG-CG 3.87Å; E520-P558 VanDerWaalsContact OE1-CB 3.25Å; E520-P558 WeakPolarHBondContact OE1-CB 3.49Å; E520-R560 VanDerWaalsContact CD-NE 3.29Å; E520-R560 WeakPolarHBondContact OE1-CG 3.26Å; E520-R560 IonicContact OE1-CZ 3.57Å; E520-R560 IonicContact OE1-NE 3.54Å; E520-R560 PolarHBondContact OE1-NE 2.84Å; E520-R560 IonicContact OE1-NH2 2.79Å; E520-R560 IonicContact OE2-CZ 3.73Å; E520-R560 IonicContact OE2-NE 3.91Å; E520-R560 PolarHBondContact OE2-NE 3.28Å; E520-R560 IonicContact OE2-NH2 3.37Å; E520-R560 PolarHBondContact OE2-NH2 3.33Å
521	K	86.2	Confident	85.4	Confident	149 Å²	149	41 Å²	41	65%	0.648	19%	0.194	S	C	*	.	H	α-helix	trans	-60.1	-29.4	171.8	-69.9	168.6	-163	174.9	0	112.4	D517 E518	D517-K521 VanDerWaalsContact O-CG 3.29Å; D517-K521 WeakPolarHBondContact O-CG 3.35Å; D517-K521 PolarHBondContact O-N 2.85Å; E518-K521 PolarHBondContact O-N 2.67Å; E518-K521 WeakPolarHBondContact OE1-CD 3.21Å; E518-K521 WeakPolarHBondContact OE1-CE 3.46Å; E518-K521 IonicContact OE1-NZ 2.74Å; E518-K521 PolarHBondContact OE1-NZ 2.93Å
522	R	86.7	Confident	85.6	Confident	100 Å²	100	41.1 Å²	41.1	38%	0.377	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.5	32.7	-175.3	-62.9	178.3	175.4	-88	1.5	112.5	E518 A519 E520 N524 D525 F528	E518-R522 WeakPolarHBondContact O-CB 3.49Å; E518-R522 PolarHBondContact O-N 3.35Å; E518-R522 IonicContact OE2-NE 2.82Å; A519-R522 CarbonylContact O-C 3.33Å; A519-R522 PolarHBondContact O-N 2.87Å; E520-R522 PolarHBondContact O-N 3.25Å; R522-N524 PolarHBondContact O-N 3.13Å; R522-D525 HydrophobicContact CB-CB 4.15Å; R522-D525 WeakPolarHBondContact O-CB 3.28Å; R522-D525 PolarHBondContact O-N 2.81Å; R522-F528 HydrophobicContact CB-CD1 3.82Å; R522-F528 HydrophobicContact CB-CE1 3.98Å; R522-F528 HydrophobicContact CG-CD1 4.42Å; R522-F528 HydrophobicContact CG-CE1 4.3Å
523	S	84.4	Confident	85.5	Confident	23 Å²	23	41.3 Å²	41.3	16%	0.161	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-15	-171.4	76.6	0	0	0	0	115.9	A519 E520 N552	A519-S523 WeakPolarHBondContact O-CA 3.45Å; A519-S523 PolarHBondContact O-N 3.22Å; A519-S523 VanDerWaalsContact O-N 3.15Å; E520-S523 PolarHBondContact O-N 3.27Å; S523-N552 WeakPolarHBondContact CB-OD1 3.41Å; S523-N552 PolarHBondContact O-ND2 3.11Å; S523-N552 PolarHBondContact O-OD1 3.39Å; S523-N552 PolarHBondContact OG-OD1 3.31Å
524	N	81.1	Confident	85.4	Confident	123 Å²	123	37.7 Å²	37.7	66%	0.658	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-2	175.9	-62.6	-65	0	0	0	113.8	R522 E526	R522-N524 PolarHBondContact O-N 3.13Å; N524-E526 PolarHBondContact O-N 3.35Å
525	D	84.8	Confident	85.5	Confident	40 Å²	40	33.8 Å²	33.8	21%	0.214	17%	0.169	C	C	.	.			trans	-89.2	81.3	177.8	-171.9	-18.5	0	0	0	110	R522 A527 F528 L529	R522-D525 HydrophobicContact CB-CB 4.15Å; R522-D525 WeakPolarHBondContact O-CB 3.28Å; R522-D525 PolarHBondContact O-N 2.81Å; D525-A527 PolarHBondContact O-N 3.35Å; D525-A527 PolarHBondContact OD1-N 3.43Å; D525-F528 HydrophobicContact CB-CB 3.95Å; D525-F528 PolarHBondContact O-N 2.82Å; D525-F528 WeakPolarHBondContact OD1-CB 3.48Å; D525-F528 PolarHBondContact OD1-N 3.37Å; D525-F528 WeakPolarHBondContact OD2-CB 3.44Å; D525-L529 VanDerWaalsContact O-CG 3.31Å; D525-L529 WeakPolarHBondContact O-CG 3.34Å; D525-L529 PolarHBondContact O-N 2.54Å
526	E	79.6	Confident	85.1	Confident	55 Å²	55	33.9 Å²	33.9	26%	0.257	17%	0.17	S	C	.	.	H	α-helix	trans	-63.1	-26.7	-176.2	-168.3	162.4	-125	0	0	112.8	R500 N524 S530 V919	R500-E526 IonicContact CZ-OE1 3.98Å; R500-E526 IonicContact NE-OE1 3.23Å; R500-E526 PolarHBondContact NE-OE1 3.01Å; R500-E526 IonicContact NH2-OE1 2.68Å; R500-E526 PolarHBondContact NH2-OE1 3.2Å; N524-E526 PolarHBondContact O-N 3.35Å; E526-S530 WeakPolarHBondContact O-CB 3.42Å; E526-S530 PolarHBondContact O-N 3.18Å; E526-V919 HydrophobicContact CG-CG2 3.93Å
527	A	84	Confident	84.7	Confident	12 Å²	12	34.4 Å²	34.4	10%	0.099	17%	0.173	C	C	.	.	H	α-helix	trans	-69.6	-46.5	175.5	0	0	0	0	0	112.1	D525 I531 V919 V923 T927	D525-A527 PolarHBondContact O-N 3.35Å; D525-A527 PolarHBondContact OD1-N 3.43Å; A527-I531 PolarHBondContact O-N 3.38Å; A527-I531 VanDerWaalsContact O-N 3.16Å; A527-V919 HydrophobicContact CB-CG1 4.47Å; A527-V923 HydrophobicContact CB-CB 4.12Å; A527-V923 HydrophobicContact CB-CG1 3.88Å; A527-T927 HydrophobicContact CB-CG2 4.07Å
528	F	88.1	Confident	84.4	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.009	16%	0.16	C	C	.	.	H	α-helix	trans	-62.9	-48.9	175.2	176.4	-112.2	0	0	0	111.8	E518 R522 D525 S530 I531 L532 T927 P928 I930 L933	E518-F528 HydrophobicContact CB-CE1 4.48Å; E518-F528 HydrophobicContact CB-CZ 4.28Å; R522-F528 HydrophobicContact CB-CD1 3.82Å; R522-F528 HydrophobicContact CB-CE1 3.98Å; R522-F528 HydrophobicContact CG-CD1 4.42Å; R522-F528 HydrophobicContact CG-CE1 4.3Å; D525-F528 HydrophobicContact CB-CB 3.95Å; D525-F528 PolarHBondContact O-N 2.82Å; D525-F528 WeakPolarHBondContact OD1-CB 3.48Å; D525-F528 PolarHBondContact OD1-N 3.37Å; D525-F528 WeakPolarHBondContact OD2-CB 3.44Å; F528-S530 VanDerWaalsContact C-N 3.33Å; F528-S530 PolarHBondContact O-N 3.18Å; F528-I531 PolarHBondContact O-N 3.31Å; F528-L532 HydrophobicContact CD1-CD1 3.98Å; F528-L532 HydrophobicContact CD2-CD1 4.29Å; F528-L532 HydrophobicContact CE1-CD1 3.5Å; F528-L532 VanDerWaalsContact CE1-CD1 3.5Å; F528-L532 HydrophobicContact CE2-CD1 3.84Å; F528-L532 HydrophobicContact CE2-CG 4.42Å; F528-L532 HydrophobicContact CG-CD1 4.37Å; F528-L532 HydrophobicContact CZ-CD1 3.43Å; F528-L532 VanDerWaalsContact CZ-CD1 3.43Å; F528-L532 HydrophobicContact CZ-CG 4.45Å; F528-L532 PolarHBondContact O-N 2.79Å; F528-T927 HydrophobicContact CB-CG2 3.89Å; F528-P928 HydrophobicContact CD2-CB 3.97Å; F528-P928 HydrophobicContact CD2-CG 3.92Å; F528-P928 HydrophobicContact CE2-CB 3.88Å; F528-P928 HydrophobicContact CE2-CG 4.13Å; F528-P928 HydrophobicContact CG-CG 4.5Å; F528-I930 HydrophobicContact CD2-CD1 3.87Å; F528-I930 HydrophobicContact CE2-CD1 3.87Å; F528-L933 HydrophobicContact CE2-CD1 3.94Å; F528-L933 HydrophobicContact CZ-CD1 3.71Å
529	L	87.1	Confident	83.9	Confident	8 Å²	8	31.7 Å²	31.7	4%	0.042	16%	0.163	C	C	.	.	H	α-helix	trans	-62.8	-38.1	-179.7	-66.3	171.7	0	0	0	112.3	F502 A519 D525 S533 L551 H913	F502-L529 HydrophobicContact CD2-CB 4.36Å; F502-L529 HydrophobicContact CD2-CD2 3.67Å; F502-L529 HydrophobicContact CE2-CD2 3.95Å; F502-L529 HydrophobicContact CG-CD2 4.22Å; A519-L529 HydrophobicContact CB-CD2 3.72Å; D525-L529 VanDerWaalsContact O-CG 3.31Å; D525-L529 WeakPolarHBondContact O-CG 3.34Å; D525-L529 PolarHBondContact O-N 2.54Å; L529-S533 VanDerWaalsContact O-CB 3.31Å; L529-S533 WeakPolarHBondContact O-CB 3.34Å; L529-S533 PolarHBondContact O-N 2.81Å; L529-L551 HydrophobicContact CD1-CD1 3.9Å; L529-L551 HydrophobicContact CD2-CD1 3.88Å; L529-H913 PolarHBondContact O-CE1 2.84Å
530	S	83.2	Confident	83.5	Confident	17 Å²	17	32 Å²	32	12%	0.119	17%	0.165	C	C	.	.	H	α-helix	trans	-71.5	-38.5	179.3	-164.2	0	0	0	0	113	E526 F528 G534 H913	E526-S530 WeakPolarHBondContact O-CB 3.42Å; E526-S530 PolarHBondContact O-N 3.18Å; F528-S530 VanDerWaalsContact C-N 3.33Å; F528-S530 PolarHBondContact O-N 3.18Å; S530-G534 PolarHBondContact O-N 3.37Å; S530-G534 VanDerWaalsContact O-N 3.09Å; S530-H913 WeakPolarHBondContact CA-CE1 3.38Å; S530-H913 PolarHBondContact OG-ND1 2.76Å
531	I	87.1	Confident	82.9	Confident	4 Å²	4	33.5 Å²	33.5	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-62.8	-53.3	171.8	-75.2	-178.8	0	0	0	110.7	R318 A527 F528 S533 G534 V535 V923 I930	R318-I531 HydrophobicContact CB-CD1 4.48Å; A527-I531 PolarHBondContact O-N 3.38Å; A527-I531 VanDerWaalsContact O-N 3.16Å; F528-I531 PolarHBondContact O-N 3.31Å; I531-S533 PolarHBondContact O-N 2.73Å; I531-G534 PolarHBondContact O-N 2.94Å; I531-G534 VanDerWaalsContact O-N 3.17Å; I531-V535 PolarHBondContact O-N 3.15Å; I531-V535 VanDerWaalsContact O-N 3.07Å; I531-V923 HydrophobicContact CD1-CB 4.23Å; I531-V923 HydrophobicContact CD1-CG1 3.64Å; I531-V923 HydrophobicContact CD1-CG2 3.6Å; I531-V923 HydrophobicContact CG1-CG1 4.17Å; I531-I930 HydrophobicContact CG2-CD1 3.9Å; I531-I930 HydrophobicContact CG2-CG1 3.66Å
532	L	87.8	Confident	82.6	Confident	5 Å²	5	28.4 Å²	28.4	3%	0.026	16%	0.16	C	C	.	.	H	α-helix	trans	-55	-51.8	-178.5	-90	173	0	0	0	112.4	F502 I515 F528 G534 V535 A536 I930 L933	F502-L532 HydrophobicContact CE2-CB 3.68Å; F502-L532 HydrophobicContact CE2-CD1 4.23Å; F502-L532 HydrophobicContact CZ-CB 3.87Å; F502-L532 HydrophobicContact CZ-CD1 3.97Å; F502-L532 HydrophobicContact CZ-CG 4.49Å; I515-L532 HydrophobicContact CG2-CD1 4.25Å; I515-L532 HydrophobicContact CG2-CD2 3.97Å; F528-L532 HydrophobicContact CD1-CD1 3.98Å; F528-L532 HydrophobicContact CD2-CD1 4.29Å; F528-L532 HydrophobicContact CE1-CD1 3.5Å; F528-L532 VanDerWaalsContact CE1-CD1 3.5Å; F528-L532 HydrophobicContact CE2-CD1 3.84Å; F528-L532 HydrophobicContact CE2-CG 4.42Å; F528-L532 HydrophobicContact CG-CD1 4.37Å; F528-L532 HydrophobicContact CZ-CD1 3.43Å; F528-L532 VanDerWaalsContact CZ-CD1 3.43Å; F528-L532 HydrophobicContact CZ-CG 4.45Å; F528-L532 PolarHBondContact O-N 2.79Å; L532-G534 VanDerWaalsContact C-N 3.3Å; L532-G534 PolarHBondContact O-N 2.73Å; L532-V535 WeakPolarHBondContact O-CG2 3.4Å; L532-V535 PolarHBondContact O-N 3.43Å; L532-A536 VanDerWaalsContact O-CB 3.32Å; L532-A536 WeakPolarHBondContact O-CB 3.3Å; L532-A536 PolarHBondContact O-N 3.49Å; L532-I930 HydrophobicContact CD2-CD1 4.36Å; L532-I930 HydrophobicContact CD2-CG2 3.7Å; L532-I930 HydrophobicContact CG-CD1 4.11Å; L532-L933 HydrophobicContact CD1-CD1 4.34Å; L532-L933 HydrophobicContact CD2-CD1 4.23Å
533	S	83.2	Confident	82.5	Confident	4 Å²	4	24 Å²	24	3%	0.028	14%	0.143	C	C	.	.	H	α-helix	trans	-65.4	-33.4	-179.2	164.3	0	0	0	0	112.3	L529 I531 N537 H913	L529-S533 VanDerWaalsContact O-CB 3.31Å; L529-S533 WeakPolarHBondContact O-CB 3.34Å; L529-S533 PolarHBondContact O-N 2.81Å; I531-S533 PolarHBondContact O-N 2.73Å; S533-N537 PolarHBondContact O-N 3.01Å; S533-H913 WeakPolarHBondContact CB-NE2 3.15Å; S533-H913 PolarHBondContact OG-NE2 3.01Å
534	G	82.2	Confident	82.3	Confident	11 Å²	11	23.7 Å²	23.7	11%	0.113	14%	0.141	C	C	.	.	H	α-helix	trans	-70.2	-34	177.1	0	0	0	0	0	114.2	N173 S530 I531 L532	N173-G534 PolarHBondContact ND2-O 2.87Å; S530-G534 PolarHBondContact O-N 3.37Å; S530-G534 VanDerWaalsContact O-N 3.09Å; I531-G534 PolarHBondContact O-N 2.94Å; I531-G534 VanDerWaalsContact O-N 3.17Å; L532-G534 VanDerWaalsContact C-N 3.3Å; L532-G534 PolarHBondContact O-N 2.73Å
535	V	85.8	Confident	82.5	Confident	4 Å²	4	19.6 Å²	19.6	2%	0.024	12%	0.117	C	C	.	.	H	α-helix	trans	-86.1	-26.2	177.5	-58.4	0	0	0	0	113.3	L168 I531 L532 N537 I930	L168-V535 HydrophobicContact CB-CG2 4.42Å; L168-V535 HydrophobicContact CD2-CB 3.77Å; L168-V535 HydrophobicContact CD2-CG1 4.48Å; L168-V535 HydrophobicContact CD2-CG2 4.25Å; I531-V535 PolarHBondContact O-N 3.15Å; I531-V535 VanDerWaalsContact O-N 3.07Å; L532-V535 WeakPolarHBondContact O-CG2 3.4Å; L532-V535 PolarHBondContact O-N 3.43Å; V535-N537 PolarHBondContact O-N 3.47Å; V535-I930 HydrophobicContact CG2-CG2 4.44Å
536	A	80.1	Confident	82.6	Confident	7 Å²	7	17.8 Å²	17.8	6%	0.058	11%	0.107	C	C	.	.	S	Bend	trans	-72.5	-8.5	171.2	0	0	0	0	0	114.1	S505 L532 V538	S505-A536 PolarHBondContact OG-O 3.24Å; L532-A536 VanDerWaalsContact O-CB 3.32Å; L532-A536 WeakPolarHBondContact O-CB 3.3Å; L532-A536 PolarHBondContact O-N 3.49Å; A536-V538 PolarHBondContact O-N 2.99Å
537	N	80.4	Confident	82.9	Confident	14 Å²	14	15.4 Å²	15.4	8%	0.075	10%	0.097	C	C	.	.			trans	-84.6	55.8	-179.6	-154.2	25.3	0	0	0	112.4	N173 S533 V535 S909 L910 D911	N173-N537 PolarHBondContact ND2-O 3.01Å; S533-N537 PolarHBondContact O-N 3.01Å; V535-N537 PolarHBondContact O-N 3.47Å; N537-S909 WeakPolarHBondContact OD1-CA 3.34Å; N537-S909 WeakPolarHBondContact OD1-CB 3.38Å; N537-L910 PolarHBondContact ND2-N 2.88Å; N537-L910 PolarHBondContact OD1-N 3.02Å; N537-D911 PolarHBondContact ND2-OD1 2.84Å
538	V	79.2	Confident	83.1	Confident	1 Å²	1	14.9 Å²	14.9	1%	0.006	9%	0.093	C	C	.	.			trans	-99.9	170.4	175	-64.2	0	0	0	0	111.1	V175 A536 M542 Y543 R546	V175-V538 HydrophobicContact CG2-CB 4.3Å; V175-V538 HydrophobicContact CG2-CG1 4.05Å; A536-V538 PolarHBondContact O-N 2.99Å; V538-M542 HydrophobicContact CG2-CB 4.43Å; V538-Y543 HydrophobicContact CG2-CD1 4.48Å; V538-Y543 HydrophobicContact CG2-CD2 3.45Å; V538-Y543 VanDerWaalsContact CG2-CD2 3.45Å; V538-Y543 HydrophobicContact CG2-CE2 4.17Å; V538-Y543 HydrophobicContact CG2-CG 3.64Å; V538-R546 PolarHBondContact O-NH2 2.98Å
539	P	78.5	Confident	83.1	Confident	42 Å²	42	14.8 Å²	14.8	27%	0.273	9%	0.092	S	C	.	.			trans	-63.2	152.7	174.4	-24.7	36.2	0	0	0	114.1	V175 S541 M542 Y543 R546	V175-P539 HydrophobicContact CG1-CG 4.36Å; P539-S541 VanDerWaalsContact C-N 3.26Å; P539-S541 PolarHBondContact O-N 3.45Å; P539-M542 PolarHBondContact O-N 3.22Å; P539-M542 VanDerWaalsContact O-N 3.12Å; P539-Y543 PolarHBondContact O-N 3.41Å; P539-R546 VanDerWaalsContact C-NH2 3.27Å; P539-R546 PolarHBondContact O-NH2 2.89Å
540	A	77.3	Confident	83.1	Confident	6 Å²	6	14.4 Å²	14.4	5%	0.05	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-21.8	-176.6	0	0	0	0	0	113.8	M542 Y543 P544 R546 Y582	A540-M542 VanDerWaalsContact C-N 3.32Å; A540-Y543 CarbonylContact O-C 3.46Å; A540-P544 VanDerWaalsContact O-CA 3.22Å; A540-P544 WeakPolarHBondContact O-CA 3.37Å; A540-R546 VanDerWaalsContact CA-NH2 3.33Å; A540-Y582 HydrophobicContact CB-CD1 3.61Å; A540-Y582 HydrophobicContact CB-CD2 3.76Å; A540-Y582 HydrophobicContact CB-CE1 3.77Å; A540-Y582 HydrophobicContact CB-CE2 3.92Å; A540-Y582 HydrophobicContact CB-CG 3.6Å
541	S	73.9	Confident	83.3	Confident	76 Å²	76	13.6 Å²	13.6	53%	0.531	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-28.4	170.7	51.6	0	0	0	0	113.5	P539	P539-S541 VanDerWaalsContact C-N 3.26Å; P539-S541 PolarHBondContact O-N 3.45Å
542	M	79.6	Confident	83.1	Confident	43 Å²	43	15.2 Å²	15.2	21%	0.212	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-56.2	176.3	-80.8	-173.8	165.7	0	0	111.7	F141 V175 R507 V538 P539 A540 P544	F141-M542 HydrophobicContact CE2-CB 4.01Å; F141-M542 HydrophobicContact CE2-CG 4.26Å; V175-M542 HydrophobicContact CG2-SD 3.67Å; R507-M542 WeakPolarHBondContact CD-O 3.3Å; R507-M542 PolarHBondContact NH1-O 3.45Å; V538-M542 HydrophobicContact CG2-CB 4.43Å; P539-M542 PolarHBondContact O-N 3.22Å; P539-M542 VanDerWaalsContact O-N 3.12Å; A540-M542 VanDerWaalsContact C-N 3.32Å; M542-P544 VanDerWaalsContact O-CD 3.32Å; M542-P544 WeakPolarHBondContact O-CD 3.25Å
543	Y	84.4	Confident	82.9	Confident	7 Å²	7	16.8 Å²	16.8	3%	0.027	10%	0.099	C	C	.	.			trans	-112.8	92.6	176.7	-73.4	-4.3	0	0	0	109.5	F141 S505 G506 R507 V538 P539 A540 R546	F141-Y543 HydrophobicContact CD2-CE1 4.44Å; F141-Y543 AromaticContact CE2-CD1 3.99Å; F141-Y543 HydrophobicContact CE2-CD1 3.99Å; F141-Y543 AromaticContact CE2-CE1 3.67Å; F141-Y543 HydrophobicContact CE2-CE1 3.67Å; F141-Y543 HydrophobicContact CZ-CE1 4.11Å; S505-Y543 WeakPolarHBondContact O-CD2 3.44Å; S505-Y543 WeakPolarHBondContact OG-CB 3.45Å; S505-Y543 WeakPolarHBondContact OG-CD2 3.19Å; G506-Y543 CarbonylContact O-C 3.58Å; G506-Y543 WeakPolarHBondContact O-CA 3.33Å; R507-Y543 HydrophobicContact CG-CD1 3.98Å; R507-Y543 HydrophobicContact CG-CE1 3.78Å; V538-Y543 HydrophobicContact CG2-CD1 4.48Å; V538-Y543 HydrophobicContact CG2-CD2 3.45Å; V538-Y543 VanDerWaalsContact CG2-CD2 3.45Å; V538-Y543 HydrophobicContact CG2-CE2 4.17Å; V538-Y543 HydrophobicContact CG2-CG 3.64Å; P539-Y543 PolarHBondContact O-N 3.41Å; A540-Y543 CarbonylContact O-C 3.46Å; Y543-R546 PolarHBondContact O-NE 3.06Å
544	P	81.6	Confident	82.4	Confident	17 Å²	17	19.9 Å²	19.9	11%	0.11	13%	0.131	C	C	.	.			trans	-83	-16.4	-173.7	32.8	-36.5	0	0	0	113.8	A540 M542 K581 Y582	A540-P544 VanDerWaalsContact O-CA 3.22Å; A540-P544 WeakPolarHBondContact O-CA 3.37Å; M542-P544 VanDerWaalsContact O-CD 3.32Å; M542-P544 WeakPolarHBondContact O-CD 3.25Å; P544-K581 HydrophobicContact CB-CG 4.43Å; P544-K581 CarbonylContact O-C 3.45Å; P544-K581 WeakPolarHBondContact O-CA 3.05Å; P544-Y582 WeakPolarHBondContact O-CB 3.18Å; P544-Y582 PolarHBondContact O-N 3Å
545	F	85.7	Confident	81.8	Confident	37 Å²	37	27.9 Å²	27.9	16%	0.162	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	126.4	172.5	-67.9	-94.4	0	0	0	109.2	S505 G506 R507 E509 V512 K581	S505-F545 CarbonylContact C-O 3.52Å; S505-F545 WeakPolarHBondContact CA-O 3.23Å; S505-F545 VanDerWaalsContact CB-O 3.3Å; S505-F545 WeakPolarHBondContact CB-O 3.36Å; G506-F545 PolarHBondContact N-O 2.96Å; G506-F545 PolarHBondContact O-N 3.32Å; R507-F545 WeakPolarHBondContact O-CD2 2.94Å; R507-F545 WeakPolarHBondContact O-CE2 3.33Å; E509-F545 HydrophobicContact CB-CD1 4.21Å; E509-F545 HydrophobicContact CB-CE1 4.17Å; V512-F545 HydrophobicContact CG2-CB 3.8Å; F545-K581 HydrophobicContact CD1-CB 4.33Å; F545-K581 HydrophobicContact CE1-CB 4.04Å; F545-K581 HydrophobicContact CE1-CG 4.39Å; F545-K581 HydrophobicContact CE2-CD 4.38Å; F545-K581 HydrophobicContact CE2-CG 4.38Å; F545-K581 HydrophobicContact CZ-CB 4.32Å; F545-K581 HydrophobicContact CZ-CD 4.01Å; F545-K581 HydrophobicContact CZ-CG 4.18Å
546	R	85.4	Confident	81.1	Confident	1 Å²	1	32.8 Å²	32.8	0%	0.004	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	140.6	-173.9	-61	-166.5	168.2	-133.6	-19.9	112.8	V538 P539 A540 Y543 Q580 H904 Q905 G907 L908	V538-R546 PolarHBondContact O-NH2 2.98Å; P539-R546 VanDerWaalsContact C-NH2 3.27Å; P539-R546 PolarHBondContact O-NH2 2.89Å; A540-R546 VanDerWaalsContact CA-NH2 3.33Å; Y543-R546 PolarHBondContact O-NE 3.06Å; R546-Q580 PolarHBondContact N-O 2.89Å; R546-H904 WeakPolarHBondContact CD-O 3.45Å; R546-H904 PolarHBondContact NH1-CE1 3.47Å; R546-H904 PolarHBondContact NH1-ND1 3.45Å; R546-Q905 HydrophobicContact CB-CG 4.42Å; R546-Q905 PolarHBondContact O-NE2 3.18Å; R546-Q905 VanDerWaalsContact O-NE2 3.11Å; R546-G907 PolarHBondContact NH1-O 2.91Å; R546-G907 VanDerWaalsContact NH1-O 3.15Å; R546-L908 PolarHBondContact NH1-O 3.48Å; R546-L908 VanDerWaalsContact NH1-O 3.07Å
547	A	86.1	Confident	80.7	Confident	6 Å²	6	36.9 Å²	36.9	5%	0.05	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	170.7	177.5	0	0	0	0	0	113	T504 V512 L516	T504-A547 PolarHBondContact N-O 3.11Å; T504-A547 PolarHBondContact O-N 2.71Å; T504-A547 VanDerWaalsContact O-O 3.06Å; V512-A547 HydrophobicContact CG1-CB 3.43Å; V512-A547 VanDerWaalsContact CG1-CB 3.43Å; L516-A547 HydrophobicContact CD1-CB 3.88Å
548	Y	88.3	Confident	80.2	Confident	1 Å²	1	38.9 Å²	38.9	0%	0.004	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	158.7	173.8	71.9	-87.8	0	0	0	111	L501 F502 I550 N561 Q898 G901 R902 Q905	L501-Y548 HydrophobicContact CD1-CD2 3.77Å; L501-Y548 HydrophobicContact CD1-CG 4.23Å; F502-Y548 CarbonylContact O-C 3.55Å; F502-Y548 WeakPolarHBondContact O-CA 3.4Å; F502-Y548 WeakPolarHBondContact O-CB 3.32Å; Y548-I550 HydrophobicContact CD2-CG1 4.31Å; Y548-I550 HydrophobicContact CE2-CD1 4.36Å; Y548-I550 HydrophobicContact CE2-CG1 4.32Å; Y548-N561 HydrophobicContact CD1-CB 4.49Å; Y548-N561 HydrophobicContact CE1-CB 3.8Å; Y548-N561 PolarHBondContact OH-OD1 3.22Å; Y548-Q898 HydrophobicContact CE2-CG 4.31Å; Y548-G901 WeakPolarHBondContact CD1-O 3.27Å; Y548-G901 VanDerWaalsContact CE1-C 3.49Å; Y548-R902 HydrophobicContact CE1-CG 4.1Å; Y548-Q905 HydrophobicContact CD1-CG 4.17Å
549	A	88.1	Confident	79.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	146.1	166.6	0	0	0	0	0	110.2	F502 L516 L551 R560	F502-A549 PolarHBondContact N-O 3.16Å; F502-A549 PolarHBondContact O-N 3.36Å; L516-A549 HydrophobicContact CD2-CB 3.96Å; A549-L551 HydrophobicContact CB-CD2 4.09Å; A549-R560 HydrophobicContact CB-CG 4.31Å
550	I	88.1	Confident	79.4	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	110.8	173	-56.8	174.2	0	0	0	108	Q499 R500 L501 Y548 R553 P558 L559 L897 Q898	Q499-I550 HydrophobicContact CG-CG2 3.94Å; Q499-I550 VanDerWaalsContact NE2-CG2 3.27Å; R500-I550 WeakPolarHBondContact O-CA 3.47Å; L501-I550 HydrophobicContact CD1-CG1 4.13Å; Y548-I550 HydrophobicContact CD2-CG1 4.31Å; Y548-I550 HydrophobicContact CE2-CD1 4.36Å; Y548-I550 HydrophobicContact CE2-CG1 4.32Å; I550-R553 HydrophobicContact CG2-CG 3.86Å; I550-R553 WeakPolarHBondContact O-CD 3.44Å; I550-P558 WeakPolarHBondContact O-CA 3.35Å; I550-L559 HydrophobicContact CB-CB 4.21Å; I550-L559 PolarHBondContact N-O 3.49Å; I550-L559 VanDerWaalsContact N-O 3.07Å; I550-L559 PolarHBondContact O-N 3.08Å; I550-L897 HydrophobicContact CD1-CB 3.81Å; I550-L897 HydrophobicContact CG1-CB 4.19Å; I550-L897 HydrophobicContact CG2-CD1 4.26Å; I550-Q898 HydrophobicContact CD1-CB 4.37Å; I550-Q898 HydrophobicContact CD1-CG 3.53Å
551	L	86.7	Confident	78.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	160.7	-172.4	-54.4	-177.2	0	0	0	111.7	Q499 R500 F502 E520 L529 A549 R553 P558	Q499-L551 WeakPolarHBondContact CA-O 3.16Å; R500-L551 PolarHBondContact N-O 2.92Å; R500-L551 PolarHBondContact O-N 3.28Å; F502-L551 HydrophobicContact CB-CD1 3.87Å; F502-L551 HydrophobicContact CB-CG 4.24Å; E520-L551 HydrophobicContact CG-CD2 3.49Å; E520-L551 VanDerWaalsContact CG-CD2 3.49Å; L529-L551 HydrophobicContact CD1-CD1 3.9Å; L529-L551 HydrophobicContact CD2-CD1 3.88Å; A549-L551 HydrophobicContact CB-CD2 4.09Å; L551-R553 PolarHBondContact O-N 3.45Å; L551-P558 HydrophobicContact CD2-CB 4.34Å
552	N	83.6	Confident	77.1	Confident	38 Å²	38	42.7 Å²	42.7	20%	0.203	24%	0.24	C	C	.	.			trans	56.7	44.4	172.3	-54	-27	0	0	0	114.9	N498 S523 G554	N498-N552 HydrophobicContact CB-CB 4.09Å; N498-N552 WeakPolarHBondContact O-CB 3.37Å; N498-N552 PolarHBondContact O-ND2 2.98Å; S523-N552 WeakPolarHBondContact CB-OD1 3.41Å; S523-N552 PolarHBondContact O-ND2 3.11Å; S523-N552 PolarHBondContact O-OD1 3.39Å; S523-N552 PolarHBondContact OG-OD1 3.31Å; N552-G554 PolarHBondContact O-N 3.45Å
553	R	82	Confident	75.2	Confident	37 Å²	37	46.9 Å²	46.9	14%	0.14	26%	0.259	C	S	.	.			trans	-81.4	37.7	-177.2	-58.9	-177.4	66	-101.5	-12.3	113.7	Q499 I550 L551 Q556 P557 D894	Q499-R553 HydrophobicContact CG-CG 4.36Å; I550-R553 HydrophobicContact CG2-CG 3.86Å; I550-R553 WeakPolarHBondContact O-CD 3.44Å; L551-R553 PolarHBondContact O-N 3.45Å; R553-Q556 HydrophobicContact CB-CB 4.22Å; R553-Q556 VanDerWaalsContact CZ-OE1 3.3Å; R553-Q556 VanDerWaalsContact NH1-CB 3.34Å; R553-Q556 PolarHBondContact O-N 3.01Å; R553-P557 PolarHBondContact NH1-O 3.12Å; R553-D894 IonicContact CZ-OD1 2.94Å; R553-D894 IonicContact CZ-OD2 2.68Å; R553-D894 IonicContact NE-OD1 2.66Å; R553-D894 PolarHBondContact NE-OD1 2.93Å; R553-D894 IonicContact NE-OD2 2.67Å; R553-D894 VanDerWaalsContact NH2-CG 3.29Å; R553-D894 IonicContact NH2-OD1 3.5Å; R553-D894 PolarHBondContact NH2-OD1 3.07Å; R553-D894 IonicContact NH2-OD2 3.65Å; R553-D894 PolarHBondContact NH2-OD2 3.04Å
554	G	74.5	Confident	72.4	Confident	69 Å²	69	50.3 Å²	50.3	71%	0.711	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	-131.9	-172.4	0	0	0	0	0	111.6	N552 Q556	N552-G554 PolarHBondContact O-N 3.45Å; G554-Q556 PolarHBondContact O-N 3.15Å
555	D	69.7	Low	69.8	Low	179 Å²	179	54.1 Å²	54.1	96%	0.957	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-5.4	177.4	-57.3	-45.1	0	0	0	113.8
556	Q	70	Confident	67	Low	107 Å²	107	60 Å²	60	50%	0.5	35%	0.347	S	S	.	.	S	Bend	trans	-88.1	145.3	176.1	-65	-162.9	4.3	0	0	111.9	R553 G554	R553-Q556 HydrophobicContact CB-CB 4.22Å; R553-Q556 VanDerWaalsContact CZ-OE1 3.3Å; R553-Q556 VanDerWaalsContact NH1-CB 3.34Å; R553-Q556 PolarHBondContact O-N 3.01Å; G554-Q556 PolarHBondContact O-N 3.15Å
557	P	72.6	Confident	64.3	Low	94 Å²	94	70.9 Å²	70.9	61%	0.61	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-63.3	160.3	177.2	27.5	-35.8	0	0	0	112.3	R553 L559	R553-P557 PolarHBondContact NH1-O 3.12Å; P557-L559 PolarHBondContact O-N 3.29Å
558	P	69.3	Low	61.4	Low	56 Å²	56	73.4 Å²	73.4	36%	0.364	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-52	134.6	170.5	-26.5	35.6	0	0	0	111.9	E520 I550 L551 R560	E520-P558 VanDerWaalsContact CD-CB 3.42Å; E520-P558 HydrophobicContact CG-CB 3.86Å; E520-P558 HydrophobicContact CG-CG 3.87Å; E520-P558 VanDerWaalsContact OE1-CB 3.25Å; E520-P558 WeakPolarHBondContact OE1-CB 3.49Å; I550-P558 WeakPolarHBondContact O-CA 3.35Å; L551-P558 HydrophobicContact CD2-CB 4.34Å; P558-R560 PolarHBondContact O-N 3.13Å
559	L	73.5	Confident	58.5	Low	29 Å²	29	81.9 Å²	81.9	15%	0.152	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	93.6	-177.8	-157.2	168.3	0	0	0	108.9	I550 P557 Q898	I550-L559 HydrophobicContact CB-CB 4.21Å; I550-L559 PolarHBondContact N-O 3.49Å; I550-L559 VanDerWaalsContact N-O 3.07Å; I550-L559 PolarHBondContact O-N 3.08Å; P557-L559 PolarHBondContact O-N 3.29Å; L559-Q898 HydrophobicContact CD2-CG 4.33Å
560	R	68.2	Low	55.8	Low	50 Å²	50	91.3 Å²	91.3	19%	0.189	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	148.5	165.4	-57	-171.2	-171.9	-166.7	1.9	109.6	D517 E520 A549 P558 I562	D517-R560 IonicContact OD1-CZ 2.77Å; D517-R560 IonicContact OD1-NH1 2.65Å; D517-R560 PolarHBondContact OD1-NH1 2.86Å; D517-R560 IonicContact OD1-NH2 2.84Å; D517-R560 PolarHBondContact OD1-NH2 2.91Å; E520-R560 VanDerWaalsContact CD-NE 3.29Å; E520-R560 WeakPolarHBondContact OE1-CG 3.26Å; E520-R560 IonicContact OE1-CZ 3.57Å; E520-R560 IonicContact OE1-NE 3.54Å; E520-R560 PolarHBondContact OE1-NE 2.84Å; E520-R560 IonicContact OE1-NH2 2.79Å; E520-R560 IonicContact OE2-CZ 3.73Å; E520-R560 IonicContact OE2-NE 3.91Å; E520-R560 PolarHBondContact OE2-NE 3.28Å; E520-R560 IonicContact OE2-NH2 3.37Å; E520-R560 PolarHBondContact OE2-NH2 3.33Å; A549-R560 HydrophobicContact CB-CG 4.31Å; P558-R560 PolarHBondContact O-N 3.13Å; R560-I562 PolarHBondContact O-N 3.29Å
561	N	61.1	Low	53	Low	26 Å²	26	95.5 Å²	95.5	14%	0.139	54%	0.537	C	S	.	.			trans	-46.1	118.2	-168.9	-174.3	31.7	0	0	0	114.9	Y548 Q905	Y548-N561 HydrophobicContact CD1-CB 4.49Å; Y548-N561 HydrophobicContact CE1-CB 3.8Å; Y548-N561 PolarHBondContact OH-OD1 3.22Å; N561-Q905 PolarHBondContact ND2-OE1 3.42Å; N561-Q905 VanDerWaalsContact ND2-OE1 3.16Å
562	I	40.7	Very low	50.3	Low	100 Å²	100	105.4 Å²	105.4	51%	0.513	58%	0.58	S	S	.	*			trans	-110.3	129.3	170.1	-65.1	172.8	0	0	0	108.9	R560 A564 R902	R560-I562 PolarHBondContact O-N 3.29Å; I562-A564 HydrophobicContact CG2-CB 4.31Å; I562-R902 PolarHBondContact O-NH2 3.02Å
563	Q	39.6	Very low	47.8	Very low	130 Å²	130	112 Å²	112	61%	0.607	61%	0.61	S	S	*	*			trans	-137.4	59.6	159.8	-161.6	172.2	-11.1	0	0	112.1	C565	Q563-C565 HydrophobicContact CG-CB 3.82Å; Q563-C565 PolarHBondContact O-N 3.33Å
564	A	26.8	Very low	45.4	Very low	79 Å²	79	119.4 Å²	119.4	65%	0.653	64%	0.639	S	S	*	*			trans	-71.6	80.2	159.6	0	0	0	0	0	109.1	I562	I562-A564 HydrophobicContact CG2-CB 4.31Å
565	C	27.2	Very low	43.4	Very low	98 Å²	98	120.7 Å²	120.7	66%	0.662	64%	0.643	S	S	*	*			trans	-142.1	41.4	-171.8	-147.1	0	0	0	0	113.8	Q563	Q563-C565 HydrophobicContact CG-CB 3.82Å; Q563-C565 PolarHBondContact O-N 3.33Å
566	L	27	Very low	41.8	Very low	160 Å²	160	121.5 Å²	121.5	84%	0.838	63%	0.634	S	S	*	*	S	Bend	trans	-156	0.7	166.2	-117.1	163.7	0	0	0	115.9
567	Y	27	Very low	40.6	Very low	229 Å²	229	119.6 Å²	119.6	90%	0.898	63%	0.626	S	S	*	*	S	Bend	trans	-129.8	139	172.9	-79.7	-82.1	0	0	0	111.9
568	G	26	Very low	39.4	Very low	60 Å²	60	119.4 Å²	119.4	62%	0.619	62%	0.623	S	S	*	*			trans	-83.9	154.6	-175.8	0	0	0	0	0	115	F570	G568-F570 VanDerWaalsContact C-N 3.32Å; G568-F570 PolarHBondContact O-N 3.34Å
569	L	28.2	Very low	38.6	Very low	179 Å²	179	118.2 Å²	118.2	94%	0.937	61%	0.612	S	S	*	*	S	Bend	trans	62.7	-18.2	154.5	-75.9	160.7	0	0	0	121.3
570	F	29.9	Very low	37.8	Very low	198 Å²	198	121.5 Å²	121.5	87%	0.868	63%	0.627	S	S	*	*			trans	-115.5	-8.9	-171.6	-82	-78.1	0	0	0	118.4	G568 K572	G568-F570 VanDerWaalsContact C-N 3.32Å; G568-F570 PolarHBondContact O-N 3.34Å; F570-K572 PolarHBondContact O-N 2.67Å
571	A	29.2	Very low	37.6	Very low	87 Å²	87	125.3 Å²	125.3	72%	0.719	64%	0.644	S	S	*	*			trans	-86.9	93	-178.8	0	0	0	0	0	112.8
572	K	29.5	Very low	37.6	Very low	209 Å²	209	125.4 Å²	125.4	91%	0.909	64%	0.643	S	S	*	*	S	Bend	trans	-137.4	10.3	176.4	-132.1	-178.7	-173	-178.2	0	117.3	F570	F570-K572 PolarHBondContact O-N 2.67Å
573	Q	31.3	Very low	38.3	Very low	175 Å²	175	126.2 Å²	126.2	82%	0.818	66%	0.658	S	S	*	*	S	Bend	trans	-142.6	-6.6	-175.6	-142.8	167.6	4.6	0	0	117.2
574	Y	31.3	Very low	39	Very low	194 Å²	194	122.2 Å²	122.2	76%	0.761	64%	0.644	S	S	*	*			trans	-134	107.5	173.8	-68.9	-79.9	0	0	0	110.8	Y576	Y574-Y576 PolarHBondContact O-N 2.84Å
575	A	33.7	Very low	40.3	Very low	96 Å²	96	125 Å²	125	79%	0.793	65%	0.653	S	S	*	*			trans	-88.4	91.7	174.7	0	0	0	0	0	109.7	M577	A575-M577 PolarHBondContact O-N 2.97Å
576	Y	36.5	Very low	41.9	Very low	196 Å²	196	123.1 Å²	123.1	77%	0.769	64%	0.644	S	S	*	*			trans	-67.4	119.8	172.2	-73.8	-89.6	0	0	0	109.9	Y574 V578	Y574-Y576 PolarHBondContact O-N 2.84Å; Y576-V578 PolarHBondContact O-N 3.38Å
577	M	44.6	Very low	43.9	Very low	66 Å²	66	121.9 Å²	121.9	33%	0.325	64%	0.639	S	S	.	*			trans	-70.8	115.1	173.9	-69.5	-178.9	67.9	0	0	109.5	K513 L516 A575 F579	K513-M577 HydrophobicContact CG-CE 4.47Å; L516-M577 HydrophobicContact CD1-CE 3.97Å; A575-M577 PolarHBondContact O-N 2.97Å; M577-F579 HydrophobicContact CB-CD2 4.21Å; M577-F579 HydrophobicContact CB-CE2 3.59Å; M577-F579 HydrophobicContact CB-CZ 4.1Å; M577-F579 HydrophobicContact CE-CE1 4Å; M577-F579 HydrophobicContact CE-CE2 4.18Å; M577-F579 HydrophobicContact CE-CZ 3.47Å; M577-F579 VanDerWaalsContact CE-CZ 3.47Å; M577-F579 WeakPolarHBondContact O-CD2 3.42Å; M577-F579 PolarHBondContact O-N 3.36Å; M577-F579 HydrophobicContact SD-CE2 4.49Å; M577-F579 HydrophobicContact SD-CZ 4.18Å
578	V	46.2	Very low	46.7	Very low	91 Å²	91	112.8 Å²	112.8	55%	0.552	60%	0.602	S	S	*	*			trans	-90.9	103.4	175.6	-177.8	0	0	0	0	109.4	Y576	Y576-V578 PolarHBondContact O-N 3.38Å
579	F	53.2	Low	49.8	Very low	31 Å²	31	111.4 Å²	111.4	14%	0.136	58%	0.583	C	S	.	*			trans	-87.4	118.8	169.9	-59.1	-94.3	0	0	0	109.2	E509 V512 K513 M577	E509-F579 HydrophobicContact CB-CG 4.45Å; E509-F579 HydrophobicContact CG-CB 4.32Å; E509-F579 HydrophobicContact CG-CD1 4.01Å; E509-F579 HydrophobicContact CG-CD2 3.46Å; E509-F579 VanDerWaalsContact CG-CD2 3.46Å; E509-F579 HydrophobicContact CG-CE1 4.1Å; E509-F579 HydrophobicContact CG-CE2 3.56Å; E509-F579 HydrophobicContact CG-CG 3.68Å; E509-F579 HydrophobicContact CG-CZ 3.87Å; E509-F579 WeakPolarHBondContact OE1-CD2 3.32Å; E509-F579 VanDerWaalsContact OE1-CE2 3.29Å; E509-F579 WeakPolarHBondContact OE1-CE2 3.33Å; V512-F579 HydrophobicContact CB-CD1 4.4Å; V512-F579 HydrophobicContact CB-CE1 4.33Å; V512-F579 HydrophobicContact CG1-CD1 4.03Å; V512-F579 HydrophobicContact CG1-CE1 4.02Å; K513-F579 HydrophobicContact CB-CE1 4.14Å; K513-F579 HydrophobicContact CB-CZ 3.88Å; K513-F579 HydrophobicContact CD-CZ 4.49Å; K513-F579 HydrophobicContact CG-CZ 4.22Å; M577-F579 HydrophobicContact CB-CD2 4.21Å; M577-F579 HydrophobicContact CB-CE2 3.59Å; M577-F579 HydrophobicContact CB-CZ 4.1Å; M577-F579 HydrophobicContact CE-CE1 4Å; M577-F579 HydrophobicContact CE-CE2 4.18Å; M577-F579 HydrophobicContact CE-CZ 3.47Å; M577-F579 VanDerWaalsContact CE-CZ 3.47Å; M577-F579 WeakPolarHBondContact O-CD2 3.42Å; M577-F579 PolarHBondContact O-N 3.36Å; M577-F579 HydrophobicContact SD-CE2 4.49Å; M577-F579 HydrophobicContact SD-CZ 4.18Å
580	Q	57.5	Low	52.9	Low	97 Å²	97	103.3 Å²	103.3	45%	0.453	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	114.8	176.4	-166.7	164.7	6.6	0	0	109.3	R546	R546-Q580 PolarHBondContact N-O 2.89Å
581	K	63.1	Low	56.1	Low	130 Å²	130	94.7 Å²	94.7	57%	0.565	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	128.3	165.3	-176.9	-179.3	177.2	-180	0	108.6	P544 F545 S583	P544-K581 HydrophobicContact CB-CG 4.43Å; P544-K581 CarbonylContact O-C 3.45Å; P544-K581 WeakPolarHBondContact O-CA 3.05Å; F545-K581 HydrophobicContact CD1-CB 4.33Å; F545-K581 HydrophobicContact CE1-CB 4.04Å; F545-K581 HydrophobicContact CE1-CG 4.39Å; F545-K581 HydrophobicContact CE2-CD 4.38Å; F545-K581 HydrophobicContact CE2-CG 4.38Å; F545-K581 HydrophobicContact CZ-CB 4.32Å; F545-K581 HydrophobicContact CZ-CD 4.01Å; F545-K581 HydrophobicContact CZ-CG 4.18Å; K581-S583 PolarHBondContact O-N 3.08Å
582	Y	62.1	Low	59.3	Low	28 Å²	28	90.6 Å²	90.6	11%	0.11	47%	0.468	C	S	.	.			trans	-70.4	119.7	172.4	-167.3	-102.5	0	0	0	110.1	A540 P544 S584 A586 R588	A540-Y582 HydrophobicContact CB-CD1 3.61Å; A540-Y582 HydrophobicContact CB-CD2 3.76Å; A540-Y582 HydrophobicContact CB-CE1 3.77Å; A540-Y582 HydrophobicContact CB-CE2 3.92Å; A540-Y582 HydrophobicContact CB-CG 3.6Å; P544-Y582 WeakPolarHBondContact O-CB 3.18Å; P544-Y582 PolarHBondContact O-N 3Å; Y582-S584 WeakPolarHBondContact CD1-O 3.37Å; Y582-S584 WeakPolarHBondContact CE1-O 3.47Å; Y582-A586 PolarHBondContact OH-O 2.97Å; Y582-R588 HydrophobicContact CE2-CG 4.24Å; Y582-R588 WeakPolarHBondContact OH-CG 3.48Å
583	S	54.5	Low	62.5	Low	117 Å²	117	80.6 Å²	80.6	82%	0.818	43%	0.425	S	S	*	.			trans	-97	-15.7	-175.2	-52.5	0	0	0	0	114.3	K581	K581-S583 PolarHBondContact O-N 3.08Å
584	S	54.3	Low	65.6	Low	46 Å²	46	72.3 Å²	72.3	32%	0.322	39%	0.386	S	S	.	.			trans	-82.7	157	-179.6	-177.2	0	0	0	0	111.4	Y582 A586	Y582-S584 WeakPolarHBondContact CD1-O 3.37Å; Y582-S584 WeakPolarHBondContact CE1-O 3.47Å; S584-A586 PolarHBondContact OG-N 3.05Å; S584-A586 PolarHBondContact OG-O 3.11Å
585	V	53.2	Low	68.5	Low	138 Å²	138	63 Å²	63	84%	0.836	35%	0.35	S	S	*	.	S	Bend	trans	-105.2	-18.1	166.2	-173.7	0	0	0	0	111.2
586	A	61.1	Low	71.1	Confident	58 Å²	58	58.5 Å²	58.5	48%	0.479	31%	0.312	S	S	.	.	S	Bend	trans	-92.5	152.2	176.2	0	0	0	0	0	111.7	Y582 S584	Y582-A586 PolarHBondContact OH-O 2.97Å; S584-A586 PolarHBondContact OG-N 3.05Å; S584-A586 PolarHBondContact OG-O 3.11Å
587	D	69.1	Low	73.5	Confident	135 Å²	135	50 Å²	50	72%	0.722	28%	0.28	S	S	*	.			trans	-69.5	158.9	171.5	-64.7	-56.7	0	0	0	111.7
588	R	85.3	Confident	75.3	Confident	37 Å²	37	47.8 Å²	47.8	14%	0.14	27%	0.274	C	S	.	.			trans	-112.9	121.4	-172.7	-47.9	-171	57.2	-167.9	0	111	Y582 N855 I857 S878 T880 A906	Y582-R588 HydrophobicContact CE2-CG 4.24Å; Y582-R588 WeakPolarHBondContact OH-CG 3.48Å; R588-N855 VanDerWaalsContact CA-OD1 3.3Å; R588-N855 WeakPolarHBondContact CA-OD1 3.46Å; R588-N855 WeakPolarHBondContact CB-OD1 3.26Å; R588-N855 WeakPolarHBondContact CG-OD1 3.22Å; R588-N855 PolarHBondContact NE-O 3.36Å; R588-N855 PolarHBondContact NE-OD1 3.49Å; R588-N855 PolarHBondContact NH2-O 3.26Å; R588-I857 HydrophobicContact CB-CD1 3.89Å; R588-I857 HydrophobicContact CB-CG1 3.99Å; R588-I857 HydrophobicContact CG-CD1 4.5Å; R588-S878 PolarHBondContact NH2-O 2.87Å; R588-T880 PolarHBondContact NH1-OG1 3.4Å; R588-T880 VanDerWaalsContact NH1-OG1 3.12Å; R588-T880 PolarHBondContact NH2-OG1 3.43Å; R588-A906 VanDerWaalsContact CD-O 3.22Å; R588-A906 WeakPolarHBondContact CD-O 3.19Å; R588-A906 PolarHBondContact NH1-O 3.05Å
589	P	91.2	Very high	77.3	Confident	31 Å²	31	43.5 Å²	43.5	20%	0.201	25%	0.248	C	C	.	.			trans	-70.2	144.1	-178.2	27.3	-32.6	0	0	0	111.9	D675 P853 A856 I857	P589-D675 VanDerWaalsContact CA-OD2 3.28Å; P589-D675 WeakPolarHBondContact CA-OD2 3.44Å; P589-D675 HydrophobicContact CB-CB 4.14Å; P589-P853 HydrophobicContact CG-CB 3.91Å; P589-P853 HydrophobicContact CG-CG 4.02Å; P589-A856 HydrophobicContact CG-CB 4.12Å; P589-A856 CarbonylContact O-C 3.59Å; P589-A856 VanDerWaalsContact O-CA 3.31Å; P589-A856 WeakPolarHBondContact O-CA 3.42Å; P589-I857 PolarHBondContact O-N 3.38Å
590	V	94.2	Very high	78.9	Confident	9 Å²	9	42.9 Å²	42.9	6%	0.055	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	125.9	-172.7	-170.1	0	0	0	0	110.8	F592 V672 P674 D675 G676 I857 I859 L908	V590-F592 HydrophobicContact CG1-CD1 4.22Å; V590-F592 HydrophobicContact CG1-CE1 3.83Å; V590-V672 HydrophobicContact CG1-CG1 4.04Å; V590-P674 CarbonylContact O-C 3.54Å; V590-D675 PolarHBondContact N-OD2 3.41Å; V590-D675 PolarHBondContact O-N 3.12Å; V590-G676 PolarHBondContact O-N 3.15Å; V590-G676 VanDerWaalsContact O-N 3.12Å; V590-I857 CarbonylContact C-O 3.55Å; V590-I857 WeakPolarHBondContact CA-O 3.45Å; V590-I859 HydrophobicContact CG1-CD1 4Å; V590-L908 HydrophobicContact CG2-CD1 3.57Å
591	W	96.5	Very high	80.4	Confident	18 Å²	18	41 Å²	41	7%	0.068	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.7	-175.9	-81.8	67.1	0	0	0	112.2	G676 V678 I813 H851 V852 P853 I857 I858 I859	W591-G676 CarbonylContact C-O 3.54Å; W591-G676 VanDerWaalsContact CA-O 3.3Å; W591-G676 WeakPolarHBondContact CA-O 3.4Å; W591-V678 HydrophobicContact CE3-CG2 3.96Å; W591-V678 HydrophobicContact CZ3-CG2 3.79Å; W591-I813 HydrophobicContact CH2-CD1 4.42Å; W591-I813 HydrophobicContact CH2-CG1 3.75Å; W591-I813 HydrophobicContact CZ3-CG1 3.79Å; W591-H851 HydrophobicContact CH2-CB 3.89Å; W591-H851 WeakPolarHBondContact CH2-O 3.45Å; W591-H851 WeakPolarHBondContact CZ2-O 3.31Å; W591-H851 HydrophobicContact CZ3-CB 4.47Å; W591-V852 HydrophobicContact CD2-CG1 4.46Å; W591-V852 HydrophobicContact CD2-CG2 4.02Å; W591-V852 HydrophobicContact CE3-CG2 3.68Å; W591-V852 HydrophobicContact CG-CG1 4.36Å; W591-V852 HydrophobicContact CZ3-CG2 4.01Å; W591-P853 VanDerWaalsContact CE2-CD 3.46Å; W591-P853 HydrophobicContact CZ2-CG 4.4Å; W591-I857 PolarHBondContact N-O 3.33Å; W591-I858 HydrophobicContact CB-CG1 4.49Å; W591-I858 HydrophobicContact CB-CG2 4.4Å; W591-I858 CarbonylContact O-C 3.59Å; W591-I858 WeakPolarHBondContact O-CA 3.34Å; W591-I859 PolarHBondContact O-N 2.9Å
592	F	97.4	Very high	81.5	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	125.1	177.6	-74.2	18.2	0	0	0	110.4	V590 Y594 L667 V672 P674 G676 I677 V678 C690 I859 V861	V590-F592 HydrophobicContact CG1-CD1 4.22Å; V590-F592 HydrophobicContact CG1-CE1 3.83Å; F592-Y594 HydrophobicContact CB-CE2 3.89Å; F592-Y594 HydrophobicContact CD2-CE2 4.39Å; F592-L667 HydrophobicContact CD2-CD1 4.16Å; F592-L667 HydrophobicContact CE1-CD1 4.18Å; F592-L667 HydrophobicContact CE2-CB 4.16Å; F592-L667 HydrophobicContact CE2-CD1 3.58Å; F592-L667 HydrophobicContact CZ-CB 3.97Å; F592-L667 HydrophobicContact CZ-CD1 3.61Å; F592-L667 HydrophobicContact CZ-CG 4.33Å; F592-V672 HydrophobicContact CE1-CG1 3.73Å; F592-V672 HydrophobicContact CZ-CB 4.36Å; F592-V672 HydrophobicContact CZ-CG1 3.77Å; F592-P674 HydrophobicContact CB-CB 4.27Å; F592-P674 HydrophobicContact CD1-CB 3.78Å; F592-P674 HydrophobicContact CD2-CB 4.2Å; F592-P674 HydrophobicContact CD2-CG 4.1Å; F592-P674 HydrophobicContact CE1-CB 4.04Å; F592-P674 HydrophobicContact CE2-CB 4.45Å; F592-P674 HydrophobicContact CE2-CG 4.21Å; F592-P674 HydrophobicContact CG-CB 3.84Å; F592-P674 HydrophobicContact CG-CG 4.24Å; F592-P674 HydrophobicContact CZ-CB 4.36Å; F592-P674 HydrophobicContact CZ-CG 4.44Å; F592-G676 PolarHBondContact N-O 3.47Å; F592-I677 WeakPolarHBondContact O-CA 3.49Å; F592-V678 PolarHBondContact O-N 3.08Å; F592-C690 VanDerWaalsContact CD2-SG 3.6Å; F592-I859 HydrophobicContact CD1-CB 4.19Å; F592-I859 HydrophobicContact CD1-CD1 4.29Å; F592-I859 HydrophobicContact CE1-CD1 3.92Å; F592-V861 HydrophobicContact CB-CG2 4.31Å; F592-V861 HydrophobicContact CD2-CG2 4.24Å; F592-V861 HydrophobicContact CG-CG2 4.23Å
593	I	96.5	Very high	82.5	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	119.2	-179.7	-51.4	-60.7	0	0	0	109.9	V678 F845 L849 I858 I859 E860 V861 L867 I871	I593-V678 CarbonylContact C-O 3.52Å; I593-V678 WeakPolarHBondContact CA-O 3.47Å; I593-V678 HydrophobicContact CD1-CB 3.73Å; I593-V678 HydrophobicContact CD1-CG2 3.79Å; I593-F845 HydrophobicContact CG2-CE2 3.83Å; I593-F845 HydrophobicContact CG2-CZ 3.67Å; I593-L849 HydrophobicContact CD1-CD2 3.95Å; I593-I858 HydrophobicContact CD1-CG2 4.14Å; I593-I858 HydrophobicContact CG1-CG2 3.49Å; I593-I858 VanDerWaalsContact CG1-CG2 3.49Å; I593-I859 PolarHBondContact N-O 2.69Å; I593-E860 CarbonylContact O-C 3.59Å; I593-E860 WeakPolarHBondContact O-CA 3.43Å; I593-V861 PolarHBondContact O-N 3.46Å; I593-L867 HydrophobicContact CG2-CD1 4.45Å; I593-I871 HydrophobicContact CB-CD1 4.38Å; I593-I871 HydrophobicContact CG1-CD1 4.34Å; I593-I871 HydrophobicContact CG2-CD1 3.95Å
594	Y	96.1	Very high	84.2	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	96.7	-178.1	-70.2	-89.6	0	0	0	112.4	F592 Q660 T664 I677 V678 H680 V686 A687 C690 V861	F592-Y594 HydrophobicContact CB-CE2 3.89Å; F592-Y594 HydrophobicContact CD2-CE2 4.39Å; Y594-Q660 HydrophobicContact CD1-CB 4.11Å; Y594-Q660 HydrophobicContact CD1-CG 4.32Å; Y594-Q660 HydrophobicContact CE1-CB 4.29Å; Y594-T664 VanDerWaalsContact CE1-OG1 3.29Å; Y594-T664 WeakPolarHBondContact CE1-OG1 3.42Å; Y594-T664 VanDerWaalsContact OH-CG2 3.26Å; Y594-T664 WeakPolarHBondContact OH-CG2 3.14Å; Y594-T664 PolarHBondContact OH-OG1 3.31Å; Y594-I677 HydrophobicContact CD2-CG2 4.19Å; Y594-I677 HydrophobicContact CE2-CG2 3.99Å; Y594-V678 PolarHBondContact N-O 3.38Å; Y594-H680 PolarHBondContact O-N 3.47Å; Y594-V686 HydrophobicContact CD1-CB 3.9Å; Y594-V686 HydrophobicContact CD1-CG1 4.01Å; Y594-V686 HydrophobicContact CE1-CB 4.01Å; Y594-V686 HydrophobicContact CE1-CG1 3.61Å; Y594-A687 HydrophobicContact CD2-CB 4.24Å; Y594-C690 HydrophobicContact CE2-CB 4.05Å; Y594-C690 WeakPolarHBondContact OH-CB 3.3Å; Y594-C690 PolarHBondContact OH-SG 2.89Å; Y594-C690 VanDerWaalsContact OH-SG 3.37Å; Y594-V861 HydrophobicContact CD1-CB 3.94Å; Y594-V861 HydrophobicContact CD1-CG1 4.03Å; Y594-V861 HydrophobicContact CE1-CB 3.71Å; Y594-V861 HydrophobicContact CE1-CG1 3.49Å; Y594-V861 VanDerWaalsContact CE1-CG1 3.49Å; Y594-V861 HydrophobicContact CE1-CG2 4.41Å
595	S	92.7	Very high	85.8	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.168	C	C	.	.			trans	-69.2	143.4	-178.8	-43.6	0	0	0	0	112.7	Q660 E860 L867	S595-Q660 PolarHBondContact O-NE2 3.2Å; S595-E860 WeakPolarHBondContact OG-CG 3.46Å; S595-E860 PolarHBondContact OG-OE1 2.81Å; S595-L867 WeakPolarHBondContact OG-CD1 3.17Å
596	G	87.4	Confident	87.5	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.01	14%	0.142	C	C	.	.			trans	-90.2	-148.2	-173.1	0	0	0	0	0	115.7	S599 H680	G596-S599 WeakPolarHBondContact O-CB 3.47Å; G596-S599 PolarHBondContact O-N 3.15Å; G596-S599 PolarHBondContact O-OG 3.06Å; G596-H680 WeakPolarHBondContact CA-O 3.46Å; G596-H680 PolarHBondContact N-O 2.96Å
597	M	86.4	Confident	88.8	Confident	18 Å²	18	25.6 Å²	25.6	9%	0.089	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	142.9	174.4	-160.4	74.3	169.2	0	0	112.1	P649 C652 F653 I656 T682 F782	M597-P649 HydrophobicContact CE-CB 4.15Å; M597-C652 HydrophobicContact CE-CB 3.56Å; M597-C652 HydrophobicContact SD-CB 3.74Å; M597-F653 HydrophobicContact CE-CD2 4.5Å; M597-F653 HydrophobicContact CE-CE2 4.44Å; M597-F653 HydrophobicContact SD-CD2 3.86Å; M597-F653 HydrophobicContact SD-CE2 3.78Å; M597-I656 HydrophobicContact SD-CD1 4.35Å; M597-T682 PolarHBondContact N-OG1 2.9Å; M597-F782 HydrophobicContact CE-CE2 3.93Å; M597-F782 HydrophobicContact CE-CZ 4.06Å; M597-F782 HydrophobicContact CG-CD2 4.45Å; M597-F782 HydrophobicContact CG-CE2 3.91Å; M597-F782 HydrophobicContact SD-CE2 4.38Å
598	G	83.4	Confident	89.8	Confident	19 Å²	19	19.2 Å²	19.2	20%	0.196	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	96	-7.5	-172.3	0	0	0	0	0	113.7	Q600	G598-Q600 VanDerWaalsContact CA-OE1 3.27Å
599	S	88.4	Confident	90	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.094	C	C	.	.			trans	-85.1	-7.2	172.9	61.1	0	0	0	0	113.9	G596	G596-S599 WeakPolarHBondContact O-CB 3.47Å; G596-S599 PolarHBondContact O-N 3.15Å; G596-S599 PolarHBondContact O-OG 3.06Å
600	Q	87.3	Confident	89.7	Confident	19 Å²	19	21.4 Å²	21.4	9%	0.089	11%	0.107	C	C	.	.			trans	-71.8	142.4	-179.3	71	-75.5	-12.3	0	0	114.1	G598 M604 F645 I656 D776	G598-Q600 VanDerWaalsContact CA-OE1 3.27Å; Q600-M604 HydrophobicContact CB-CE 4.36Å; Q600-M604 HydrophobicContact CB-SD 4.16Å; Q600-F645 HydrophobicContact CG-CB 4.43Å; Q600-I656 HydrophobicContact CB-CD1 4.19Å; Q600-I656 HydrophobicContact CB-CG1 4.17Å; Q600-D776 PolarHBondContact NE2-O 3.15Å; Q600-D776 PolarHBondContact NE2-OD2 3.48Å
601	W	88.5	Confident	89.2	Confident	56 Å²	56	21.5 Å²	21.5	21%	0.212	11%	0.107	C	C	.	.			trans	-154.5	171.9	170.9	57.4	-77.3	0	0	0	111.4	M604 P863 M885 N892	W601-M604 HydrophobicContact CD2-CB 3.8Å; W601-M604 HydrophobicContact CE3-CB 4.49Å; W601-M604 HydrophobicContact CG-CB 3.95Å; W601-M604 HydrophobicContact CZ2-CB 4.05Å; W601-M604 PolarHBondContact N-SD 2.81Å; W601-M604 WeakPolarHBondContact O-CB 3.35Å; W601-M604 WeakPolarHBondContact O-CG 3.28Å; W601-P863 PolarHBondContact NE1-O 3.48Å; W601-M885 HydrophobicContact CZ2-CE 4.16Å; W601-N892 WeakPolarHBondContact CH2-ND2 3.46Å
602	I	85.1	Confident	88.8	Confident	55 Å²	55	20.7 Å²	20.7	28%	0.282	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	137.2	-176	-108.4	160	0	0	0	112.6	M604 E640 K642 F645	I602-M604 PolarHBondContact O-N 3.23Å; I602-E640 WeakPolarHBondContact CD1-O 3.23Å; I602-K642 VanDerWaalsContact CD1-CA 3.44Å; I602-K642 HydrophobicContact CD1-CB 4.09Å; I602-K642 HydrophobicContact CD1-CG 3.43Å; I602-K642 VanDerWaalsContact CD1-CG 3.43Å; I602-F645 HydrophobicContact CG1-CE2 4.41Å
603	G	84.2	Confident	88.2	Confident	13 Å²	13	22.8 Å²	22.8	13%	0.134	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	68	13	-173.9	0	0	0	0	0	113.4	G605 R606	G603-G605 PolarHBondContact O-N 2.81Å; G603-R606 WeakPolarHBondContact O-CB 3.46Å; G603-R606 PolarHBondContact O-N 2.77Å
604	M	90	Very high	87.7	Confident	1 Å²	1	23.4 Å²	23.4	1%	0.005	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	115.5	179.6	59.6	178.3	-173.7	0	0	111.1	Q600 W601 I602 R606 I637 F645 C655 I659 P863	Q600-M604 HydrophobicContact CB-CE 4.36Å; Q600-M604 HydrophobicContact CB-SD 4.16Å; W601-M604 HydrophobicContact CD2-CB 3.8Å; W601-M604 HydrophobicContact CE3-CB 4.49Å; W601-M604 HydrophobicContact CG-CB 3.95Å; W601-M604 HydrophobicContact CZ2-CB 4.05Å; W601-M604 PolarHBondContact N-SD 2.81Å; W601-M604 WeakPolarHBondContact O-CB 3.35Å; W601-M604 WeakPolarHBondContact O-CG 3.28Å; I602-M604 PolarHBondContact O-N 3.23Å; M604-R606 VanDerWaalsContact C-N 3.3Å; M604-R606 PolarHBondContact O-N 3.02Å; M604-I637 WeakPolarHBondContact O-CG2 3.5Å; M604-F645 HydrophobicContact CE-CE1 4.07Å; M604-F645 HydrophobicContact CE-CZ 3.92Å; M604-C655 HydrophobicContact CE-CB 3.37Å; M604-I659 HydrophobicContact CB-CD1 4.01Å; M604-I659 HydrophobicContact CE-CD1 4.03Å; M604-I659 HydrophobicContact CG-CD1 3.48Å; M604-I659 VanDerWaalsContact CG-CD1 3.48Å; M604-I659 WeakPolarHBondContact O-CD1 3.32Å; M604-I659 HydrophobicContact SD-CD1 3.9Å; M604-P863 HydrophobicContact CB-CB 4.26Å; M604-P863 HydrophobicContact SD-CB 3.77Å; M604-P863 HydrophobicContact SD-CG 4.19Å
605	G	87.9	Confident	87.5	Confident	1 Å²	1	23.4 Å²	23.4	1%	0.01	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	5	-178.2	0	0	0	0	0	115.4	G603 D607 L608 I609 M885	G603-G605 PolarHBondContact O-N 2.81Å; G605-D607 PolarHBondContact O-N 3.1Å; G605-L608 WeakPolarHBondContact O-CB 3.44Å; G605-L608 PolarHBondContact O-N 3.05Å; G605-L608 VanDerWaalsContact O-N 3.12Å; G605-I609 WeakPolarHBondContact O-CG1 3.23Å; G605-I609 PolarHBondContact O-N 2.78Å; G605-M885 VanDerWaalsContact N-CE 3.26Å
606	R	89.2	Confident	87.4	Confident	79 Å²	79	24.4 Å²	24.4	30%	0.298	13%	0.129	S	C	.	.	H	α-helix	trans	-55	-52.4	174.6	176.1	176.9	176.8	173.4	-1.4	111.5	G603 M604 L608 I609 E610 M638 E640	G603-R606 WeakPolarHBondContact O-CB 3.46Å; G603-R606 PolarHBondContact O-N 2.77Å; M604-R606 VanDerWaalsContact C-N 3.3Å; M604-R606 PolarHBondContact O-N 3.02Å; R606-L608 PolarHBondContact O-N 3.34Å; R606-I609 WeakPolarHBondContact O-CB 3.48Å; R606-I609 PolarHBondContact O-N 3Å; R606-E610 WeakPolarHBondContact CG-OE1 3.28Å; R606-E610 IonicContact NE-OE1 3.26Å; R606-E610 PolarHBondContact NE-OE1 3.2Å; R606-E610 PolarHBondContact O-N 3.05Å; R606-M638 HydrophobicContact CB-SD 4.44Å; R606-M638 HydrophobicContact CG-CE 4.12Å; R606-M638 HydrophobicContact CG-SD 3.96Å; R606-E640 IonicContact CZ-OE1 3.84Å; R606-E640 IonicContact NH1-OE1 3.21Å; R606-E640 PolarHBondContact NH1-OE1 2.76Å; R606-E640 IonicContact NH2-OE1 2.66Å
607	D	87.2	Confident	87.5	Confident	46 Å²	46	32.2 Å²	32.2	25%	0.246	16%	0.158	C	C	.	.	H	α-helix	trans	-57.2	-35.2	177.5	-41.6	-13.6	0	0	0	111.8	G605 E610 M611 N892 V893	G605-D607 PolarHBondContact O-N 3.1Å; D607-E610 PolarHBondContact O-N 3.02Å; D607-M611 WeakPolarHBondContact O-CB 3.09Å; D607-M611 PolarHBondContact O-N 3.41Å; D607-N892 PolarHBondContact OD2-N 3.14Å; D607-V893 HydrophobicContact CB-CG2 3.7Å; D607-V893 WeakPolarHBondContact O-CG2 3.33Å
608	L	90.2	Very high	87.9	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-74.5	-32.5	179.2	-57.5	177	0	0	0	112.1	G605 R606 M611 F612 F615 L663 M885 V893 F896	G605-L608 WeakPolarHBondContact O-CB 3.44Å; G605-L608 PolarHBondContact O-N 3.05Å; G605-L608 VanDerWaalsContact O-N 3.12Å; R606-L608 PolarHBondContact O-N 3.34Å; L608-M611 PolarHBondContact O-N 3.47Å; L608-F612 HydrophobicContact CB-CD2 4.29Å; L608-F612 HydrophobicContact CD2-CD2 3.87Å; L608-F612 HydrophobicContact CD2-CE2 3.68Å; L608-F612 WeakPolarHBondContact O-CB 3.3Å; L608-F612 PolarHBondContact O-N 3Å; L608-F615 HydrophobicContact CB-CD1 3.9Å; L608-F615 HydrophobicContact CB-CD2 4.16Å; L608-F615 HydrophobicContact CB-CE1 3.95Å; L608-F615 HydrophobicContact CB-CE2 4.19Å; L608-F615 HydrophobicContact CB-CG 4.01Å; L608-F615 HydrophobicContact CB-CZ 4.09Å; L608-F615 HydrophobicContact CD1-CD2 4.36Å; L608-F615 HydrophobicContact CD1-CE2 3.82Å; L608-F615 HydrophobicContact CD1-CZ 3.98Å; L608-L663 HydrophobicContact CD1-CD2 4.3Å; L608-M885 HydrophobicContact CD1-CE 4.18Å; L608-M885 HydrophobicContact CD1-CG 4.02Å; L608-M885 HydrophobicContact CD1-SD 3.62Å; L608-V893 HydrophobicContact CD2-CG2 4.06Å; L608-F896 HydrophobicContact CD2-CB 4.1Å; L608-F896 HydrophobicContact CD2-CD1 4.35Å; L608-F896 HydrophobicContact CD2-CG 4.25Å
609	I	89.4	Confident	88.5	Confident	17 Å²	17	31.2 Å²	31.2	9%	0.087	15%	0.149	C	C	.	.	H	α-helix	trans	-67	-41.8	170.6	-68.7	167.8	0	0	0	110.5	G605 R606 M611 F615 A616 I619 M634 I637 M638	G605-I609 WeakPolarHBondContact O-CG1 3.23Å; G605-I609 PolarHBondContact O-N 2.78Å; R606-I609 WeakPolarHBondContact O-CB 3.48Å; R606-I609 PolarHBondContact O-N 3Å; I609-M611 VanDerWaalsContact C-N 3.29Å; I609-M611 PolarHBondContact O-N 3.02Å; I609-F615 HydrophobicContact CD1-CE1 4.45Å; I609-F615 HydrophobicContact CG1-CD1 3.64Å; I609-F615 HydrophobicContact CG1-CE1 3.77Å; I609-A616 HydrophobicContact CG2-CB 4.16Å; I609-I619 HydrophobicContact CD1-CG1 4.31Å; I609-I619 HydrophobicContact CD1-CG2 4.24Å; I609-I619 HydrophobicContact CG1-CG1 4.35Å; I609-M634 HydrophobicContact CD1-SD 4.13Å; I609-M634 HydrophobicContact CG2-CE 3.6Å; I609-M634 HydrophobicContact CG2-SD 4.16Å; I609-I637 HydrophobicContact CD1-CB 4.4Å; I609-I637 HydrophobicContact CD1-CG2 3.63Å; I609-M638 HydrophobicContact CB-SD 4.49Å; I609-M638 HydrophobicContact CD1-SD 4.14Å; I609-M638 HydrophobicContact CG2-SD 4.2Å
610	E	85.2	Confident	88.7	Confident	98 Å²	98	34 Å²	34	46%	0.458	17%	0.166	S	C	.	.	H	α-helix	trans	-71.7	-22.2	177.9	-67.2	179.2	-158	0	0	112.8	R606 D607	R606-E610 WeakPolarHBondContact CG-OE1 3.28Å; R606-E610 IonicContact NE-OE1 3.26Å; R606-E610 PolarHBondContact NE-OE1 3.2Å; R606-E610 PolarHBondContact O-N 3.05Å; D607-E610 PolarHBondContact O-N 3.02Å
611	M	85.3	Confident	89	Confident	11 Å²	11	39.6 Å²	39.6	5%	0.054	19%	0.187	C	C	.	.	H	α-helix	trans	-102.3	-37.3	-175.4	-175.3	64.8	-155.6	0	0	115.5	R497 Q499 D607 L608 I609 V893 Y916	R497-M611 HydrophobicContact CB-SD 4.03Å; R497-M611 VanDerWaalsContact O-CE 3.31Å; R497-M611 WeakPolarHBondContact O-CE 3.47Å; Q499-M611 HydrophobicContact CB-CE 4.14Å; Q499-M611 WeakPolarHBondContact O-CE 3.44Å; D607-M611 WeakPolarHBondContact O-CB 3.09Å; D607-M611 PolarHBondContact O-N 3.41Å; L608-M611 PolarHBondContact O-N 3.47Å; I609-M611 VanDerWaalsContact C-N 3.29Å; I609-M611 PolarHBondContact O-N 3.02Å; M611-V893 HydrophobicContact CB-CG2 3.73Å; M611-V893 HydrophobicContact CG-CG1 3.98Å; M611-V893 HydrophobicContact CG-CG2 3.93Å; M611-V893 HydrophobicContact SD-CG1 4.47Å; M611-Y916 HydrophobicContact CE-CD1 4.44Å; M611-Y916 HydrophobicContact CE-CE1 3.94Å
612	F	87.8	Confident	89.4	Confident	1 Å²	1	37 Å²	37	0%	0.004	18%	0.176	C	C	.	.			trans	-121	108.2	-167.6	-62.4	-72	0	0	0	112.7	L608 V614 F615 A616 M666 V893 F896 L897 I915 Y916	L608-F612 HydrophobicContact CB-CD2 4.29Å; L608-F612 HydrophobicContact CD2-CD2 3.87Å; L608-F612 HydrophobicContact CD2-CE2 3.68Å; L608-F612 WeakPolarHBondContact O-CB 3.3Å; L608-F612 PolarHBondContact O-N 3Å; F612-V614 PolarHBondContact O-N 2.72Å; F612-V614 VanDerWaalsContact O-N 3.12Å; F612-F615 HydrophobicContact CB-CB 3.95Å; F612-F615 WeakPolarHBondContact O-CB 3.46Å; F612-F615 PolarHBondContact O-N 3.32Å; F612-A616 PolarHBondContact O-N 2.75Å; F612-M666 HydrophobicContact CB-CE 3.93Å; F612-M666 HydrophobicContact CB-SD 4.27Å; F612-M666 HydrophobicContact CD1-CE 3.67Å; F612-M666 HydrophobicContact CD2-CE 3.88Å; F612-M666 HydrophobicContact CE1-CE 4.12Å; F612-M666 HydrophobicContact CE2-CE 4.33Å; F612-M666 HydrophobicContact CG-CE 3.54Å; F612-M666 HydrophobicContact CG-SD 4.37Å; F612-M666 HydrophobicContact CZ-CE 4.44Å; F612-V893 HydrophobicContact CE2-CG2 4.42Å; F612-F896 HydrophobicContact CE2-CD1 4.02Å; F612-F896 HydrophobicContact CE2-CE1 4.3Å; F612-F896 HydrophobicContact CZ-CD1 4.14Å; F612-F896 HydrophobicContact CZ-CE1 4.28Å; F612-L897 HydrophobicContact CZ-CD2 3.94Å; F612-L897 HydrophobicContact CZ-CG 4.43Å; F612-I915 HydrophobicContact CD1-CD1 4.16Å; F612-I915 HydrophobicContact CE1-CD1 3.82Å; F612-Y916 HydrophobicContact CD1-CE1 4.49Å; F612-Y916 HydrophobicContact CE1-CD1 4.19Å; F612-Y916 AromaticContact CE1-CE1 3.65Å; F612-Y916 HydrophobicContact CE1-CE1 3.65Å; F612-Y916 HydrophobicContact CZ-CE1 4.45Å
613	P	83.6	Confident	89.9	Confident	43 Å²	43	34.9 Å²	34.9	28%	0.279	17%	0.167	S	C	.	.	H	α-helix	trans	-58.2	-28.5	179.6	-27.8	35.8	0	0	0	114.6	R617	P613-R617 WeakPolarHBondContact O-CB 2.43Å; P613-R617 VanDerWaalsContact O-CG 3.24Å; P613-R617 WeakPolarHBondContact O-CG 3.31Å; P613-R617 PolarHBondContact O-N 3.22Å; P613-R617 VanDerWaalsContact O-N 3.07Å; P613-R617 PolarHBondContact O-NE 3Å; P613-R617 VanDerWaalsContact O-NE 3.1Å
614	V	86.1	Confident	90.3	Very high	14 Å²	14	40.2 Å²	40.2	9%	0.085	19%	0.188	C	C	.	.	H	α-helix	trans	-65.6	-49.7	173.3	177.4	0	0	0	0	110.7	F612 R617 T618 M666	F612-V614 PolarHBondContact O-N 2.72Å; F612-V614 VanDerWaalsContact O-N 3.12Å; V614-R617 PolarHBondContact O-N 3.39Å; V614-T618 PolarHBondContact O-N 2.9Å; V614-T618 VanDerWaalsContact O-N 3.12Å; V614-T618 PolarHBondContact O-OG1 2.8Å; V614-M666 HydrophobicContact CB-CG 4.44Å; V614-M666 HydrophobicContact CG1-CG 4.1Å
615	F	91.3	Very high	90.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60.9	-49.5	179.2	-164.1	-84.4	0	0	0	110.9	L608 I609 F612 R617 T618 I619 I659 A662 L663 M666	L608-F615 HydrophobicContact CB-CD1 3.9Å; L608-F615 HydrophobicContact CB-CD2 4.16Å; L608-F615 HydrophobicContact CB-CE1 3.95Å; L608-F615 HydrophobicContact CB-CE2 4.19Å; L608-F615 HydrophobicContact CB-CG 4.01Å; L608-F615 HydrophobicContact CB-CZ 4.09Å; L608-F615 HydrophobicContact CD1-CD2 4.36Å; L608-F615 HydrophobicContact CD1-CE2 3.82Å; L608-F615 HydrophobicContact CD1-CZ 3.98Å; I609-F615 HydrophobicContact CD1-CE1 4.45Å; I609-F615 HydrophobicContact CG1-CD1 3.64Å; I609-F615 HydrophobicContact CG1-CE1 3.77Å; F612-F615 HydrophobicContact CB-CB 3.95Å; F612-F615 WeakPolarHBondContact O-CB 3.46Å; F612-F615 PolarHBondContact O-N 3.32Å; F615-R617 PolarHBondContact O-N 3.37Å; F615-T618 PolarHBondContact O-N 2.74Å; F615-I619 HydrophobicContact CD1-CG1 4.01Å; F615-I619 HydrophobicContact CE1-CD1 4.26Å; F615-I619 HydrophobicContact CE1-CG1 3.89Å; F615-I619 WeakPolarHBondContact O-CG1 3.39Å; F615-I619 PolarHBondContact O-N 3.07Å; F615-I659 HydrophobicContact CZ-CB 4.48Å; F615-I659 HydrophobicContact CZ-CG1 4.2Å; F615-I659 HydrophobicContact CZ-CG2 4.16Å; F615-A662 HydrophobicContact CD1-CB 4.27Å; F615-A662 HydrophobicContact CD2-CB 3.52Å; F615-A662 HydrophobicContact CE1-CB 4.3Å; F615-A662 HydrophobicContact CE2-CB 3.56Å; F615-A662 HydrophobicContact CG-CB 3.9Å; F615-A662 HydrophobicContact CZ-CB 3.97Å; F615-L663 HydrophobicContact CE2-CD2 3.96Å; F615-L663 HydrophobicContact CE2-CG 4.09Å; F615-M666 HydrophobicContact CB-SD 3.89Å; F615-M666 HydrophobicContact CD2-SD 3.75Å; F615-M666 HydrophobicContact CG-SD 4.3Å
616	A	90.8	Very high	90.9	Very high	20 Å²	20	41.5 Å²	41.5	17%	0.165	20%	0.196	C	C	.	.	H	α-helix	trans	-57.5	-48.2	178.1	0	0	0	0	0	112.8	I609 F612 T618 I619 V620	I609-A616 HydrophobicContact CG2-CB 4.16Å; F612-A616 PolarHBondContact O-N 2.75Å; A616-T618 VanDerWaalsContact C-N 3.3Å; A616-T618 PolarHBondContact O-N 2.69Å; A616-I619 PolarHBondContact O-N 3.42Å; A616-V620 WeakPolarHBondContact O-CB 3.39Å; A616-V620 VanDerWaalsContact O-CG2 3.31Å; A616-V620 WeakPolarHBondContact O-CG2 3.32Å; A616-V620 PolarHBondContact O-N 2.97Å
617	R	91	Very high	91	Very high	165 Å²	165	45 Å²	45	62%	0.623	21%	0.214	S	C	*	.	H	α-helix	trans	-60.8	-37.8	177.6	-76.7	-179.1	-64.7	-126.9	3.2	112.5	P613 V614 F615 V620 R621	P613-R617 WeakPolarHBondContact O-CB 2.43Å; P613-R617 VanDerWaalsContact O-CG 3.24Å; P613-R617 WeakPolarHBondContact O-CG 3.31Å; P613-R617 PolarHBondContact O-N 3.22Å; P613-R617 VanDerWaalsContact O-N 3.07Å; P613-R617 PolarHBondContact O-NE 3Å; P613-R617 VanDerWaalsContact O-NE 3.1Å; V614-R617 PolarHBondContact O-N 3.39Å; F615-R617 PolarHBondContact O-N 3.37Å; R617-V620 PolarHBondContact O-N 2Å; R617-R621 PolarHBondContact O-N 3.05Å
618	T	94.1	Very high	91.2	Very high	17 Å²	17	48 Å²	48	10%	0.104	24%	0.236	C	C	.	.	H	α-helix	trans	-67	-45.4	177.8	-56.7	0	0	0	0	111.9	V614 F615 A616 V620 R621 C622 I661 A662 L696	V614-T618 PolarHBondContact O-N 2.9Å; V614-T618 VanDerWaalsContact O-N 3.12Å; V614-T618 PolarHBondContact O-OG1 2.8Å; F615-T618 PolarHBondContact O-N 2.74Å; A616-T618 VanDerWaalsContact C-N 3.3Å; A616-T618 PolarHBondContact O-N 2.69Å; T618-V620 VanDerWaalsContact C-N 3.35Å; T618-V620 PolarHBondContact O-N 3.5Å; T618-R621 PolarHBondContact O-N 3.5Å; T618-C622 PolarHBondContact O-N 3.1Å; T618-C622 PolarHBondContact O-SG 3.27Å; T618-I661 HydrophobicContact CG2-CB 4.5Å; T618-I661 HydrophobicContact CG2-CG2 3.71Å; T618-A662 HydrophobicContact CG2-CB 4Å; T618-L696 HydrophobicContact CG2-CD1 3.86Å
619	I	94.9	Very high	91.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.3	-40.1	175.2	-60.1	-62.5	0	0	0	111.4	I609 F615 A616 C622 S623 M634 I637 A658 I659 A662	I609-I619 HydrophobicContact CD1-CG1 4.31Å; I609-I619 HydrophobicContact CD1-CG2 4.24Å; I609-I619 HydrophobicContact CG1-CG1 4.35Å; F615-I619 HydrophobicContact CD1-CG1 4.01Å; F615-I619 HydrophobicContact CE1-CD1 4.26Å; F615-I619 HydrophobicContact CE1-CG1 3.89Å; F615-I619 WeakPolarHBondContact O-CG1 3.39Å; F615-I619 PolarHBondContact O-N 3.07Å; A616-I619 PolarHBondContact O-N 3.42Å; I619-C622 WeakPolarHBondContact O-CB 3.46Å; I619-C622 PolarHBondContact O-N 2.88Å; I619-S623 PolarHBondContact O-N 3.49Å; I619-M634 HydrophobicContact CB-SD 4.4Å; I619-M634 HydrophobicContact CG2-CB 4.01Å; I619-M634 HydrophobicContact CG2-SD 3.77Å; I619-I637 HydrophobicContact CD1-CD1 4.2Å; I619-I637 HydrophobicContact CG2-CD1 4.12Å; I619-A658 HydrophobicContact CD1-CB 3.81Å; I619-A658 VanDerWaalsContact CD1-O 3.31Å; I619-A658 WeakPolarHBondContact CD1-O 3.21Å; I619-I659 HydrophobicContact CD1-CG1 4.24Å; I619-A662 HydrophobicContact CD1-CB 3.99Å; I619-A662 HydrophobicContact CG1-CB 4.28Å
620	V	94.1	Very high	91.2	Very high	59 Å²	59	54.3 Å²	54.3	36%	0.358	28%	0.283	S	S	.	.	H	α-helix	trans	-61.2	-45.5	174.9	168.2	0	0	0	0	111.4	A616 R617 T618 C622 S623 E624 M634	A616-V620 WeakPolarHBondContact O-CB 3.39Å; A616-V620 VanDerWaalsContact O-CG2 3.31Å; A616-V620 WeakPolarHBondContact O-CG2 3.32Å; A616-V620 PolarHBondContact O-N 2.97Å; R617-V620 PolarHBondContact O-N 2Å; T618-V620 VanDerWaalsContact C-N 3.35Å; T618-V620 PolarHBondContact O-N 3.5Å; V620-C622 PolarHBondContact O-N 3.48Å; V620-S623 CarbonylContact O-C 3.6Å; V620-S623 WeakPolarHBondContact O-CA 3.41Å; V620-S623 VanDerWaalsContact O-CB 3.3Å; V620-S623 WeakPolarHBondContact O-CB 3.35Å; V620-S623 PolarHBondContact O-N 2.97Å; V620-E624 HydrophobicContact CG1-CG 4.49Å; V620-E624 PolarHBondContact O-N 3.07Å; V620-M634 HydrophobicContact CG2-CE 4.43Å; V620-M634 HydrophobicContact CG2-SD 4.15Å
621	R	94.2	Very high	91.5	Very high	136 Å²	136	51.1 Å²	51.1	51%	0.513	27%	0.268	S	S	.	.	H	α-helix	trans	-63	-39.7	177.5	-169.8	171.5	174.4	134	-7.4	112.1	R617 T618 S623 E624 V625 L696 E697	R617-R621 PolarHBondContact O-N 3.05Å; T618-R621 PolarHBondContact O-N 3.5Å; R621-S623 VanDerWaalsContact C-N 3.28Å; R621-S623 PolarHBondContact O-N 3.45Å; R621-E624 PolarHBondContact O-N 3.43Å; R621-E624 VanDerWaalsContact O-N 3.14Å; R621-V625 WeakPolarHBondContact O-CG2 3.04Å; R621-V625 PolarHBondContact O-N 3.2Å; R621-L696 HydrophobicContact CB-CD1 4.41Å; R621-L696 HydrophobicContact CB-CD2 4.46Å; R621-L696 HydrophobicContact CG-CD1 4.42Å; R621-L696 HydrophobicContact CG-CD2 3.99Å; R621-E697 IonicContact CZ-OE1 3.52Å; R621-E697 IonicContact NE-OE1 3.22Å; R621-E697 PolarHBondContact NE-OE1 3.5Å; R621-E697 IonicContact NH2-OE1 3.86Å; R621-E697 PolarHBondContact NH2-OE1 2.95Å
622	C	95.6	Very high	91.9	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.4	-38.8	170.3	-70.6	0	0	0	0	112.4	T618 I619 V620 L626 P633 A658 I700	T618-C622 PolarHBondContact O-N 3.1Å; T618-C622 PolarHBondContact O-SG 3.27Å; I619-C622 WeakPolarHBondContact O-CB 3.46Å; I619-C622 PolarHBondContact O-N 2.88Å; V620-C622 PolarHBondContact O-N 3.48Å; C622-L626 PolarHBondContact O-N 2.93Å; C622-P633 HydrophobicContact CB-CG 4.01Å; C622-A658 HydrophobicContact CB-CB 4.2Å; C622-I700 HydrophobicContact CB-CD1 4.23Å; C622-I700 HydrophobicContact CB-CG1 4.04Å
623	S	95.4	Very high	92	Very high	12 Å²	12	52.8 Å²	52.8	8%	0.084	28%	0.281	C	S	.	.	H	α-helix	trans	-68.2	-34.9	172.5	-85.3	0	0	0	0	113.9	I619 V620 R621 L626 K627 S632 P633 M634	I619-S623 PolarHBondContact O-N 3.49Å; V620-S623 CarbonylContact O-C 3.6Å; V620-S623 WeakPolarHBondContact O-CA 3.41Å; V620-S623 VanDerWaalsContact O-CB 3.3Å; V620-S623 WeakPolarHBondContact O-CB 3.35Å; V620-S623 PolarHBondContact O-N 2.97Å; R621-S623 VanDerWaalsContact C-N 3.28Å; R621-S623 PolarHBondContact O-N 3.45Å; S623-L626 PolarHBondContact O-N 2.85Å; S623-K627 WeakPolarHBondContact O-CB 3.07Å; S623-K627 PolarHBondContact O-N 2.77Å; S623-S632 WeakPolarHBondContact CB-OG 3.42Å; S623-S632 VanDerWaalsContact OG-C 3.31Å; S623-S632 VanDerWaalsContact OG-CA 3.28Å; S623-S632 WeakPolarHBondContact OG-CA 3.49Å; S623-S632 PolarHBondContact OG-OG 3.36Å; S623-P633 WeakPolarHBondContact OG-CD 3.14Å; S623-M634 VanDerWaalsContact OG-CB 3.3Å; S623-M634 WeakPolarHBondContact OG-CB 3.39Å; S623-M634 PolarHBondContact OG-N 2.96Å
624	E	93.7	Very high	92.4	Very high	124 Å²	124	53.1 Å²	53.1	58%	0.579	28%	0.28	S	S	*	.	H	α-helix	trans	-68.1	-40.5	176.6	-69.8	-174.7	134.2	0	0	112.1	V620 R621 L626 K627	V620-E624 HydrophobicContact CG1-CG 4.49Å; V620-E624 PolarHBondContact O-N 3.07Å; R621-E624 PolarHBondContact O-N 3.43Å; R621-E624 VanDerWaalsContact O-N 3.14Å; E624-L626 VanDerWaalsContact C-N 3.33Å; E624-L626 PolarHBondContact O-N 2.98Å; E624-K627 VanDerWaalsContact O-CB 3.25Å; E624-K627 WeakPolarHBondContact O-CB 3.31Å; E624-K627 PolarHBondContact O-N 2.84Å
625	V	94.3	Very high	92.6	Very high	29 Å²	29	54.7 Å²	54.7	18%	0.176	30%	0.298	C	S	.	.	H	α-helix	trans	-63.1	-37.7	175	176.5	0	0	0	0	111.9	R621 P628 L696 E697 I700 L701	R621-V625 WeakPolarHBondContact O-CG2 3.04Å; R621-V625 PolarHBondContact O-N 3.2Å; V625-P628 VanDerWaalsContact O-CD 3.28Å; V625-P628 WeakPolarHBondContact O-CD 3.35Å; V625-L696 HydrophobicContact CG2-CD2 4.27Å; V625-E697 HydrophobicContact CG1-CB 4.46Å; V625-E697 HydrophobicContact CG2-CB 4.36Å; V625-E697 HydrophobicContact CG2-CG 3.77Å; V625-I700 HydrophobicContact CB-CG2 3.91Å; V625-I700 HydrophobicContact CG1-CG2 3.54Å; V625-I700 HydrophobicContact CG2-CG2 4.47Å; V625-L701 HydrophobicContact CG1-CD1 4.21Å; V625-L701 HydrophobicContact CG1-CD2 3.92Å; V625-L701 HydrophobicContact CG1-CG 3.79Å
626	L	95.3	Very high	92.6	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-87.9	-8.1	-179.8	-65.9	-174.6	0	0	0	114.8	C622 S623 E624 F629 G630 L631 P633 V654 I700 L701 Y704	C622-L626 PolarHBondContact O-N 2.93Å; S623-L626 PolarHBondContact O-N 2.85Å; E624-L626 VanDerWaalsContact C-N 3.33Å; E624-L626 PolarHBondContact O-N 2.98Å; L626-F629 HydrophobicContact CD2-CD2 4.34Å; L626-F629 WeakPolarHBondContact O-CA 3.4Å; L626-F629 WeakPolarHBondContact O-CB 3.31Å; L626-F629 PolarHBondContact O-N 2.8Å; L626-G630 PolarHBondContact O-N 3.14Å; L626-L631 CarbonylContact C-O 3.34Å; L626-L631 HydrophobicContact CB-CB 4.23Å; L626-L631 PolarHBondContact O-N 3.4Å; L626-P633 HydrophobicContact CD1-CG 4.34Å; L626-V654 HydrophobicContact CD1-CB 4.33Å; L626-V654 HydrophobicContact CD1-CG1 3.39Å; L626-V654 HydrophobicContact CD1-CG2 3.94Å; L626-I700 HydrophobicContact CD1-CD1 4.47Å; L626-I700 HydrophobicContact CD1-CG1 3.83Å; L626-I700 HydrophobicContact CG-CG1 4.08Å; L626-L701 HydrophobicContact CD2-CD2 4.17Å; L626-Y704 HydrophobicContact CD2-CD2 4.45Å; L626-Y704 HydrophobicContact CD2-CG 4.06Å
627	K	91.8	Very high	92.5	Very high	154 Å²	154	54.7 Å²	54.7	67%	0.67	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-52.5	-40	177.9	-165.4	176.5	-176.3	176.1	0	114.5	S623 E624 F629 G630	S623-K627 WeakPolarHBondContact O-CB 3.07Å; S623-K627 PolarHBondContact O-N 2.77Å; E624-K627 VanDerWaalsContact O-CB 3.25Å; E624-K627 WeakPolarHBondContact O-CB 3.31Å; E624-K627 PolarHBondContact O-N 2.84Å; K627-F629 PolarHBondContact O-N 3.03Å; K627-G630 PolarHBondContact O-N 3Å
628	P	90.8	Very high	92.5	Very high	109 Å²	109	50.2 Å²	50.2	71%	0.708	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-63.6	-20.7	175.9	-21.6	35	0	0	0	114	V625	V625-P628 VanDerWaalsContact O-CD 3.28Å; V625-P628 WeakPolarHBondContact O-CD 3.35Å
629	F	91.5	Very high	92	Very high	78 Å²	78	51.7 Å²	51.7	34%	0.342	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-97.9	3.6	-179.3	-56.4	-77.5	0	0	0	113.3	L626 K627 L701 Y704 F705	L626-F629 HydrophobicContact CD2-CD2 4.34Å; L626-F629 WeakPolarHBondContact O-CA 3.4Å; L626-F629 WeakPolarHBondContact O-CB 3.31Å; L626-F629 PolarHBondContact O-N 2.8Å; K627-F629 PolarHBondContact O-N 3.03Å; F629-L701 HydrophobicContact CD2-CD2 4.37Å; F629-L701 HydrophobicContact CE2-CD2 3.58Å; F629-L701 HydrophobicContact CZ-CD2 4.2Å; F629-Y704 HydrophobicContact CB-CE1 4.09Å; F629-Y704 HydrophobicContact CB-CE2 3.9Å; F629-Y704 HydrophobicContact CD1-CD1 4.3Å; F629-Y704 AromaticContact CD1-CE1 3.41Å; F629-Y704 HydrophobicContact CD1-CE1 3.41Å; F629-Y704 VanDerWaalsContact CD1-CE1 3.41Å; F629-Y704 AromaticContact CD1-CZ 3.64Å; F629-Y704 HydrophobicContact CD2-CD1 4.48Å; F629-Y704 HydrophobicContact CD2-CE1 4.3Å; F629-Y704 AromaticContact CE1-CE1 3.86Å; F629-Y704 HydrophobicContact CE1-CE1 3.86Å; F629-Y704 HydrophobicContact CG-CD1 4.25Å; F629-Y704 AromaticContact CG-CE1 3.65Å; F629-Y704 HydrophobicContact CG-CE1 3.65Å; F629-Y704 HydrophobicContact CG-CE2 4.36Å; F629-Y704 AromaticContact CG-CZ 3.71Å; F629-Y704 HydrophobicContact CZ-CE1 4.47Å; F629-F705 HydrophobicContact CE1-CE1 4.38Å; F629-F705 AromaticContact CE1-CZ 3.8Å; F629-F705 HydrophobicContact CE1-CZ 3.8Å; F629-F705 HydrophobicContact CZ-CE2 4.34Å; F629-F705 AromaticContact CZ-CZ 3.88Å; F629-F705 HydrophobicContact CZ-CZ 3.88Å
630	G	88.9	Confident	91.3	Very high	71 Å²	71	58.2 Å²	58.2	73%	0.732	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	14.2	178.7	0	0	0	0	0	115	L626 K627	L626-G630 PolarHBondContact O-N 3.14Å; K627-G630 PolarHBondContact O-N 3Å
631	L	91.3	Very high	90.6	Very high	30 Å²	30	59 Å²	59	16%	0.157	32%	0.324	C	S	.	.			trans	-110.9	155.4	179	-58.1	-175.9	0	0	0	111.9	L626 M636 L650 Y704	L626-L631 CarbonylContact C-O 3.34Å; L626-L631 HydrophobicContact CB-CB 4.23Å; L626-L631 PolarHBondContact O-N 3.4Å; L631-M636 HydrophobicContact CB-CE 3.79Å; L631-M636 HydrophobicContact CD1-CE 4.3Å; L631-M636 HydrophobicContact CD2-CE 3.7Å; L631-M636 HydrophobicContact CG-CE 4.12Å; L631-L650 HydrophobicContact CD1-CD1 4.28Å; L631-L650 HydrophobicContact CD1-CD2 4.11Å; L631-L650 HydrophobicContact CD1-CG 4.18Å; L631-L650 HydrophobicContact CD2-CD2 4.48Å; L631-Y704 HydrophobicContact CD1-CD2 3.49Å; L631-Y704 VanDerWaalsContact CD1-CD2 3.49Å; L631-Y704 HydrophobicContact CD1-CE2 3.57Å; L631-Y704 HydrophobicContact CG-CE2 4.34Å
632	S	92.7	Very high	89.7	Confident	48 Å²	48	60.1 Å²	60.1	34%	0.336	33%	0.333	S	S	.	.			trans	-148.9	98.2	173.5	179.1	0	0	0	0	109.6	S623 M634 G635 M636	S623-S632 WeakPolarHBondContact CB-OG 3.42Å; S623-S632 VanDerWaalsContact OG-C 3.31Å; S623-S632 VanDerWaalsContact OG-CA 3.28Å; S623-S632 WeakPolarHBondContact OG-CA 3.49Å; S623-S632 PolarHBondContact OG-OG 3.36Å; S632-M634 PolarHBondContact O-N 3.38Å; S632-G635 WeakPolarHBondContact O-CA 3.22Å; S632-G635 PolarHBondContact O-N 3.06Å; S632-G635 PolarHBondContact OG-N 3.12Å; S632-M636 PolarHBondContact O-N 3.15Å; S632-M636 VanDerWaalsContact O-N 3.07Å
633	P	91.4	Very high	88.9	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-48.1	-39.3	171.1	10.6	-27	0	0	0	113.5	C622 S623 L626 G635 M636 I637 V654 A658	C622-P633 HydrophobicContact CB-CG 4.01Å; S623-P633 WeakPolarHBondContact OG-CD 3.14Å; L626-P633 HydrophobicContact CD1-CG 4.34Å; P633-G635 VanDerWaalsContact C-N 3.3Å; P633-G635 PolarHBondContact O-N 3.34Å; P633-M636 PolarHBondContact O-N 3.44Å; P633-M636 VanDerWaalsContact O-N 3.07Å; P633-I637 WeakPolarHBondContact O-CB 3.47Å; P633-I637 WeakPolarHBondContact O-CG1 3.1Å; P633-I637 PolarHBondContact O-N 2.72Å; P633-V654 HydrophobicContact CB-CG1 4Å; P633-V654 HydrophobicContact CG-CG1 4Å; P633-A658 HydrophobicContact CB-CB 4.07Å; P633-A658 HydrophobicContact CG-CB 4.46Å
634	M	92.4	Very high	88.4	Confident	50 Å²	50	68.4 Å²	68.4	25%	0.246	37%	0.369	C	S	.	.	H	α-helix	trans	-53.3	-45.1	172.2	-171.9	72.1	178.5	0	0	112.3	I609 I619 V620 S623 S632 M638	I609-M634 HydrophobicContact CD1-SD 4.13Å; I609-M634 HydrophobicContact CG2-CE 3.6Å; I609-M634 HydrophobicContact CG2-SD 4.16Å; I619-M634 HydrophobicContact CB-SD 4.4Å; I619-M634 HydrophobicContact CG2-CB 4.01Å; I619-M634 HydrophobicContact CG2-SD 3.77Å; V620-M634 HydrophobicContact CG2-CE 4.43Å; V620-M634 HydrophobicContact CG2-SD 4.15Å; S623-M634 VanDerWaalsContact OG-CB 3.3Å; S623-M634 WeakPolarHBondContact OG-CB 3.39Å; S623-M634 PolarHBondContact OG-N 2.96Å; S632-M634 PolarHBondContact O-N 3.38Å; M634-M638 HydrophobicContact CE-CG 4.42Å; M634-M638 WeakPolarHBondContact O-CB 3.46Å; M634-M638 VanDerWaalsContact O-CG 3.23Å; M634-M638 WeakPolarHBondContact O-CG 3.4Å; M634-M638 PolarHBondContact O-N 2.85Å
635	G	88.6	Confident	88.1	Confident	46 Å²	46	63.1 Å²	63.1	47%	0.474	34%	0.344	S	S	.	.	H	α-helix	trans	-73.5	-24.7	177.6	0	0	0	0	0	114.3	S632 P633	S632-G635 WeakPolarHBondContact O-CA 3.22Å; S632-G635 PolarHBondContact O-N 3.06Å; S632-G635 PolarHBondContact OG-N 3.12Å; P633-G635 VanDerWaalsContact C-N 3.3Å; P633-G635 PolarHBondContact O-N 3.34Å
636	M	91.3	Very high	87.4	Confident	19 Å²	19	65.7 Å²	65.7	9%	0.094	36%	0.36	C	S	.	.	H	α-helix	trans	-82.2	-26.6	175.9	-62.2	176.6	-161.7	0	0	113.2	L631 S632 P633 T639 V644 N651	L631-M636 HydrophobicContact CB-CE 3.79Å; L631-M636 HydrophobicContact CD1-CE 4.3Å; L631-M636 HydrophobicContact CD2-CE 3.7Å; L631-M636 HydrophobicContact CG-CE 4.12Å; S632-M636 PolarHBondContact O-N 3.15Å; S632-M636 VanDerWaalsContact O-N 3.07Å; P633-M636 PolarHBondContact O-N 3.44Å; P633-M636 VanDerWaalsContact O-N 3.07Å; M636-T639 WeakPolarHBondContact O-CG2 3.19Å; M636-V644 HydrophobicContact CB-CG1 4.02Å; M636-V644 HydrophobicContact CG-CG1 4.22Å; M636-N651 WeakPolarHBondContact CE-OD1 3.44Å; M636-N651 HydrophobicContact SD-CB 3.96Å; M636-N651 VanDerWaalsContact SD-CG 3.57Å
637	I	90.4	Very high	86.7	Confident	1 Å²	1	70.8 Å²	70.8	1%	0.005	39%	0.387	C	S	.	.	H	α-helix	trans	-81.9	-39.4	177.5	-71.4	164.5	0	0	0	111.1	M604 I609 I619 P633 T639 C655 I659	M604-I637 WeakPolarHBondContact O-CG2 3.5Å; I609-I637 HydrophobicContact CD1-CB 4.4Å; I609-I637 HydrophobicContact CD1-CG2 3.63Å; I619-I637 HydrophobicContact CD1-CD1 4.2Å; I619-I637 HydrophobicContact CG2-CD1 4.12Å; P633-I637 WeakPolarHBondContact O-CB 3.47Å; P633-I637 WeakPolarHBondContact O-CG1 3.1Å; P633-I637 PolarHBondContact O-N 2.72Å; I637-T639 PolarHBondContact O-N 2.8Å; I637-C655 HydrophobicContact CG1-CB 4.44Å; I637-I659 HydrophobicContact CD1-CD1 4.04Å; I637-I659 HydrophobicContact CD1-CG1 4Å; I637-I659 HydrophobicContact CG1-CD1 4.46Å
638	M	89.3	Confident	86.5	Confident	71 Å²	71	65.4 Å²	65.4	35%	0.35	37%	0.366	S	S	.	.	S	Bend	trans	-80.6	13.3	-177.2	-60.6	-60.7	-68.2	0	0	114.4	R606 I609 M634	R606-M638 HydrophobicContact CB-SD 4.44Å; R606-M638 HydrophobicContact CG-CE 4.12Å; R606-M638 HydrophobicContact CG-SD 3.96Å; I609-M638 HydrophobicContact CB-SD 4.49Å; I609-M638 HydrophobicContact CD1-SD 4.14Å; I609-M638 HydrophobicContact CG2-SD 4.2Å; M634-M638 HydrophobicContact CE-CG 4.42Å; M634-M638 WeakPolarHBondContact O-CB 3.46Å; M634-M638 VanDerWaalsContact O-CG 3.23Å; M634-M638 WeakPolarHBondContact O-CG 3.4Å; M634-M638 PolarHBondContact O-N 2.85Å
639	T	84.9	Confident	86.4	Confident	49 Å²	49	60.3 Å²	60.3	30%	0.301	33%	0.333	S	S	.	.			trans	-116.2	154.4	-179.8	-172.5	0	0	0	0	112.4	M636 I637 V644	M636-T639 WeakPolarHBondContact O-CG2 3.19Å; I637-T639 PolarHBondContact O-N 2.8Å; T639-V644 HydrophobicContact CG2-CG2 3.84Å
640	E	78.7	Confident	86.4	Confident	136 Å²	136	57.8 Å²	57.8	64%	0.636	32%	0.323	S	S	*	.			trans	-106.9	2.5	-174.3	-63.8	174.3	-168.9	0	0	112.9	I602 R606 K642	I602-E640 WeakPolarHBondContact CD1-O 3.23Å; R606-E640 IonicContact CZ-OE1 3.84Å; R606-E640 IonicContact NH1-OE1 3.21Å; R606-E640 PolarHBondContact NH1-OE1 2.76Å; R606-E640 IonicContact NH2-OE1 2.66Å; E640-K642 PolarHBondContact O-N 3.34Å
641	D	81.1	Confident	86.5	Confident	75 Å²	75	55.3 Å²	55.3	40%	0.401	29%	0.293	S	S	.	.			trans	-78.3	113.9	179.4	-174.1	0.1	0	0	0	112.8	K643 V644	D641-K643 PolarHBondContact O-N 3.07Å; D641-K643 WeakPolarHBondContact OD1-CB 3.32Å; D641-K643 WeakPolarHBondContact OD1-CG 3.11Å; D641-K643 PolarHBondContact OD1-N 2.74Å; D641-V644 HydrophobicContact CB-CG2 4.29Å; D641-V644 WeakPolarHBondContact O-CB 3.43Å; D641-V644 WeakPolarHBondContact O-CG2 3.47Å; D641-V644 PolarHBondContact O-N 3.02Å; D641-V644 VanDerWaalsContact O-N 3.09Å
642	K	74.5	Confident	86.5	Confident	160 Å²	160	53.9 Å²	53.9	70%	0.696	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-55.5	-23.6	177.5	-77.7	178	176.5	-175.4	0	113.9	I602 E640 V644 V646	I602-K642 VanDerWaalsContact CD1-CA 3.44Å; I602-K642 HydrophobicContact CD1-CB 4.09Å; I602-K642 HydrophobicContact CD1-CG 3.43Å; I602-K642 VanDerWaalsContact CD1-CG 3.43Å; E640-K642 PolarHBondContact O-N 3.34Å; K642-V644 PolarHBondContact O-N 2.61Å; K642-V646 WeakPolarHBondContact O-CG2 3.2Å
643	K	79.6	Confident	86.5	Confident	162 Å²	162	51.7 Å²	51.7	70%	0.704	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-71.5	-10.6	179.2	-61.4	168.1	-172.9	166.9	0	114.1	D641 F645	D641-K643 PolarHBondContact O-N 3.07Å; D641-K643 WeakPolarHBondContact OD1-CB 3.32Å; D641-K643 WeakPolarHBondContact OD1-CG 3.11Å; D641-K643 PolarHBondContact OD1-N 2.74Å; K643-F645 VanDerWaalsContact C-N 3.33Å; K643-F645 PolarHBondContact O-N 2.7Å
644	V	85.1	Confident	86.6	Confident	25 Å²	25	51.7 Å²	51.7	15%	0.152	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-68.4	-32.1	-179.1	172.9	0	0	0	0	112.2	M636 T639 D641 K642 N651	M636-V644 HydrophobicContact CB-CG1 4.02Å; M636-V644 HydrophobicContact CG-CG1 4.22Å; T639-V644 HydrophobicContact CG2-CG2 3.84Å; D641-V644 HydrophobicContact CB-CG2 4.29Å; D641-V644 WeakPolarHBondContact O-CB 3.43Å; D641-V644 WeakPolarHBondContact O-CG2 3.47Å; D641-V644 PolarHBondContact O-N 3.02Å; D641-V644 VanDerWaalsContact O-N 3.09Å; K642-V644 PolarHBondContact O-N 2.61Å; V644-N651 VanDerWaalsContact O-CB 3.26Å; V644-N651 WeakPolarHBondContact O-CB 3.49Å; V644-N651 PolarHBondContact O-ND2 3.15Å
645	F	85.7	Confident	86.7	Confident	12 Å²	12	49.3 Å²	49.3	5%	0.053	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-34.6	-179.2	-58.2	-62.1	0	0	0	113.5	Q600 I602 M604 K643 N647 N648 N651 C652 C655 S778	Q600-F645 HydrophobicContact CG-CB 4.43Å; I602-F645 HydrophobicContact CG1-CE2 4.41Å; M604-F645 HydrophobicContact CE-CE1 4.07Å; M604-F645 HydrophobicContact CE-CZ 3.92Å; K643-F645 VanDerWaalsContact C-N 3.33Å; K643-F645 PolarHBondContact O-N 2.7Å; F645-N647 PolarHBondContact O-N 2.75Å; F645-N648 PolarHBondContact O-N 2.74Å; F645-N651 HydrophobicContact CD1-CB 4.23Å; F645-N651 HydrophobicContact CE1-CB 4.44Å; F645-C652 PolarHBondContact O-SG 3.17Å; F645-C655 HydrophobicContact CE1-CB 3.99Å; F645-C655 HydrophobicContact CZ-CB 4.45Å; F645-S778 PolarHBondContact O-OG 2.88Å
646	V	81	Confident	87	Confident	84 Å²	84	47.1 Å²	47.1	51%	0.509	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	123.3	-178.7	172.4	0	0	0	0	111.2	K642 N648	K642-V646 WeakPolarHBondContact O-CG2 3.2Å; V646-N648 PolarHBondContact O-N 3.25Å
647	N	80.2	Confident	87.2	Confident	106 Å²	106	46.2 Å²	46.2	57%	0.567	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	25.2	-176.8	-62.3	-13.5	0	0	0	114.8	F645 S778	F645-N647 PolarHBondContact O-N 2.75Å; N647-S778 WeakPolarHBondContact CA-O 3.24Å
648	N	87.5	Confident	87.4	Confident	42 Å²	42	46.1 Å²	46.1	23%	0.225	23%	0.231	C	C	.	.			trans	-127.9	76.2	-178.1	-167.6	-16.1	0	0	0	111.9	F645 V646 L650 N651 C652	F645-N648 PolarHBondContact O-N 2.74Å; V646-N648 PolarHBondContact O-N 3.25Å; N648-L650 PolarHBondContact O-N 3.13Å; N648-L650 VanDerWaalsContact O-N 3.17Å; N648-L650 WeakPolarHBondContact OD1-CB 3.45Å; N648-N651 HydrophobicContact CB-CB 4.44Å; N648-N651 VanDerWaalsContact ND2-CG 3.31Å; N648-N651 PolarHBondContact ND2-ND2 3.44Å; N648-N651 PolarHBondContact O-N 2.88Å; N648-N651 VanDerWaalsContact O-N 3.14Å; N648-N651 PolarHBondContact OD1-N 2.8Å; N648-C652 PolarHBondContact O-N 3.28Å; N648-C652 PolarHBondContact O-SG 2.66Å; N648-C652 VanDerWaalsContact O-SG 3.41Å
649	P	88	Confident	87.7	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.013	21%	0.214	C	C	.	.	H	α-helix	trans	-62.7	-25.2	-176.1	26.4	-35.8	0	0	0	113.4	M597 C652 F653 M710 V711 M780 F782	M597-P649 HydrophobicContact CE-CB 4.15Å; P649-C652 PolarHBondContact O-N 3Å; P649-F653 WeakPolarHBondContact O-CB 3.44Å; P649-F653 VanDerWaalsContact O-CD2 3.25Å; P649-F653 WeakPolarHBondContact O-CD2 3.38Å; P649-F653 PolarHBondContact O-N 2.86Å; P649-M710 HydrophobicContact CG-CB 4.13Å; P649-V711 HydrophobicContact CG-CG2 4.04Å; P649-M780 HydrophobicContact CB-CG 4.27Å; P649-M780 HydrophobicContact CG-CG 3.96Å; P649-F782 HydrophobicContact CB-CZ 4.09Å
650	L	91.7	Very high	88.2	Confident	25 Å²	25	40.4 Å²	40.4	13%	0.131	20%	0.2	C	C	.	.	H	α-helix	trans	-57.4	-52.4	172.3	175.4	75.6	0	0	0	111.8	L631 N648 V654 Y704 K708 V711	L631-L650 HydrophobicContact CD1-CD1 4.28Å; L631-L650 HydrophobicContact CD1-CD2 4.11Å; L631-L650 HydrophobicContact CD1-CG 4.18Å; L631-L650 HydrophobicContact CD2-CD2 4.48Å; N648-L650 PolarHBondContact O-N 3.13Å; N648-L650 VanDerWaalsContact O-N 3.17Å; N648-L650 WeakPolarHBondContact OD1-CB 3.45Å; L650-V654 WeakPolarHBondContact O-CB 3.48Å; L650-V654 WeakPolarHBondContact O-CG2 3.43Å; L650-V654 PolarHBondContact O-N 3.33Å; L650-V654 VanDerWaalsContact O-N 3.16Å; L650-Y704 HydrophobicContact CD1-CD2 3.72Å; L650-Y704 HydrophobicContact CD1-CE2 3.97Å; L650-Y704 WeakPolarHBondContact CD1-O 3.25Å; L650-K708 HydrophobicContact CD1-CB 3.99Å; L650-V711 HydrophobicContact CB-CG2 4Å
651	N	91.7	Very high	89.1	Confident	18 Å²	18	34 Å²	34	10%	0.096	17%	0.169	C	C	.	.	H	α-helix	trans	-67.6	-38.8	-179	-74.7	6	0	0	0	111.6	M636 V644 F645 N648 C655	M636-N651 WeakPolarHBondContact CE-OD1 3.44Å; M636-N651 HydrophobicContact SD-CB 3.96Å; M636-N651 VanDerWaalsContact SD-CG 3.57Å; V644-N651 VanDerWaalsContact O-CB 3.26Å; V644-N651 WeakPolarHBondContact O-CB 3.49Å; V644-N651 PolarHBondContact O-ND2 3.15Å; F645-N651 HydrophobicContact CD1-CB 4.23Å; F645-N651 HydrophobicContact CE1-CB 4.44Å; N648-N651 HydrophobicContact CB-CB 4.44Å; N648-N651 VanDerWaalsContact ND2-CG 3.31Å; N648-N651 PolarHBondContact ND2-ND2 3.44Å; N648-N651 PolarHBondContact O-N 2.88Å; N648-N651 VanDerWaalsContact O-N 3.14Å; N648-N651 PolarHBondContact OD1-N 2.8Å; N651-C655 WeakPolarHBondContact O-CB 3.32Å; N651-C655 PolarHBondContact O-N 3.07Å; N651-C655 PolarHBondContact O-SG 2.72Å
652	C	91.1	Very high	89.8	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.3	-52.9	176.2	-60.3	0	0	0	0	111.7	M597 F645 N648 P649 V654 C655 I656	M597-C652 HydrophobicContact CE-CB 3.56Å; M597-C652 HydrophobicContact SD-CB 3.74Å; F645-C652 PolarHBondContact O-SG 3.17Å; N648-C652 PolarHBondContact O-N 3.28Å; N648-C652 PolarHBondContact O-SG 2.66Å; N648-C652 VanDerWaalsContact O-SG 3.41Å; P649-C652 PolarHBondContact O-N 3Å; C652-V654 VanDerWaalsContact C-N 3.34Å; C652-V654 PolarHBondContact O-N 3.3Å; C652-C655 PolarHBondContact O-N 2.87Å; C652-I656 HydrophobicContact CB-CD1 4.45Å; C652-I656 WeakPolarHBondContact O-CB 3.38Å; C652-I656 WeakPolarHBondContact O-CD1 3.24Å; C652-I656 WeakPolarHBondContact O-CG1 3.21Å; C652-I656 PolarHBondContact O-N 2.75Å
653	F	92.2	Very high	90.8	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.009	12%	0.117	C	C	.	.	H	α-helix	trans	-56.6	-46.7	179	-89.8	-126.9	0	0	0	111.8	M597 P649 S657 T682 M685 R706 F782	M597-F653 HydrophobicContact CE-CD2 4.5Å; M597-F653 HydrophobicContact CE-CE2 4.44Å; M597-F653 HydrophobicContact SD-CD2 3.86Å; M597-F653 HydrophobicContact SD-CE2 3.78Å; P649-F653 WeakPolarHBondContact O-CB 3.44Å; P649-F653 VanDerWaalsContact O-CD2 3.25Å; P649-F653 WeakPolarHBondContact O-CD2 3.38Å; P649-F653 PolarHBondContact O-N 2.86Å; F653-S657 VanDerWaalsContact O-CB 3.31Å; F653-S657 WeakPolarHBondContact O-CB 3.48Å; F653-S657 PolarHBondContact O-N 2.89Å; F653-S657 PolarHBondContact O-OG 3.26Å; F653-T682 HydrophobicContact CD1-CG2 3.81Å; F653-T682 HydrophobicContact CD2-CG2 4.2Å; F653-T682 HydrophobicContact CE1-CG2 3.92Å; F653-T682 HydrophobicContact CE2-CG2 4.31Å; F653-T682 HydrophobicContact CG-CG2 3.95Å; F653-T682 HydrophobicContact CZ-CG2 4.17Å; F653-M685 HydrophobicContact CD1-CE 4.21Å; F653-R706 HydrophobicContact CD1-CB 3.86Å; F653-R706 HydrophobicContact CE1-CB 3.86Å; F653-F782 AromaticContact CE2-CE1 3.81Å; F653-F782 HydrophobicContact CE2-CE1 3.81Å; F653-F782 AromaticContact CE2-CZ 3.75Å; F653-F782 HydrophobicContact CE2-CZ 3.75Å; F653-F782 HydrophobicContact CZ-CD1 4.47Å; F653-F782 AromaticContact CZ-CE1 3.84Å; F653-F782 HydrophobicContact CZ-CE1 3.84Å; F653-F782 HydrophobicContact CZ-CZ 4.26Å
654	V	94.5	Very high	91.5	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-64	-46.8	-179.6	164.4	0	0	0	0	111.9	L626 P633 L650 C652 A658 I700	L626-V654 HydrophobicContact CD1-CB 4.33Å; L626-V654 HydrophobicContact CD1-CG1 3.39Å; L626-V654 HydrophobicContact CD1-CG2 3.94Å; P633-V654 HydrophobicContact CB-CG1 4Å; P633-V654 HydrophobicContact CG-CG1 4Å; L650-V654 WeakPolarHBondContact O-CB 3.48Å; L650-V654 WeakPolarHBondContact O-CG2 3.43Å; L650-V654 PolarHBondContact O-N 3.33Å; L650-V654 VanDerWaalsContact O-N 3.16Å; C652-V654 VanDerWaalsContact C-N 3.34Å; C652-V654 PolarHBondContact O-N 3.3Å; V654-A658 WeakPolarHBondContact O-CB 3.36Å; V654-A658 PolarHBondContact O-N 2.62Å; V654-I700 HydrophobicContact CG1-CD1 4.4Å; V654-I700 WeakPolarHBondContact O-CD1 3.38Å
655	C	94	Very high	91.9	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-80.5	-34.5	-172.3	-59	0	0	0	0	113.5	M604 I637 F645 N651 C652 I659	M604-C655 HydrophobicContact CE-CB 3.37Å; I637-C655 HydrophobicContact CG1-CB 4.44Å; F645-C655 HydrophobicContact CE1-CB 3.99Å; F645-C655 HydrophobicContact CZ-CB 4.45Å; N651-C655 WeakPolarHBondContact O-CB 3.32Å; N651-C655 PolarHBondContact O-N 3.07Å; N651-C655 PolarHBondContact O-SG 2.72Å; C652-C655 PolarHBondContact O-N 2.87Å; C655-I659 PolarHBondContact O-N 3.25Å
656	I	94.1	Very high	92.2	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-59.8	-51.3	170.9	-66	166.2	0	0	0	109.1	M597 Q600 C652 A658 I659 Q660 P863	M597-I656 HydrophobicContact SD-CD1 4.35Å; Q600-I656 HydrophobicContact CB-CD1 4.19Å; Q600-I656 HydrophobicContact CB-CG1 4.17Å; C652-I656 HydrophobicContact CB-CD1 4.45Å; C652-I656 WeakPolarHBondContact O-CB 3.38Å; C652-I656 WeakPolarHBondContact O-CD1 3.24Å; C652-I656 WeakPolarHBondContact O-CG1 3.21Å; C652-I656 PolarHBondContact O-N 2.75Å; I656-A658 PolarHBondContact O-N 3.07Å; I656-I659 PolarHBondContact O-N 2.84Å; I656-Q660 HydrophobicContact CG2-CG 4.43Å; I656-Q660 WeakPolarHBondContact O-CG 3.34Å; I656-Q660 PolarHBondContact O-N 3.09Å; I656-P863 HydrophobicContact CB-CG 4.42Å; I656-P863 HydrophobicContact CG1-CG 4.35Å; I656-P863 HydrophobicContact CG2-CG 4.21Å
657	S	95.2	Very high	92.8	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-59.7	-44.9	-179.6	-53.5	0	0	0	0	111.8	F653 I659 Q660 I661 M685 A703	F653-S657 VanDerWaalsContact O-CB 3.31Å; F653-S657 WeakPolarHBondContact O-CB 3.48Å; F653-S657 PolarHBondContact O-N 2.89Å; F653-S657 PolarHBondContact O-OG 3.26Å; S657-I659 VanDerWaalsContact C-N 3.34Å; S657-I659 PolarHBondContact O-N 2.86Å; S657-Q660 PolarHBondContact O-N 3.38Å; S657-I661 WeakPolarHBondContact O-CD1 3.21Å; S657-I661 WeakPolarHBondContact O-CG1 3.48Å; S657-I661 PolarHBondContact O-N 3.01Å; S657-M685 WeakPolarHBondContact OG-CE 3.37Å; S657-A703 WeakPolarHBondContact OG-CB 3.24Å
658	A	95.5	Very high	93.3	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-58.8	-42.5	178.9	0	0	0	0	0	112.7	I619 C622 P633 V654 I656 A662 I700	I619-A658 HydrophobicContact CD1-CB 3.81Å; I619-A658 VanDerWaalsContact CD1-O 3.31Å; I619-A658 WeakPolarHBondContact CD1-O 3.21Å; C622-A658 HydrophobicContact CB-CB 4.2Å; P633-A658 HydrophobicContact CB-CB 4.07Å; P633-A658 HydrophobicContact CG-CB 4.46Å; V654-A658 WeakPolarHBondContact O-CB 3.36Å; V654-A658 PolarHBondContact O-N 2.62Å; I656-A658 PolarHBondContact O-N 3.07Å; A658-A662 WeakPolarHBondContact O-CB 3.34Å; A658-A662 PolarHBondContact O-N 2.81Å; A658-I700 HydrophobicContact CB-CD1 4.1Å
659	I	95.6	Very high	93.4	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-69.2	-42.1	177.5	-72.8	171.8	0	0	0	111.5	M604 F615 I619 I637 C655 I656 S657 I661 A662 L663 P863 M885	M604-I659 HydrophobicContact CB-CD1 4.01Å; M604-I659 HydrophobicContact CE-CD1 4.03Å; M604-I659 HydrophobicContact CG-CD1 3.48Å; M604-I659 VanDerWaalsContact CG-CD1 3.48Å; M604-I659 WeakPolarHBondContact O-CD1 3.32Å; M604-I659 HydrophobicContact SD-CD1 3.9Å; F615-I659 HydrophobicContact CZ-CB 4.48Å; F615-I659 HydrophobicContact CZ-CG1 4.2Å; F615-I659 HydrophobicContact CZ-CG2 4.16Å; I619-I659 HydrophobicContact CD1-CG1 4.24Å; I637-I659 HydrophobicContact CD1-CD1 4.04Å; I637-I659 HydrophobicContact CD1-CG1 4Å; I637-I659 HydrophobicContact CG1-CD1 4.46Å; C655-I659 PolarHBondContact O-N 3.25Å; I656-I659 PolarHBondContact O-N 2.84Å; S657-I659 VanDerWaalsContact C-N 3.34Å; S657-I659 PolarHBondContact O-N 2.86Å; I659-I661 PolarHBondContact O-N 3.39Å; I659-A662 PolarHBondContact O-N 2.9Å; I659-A662 VanDerWaalsContact O-N 3.15Å; I659-L663 HydrophobicContact CG2-CD1 4.09Å; I659-L663 HydrophobicContact CG2-CG 4.31Å; I659-L663 WeakPolarHBondContact O-CG 3.38Å; I659-L663 PolarHBondContact O-N 3.27Å; I659-P863 HydrophobicContact CB-CG 4.18Å; I659-P863 HydrophobicContact CD1-CB 4.27Å; I659-P863 HydrophobicContact CD1-CG 4.39Å; I659-P863 HydrophobicContact CG2-CB 4.1Å; I659-P863 HydrophobicContact CG2-CG 3.91Å; I659-M885 HydrophobicContact CG2-CE 4.47Å; I659-M885 HydrophobicContact CG2-SD 3.84Å
660	Q	96	Very high	93.5	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-64.1	-39.7	177.5	-71	-179.5	-50.7	0	0	111.9	Y594 S595 I656 S657 A662 T664 V686 V861	Y594-Q660 HydrophobicContact CD1-CB 4.11Å; Y594-Q660 HydrophobicContact CD1-CG 4.32Å; Y594-Q660 HydrophobicContact CE1-CB 4.29Å; S595-Q660 PolarHBondContact O-NE2 3.2Å; I656-Q660 HydrophobicContact CG2-CG 4.43Å; I656-Q660 WeakPolarHBondContact O-CG 3.34Å; I656-Q660 PolarHBondContact O-N 3.09Å; S657-Q660 PolarHBondContact O-N 3.38Å; Q660-A662 VanDerWaalsContact C-N 3.33Å; Q660-A662 PolarHBondContact O-N 2.84Å; Q660-T664 VanDerWaalsContact O-CB 3.32Å; Q660-T664 WeakPolarHBondContact O-CB 3.35Å; Q660-T664 PolarHBondContact O-N 3.14Å; Q660-T664 PolarHBondContact O-OG1 3.05Å; Q660-V686 HydrophobicContact CB-CB 4.08Å; Q660-V686 HydrophobicContact CB-CG1 3.82Å; Q660-V686 HydrophobicContact CB-CG2 3.93Å; Q660-V861 WeakPolarHBondContact CG-O 3.31Å; Q660-V861 PolarHBondContact NE2-O 3.28Å
661	I	96.3	Very high	93.3	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-61.1	-43.2	172.3	-65	162.1	0	0	0	110	T618 S657 I659 T664 S665 V686 F689 L696 T699	T618-I661 HydrophobicContact CG2-CB 4.5Å; T618-I661 HydrophobicContact CG2-CG2 3.71Å; S657-I661 WeakPolarHBondContact O-CD1 3.21Å; S657-I661 WeakPolarHBondContact O-CG1 3.48Å; S657-I661 PolarHBondContact O-N 3.01Å; I659-I661 PolarHBondContact O-N 3.39Å; I661-T664 PolarHBondContact O-N 3.28Å; I661-S665 WeakPolarHBondContact O-CB 3.15Å; I661-S665 PolarHBondContact O-N 2.72Å; I661-S665 PolarHBondContact O-OG 2.6Å; I661-V686 HydrophobicContact CG1-CG1 3.84Å; I661-V686 HydrophobicContact CG1-CG2 4.18Å; I661-F689 HydrophobicContact CB-CD1 4.48Å; I661-F689 HydrophobicContact CB-CE1 4.41Å; I661-F689 HydrophobicContact CG1-CD1 4.3Å; I661-F689 HydrophobicContact CG2-CD1 4.18Å; I661-F689 HydrophobicContact CG2-CE1 3.77Å; I661-F689 HydrophobicContact CG2-CE2 4.34Å; I661-F689 HydrophobicContact CG2-CZ 3.86Å; I661-L696 HydrophobicContact CG2-CD1 3.92Å; I661-L696 HydrophobicContact CG2-CG 4.08Å; I661-T699 HydrophobicContact CD1-CG2 3.75Å; I661-T699 HydrophobicContact CG1-CG2 4.18Å
662	A	95.3	Very high	93.3	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-66.7	-44.2	179.3	0	0	0	0	0	113.3	F615 T618 I619 A658 I659 Q660 S665 M666	F615-A662 HydrophobicContact CD1-CB 4.27Å; F615-A662 HydrophobicContact CD2-CB 3.52Å; F615-A662 HydrophobicContact CE1-CB 4.3Å; F615-A662 HydrophobicContact CE2-CB 3.56Å; F615-A662 HydrophobicContact CG-CB 3.9Å; F615-A662 HydrophobicContact CZ-CB 3.97Å; T618-A662 HydrophobicContact CG2-CB 4Å; I619-A662 HydrophobicContact CD1-CB 3.99Å; I619-A662 HydrophobicContact CG1-CB 4.28Å; A658-A662 WeakPolarHBondContact O-CB 3.34Å; A658-A662 PolarHBondContact O-N 2.81Å; I659-A662 PolarHBondContact O-N 2.9Å; I659-A662 VanDerWaalsContact O-N 3.15Å; Q660-A662 VanDerWaalsContact C-N 3.33Å; Q660-A662 PolarHBondContact O-N 2.84Å; A662-S665 PolarHBondContact O-N 2.99Å; A662-M666 PolarHBondContact O-N 3.38Å
663	L	95.6	Very high	93.3	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-60.9	-46.9	172.9	-70	174.2	0	0	0	111.5	L608 F615 I659 S665 M666 L667 V861 L884 M885 F896	L608-L663 HydrophobicContact CD1-CD2 4.3Å; F615-L663 HydrophobicContact CE2-CD2 3.96Å; F615-L663 HydrophobicContact CE2-CG 4.09Å; I659-L663 HydrophobicContact CG2-CD1 4.09Å; I659-L663 HydrophobicContact CG2-CG 4.31Å; I659-L663 WeakPolarHBondContact O-CG 3.38Å; I659-L663 PolarHBondContact O-N 3.27Å; L663-S665 VanDerWaalsContact C-N 3.29Å; L663-S665 PolarHBondContact O-N 2.69Å; L663-M666 PolarHBondContact O-N 2.88Å; L663-M666 VanDerWaalsContact O-N 3.11Å; L663-L667 WeakPolarHBondContact O-CG 3.17Å; L663-L667 PolarHBondContact O-N 3.08Å; L663-V861 HydrophobicContact CB-CG1 3.7Å; L663-V861 HydrophobicContact CD1-CG1 4.15Å; L663-L884 HydrophobicContact CB-CD1 4.41Å; L663-L884 HydrophobicContact CD1-CB 4.4Å; L663-L884 HydrophobicContact CD1-CD1 4.48Å; L663-L884 HydrophobicContact CD2-CB 4.41Å; L663-L884 HydrophobicContact CD2-CD1 4.44Å; L663-M885 HydrophobicContact CD1-CG 4.46Å; L663-M885 HydrophobicContact CD1-SD 3.96Å; L663-M885 HydrophobicContact CD2-CG 4.41Å; L663-M885 HydrophobicContact CD2-SD 4.13Å; L663-M885 HydrophobicContact CG-SD 4.38Å; L663-F896 HydrophobicContact CD2-CD2 4.27Å; L663-F896 HydrophobicContact CD2-CE2 3.99Å
664	T	95	Very high	93.3	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-59.3	-41.5	176.8	-53.5	0	0	0	0	111.5	Y594 Q660 I661 M666 L667 K668 F689 C690	Y594-T664 VanDerWaalsContact CE1-OG1 3.29Å; Y594-T664 WeakPolarHBondContact CE1-OG1 3.42Å; Y594-T664 VanDerWaalsContact OH-CG2 3.26Å; Y594-T664 WeakPolarHBondContact OH-CG2 3.14Å; Y594-T664 PolarHBondContact OH-OG1 3.31Å; Q660-T664 VanDerWaalsContact O-CB 3.32Å; Q660-T664 WeakPolarHBondContact O-CB 3.35Å; Q660-T664 PolarHBondContact O-N 3.14Å; Q660-T664 PolarHBondContact O-OG1 3.05Å; I661-T664 PolarHBondContact O-N 3.28Å; T664-M666 VanDerWaalsContact C-N 3.31Å; T664-M666 PolarHBondContact O-N 3.49Å; T664-L667 PolarHBondContact O-N 3.27Å; T664-K668 PolarHBondContact O-N 3.21Å; T664-F689 HydrophobicContact CG2-CD1 4.02Å; T664-F689 HydrophobicContact CG2-CE1 3.93Å; T664-C690 HydrophobicContact CG2-CB 4.07Å
665	S	93.1	Very high	93.3	Very high	24 Å²	24	19.5 Å²	19.5	17%	0.168	11%	0.114	C	C	.	.	H	α-helix	trans	-63.6	-36.7	176.9	-58.2	0	0	0	0	111.8	I661 A662 L663 M669	I661-S665 WeakPolarHBondContact O-CB 3.15Å; I661-S665 PolarHBondContact O-N 2.72Å; I661-S665 PolarHBondContact O-OG 2.6Å; A662-S665 PolarHBondContact O-N 2.99Å; L663-S665 VanDerWaalsContact C-N 3.29Å; L663-S665 PolarHBondContact O-N 2.69Å; S665-M669 WeakPolarHBondContact O-CB 3.48Å; S665-M669 PolarHBondContact O-N 2.72Å; S665-M669 VanDerWaalsContact O-N 3.08Å
666	M	92.8	Very high	93.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-69.2	-43.1	173.7	-71	-177.1	73.5	0	0	112.3	F612 V614 F615 A662 L663 T664 M669 M670 F896 I915	F612-M666 HydrophobicContact CB-CE 3.93Å; F612-M666 HydrophobicContact CB-SD 4.27Å; F612-M666 HydrophobicContact CD1-CE 3.67Å; F612-M666 HydrophobicContact CD2-CE 3.88Å; F612-M666 HydrophobicContact CE1-CE 4.12Å; F612-M666 HydrophobicContact CE2-CE 4.33Å; F612-M666 HydrophobicContact CG-CE 3.54Å; F612-M666 HydrophobicContact CG-SD 4.37Å; F612-M666 HydrophobicContact CZ-CE 4.44Å; V614-M666 HydrophobicContact CB-CG 4.44Å; V614-M666 HydrophobicContact CG1-CG 4.1Å; F615-M666 HydrophobicContact CB-SD 3.89Å; F615-M666 HydrophobicContact CD2-SD 3.75Å; F615-M666 HydrophobicContact CG-SD 4.3Å; A662-M666 PolarHBondContact O-N 3.38Å; L663-M666 PolarHBondContact O-N 2.88Å; L663-M666 VanDerWaalsContact O-N 3.11Å; T664-M666 VanDerWaalsContact C-N 3.31Å; T664-M666 PolarHBondContact O-N 3.49Å; M666-M669 WeakPolarHBondContact O-CB 3.39Å; M666-M669 PolarHBondContact O-N 2.89Å; M666-M670 WeakPolarHBondContact O-CE 3.49Å; M666-M670 WeakPolarHBondContact O-CG 3.3Å; M666-M670 PolarHBondContact O-N 2.94Å; M666-F896 HydrophobicContact CB-CZ 4.49Å; M666-F896 HydrophobicContact CE-CE1 3.49Å; M666-F896 VanDerWaalsContact CE-CE1 3.49Å; M666-F896 HydrophobicContact CE-CZ 3.67Å; M666-F896 HydrophobicContact SD-CE1 4.39Å; M666-F896 HydrophobicContact SD-CZ 4.13Å; M666-I915 HydrophobicContact CB-CG2 4.21Å; M666-I915 HydrophobicContact CE-CB 3.98Å; M666-I915 HydrophobicContact CE-CD1 3.58Å; M666-I915 HydrophobicContact CE-CG1 4.38Å; M666-I915 HydrophobicContact CE-CG2 3.93Å; M666-I915 HydrophobicContact CG-CG2 4.24Å
667	L	93.9	Very high	93.5	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-59	-52.1	177.4	-69.8	171	0	0	0	111.6	F592 L663 T664 M669 M670 G671 V672 I859 V861 L884	F592-L667 HydrophobicContact CD2-CD1 4.16Å; F592-L667 HydrophobicContact CE1-CD1 4.18Å; F592-L667 HydrophobicContact CE2-CB 4.16Å; F592-L667 HydrophobicContact CE2-CD1 3.58Å; F592-L667 HydrophobicContact CZ-CB 3.97Å; F592-L667 HydrophobicContact CZ-CD1 3.61Å; F592-L667 HydrophobicContact CZ-CG 4.33Å; L663-L667 WeakPolarHBondContact O-CG 3.17Å; L663-L667 PolarHBondContact O-N 3.08Å; T664-L667 PolarHBondContact O-N 3.27Å; L667-M669 VanDerWaalsContact C-N 3.29Å; L667-M669 PolarHBondContact O-N 3.44Å; L667-M670 HydrophobicContact CD2-CE 4.35Å; L667-M670 PolarHBondContact O-N 3.07Å; L667-M670 VanDerWaalsContact O-N 3.08Å; L667-G671 PolarHBondContact O-N 3.23Å; L667-V672 HydrophobicContact CB-CB 4.26Å; L667-V672 PolarHBondContact O-N 2.69Å; L667-I859 HydrophobicContact CD1-CG2 4.29Å; L667-V861 HydrophobicContact CD1-CG2 3.86Å; L667-L884 HydrophobicContact CD1-CD1 3.95Å; L667-L884 HydrophobicContact CD2-CD1 4.31Å; L667-L884 HydrophobicContact CG-CD1 4.34Å
668	K	91	Very high	93.6	Very high	53 Å²	53	19.6 Å²	19.6	23%	0.23	11%	0.114	C	C	.	.	H	α-helix	trans	-59.4	-38.8	175.5	-75	-172.3	171.3	-177.9	0	112.1	T664 M670 G671 E673 C690 N692	T664-K668 PolarHBondContact O-N 3.21Å; K668-M670 VanDerWaalsContact C-N 3.27Å; K668-M670 PolarHBondContact O-N 3.36Å; K668-G671 PolarHBondContact O-N 3.05Å; K668-G671 VanDerWaalsContact O-N 3.08Å; K668-E673 VanDerWaalsContact CE-OE1 3.25Å; K668-E673 WeakPolarHBondContact CE-OE1 3.19Å; K668-E673 IonicContact NZ-OE1 2.86Å; K668-C690 PolarHBondContact NZ-O 3.09Å; K668-N692 PolarHBondContact NZ-OD1 3.44Å
669	M	88.7	Confident	93.5	Very high	88 Å²	88	19.6 Å²	19.6	43%	0.433	11%	0.114	S	C	.	.	H	α-helix	trans	-63.7	-29	176.3	-172.1	61.7	64.8	0	0	113.3	S665 M666 L667 G671 N914 I915	S665-M669 WeakPolarHBondContact O-CB 3.48Å; S665-M669 PolarHBondContact O-N 2.72Å; S665-M669 VanDerWaalsContact O-N 3.08Å; M666-M669 WeakPolarHBondContact O-CB 3.39Å; M666-M669 PolarHBondContact O-N 2.89Å; L667-M669 VanDerWaalsContact C-N 3.29Å; L667-M669 PolarHBondContact O-N 3.44Å; M669-G671 VanDerWaalsContact C-N 3.32Å; M669-N914 HydrophobicContact CG-CB 3.74Å; M669-N914 VanDerWaalsContact O-CB 3.23Å; M669-N914 WeakPolarHBondContact O-CB 3.48Å; M669-N914 PolarHBondContact O-ND2 2.85Å; M669-N914 HydrophobicContact SD-CB 4.07Å; M669-I915 HydrophobicContact CB-CG2 4.34Å; M669-I915 HydrophobicContact CG-CG2 4.19Å
670	M	90.3	Very high	93.4	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.005	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	3.8	174.9	-65.7	-178.4	-67.8	0	0	113.9	M666 L667 K668 F896 L900 L910 D911 V912 I915	M666-M670 WeakPolarHBondContact O-CE 3.49Å; M666-M670 WeakPolarHBondContact O-CG 3.3Å; M666-M670 PolarHBondContact O-N 2.94Å; L667-M670 HydrophobicContact CD2-CE 4.35Å; L667-M670 PolarHBondContact O-N 3.07Å; L667-M670 VanDerWaalsContact O-N 3.08Å; K668-M670 VanDerWaalsContact C-N 3.27Å; K668-M670 PolarHBondContact O-N 3.36Å; M670-F896 HydrophobicContact CE-CZ 4.4Å; M670-L900 HydrophobicContact CE-CD1 3.78Å; M670-L900 HydrophobicContact CE-CD2 3.58Å; M670-L900 HydrophobicContact CE-CG 4.34Å; M670-L900 HydrophobicContact SD-CD1 3.68Å; M670-L900 HydrophobicContact SD-CD2 4.32Å; M670-L910 HydrophobicContact CB-CD2 4.46Å; M670-D911 PolarHBondContact O-N 3.34Å; M670-V912 HydrophobicContact SD-CG1 4.15Å; M670-I915 HydrophobicContact CG-CG1 4.33Å; M670-I915 HydrophobicContact CG-CG2 3.84Å; M670-I915 HydrophobicContact SD-CD1 3.67Å; M670-I915 HydrophobicContact SD-CG1 4.04Å; M670-I915 HydrophobicContact SD-CG2 4.24Å
671	G	88.1	Confident	93.2	Very high	60 Å²	60	20.7 Å²	20.7	62%	0.619	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.6	12.7	-179.5	0	0	0	0	0	115.1	L667 K668 M669 E673	L667-G671 PolarHBondContact O-N 3.23Å; K668-G671 PolarHBondContact O-N 3.05Å; K668-G671 VanDerWaalsContact O-N 3.08Å; M669-G671 VanDerWaalsContact C-N 3.32Å; G671-E673 PolarHBondContact O-N 2.76Å
672	V	91.3	Very high	92.9	Very high	6 Å²	6	20.7 Å²	20.7	4%	0.036	12%	0.12	C	C	.	.			trans	-91	100.3	177.7	-167.8	0	0	0	0	110.2	V590 F592 L667 I859 L908 L910	V590-V672 HydrophobicContact CG1-CG1 4.04Å; F592-V672 HydrophobicContact CE1-CG1 3.73Å; F592-V672 HydrophobicContact CZ-CB 4.36Å; F592-V672 HydrophobicContact CZ-CG1 3.77Å; L667-V672 HydrophobicContact CB-CB 4.26Å; L667-V672 PolarHBondContact O-N 2.69Å; V672-I859 HydrophobicContact CG1-CD1 4.31Å; V672-L908 HydrophobicContact CG1-CD2 4.14Å; V672-L908 HydrophobicContact CG2-CD2 4.05Å; V672-L910 HydrophobicContact CG2-CD2 3.27Å
673	E	90.2	Very high	92.8	Very high	86 Å²	86	20.7 Å²	20.7	40%	0.402	12%	0.12	S	C	.	.			trans	-86.9	148.3	159.2	-81.6	-77.8	124.9	0	0	109.8	K668 G671 R811	K668-E673 VanDerWaalsContact CE-OE1 3.25Å; K668-E673 WeakPolarHBondContact CE-OE1 3.19Å; K668-E673 IonicContact NZ-OE1 2.86Å; G671-E673 PolarHBondContact O-N 2.76Å; E673-R811 IonicContact OE2-CZ 3.21Å; E673-R811 IonicContact OE2-NH1 2.85Å; E673-R811 PolarHBondContact OE2-NH1 3.25Å; E673-R811 IonicContact OE2-NH2 2.7Å; E673-R811 PolarHBondContact OE2-NH2 2.61Å
674	P	94.1	Very high	92.7	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.006	12%	0.12	C	C	.	.			trans	-84.2	144.2	166.3	31.8	-31.6	0	0	0	112.3	V590 F592 G676 I677 R811	V590-P674 CarbonylContact O-C 3.54Å; F592-P674 HydrophobicContact CB-CB 4.27Å; F592-P674 HydrophobicContact CD1-CB 3.78Å; F592-P674 HydrophobicContact CD2-CB 4.2Å; F592-P674 HydrophobicContact CD2-CG 4.1Å; F592-P674 HydrophobicContact CE1-CB 4.04Å; F592-P674 HydrophobicContact CE2-CB 4.45Å; F592-P674 HydrophobicContact CE2-CG 4.21Å; F592-P674 HydrophobicContact CG-CB 3.84Å; F592-P674 HydrophobicContact CG-CG 4.24Å; F592-P674 HydrophobicContact CZ-CB 4.36Å; F592-P674 HydrophobicContact CZ-CG 4.44Å; P674-G676 WeakPolarHBondContact CB-O 3.41Å; P674-I677 HydrophobicContact CB-CG1 3.88Å; P674-I677 HydrophobicContact CG-CD1 3.79Å; P674-I677 HydrophobicContact CG-CG1 3.56Å; P674-R811 WeakPolarHBondContact O-CD 3.19Å; P674-R811 PolarHBondContact O-NH1 3.19Å
675	D	94.1	Very high	92.6	Very high	91 Å²	91	20.7 Å²	20.7	49%	0.487	12%	0.12	S	C	.	.	S	Bend	trans	-81.2	-30.7	161.5	-60.5	-70.3	0	0	0	111.3	P589 V590 R811	P589-D675 VanDerWaalsContact CA-OD2 3.28Å; P589-D675 WeakPolarHBondContact CA-OD2 3.44Å; P589-D675 HydrophobicContact CB-CB 4.14Å; V590-D675 PolarHBondContact N-OD2 3.41Å; V590-D675 PolarHBondContact O-N 3.12Å; D675-R811 WeakPolarHBondContact O-CB 3.26Å; D675-R811 VanDerWaalsContact O-CG 3.28Å; D675-R811 WeakPolarHBondContact O-CG 3.4Å
676	G	95.2	Very high	92.7	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.01	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	149.1	175.1	0	0	0	0	0	113.8	V590 W591 F592 P674 R811	V590-G676 PolarHBondContact O-N 3.15Å; V590-G676 VanDerWaalsContact O-N 3.12Å; W591-G676 CarbonylContact C-O 3.54Å; W591-G676 VanDerWaalsContact CA-O 3.3Å; W591-G676 WeakPolarHBondContact CA-O 3.4Å; F592-G676 PolarHBondContact N-O 3.47Å; P674-G676 WeakPolarHBondContact CB-O 3.41Å; G676-R811 CarbonylContact C-O 3.59Å; G676-R811 WeakPolarHBondContact CA-O 3.37Å
677	I	97.3	Very high	92.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	125.6	-174.2	-54.8	167.5	0	0	0	109	F592 Y594 P674 A687 C690 D691 R811 W812 I813	F592-I677 WeakPolarHBondContact O-CA 3.49Å; Y594-I677 HydrophobicContact CD2-CG2 4.19Å; Y594-I677 HydrophobicContact CE2-CG2 3.99Å; P674-I677 HydrophobicContact CB-CG1 3.88Å; P674-I677 HydrophobicContact CG-CD1 3.79Å; P674-I677 HydrophobicContact CG-CG1 3.56Å; I677-A687 HydrophobicContact CG2-CB 3.69Å; I677-C690 HydrophobicContact CD1-CB 4.1Å; I677-D691 HydrophobicContact CD1-CB 4.12Å; I677-R811 PolarHBondContact N-O 3.05Å; I677-W812 HydrophobicContact CB-CB 4.38Å; I677-W812 WeakPolarHBondContact O-CA 3.49Å; I677-I813 PolarHBondContact O-N 2.93Å
678	V	95.9	Very high	92.6	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	136.8	172	-173.1	0	0	0	0	109.2	W591 F592 I593 Y594 I813 F845 A848	W591-V678 HydrophobicContact CE3-CG2 3.96Å; W591-V678 HydrophobicContact CZ3-CG2 3.79Å; F592-V678 PolarHBondContact O-N 3.08Å; I593-V678 CarbonylContact C-O 3.52Å; I593-V678 WeakPolarHBondContact CA-O 3.47Å; I593-V678 HydrophobicContact CD1-CB 3.73Å; I593-V678 HydrophobicContact CD1-CG2 3.79Å; Y594-V678 PolarHBondContact N-O 3.38Å; V678-I813 HydrophobicContact CG2-CB 4.2Å; V678-F845 HydrophobicContact CG1-CD2 3.76Å; V678-F845 HydrophobicContact CG1-CE2 3.65Å; V678-A848 HydrophobicContact CG1-CB 3.61Å; V678-A848 VanDerWaalsContact CG2-O 3.31Å; V678-A848 WeakPolarHBondContact CG2-O 3.41Å
679	G	93.3	Very high	92.8	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	155.6	164.5	0	0	0	0	0	112.1	S815	G679-S815 WeakPolarHBondContact O-CB 3.44Å; G679-S815 PolarHBondContact O-OG 2.87Å
680	H	94	Very high	93.1	Very high	17 Å²	17	14.4 Å²	14.4	8%	0.079	9%	0.087	C	C	.	.			trans	-117.4	121.2	167.8	-177.6	-72.4	0	0	0	108.5	Y594 G596 T682 G683 N744 F845 L867	Y594-H680 PolarHBondContact O-N 3.47Å; G596-H680 WeakPolarHBondContact CA-O 3.46Å; G596-H680 PolarHBondContact N-O 2.96Å; H680-T682 PolarHBondContact O-N 2.78Å; H680-T682 VanDerWaalsContact O-N 3.17Å; H680-G683 PolarHBondContact O-N 3Å; H680-N744 PolarHBondContact NE2-OD1 2.98Å; H680-F845 HydrophobicContact CB-CD2 3.96Å; H680-F845 HydrophobicContact CB-CE2 4.1Å; H680-F845 AromaticContact CD2-CD1 3.79Å; H680-F845 AromaticContact CD2-CD2 3.88Å; H680-F845 AromaticContact CD2-CG 3.53Å; H680-L867 HydrophobicContact CB-CD1 3.92Å
681	S	92.5	Very high	93.3	Very high	6 Å²	6	14.9 Å²	14.9	4%	0.042	9%	0.09	C	C	.	.	G	3₁₀ helix	trans	53	-123.3	176.7	-177.3	0	0	0	0	111	G683 E684 H783 N838	S681-G683 PolarHBondContact O-N 3.46Å; S681-G683 VanDerWaalsContact O-N 3.07Å; S681-E684 PolarHBondContact O-N 2.76Å; S681-H783 PolarHBondContact OG-NE2 3.03Å; S681-N838 PolarHBondContact O-ND2 2.86Å; S681-N838 PolarHBondContact O-OD1 2.7Å
682	T	89.9	Confident	93.5	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	-44.6	-34.4	172.9	-37.3	0	0	0	0	114.4	M597 F653 H680 E684 M685	M597-T682 PolarHBondContact N-OG1 2.9Å; F653-T682 HydrophobicContact CD1-CG2 3.81Å; F653-T682 HydrophobicContact CD2-CG2 4.2Å; F653-T682 HydrophobicContact CE1-CG2 3.92Å; F653-T682 HydrophobicContact CE2-CG2 4.31Å; F653-T682 HydrophobicContact CG-CG2 3.95Å; F653-T682 HydrophobicContact CZ-CG2 4.17Å; H680-T682 PolarHBondContact O-N 2.78Å; H680-T682 VanDerWaalsContact O-N 3.17Å; T682-E684 VanDerWaalsContact C-N 3.25Å; T682-E684 PolarHBondContact O-N 3.13Å; T682-M685 HydrophobicContact CG2-CE 3.5Å; T682-M685 VanDerWaalsContact CG2-CE 3.5Å; T682-M685 WeakPolarHBondContact O-CE 3.45Å; T682-M685 PolarHBondContact O-N 3Å
683	G	92.3	Very high	93.5	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	-64.8	-22.1	-175.5	0	0	0	0	0	114.8	H680 S681 M685 V686 A687	H680-G683 PolarHBondContact O-N 3Å; S681-G683 PolarHBondContact O-N 3.46Å; S681-G683 VanDerWaalsContact O-N 3.07Å; G683-M685 PolarHBondContact O-N 2.96Å; G683-M685 VanDerWaalsContact O-N 3.13Å; G683-V686 PolarHBondContact O-N 3.36Å; G683-A687 PolarHBondContact O-N 3.02Å
684	E	93	Very high	93.6	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-60.6	-22.4	176.4	-74.3	-147	105.3	0	0	113.9	S681 T682 V686 G688 W812 S815 S816 Y834 N838	S681-E684 PolarHBondContact O-N 2.76Å; T682-E684 VanDerWaalsContact C-N 3.25Å; T682-E684 PolarHBondContact O-N 3.13Å; E684-V686 VanDerWaalsContact C-N 3.29Å; E684-V686 PolarHBondContact O-N 3.3Å; E684-G688 PolarHBondContact O-N 2.87Å; E684-G688 VanDerWaalsContact O-N 3.15Å; E684-W812 HydrophobicContact CB-CZ2 4.2Å; E684-W812 WeakPolarHBondContact O-CZ2 3.45Å; E684-W812 PolarHBondContact OE1-NE1 3.31Å; E684-S815 PolarHBondContact OE1-N 2.93Å; E684-S816 VanDerWaalsContact OE2-CB 3.24Å; E684-S816 WeakPolarHBondContact OE2-CB 3.3Å; E684-S816 PolarHBondContact OE2-OG 3.25Å; E684-Y834 VanDerWaalsContact CD-OH 3.31Å; E684-Y834 PolarHBondContact OE1-OH 2.92Å; E684-Y834 PolarHBondContact OE2-OH 3.17Å; E684-N838 WeakPolarHBondContact CB-ND2 3.27Å; E684-N838 WeakPolarHBondContact CG-ND2 3.43Å; E684-N838 PolarHBondContact OE2-ND2 3.49Å
685	M	93	Very high	93.5	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-64.9	-36.4	172.9	-61.4	-176.6	-64.3	0	0	111.6	F653 S657 T682 G683 F689 T699 T702 A703 R706	F653-M685 HydrophobicContact CD1-CE 4.21Å; S657-M685 WeakPolarHBondContact OG-CE 3.37Å; T682-M685 HydrophobicContact CG2-CE 3.5Å; T682-M685 VanDerWaalsContact CG2-CE 3.5Å; T682-M685 WeakPolarHBondContact O-CE 3.45Å; T682-M685 PolarHBondContact O-N 3Å; G683-M685 PolarHBondContact O-N 2.96Å; G683-M685 VanDerWaalsContact O-N 3.13Å; M685-F689 PolarHBondContact O-N 3.34Å; M685-T699 HydrophobicContact CB-CG2 4.18Å; M685-T699 WeakPolarHBondContact O-CG2 3.42Å; M685-T702 HydrophobicContact CG-CG2 4.22Å; M685-T702 HydrophobicContact SD-CG2 3.76Å; M685-A703 HydrophobicContact CE-CB 3.71Å; M685-A703 HydrophobicContact SD-CB 4.11Å; M685-R706 WeakPolarHBondContact SD-CD 3.07Å; M685-R706 PolarHBondContact SD-NH1 2.94Å; M685-R706 VanDerWaalsContact SD-NH1 3.37Å
686	V	95.1	Very high	93.4	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-90.5	-22.6	-179.1	-165.5	0	0	0	0	111.6	Y594 Q660 I661 G683 E684 G688 F689 C690 T699	Y594-V686 HydrophobicContact CD1-CB 3.9Å; Y594-V686 HydrophobicContact CD1-CG1 4.01Å; Y594-V686 HydrophobicContact CE1-CB 4.01Å; Y594-V686 HydrophobicContact CE1-CG1 3.61Å; Q660-V686 HydrophobicContact CB-CB 4.08Å; Q660-V686 HydrophobicContact CB-CG1 3.82Å; Q660-V686 HydrophobicContact CB-CG2 3.93Å; I661-V686 HydrophobicContact CG1-CG1 3.84Å; I661-V686 HydrophobicContact CG1-CG2 4.18Å; G683-V686 PolarHBondContact O-N 3.36Å; E684-V686 VanDerWaalsContact C-N 3.29Å; E684-V686 PolarHBondContact O-N 3.3Å; V686-G688 VanDerWaalsContact C-N 3.27Å; V686-G688 PolarHBondContact O-N 3.35Å; V686-F689 HydrophobicContact CG1-CB 4.27Å; V686-F689 HydrophobicContact CG1-CD1 4.19Å; V686-F689 WeakPolarHBondContact O-CB 3.41Å; V686-F689 PolarHBondContact O-N 3.4Å; V686-F689 VanDerWaalsContact O-N 3.15Å; V686-C690 PolarHBondContact O-N 3.26Å; V686-T699 HydrophobicContact CG2-CG2 4.01Å
687	A	94	Very high	93.4	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-55.1	-45.1	160.8	0	0	0	0	0	110.9	Y594 I677 G683 F689 C690 D691 W812	Y594-A687 HydrophobicContact CD2-CB 4.24Å; I677-A687 HydrophobicContact CG2-CB 3.69Å; G683-A687 PolarHBondContact O-N 3.02Å; A687-F689 VanDerWaalsContact C-N 3.33Å; A687-F689 PolarHBondContact O-N 2.82Å; A687-C690 WeakPolarHBondContact O-CB 3.28Å; A687-C690 PolarHBondContact O-N 3.28Å; A687-C690 VanDerWaalsContact O-N 3.08Å; A687-D691 WeakPolarHBondContact O-CB 3.41Å; A687-D691 PolarHBondContact O-N 3.12Å; A687-W812 HydrophobicContact CB-CD2 4.21Å; A687-W812 HydrophobicContact CB-CG 4.46Å; A687-W812 HydrophobicContact CB-CZ2 4.13Å
688	G	92.3	Very high	93.2	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-61.4	-33.3	173.1	0	0	0	0	0	114.6	E684 V686 N692 C693 F694 W812	E684-G688 PolarHBondContact O-N 2.87Å; E684-G688 VanDerWaalsContact O-N 3.15Å; V686-G688 VanDerWaalsContact C-N 3.27Å; V686-G688 PolarHBondContact O-N 3.35Å; G688-N692 PolarHBondContact O-N 3.4Å; G688-C693 CarbonylContact O-C 3.46Å; G688-C693 WeakPolarHBondContact O-CA 3.34Å; G688-C693 WeakPolarHBondContact O-CB 3.46Å; G688-C693 PolarHBondContact O-N 2.69Å; G688-F694 PolarHBondContact O-N 3.32Å; G688-W812 VanDerWaalsContact CA-CZ3 3.43Å
689	F	94.9	Very high	93.1	Very high	33 Å²	33	15.3 Å²	15.3	15%	0.145	8%	0.081	C	C	.	.	H	α-helix	trans	-69.2	-39.6	170.2	172.2	-105.6	0	0	0	112.2	I661 T664 M685 V686 A687 N692 L696	I661-F689 HydrophobicContact CB-CD1 4.48Å; I661-F689 HydrophobicContact CB-CE1 4.41Å; I661-F689 HydrophobicContact CG1-CD1 4.3Å; I661-F689 HydrophobicContact CG2-CD1 4.18Å; I661-F689 HydrophobicContact CG2-CE1 3.77Å; I661-F689 HydrophobicContact CG2-CE2 4.34Å; I661-F689 HydrophobicContact CG2-CZ 3.86Å; T664-F689 HydrophobicContact CG2-CD1 4.02Å; T664-F689 HydrophobicContact CG2-CE1 3.93Å; M685-F689 PolarHBondContact O-N 3.34Å; V686-F689 HydrophobicContact CG1-CB 4.27Å; V686-F689 HydrophobicContact CG1-CD1 4.19Å; V686-F689 WeakPolarHBondContact O-CB 3.41Å; V686-F689 PolarHBondContact O-N 3.4Å; V686-F689 VanDerWaalsContact O-N 3.15Å; A687-F689 VanDerWaalsContact C-N 3.33Å; A687-F689 PolarHBondContact O-N 2.82Å; F689-N692 PolarHBondContact O-N 3.31Å; F689-L696 HydrophobicContact CE2-CB 4.28Å
690	C	95.2	Very high	93.2	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-66.6	-41	178.2	-162	0	0	0	0	112	F592 Y594 T664 K668 I677 V686 A687 N692	F592-C690 VanDerWaalsContact CD2-SG 3.6Å; Y594-C690 HydrophobicContact CE2-CB 4.05Å; Y594-C690 WeakPolarHBondContact OH-CB 3.3Å; Y594-C690 PolarHBondContact OH-SG 2.89Å; Y594-C690 VanDerWaalsContact OH-SG 3.37Å; T664-C690 HydrophobicContact CG2-CB 4.07Å; K668-C690 PolarHBondContact NZ-O 3.09Å; I677-C690 HydrophobicContact CD1-CB 4.1Å; V686-C690 PolarHBondContact O-N 3.26Å; A687-C690 WeakPolarHBondContact O-CB 3.28Å; A687-C690 PolarHBondContact O-N 3.28Å; A687-C690 VanDerWaalsContact O-N 3.08Å; C690-N692 PolarHBondContact O-N 2.97Å
691	D	93.9	Very high	93.3	Very high	12 Å²	12	16.2 Å²	16.2	6%	0.064	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-3.5	174.6	-164.3	48.7	0	0	0	113.5	I677 A687 C693 R808 S809 W812	I677-D691 HydrophobicContact CD1-CB 4.12Å; A687-D691 WeakPolarHBondContact O-CB 3.41Å; A687-D691 PolarHBondContact O-N 3.12Å; D691-C693 PolarHBondContact O-N 2.95Å; D691-C693 PolarHBondContact OD2-SG 2.8Å; D691-R808 WeakPolarHBondContact OD2-CA 3.25Å; D691-S809 WeakPolarHBondContact OD1-CB 3.48Å; D691-S809 PolarHBondContact OD1-OG 2.82Å; D691-S809 PolarHBondContact OD2-N 3.42Å; D691-W812 HydrophobicContact CB-CB 4.38Å; D691-W812 HydrophobicContact CB-CE3 4.01Å
692	N	91.7	Very high	93.4	Very high	98 Å²	98	16 Å²	16	52%	0.524	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	10.1	-173	-41.9	-67.1	0	0	0	114.7	K668 G688 F689 C690 F694	K668-N692 PolarHBondContact NZ-OD1 3.44Å; G688-N692 PolarHBondContact O-N 3.4Å; F689-N692 PolarHBondContact O-N 3.31Å; C690-N692 PolarHBondContact O-N 2.97Å; N692-F694 VanDerWaalsContact C-N 3.3Å; N692-F694 PolarHBondContact O-N 3.47Å
693	C	91.2	Very high	93.6	Very high	4 Å²	4	16 Å²	16	3%	0.027	8%	0.084	C	C	.	.	S	Bend	trans	-63	-33	169.9	-85.2	0	0	0	0	113.1	G688 D691 K806 L807 R808 W812 C830	G688-C693 CarbonylContact O-C 3.46Å; G688-C693 WeakPolarHBondContact O-CA 3.34Å; G688-C693 WeakPolarHBondContact O-CB 3.46Å; G688-C693 PolarHBondContact O-N 2.69Å; D691-C693 PolarHBondContact O-N 2.95Å; D691-C693 PolarHBondContact OD2-SG 2.8Å; C693-K806 HydrophobicContact CB-CB 4.5Å; C693-K806 WeakPolarHBondContact O-CD 3.45Å; C693-K806 WeakPolarHBondContact O-CE 3.33Å; C693-K806 WeakPolarHBondContact O-CG 3.49Å; C693-K806 PolarHBondContact O-NZ 2.86Å; C693-L807 PolarHBondContact SG-O 3.4Å; C693-R808 VanDerWaalsContact SG-CA 3.57Å; C693-W812 HydrophobicContact CB-CZ3 4.36Å; C693-C830 HydrophobicContact CB-CB 3.56Å
694	F	91.9	Very high	93.7	Very high	5 Å²	5	16.5 Å²	16.5	2%	0.022	9%	0.086	C	C	.	.	S	Bend	trans	-117.8	147.2	175.7	-83.7	-9.5	0	0	0	112.5	G688 N692 E698 T699 T702 I802 C830 H835	G688-F694 PolarHBondContact O-N 3.32Å; N692-F694 VanDerWaalsContact C-N 3.3Å; N692-F694 PolarHBondContact O-N 3.47Å; F694-E698 WeakPolarHBondContact CA-OE2 3.48Å; F694-E698 HydrophobicContact CB-CB 4.19Å; F694-E698 HydrophobicContact CD1-CB 3.93Å; F694-E698 HydrophobicContact CE1-CB 4.44Å; F694-E698 HydrophobicContact CG-CB 4.02Å; F694-T699 VanDerWaalsContact CB-OG1 3.3Å; F694-T699 WeakPolarHBondContact CB-OG1 3.26Å; F694-T702 HydrophobicContact CE2-CG2 4.29Å; F694-I802 HydrophobicContact CE1-CD1 3.77Å; F694-I802 HydrophobicContact CE1-CG1 3.75Å; F694-I802 HydrophobicContact CE1-CG2 4.18Å; F694-I802 HydrophobicContact CZ-CD1 3.54Å; F694-I802 HydrophobicContact CZ-CG1 3.93Å; F694-C830 VanDerWaalsContact CD1-SG 3.59Å; F694-C830 WeakPolarHBondContact CE1-SG 3.18Å; F694-H835 AromaticContact CE2-CD2 3.89Å; F694-H835 AromaticContact CE2-CE1 4Å; F694-H835 AromaticContact CE2-NE2 3.53Å; F694-H835 AromaticContact CZ-CD2 3.4Å; F694-H835 WeakPolarHBondContact CZ-CD2 3.26Å; F694-H835 AromaticContact CZ-NE2 3.34Å; F694-H835 VanDerWaalsContact CZ-NE2 3.34Å; F694-H835 WeakPolarHBondContact CZ-NE2 3.45Å
695	S	91.9	Very high	93.7	Very high	40 Å²	40	18.4 Å²	18.4	28%	0.28	9%	0.094	S	C	.	.			trans	-76.8	167.4	158.7	96.3	0	0	0	0	111.3	E697 E698 T699	S695-E697 VanDerWaalsContact CB-OE2 3.27Å; S695-E697 WeakPolarHBondContact CB-OE2 3.31Å; S695-E697 PolarHBondContact O-N 2.7Å; S695-E697 WeakPolarHBondContact OG-CB 3.43Å; S695-E697 PolarHBondContact OG-N 2.65Å; S695-E697 VanDerWaalsContact OG-N 3.13Å; S695-E697 PolarHBondContact OG-OE2 3.4Å; S695-E698 PolarHBondContact N-OE2 3.38Å; S695-E698 PolarHBondContact O-N 3.03Å; S695-E698 PolarHBondContact OG-N 2.67Å; S695-E698 VanDerWaalsContact OG-N 3.17Å; S695-T699 WeakPolarHBondContact O-CB 3.42Å; S695-T699 PolarHBondContact O-N 3.04Å; S695-T699 PolarHBondContact O-OG1 3.15Å
696	L	93.7	Very high	93.6	Very high	18 Å²	18	18.5 Å²	18.5	9%	0.094	10%	0.095	C	C	.	.	H	α-helix	trans	-56.8	-41.7	172.3	176	156.8	0	0	0	111.1	T618 R621 V625 I661 F689 T699 I700	T618-L696 HydrophobicContact CG2-CD1 3.86Å; R621-L696 HydrophobicContact CB-CD1 4.41Å; R621-L696 HydrophobicContact CB-CD2 4.46Å; R621-L696 HydrophobicContact CG-CD1 4.42Å; R621-L696 HydrophobicContact CG-CD2 3.99Å; V625-L696 HydrophobicContact CG2-CD2 4.27Å; I661-L696 HydrophobicContact CG2-CD1 3.92Å; I661-L696 HydrophobicContact CG2-CG 4.08Å; F689-L696 HydrophobicContact CE2-CB 4.28Å; L696-T699 PolarHBondContact O-N 3.28Å; L696-I700 WeakPolarHBondContact O-CB 3.39Å; L696-I700 WeakPolarHBondContact O-CG2 3.29Å; L696-I700 PolarHBondContact O-N 3.24Å
697	E	93.6	Very high	93.4	Very high	54 Å²	54	18.5 Å²	18.5	25%	0.252	10%	0.095	S	C	.	.	H	α-helix	trans	-64.6	-49.9	179.1	-57.6	71.5	-162	0	0	111.6	R621 V625 S695 T699 L701	R621-E697 IonicContact CZ-OE1 3.52Å; R621-E697 IonicContact NE-OE1 3.22Å; R621-E697 PolarHBondContact NE-OE1 3.5Å; R621-E697 IonicContact NH2-OE1 3.86Å; R621-E697 PolarHBondContact NH2-OE1 2.95Å; V625-E697 HydrophobicContact CG1-CB 4.46Å; V625-E697 HydrophobicContact CG2-CB 4.36Å; V625-E697 HydrophobicContact CG2-CG 3.77Å; S695-E697 VanDerWaalsContact CB-OE2 3.27Å; S695-E697 WeakPolarHBondContact CB-OE2 3.31Å; S695-E697 PolarHBondContact O-N 2.7Å; S695-E697 WeakPolarHBondContact OG-CB 3.43Å; S695-E697 PolarHBondContact OG-N 2.65Å; S695-E697 VanDerWaalsContact OG-N 3.13Å; S695-E697 PolarHBondContact OG-OE2 3.4Å; E697-T699 VanDerWaalsContact C-N 3.3Å; E697-T699 PolarHBondContact O-N 3.47Å; E697-L701 VanDerWaalsContact O-CB 3.3Å; E697-L701 WeakPolarHBondContact O-CB 3.36Å; E697-L701 WeakPolarHBondContact O-CD1 3.47Å; E697-L701 WeakPolarHBondContact O-CG 3.46Å; E697-L701 PolarHBondContact O-N 2.92Å; E697-L701 VanDerWaalsContact O-N 3.07Å
698	E	93.6	Very high	93.2	Very high	35 Å²	35	22 Å²	22	16%	0.164	11%	0.11	C	C	.	.	H	α-helix	trans	-58.7	-42.5	176.7	-67.7	172.4	135.8	0	0	111.1	F694 S695 T702 K806	F694-E698 WeakPolarHBondContact CA-OE2 3.48Å; F694-E698 HydrophobicContact CB-CB 4.19Å; F694-E698 HydrophobicContact CD1-CB 3.93Å; F694-E698 HydrophobicContact CE1-CB 4.44Å; F694-E698 HydrophobicContact CG-CB 4.02Å; S695-E698 PolarHBondContact N-OE2 3.38Å; S695-E698 PolarHBondContact O-N 3.03Å; S695-E698 PolarHBondContact OG-N 2.67Å; S695-E698 VanDerWaalsContact OG-N 3.17Å; E698-T702 VanDerWaalsContact O-CB 3.3Å; E698-T702 WeakPolarHBondContact O-CB 3.21Å; E698-T702 PolarHBondContact O-N 3.04Å; E698-T702 PolarHBondContact O-OG1 2.87Å; E698-K806 VanDerWaalsContact CD-NZ 3.27Å; E698-K806 IonicContact OE1-NZ 3.36Å; E698-K806 PolarHBondContact OE1-NZ 2.75Å; E698-K806 IonicContact OE2-NZ 2.8Å; E698-K806 PolarHBondContact OE2-NZ 2.89Å
699	T	94.9	Very high	93	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-65	-52.7	180	-51.6	0	0	0	0	112.3	I661 M685 V686 F694 S695 L696 E697 L701 T702 A703	I661-T699 HydrophobicContact CD1-CG2 3.75Å; I661-T699 HydrophobicContact CG1-CG2 4.18Å; M685-T699 HydrophobicContact CB-CG2 4.18Å; M685-T699 WeakPolarHBondContact O-CG2 3.42Å; V686-T699 HydrophobicContact CG2-CG2 4.01Å; F694-T699 VanDerWaalsContact CB-OG1 3.3Å; F694-T699 WeakPolarHBondContact CB-OG1 3.26Å; S695-T699 WeakPolarHBondContact O-CB 3.42Å; S695-T699 PolarHBondContact O-N 3.04Å; S695-T699 PolarHBondContact O-OG1 3.15Å; L696-T699 PolarHBondContact O-N 3.28Å; E697-T699 VanDerWaalsContact C-N 3.3Å; E697-T699 PolarHBondContact O-N 3.47Å; T699-L701 PolarHBondContact O-N 3.37Å; T699-T702 PolarHBondContact O-N 2.91Å; T699-A703 PolarHBondContact O-N 3.24Å
700	I	95.6	Very high	92.7	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-72.2	-30.5	-173.8	-160.1	67.4	0	0	0	112.1	C622 V625 L626 V654 A658 L696 Y704	C622-I700 HydrophobicContact CB-CD1 4.23Å; C622-I700 HydrophobicContact CB-CG1 4.04Å; V625-I700 HydrophobicContact CB-CG2 3.91Å; V625-I700 HydrophobicContact CG1-CG2 3.54Å; V625-I700 HydrophobicContact CG2-CG2 4.47Å; L626-I700 HydrophobicContact CD1-CD1 4.47Å; L626-I700 HydrophobicContact CD1-CG1 3.83Å; L626-I700 HydrophobicContact CG-CG1 4.08Å; V654-I700 HydrophobicContact CG1-CD1 4.4Å; V654-I700 WeakPolarHBondContact O-CD1 3.38Å; A658-I700 HydrophobicContact CB-CD1 4.1Å; L696-I700 WeakPolarHBondContact O-CB 3.39Å; L696-I700 WeakPolarHBondContact O-CG2 3.29Å; L696-I700 PolarHBondContact O-N 3.24Å; I700-Y704 PolarHBondContact O-N 2.99Å
701	L	94.9	Very high	92.3	Very high	36 Å²	36	24 Å²	24	19%	0.188	13%	0.125	C	C	.	.	H	α-helix	trans	-68.9	-41.3	170.5	-70	172.2	0	0	0	111.5	V625 L626 F629 E697 T699 A703 Y704 F705 V801	V625-L701 HydrophobicContact CG1-CD1 4.21Å; V625-L701 HydrophobicContact CG1-CD2 3.92Å; V625-L701 HydrophobicContact CG1-CG 3.79Å; L626-L701 HydrophobicContact CD2-CD2 4.17Å; F629-L701 HydrophobicContact CD2-CD2 4.37Å; F629-L701 HydrophobicContact CE2-CD2 3.58Å; F629-L701 HydrophobicContact CZ-CD2 4.2Å; E697-L701 VanDerWaalsContact O-CB 3.3Å; E697-L701 WeakPolarHBondContact O-CB 3.36Å; E697-L701 WeakPolarHBondContact O-CD1 3.47Å; E697-L701 WeakPolarHBondContact O-CG 3.46Å; E697-L701 PolarHBondContact O-N 2.92Å; E697-L701 VanDerWaalsContact O-N 3.07Å; T699-L701 PolarHBondContact O-N 3.37Å; L701-A703 VanDerWaalsContact C-N 3.32Å; L701-A703 PolarHBondContact O-N 3.16Å; L701-Y704 PolarHBondContact O-N 3.16Å; L701-F705 HydrophobicContact CB-CD2 4.45Å; L701-F705 HydrophobicContact CB-CE2 4.48Å; L701-F705 HydrophobicContact CD2-CE2 4.37Å; L701-F705 WeakPolarHBondContact O-CD2 3.32Å; L701-F705 PolarHBondContact O-N 3.01Å; L701-V801 HydrophobicContact CB-CG1 3.64Å; L701-V801 HydrophobicContact CB-CG2 4.23Å; L701-V801 HydrophobicContact CD1-CG1 4.37Å
702	T	94.2	Very high	92	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.3	-43.4	174.8	-61.2	0	0	0	0	111	M685 F694 E698 T699 F705 R706 L798 H835	M685-T702 HydrophobicContact CG-CG2 4.22Å; M685-T702 HydrophobicContact SD-CG2 3.76Å; F694-T702 HydrophobicContact CE2-CG2 4.29Å; E698-T702 VanDerWaalsContact O-CB 3.3Å; E698-T702 WeakPolarHBondContact O-CB 3.21Å; E698-T702 PolarHBondContact O-N 3.04Å; E698-T702 PolarHBondContact O-OG1 2.87Å; T699-T702 PolarHBondContact O-N 2.91Å; T702-F705 PolarHBondContact O-N 3.01Å; T702-R706 HydrophobicContact CG2-CG 4.5Å; T702-R706 WeakPolarHBondContact O-CB 3.13Å; T702-R706 VanDerWaalsContact O-CG 3.27Å; T702-R706 WeakPolarHBondContact O-CG 3.44Å; T702-R706 PolarHBondContact O-N 3.43Å; T702-L798 HydrophobicContact CG2-CD1 4.15Å; T702-L798 HydrophobicContact CG2-CD2 3.9Å; T702-H835 HydrophobicContact CG2-CB 4.11Å
703	A	94.3	Very high	91.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.4	-45.5	173.6	0	0	0	0	0	112.7	S657 M685 T699 L701 G707	S657-A703 WeakPolarHBondContact OG-CB 3.24Å; M685-A703 HydrophobicContact CE-CB 3.71Å; M685-A703 HydrophobicContact SD-CB 4.11Å; T699-A703 PolarHBondContact O-N 3.24Å; L701-A703 VanDerWaalsContact C-N 3.32Å; L701-A703 PolarHBondContact O-N 3.16Å; A703-G707 PolarHBondContact O-N 3.19Å
704	Y	94.6	Very high	91.1	Very high	11 Å²	11	34.2 Å²	34.2	4%	0.043	18%	0.177	C	C	.	.	H	α-helix	trans	-59	-51	175.4	169.4	-105.8	0	0	0	112.5	L626 F629 L631 L650 I700 L701 G707 K708	L626-Y704 HydrophobicContact CD2-CD2 4.45Å; L626-Y704 HydrophobicContact CD2-CG 4.06Å; F629-Y704 HydrophobicContact CB-CE1 4.09Å; F629-Y704 HydrophobicContact CB-CE2 3.9Å; F629-Y704 HydrophobicContact CD1-CD1 4.3Å; F629-Y704 AromaticContact CD1-CE1 3.41Å; F629-Y704 HydrophobicContact CD1-CE1 3.41Å; F629-Y704 VanDerWaalsContact CD1-CE1 3.41Å; F629-Y704 AromaticContact CD1-CZ 3.64Å; F629-Y704 HydrophobicContact CD2-CD1 4.48Å; F629-Y704 HydrophobicContact CD2-CE1 4.3Å; F629-Y704 AromaticContact CE1-CE1 3.86Å; F629-Y704 HydrophobicContact CE1-CE1 3.86Å; F629-Y704 HydrophobicContact CG-CD1 4.25Å; F629-Y704 AromaticContact CG-CE1 3.65Å; F629-Y704 HydrophobicContact CG-CE1 3.65Å; F629-Y704 HydrophobicContact CG-CE2 4.36Å; F629-Y704 AromaticContact CG-CZ 3.71Å; F629-Y704 HydrophobicContact CZ-CE1 4.47Å; L631-Y704 HydrophobicContact CD1-CD2 3.49Å; L631-Y704 VanDerWaalsContact CD1-CD2 3.49Å; L631-Y704 HydrophobicContact CD1-CE2 3.57Å; L631-Y704 HydrophobicContact CG-CE2 4.34Å; L650-Y704 HydrophobicContact CD1-CD2 3.72Å; L650-Y704 HydrophobicContact CD1-CE2 3.97Å; L650-Y704 WeakPolarHBondContact CD1-O 3.25Å; I700-Y704 PolarHBondContact O-N 2.99Å; L701-Y704 PolarHBondContact O-N 3.16Å; Y704-G707 PolarHBondContact O-N 3.14Å; Y704-K708 HydrophobicContact CE1-CD 4.12Å; Y704-K708 HydrophobicContact CE2-CD 4.38Å; Y704-K708 VanDerWaalsContact O-CB 3.26Å; Y704-K708 WeakPolarHBondContact O-CB 3.5Å; Y704-K708 PolarHBondContact O-N 2.71Å; Y704-K708 WeakPolarHBondContact OH-CD 3.37Å; Y704-K708 PolarHBondContact OH-NZ 3.33Å
705	F	93.3	Very high	90.7	Very high	40 Å²	40	35.6 Å²	35.6	18%	0.175	18%	0.183	C	C	.	.	H	α-helix	trans	-72.1	-32.2	-175.1	-74.4	-65.6	0	0	0	113.1	F629 L701 T702 A709 T797 L798 V801	F629-F705 HydrophobicContact CE1-CE1 4.38Å; F629-F705 AromaticContact CE1-CZ 3.8Å; F629-F705 HydrophobicContact CE1-CZ 3.8Å; F629-F705 HydrophobicContact CZ-CE2 4.34Å; F629-F705 AromaticContact CZ-CZ 3.88Å; F629-F705 HydrophobicContact CZ-CZ 3.88Å; L701-F705 HydrophobicContact CB-CD2 4.45Å; L701-F705 HydrophobicContact CB-CE2 4.48Å; L701-F705 HydrophobicContact CD2-CE2 4.37Å; L701-F705 WeakPolarHBondContact O-CD2 3.32Å; L701-F705 PolarHBondContact O-N 3.01Å; T702-F705 PolarHBondContact O-N 3.01Å; F705-A709 WeakPolarHBondContact O-CB 3.47Å; F705-A709 PolarHBondContact O-N 3.29Å; F705-T797 HydrophobicContact CB-CG2 4.07Å; F705-T797 HydrophobicContact CD1-CG2 3.32Å; F705-T797 HydrophobicContact CD2-CG2 4.29Å; F705-T797 HydrophobicContact CE1-CG2 3.71Å; F705-T797 HydrophobicContact CG-CG2 3.65Å; F705-T797 HydrophobicContact CZ-CG2 4.34Å; F705-L798 HydrophobicContact CB-CD2 3.99Å; F705-V801 HydrophobicContact CD2-CG2 3.55Å; F705-V801 HydrophobicContact CE2-CG2 3.73Å
706	R	91.3	Very high	90.2	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.008	20%	0.195	C	C	.	.	H	α-helix	trans	-61.9	-52.8	168.2	-71.6	177.2	79.2	-176.3	8.4	111.3	F653 M685 T702 K708 A709 M710 L794 L798 N838 T839	F653-R706 HydrophobicContact CD1-CB 3.86Å; F653-R706 HydrophobicContact CE1-CB 3.86Å; M685-R706 WeakPolarHBondContact SD-CD 3.07Å; M685-R706 PolarHBondContact SD-NH1 2.94Å; M685-R706 VanDerWaalsContact SD-NH1 3.37Å; T702-R706 HydrophobicContact CG2-CG 4.5Å; T702-R706 WeakPolarHBondContact O-CB 3.13Å; T702-R706 VanDerWaalsContact O-CG 3.27Å; T702-R706 WeakPolarHBondContact O-CG 3.44Å; T702-R706 PolarHBondContact O-N 3.43Å; R706-K708 VanDerWaalsContact C-N 3.28Å; R706-K708 PolarHBondContact O-N 2.85Å; R706-A709 PolarHBondContact O-N 3.46Å; R706-M710 WeakPolarHBondContact O-CG 3.41Å; R706-M710 PolarHBondContact O-N 3.49Å; R706-L794 HydrophobicContact CB-CD1 4.41Å; R706-L794 HydrophobicContact CG-CD1 3.91Å; R706-L794 HydrophobicContact CG-CD2 4.05Å; R706-L798 HydrophobicContact CG-CD1 4.45Å; R706-N838 PolarHBondContact NH1-OD1 2.74Å; R706-N838 VanDerWaalsContact NH2-C 3.32Å; R706-N838 PolarHBondContact NH2-O 3.43Å; R706-N838 PolarHBondContact NH2-OD1 2.9Å; R706-T839 VanDerWaalsContact CZ-OG1 3.23Å; R706-T839 PolarHBondContact NE-OG1 3.09Å; R706-T839 VanDerWaalsContact NH2-CA 3.35Å; R706-T839 PolarHBondContact NH2-OG1 2.85Å
707	G	89.6	Confident	89.9	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60	-37.8	178.8	0	0	0	0	0	113	A703 Y704 M710 V711	A703-G707 PolarHBondContact O-N 3.19Å; Y704-G707 PolarHBondContact O-N 3.14Å; G707-M710 PolarHBondContact O-N 3.07Å; G707-V711 WeakPolarHBondContact O-CG2 3.49Å; G707-V711 PolarHBondContact O-N 3.43Å
708	K	90.4	Very high	89.6	Confident	75 Å²	75	39.1 Å²	39.1	33%	0.326	21%	0.205	S	C	.	.	H	α-helix	trans	-69.3	-43.3	176.6	179.9	162.2	-179.4	174.7	0	112.7	L650 Y704 R706 M710 V711 D712	L650-K708 HydrophobicContact CD1-CB 3.99Å; Y704-K708 HydrophobicContact CE1-CD 4.12Å; Y704-K708 HydrophobicContact CE2-CD 4.38Å; Y704-K708 VanDerWaalsContact O-CB 3.26Å; Y704-K708 WeakPolarHBondContact O-CB 3.5Å; Y704-K708 PolarHBondContact O-N 2.71Å; Y704-K708 WeakPolarHBondContact OH-CD 3.37Å; Y704-K708 PolarHBondContact OH-NZ 3.33Å; R706-K708 VanDerWaalsContact C-N 3.28Å; R706-K708 PolarHBondContact O-N 2.85Å; K708-M710 PolarHBondContact O-N 3.15Å; K708-V711 PolarHBondContact O-N 3.26Å; K708-V711 VanDerWaalsContact O-N 3.12Å; K708-D712 WeakPolarHBondContact CE-OD2 3.48Å; K708-D712 VanDerWaalsContact CG-OD2 3.26Å; K708-D712 WeakPolarHBondContact CG-OD2 3.2Å; K708-D712 WeakPolarHBondContact O-CB 3.43Å; K708-D712 PolarHBondContact O-N 3.12Å
709	A	88.9	Confident	89.4	Confident	10 Å²	10	37.5 Å²	37.5	8%	0.083	20%	0.197	C	C	.	.	H	α-helix	trans	-57.7	-36.5	176.2	0	0	0	0	0	111.9	F705 R706 A713 I790 L794	F705-A709 WeakPolarHBondContact O-CB 3.47Å; F705-A709 PolarHBondContact O-N 3.29Å; R706-A709 PolarHBondContact O-N 3.46Å; A709-A713 VanDerWaalsContact O-CB 3.24Å; A709-A713 WeakPolarHBondContact O-CB 3.16Å; A709-A713 PolarHBondContact O-N 3.42Å; A709-I790 HydrophobicContact CB-CB 4.4Å; A709-I790 HydrophobicContact CB-CD1 4.04Å; A709-I790 HydrophobicContact CB-CG2 4.4Å; A709-I790 WeakPolarHBondContact O-CG2 3.2Å; A709-L794 HydrophobicContact CB-CB 4.41Å; A709-L794 HydrophobicContact CB-CD1 4.17Å
710	M	87.6	Confident	89.3	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64.6	-45	174.1	-64.5	-65.3	177.2	0	0	113	P649 R706 G707 K708 F715 F782 I787 I790 T839	P649-M710 HydrophobicContact CG-CB 4.13Å; R706-M710 WeakPolarHBondContact O-CG 3.41Å; R706-M710 PolarHBondContact O-N 3.49Å; G707-M710 PolarHBondContact O-N 3.07Å; K708-M710 PolarHBondContact O-N 3.15Å; M710-F715 HydrophobicContact SD-CD2 4.5Å; M710-F715 HydrophobicContact SD-CE2 3.83Å; M710-F782 HydrophobicContact CE-CD1 3.94Å; M710-F782 HydrophobicContact CE-CE1 3.9Å; M710-F782 HydrophobicContact CG-CE1 4.2Å; M710-F782 HydrophobicContact SD-CE1 4.18Å; M710-I787 HydrophobicContact CE-CD1 3.83Å; M710-I787 HydrophobicContact SD-CB 4.47Å; M710-I787 HydrophobicContact SD-CG2 4.16Å; M710-I790 HydrophobicContact CE-CD1 3.62Å; M710-I790 HydrophobicContact SD-CD1 3.91Å; M710-T839 HydrophobicContact CE-CG2 3.3Å
711	V	87	Confident	89.1	Confident	63 Å²	63	38.1 Å²	38.1	38%	0.382	20%	0.2	S	C	.	.	H	α-helix	trans	-70	-44.7	-179.5	174.6	0	0	0	0	111.8	P649 L650 G707 K708 A713 K714	P649-V711 HydrophobicContact CG-CG2 4.04Å; L650-V711 HydrophobicContact CB-CG2 4Å; G707-V711 WeakPolarHBondContact O-CG2 3.49Å; G707-V711 PolarHBondContact O-N 3.43Å; K708-V711 PolarHBondContact O-N 3.26Å; K708-V711 VanDerWaalsContact O-N 3.12Å; V711-A713 VanDerWaalsContact C-N 3.28Å; V711-A713 PolarHBondContact O-N 2.94Å; V711-K714 PolarHBondContact O-N 3.07Å
712	D	86.8	Confident	88.8	Confident	105 Å²	105	37.4 Å²	37.4	56%	0.561	20%	0.2	S	C	*	.	H	α-helix	trans	-67.7	-27	-176.9	-74.8	-17.3	0	0	0	112.4	K708	K708-D712 WeakPolarHBondContact CE-OD2 3.48Å; K708-D712 VanDerWaalsContact CG-OD2 3.26Å; K708-D712 WeakPolarHBondContact CG-OD2 3.2Å; K708-D712 WeakPolarHBondContact O-CB 3.43Å; K708-D712 PolarHBondContact O-N 3.12Å
713	A	84.2	Confident	88.7	Confident	41 Å²	41	37.4 Å²	37.4	34%	0.339	20%	0.2	S	C	.	.	H	α-helix	trans	-76.5	-19	-178.5	0	0	0	0	0	115.4	A709 V711 F715 I790	A709-A713 VanDerWaalsContact O-CB 3.24Å; A709-A713 WeakPolarHBondContact O-CB 3.16Å; A709-A713 PolarHBondContact O-N 3.42Å; V711-A713 VanDerWaalsContact C-N 3.28Å; V711-A713 PolarHBondContact O-N 2.94Å; A713-F715 HydrophobicContact CB-CD2 4.09Å; A713-F715 HydrophobicContact CB-CE1 4.21Å; A713-F715 HydrophobicContact CB-CE2 3.57Å; A713-F715 HydrophobicContact CB-CZ 3.64Å; A713-F715 PolarHBondContact O-N 2.85Å; A713-I790 HydrophobicContact CB-CG2 3.47Å; A713-I790 VanDerWaalsContact CB-CG2 3.47Å
714	K	81.1	Confident	88.5	Confident	183 Å²	183	38.5 Å²	38.5	80%	0.796	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	54.2	175.8	-57.3	-177.9	-176.9	179.4	0	114.3	V711	V711-K714 PolarHBondContact O-N 3.07Å
715	F	83	Confident	88.2	Confident	34 Å²	34	38.6 Å²	38.6	15%	0.149	21%	0.212	C	C	.	.			trans	-59.3	156.2	175.9	-64.1	-65.9	0	0	0	113.4	M710 A713 M780 L786 I787 S789 I790	M710-F715 HydrophobicContact SD-CD2 4.5Å; M710-F715 HydrophobicContact SD-CE2 3.83Å; A713-F715 HydrophobicContact CB-CD2 4.09Å; A713-F715 HydrophobicContact CB-CE1 4.21Å; A713-F715 HydrophobicContact CB-CE2 3.57Å; A713-F715 HydrophobicContact CB-CZ 3.64Å; A713-F715 PolarHBondContact O-N 2.85Å; F715-M780 HydrophobicContact CB-SD 4.48Å; F715-M780 HydrophobicContact CD2-SD 4.03Å; F715-L786 WeakPolarHBondContact CD1-O 3.26Å; F715-L786 WeakPolarHBondContact CE1-O 3.3Å; F715-I787 HydrophobicContact CD1-CG2 4.45Å; F715-I787 HydrophobicContact CD2-CG2 4.08Å; F715-I787 HydrophobicContact CE1-CB 4.34Å; F715-I787 HydrophobicContact CE1-CG2 4.24Å; F715-I787 HydrophobicContact CE2-CB 4.25Å; F715-I787 HydrophobicContact CE2-CG2 3.82Å; F715-I787 HydrophobicContact CG-CG2 4.38Å; F715-I787 HydrophobicContact CZ-CB 3.92Å; F715-I787 HydrophobicContact CZ-CG2 3.9Å; F715-S789 WeakPolarHBondContact CE1-OG 3.45Å; F715-I790 HydrophobicContact CE2-CG2 4.16Å; F715-I790 HydrophobicContact CZ-CG1 4.36Å; F715-I790 HydrophobicContact CZ-CG2 3.71Å
716	P	82.3	Confident	88.1	Confident	82 Å²	82	38.9 Å²	38.9	53%	0.532	22%	0.217	S	C	.	.			trans	-57.8	158.6	163	-18.5	31.8	0	0	0	111.1	G718 L754	P716-G718 PolarHBondContact O-N 3.18Å; P716-L754 HydrophobicContact CB-CD2 3.83Å; P716-L754 HydrophobicContact CG-CD2 4.44Å
717	L	85.8	Confident	87.7	Confident	103 Å²	103	39.8 Å²	39.8	54%	0.539	23%	0.225	S	C	.	.			trans	-62.1	110	179.3	-170.5	71.7	0	0	0	110.8	Y755	L717-Y755 HydrophobicContact CD2-CD2 4.4Å; L717-Y755 HydrophobicContact CD2-CG 4.05Å; L717-Y755 HydrophobicContact CG-CG 4.4Å; L717-Y755 WeakPolarHBondContact O-CB 3.16Å; L717-Y755 PolarHBondContact O-N 3.12Å
718	G	87.9	Confident	87.5	Confident	1 Å²	1	46 Å²	46	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	161.1	175.9	0	0	0	0	0	112.2	P716 G753 G779	P716-G718 PolarHBondContact O-N 3.18Å; G718-G753 CarbonylContact C-O 3.53Å; G718-G753 VanDerWaalsContact CA-O 3.32Å; G718-G753 WeakPolarHBondContact CA-O 3.47Å; G718-G779 PolarHBondContact N-O 3.47Å; G718-G779 CarbonylContact O-C 3.59Å; G718-G779 VanDerWaalsContact O-C 3.31Å; G718-G779 WeakPolarHBondContact O-CA 3.36Å
719	G	89.2	Confident	87.3	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	158.8	170.4	0	0	0	0	0	111	G753	G719-G753 PolarHBondContact N-O 3.49Å; G719-G753 PolarHBondContact O-N 3.4Å; G719-G753 VanDerWaalsContact O-N 3.14Å
720	M	92.8	Very high	87.1	Confident	13 Å²	13	44.9 Å²	44.9	6%	0.064	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	152	171.5	-63.4	-177.7	74.8	0	0	109.8	A741 I751 I775 F782	M720-A741 HydrophobicContact CE-CB 3.86Å; M720-I751 CarbonylContact C-O 3.59Å; M720-I751 WeakPolarHBondContact CA-O 3.49Å; M720-I751 WeakPolarHBondContact CB-O 3.47Å; M720-I775 HydrophobicContact CB-CB 4.33Å; M720-I775 PolarHBondContact O-N 3.19Å; M720-F782 HydrophobicContact CE-CB 4.36Å; M720-F782 HydrophobicContact SD-CB 3.82Å; M720-F782 HydrophobicContact SD-CD2 3.83Å; M720-F782 HydrophobicContact SD-CG 4.33Å
721	A	90.9	Very high	86.8	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	144.4	176.6	0	0	0	0	0	111.6	S750 I751 V758 V762 K773 M774	A721-S750 CarbonylContact O-C 3.59Å; A721-S750 VanDerWaalsContact O-CA 3.23Å; A721-S750 WeakPolarHBondContact O-CA 3.34Å; A721-I751 HydrophobicContact CB-CD1 4.19Å; A721-I751 HydrophobicContact CB-CG1 3.86Å; A721-I751 PolarHBondContact N-O 3.06Å; A721-I751 WeakPolarHBondContact O-CG1 3.1Å; A721-I751 PolarHBondContact O-N 2.71Å; A721-V758 HydrophobicContact CB-CG1 3.89Å; A721-V762 HydrophobicContact CB-CG2 3.38Å; A721-K773 CarbonylContact C-O 3.5Å; A721-K773 WeakPolarHBondContact CA-O 3.37Å; A721-K773 WeakPolarHBondContact CB-O 3.46Å; A721-M774 HydrophobicContact CB-SD 4Å
722	A	90.3	Very high	86.6	Confident	21 Å²	21	49.5 Å²	49.5	17%	0.174	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	142.6	167	0	0	0	0	0	109.7	F771 A772 K773 I775	A722-F771 HydrophobicContact CB-CE1 4.41Å; A722-A772 CarbonylContact O-C 3.51Å; A722-A772 WeakPolarHBondContact O-CA 3.29Å; A722-K773 PolarHBondContact N-O 2.99Å; A722-K773 PolarHBondContact O-N 3.14Å; A722-I775 HydrophobicContact CB-CD1 4.16Å; A722-I775 HydrophobicContact CB-CG1 4.43Å
723	V	90.9	Very high	86.4	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	136.9	-176.3	-173.4	0	0	0	0	109	L725 V730 S748 T749 I751 L765 I770 F771	V723-L725 VanDerWaalsContact C-N 3.29Å; V723-L725 HydrophobicContact CG1-CB 3.95Å; V723-L725 HydrophobicContact CG1-CD1 3.8Å; V723-L725 HydrophobicContact CG1-CG 3.8Å; V723-L725 PolarHBondContact O-N 2.86Å; V723-V730 HydrophobicContact CB-CG2 4.4Å; V723-V730 HydrophobicContact CG1-CG2 4.3Å; V723-S748 WeakPolarHBondContact O-CA 3.28Å; V723-T749 PolarHBondContact N-O 2.89Å; V723-T749 PolarHBondContact O-N 2.99Å; V723-I751 HydrophobicContact CG2-CD1 4.04Å; V723-I751 HydrophobicContact CG2-CG1 3.97Å; V723-I751 HydrophobicContact CG2-CG2 4.34Å; V723-L765 HydrophobicContact CG1-CD1 3.75Å; V723-L765 HydrophobicContact CG2-CD1 4.28Å; V723-I770 HydrophobicContact CG1-CG2 4.48Å; V723-F771 CarbonylContact C-O 3.19Å; V723-F771 WeakPolarHBondContact CA-O 3.43Å
724	G	90.7	Very high	85.9	Confident	23 Å²	23	49.2 Å²	49.2	24%	0.237	28%	0.278	C	S	.	.	S	Bend	trans	-86.5	67.9	173.6	0	0	0	0	0	110.8	D747 F771	G724-D747 CarbonylContact C-O 3.54Å; G724-D747 WeakPolarHBondContact CA-O 3.46Å; G724-F771 PolarHBondContact N-O 3.04Å
725	L	88.8	Confident	85.3	Confident	13 Å²	13	42.3 Å²	42.3	7%	0.068	26%	0.259	C	S	.	.	S	Bend	trans	-152.3	154.5	178.4	-68.3	176.8	0	0	0	109.2	V723 E729 V730 D747 T749 L765 I770	V723-L725 VanDerWaalsContact C-N 3.29Å; V723-L725 HydrophobicContact CG1-CB 3.95Å; V723-L725 HydrophobicContact CG1-CD1 3.8Å; V723-L725 HydrophobicContact CG1-CG 3.8Å; V723-L725 PolarHBondContact O-N 2.86Å; L725-E729 HydrophobicContact CB-CB 4.06Å; L725-E729 HydrophobicContact CD1-CB 4.46Å; L725-E729 HydrophobicContact CD2-CB 4.43Å; L725-E729 WeakPolarHBondContact CD2-OE1 3.5Å; L725-V730 HydrophobicContact CB-CG2 3.82Å; L725-V730 HydrophobicContact CD1-CG2 4.39Å; L725-D747 PolarHBondContact N-O 3.2Å; L725-T749 WeakPolarHBondContact O-CB 3.3Å; L725-T749 PolarHBondContact O-N 3.5Å; L725-T749 PolarHBondContact O-OG1 3.2Å; L725-L765 HydrophobicContact CD1-CD2 3.99Å; L725-I770 HydrophobicContact CD1-CG2 4.21Å; L725-I770 HydrophobicContact CD2-CD1 4.25Å; L725-I770 HydrophobicContact CD2-CG2 4Å; L725-I770 HydrophobicContact CG-CG2 3.83Å
726	T	89.6	Confident	84.9	Confident	46 Å²	46	51 Å²	51	28%	0.282	30%	0.297	S	S	.	.			trans	-63.5	159.6	172.3	62.2	0	0	0	0	112.3	D728 E729 V730 E746	T726-D728 VanDerWaalsContact C-N 3.26Å; T726-D728 PolarHBondContact O-N 3.01Å; T726-E729 PolarHBondContact N-OE2 2.89Å; T726-E729 VanDerWaalsContact N-OE2 3.16Å; T726-E729 PolarHBondContact O-N 2.97Å; T726-E729 VanDerWaalsContact OG1-CB 3.27Å; T726-E729 WeakPolarHBondContact OG1-CB 3.3Å; T726-E729 WeakPolarHBondContact OG1-CG 3.15Å; T726-E729 PolarHBondContact OG1-N 3.46Å; T726-E729 PolarHBondContact OG1-OE2 3.18Å; T726-E729 VanDerWaalsContact OG1-OE2 3.07Å; T726-V730 WeakPolarHBondContact O-CG2 3.39Å; T726-V730 PolarHBondContact O-N 3Å; T726-E746 VanDerWaalsContact CA-O 3.25Å; T726-E746 WeakPolarHBondContact CA-O 3.46Å; T726-E746 WeakPolarHBondContact CG2-O 3.48Å
727	A	84.6	Confident	85	Confident	20 Å²	20	47.9 Å²	47.9	17%	0.165	28%	0.279	C	S	.	.	H	α-helix	trans	-57.9	-39.4	178.2	0	0	0	0	0	112.3	V730 A731 T749	A727-V730 PolarHBondContact O-N 3.07Å; A727-A731 WeakPolarHBondContact O-CB 3.36Å; A727-A731 PolarHBondContact O-N 3Å; A727-T749 WeakPolarHBondContact CA-OG1 3.44Å; A727-T749 PolarHBondContact N-OG1 3.07Å
728	D	84.1	Confident	85.2	Confident	131 Å²	131	43.5 Å²	43.5	70%	0.701	26%	0.257	S	S	*	.	H	α-helix	trans	-74.7	-36.4	179.7	-68.2	-44.9	0	0	0	113.3	T726 V730 A731 S732	T726-D728 VanDerWaalsContact C-N 3.26Å; T726-D728 PolarHBondContact O-N 3.01Å; D728-V730 VanDerWaalsContact C-N 3.3Å; D728-V730 PolarHBondContact O-N 2.72Å; D728-A731 PolarHBondContact O-N 2.89Å; D728-S732 WeakPolarHBondContact O-CB 3.26Å; D728-S732 PolarHBondContact O-N 3.46Å; D728-S732 PolarHBondContact O-OG 3.31Å
729	E	87.1	Confident	85.3	Confident	59 Å²	59	47.9 Å²	47.9	28%	0.276	27%	0.273	S	S	.	.	H	α-helix	trans	-63.6	-38.3	169.3	-78.3	-177.8	103.3	0	0	111.9	L725 T726 S732 R733	L725-E729 HydrophobicContact CB-CB 4.06Å; L725-E729 HydrophobicContact CD1-CB 4.46Å; L725-E729 HydrophobicContact CD2-CB 4.43Å; L725-E729 WeakPolarHBondContact CD2-OE1 3.5Å; T726-E729 PolarHBondContact N-OE2 2.89Å; T726-E729 VanDerWaalsContact N-OE2 3.16Å; T726-E729 PolarHBondContact O-N 2.97Å; T726-E729 VanDerWaalsContact OG1-CB 3.27Å; T726-E729 WeakPolarHBondContact OG1-CB 3.3Å; T726-E729 WeakPolarHBondContact OG1-CG 3.15Å; T726-E729 PolarHBondContact OG1-N 3.46Å; T726-E729 PolarHBondContact OG1-OE2 3.18Å; T726-E729 VanDerWaalsContact OG1-OE2 3.07Å; E729-S732 WeakPolarHBondContact CA-OG 3.48Å; E729-S732 PolarHBondContact O-OG 3.3Å; E729-R733 WeakPolarHBondContact O-CB 3.39Å; E729-R733 WeakPolarHBondContact O-CG 3.31Å; E729-R733 PolarHBondContact O-N 2.55Å; E729-R733 IonicContact OE1-CZ 3.03Å; E729-R733 IonicContact OE1-NE 2.81Å; E729-R733 IonicContact OE1-NH2 3.77Å; E729-R733 PolarHBondContact OE1-NH2 2.88Å
730	V	85	Confident	85.4	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.012	29%	0.285	C	S	.	.	H	α-helix	trans	-65.6	-46.6	174.2	168.9	0	0	0	0	110.6	V723 L725 T726 A727 D728 S732 R733 C734 V740 T749 I751	V723-V730 HydrophobicContact CB-CG2 4.4Å; V723-V730 HydrophobicContact CG1-CG2 4.3Å; L725-V730 HydrophobicContact CB-CG2 3.82Å; L725-V730 HydrophobicContact CD1-CG2 4.39Å; T726-V730 WeakPolarHBondContact O-CG2 3.39Å; T726-V730 PolarHBondContact O-N 3Å; A727-V730 PolarHBondContact O-N 3.07Å; D728-V730 VanDerWaalsContact C-N 3.3Å; D728-V730 PolarHBondContact O-N 2.72Å; V730-S732 VanDerWaalsContact C-N 3.29Å; V730-S732 PolarHBondContact O-N 3.25Å; V730-R733 PolarHBondContact O-N 3Å; V730-C734 WeakPolarHBondContact O-CB 3.21Å; V730-C734 PolarHBondContact O-N 3.02Å; V730-C734 PolarHBondContact O-SG 3.42Å; V730-V740 HydrophobicContact CB-CG2 4.16Å; V730-V740 HydrophobicContact CG1-CG2 3.63Å; V730-T749 HydrophobicContact CB-CG2 4.11Å; V730-T749 HydrophobicContact CG1-CG2 4.14Å; V730-T749 HydrophobicContact CG2-CG2 3.97Å; V730-I751 HydrophobicContact CG1-CG2 3.23Å
731	A	81.1	Confident	85.3	Confident	67 Å²	67	49.2 Å²	49.2	55%	0.554	28%	0.282	S	S	*	.	H	α-helix	trans	-61.5	-34.8	178.6	0	0	0	0	0	113	A727 D728	A727-A731 WeakPolarHBondContact O-CB 3.36Å; A727-A731 PolarHBondContact O-N 3Å; D728-A731 PolarHBondContact O-N 2.89Å
732	S	82	Confident	85.4	Confident	93 Å²	93	49.4 Å²	49.4	65%	0.65	28%	0.283	S	S	*	.	H	α-helix	trans	-86.1	-29.4	179.7	56.8	0	0	0	0	114.5	D728 E729 V730	D728-S732 WeakPolarHBondContact O-CB 3.26Å; D728-S732 PolarHBondContact O-N 3.46Å; D728-S732 PolarHBondContact O-OG 3.31Å; E729-S732 WeakPolarHBondContact CA-OG 3.48Å; E729-S732 PolarHBondContact O-OG 3.3Å; V730-S732 VanDerWaalsContact C-N 3.29Å; V730-S732 PolarHBondContact O-N 3.25Å
733	R	82.9	Confident	85.5	Confident	112 Å²	112	49.8 Å²	49.8	42%	0.423	28%	0.281	S	S	.	.	H	α-helix	trans	-90.7	-19.5	179.3	-63.6	178.9	-165.3	-133.7	11	114.4	E729 V730	E729-R733 WeakPolarHBondContact O-CB 3.39Å; E729-R733 WeakPolarHBondContact O-CG 3.31Å; E729-R733 PolarHBondContact O-N 2.55Å; E729-R733 IonicContact OE1-CZ 3.03Å; E729-R733 IonicContact OE1-NE 2.81Å; E729-R733 IonicContact OE1-NH2 3.77Å; E729-R733 PolarHBondContact OE1-NH2 2.88Å; V730-R733 PolarHBondContact O-N 3Å
734	C	73.2	Confident	85.5	Confident	29 Å²	29	50.1 Å²	50.1	20%	0.196	28%	0.283	C	S	.	.	S	Bend	trans	-82.2	146.5	-175.2	-73.2	0	0	0	0	114.3	V730 V738	V730-C734 WeakPolarHBondContact O-CB 3.21Å; V730-C734 PolarHBondContact O-N 3.02Å; V730-C734 PolarHBondContact O-SG 3.42Å; C734-V738 HydrophobicContact CB-CB 4.13Å; C734-V738 HydrophobicContact CB-CG1 4Å
735	G	69.6	Low	85.4	Confident	37 Å²	37	49 Å²	49	38%	0.381	27%	0.272	S	S	.	.			trans	-80.2	158.4	178.2	0	0	0	0	0	113.8	G737 V738	G735-G737 PolarHBondContact O-N 3.19Å; G735-V738 PolarHBondContact O-N 3.35Å
736	K	75	Confident	85.4	Confident	218 Å²	218	54.4 Å²	54.4	95%	0.948	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	109.6	174.7	-104.1	-173.9	174.3	179.8	0	111.3
737	G	83.7	Confident	85.3	Confident	16 Å²	16	55.3 Å²	55.3	17%	0.165	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	121.2	-7.1	-178.8	0	0	0	0	0	114.5	G735 Y739 G753	G735-G737 PolarHBondContact O-N 3.19Å; G737-Y739 WeakPolarHBondContact O-CE2 3.44Å; G737-G753 WeakPolarHBondContact O-CA 3.29Å
738	V	89.7	Confident	85.6	Confident	11 Å²	11	54.7 Å²	54.7	7%	0.067	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	135.9	170.6	177.8	0	0	0	0	108.4	C734 G735 I751 E757 V758	C734-V738 HydrophobicContact CB-CB 4.13Å; C734-V738 HydrophobicContact CB-CG1 4Å; G735-V738 PolarHBondContact O-N 3.35Å; V738-I751 HydrophobicContact CG1-CB 3.76Å; V738-I751 HydrophobicContact CG1-CD1 3.91Å; V738-I751 HydrophobicContact CG1-CG1 4.36Å; V738-I751 HydrophobicContact CG1-CG2 4Å; V738-E757 HydrophobicContact CG2-CB 3.72Å; V738-V758 HydrophobicContact CG2-CG2 4.13Å
739	Y	90.2	Very high	86	Confident	93 Å²	93	48.4 Å²	48.4	37%	0.365	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	151.8	-172.9	-52	-86.2	0	0	0	110.9	G737 I751 S752 P785	G737-Y739 WeakPolarHBondContact O-CE2 3.44Å; Y739-I751 CarbonylContact O-C 3.6Å; Y739-I751 VanDerWaalsContact O-CA 3.27Å; Y739-I751 WeakPolarHBondContact O-CA 3.36Å; Y739-S752 PolarHBondContact N-O 3.26Å; Y739-S752 PolarHBondContact O-N 3.34Å; Y739-P785 HydrophobicContact CD1-CG 4.12Å; Y739-P785 HydrophobicContact CE1-CG 3.86Å; Y739-P785 HydrophobicContact CE2-CG 4.36Å; Y739-P785 HydrophobicContact CG-CG 4.48Å
740	V	91.2	Very high	86.3	Confident	41 Å²	41	46 Å²	46	25%	0.248	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	130.1	166.1	177	0	0	0	0	108.7	V730 T749	V730-V740 HydrophobicContact CB-CG2 4.16Å; V730-V740 HydrophobicContact CG1-CG2 3.63Å; V740-T749 HydrophobicContact CB-CG2 4.44Å; V740-T749 HydrophobicContact CG1-CG2 3.71Å; V740-T749 HydrophobicContact CG2-CG2 4.19Å
741	A	91.1	Very high	86.7	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	-32.4	-175.8	0	0	0	0	0	113.8	M720 S750 S752 H783 P842 V843	M720-A741 HydrophobicContact CE-CB 3.86Å; A741-S750 PolarHBondContact N-O 3.09Å; A741-S752 VanDerWaalsContact CB-CB 3.42Å; A741-H783 HydrophobicContact CB-CB 3.9Å; A741-H783 WeakPolarHBondContact O-CB 3.03Å; A741-P842 WeakPolarHBondContact O-CA 3.49Å; A741-V843 PolarHBondContact O-N 3.34Å
742	C	92.5	Very high	87.2	Confident	4 Å²	4	42.7 Å²	42.7	3%	0.027	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	129.3	170.8	-42.6	0	0	0	0	109.5	N744 T749 S750 V843	C742-N744 WeakPolarHBondContact CB-OD1 3.45Å; C742-N744 PolarHBondContact O-ND2 3.42Å; C742-T749 CarbonylContact O-C 3.57Å; C742-T749 WeakPolarHBondContact O-CA 3.21Å; C742-S750 PolarHBondContact N-O 2.78Å; C742-S750 PolarHBondContact O-N 3.31Å; C742-V843 CarbonylContact C-O 3.59Å; C742-V843 WeakPolarHBondContact CA-O 3.5Å; C742-V843 HydrophobicContact CB-CB 3.99Å
743	H	93.1	Very high	87.7	Confident	29 Å²	29	38.2 Å²	38.2	13%	0.134	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	110.9	163.7	-165.2	-158.5	0	0	0	106.4	V843 F845 Y846 E847	H743-V843 PolarHBondContact N-O 3.49Å; H743-F845 CarbonylContact O-C 3.49Å; H743-F845 WeakPolarHBondContact O-CA 3.22Å; H743-F845 WeakPolarHBondContact O-CB 3.32Å; H743-F845 PolarHBondContact O-N 3.34Å; H743-Y846 AromaticContact CE1-CD1 3.54Å; H743-Y846 AromaticContact ND1-CD1 3.91Å; H743-Y846 PolarHBondContact O-N 3.17Å; H743-E847 IonicContact CE1-OE1 2.67Å; H743-E847 IonicContact CG-OE1 3.12Å; H743-E847 IonicContact ND1-OE1 3.86Å; H743-E847 PolarHBondContact ND1-OE1 2.91Å; H743-E847 IonicContact ND1-OE2 3.09Å
744	N	89.7	Confident	88	Confident	8 Å²	8	36.2 Å²	36.2	4%	0.043	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	-41.6	-169.6	-44.9	-86	0	0	0	111.9	H680 C742 S748 S750 F845 I870	H680-N744 PolarHBondContact NE2-OD1 2.98Å; C742-N744 WeakPolarHBondContact CB-OD1 3.45Å; C742-N744 PolarHBondContact O-ND2 3.42Å; N744-S748 WeakPolarHBondContact CA-O 3.46Å; N744-S748 VanDerWaalsContact CB-O 3.29Å; N744-S748 WeakPolarHBondContact CB-O 3.46Å; N744-S748 PolarHBondContact N-O 2.99Å; N744-S748 PolarHBondContact ND2-O 3.12Å; N744-S750 PolarHBondContact ND2-N 2.92Å; N744-S750 PolarHBondContact ND2-OG 3.07Å; N744-F845 HydrophobicContact CB-CD1 4.46Å; N744-I870 HydrophobicContact CB-CD1 4.07Å; N744-I870 HydrophobicContact CB-CG1 4.22Å; N744-I870 HydrophobicContact CB-CG2 3.97Å; N744-I870 WeakPolarHBondContact O-CG2 3.49Å
745	A	90.2	Very high	88.8	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.008	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	165.3	165.7	0	0	0	0	0	107.8	D747 S748 I870 V874	A745-D747 PolarHBondContact O-N 3.05Å; A745-S748 PolarHBondContact N-O 2.93Å; A745-S748 CarbonylContact O-C 3.58Å; A745-S748 PolarHBondContact O-N 2.94Å; A745-I870 HydrophobicContact CB-CD1 4.43Å; A745-I870 HydrophobicContact CB-CG2 4.24Å; A745-V874 HydrophobicContact CB-CG2 3.56Å
746	E	87.5	Confident	89.7	Confident	125 Å²	125	43.5 Å²	43.5	58%	0.584	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-42	-49.9	171.8	-171.7	-175.2	-171.8	0	0	112.5	T726 Y846	T726-E746 VanDerWaalsContact CA-O 3.25Å; T726-E746 WeakPolarHBondContact CA-O 3.46Å; T726-E746 WeakPolarHBondContact CG2-O 3.48Å; E746-Y846 HydrophobicContact CB-CE1 4.17Å; E746-Y846 HydrophobicContact CB-CE2 3.92Å
747	D	88.5	Confident	90.4	Very high	65 Å²	65	35.6 Å²	35.6	35%	0.348	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	12.1	179.5	82.4	-37.5	0	0	0	114	G724 L725 A745 R873	G724-D747 CarbonylContact C-O 3.54Å; G724-D747 WeakPolarHBondContact CA-O 3.46Å; L725-D747 PolarHBondContact N-O 3.2Å; A745-D747 PolarHBondContact O-N 3.05Å; D747-R873 WeakPolarHBondContact OD1-CD 3.48Å; D747-R873 IonicContact OD1-CZ 3.01Å; D747-R873 IonicContact OD1-NE 3.71Å; D747-R873 IonicContact OD1-NH1 2.65Å; D747-R873 PolarHBondContact OD1-NH1 3.09Å; D747-R873 IonicContact OD2-CZ 2.64Å; D747-R873 IonicContact OD2-NE 3.68Å; D747-R873 IonicContact OD2-NH1 2.73Å; D747-R873 PolarHBondContact OD2-NH1 3.32Å
748	S	91.3	Very high	90.8	Very high	7 Å²	7	34.8 Å²	34.8	5%	0.049	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	96.7	-171.6	-155.5	0	0	0	0	115.3	V723 N744 A745 I870	V723-S748 WeakPolarHBondContact O-CA 3.28Å; N744-S748 WeakPolarHBondContact CA-O 3.46Å; N744-S748 VanDerWaalsContact CB-O 3.29Å; N744-S748 WeakPolarHBondContact CB-O 3.46Å; N744-S748 PolarHBondContact N-O 2.99Å; N744-S748 PolarHBondContact ND2-O 3.12Å; A745-S748 PolarHBondContact N-O 2.93Å; A745-S748 CarbonylContact O-C 3.58Å; A745-S748 PolarHBondContact O-N 2.94Å; S748-I870 WeakPolarHBondContact OG-CD1 3.37Å
749	T	92	Very high	90.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	144.5	-178.2	-57.8	0	0	0	0	111.4	V723 L725 A727 V730 V740 C742	V723-T749 PolarHBondContact N-O 2.89Å; V723-T749 PolarHBondContact O-N 2.99Å; L725-T749 WeakPolarHBondContact O-CB 3.3Å; L725-T749 PolarHBondContact O-N 3.5Å; L725-T749 PolarHBondContact O-OG1 3.2Å; A727-T749 WeakPolarHBondContact CA-OG1 3.44Å; A727-T749 PolarHBondContact N-OG1 3.07Å; V730-T749 HydrophobicContact CB-CG2 4.11Å; V730-T749 HydrophobicContact CG1-CG2 4.14Å; V730-T749 HydrophobicContact CG2-CG2 3.97Å; V740-T749 HydrophobicContact CB-CG2 4.44Å; V740-T749 HydrophobicContact CG1-CG2 3.71Å; V740-T749 HydrophobicContact CG2-CG2 4.19Å; C742-T749 CarbonylContact O-C 3.57Å; C742-T749 WeakPolarHBondContact O-CA 3.21Å
750	S	92.3	Very high	90.8	Very high	7 Å²	7	40.2 Å²	40.2	5%	0.049	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	128.8	169.6	-58.9	0	0	0	0	111.4	A721 A741 C742 N744	A721-S750 CarbonylContact O-C 3.59Å; A721-S750 VanDerWaalsContact O-CA 3.23Å; A721-S750 WeakPolarHBondContact O-CA 3.34Å; A741-S750 PolarHBondContact N-O 3.09Å; C742-S750 PolarHBondContact N-O 2.78Å; C742-S750 PolarHBondContact O-N 3.31Å; N744-S750 PolarHBondContact ND2-N 2.92Å; N744-S750 PolarHBondContact ND2-OG 3.07Å
751	I	93.1	Very high	90.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	154	174.3	55.6	172.3	0	0	0	112.2	M720 A721 V723 V730 V738 Y739 V758 T761	M720-I751 CarbonylContact C-O 3.59Å; M720-I751 WeakPolarHBondContact CA-O 3.49Å; M720-I751 WeakPolarHBondContact CB-O 3.47Å; A721-I751 HydrophobicContact CB-CD1 4.19Å; A721-I751 HydrophobicContact CB-CG1 3.86Å; A721-I751 PolarHBondContact N-O 3.06Å; A721-I751 WeakPolarHBondContact O-CG1 3.1Å; A721-I751 PolarHBondContact O-N 2.71Å; V723-I751 HydrophobicContact CG2-CD1 4.04Å; V723-I751 HydrophobicContact CG2-CG1 3.97Å; V723-I751 HydrophobicContact CG2-CG2 4.34Å; V730-I751 HydrophobicContact CG1-CG2 3.23Å; V738-I751 HydrophobicContact CG1-CB 3.76Å; V738-I751 HydrophobicContact CG1-CD1 3.91Å; V738-I751 HydrophobicContact CG1-CG1 4.36Å; V738-I751 HydrophobicContact CG1-CG2 4Å; Y739-I751 CarbonylContact O-C 3.6Å; Y739-I751 VanDerWaalsContact O-CA 3.27Å; Y739-I751 WeakPolarHBondContact O-CA 3.36Å; I751-V758 HydrophobicContact CD1-CG1 4.01Å; I751-V758 HydrophobicContact CG1-CG1 4.22Å; I751-T761 HydrophobicContact CD1-CG2 4.02Å
752	S	92.7	Very high	90.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	145.5	179.5	-174.4	0	0	0	0	111	Y739 A741 A781 F782	Y739-S752 PolarHBondContact N-O 3.26Å; Y739-S752 PolarHBondContact O-N 3.34Å; A741-S752 VanDerWaalsContact CB-CB 3.42Å; S752-A781 VanDerWaalsContact OG-CA 3.25Å; S752-A781 WeakPolarHBondContact OG-CA 3.32Å; S752-A781 PolarHBondContact OG-O 3.44Å; S752-F782 VanDerWaalsContact CB-O 3.23Å; S752-F782 WeakPolarHBondContact CB-O 3.33Å; S752-F782 PolarHBondContact OG-N 2.89Å; S752-F782 PolarHBondContact OG-O 2.78Å
753	G	91.5	Very high	90.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.4	-166	-178.4	0	0	0	0	0	113.3	G718 G719 G737 A781	G718-G753 CarbonylContact C-O 3.53Å; G718-G753 VanDerWaalsContact CA-O 3.32Å; G718-G753 WeakPolarHBondContact CA-O 3.47Å; G719-G753 PolarHBondContact N-O 3.49Å; G719-G753 PolarHBondContact O-N 3.4Å; G719-G753 VanDerWaalsContact O-N 3.14Å; G737-G753 WeakPolarHBondContact O-CA 3.29Å; G753-A781 WeakPolarHBondContact O-CB 3.48Å
754	L	90.6	Very high	90.2	Very high	70 Å²	70	45.7 Å²	45.7	37%	0.366	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	136.7	169.7	-68.1	173.9	0	0	0	109.7	P716 E756 E757 V758 L786	P716-L754 HydrophobicContact CB-CD2 3.83Å; P716-L754 HydrophobicContact CG-CD2 4.44Å; L754-E756 VanDerWaalsContact C-N 3.3Å; L754-E756 PolarHBondContact O-N 3.24Å; L754-E757 HydrophobicContact CB-CG 4.35Å; L754-E757 PolarHBondContact O-N 3.37Å; L754-V758 PolarHBondContact O-N 3.19Å; L754-V758 VanDerWaalsContact O-N 3.09Å; L754-L786 HydrophobicContact CD2-CD1 4.2Å; L754-L786 HydrophobicContact CD2-CD2 4.13Å; L754-L786 HydrophobicContact CG-CD1 4.22Å; L754-L786 HydrophobicContact CG-CD2 4.43Å
755	Y	89.4	Confident	90.2	Very high	77 Å²	77	45.7 Å²	45.7	30%	0.302	22%	0.217	S	C	.	.	H	α-helix	trans	-51	-47.6	-172.4	-178.7	-82.5	0	0	0	112.7	L717 E757 V758 E759 M774	L717-Y755 HydrophobicContact CD2-CD2 4.4Å; L717-Y755 HydrophobicContact CD2-CG 4.05Å; L717-Y755 HydrophobicContact CG-CG 4.4Å; L717-Y755 WeakPolarHBondContact O-CB 3.16Å; L717-Y755 PolarHBondContact O-N 3.12Å; Y755-E757 VanDerWaalsContact C-N 3.33Å; Y755-E757 PolarHBondContact O-N 2.87Å; Y755-V758 PolarHBondContact O-N 2.69Å; Y755-E759 HydrophobicContact CE1-CB 4.12Å; Y755-E759 VanDerWaalsContact CE1-CD 3.47Å; Y755-E759 HydrophobicContact CE1-CG 4.36Å; Y755-E759 WeakPolarHBondContact CE1-OE1 3.31Å; Y755-E759 VanDerWaalsContact CZ-OE1 3.29Å; Y755-E759 WeakPolarHBondContact O-CB 3.33Å; Y755-E759 PolarHBondContact O-N 3.06Å; Y755-E759 PolarHBondContact OH-OE1 3Å; Y755-M774 HydrophobicContact CD2-CE 4.19Å; Y755-M774 HydrophobicContact CE2-CE 3.76Å
756	E	88.4	Confident	90.1	Very high	142 Å²	142	51 Å²	51	66%	0.664	24%	0.242	S	C	*	.	H	α-helix	trans	-66	-27.6	-179	-62.2	-176.6	170.7	0	0	114.2	L754 R760	L754-E756 VanDerWaalsContact C-N 3.3Å; L754-E756 PolarHBondContact O-N 3.24Å; E756-R760 WeakPolarHBondContact O-CB 3.03Å; E756-R760 PolarHBondContact O-N 2.81Å
757	E	89.8	Confident	90.1	Very high	51 Å²	51	54 Å²	54	24%	0.238	25%	0.253	C	S	.	.	H	α-helix	trans	-79.8	-40.1	176.3	-66.2	-61.4	138.8	0	0	110.9	V738 L754 Y755 R760 T761	V738-E757 HydrophobicContact CG2-CB 3.72Å; L754-E757 HydrophobicContact CB-CG 4.35Å; L754-E757 PolarHBondContact O-N 3.37Å; Y755-E757 VanDerWaalsContact C-N 3.33Å; Y755-E757 PolarHBondContact O-N 2.87Å; E757-R760 IonicContact OE1-CZ 2.97Å; E757-R760 IonicContact OE1-NH1 2.74Å; E757-R760 PolarHBondContact OE1-NH1 3.44Å; E757-R760 IonicContact OE1-NH2 2.83Å; E757-R760 PolarHBondContact OE1-NH2 2.91Å; E757-R760 IonicContact OE2-CZ 2.71Å; E757-R760 IonicContact OE2-NH1 3.31Å; E757-R760 PolarHBondContact OE2-NH1 2.7Å; E757-R760 IonicContact OE2-NH2 3.85Å; E757-T761 WeakPolarHBondContact O-CB 3.46Å; E757-T761 PolarHBondContact O-N 3.19Å; E757-T761 PolarHBondContact O-OG1 3.25Å
758	V	91.5	Very high	90	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-67.4	-47.2	177.3	177.6	0	0	0	0	110.8	A721 V738 I751 L754 Y755 R760 T761 V762 M774	A721-V758 HydrophobicContact CB-CG1 3.89Å; V738-V758 HydrophobicContact CG2-CG2 4.13Å; I751-V758 HydrophobicContact CD1-CG1 4.01Å; I751-V758 HydrophobicContact CG1-CG1 4.22Å; L754-V758 PolarHBondContact O-N 3.19Å; L754-V758 VanDerWaalsContact O-N 3.09Å; Y755-V758 PolarHBondContact O-N 2.69Å; V758-R760 VanDerWaalsContact C-N 3.33Å; V758-R760 PolarHBondContact O-N 3.32Å; V758-T761 WeakPolarHBondContact O-CB 3.5Å; V758-T761 PolarHBondContact O-N 3.13Å; V758-T761 VanDerWaalsContact O-N 3.11Å; V758-V762 WeakPolarHBondContact O-CG2 3.13Å; V758-V762 PolarHBondContact O-N 3.31Å; V758-M774 HydrophobicContact CG1-CE 4.19Å; V758-M774 HydrophobicContact CG1-SD 3.88Å
759	E	91.3	Very high	89.7	Confident	85 Å²	85	58.1 Å²	58.1	40%	0.397	29%	0.289	S	S	.	.	H	α-helix	trans	-61.7	-39.7	178.4	-175	177.5	-107.1	0	0	112.1	Y755 S763	Y755-E759 HydrophobicContact CE1-CB 4.12Å; Y755-E759 VanDerWaalsContact CE1-CD 3.47Å; Y755-E759 HydrophobicContact CE1-CG 4.36Å; Y755-E759 WeakPolarHBondContact CE1-OE1 3.31Å; Y755-E759 VanDerWaalsContact CZ-OE1 3.29Å; Y755-E759 WeakPolarHBondContact O-CB 3.33Å; Y755-E759 PolarHBondContact O-N 3.06Å; Y755-E759 PolarHBondContact OH-OE1 3Å; E759-S763 VanDerWaalsContact O-CB 3.29Å; E759-S763 WeakPolarHBondContact O-CB 3.12Å; E759-S763 PolarHBondContact O-N 3.46Å; E759-S763 PolarHBondContact O-OG 3.39Å
760	R	88.4	Confident	89.5	Confident	133 Å²	133	59.7 Å²	59.7	50%	0.502	30%	0.297	S	S	.	.	H	α-helix	trans	-66.3	-36.8	174.4	-163.5	-169.6	-46.6	139.4	9.1	112.1	E756 E757 V758 K764	E756-R760 WeakPolarHBondContact O-CB 3.03Å; E756-R760 PolarHBondContact O-N 2.81Å; E757-R760 IonicContact OE1-CZ 2.97Å; E757-R760 IonicContact OE1-NH1 2.74Å; E757-R760 PolarHBondContact OE1-NH1 3.44Å; E757-R760 IonicContact OE1-NH2 2.83Å; E757-R760 PolarHBondContact OE1-NH2 2.91Å; E757-R760 IonicContact OE2-CZ 2.71Å; E757-R760 IonicContact OE2-NH1 3.31Å; E757-R760 PolarHBondContact OE2-NH1 2.7Å; E757-R760 IonicContact OE2-NH2 3.85Å; V758-R760 VanDerWaalsContact C-N 3.33Å; V758-R760 PolarHBondContact O-N 3.32Å; R760-K764 PolarHBondContact O-N 3.38Å; R760-K764 VanDerWaalsContact O-N 3.1Å
761	T	89.1	Confident	89.3	Confident	19 Å²	19	65.2 Å²	65.2	12%	0.117	32%	0.32	C	S	.	.	H	α-helix	trans	-68.7	-46	176.5	-59.1	0	0	0	0	111.4	I751 E757 V758 S763 K764 L765	I751-T761 HydrophobicContact CD1-CG2 4.02Å; E757-T761 WeakPolarHBondContact O-CB 3.46Å; E757-T761 PolarHBondContact O-N 3.19Å; E757-T761 PolarHBondContact O-OG1 3.25Å; V758-T761 WeakPolarHBondContact O-CB 3.5Å; V758-T761 PolarHBondContact O-N 3.13Å; V758-T761 VanDerWaalsContact O-N 3.11Å; T761-S763 VanDerWaalsContact C-N 3.32Å; T761-S763 PolarHBondContact O-N 3.38Å; T761-K764 WeakPolarHBondContact O-CB 2.94Å; T761-K764 PolarHBondContact O-N 3.03Å; T761-K764 VanDerWaalsContact O-N 3.14Å; T761-L765 HydrophobicContact CG2-CD1 4.06Å; T761-L765 WeakPolarHBondContact O-CG 3.29Å; T761-L765 PolarHBondContact O-N 2.7Å
762	V	90.2	Very high	89.2	Confident	7 Å²	7	65.5 Å²	65.5	4%	0.042	32%	0.323	C	S	.	.	H	α-helix	trans	-58.5	-44.9	173.3	171.1	0	0	0	0	110.9	A721 V758 K764 L765 Q766 A772 M774	A721-V762 HydrophobicContact CB-CG2 3.38Å; V758-V762 WeakPolarHBondContact O-CG2 3.13Å; V758-V762 PolarHBondContact O-N 3.31Å; V762-K764 PolarHBondContact O-N 3.47Å; V762-L765 PolarHBondContact O-N 3.44Å; V762-Q766 HydrophobicContact CG1-CG 4.32Å; V762-Q766 WeakPolarHBondContact O-CG 3.43Å; V762-Q766 PolarHBondContact O-N 2.83Å; V762-A772 HydrophobicContact CB-CB 4.35Å; V762-A772 HydrophobicContact CG1-CB 3.99Å; V762-A772 HydrophobicContact CG2-CB 4.32Å; V762-M774 HydrophobicContact CG2-SD 3.94Å
763	S	88.8	Confident	89.1	Confident	58 Å²	58	71.9 Å²	71.9	41%	0.406	35%	0.35	S	S	.	.	H	α-helix	trans	-65.7	-21.7	178.5	-60.2	0	0	0	0	114.2	E759 T761 K767	E759-S763 VanDerWaalsContact O-CB 3.29Å; E759-S763 WeakPolarHBondContact O-CB 3.12Å; E759-S763 PolarHBondContact O-N 3.46Å; E759-S763 PolarHBondContact O-OG 3.39Å; T761-S763 VanDerWaalsContact C-N 3.32Å; T761-S763 PolarHBondContact O-N 3.38Å; S763-K767 WeakPolarHBondContact O-CG 3.49Å
764	K	87.9	Confident	88.9	Confident	105 Å²	105	74.6 Å²	74.6	46%	0.457	36%	0.364	S	S	.	.	H	α-helix	trans	-78.6	-53.4	171.4	-178.9	-177.9	179.9	-79.5	0	110.3	R760 T761 V762 Q766 K767 E768	R760-K764 PolarHBondContact O-N 3.38Å; R760-K764 VanDerWaalsContact O-N 3.1Å; T761-K764 WeakPolarHBondContact O-CB 2.94Å; T761-K764 PolarHBondContact O-N 3.03Å; T761-K764 VanDerWaalsContact O-N 3.14Å; V762-K764 PolarHBondContact O-N 3.47Å; K764-Q766 PolarHBondContact O-N 2.64Å; K764-K767 WeakPolarHBondContact O-CB 3.17Å; K764-K767 PolarHBondContact O-N 3.5Å; K764-E768 VanDerWaalsContact CE-OE1 3.23Å; K764-E768 WeakPolarHBondContact CE-OE1 3.36Å; K764-E768 WeakPolarHBondContact CG-OE1 3.47Å; K764-E768 IonicContact NZ-OE1 3.55Å; K764-E768 PolarHBondContact NZ-OE1 2.85Å; K764-E768 IonicContact NZ-OE2 3.47Å; K764-E768 PolarHBondContact O-N 3.21Å
765	L	89.3	Confident	88.7	Confident	7 Å²	7	73.7 Å²	73.7	4%	0.037	36%	0.358	C	S	.	.	H	α-helix	trans	-61.5	-40.2	-176.5	-67	169	0	0	0	112.5	V723 L725 T761 V762 K767 E768 G769 I770 A772	V723-L765 HydrophobicContact CG1-CD1 3.75Å; V723-L765 HydrophobicContact CG2-CD1 4.28Å; L725-L765 HydrophobicContact CD1-CD2 3.99Å; T761-L765 HydrophobicContact CG2-CD1 4.06Å; T761-L765 WeakPolarHBondContact O-CG 3.29Å; T761-L765 PolarHBondContact O-N 2.7Å; V762-L765 PolarHBondContact O-N 3.44Å; L765-K767 PolarHBondContact O-N 3.02Å; L765-E768 CarbonylContact O-C 3.37Å; L765-E768 WeakPolarHBondContact O-CA 3.42Å; L765-E768 WeakPolarHBondContact O-CB 3.34Å; L765-E768 PolarHBondContact O-N 2.86Å; L765-G769 PolarHBondContact O-N 2.87Å; L765-I770 HydrophobicContact CB-CB 4.24Å; L765-I770 HydrophobicContact CB-CG2 4.42Å; L765-I770 HydrophobicContact CD2-CB 4.49Å; L765-I770 HydrophobicContact CD2-CD1 3.85Å; L765-I770 HydrophobicContact CD2-CG2 4.4Å; L765-I770 PolarHBondContact O-N 2.78Å; L765-A772 HydrophobicContact CB-CB 3.86Å; L765-A772 HydrophobicContact CD1-CB 4.26Å
766	Q	88.6	Confident	88.3	Confident	113 Å²	113	73.8 Å²	73.8	53%	0.528	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-61.2	-30	174	-72.7	-178.7	-7.1	0	0	113.5	V762 K764 G769 A772	V762-Q766 HydrophobicContact CG1-CG 4.32Å; V762-Q766 WeakPolarHBondContact O-CG 3.43Å; V762-Q766 PolarHBondContact O-N 2.83Å; K764-Q766 PolarHBondContact O-N 2.64Å; Q766-G769 PolarHBondContact O-N 3.01Å; Q766-A772 HydrophobicContact CG-CB 4.32Å; Q766-A772 PolarHBondContact NE2-O 2.65Å
767	K	86.7	Confident	88	Confident	188 Å²	188	67.3 Å²	67.3	82%	0.817	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-78.2	-21.6	174.2	-72.3	177.2	177.2	177.7	0	113.1	S763 K764 L765	S763-K767 WeakPolarHBondContact O-CG 3.49Å; K764-K767 WeakPolarHBondContact O-CB 3.17Å; K764-K767 PolarHBondContact O-N 3.5Å; L765-K767 PolarHBondContact O-N 3.02Å
768	E	86.6	Confident	87.7	Confident	87 Å²	87	65 Å²	65	41%	0.407	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-84.4	1.7	173.4	-67.2	169.5	-166.7	0	0	111.7	K764 L765 I770	K764-E768 VanDerWaalsContact CE-OE1 3.23Å; K764-E768 WeakPolarHBondContact CE-OE1 3.36Å; K764-E768 WeakPolarHBondContact CG-OE1 3.47Å; K764-E768 IonicContact NZ-OE1 3.55Å; K764-E768 PolarHBondContact NZ-OE1 2.85Å; K764-E768 IonicContact NZ-OE2 3.47Å; K764-E768 PolarHBondContact O-N 3.21Å; L765-E768 CarbonylContact O-C 3.37Å; L765-E768 WeakPolarHBondContact O-CA 3.42Å; L765-E768 WeakPolarHBondContact O-CB 3.34Å; L765-E768 PolarHBondContact O-N 2.86Å; E768-I770 VanDerWaalsContact C-N 3.25Å; E768-I770 HydrophobicContact CB-CD1 3.99Å; E768-I770 HydrophobicContact CB-CG1 4.26Å; E768-I770 PolarHBondContact O-N 2.8Å
769	G	85.1	Confident	87.2	Confident	71 Å²	71	65.5 Å²	65.5	73%	0.732	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	1.3	-177.7	0	0	0	0	0	114.4	L765 Q766	L765-G769 PolarHBondContact O-N 2.87Å; Q766-G769 PolarHBondContact O-N 3.01Å
770	I	87.4	Confident	87	Confident	33 Å²	33	62.6 Å²	62.6	17%	0.169	32%	0.316	C	S	.	.			trans	-81.6	138.4	-176.4	-61.1	167.1	0	0	0	109.5	V723 L725 L765 E768 A772	V723-I770 HydrophobicContact CG1-CG2 4.48Å; L725-I770 HydrophobicContact CD1-CG2 4.21Å; L725-I770 HydrophobicContact CD2-CD1 4.25Å; L725-I770 HydrophobicContact CD2-CG2 4Å; L725-I770 HydrophobicContact CG-CG2 3.83Å; L765-I770 HydrophobicContact CB-CB 4.24Å; L765-I770 HydrophobicContact CB-CG2 4.42Å; L765-I770 HydrophobicContact CD2-CB 4.49Å; L765-I770 HydrophobicContact CD2-CD1 3.85Å; L765-I770 HydrophobicContact CD2-CG2 4.4Å; L765-I770 PolarHBondContact O-N 2.78Å; E768-I770 VanDerWaalsContact C-N 3.25Å; E768-I770 HydrophobicContact CB-CD1 3.99Å; E768-I770 HydrophobicContact CB-CG1 4.26Å; E768-I770 PolarHBondContact O-N 2.8Å; I770-A772 PolarHBondContact O-N 3.21Å
771	F	89.8	Confident	87	Confident	124 Å²	124	56.5 Å²	56.5	54%	0.544	29%	0.294	S	S	.	.			trans	-62.6	118.5	174.3	175.6	-101.4	0	0	0	110.1	A722 V723 G724 K773	A722-F771 HydrophobicContact CB-CE1 4.41Å; V723-F771 CarbonylContact C-O 3.19Å; V723-F771 WeakPolarHBondContact CA-O 3.43Å; G724-F771 PolarHBondContact N-O 3.04Å; F771-K773 HydrophobicContact CE2-CB 4.48Å; F771-K773 HydrophobicContact CZ-CB 4.15Å
772	A	90	Very high	87.1	Confident	6 Å²	6	55.8 Å²	55.8	5%	0.05	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	135.3	170.7	0	0	0	0	0	110	A722 V762 L765 Q766 I770	A722-A772 CarbonylContact O-C 3.51Å; A722-A772 WeakPolarHBondContact O-CA 3.29Å; V762-A772 HydrophobicContact CB-CB 4.35Å; V762-A772 HydrophobicContact CG1-CB 3.99Å; V762-A772 HydrophobicContact CG2-CB 4.32Å; L765-A772 HydrophobicContact CB-CB 3.86Å; L765-A772 HydrophobicContact CD1-CB 4.26Å; Q766-A772 HydrophobicContact CG-CB 4.32Å; Q766-A772 PolarHBondContact NE2-O 2.65Å; I770-A772 PolarHBondContact O-N 3.21Å
773	K	89.7	Confident	87.1	Confident	133 Å²	133	55.7 Å²	55.7	58%	0.578	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.5	127.5	-174.1	-174.3	-175.9	174.5	-173	0	112.2	A721 A722 F771	A721-K773 CarbonylContact C-O 3.5Å; A721-K773 WeakPolarHBondContact CA-O 3.37Å; A721-K773 WeakPolarHBondContact CB-O 3.46Å; A722-K773 PolarHBondContact N-O 2.99Å; A722-K773 PolarHBondContact O-N 3.14Å; F771-K773 HydrophobicContact CE2-CB 4.48Å; F771-K773 HydrophobicContact CZ-CB 4.15Å
774	M	88.5	Confident	87.1	Confident	58 Å²	58	53.1 Å²	53.1	29%	0.286	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	143.6	174	-64	-62.5	-70.8	0	0	112.4	A721 Y755 V758 V762	A721-M774 HydrophobicContact CB-SD 4Å; Y755-M774 HydrophobicContact CD2-CE 4.19Å; Y755-M774 HydrophobicContact CE2-CE 3.76Å; V758-M774 HydrophobicContact CG1-CE 4.19Å; V758-M774 HydrophobicContact CG1-SD 3.88Å; V762-M774 HydrophobicContact CG2-SD 3.94Å
775	I	86	Confident	87	Confident	50 Å²	50	51.3 Å²	51.3	26%	0.256	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	139.8	176.4	-58.7	167.3	0	0	0	108.6	M720 A722 S777	M720-I775 HydrophobicContact CB-CB 4.33Å; M720-I775 PolarHBondContact O-N 3.19Å; A722-I775 HydrophobicContact CB-CD1 4.16Å; A722-I775 HydrophobicContact CB-CG1 4.43Å; I775-S777 VanDerWaalsContact C-N 3.33Å; I775-S777 PolarHBondContact O-N 3.06Å
776	D	81.4	Confident	86.8	Confident	80 Å²	80	53.5 Å²	53.5	43%	0.428	28%	0.281	S	S	.	.			trans	-73.2	88.5	168.7	178	21.2	0	0	0	111	Q600 S778	Q600-D776 PolarHBondContact NE2-O 3.15Å; Q600-D776 PolarHBondContact NE2-OD2 3.48Å; D776-S778 VanDerWaalsContact C-N 3.29Å; D776-S778 WeakPolarHBondContact OD1-CA 3.42Å; D776-S778 PolarHBondContact OD1-N 2.83Å
777	S	82.8	Confident	86.9	Confident	6 Å²	6	48.2 Å²	48.2	4%	0.042	26%	0.256	C	S	.	.			trans	-87.9	10.4	170.1	53.1	0	0	0	0	113	I775 G779 M780 F782	I775-S777 VanDerWaalsContact C-N 3.33Å; I775-S777 PolarHBondContact O-N 3.06Å; S777-G779 PolarHBondContact O-N 3.43Å; S777-M780 VanDerWaalsContact CB-O 3.25Å; S777-M780 WeakPolarHBondContact CB-O 3.42Å; S777-M780 PolarHBondContact O-N 2.96Å; S777-M780 PolarHBondContact OG-O 3.47Å; S777-F782 WeakPolarHBondContact O-CE2 3.47Å
778	S	82.7	Confident	86.8	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.007	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	39.8	-176.1	-54.2	0	0	0	0	113.4	F645 N647 D776	F645-S778 PolarHBondContact O-OG 2.88Å; N647-S778 WeakPolarHBondContact CA-O 3.24Å; D776-S778 VanDerWaalsContact C-N 3.29Å; D776-S778 WeakPolarHBondContact OD1-CA 3.42Å; D776-S778 PolarHBondContact OD1-N 2.83Å
779	G	80.7	Confident	86.7	Confident	11 Å²	11	45.6 Å²	45.6	11%	0.113	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	16.7	176.4	0	0	0	0	0	115.5	G718 S777	G718-G779 PolarHBondContact N-O 3.47Å; G718-G779 CarbonylContact O-C 3.59Å; G718-G779 VanDerWaalsContact O-C 3.31Å; G718-G779 WeakPolarHBondContact O-CA 3.36Å; S777-G779 PolarHBondContact O-N 3.43Å
780	M	87	Confident	86.9	Confident	25 Å²	25	42.6 Å²	42.6	12%	0.123	22%	0.224	C	C	.	.			trans	-114.1	145.5	-176.9	-64.9	-67.2	131.5	0	0	112.3	P649 F715 S777 F782	P649-M780 HydrophobicContact CB-CG 4.27Å; P649-M780 HydrophobicContact CG-CG 3.96Å; F715-M780 HydrophobicContact CB-SD 4.48Å; F715-M780 HydrophobicContact CD2-SD 4.03Å; S777-M780 VanDerWaalsContact CB-O 3.25Å; S777-M780 WeakPolarHBondContact CB-O 3.42Å; S777-M780 PolarHBondContact O-N 2.96Å; S777-M780 PolarHBondContact OG-O 3.47Å; M780-F782 HydrophobicContact CB-CD2 4.07Å; M780-F782 HydrophobicContact CB-CE1 4.1Å; M780-F782 HydrophobicContact CB-CE2 3.61Å; M780-F782 HydrophobicContact CB-CZ 3.62Å; M780-F782 HydrophobicContact CG-CE2 4.39Å; M780-F782 HydrophobicContact CG-CZ 4.01Å; M780-F782 PolarHBondContact O-N 3.42Å
781	A	89.6	Confident	86.9	Confident	4 Å²	4	41.5 Å²	41.5	3%	0.033	22%	0.221	C	C	.	.			trans	-98.1	71.9	174.3	0	0	0	0	0	110.5	S752 G753 S784 L786	S752-A781 VanDerWaalsContact OG-CA 3.25Å; S752-A781 WeakPolarHBondContact OG-CA 3.32Å; S752-A781 PolarHBondContact OG-O 3.44Å; G753-A781 WeakPolarHBondContact O-CB 3.48Å; A781-S784 PolarHBondContact O-OG 3.14Å; A781-L786 HydrophobicContact CB-CB 4.33Å; A781-L786 HydrophobicContact CB-CD1 3.65Å
782	F	89.7	Confident	86.7	Confident	4 Å²	4	42 Å²	42	2%	0.018	23%	0.229	C	C	.	.			trans	-61	154.1	179.3	-61.7	-71.4	0	0	0	112.1	M597 P649 F653 M710 M720 S752 S777 M780 S784	M597-F782 HydrophobicContact CE-CE2 3.93Å; M597-F782 HydrophobicContact CE-CZ 4.06Å; M597-F782 HydrophobicContact CG-CD2 4.45Å; M597-F782 HydrophobicContact CG-CE2 3.91Å; M597-F782 HydrophobicContact SD-CE2 4.38Å; P649-F782 HydrophobicContact CB-CZ 4.09Å; F653-F782 AromaticContact CE2-CE1 3.81Å; F653-F782 HydrophobicContact CE2-CE1 3.81Å; F653-F782 AromaticContact CE2-CZ 3.75Å; F653-F782 HydrophobicContact CE2-CZ 3.75Å; F653-F782 HydrophobicContact CZ-CD1 4.47Å; F653-F782 AromaticContact CZ-CE1 3.84Å; F653-F782 HydrophobicContact CZ-CE1 3.84Å; F653-F782 HydrophobicContact CZ-CZ 4.26Å; M710-F782 HydrophobicContact CE-CD1 3.94Å; M710-F782 HydrophobicContact CE-CE1 3.9Å; M710-F782 HydrophobicContact CG-CE1 4.2Å; M710-F782 HydrophobicContact SD-CE1 4.18Å; M720-F782 HydrophobicContact CE-CB 4.36Å; M720-F782 HydrophobicContact SD-CB 3.82Å; M720-F782 HydrophobicContact SD-CD2 3.83Å; M720-F782 HydrophobicContact SD-CG 4.33Å; S752-F782 VanDerWaalsContact CB-O 3.23Å; S752-F782 WeakPolarHBondContact CB-O 3.33Å; S752-F782 PolarHBondContact OG-N 2.89Å; S752-F782 PolarHBondContact OG-O 2.78Å; S777-F782 WeakPolarHBondContact O-CE2 3.47Å; M780-F782 HydrophobicContact CB-CD2 4.07Å; M780-F782 HydrophobicContact CB-CE1 4.1Å; M780-F782 HydrophobicContact CB-CE2 3.61Å; M780-F782 HydrophobicContact CB-CZ 3.62Å; M780-F782 HydrophobicContact CG-CE2 4.39Å; M780-F782 HydrophobicContact CG-CZ 4.01Å; M780-F782 PolarHBondContact O-N 3.42Å; F782-S784 VanDerWaalsContact C-N 3.29Å; F782-S784 PolarHBondContact O-N 2.96Å
783	H	91.4	Very high	86.6	Confident	5 Å²	5	45.1 Å²	45.1	2%	0.023	25%	0.25	C	S	.	.	S	Bend	trans	51.7	45.3	178.5	-43.9	-51.9	0	0	0	113	S681 A741 N838 S841 V843	S681-H783 PolarHBondContact OG-NE2 3.03Å; A741-H783 HydrophobicContact CB-CB 3.9Å; A741-H783 WeakPolarHBondContact O-CB 3.03Å; H783-N838 PolarHBondContact CE1-O 2.87Å; H783-S841 WeakPolarHBondContact CB-O 3.25Å; H783-S841 PolarHBondContact ND1-O 2.97Å; H783-S841 VanDerWaalsContact ND1-O 3.17Å; H783-V843 VanDerWaalsContact CD2-CG2 3.47Å; H783-V843 WeakPolarHBondContact CD2-CG2 3.24Å; H783-V843 VanDerWaalsContact NE2-CG2 3.3Å; H783-V843 WeakPolarHBondContact NE2-CG2 3.27Å
784	S	88.2	Confident	86.7	Confident	4 Å²	4	38.8 Å²	38.8	3%	0.028	22%	0.223	C	C	.	.	S	Bend	trans	-142.4	158.8	-179.4	80.5	0	0	0	0	112	A781 F782 L786 I787	A781-S784 PolarHBondContact O-OG 3.14Å; F782-S784 VanDerWaalsContact C-N 3.29Å; F782-S784 PolarHBondContact O-N 2.96Å; S784-L786 PolarHBondContact O-N 3.35Å; S784-L786 PolarHBondContact OG-N 2.91Å; S784-I787 WeakPolarHBondContact O-CG1 3.27Å; S784-I787 PolarHBondContact O-N 3.39Å
785	P	85.5	Confident	86.9	Confident	67 Å²	67	41.7 Å²	41.7	44%	0.435	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-57.3	-20.6	177	-27.2	36.3	0	0	0	114.8	Y739 I787 Q788	Y739-P785 HydrophobicContact CD1-CG 4.12Å; Y739-P785 HydrophobicContact CE1-CG 3.86Å; Y739-P785 HydrophobicContact CE2-CG 4.36Å; Y739-P785 HydrophobicContact CG-CG 4.48Å; P785-I787 VanDerWaalsContact C-N 3.25Å; P785-I787 PolarHBondContact O-N 3.26Å; P785-Q788 WeakPolarHBondContact O-CB 3.26Å; P785-Q788 PolarHBondContact O-N 2.92Å
786	L	86.3	Confident	87	Confident	54 Å²	54	46.9 Å²	46.9	28%	0.283	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-61.2	-33	178.7	-70.5	164.3	0	0	0	112.6	F715 L754 A781 S784	F715-L786 WeakPolarHBondContact CD1-O 3.26Å; F715-L786 WeakPolarHBondContact CE1-O 3.3Å; L754-L786 HydrophobicContact CD2-CD1 4.2Å; L754-L786 HydrophobicContact CD2-CD2 4.13Å; L754-L786 HydrophobicContact CG-CD1 4.22Å; L754-L786 HydrophobicContact CG-CD2 4.43Å; A781-L786 HydrophobicContact CB-CB 4.33Å; A781-L786 HydrophobicContact CB-CD1 3.65Å; S784-L786 PolarHBondContact O-N 3.35Å; S784-L786 PolarHBondContact OG-N 2.91Å
787	I	88.7	Confident	87.5	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-95.6	-1.7	-178.9	58.1	159.2	0	0	0	114.1	M710 F715 S784 P785 S789 I790 T839 L840	M710-I787 HydrophobicContact CE-CD1 3.83Å; M710-I787 HydrophobicContact SD-CB 4.47Å; M710-I787 HydrophobicContact SD-CG2 4.16Å; F715-I787 HydrophobicContact CD1-CG2 4.45Å; F715-I787 HydrophobicContact CD2-CG2 4.08Å; F715-I787 HydrophobicContact CE1-CB 4.34Å; F715-I787 HydrophobicContact CE1-CG2 4.24Å; F715-I787 HydrophobicContact CE2-CB 4.25Å; F715-I787 HydrophobicContact CE2-CG2 3.82Å; F715-I787 HydrophobicContact CG-CG2 4.38Å; F715-I787 HydrophobicContact CZ-CB 3.92Å; F715-I787 HydrophobicContact CZ-CG2 3.9Å; S784-I787 WeakPolarHBondContact O-CG1 3.27Å; S784-I787 PolarHBondContact O-N 3.39Å; P785-I787 VanDerWaalsContact C-N 3.25Å; P785-I787 PolarHBondContact O-N 3.26Å; I787-S789 PolarHBondContact O-N 2.91Å; I787-I790 WeakPolarHBondContact O-CG1 3.28Å; I787-I790 PolarHBondContact O-N 3.39Å; I787-T839 WeakPolarHBondContact CD1-O 3.42Å; I787-L840 HydrophobicContact CD1-CD2 4.07Å; I787-L840 HydrophobicContact CG1-CD2 4.11Å
788	Q	85	Confident	88	Confident	128 Å²	128	44.6 Å²	44.6	60%	0.598	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-61.5	-22.5	-172	-151.8	172	31.3	0	0	113.8	P785 I790 G791 L840	P785-Q788 WeakPolarHBondContact O-CB 3.26Å; P785-Q788 PolarHBondContact O-N 2.92Å; Q788-I790 VanDerWaalsContact C-N 3.3Å; Q788-I790 PolarHBondContact O-N 2.84Å; Q788-G791 PolarHBondContact O-N 3.4Å; Q788-L840 HydrophobicContact CG-CD1 4.44Å
789	S	84.4	Confident	88.4	Confident	92 Å²	92	48 Å²	48	64%	0.643	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-63.9	-25.1	179.6	62.9	0	0	0	0	114.7	F715 I787 G791	F715-S789 WeakPolarHBondContact CE1-OG 3.45Å; I787-S789 PolarHBondContact O-N 2.91Å; S789-G791 VanDerWaalsContact C-N 3.33Å; S789-G791 PolarHBondContact O-N 3.02Å
790	I	89.4	Confident	88.9	Confident	8 Å²	8	54.9 Å²	54.9	4%	0.041	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-77.4	-14.8	178.3	55.5	149.3	0	0	0	113.9	A709 M710 A713 F715 I787 Q788 N792 S793 L794 T839 L840	A709-I790 HydrophobicContact CB-CB 4.4Å; A709-I790 HydrophobicContact CB-CD1 4.04Å; A709-I790 HydrophobicContact CB-CG2 4.4Å; A709-I790 WeakPolarHBondContact O-CG2 3.2Å; M710-I790 HydrophobicContact CE-CD1 3.62Å; M710-I790 HydrophobicContact SD-CD1 3.91Å; A713-I790 HydrophobicContact CB-CG2 3.47Å; A713-I790 VanDerWaalsContact CB-CG2 3.47Å; F715-I790 HydrophobicContact CE2-CG2 4.16Å; F715-I790 HydrophobicContact CZ-CG1 4.36Å; F715-I790 HydrophobicContact CZ-CG2 3.71Å; I787-I790 WeakPolarHBondContact O-CG1 3.28Å; I787-I790 PolarHBondContact O-N 3.39Å; Q788-I790 VanDerWaalsContact C-N 3.3Å; Q788-I790 PolarHBondContact O-N 2.84Å; I790-N792 PolarHBondContact O-N 3.43Å; I790-S793 WeakPolarHBondContact O-CA 3.21Å; I790-S793 WeakPolarHBondContact O-CB 3.42Å; I790-S793 PolarHBondContact O-N 2.76Å; I790-L794 HydrophobicContact CD1-CD2 4.25Å; I790-L794 WeakPolarHBondContact O-CB 3.49Å; I790-L794 PolarHBondContact O-N 2.73Å; I790-T839 HydrophobicContact CD1-CG2 4.01Å; I790-L840 HydrophobicContact CG1-CD2 4.39Å
791	G	87.5	Confident	89.1	Confident	9 Å²	9	54.5 Å²	54.5	9%	0.093	29%	0.287	C	S	.	.	H	α-helix	trans	-50.1	-51	-169.6	0	0	0	0	0	114	Q788 S789 S793 R795	Q788-G791 PolarHBondContact O-N 3.4Å; S789-G791 VanDerWaalsContact C-N 3.33Å; S789-G791 PolarHBondContact O-N 3.02Å; G791-S793 PolarHBondContact O-N 3.47Å; G791-R795 WeakPolarHBondContact O-CB 3.3Å; G791-R795 PolarHBondContact O-N 3.04Å
792	N	86.7	Confident	89.2	Confident	135 Å²	135	54.4 Å²	54.4	72%	0.722	29%	0.286	S	S	*	.	H	α-helix	trans	-66.4	-33.7	178.6	-73.9	-38.5	0	0	0	113.8	I790 K796	I790-N792 PolarHBondContact O-N 3.43Å; N792-K796 WeakPolarHBondContact O-CB 3.19Å; N792-K796 PolarHBondContact O-N 2.85Å
793	S	88.1	Confident	88.9	Confident	71 Å²	71	59.1 Å²	59.1	50%	0.497	32%	0.316	S	S	.	.	H	α-helix	trans	-70.7	-49.2	177.9	-175.4	0	0	0	0	111.1	I790 G791 K796 T797	I790-S793 WeakPolarHBondContact O-CA 3.21Å; I790-S793 WeakPolarHBondContact O-CB 3.42Å; I790-S793 PolarHBondContact O-N 2.76Å; G791-S793 PolarHBondContact O-N 3.47Å; S793-K796 PolarHBondContact O-N 3.07Å; S793-T797 PolarHBondContact O-N 2.65Å; S793-T797 PolarHBondContact O-OG1 3.48Å
794	L	91.3	Very high	88.8	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.005	35%	0.35	C	S	.	.	H	α-helix	trans	-62.6	-47.9	178.3	-179	62.5	0	0	0	110.8	R706 A709 I790 K796 T797 L798 V836 T839	R706-L794 HydrophobicContact CB-CD1 4.41Å; R706-L794 HydrophobicContact CG-CD1 3.91Å; R706-L794 HydrophobicContact CG-CD2 4.05Å; A709-L794 HydrophobicContact CB-CB 4.41Å; A709-L794 HydrophobicContact CB-CD1 4.17Å; I790-L794 HydrophobicContact CD1-CD2 4.25Å; I790-L794 WeakPolarHBondContact O-CB 3.49Å; I790-L794 PolarHBondContact O-N 2.73Å; L794-K796 VanDerWaalsContact C-N 3.34Å; L794-K796 PolarHBondContact O-N 2.85Å; L794-T797 CarbonylContact O-C 3.57Å; L794-T797 WeakPolarHBondContact O-CA 3.46Å; L794-T797 WeakPolarHBondContact O-CB 3.4Å; L794-T797 PolarHBondContact O-N 3.46Å; L794-L798 HydrophobicContact CD1-CD1 3.9Å; L794-L798 HydrophobicContact CD1-CD2 4.26Å; L794-L798 HydrophobicContact CD1-CG 3.82Å; L794-L798 HydrophobicContact CD2-CD1 4.43Å; L794-L798 HydrophobicContact CG-CD1 3.9Å; L794-L798 HydrophobicContact CG-CG 4.14Å; L794-L798 PolarHBondContact O-N 2.86Å; L794-V836 HydrophobicContact CB-CG2 4.19Å; L794-V836 HydrophobicContact CD2-CG2 3.99Å; L794-V836 HydrophobicContact CG-CG2 3.85Å; L794-T839 HydrophobicContact CD2-CG2 4.04Å
795	R	91.5	Very high	88.8	Confident	119 Å²	119	68.9 Å²	68.9	45%	0.449	37%	0.367	S	S	.	.	H	α-helix	trans	-54.5	-46.5	177.4	-174.3	-177	170.2	-169.2	1.1	112.8	G791 T797 N799 E833 V836	G791-R795 WeakPolarHBondContact O-CB 3.3Å; G791-R795 PolarHBondContact O-N 3.04Å; R795-T797 PolarHBondContact O-N 3.18Å; R795-N799 WeakPolarHBondContact O-CB 3.38Å; R795-N799 PolarHBondContact O-N 2.68Å; R795-N799 VanDerWaalsContact O-N 3.11Å; R795-N799 PolarHBondContact O-ND2 3.28Å; R795-E833 IonicContact CZ-OE1 2.73Å; R795-E833 IonicContact NE-OE1 3.26Å; R795-E833 PolarHBondContact NE-OE1 2.78Å; R795-E833 IonicContact NH2-OE1 3.59Å; R795-E833 PolarHBondContact NH2-OE1 3.33Å; R795-V836 HydrophobicContact CB-CG2 3.79Å; R795-V836 HydrophobicContact CG-CG2 4.49Å
796	K	89.4	Confident	89.1	Confident	158 Å²	158	69.2 Å²	69.2	69%	0.687	36%	0.361	S	S	*	.	H	α-helix	trans	-65.1	-28.6	178.7	-171.2	178.6	-178.8	-177.4	0	112.4	N792 S793 L794	N792-K796 WeakPolarHBondContact O-CB 3.19Å; N792-K796 PolarHBondContact O-N 2.85Å; S793-K796 PolarHBondContact O-N 3.07Å; L794-K796 VanDerWaalsContact C-N 3.34Å; L794-K796 PolarHBondContact O-N 2.85Å
797	T	91	Very high	89.4	Confident	39 Å²	39	71.9 Å²	71.9	24%	0.239	38%	0.375	C	S	.	.	H	α-helix	trans	-84.1	-45.1	-179.8	-50	0	0	0	0	111.5	F705 S793 L794 R795 N799 Q800	F705-T797 HydrophobicContact CB-CG2 4.07Å; F705-T797 HydrophobicContact CD1-CG2 3.32Å; F705-T797 HydrophobicContact CD2-CG2 4.29Å; F705-T797 HydrophobicContact CE1-CG2 3.71Å; F705-T797 HydrophobicContact CG-CG2 3.65Å; F705-T797 HydrophobicContact CZ-CG2 4.34Å; S793-T797 PolarHBondContact O-N 2.65Å; S793-T797 PolarHBondContact O-OG1 3.48Å; L794-T797 CarbonylContact O-C 3.57Å; L794-T797 WeakPolarHBondContact O-CA 3.46Å; L794-T797 WeakPolarHBondContact O-CB 3.4Å; L794-T797 PolarHBondContact O-N 3.46Å; R795-T797 PolarHBondContact O-N 3.18Å; T797-N799 VanDerWaalsContact C-N 3.31Å; T797-N799 PolarHBondContact O-N 2.77Å; T797-Q800 WeakPolarHBondContact O-CB 3.42Å; T797-Q800 PolarHBondContact O-N 3.3Å
798	L	92.9	Very high	89.7	Confident	0 Å²	0	73 Å²	73	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-66.7	-29.3	177.9	-66.3	-174.1	0	0	0	112.8	T702 F705 R706 L794 Q800 V801 I802 A832 H835 V836	T702-L798 HydrophobicContact CG2-CD1 4.15Å; T702-L798 HydrophobicContact CG2-CD2 3.9Å; F705-L798 HydrophobicContact CB-CD2 3.99Å; R706-L798 HydrophobicContact CG-CD1 4.45Å; L794-L798 HydrophobicContact CD1-CD1 3.9Å; L794-L798 HydrophobicContact CD1-CD2 4.26Å; L794-L798 HydrophobicContact CD1-CG 3.82Å; L794-L798 HydrophobicContact CD2-CD1 4.43Å; L794-L798 HydrophobicContact CG-CD1 3.9Å; L794-L798 HydrophobicContact CG-CG 4.14Å; L794-L798 PolarHBondContact O-N 2.86Å; L798-Q800 PolarHBondContact O-N 2.98Å; L798-Q800 VanDerWaalsContact O-N 3.1Å; L798-V801 HydrophobicContact CD2-CG2 4.42Å; L798-V801 PolarHBondContact O-N 3.18Å; L798-I802 HydrophobicContact CB-CD1 4.38Å; L798-I802 PolarHBondContact O-N 2.9Å; L798-A832 HydrophobicContact CB-CB 3.69Å; L798-H835 HydrophobicContact CD1-CB 3.97Å; L798-V836 HydrophobicContact CD1-CG2 4.33Å
799	N	91.6	Very high	90	Very high	71 Å²	71	68.7 Å²	68.7	38%	0.38	36%	0.364	S	S	.	.	H	α-helix	trans	-62.8	-10.7	169.6	-91.2	-78	0	0	0	114	R795 T797 A832 E833	R795-N799 WeakPolarHBondContact O-CB 3.38Å; R795-N799 PolarHBondContact O-N 2.68Å; R795-N799 VanDerWaalsContact O-N 3.11Å; R795-N799 PolarHBondContact O-ND2 3.28Å; T797-N799 VanDerWaalsContact C-N 3.31Å; T797-N799 PolarHBondContact O-N 2.77Å; N799-A832 HydrophobicContact CB-CB 4.28Å; N799-A832 WeakPolarHBondContact ND2-CB 3.28Å; N799-E833 PolarHBondContact ND2-OE1 2.86Å
800	Q	91.1	Very high	90.3	Very high	156 Å²	156	70 Å²	70	73%	0.729	37%	0.373	S	S	*	.	H	α-helix	trans	-94	-19.1	169.9	-56.9	-176.5	-6.7	0	0	112.8	T797 L798	T797-Q800 WeakPolarHBondContact O-CB 3.42Å; T797-Q800 PolarHBondContact O-N 3.3Å; L798-Q800 PolarHBondContact O-N 2.98Å; L798-Q800 VanDerWaalsContact O-N 3.1Å
801	V	90.9	Very high	90.5	Very high	18 Å²	18	72.8 Å²	72.8	11%	0.109	38%	0.383	C	S	.	.	H	α-helix	trans	-88.4	-35.3	176.5	-178.1	0	0	0	0	110.8	L701 F705 L798 P803	L701-V801 HydrophobicContact CB-CG1 3.64Å; L701-V801 HydrophobicContact CB-CG2 4.23Å; L701-V801 HydrophobicContact CD1-CG1 4.37Å; F705-V801 HydrophobicContact CD2-CG2 3.55Å; F705-V801 HydrophobicContact CE2-CG2 3.73Å; L798-V801 HydrophobicContact CD2-CG2 4.42Å; L798-V801 PolarHBondContact O-N 3.18Å; V801-P803 VanDerWaalsContact C-CD 3.44Å; V801-P803 WeakPolarHBondContact O-CD 3.46Å
802	I	91.6	Very high	90.8	Very high	2 Å²	2	72.6 Å²	72.6	1%	0.01	38%	0.379	C	S	.	.			trans	-118.7	73.4	-173.7	-48	160.6	0	0	0	108	F694 L798 Q804 A832	F694-I802 HydrophobicContact CE1-CD1 3.77Å; F694-I802 HydrophobicContact CE1-CG1 3.75Å; F694-I802 HydrophobicContact CE1-CG2 4.18Å; F694-I802 HydrophobicContact CZ-CD1 3.54Å; F694-I802 HydrophobicContact CZ-CG1 3.93Å; L798-I802 HydrophobicContact CB-CD1 4.38Å; L798-I802 PolarHBondContact O-N 2.9Å; I802-Q804 VanDerWaalsContact C-N 3.28Å; I802-Q804 PolarHBondContact O-N 2.83Å; I802-A832 HydrophobicContact CD1-CB 4.31Å
803	P	84.4	Confident	91.2	Very high	102 Å²	102	66.8 Å²	66.8	66%	0.662	35%	0.348	S	S	*	.	S	Bend	trans	-73.5	-18.3	-173.8	30.7	-37.1	0	0	0	113.6	V801	V801-P803 VanDerWaalsContact C-CD 3.44Å; V801-P803 WeakPolarHBondContact O-CD 3.46Å
804	Q	88.6	Confident	91.5	Very high	156 Å²	156	63.6 Å²	63.6	73%	0.729	33%	0.325	S	S	*	.	S	Bend	trans	-139.2	107.9	171.7	-71.9	-172.1	-20.5	0	0	108.6	I802	I802-Q804 VanDerWaalsContact C-N 3.28Å; I802-Q804 PolarHBondContact O-N 2.83Å
805	P	88.8	Confident	91.7	Very high	58 Å²	58	63.5 Å²	63.5	38%	0.377	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-59.5	138.2	173.2	-24.9	35.4	0	0	0	111.6	Y829 C830	P805-Y829 HydrophobicContact CB-CD1 4.3Å; P805-Y829 HydrophobicContact CB-CG 4.41Å; P805-C830 WeakPolarHBondContact CA-O 3.25Å; P805-C830 WeakPolarHBondContact CB-O 3.19Å
806	K	92.2	Very high	91.7	Very high	74 Å²	74	58 Å²	58	32%	0.322	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	149.7	175.3	-52.6	-165.9	-159.1	62.2	0	110	C693 E698 Y829 C830	C693-K806 HydrophobicContact CB-CB 4.5Å; C693-K806 WeakPolarHBondContact O-CD 3.45Å; C693-K806 WeakPolarHBondContact O-CE 3.33Å; C693-K806 WeakPolarHBondContact O-CG 3.49Å; C693-K806 PolarHBondContact O-NZ 2.86Å; E698-K806 VanDerWaalsContact CD-NZ 3.27Å; E698-K806 IonicContact OE1-NZ 3.36Å; E698-K806 PolarHBondContact OE1-NZ 2.75Å; E698-K806 IonicContact OE2-NZ 2.8Å; E698-K806 PolarHBondContact OE2-NZ 2.89Å; K806-Y829 WeakPolarHBondContact O-CA 3.41Å; K806-C830 PolarHBondContact O-N 3.35Å
807	L	92.7	Very high	91.9	Very high	110 Å²	110	50.6 Å²	50.6	58%	0.576	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	129.8	177.8	-165.7	80.5	0	0	0	109.8	C693 K828 Y829	C693-L807 PolarHBondContact SG-O 3.4Å; L807-K828 WeakPolarHBondContact CA-O 3.29Å; L807-K828 HydrophobicContact CD1-CB 4.01Å; L807-Y829 HydrophobicContact CB-CE1 4.45Å; L807-Y829 HydrophobicContact CD1-CD1 4.2Å; L807-Y829 HydrophobicContact CD1-CE1 3.81Å
808	R	94.1	Very high	91.9	Very high	25 Å²	25	51.2 Å²	51.2	9%	0.094	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-71.7	139.7	174.4	-64	173.9	61.8	-99.6	-6.3	109.8	D691 C693 W812 G827 K828 C830	D691-R808 WeakPolarHBondContact OD2-CA 3.25Å; C693-R808 VanDerWaalsContact SG-CA 3.57Å; R808-W812 HydrophobicContact CB-CE3 4.2Å; R808-W812 HydrophobicContact CG-CE3 3.7Å; R808-W812 HydrophobicContact CG-CZ3 3.65Å; R808-W812 VanDerWaalsContact NH2-CD1 3.3Å; R808-W812 VanDerWaalsContact NH2-CD2 3.28Å; R808-W812 PolarHBondContact NH2-O 2.93Å; R808-G827 WeakPolarHBondContact CD-O 3.23Å; R808-G827 PolarHBondContact NH1-O 3.47Å; R808-K828 PolarHBondContact N-O 3.27Å; R808-C830 HydrophobicContact CG-CB 3.99Å
809	S	92.3	Very high	91.8	Very high	39 Å²	39	54.3 Å²	54.3	27%	0.273	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-81	155.8	171.9	91.6	0	0	0	0	111.2	D691 R811 W812	D691-S809 WeakPolarHBondContact OD1-CB 3.48Å; D691-S809 PolarHBondContact OD1-OG 2.82Å; D691-S809 PolarHBondContact OD2-N 3.42Å; S809-R811 PolarHBondContact O-N 2.91Å; S809-R811 WeakPolarHBondContact OG-CB 3.49Å; S809-R811 PolarHBondContact OG-N 3.45Å; S809-W812 PolarHBondContact O-N 3.43Å
810	S	89.7	Confident	91.7	Very high	119 Å²	119	56.1 Å²	56.1	83%	0.832	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-8.4	176.1	54.8	0	0	0	0	114.1	W812	S810-W812 VanDerWaalsContact C-N 3.33Å
811	R	93.5	Very high	91.7	Very high	66 Å²	66	53.4 Å²	53.4	25%	0.249	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-25.7	170.4	-57.5	-171.9	-66.5	172.1	-4.9	112.2	E673 P674 D675 G676 I677 S809 I813	E673-R811 IonicContact OE2-CZ 3.21Å; E673-R811 IonicContact OE2-NH1 2.85Å; E673-R811 PolarHBondContact OE2-NH1 3.25Å; E673-R811 IonicContact OE2-NH2 2.7Å; E673-R811 PolarHBondContact OE2-NH2 2.61Å; P674-R811 WeakPolarHBondContact O-CD 3.19Å; P674-R811 PolarHBondContact O-NH1 3.19Å; D675-R811 WeakPolarHBondContact O-CB 3.26Å; D675-R811 VanDerWaalsContact O-CG 3.28Å; D675-R811 WeakPolarHBondContact O-CG 3.4Å; G676-R811 CarbonylContact C-O 3.59Å; G676-R811 WeakPolarHBondContact CA-O 3.37Å; I677-R811 PolarHBondContact N-O 3.05Å; S809-R811 PolarHBondContact O-N 2.91Å; S809-R811 WeakPolarHBondContact OG-CB 3.49Å; S809-R811 PolarHBondContact OG-N 3.45Å; R811-I813 PolarHBondContact O-N 2.95Å
812	W	95	Very high	91.8	Very high	5 Å²	5	55.1 Å²	55.1	2%	0.019	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	103.4	179.8	-179.3	10.4	0	0	0	110.9	I677 E684 A687 G688 D691 C693 R808 S809 S810 C830 Y834	I677-W812 HydrophobicContact CB-CB 4.38Å; I677-W812 WeakPolarHBondContact O-CA 3.49Å; E684-W812 HydrophobicContact CB-CZ2 4.2Å; E684-W812 WeakPolarHBondContact O-CZ2 3.45Å; E684-W812 PolarHBondContact OE1-NE1 3.31Å; A687-W812 HydrophobicContact CB-CD2 4.21Å; A687-W812 HydrophobicContact CB-CG 4.46Å; A687-W812 HydrophobicContact CB-CZ2 4.13Å; G688-W812 VanDerWaalsContact CA-CZ3 3.43Å; D691-W812 HydrophobicContact CB-CB 4.38Å; D691-W812 HydrophobicContact CB-CE3 4.01Å; C693-W812 HydrophobicContact CB-CZ3 4.36Å; R808-W812 HydrophobicContact CB-CE3 4.2Å; R808-W812 HydrophobicContact CG-CE3 3.7Å; R808-W812 HydrophobicContact CG-CZ3 3.65Å; R808-W812 VanDerWaalsContact NH2-CD1 3.3Å; R808-W812 VanDerWaalsContact NH2-CD2 3.28Å; R808-W812 PolarHBondContact NH2-O 2.93Å; S809-W812 PolarHBondContact O-N 3.43Å; S810-W812 VanDerWaalsContact C-N 3.33Å; W812-C830 HydrophobicContact CZ3-CB 4.16Å; W812-Y834 HydrophobicContact CH2-CD1 4.47Å; W812-Y834 AromaticContact CH2-CE1 3.87Å; W812-Y834 HydrophobicContact CH2-CE1 3.87Å; W812-Y834 AromaticContact CZ2-CE1 3.66Å; W812-Y834 HydrophobicContact CZ2-CE1 3.66Å; W812-Y834 AromaticContact CZ2-CZ 3.82Å
813	I	95.1	Very high	91.7	Very high	14 Å²	14	61 Å²	61	7%	0.072	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	124.3	170.2	-57.4	-52.2	0	0	0	109	W591 I677 V678 R811 W822 A848 H851	W591-I813 HydrophobicContact CH2-CD1 4.42Å; W591-I813 HydrophobicContact CH2-CG1 3.75Å; W591-I813 HydrophobicContact CZ3-CG1 3.79Å; I677-I813 PolarHBondContact O-N 2.93Å; V678-I813 HydrophobicContact CG2-CB 4.2Å; R811-I813 PolarHBondContact O-N 2.95Å; I813-W822 HydrophobicContact CB-CH2 4.39Å; I813-W822 HydrophobicContact CD1-CH2 3.88Å; I813-W822 HydrophobicContact CD1-CZ3 4.03Å; I813-W822 HydrophobicContact CG2-CH2 3.69Å; I813-W822 HydrophobicContact CG2-CZ2 3.84Å; I813-A848 HydrophobicContact CG2-CB 3.56Å; I813-H851 HydrophobicContact CD1-CB 4.33Å; I813-H851 HydrophobicContact CG1-CB 4.34Å
814	S	94.2	Very high	92	Very high	3 Å²	3	58 Å²	58	2%	0.021	32%	0.315	C	S	.	.			trans	-80.5	137.8	179.7	-175	0	0	0	0	110.8	S816 V817 Y834	S814-S816 PolarHBondContact OG-N 3.49Å; S814-V817 PolarHBondContact OG-N 3.1Å; S814-Y834 VanDerWaalsContact CB-OH 3.3Å; S814-Y834 WeakPolarHBondContact CB-OH 3.3Å; S814-Y834 PolarHBondContact OG-OH 3.44Å
815	S	94.5	Very high	91.9	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.314	C	S	.	.	S	Bend	trans	-108.1	15.1	168.7	72.7	0	0	0	0	113.6	G679 E684 V843 L844	G679-S815 WeakPolarHBondContact O-CB 3.44Å; G679-S815 PolarHBondContact O-OG 2.87Å; E684-S815 PolarHBondContact OE1-N 2.93Å; S815-V843 CarbonylContact O-C 3.55Å; S815-V843 VanDerWaalsContact O-CA 3.29Å; S815-V843 WeakPolarHBondContact O-CA 3.45Å; S815-L844 WeakPolarHBondContact CA-O 3.18Å; S815-L844 VanDerWaalsContact CB-O 3.24Å; S815-L844 WeakPolarHBondContact CB-O 3.1Å; S815-L844 PolarHBondContact O-N 3.14Å
816	S	92.5	Very high	92.1	Very high	4 Å²	4	56.1 Å²	56.1	3%	0.028	31%	0.307	C	S	.	.	S	Bend	trans	-133.6	-20.9	179.6	63.4	0	0	0	0	114.7	E684 S814 N837	E684-S816 VanDerWaalsContact OE2-CB 3.24Å; E684-S816 WeakPolarHBondContact OE2-CB 3.3Å; E684-S816 PolarHBondContact OE2-OG 3.25Å; S814-S816 PolarHBondContact OG-N 3.49Å; S816-N837 VanDerWaalsContact C-ND2 3.32Å; S816-N837 PolarHBondContact O-ND2 2.98Å
817	V	92.9	Very high	92	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.006	29%	0.291	C	S	.	.	S	Bend	trans	-101.1	127.9	166.2	-175.9	0	0	0	0	106.8	S814 E821 W822 L826 Y834	S814-V817 PolarHBondContact OG-N 3.1Å; V817-E821 HydrophobicContact CG1-CB 3.5Å; V817-W822 PolarHBondContact O-NE1 2.77Å; V817-L826 HydrophobicContact CG2-CD2 4.11Å; V817-L826 HydrophobicContact CG2-CG 4.01Å; V817-Y834 HydrophobicContact CG2-CD2 3.85Å; V817-Y834 HydrophobicContact CG2-CE2 3.64Å
818	P	91.5	Very high	91.9	Very high	52 Å²	52	51.1 Å²	51.1	34%	0.338	28%	0.28	S	S	.	.			trans	-55.5	148.9	172.6	-23.7	33.7	0	0	0	111.5	S820 E821 W822 L844	P818-S820 PolarHBondContact O-N 2.89Å; P818-E821 WeakPolarHBondContact O-CA 3.47Å; P818-E821 PolarHBondContact O-N 2.92Å; P818-W822 PolarHBondContact O-N 2.59Å; P818-L844 HydrophobicContact CB-CD1 4.22Å; P818-L844 HydrophobicContact CG-CD1 4.11Å
819	E	90.6	Very high	91.8	Very high	65 Å²	65	54.4 Å²	54.4	30%	0.304	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-50.1	-44.7	179.9	-171.1	-125.6	125.6	0	0	112.4	E821 W822 K2414	E819-E821 PolarHBondContact O-N 3.02Å; E819-W822 HydrophobicContact CB-CZ2 4.32Å; E819-W822 HydrophobicContact CG-CD2 4.4Å; E819-W822 HydrophobicContact CG-CE3 4.29Å; E819-W822 HydrophobicContact CG-CH2 4.23Å; E819-W822 HydrophobicContact CG-CZ2 4.36Å; E819-W822 HydrophobicContact CG-CZ3 4.2Å; E819-W822 WeakPolarHBondContact O-CB 3.24Å; E819-W822 PolarHBondContact O-N 3.23Å; E819-K2414 IonicContact OE1-NZ 3.27Å; E819-K2414 PolarHBondContact OE1-NZ 3.47Å
820	S	90.6	Very high	91.9	Very high	110 Å²	110	52.5 Å²	52.5	77%	0.769	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-61.7	-12.9	175.4	55.7	0	0	0	0	115.8	P818	P818-S820 PolarHBondContact O-N 2.89Å
821	E	91.2	Very high	92	Very high	99 Å²	99	47.2 Å²	47.2	46%	0.463	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-111.8	3.1	175.1	-75.8	-169.5	-159.4	0	0	113.5	V817 P818 E819 D823 S824	V817-E821 HydrophobicContact CG1-CB 3.5Å; P818-E821 WeakPolarHBondContact O-CA 3.47Å; P818-E821 PolarHBondContact O-N 2.92Å; E819-E821 PolarHBondContact O-N 3.02Å; E821-D823 PolarHBondContact O-N 2.73Å; E821-S824 WeakPolarHBondContact O-CB 3.15Å; E821-S824 PolarHBondContact O-N 2.92Å; E821-S824 PolarHBondContact O-OG 2.93Å
822	W	91.7	Very high	92	Very high	53 Å²	53	44 Å²	44	20%	0.201	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-32.7	178.7	-72	3.5	0	0	0	113.3	I813 V817 P818 E819 S824 G827 K828 H851	I813-W822 HydrophobicContact CB-CH2 4.39Å; I813-W822 HydrophobicContact CD1-CH2 3.88Å; I813-W822 HydrophobicContact CD1-CZ3 4.03Å; I813-W822 HydrophobicContact CG2-CH2 3.69Å; I813-W822 HydrophobicContact CG2-CZ2 3.84Å; V817-W822 PolarHBondContact O-NE1 2.77Å; P818-W822 PolarHBondContact O-N 2.59Å; E819-W822 HydrophobicContact CB-CZ2 4.32Å; E819-W822 HydrophobicContact CG-CD2 4.4Å; E819-W822 HydrophobicContact CG-CE3 4.29Å; E819-W822 HydrophobicContact CG-CH2 4.23Å; E819-W822 HydrophobicContact CG-CZ2 4.36Å; E819-W822 HydrophobicContact CG-CZ3 4.2Å; E819-W822 WeakPolarHBondContact O-CB 3.24Å; E819-W822 PolarHBondContact O-N 3.23Å; W822-S824 PolarHBondContact O-N 3.07Å; W822-G827 CarbonylContact O-C 3.56Å; W822-G827 WeakPolarHBondContact O-CA 3.26Å; W822-K828 PolarHBondContact O-N 2.77Å; W822-H851 AromaticContact CH2-CD2 3.98Å; W822-H851 AromaticContact CH2-CE1 3.73Å; W822-H851 AromaticContact CH2-NE2 3.3Å; W822-H851 VanDerWaalsContact CH2-NE2 3.3Å; W822-H851 WeakPolarHBondContact CH2-NE2 3.45Å
823	D	88.8	Confident	91.9	Very high	127 Å²	127	46.3 Å²	46.3	68%	0.679	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-3.5	176.8	-110.7	-45.1	0	0	0	113.9	E821 K828	E821-D823 PolarHBondContact O-N 2.73Å; D823-K828 WeakPolarHBondContact O-CD 3.34Å; D823-K828 WeakPolarHBondContact O-CE 3.41Å; D823-K828 PolarHBondContact O-NZ 3.23Å; D823-K828 WeakPolarHBondContact OD1-CE 3.31Å; D823-K828 IonicContact OD1-NZ 3.43Å; D823-K828 PolarHBondContact OD1-NZ 3.26Å
824	S	91.2	Very high	91.9	Very high	39 Å²	39	45.6 Å²	45.6	27%	0.273	24%	0.238	S	C	.	.	S	Bend	trans	-75	165.9	175.3	73.8	0	0	0	0	112.5	E821 W822 L826 G827 K828	E821-S824 WeakPolarHBondContact O-CB 3.15Å; E821-S824 PolarHBondContact O-N 2.92Å; E821-S824 PolarHBondContact O-OG 2.93Å; W822-S824 PolarHBondContact O-N 3.07Å; S824-L826 PolarHBondContact O-N 3.24Å; S824-L826 PolarHBondContact OG-N 3.33Å; S824-G827 PolarHBondContact O-N 2.89Å; S824-G827 VanDerWaalsContact O-N 3.14Å; S824-G827 PolarHBondContact OG-N 3.37Å; S824-G827 VanDerWaalsContact OG-N 3.07Å; S824-K828 WeakPolarHBondContact O-CB 3.26Å; S824-K828 WeakPolarHBondContact O-CG 3.3Å; S824-K828 PolarHBondContact O-N 2.83Å
825	D	87.7	Confident	91.8	Very high	129 Å²	129	45.5 Å²	45.5	69%	0.69	24%	0.237	S	C	*	.	H	α-helix	trans	-59.5	-25.7	170.5	-75	-31.4	0	0	0	112.7	Y829	D825-Y829 WeakPolarHBondContact O-CD2 3.46Å
826	L	91.9	Very high	91.7	Very high	45 Å²	45	46.2 Å²	46.2	24%	0.236	24%	0.242	C	C	.	.	H	α-helix	trans	-70.9	-50.7	173.2	-175.7	66.1	0	0	0	110.1	V817 S824 E833 Y834 N837	V817-L826 HydrophobicContact CG2-CD2 4.11Å; V817-L826 HydrophobicContact CG2-CG 4.01Å; S824-L826 PolarHBondContact O-N 3.24Å; S824-L826 PolarHBondContact OG-N 3.33Å; L826-E833 HydrophobicContact CD1-CB 4Å; L826-Y834 WeakPolarHBondContact O-CD2 3.37Å; L826-N837 HydrophobicContact CD1-CB 4.33Å; L826-N837 HydrophobicContact CD2-CB 4.29Å
827	G	89.8	Confident	91.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-70.2	-34.1	-177.8	0	0	0	0	0	114.6	R808 W822 S824	R808-G827 WeakPolarHBondContact CD-O 3.23Å; R808-G827 PolarHBondContact NH1-O 3.47Å; W822-G827 CarbonylContact O-C 3.56Å; W822-G827 WeakPolarHBondContact O-CA 3.26Å; S824-G827 PolarHBondContact O-N 2.89Å; S824-G827 VanDerWaalsContact O-N 3.14Å; S824-G827 PolarHBondContact OG-N 3.37Å; S824-G827 VanDerWaalsContact OG-N 3.07Å
828	K	90.7	Very high	91.7	Very high	78 Å²	78	47.4 Å²	47.4	34%	0.339	25%	0.248	S	C	.	.	H	α-helix	trans	-75.1	-31.8	-178.1	-81.2	175.6	169	140.5	0	114.5	L807 R808 W822 D823 S824	L807-K828 WeakPolarHBondContact CA-O 3.29Å; L807-K828 HydrophobicContact CD1-CB 4.01Å; R808-K828 PolarHBondContact N-O 3.27Å; W822-K828 PolarHBondContact O-N 2.77Å; D823-K828 WeakPolarHBondContact O-CD 3.34Å; D823-K828 WeakPolarHBondContact O-CE 3.41Å; D823-K828 PolarHBondContact O-NZ 3.23Å; D823-K828 WeakPolarHBondContact OD1-CE 3.31Å; D823-K828 IonicContact OD1-NZ 3.43Å; D823-K828 PolarHBondContact OD1-NZ 3.26Å; S824-K828 WeakPolarHBondContact O-CB 3.26Å; S824-K828 WeakPolarHBondContact O-CG 3.3Å; S824-K828 PolarHBondContact O-N 2.83Å
829	Y	93.1	Very high	91.6	Very high	94 Å²	94	45 Å²	45	37%	0.369	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	124.4	-170.2	-67.4	-78.4	0	0	0	112.9	P805 K806 L807 D825 S831	P805-Y829 HydrophobicContact CB-CD1 4.3Å; P805-Y829 HydrophobicContact CB-CG 4.41Å; K806-Y829 WeakPolarHBondContact O-CA 3.41Å; L807-Y829 HydrophobicContact CB-CE1 4.45Å; L807-Y829 HydrophobicContact CD1-CD1 4.2Å; L807-Y829 HydrophobicContact CD1-CE1 3.81Å; D825-Y829 WeakPolarHBondContact O-CD2 3.46Å; Y829-S831 VanDerWaalsContact C-N 3.28Å; Y829-S831 WeakPolarHBondContact O-CB 3.46Å; Y829-S831 PolarHBondContact O-N 3.46Å; Y829-S831 PolarHBondContact O-OG 3.02Å
830	C	93.7	Very high	91.6	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	90.9	166	-177	0	0	0	0	108.4	C693 F694 P805 K806 R808 W812 H835	C693-C830 HydrophobicContact CB-CB 3.56Å; F694-C830 VanDerWaalsContact CD1-SG 3.59Å; F694-C830 WeakPolarHBondContact CE1-SG 3.18Å; P805-C830 WeakPolarHBondContact CA-O 3.25Å; P805-C830 WeakPolarHBondContact CB-O 3.19Å; K806-C830 PolarHBondContact O-N 3.35Å; R808-C830 HydrophobicContact CG-CB 3.99Å; W812-C830 HydrophobicContact CZ3-CB 4.16Å; C830-H835 PolarHBondContact SG-NE2 2.99Å
831	S	92.9	Very high	91.7	Very high	7 Å²	7	40 Å²	40	5%	0.049	20%	0.201	C	C	.	.			trans	-127	163.4	-162.6	56.8	0	0	0	0	111.5	Y829 E833 Y834 H835	Y829-S831 VanDerWaalsContact C-N 3.28Å; Y829-S831 WeakPolarHBondContact O-CB 3.46Å; Y829-S831 PolarHBondContact O-N 3.46Å; Y829-S831 PolarHBondContact O-OG 3.02Å; S831-E833 PolarHBondContact O-N 2.75Å; S831-Y834 PolarHBondContact O-N 2.86Å; S831-Y834 WeakPolarHBondContact OG-CB 3.24Å; S831-Y834 PolarHBondContact OG-N 2.89Å; S831-H835 PolarHBondContact O-CD2 3.19Å; S831-H835 VanDerWaalsContact O-CD2 3.27Å; S831-H835 PolarHBondContact O-N 3.27Å; S831-H835 VanDerWaalsContact O-N 3.13Å
832	A	92.3	Very high	91.7	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.3	-36.6	172.1	0	0	0	0	0	111.5	L798 N799 I802 V836	L798-A832 HydrophobicContact CB-CB 3.69Å; N799-A832 HydrophobicContact CB-CB 4.28Å; N799-A832 WeakPolarHBondContact ND2-CB 3.28Å; I802-A832 HydrophobicContact CD1-CB 4.31Å; A832-V836 WeakPolarHBondContact O-CG2 3.45Å; A832-V836 PolarHBondContact O-N 2.81Å
833	E	93.2	Very high	91.8	Very high	52 Å²	52	35.6 Å²	35.6	24%	0.243	19%	0.188	C	C	.	.	H	α-helix	trans	-62.9	-46.1	173.8	-73.4	66.9	-159.4	0	0	111.9	R795 N799 L826 S831 H835 V836 N837	R795-E833 IonicContact CZ-OE1 2.73Å; R795-E833 IonicContact NE-OE1 3.26Å; R795-E833 PolarHBondContact NE-OE1 2.78Å; R795-E833 IonicContact NH2-OE1 3.59Å; R795-E833 PolarHBondContact NH2-OE1 3.33Å; N799-E833 PolarHBondContact ND2-OE1 2.86Å; L826-E833 HydrophobicContact CD1-CB 4Å; S831-E833 PolarHBondContact O-N 2.75Å; E833-H835 PolarHBondContact O-N 3.37Å; E833-V836 PolarHBondContact O-N 2.84Å; E833-N837 PolarHBondContact O-N 2.83Å
834	Y	94.3	Very high	92	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-58.2	-49.2	175	-174.2	-83.6	0	0	0	112.1	E684 W812 S814 V817 L826 S831 V836 N837 N838	E684-Y834 VanDerWaalsContact CD-OH 3.31Å; E684-Y834 PolarHBondContact OE1-OH 2.92Å; E684-Y834 PolarHBondContact OE2-OH 3.17Å; W812-Y834 HydrophobicContact CH2-CD1 4.47Å; W812-Y834 AromaticContact CH2-CE1 3.87Å; W812-Y834 HydrophobicContact CH2-CE1 3.87Å; W812-Y834 AromaticContact CZ2-CE1 3.66Å; W812-Y834 HydrophobicContact CZ2-CE1 3.66Å; W812-Y834 AromaticContact CZ2-CZ 3.82Å; S814-Y834 VanDerWaalsContact CB-OH 3.3Å; S814-Y834 WeakPolarHBondContact CB-OH 3.3Å; S814-Y834 PolarHBondContact OG-OH 3.44Å; V817-Y834 HydrophobicContact CG2-CD2 3.85Å; V817-Y834 HydrophobicContact CG2-CE2 3.64Å; L826-Y834 WeakPolarHBondContact O-CD2 3.37Å; S831-Y834 PolarHBondContact O-N 2.86Å; S831-Y834 WeakPolarHBondContact OG-CB 3.24Å; S831-Y834 PolarHBondContact OG-N 2.89Å; Y834-V836 VanDerWaalsContact C-N 3.28Å; Y834-V836 PolarHBondContact O-N 2.87Å; Y834-N837 WeakPolarHBondContact O-CA 3.43Å; Y834-N837 WeakPolarHBondContact O-CB 3.43Å; Y834-N837 PolarHBondContact O-N 3.24Å; Y834-N837 VanDerWaalsContact O-N 3.08Å; Y834-N838 PolarHBondContact O-N 2.81Å
835	H	92.8	Very high	92.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-74.7	-17.4	-178.1	-67.4	-67.7	0	0	0	113.6	F694 T702 L798 C830 S831 E833 T839	F694-H835 AromaticContact CE2-CD2 3.89Å; F694-H835 AromaticContact CE2-CE1 4Å; F694-H835 AromaticContact CE2-NE2 3.53Å; F694-H835 AromaticContact CZ-CD2 3.4Å; F694-H835 WeakPolarHBondContact CZ-CD2 3.26Å; F694-H835 AromaticContact CZ-NE2 3.34Å; F694-H835 VanDerWaalsContact CZ-NE2 3.34Å; F694-H835 WeakPolarHBondContact CZ-NE2 3.45Å; T702-H835 HydrophobicContact CG2-CB 4.11Å; L798-H835 HydrophobicContact CD1-CB 3.97Å; C830-H835 PolarHBondContact SG-NE2 2.99Å; S831-H835 PolarHBondContact O-CD2 3.19Å; S831-H835 VanDerWaalsContact O-CD2 3.27Å; S831-H835 PolarHBondContact O-N 3.27Å; S831-H835 VanDerWaalsContact O-N 3.13Å; E833-H835 PolarHBondContact O-N 3.37Å; H835-T839 PolarHBondContact O-OG1 3.29Å
836	V	92.7	Very high	92.5	Very high	15 Å²	15	25.9 Å²	25.9	9%	0.091	13%	0.13	C	C	.	.	H	α-helix	trans	-72.9	-45	163.2	170.8	0	0	0	0	110.7	L794 R795 L798 A832 E833 Y834 T839 L840	L794-V836 HydrophobicContact CB-CG2 4.19Å; L794-V836 HydrophobicContact CD2-CG2 3.99Å; L794-V836 HydrophobicContact CG-CG2 3.85Å; R795-V836 HydrophobicContact CB-CG2 3.79Å; R795-V836 HydrophobicContact CG-CG2 4.49Å; L798-V836 HydrophobicContact CD1-CG2 4.33Å; A832-V836 WeakPolarHBondContact O-CG2 3.45Å; A832-V836 PolarHBondContact O-N 2.81Å; E833-V836 PolarHBondContact O-N 2.84Å; Y834-V836 VanDerWaalsContact C-N 3.28Å; Y834-V836 PolarHBondContact O-N 2.87Å; V836-T839 WeakPolarHBondContact O-CA 3.11Å; V836-T839 VanDerWaalsContact O-CB 3.26Å; V836-T839 WeakPolarHBondContact O-CB 3.17Å; V836-T839 PolarHBondContact O-N 3.35Å; V836-L840 HydrophobicContact CG1-CD1 4.02Å; V836-L840 PolarHBondContact O-N 2.86Å
837	N	93.2	Very high	92.6	Very high	30 Å²	30	26.6 Å²	26.6	16%	0.16	13%	0.132	C	C	.	.	H	α-helix	trans	-57.4	-51.3	176	179	63	0	0	0	111.8	S816 L826 E833 Y834 T839 L840 S841	S816-N837 VanDerWaalsContact C-ND2 3.32Å; S816-N837 PolarHBondContact O-ND2 2.98Å; L826-N837 HydrophobicContact CD1-CB 4.33Å; L826-N837 HydrophobicContact CD2-CB 4.29Å; E833-N837 PolarHBondContact O-N 2.83Å; Y834-N837 WeakPolarHBondContact O-CA 3.43Å; Y834-N837 WeakPolarHBondContact O-CB 3.43Å; Y834-N837 PolarHBondContact O-N 3.24Å; Y834-N837 VanDerWaalsContact O-N 3.08Å; N837-T839 PolarHBondContact O-N 2.8Å; N837-L840 PolarHBondContact O-N 2.94Å; N837-S841 WeakPolarHBondContact O-CB 3.31Å; N837-S841 PolarHBondContact O-N 3.28Å; N837-S841 WeakPolarHBondContact OD1-CB 3.48Å; N837-S841 PolarHBondContact OD1-OG 3.45Å
838	N	92.9	Very high	92.7	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-57.1	-10.5	171.3	173.9	-97.6	0	0	0	114.6	S681 E684 R706 H783 Y834	S681-N838 PolarHBondContact O-ND2 2.86Å; S681-N838 PolarHBondContact O-OD1 2.7Å; E684-N838 WeakPolarHBondContact CB-ND2 3.27Å; E684-N838 WeakPolarHBondContact CG-ND2 3.43Å; E684-N838 PolarHBondContact OE2-ND2 3.49Å; R706-N838 PolarHBondContact NH1-OD1 2.74Å; R706-N838 VanDerWaalsContact NH2-C 3.32Å; R706-N838 PolarHBondContact NH2-O 3.43Å; R706-N838 PolarHBondContact NH2-OD1 2.9Å; H783-N838 PolarHBondContact CE1-O 2.87Å; Y834-N838 PolarHBondContact O-N 2.81Å
839	T	89	Confident	92.9	Very high	2 Å²	2	23 Å²	23	1%	0.012	12%	0.117	C	C	.	.	H	α-helix	trans	-93.2	-26.7	173.5	-54.1	0	0	0	0	113.1	R706 M710 I787 I790 L794 H835 V836 N837	R706-T839 VanDerWaalsContact CZ-OG1 3.23Å; R706-T839 PolarHBondContact NE-OG1 3.09Å; R706-T839 VanDerWaalsContact NH2-CA 3.35Å; R706-T839 PolarHBondContact NH2-OG1 2.85Å; M710-T839 HydrophobicContact CE-CG2 3.3Å; I787-T839 WeakPolarHBondContact CD1-O 3.42Å; I790-T839 HydrophobicContact CD1-CG2 4.01Å; L794-T839 HydrophobicContact CD2-CG2 4.04Å; H835-T839 PolarHBondContact O-OG1 3.29Å; V836-T839 WeakPolarHBondContact O-CA 3.11Å; V836-T839 VanDerWaalsContact O-CB 3.26Å; V836-T839 WeakPolarHBondContact O-CB 3.17Å; V836-T839 PolarHBondContact O-N 3.35Å; N837-T839 PolarHBondContact O-N 2.8Å
840	L	90.5	Very high	92.9	Very high	33 Å²	33	21.9 Å²	21.9	17%	0.173	12%	0.116	C	C	.	.	H	α-helix	trans	-114.2	-32.7	-166.3	-60	-175.9	0	0	0	113.4	I787 Q788 I790 V836 N837	I787-L840 HydrophobicContact CD1-CD2 4.07Å; I787-L840 HydrophobicContact CG1-CD2 4.11Å; Q788-L840 HydrophobicContact CG-CD1 4.44Å; I790-L840 HydrophobicContact CG1-CD2 4.39Å; V836-L840 HydrophobicContact CG1-CD1 4.02Å; V836-L840 PolarHBondContact O-N 2.86Å; N837-L840 PolarHBondContact O-N 2.94Å
841	S	91.2	Very high	92.9	Very high	35 Å²	35	23.6 Å²	23.6	25%	0.245	12%	0.124	C	C	.	.	S	Bend	trans	-88.4	155	-175.8	-59.2	0	0	0	0	111.7	H783 N837	H783-S841 WeakPolarHBondContact CB-O 3.25Å; H783-S841 PolarHBondContact ND1-O 2.97Å; H783-S841 VanDerWaalsContact ND1-O 3.17Å; N837-S841 WeakPolarHBondContact O-CB 3.31Å; N837-S841 PolarHBondContact O-N 3.28Å; N837-S841 WeakPolarHBondContact OD1-CB 3.48Å; N837-S841 PolarHBondContact OD1-OG 3.45Å
842	P	91.3	Very high	92.8	Very high	59 Å²	59	23.6 Å²	23.6	38%	0.383	12%	0.124	S	C	.	.			trans	-57	152.3	175	-24.2	35.1	0	0	0	113.1	A741	A741-P842 WeakPolarHBondContact O-CA 3.49Å
843	V	94	Very high	92.7	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.006	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	113.3	175.2	-171.5	0	0	0	0	109.8	A741 C742 H743 H783 S815 F845	A741-V843 PolarHBondContact O-N 3.34Å; C742-V843 CarbonylContact C-O 3.59Å; C742-V843 WeakPolarHBondContact CA-O 3.5Å; C742-V843 HydrophobicContact CB-CB 3.99Å; H743-V843 PolarHBondContact N-O 3.49Å; H783-V843 VanDerWaalsContact CD2-CG2 3.47Å; H783-V843 WeakPolarHBondContact CD2-CG2 3.24Å; H783-V843 VanDerWaalsContact NE2-CG2 3.3Å; H783-V843 WeakPolarHBondContact NE2-CG2 3.27Å; S815-V843 CarbonylContact O-C 3.55Å; S815-V843 VanDerWaalsContact O-CA 3.29Å; S815-V843 WeakPolarHBondContact O-CA 3.45Å; V843-F845 HydrophobicContact CG1-CB 4.09Å; V843-F845 PolarHBondContact O-N 3.28Å
844	L	94.4	Very high	92.1	Very high	42 Å²	42	24 Å²	24	22%	0.22	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	79.7	177.6	-55	178	0	0	0	108.8	S815 P818 E847 A848	S815-L844 WeakPolarHBondContact CA-O 3.18Å; S815-L844 VanDerWaalsContact CB-O 3.24Å; S815-L844 WeakPolarHBondContact CB-O 3.1Å; S815-L844 PolarHBondContact O-N 3.14Å; P818-L844 HydrophobicContact CB-CD1 4.22Å; P818-L844 HydrophobicContact CG-CD1 4.11Å; L844-E847 WeakPolarHBondContact CA-OE2 3.24Å; L844-E847 HydrophobicContact CB-CB 4.34Å; L844-E847 HydrophobicContact CB-CG 4.3Å; L844-A848 WeakPolarHBondContact O-CB 3.21Å
845	F	94.5	Very high	91.7	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-23.1	-172.5	-176.8	-103.8	0	0	0	113.9	I593 V678 H680 H743 N744 V843 E847 L849 L867 I870 I871	I593-F845 HydrophobicContact CG2-CE2 3.83Å; I593-F845 HydrophobicContact CG2-CZ 3.67Å; V678-F845 HydrophobicContact CG1-CD2 3.76Å; V678-F845 HydrophobicContact CG1-CE2 3.65Å; H680-F845 HydrophobicContact CB-CD2 3.96Å; H680-F845 HydrophobicContact CB-CE2 4.1Å; H680-F845 AromaticContact CD2-CD1 3.79Å; H680-F845 AromaticContact CD2-CD2 3.88Å; H680-F845 AromaticContact CD2-CG 3.53Å; H743-F845 CarbonylContact O-C 3.49Å; H743-F845 WeakPolarHBondContact O-CA 3.22Å; H743-F845 WeakPolarHBondContact O-CB 3.32Å; H743-F845 PolarHBondContact O-N 3.34Å; N744-F845 HydrophobicContact CB-CD1 4.46Å; V843-F845 HydrophobicContact CG1-CB 4.09Å; V843-F845 PolarHBondContact O-N 3.28Å; F845-E847 PolarHBondContact N-OE2 3.25Å; F845-E847 VanDerWaalsContact N-OE2 3.15Å; F845-L849 HydrophobicContact CD1-CD1 3.87Å; F845-L849 HydrophobicContact CD1-CG 4.29Å; F845-L849 HydrophobicContact CE1-CD1 3.35Å; F845-L849 HydrophobicContact CE1-CD2 4.49Å; F845-L849 HydrophobicContact CE1-CG 3.89Å; F845-L849 HydrophobicContact CE2-CG 4.29Å; F845-L849 HydrophobicContact CZ-CD1 3.78Å; F845-L849 HydrophobicContact CZ-CD2 4.07Å; F845-L849 HydrophobicContact CZ-CG 3.87Å; F845-L849 WeakPolarHBondContact O-CB 3.5Å; F845-L849 VanDerWaalsContact O-CG 3.3Å; F845-L849 WeakPolarHBondContact O-CG 3.39Å; F845-L849 PolarHBondContact O-N 3.14Å; F845-L867 HydrophobicContact CE1-CD1 3.81Å; F845-L867 HydrophobicContact CE2-CD1 4.21Å; F845-L867 HydrophobicContact CZ-CD1 3.59Å; F845-I870 HydrophobicContact CD1-CG2 4.28Å; F845-I870 HydrophobicContact CE1-CG2 3.99Å; F845-I871 HydrophobicContact CE1-CG1 4.44Å; F845-I871 HydrophobicContact CZ-CG1 4.31Å
846	Y	93.9	Very high	91.6	Very high	49 Å²	49	26.2 Å²	26.2	19%	0.192	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-49.4	169.1	169.9	-123	0	0	0	109.7	H743 E746 A848 L849 L850 V874	H743-Y846 AromaticContact CE1-CD1 3.54Å; H743-Y846 AromaticContact ND1-CD1 3.91Å; H743-Y846 PolarHBondContact O-N 3.17Å; E746-Y846 HydrophobicContact CB-CE1 4.17Å; E746-Y846 HydrophobicContact CB-CE2 3.92Å; Y846-A848 PolarHBondContact O-N 2.78Å; Y846-L849 WeakPolarHBondContact O-CB 3.3Å; Y846-L849 PolarHBondContact O-N 3.08Å; Y846-L850 HydrophobicContact CE1-CD1 4.08Å; Y846-L850 HydrophobicContact CE2-CD1 4.38Å; Y846-L850 HydrophobicContact CE2-CD2 4.03Å; Y846-L850 HydrophobicContact CE2-CG 4.23Å; Y846-L850 PolarHBondContact O-N 3.41Å; Y846-V874 HydrophobicContact CD2-CG1 3.89Å; Y846-V874 HydrophobicContact CD2-CG2 3.79Å; Y846-V874 HydrophobicContact CE2-CG1 3.91Å; Y846-V874 HydrophobicContact CE2-CG2 4.15Å
847	E	93.5	Very high	91.6	Very high	60 Å²	60	25.5 Å²	25.5	28%	0.28	14%	0.135	S	C	.	.	H	α-helix	trans	-52.6	-54.8	173.7	-55.4	82.8	172	0	0	109.8	H743 L844 F845 L849 L850 H851	H743-E847 IonicContact CE1-OE1 2.67Å; H743-E847 IonicContact CG-OE1 3.12Å; H743-E847 IonicContact ND1-OE1 3.86Å; H743-E847 PolarHBondContact ND1-OE1 2.91Å; H743-E847 IonicContact ND1-OE2 3.09Å; L844-E847 WeakPolarHBondContact CA-OE2 3.24Å; L844-E847 HydrophobicContact CB-CB 4.34Å; L844-E847 HydrophobicContact CB-CG 4.3Å; F845-E847 PolarHBondContact N-OE2 3.25Å; F845-E847 VanDerWaalsContact N-OE2 3.15Å; E847-L849 PolarHBondContact O-N 3.41Å; E847-L850 PolarHBondContact O-N 3.2Å; E847-L850 VanDerWaalsContact O-N 3.13Å; E847-H851 PolarHBondContact O-CD2 3.47Å
848	A	93.2	Very high	91.7	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.008	13%	0.128	C	C	.	.	H	α-helix	trans	-65.1	-12.5	179	0	0	0	0	0	115.4	V678 I813 L844 Y846	V678-A848 HydrophobicContact CG1-CB 3.61Å; V678-A848 VanDerWaalsContact CG2-O 3.31Å; V678-A848 WeakPolarHBondContact CG2-O 3.41Å; I813-A848 HydrophobicContact CG2-CB 3.56Å; L844-A848 WeakPolarHBondContact O-CB 3.21Å; Y846-A848 PolarHBondContact O-N 2.78Å
849	L	93.7	Very high	91.9	Very high	2 Å²	2	24 Å²	24	1%	0.01	13%	0.127	C	C	.	.	H	α-helix	trans	-95.2	-18.2	175.7	-83.3	-179.1	0	0	0	114	I593 F845 Y846 E847 H851 V852 I870 I871 V874 V875	I593-L849 HydrophobicContact CD1-CD2 3.95Å; F845-L849 HydrophobicContact CD1-CD1 3.87Å; F845-L849 HydrophobicContact CD1-CG 4.29Å; F845-L849 HydrophobicContact CE1-CD1 3.35Å; F845-L849 HydrophobicContact CE1-CD2 4.49Å; F845-L849 HydrophobicContact CE1-CG 3.89Å; F845-L849 HydrophobicContact CE2-CG 4.29Å; F845-L849 HydrophobicContact CZ-CD1 3.78Å; F845-L849 HydrophobicContact CZ-CD2 4.07Å; F845-L849 HydrophobicContact CZ-CG 3.87Å; F845-L849 WeakPolarHBondContact O-CB 3.5Å; F845-L849 VanDerWaalsContact O-CG 3.3Å; F845-L849 WeakPolarHBondContact O-CG 3.39Å; F845-L849 PolarHBondContact O-N 3.14Å; Y846-L849 WeakPolarHBondContact O-CB 3.3Å; Y846-L849 PolarHBondContact O-N 3.08Å; E847-L849 PolarHBondContact O-N 3.41Å; L849-H851 PolarHBondContact O-N 2.88Å; L849-V852 HydrophobicContact CD2-CG2 4.21Å; L849-V852 WeakPolarHBondContact O-CB 3.21Å; L849-V852 VanDerWaalsContact O-CG2 3.27Å; L849-V852 WeakPolarHBondContact O-CG2 3.37Å; L849-V852 PolarHBondContact O-N 3.29Å; L849-I870 HydrophobicContact CD1-CG2 4.15Å; L849-I871 HydrophobicContact CD1-CG1 4.02Å; L849-I871 HydrophobicContact CD2-CG1 4.22Å; L849-I871 HydrophobicContact CD2-CG2 4.47Å; L849-V874 HydrophobicContact CB-CB 4.39Å; L849-V874 HydrophobicContact CB-CG1 3.79Å; L849-V874 HydrophobicContact CD1-CB 4.26Å; L849-V874 HydrophobicContact CD1-CG2 4.28Å; L849-V875 HydrophobicContact CD2-CG1 4.48Å
850	L	92.9	Very high	92.2	Very high	70 Å²	70	24 Å²	24	37%	0.366	13%	0.127	S	C	.	.	H	α-helix	trans	-66.6	-30.6	176.7	-71.8	171.2	0	0	0	110.9	Y846 E847 V852 V874 D2645	Y846-L850 HydrophobicContact CE1-CD1 4.08Å; Y846-L850 HydrophobicContact CE2-CD1 4.38Å; Y846-L850 HydrophobicContact CE2-CD2 4.03Å; Y846-L850 HydrophobicContact CE2-CG 4.23Å; Y846-L850 PolarHBondContact O-N 3.41Å; E847-L850 PolarHBondContact O-N 3.2Å; E847-L850 VanDerWaalsContact O-N 3.13Å; L850-V852 PolarHBondContact O-N 3.26Å; L850-V874 HydrophobicContact CD2-CG1 4.17Å; L850-D2645 WeakPolarHBondContact CA-OD2 3.48Å; L850-D2645 WeakPolarHBondContact CB-OD2 3.46Å
851	H	94	Very high	92.5	Very high	36 Å²	36	22.4 Å²	22.4	17%	0.167	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-5.8	-178.6	-65.5	-83.3	0	0	0	113.6	W591 I813 W822 E847 L849 P853 D2645	W591-H851 HydrophobicContact CH2-CB 3.89Å; W591-H851 WeakPolarHBondContact CH2-O 3.45Å; W591-H851 WeakPolarHBondContact CZ2-O 3.31Å; W591-H851 HydrophobicContact CZ3-CB 4.47Å; I813-H851 HydrophobicContact CD1-CB 4.33Å; I813-H851 HydrophobicContact CG1-CB 4.34Å; W822-H851 AromaticContact CH2-CD2 3.98Å; W822-H851 AromaticContact CH2-CE1 3.73Å; W822-H851 AromaticContact CH2-NE2 3.3Å; W822-H851 VanDerWaalsContact CH2-NE2 3.3Å; W822-H851 WeakPolarHBondContact CH2-NE2 3.45Å; E847-H851 PolarHBondContact O-CD2 3.47Å; L849-H851 PolarHBondContact O-N 2.88Å; H851-P853 VanDerWaalsContact O-CD 3.29Å; H851-P853 WeakPolarHBondContact O-CD 3.4Å; H851-D2645 VanDerWaalsContact CA-OD2 3.24Å; H851-D2645 WeakPolarHBondContact CA-OD2 3.43Å; H851-D2645 HydrophobicContact CB-CB 4.48Å; H851-D2645 IonicContact CD2-OD2 2.76Å; H851-D2645 PolarHBondContact CD2-OD2 3.09Å; H851-D2645 IonicContact CE1-OD1 2.84Å; H851-D2645 PolarHBondContact CE1-OD1 2.75Å; H851-D2645 IonicContact CE1-OD2 2.67Å; H851-D2645 PolarHBondContact CE1-OD2 3.29Å; H851-D2645 VanDerWaalsContact CG-CG 3.5Å; H851-D2645 IonicContact CG-OD2 3.78Å; H851-D2645 PolarHBondContact N-OD2 3.26Å; H851-D2645 WeakPolarHBondContact ND1-CB 3.42Å; H851-D2645 VanDerWaalsContact ND1-CG 3.32Å; H851-D2645 IonicContact ND1-OD1 3.19Å; H851-D2645 IonicContact ND1-OD2 3.53Å; H851-D2645 PolarHBondContact ND1-OD2 2.88Å; H851-D2645 IonicContact NE2-OD1 3.24Å; H851-D2645 IonicContact NE2-OD2 2.65Å; H851-D2645 PolarHBondContact NE2-OD2 2.76Å
852	V	92.4	Very high	92.6	Very high	7 Å²	7	20.8 Å²	20.8	4%	0.042	11%	0.107	C	C	.	.			trans	-72.7	114.8	-178.9	179.7	0	0	0	0	109.9	W591 L849 L850 A856 I858 V875	W591-V852 HydrophobicContact CD2-CG1 4.46Å; W591-V852 HydrophobicContact CD2-CG2 4.02Å; W591-V852 HydrophobicContact CE3-CG2 3.68Å; W591-V852 HydrophobicContact CG-CG1 4.36Å; W591-V852 HydrophobicContact CZ3-CG2 4.01Å; L849-V852 HydrophobicContact CD2-CG2 4.21Å; L849-V852 WeakPolarHBondContact O-CB 3.21Å; L849-V852 VanDerWaalsContact O-CG2 3.27Å; L849-V852 WeakPolarHBondContact O-CG2 3.37Å; L849-V852 PolarHBondContact O-N 3.29Å; L850-V852 PolarHBondContact O-N 3.26Å; V852-A856 HydrophobicContact CG1-CB 3.7Å; V852-I858 HydrophobicContact CG1-CD1 3.81Å; V852-I858 HydrophobicContact CG1-CG1 4.02Å; V852-V875 HydrophobicContact CB-CG1 4.19Å; V852-V875 HydrophobicContact CG1-CG1 4.25Å; V852-V875 HydrophobicContact CG2-CG1 4.34Å
853	P	88.6	Confident	92.6	Very high	19 Å²	19	18 Å²	18	12%	0.123	9%	0.089	C	C	.	.			trans	-62.5	160.3	-176.2	-23.1	34.2	0	0	0	113.6	P589 W591 H851 A856 C879	P589-P853 HydrophobicContact CG-CB 3.91Å; P589-P853 HydrophobicContact CG-CG 4.02Å; W591-P853 VanDerWaalsContact CE2-CD 3.46Å; W591-P853 HydrophobicContact CZ2-CG 4.4Å; H851-P853 VanDerWaalsContact O-CD 3.29Å; H851-P853 WeakPolarHBondContact O-CD 3.4Å; P853-A856 WeakPolarHBondContact O-CB 3.46Å; P853-A856 PolarHBondContact O-N 2.97Å; P853-C879 PolarHBondContact O-SG 3.26Å; P853-C879 VanDerWaalsContact O-SG 3.37Å
854	E	81.3	Confident	92.6	Very high	41 Å²	41	19 Å²	19	19%	0.192	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	150.5	171.9	-83	-179.1	-139.7	0	0	112.6	A856 P876 S2606 K2607 D2635	E854-A856 PolarHBondContact O-N 2.82Å; E854-A856 VanDerWaalsContact O-N 3.14Å; E854-P876 HydrophobicContact CG-CB 3.93Å; E854-P876 HydrophobicContact CG-CG 3.66Å; E854-S2606 VanDerWaalsContact CD-OG 3.26Å; E854-S2606 VanDerWaalsContact OE1-CB 3.31Å; E854-S2606 WeakPolarHBondContact OE1-CB 3.42Å; E854-S2606 PolarHBondContact OE1-OG 3.33Å; E854-K2607 WeakPolarHBondContact OE1-CD 3.45Å; E854-K2607 WeakPolarHBondContact OE1-CE 3.37Å; E854-K2607 VanDerWaalsContact OE1-CG 3.26Å; E854-K2607 WeakPolarHBondContact OE1-CG 3.4Å; E854-K2607 IonicContact OE1-NZ 2.74Å; E854-D2635 WeakPolarHBondContact CB-OD1 3.48Å; E854-D2635 PolarHBondContact N-OD1 3.1Å
855	N	85.2	Confident	92.3	Very high	47 Å²	47	17.5 Å²	17.5	25%	0.251	9%	0.087	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	1.8	-170.5	96.7	72.6	0	0	0	116.3	R588 S878	R588-N855 VanDerWaalsContact CA-OD1 3.3Å; R588-N855 WeakPolarHBondContact CA-OD1 3.46Å; R588-N855 WeakPolarHBondContact CB-OD1 3.26Å; R588-N855 WeakPolarHBondContact CG-OD1 3.22Å; R588-N855 PolarHBondContact NE-O 3.36Å; R588-N855 PolarHBondContact NE-OD1 3.49Å; R588-N855 PolarHBondContact NH2-O 3.26Å; N855-S878 PolarHBondContact N-OG 3.15Å; N855-S878 VanDerWaalsContact N-OG 3.16Å
856	A	90.9	Very high	92	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.104	C	C	.	.			trans	-53.1	149.5	-177	0	0	0	0	0	115.1	P589 V852 P853 E854 I858 C879 T880	P589-A856 HydrophobicContact CG-CB 4.12Å; P589-A856 CarbonylContact O-C 3.59Å; P589-A856 VanDerWaalsContact O-CA 3.31Å; P589-A856 WeakPolarHBondContact O-CA 3.42Å; V852-A856 HydrophobicContact CG1-CB 3.7Å; P853-A856 WeakPolarHBondContact O-CB 3.46Å; P853-A856 PolarHBondContact O-N 2.97Å; E854-A856 PolarHBondContact O-N 2.82Å; E854-A856 VanDerWaalsContact O-N 3.14Å; A856-I858 HydrophobicContact CB-CG1 4.36Å; A856-C879 PolarHBondContact N-SG 3.06Å; A856-C879 CarbonylContact O-C 3.57Å; A856-C879 VanDerWaalsContact O-CA 3.22Å; A856-C879 WeakPolarHBondContact O-CA 3.32Å; A856-C879 WeakPolarHBondContact O-CB 3.36Å; A856-T880 PolarHBondContact O-N 3.46Å
857	I	92.8	Very high	91.7	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.005	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	112.8	171.7	-64.2	175.6	0	0	0	108	R588 P589 V590 W591 L903 A906 L908	R588-I857 HydrophobicContact CB-CD1 3.89Å; R588-I857 HydrophobicContact CB-CG1 3.99Å; R588-I857 HydrophobicContact CG-CD1 4.5Å; P589-I857 PolarHBondContact O-N 3.38Å; V590-I857 CarbonylContact C-O 3.55Å; V590-I857 WeakPolarHBondContact CA-O 3.45Å; W591-I857 PolarHBondContact N-O 3.33Å; I857-L903 HydrophobicContact CG2-CD2 3.35Å; I857-A906 HydrophobicContact CD1-CB 3.88Å; I857-A906 HydrophobicContact CG1-CB 4.2Å; I857-L908 HydrophobicContact CD1-CB 4.45Å; I857-L908 HydrophobicContact CD1-CD1 4.16Å
858	I	95.8	Very high	91.5	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	122.3	-168.9	-46.2	166.5	0	0	0	109.9	W591 I593 V852 A856 I871 V875 C879 T880 Y881 Q882	W591-I858 HydrophobicContact CB-CG1 4.49Å; W591-I858 HydrophobicContact CB-CG2 4.4Å; W591-I858 CarbonylContact O-C 3.59Å; W591-I858 WeakPolarHBondContact O-CA 3.34Å; I593-I858 HydrophobicContact CD1-CG2 4.14Å; I593-I858 HydrophobicContact CG1-CG2 3.49Å; I593-I858 VanDerWaalsContact CG1-CG2 3.49Å; V852-I858 HydrophobicContact CG1-CD1 3.81Å; V852-I858 HydrophobicContact CG1-CG1 4.02Å; A856-I858 HydrophobicContact CB-CG1 4.36Å; I858-I871 HydrophobicContact CD1-CG2 4.02Å; I858-I871 HydrophobicContact CG2-CG2 4.08Å; I858-V875 HydrophobicContact CD1-CB 3.93Å; I858-V875 HydrophobicContact CD1-CG1 3.84Å; I858-V875 HydrophobicContact CD1-CG2 3.53Å; I858-C879 HydrophobicContact CD1-CB 3.96Å; I858-T880 PolarHBondContact N-O 2.81Å; I858-Y881 WeakPolarHBondContact O-CA 3.45Å; I858-Q882 PolarHBondContact O-N 3.04Å
859	I	96.6	Very high	91.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	113.2	-173.4	-54.7	-176.5	0	0	0	109.8	V590 W591 F592 I593 L667 V672 V861 Q882 L884 L903	V590-I859 HydrophobicContact CG1-CD1 4Å; W591-I859 PolarHBondContact O-N 2.9Å; F592-I859 HydrophobicContact CD1-CB 4.19Å; F592-I859 HydrophobicContact CD1-CD1 4.29Å; F592-I859 HydrophobicContact CE1-CD1 3.92Å; I593-I859 PolarHBondContact N-O 2.69Å; L667-I859 HydrophobicContact CD1-CG2 4.29Å; V672-I859 HydrophobicContact CG1-CD1 4.31Å; I859-V861 HydrophobicContact CG2-CG2 4.04Å; I859-V861 PolarHBondContact O-N 3.1Å; I859-Q882 WeakPolarHBondContact CA-O 3.49Å; I859-L884 HydrophobicContact CG2-CD1 3.77Å; I859-L884 HydrophobicContact CG2-CD2 3.96Å; I859-L884 HydrophobicContact CG2-CG 3.79Å; I859-L903 HydrophobicContact CD1-CD1 3.74Å; I859-L903 HydrophobicContact CD1-CD2 3.95Å; I859-L903 HydrophobicContact CG1-CD1 4.17Å; I859-L903 HydrophobicContact CG1-CD2 3.84Å
860	E	96.6	Very high	90.9	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	105.5	174.4	-163.1	-179.1	153.9	0	0	110.7	I593 S595 A862 C865 L866 L867 Q868 Y881 Q882 L884	I593-E860 CarbonylContact O-C 3.59Å; I593-E860 WeakPolarHBondContact O-CA 3.43Å; S595-E860 WeakPolarHBondContact OG-CG 3.46Å; S595-E860 PolarHBondContact OG-OE1 2.81Å; E860-A862 HydrophobicContact CG-CB 4.4Å; E860-A862 PolarHBondContact O-N 2.83Å; E860-C865 VanDerWaalsContact OE1-C 3.26Å; E860-C865 WeakPolarHBondContact OE1-CA 3.12Å; E860-L866 PolarHBondContact OE1-N 2.88Å; E860-L867 PolarHBondContact OE1-N 3.37Å; E860-L867 PolarHBondContact OE2-N 3.16Å; E860-Q868 PolarHBondContact OE2-N 3.13Å; E860-Y881 HydrophobicContact CB-CE2 3.89Å; E860-Y881 PolarHBondContact OE2-OH 3.11Å; E860-Q882 PolarHBondContact N-O 2.86Å; E860-Q882 VanDerWaalsContact N-O 3.09Å; E860-L884 PolarHBondContact O-N 3.44Å; E860-L884 VanDerWaalsContact O-N 3.15Å
861	V	95.7	Very high	90.9	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.114	C	C	.	.			trans	-92.7	84.1	-178.1	-170.2	0	0	0	0	108.9	F592 I593 Y594 Q660 L663 L667 I859 L884	F592-V861 HydrophobicContact CB-CG2 4.31Å; F592-V861 HydrophobicContact CD2-CG2 4.24Å; F592-V861 HydrophobicContact CG-CG2 4.23Å; I593-V861 PolarHBondContact O-N 3.46Å; Y594-V861 HydrophobicContact CD1-CB 3.94Å; Y594-V861 HydrophobicContact CD1-CG1 4.03Å; Y594-V861 HydrophobicContact CE1-CB 3.71Å; Y594-V861 HydrophobicContact CE1-CG1 3.49Å; Y594-V861 VanDerWaalsContact CE1-CG1 3.49Å; Y594-V861 HydrophobicContact CE1-CG2 4.41Å; Q660-V861 WeakPolarHBondContact CG-O 3.31Å; Q660-V861 PolarHBondContact NE2-O 3.28Å; L663-V861 HydrophobicContact CB-CG1 3.7Å; L663-V861 HydrophobicContact CD1-CG1 4.15Å; L667-V861 HydrophobicContact CD1-CG2 3.86Å; I859-V861 HydrophobicContact CG2-CG2 4.04Å; I859-V861 PolarHBondContact O-N 3.1Å; V861-L884 HydrophobicContact CG2-CD1 4.18Å
862	A	93.5	Very high	90.6	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.008	13%	0.13	C	C	.	.	S	Bend	trans	-150.1	159	-177.1	0	0	0	0	0	111.7	E860 H864	E860-A862 HydrophobicContact CG-CB 4.4Å; E860-A862 PolarHBondContact O-N 2.83Å; A862-H864 VanDerWaalsContact CB-O 3.3Å; A862-H864 WeakPolarHBondContact CB-O 3.26Å; A862-H864 PolarHBondContact O-N 3Å
863	P	91.8	Very high	90.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	-63.1	-22.4	172	-14.9	27	0	0	0	113	W601 M604 I656 I659 M885	W601-P863 PolarHBondContact NE1-O 3.48Å; M604-P863 HydrophobicContact CB-CB 4.26Å; M604-P863 HydrophobicContact SD-CB 3.77Å; M604-P863 HydrophobicContact SD-CG 4.19Å; I656-P863 HydrophobicContact CB-CG 4.42Å; I656-P863 HydrophobicContact CG1-CG 4.35Å; I656-P863 HydrophobicContact CG2-CG 4.21Å; I659-P863 HydrophobicContact CB-CG 4.18Å; I659-P863 HydrophobicContact CD1-CB 4.27Å; I659-P863 HydrophobicContact CD1-CG 4.39Å; I659-P863 HydrophobicContact CG2-CB 4.1Å; I659-P863 HydrophobicContact CG2-CG 3.91Å; P863-M885 VanDerWaalsContact O-CB 3.23Å; P863-M885 WeakPolarHBondContact O-CB 3.42Å
864	H	92.5	Very high	90.4	Very high	24 Å²	24	32.3 Å²	32.3	11%	0.111	16%	0.155	C	C	.	.	S	Bend	trans	-144.5	134.8	169.8	177.5	26.3	0	0	0	108.9	A862 L866 M885 N886 S887	A862-H864 VanDerWaalsContact CB-O 3.3Å; A862-H864 WeakPolarHBondContact CB-O 3.26Å; A862-H864 PolarHBondContact O-N 3Å; H864-L866 PolarHBondContact O-N 3.18Å; H864-M885 CarbonylContact C-O 3.49Å; H864-M885 WeakPolarHBondContact CA-O 3.49Å; H864-N886 PolarHBondContact CE1-OD1 3.3Å; H864-N886 VanDerWaalsContact CE1-OD1 3.25Å; H864-N886 PolarHBondContact ND1-OD1 2.9Å; H864-S887 PolarHBondContact CD2-OG 3.33Å; H864-S887 VanDerWaalsContact CD2-OG 3.3Å; H864-S887 PolarHBondContact CE1-OG 2.98Å; H864-S887 PolarHBondContact ND1-N 3.48Å; H864-S887 PolarHBondContact NE2-OG 3.04Å
865	C	89.9	Confident	90.6	Very high	9 Å²	9	31 Å²	31	6%	0.061	15%	0.15	C	C	.	.			trans	-62.6	63.8	169.5	60.3	0	0	0	0	113.6	E860 Y881 M885	E860-C865 VanDerWaalsContact OE1-C 3.26Å; E860-C865 WeakPolarHBondContact OE1-CA 3.12Å; C865-Y881 WeakPolarHBondContact CB-OH 3.47Å; C865-M885 PolarHBondContact N-O 2.67Å; C865-M885 PolarHBondContact SG-O 2.96Å
866	L	87.1	Confident	90.3	Very high	68 Å²	68	30.1 Å²	30.1	36%	0.356	15%	0.147	S	C	.	.			trans	-69.1	-33.8	-176	-177.6	66.8	0	0	0	112.5	E860 H864	E860-L866 PolarHBondContact OE1-N 2.88Å; H864-L866 PolarHBondContact O-N 3.18Å
867	L	88.3	Confident	89.7	Confident	8 Å²	8	36.4 Å²	36.4	4%	0.042	19%	0.191	C	C	.	.	S	Bend	trans	-96.4	2.1	-170	-58.4	178.6	0	0	0	113.4	I593 S595 H680 F845 E860 S869 I870 I871	I593-L867 HydrophobicContact CG2-CD1 4.45Å; S595-L867 WeakPolarHBondContact OG-CD1 3.17Å; H680-L867 HydrophobicContact CB-CD1 3.92Å; F845-L867 HydrophobicContact CE1-CD1 3.81Å; F845-L867 HydrophobicContact CE2-CD1 4.21Å; F845-L867 HydrophobicContact CZ-CD1 3.59Å; E860-L867 PolarHBondContact OE1-N 3.37Å; E860-L867 PolarHBondContact OE2-N 3.16Å; L867-S869 VanDerWaalsContact C-N 3.29Å; L867-S869 PolarHBondContact O-N 3.48Å; L867-S869 VanDerWaalsContact O-N 3.12Å; L867-I870 WeakPolarHBondContact O-CA 3.39Å; L867-I870 WeakPolarHBondContact O-CB 3.05Å; L867-I870 PolarHBondContact O-N 2.91Å; L867-I871 HydrophobicContact CB-CD1 3.67Å; L867-I871 HydrophobicContact CB-CG1 4.15Å; L867-I871 WeakPolarHBondContact O-CG1 3.22Å; L867-I871 PolarHBondContact O-N 3.05Å
868	Q	89	Confident	89	Confident	79 Å²	79	38.8 Å²	38.8	37%	0.369	21%	0.208	S	C	.	.	H	α-helix	trans	-44.7	-46.6	179.6	177	169.5	-5.4	0	0	114.6	E860 I870 R872 Y881	E860-Q868 PolarHBondContact OE2-N 3.13Å; Q868-I870 VanDerWaalsContact C-N 3.34Å; Q868-R872 VanDerWaalsContact O-CB 3.3Å; Q868-R872 WeakPolarHBondContact O-CB 3.17Å; Q868-R872 VanDerWaalsContact O-CG 3.32Å; Q868-R872 WeakPolarHBondContact O-CG 3.43Å; Q868-R872 PolarHBondContact O-N 3.28Å; Q868-Y881 HydrophobicContact CB-CE1 3.78Å; Q868-Y881 HydrophobicContact CB-CE2 4.42Å; Q868-Y881 WeakPolarHBondContact CB-OH 3.23Å; Q868-Y881 HydrophobicContact CG-CD1 4.03Å; Q868-Y881 HydrophobicContact CG-CE1 3.47Å; Q868-Y881 VanDerWaalsContact CG-CE1 3.47Å
869	S	85	Confident	88.6	Confident	83 Å²	83	39.6 Å²	39.6	58%	0.58	21%	0.213	S	C	*	.	H	α-helix	trans	-78.6	-17.8	-177.1	55.2	0	0	0	0	114.1	L867	L867-S869 VanDerWaalsContact C-N 3.29Å; L867-S869 PolarHBondContact O-N 3.48Å; L867-S869 VanDerWaalsContact O-N 3.12Å
870	I	90	Very high	88.2	Confident	16 Å²	16	41.6 Å²	41.6	8%	0.082	23%	0.225	C	C	.	.	H	α-helix	trans	-81.8	-56.2	173.5	-64.4	-59.6	0	0	0	108.7	N744 A745 S748 F845 L849 L867 Q868 R872 R873 V874	N744-I870 HydrophobicContact CB-CD1 4.07Å; N744-I870 HydrophobicContact CB-CG1 4.22Å; N744-I870 HydrophobicContact CB-CG2 3.97Å; N744-I870 WeakPolarHBondContact O-CG2 3.49Å; A745-I870 HydrophobicContact CB-CD1 4.43Å; A745-I870 HydrophobicContact CB-CG2 4.24Å; S748-I870 WeakPolarHBondContact OG-CD1 3.37Å; F845-I870 HydrophobicContact CD1-CG2 4.28Å; F845-I870 HydrophobicContact CE1-CG2 3.99Å; L849-I870 HydrophobicContact CD1-CG2 4.15Å; L867-I870 WeakPolarHBondContact O-CA 3.39Å; L867-I870 WeakPolarHBondContact O-CB 3.05Å; L867-I870 PolarHBondContact O-N 2.91Å; Q868-I870 VanDerWaalsContact C-N 3.34Å; I870-R872 VanDerWaalsContact C-N 3.35Å; I870-R872 PolarHBondContact O-N 3.43Å; I870-R873 WeakPolarHBondContact O-CB 3.47Å; I870-R873 PolarHBondContact O-N 3.35Å; I870-V874 PolarHBondContact O-N 2.95Å; I870-V874 VanDerWaalsContact O-N 3.15Å
871	I	91.8	Very high	88	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-57.6	-48.5	-176.2	-62.1	158.1	0	0	0	110.1	I593 F845 L849 I858 L867 R873 V874 V875 Y881	I593-I871 HydrophobicContact CB-CD1 4.38Å; I593-I871 HydrophobicContact CG1-CD1 4.34Å; I593-I871 HydrophobicContact CG2-CD1 3.95Å; F845-I871 HydrophobicContact CE1-CG1 4.44Å; F845-I871 HydrophobicContact CZ-CG1 4.31Å; L849-I871 HydrophobicContact CD1-CG1 4.02Å; L849-I871 HydrophobicContact CD2-CG1 4.22Å; L849-I871 HydrophobicContact CD2-CG2 4.47Å; I858-I871 HydrophobicContact CD1-CG2 4.02Å; I858-I871 HydrophobicContact CG2-CG2 4.08Å; L867-I871 HydrophobicContact CB-CD1 3.67Å; L867-I871 HydrophobicContact CB-CG1 4.15Å; L867-I871 WeakPolarHBondContact O-CG1 3.22Å; L867-I871 PolarHBondContact O-N 3.05Å; I871-R873 PolarHBondContact O-N 3.43Å; I871-R873 VanDerWaalsContact O-N 3.1Å; I871-V874 PolarHBondContact O-N 3.31Å; I871-V875 HydrophobicContact CG2-CG1 4.08Å; I871-V875 HydrophobicContact CG2-CG2 4.23Å; I871-V875 WeakPolarHBondContact O-CG1 3.37Å; I871-V875 WeakPolarHBondContact O-CG2 3.42Å; I871-V875 PolarHBondContact O-N 2.69Å; I871-Y881 HydrophobicContact CB-CD2 4.06Å; I871-Y881 HydrophobicContact CB-CE2 4.34Å; I871-Y881 HydrophobicContact CD1-CD2 4.12Å; I871-Y881 HydrophobicContact CD1-CE2 3.66Å; I871-Y881 HydrophobicContact CG2-CD2 3.78Å; I871-Y881 HydrophobicContact CG2-CE2 4.44Å
872	R	88.2	Confident	87.9	Confident	134 Å²	134	42.8 Å²	42.8	51%	0.506	23%	0.231	S	C	.	.	H	α-helix	trans	-67.6	-5.2	178.1	-70.5	-178.6	168.9	-126.8	-7.9	115.5	Q868 I870 Y881	Q868-R872 VanDerWaalsContact O-CB 3.3Å; Q868-R872 WeakPolarHBondContact O-CB 3.17Å; Q868-R872 VanDerWaalsContact O-CG 3.32Å; Q868-R872 WeakPolarHBondContact O-CG 3.43Å; Q868-R872 PolarHBondContact O-N 3.28Å; I870-R872 VanDerWaalsContact C-N 3.35Å; I870-R872 PolarHBondContact O-N 3.43Å; R872-Y881 HydrophobicContact CG-CD1 4.27Å; R872-Y881 HydrophobicContact CG-CG 3.98Å; R872-Y881 PolarHBondContact NH2-O 3.42Å
873	R	85.7	Confident	87.9	Confident	139 Å²	139	42.8 Å²	42.8	53%	0.525	23%	0.231	S	C	.	.	H	α-helix	trans	-98.6	-36.3	174.9	-176.1	-176.1	-66	179.4	-13.4	111.6	D747 I870 I871	D747-R873 WeakPolarHBondContact OD1-CD 3.48Å; D747-R873 IonicContact OD1-CZ 3.01Å; D747-R873 IonicContact OD1-NE 3.71Å; D747-R873 IonicContact OD1-NH1 2.65Å; D747-R873 PolarHBondContact OD1-NH1 3.09Å; D747-R873 IonicContact OD2-CZ 2.64Å; D747-R873 IonicContact OD2-NE 3.68Å; D747-R873 IonicContact OD2-NH1 2.73Å; D747-R873 PolarHBondContact OD2-NH1 3.32Å; I870-R873 WeakPolarHBondContact O-CB 3.47Å; I870-R873 PolarHBondContact O-N 3.35Å; I871-R873 PolarHBondContact O-N 3.43Å; I871-R873 VanDerWaalsContact O-N 3.1Å
874	V	89.7	Confident	88	Confident	28 Å²	28	42.8 Å²	42.8	17%	0.17	23%	0.231	C	C	.	.	H	α-helix	trans	-81.8	-44.9	-179.9	179.8	0	0	0	0	111.7	A745 Y846 L849 L850 I870 I871	A745-V874 HydrophobicContact CB-CG2 3.56Å; Y846-V874 HydrophobicContact CD2-CG1 3.89Å; Y846-V874 HydrophobicContact CD2-CG2 3.79Å; Y846-V874 HydrophobicContact CE2-CG1 3.91Å; Y846-V874 HydrophobicContact CE2-CG2 4.15Å; L849-V874 HydrophobicContact CB-CB 4.39Å; L849-V874 HydrophobicContact CB-CG1 3.79Å; L849-V874 HydrophobicContact CD1-CB 4.26Å; L849-V874 HydrophobicContact CD1-CG2 4.28Å; L850-V874 HydrophobicContact CD2-CG1 4.17Å; I870-V874 PolarHBondContact O-N 2.95Å; I870-V874 VanDerWaalsContact O-N 3.15Å; I871-V874 PolarHBondContact O-N 3.31Å
875	V	87.4	Confident	88.1	Confident	15 Å²	15	41.7 Å²	41.7	9%	0.091	23%	0.225	C	C	.	.	S	Bend	trans	-84	150.6	-171.4	-50.9	0	0	0	0	112.6	L849 V852 I858 I871 C879	L849-V875 HydrophobicContact CD2-CG1 4.48Å; V852-V875 HydrophobicContact CB-CG1 4.19Å; V852-V875 HydrophobicContact CG1-CG1 4.25Å; V852-V875 HydrophobicContact CG2-CG1 4.34Å; I858-V875 HydrophobicContact CD1-CB 3.93Å; I858-V875 HydrophobicContact CD1-CG1 3.84Å; I858-V875 HydrophobicContact CD1-CG2 3.53Å; I871-V875 HydrophobicContact CG2-CG1 4.08Å; I871-V875 HydrophobicContact CG2-CG2 4.23Å; I871-V875 WeakPolarHBondContact O-CG1 3.37Å; I871-V875 WeakPolarHBondContact O-CG2 3.42Å; I871-V875 PolarHBondContact O-N 2.69Å; V875-C879 HydrophobicContact CG2-CB 4.12Å
876	P	78.4	Confident	88.1	Confident	27 Å²	27	42.1 Å²	42.1	18%	0.175	23%	0.227	C	C	.	.			trans	-56.1	146.9	-179.9	-27.4	35.6	0	0	0	114.2	E854 S878 C879	E854-P876 HydrophobicContact CG-CB 3.93Å; E854-P876 HydrophobicContact CG-CG 3.66Å; P876-S878 PolarHBondContact O-N 3.35Å; P876-S878 VanDerWaalsContact O-N 3.11Å; P876-C879 VanDerWaalsContact O-CB 3.26Å; P876-C879 WeakPolarHBondContact O-CB 3.18Å; P876-C879 PolarHBondContact O-N 3.13Å; P876-C879 PolarHBondContact O-SG 3.3Å
877	S	77.6	Confident	88.1	Confident	132 Å²	132	41.1 Å²	41.1	92%	0.923	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-15.1	178.5	57.6	0	0	0	0	114.6	C879	S877-C879 VanDerWaalsContact C-N 3.29Å
878	S	78.8	Confident	88	Confident	52 Å²	52	50.7 Å²	50.7	36%	0.364	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-19.9	169.9	58.7	0	0	0	0	113.2	R588 N855 P876	R588-S878 PolarHBondContact NH2-O 2.87Å; N855-S878 PolarHBondContact N-OG 3.15Å; N855-S878 VanDerWaalsContact N-OG 3.16Å; P876-S878 PolarHBondContact O-N 3.35Å; P876-S878 VanDerWaalsContact O-N 3.11Å
879	C	86.6	Confident	87.8	Confident	16 Å²	16	50.8 Å²	50.8	11%	0.108	26%	0.262	C	S	.	.	S	Bend	trans	-80.3	145.2	-178.4	-55.3	0	0	0	0	111.8	P853 A856 I858 V875 P876 S877	P853-C879 PolarHBondContact O-SG 3.26Å; P853-C879 VanDerWaalsContact O-SG 3.37Å; A856-C879 PolarHBondContact N-SG 3.06Å; A856-C879 CarbonylContact O-C 3.57Å; A856-C879 VanDerWaalsContact O-CA 3.22Å; A856-C879 WeakPolarHBondContact O-CA 3.32Å; A856-C879 WeakPolarHBondContact O-CB 3.36Å; I858-C879 HydrophobicContact CD1-CB 3.96Å; V875-C879 HydrophobicContact CG2-CB 4.12Å; P876-C879 VanDerWaalsContact O-CB 3.26Å; P876-C879 WeakPolarHBondContact O-CB 3.18Å; P876-C879 PolarHBondContact O-N 3.13Å; P876-C879 PolarHBondContact O-SG 3.3Å; S877-C879 VanDerWaalsContact C-N 3.29Å
880	T	88	Confident	87.6	Confident	43 Å²	43	56.3 Å²	56.3	26%	0.264	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	98	-179.3	-57.2	0	0	0	0	110.8	R588 A856 I858 A906	R588-T880 PolarHBondContact NH1-OG1 3.4Å; R588-T880 VanDerWaalsContact NH1-OG1 3.12Å; R588-T880 PolarHBondContact NH2-OG1 3.43Å; A856-T880 PolarHBondContact O-N 3.46Å; I858-T880 PolarHBondContact N-O 2.81Å; T880-A906 HydrophobicContact CG2-CB 3.87Å
881	Y	93.1	Very high	87.4	Confident	9 Å²	9	56.8 Å²	56.8	4%	0.035	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	132.7	171.1	169.6	-81.9	0	0	0	112.4	I858 E860 C865 Q868 I871 R872	I858-Y881 WeakPolarHBondContact O-CA 3.45Å; E860-Y881 HydrophobicContact CB-CE2 3.89Å; E860-Y881 PolarHBondContact OE2-OH 3.11Å; C865-Y881 WeakPolarHBondContact CB-OH 3.47Å; Q868-Y881 HydrophobicContact CB-CE1 3.78Å; Q868-Y881 HydrophobicContact CB-CE2 4.42Å; Q868-Y881 WeakPolarHBondContact CB-OH 3.23Å; Q868-Y881 HydrophobicContact CG-CD1 4.03Å; Q868-Y881 HydrophobicContact CG-CE1 3.47Å; Q868-Y881 VanDerWaalsContact CG-CE1 3.47Å; I871-Y881 HydrophobicContact CB-CD2 4.06Å; I871-Y881 HydrophobicContact CB-CE2 4.34Å; I871-Y881 HydrophobicContact CD1-CD2 4.12Å; I871-Y881 HydrophobicContact CD1-CE2 3.66Å; I871-Y881 HydrophobicContact CG2-CD2 3.78Å; I871-Y881 HydrophobicContact CG2-CE2 4.44Å; R872-Y881 HydrophobicContact CG-CD1 4.27Å; R872-Y881 HydrophobicContact CG-CG 3.98Å; R872-Y881 PolarHBondContact NH2-O 3.42Å
882	Q	93.1	Very high	87.2	Confident	16 Å²	16	56.9 Å²	56.9	8%	0.075	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	124.3	166.5	-176.5	56.6	65.4	0	0	111.6	I858 I859 E860 S899 L903	I858-Q882 PolarHBondContact O-N 3.04Å; I859-Q882 WeakPolarHBondContact CA-O 3.49Å; E860-Q882 PolarHBondContact N-O 2.86Å; E860-Q882 VanDerWaalsContact N-O 3.09Å; Q882-S899 PolarHBondContact NE2-OG 3.37Å; Q882-L903 HydrophobicContact CB-CD2 4.22Å; Q882-L903 HydrophobicContact CB-CG 4.45Å; Q882-L903 HydrophobicContact CG-CG 4.45Å
883	G	93.1	Very high	87.3	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	156.3	170.7	0	0	0	0	0	112.1	F895 S899	G883-F895 WeakPolarHBondContact O-CE1 3.11Å; G883-S899 PolarHBondContact O-OG 2.87Å
884	L	94.6	Very high	87.4	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.24	C	C	.	.	S	Bend	trans	-96.6	-23.8	-171.9	-64.9	179.5	0	0	0	116.2	L663 L667 I859 E860 V861 F896	L663-L884 HydrophobicContact CB-CD1 4.41Å; L663-L884 HydrophobicContact CD1-CB 4.4Å; L663-L884 HydrophobicContact CD1-CD1 4.48Å; L663-L884 HydrophobicContact CD2-CB 4.41Å; L663-L884 HydrophobicContact CD2-CD1 4.44Å; L667-L884 HydrophobicContact CD1-CD1 3.95Å; L667-L884 HydrophobicContact CD2-CD1 4.31Å; L667-L884 HydrophobicContact CG-CD1 4.34Å; I859-L884 HydrophobicContact CG2-CD1 3.77Å; I859-L884 HydrophobicContact CG2-CD2 3.96Å; I859-L884 HydrophobicContact CG2-CG 3.79Å; E860-L884 PolarHBondContact O-N 3.44Å; E860-L884 VanDerWaalsContact O-N 3.15Å; V861-L884 HydrophobicContact CG2-CD1 4.18Å; L884-F896 HydrophobicContact CB-CD2 4.27Å; L884-F896 HydrophobicContact CD2-CD2 4.38Å; L884-F896 HydrophobicContact CD2-CE2 4.3Å
885	M	94.3	Very high	87.4	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.236	C	C	.	.			trans	-140.8	148.9	178.3	-68.7	175.4	60.7	0	0	110.5	W601 G605 L608 I659 L663 P863 H864 C865 N892	W601-M885 HydrophobicContact CZ2-CE 4.16Å; G605-M885 VanDerWaalsContact N-CE 3.26Å; L608-M885 HydrophobicContact CD1-CE 4.18Å; L608-M885 HydrophobicContact CD1-CG 4.02Å; L608-M885 HydrophobicContact CD1-SD 3.62Å; I659-M885 HydrophobicContact CG2-CE 4.47Å; I659-M885 HydrophobicContact CG2-SD 3.84Å; L663-M885 HydrophobicContact CD1-CG 4.46Å; L663-M885 HydrophobicContact CD1-SD 3.96Å; L663-M885 HydrophobicContact CD2-CG 4.41Å; L663-M885 HydrophobicContact CD2-SD 4.13Å; L663-M885 HydrophobicContact CG-SD 4.38Å; P863-M885 VanDerWaalsContact O-CB 3.23Å; P863-M885 WeakPolarHBondContact O-CB 3.42Å; H864-M885 CarbonylContact C-O 3.49Å; H864-M885 WeakPolarHBondContact CA-O 3.49Å; C865-M885 PolarHBondContact N-O 2.67Å; C865-M885 PolarHBondContact SG-O 2.96Å; M885-N892 WeakPolarHBondContact CA-OD1 3.17Å; M885-N892 WeakPolarHBondContact CB-OD1 3.18Å
886	N	90.1	Very high	87.6	Confident	18 Å²	18	43.6 Å²	43.6	10%	0.096	23%	0.231	C	C	.	.			trans	-143.8	122.8	-178.1	179.2	16.2	0	0	0	111	H864 R888 E889 N892 F895	H864-N886 PolarHBondContact CE1-OD1 3.3Å; H864-N886 VanDerWaalsContact CE1-OD1 3.25Å; H864-N886 PolarHBondContact ND1-OD1 2.9Å; N886-R888 PolarHBondContact O-N 2.98Å; N886-R888 VanDerWaalsContact O-N 3.09Å; N886-R888 PolarHBondContact OD1-N 3.11Å; N886-E889 HydrophobicContact CB-CG 3.66Å; N886-E889 WeakPolarHBondContact ND2-CG 3.38Å; N886-E889 PolarHBondContact ND2-OE1 3.49Å; N886-E889 PolarHBondContact O-N 3.44Å; N886-N892 PolarHBondContact N-OD1 3.41Å; N886-N892 PolarHBondContact O-ND2 2.96Å; N886-N892 PolarHBondContact O-OD1 3.01Å; N886-F895 HydrophobicContact CB-CD1 4.07Å; N886-F895 HydrophobicContact CB-CD2 4.15Å; N886-F895 HydrophobicContact CB-CE1 3.8Å; N886-F895 HydrophobicContact CB-CE2 3.87Å; N886-F895 HydrophobicContact CB-CG 4.23Å; N886-F895 HydrophobicContact CB-CZ 3.68Å
887	S	86.9	Confident	88.2	Confident	47 Å²	47	42.3 Å²	42.3	33%	0.329	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-5.6	-179.1	63.9	0	0	0	0	114.5	H864	H864-S887 PolarHBondContact CD2-OG 3.33Å; H864-S887 VanDerWaalsContact CD2-OG 3.3Å; H864-S887 PolarHBondContact CE1-OG 2.98Å; H864-S887 PolarHBondContact ND1-N 3.48Å; H864-S887 PolarHBondContact NE2-OG 3.04Å
888	R	86.3	Confident	88.8	Confident	210 Å²	210	37.4 Å²	37.4	79%	0.792	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-4.2	-179.5	-52.3	-174.7	-167.2	179.7	8.7	114.2	N886	N886-R888 PolarHBondContact O-N 2.98Å; N886-R888 VanDerWaalsContact O-N 3.09Å; N886-R888 PolarHBondContact OD1-N 3.11Å
889	E	84.5	Confident	89.4	Confident	80 Å²	80	34.9 Å²	34.9	37%	0.374	17%	0.168	S	C	.	.			trans	-94.6	140.6	-178	-53.3	-69.6	163.2	0	0	110.7	N886 S891 F895	N886-E889 HydrophobicContact CB-CG 3.66Å; N886-E889 WeakPolarHBondContact ND2-CG 3.38Å; N886-E889 PolarHBondContact ND2-OE1 3.49Å; N886-E889 PolarHBondContact O-N 3.44Å; E889-S891 PolarHBondContact O-N 3.25Å; E889-F895 HydrophobicContact CB-CB 4.38Å; E889-F895 HydrophobicContact CG-CB 3.96Å; E889-F895 HydrophobicContact CG-CD2 3.53Å; E889-F895 HydrophobicContact CG-CE2 4.22Å; E889-F895 HydrophobicContact CG-CG 3.89Å; E889-F895 WeakPolarHBondContact OE1-CD2 3.38Å
890	E	81.1	Confident	89.7	Confident	200 Å²	200	34.1 Å²	34.1	94%	0.935	16%	0.163	S	C	*	.	S	Bend	trans	-67.4	-21.8	175.3	-65.7	-171.4	135.2	0	0	113.5
891	S	85.6	Confident	89.7	Confident	26 Å²	26	32.1 Å²	32.1	18%	0.182	15%	0.15	C	C	.	.			trans	-140.8	101	-173.9	172.1	0	0	0	0	109.1	E889 V893 D894 F895	E889-S891 PolarHBondContact O-N 3.25Å; S891-V893 PolarHBondContact O-N 3.39Å; S891-D894 VanDerWaalsContact CB-OD2 3.27Å; S891-D894 WeakPolarHBondContact CB-OD2 3.27Å; S891-D894 PolarHBondContact O-N 2.91Å; S891-D894 WeakPolarHBondContact OG-CB 3.39Å; S891-D894 VanDerWaalsContact OG-CG 3.29Å; S891-D894 PolarHBondContact OG-N 3.23Å; S891-D894 VanDerWaalsContact OG-N 3.14Å; S891-D894 PolarHBondContact OG-OD2 2.76Å; S891-F895 PolarHBondContact O-N 2.78Å; S891-F895 VanDerWaalsContact O-N 3.11Å
892	N	88.7	Confident	89.4	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-74.4	-16.7	178.2	-93.8	-103.4	0	0	0	112.1	W601 D607 M885 N886 F896	W601-N892 WeakPolarHBondContact CH2-ND2 3.46Å; D607-N892 PolarHBondContact OD2-N 3.14Å; M885-N892 WeakPolarHBondContact CA-OD1 3.17Å; M885-N892 WeakPolarHBondContact CB-OD1 3.18Å; N886-N892 PolarHBondContact N-OD1 3.41Å; N886-N892 PolarHBondContact O-ND2 2.96Å; N886-N892 PolarHBondContact O-OD1 3.01Å; N892-F896 WeakPolarHBondContact O-CB 3.46Å; N892-F896 PolarHBondContact O-N 2.86Å
893	V	89.2	Confident	89.3	Confident	5 Å²	5	33.6 Å²	33.6	3%	0.03	16%	0.155	C	C	.	.	H	α-helix	trans	-65.9	-47.4	165.8	171.6	0	0	0	0	111	D607 L608 M611 F612 S891 F895 F896 L897	D607-V893 HydrophobicContact CB-CG2 3.7Å; D607-V893 WeakPolarHBondContact O-CG2 3.33Å; L608-V893 HydrophobicContact CD2-CG2 4.06Å; M611-V893 HydrophobicContact CB-CG2 3.73Å; M611-V893 HydrophobicContact CG-CG1 3.98Å; M611-V893 HydrophobicContact CG-CG2 3.93Å; M611-V893 HydrophobicContact SD-CG1 4.47Å; F612-V893 HydrophobicContact CE2-CG2 4.42Å; S891-V893 PolarHBondContact O-N 3.39Å; V893-F895 PolarHBondContact O-N 3.3Å; V893-F896 PolarHBondContact O-N 2.73Å; V893-L897 HydrophobicContact CG1-CD1 4.12Å; V893-L897 HydrophobicContact CG1-CG 4.49Å; V893-L897 WeakPolarHBondContact O-CB 3.47Å; V893-L897 WeakPolarHBondContact O-CG 3.43Å; V893-L897 PolarHBondContact O-N 2.73Å
894	D	87.8	Confident	89	Confident	16 Å²	16	33.6 Å²	33.6	9%	0.086	16%	0.155	C	C	.	.	H	α-helix	trans	-62.3	-43.7	176.4	-79.5	-56.3	0	0	0	111.7	Q499 R553 S891 L897 Q898	Q499-D894 PolarHBondContact NE2-OD1 2.97Å; R553-D894 IonicContact CZ-OD1 2.94Å; R553-D894 IonicContact CZ-OD2 2.68Å; R553-D894 IonicContact NE-OD1 2.66Å; R553-D894 PolarHBondContact NE-OD1 2.93Å; R553-D894 IonicContact NE-OD2 2.67Å; R553-D894 VanDerWaalsContact NH2-CG 3.29Å; R553-D894 IonicContact NH2-OD1 3.5Å; R553-D894 PolarHBondContact NH2-OD1 3.07Å; R553-D894 IonicContact NH2-OD2 3.65Å; R553-D894 PolarHBondContact NH2-OD2 3.04Å; S891-D894 VanDerWaalsContact CB-OD2 3.27Å; S891-D894 WeakPolarHBondContact CB-OD2 3.27Å; S891-D894 PolarHBondContact O-N 2.91Å; S891-D894 WeakPolarHBondContact OG-CB 3.39Å; S891-D894 VanDerWaalsContact OG-CG 3.29Å; S891-D894 PolarHBondContact OG-N 3.23Å; S891-D894 VanDerWaalsContact OG-N 3.14Å; S891-D894 PolarHBondContact OG-OD2 2.76Å; D894-L897 PolarHBondContact O-N 2.72Å; D894-Q898 WeakPolarHBondContact O-CB 3.3Å; D894-Q898 VanDerWaalsContact O-CG 3.27Å; D894-Q898 WeakPolarHBondContact O-CG 3.47Å; D894-Q898 PolarHBondContact O-N 2.71Å
895	F	90.4	Very high	88.5	Confident	17 Å²	17	34 Å²	34	8%	0.075	16%	0.157	C	C	.	.	H	α-helix	trans	-64	-44.2	178.8	-172.6	-93.5	0	0	0	112.1	G883 N886 E889 S891 V893 Q898 S899	G883-F895 WeakPolarHBondContact O-CE1 3.11Å; N886-F895 HydrophobicContact CB-CD1 4.07Å; N886-F895 HydrophobicContact CB-CD2 4.15Å; N886-F895 HydrophobicContact CB-CE1 3.8Å; N886-F895 HydrophobicContact CB-CE2 3.87Å; N886-F895 HydrophobicContact CB-CG 4.23Å; N886-F895 HydrophobicContact CB-CZ 3.68Å; E889-F895 HydrophobicContact CB-CB 4.38Å; E889-F895 HydrophobicContact CG-CB 3.96Å; E889-F895 HydrophobicContact CG-CD2 3.53Å; E889-F895 HydrophobicContact CG-CE2 4.22Å; E889-F895 HydrophobicContact CG-CG 3.89Å; E889-F895 WeakPolarHBondContact OE1-CD2 3.38Å; S891-F895 PolarHBondContact O-N 2.78Å; S891-F895 VanDerWaalsContact O-N 3.11Å; V893-F895 PolarHBondContact O-N 3.3Å; F895-Q898 PolarHBondContact O-N 2.74Å; F895-S899 WeakPolarHBondContact O-CB 3.33Å; F895-S899 PolarHBondContact O-N 3.24Å; F895-S899 PolarHBondContact O-OG 3.21Å
896	F	92.2	Very high	87.9	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.4	-45.8	176.3	179.1	-104.8	0	0	0	111.7	L608 F612 L663 M666 M670 L884 N892 V893 S899 L900 I915	L608-F896 HydrophobicContact CD2-CB 4.1Å; L608-F896 HydrophobicContact CD2-CD1 4.35Å; L608-F896 HydrophobicContact CD2-CG 4.25Å; F612-F896 HydrophobicContact CE2-CD1 4.02Å; F612-F896 HydrophobicContact CE2-CE1 4.3Å; F612-F896 HydrophobicContact CZ-CD1 4.14Å; F612-F896 HydrophobicContact CZ-CE1 4.28Å; L663-F896 HydrophobicContact CD2-CD2 4.27Å; L663-F896 HydrophobicContact CD2-CE2 3.99Å; M666-F896 HydrophobicContact CB-CZ 4.49Å; M666-F896 HydrophobicContact CE-CE1 3.49Å; M666-F896 VanDerWaalsContact CE-CE1 3.49Å; M666-F896 HydrophobicContact CE-CZ 3.67Å; M666-F896 HydrophobicContact SD-CE1 4.39Å; M666-F896 HydrophobicContact SD-CZ 4.13Å; M670-F896 HydrophobicContact CE-CZ 4.4Å; L884-F896 HydrophobicContact CB-CD2 4.27Å; L884-F896 HydrophobicContact CD2-CD2 4.38Å; L884-F896 HydrophobicContact CD2-CE2 4.3Å; N892-F896 WeakPolarHBondContact O-CB 3.46Å; N892-F896 PolarHBondContact O-N 2.86Å; V893-F896 PolarHBondContact O-N 2.73Å; F896-S899 WeakPolarHBondContact O-CB 3.32Å; F896-S899 PolarHBondContact O-N 2.76Å; F896-L900 HydrophobicContact CD1-CD1 4.18Å; F896-L900 HydrophobicContact CE1-CD1 3.59Å; F896-L900 HydrophobicContact CE1-CG 4.32Å; F896-L900 HydrophobicContact CZ-CD1 3.85Å; F896-L900 HydrophobicContact CZ-CD2 4.42Å; F896-L900 HydrophobicContact CZ-CG 4.29Å; F896-L900 WeakPolarHBondContact O-CG 3.43Å; F896-L900 PolarHBondContact O-N 3.3Å; F896-I915 HydrophobicContact CE1-CD1 4.33Å
897	L	90.5	Very high	87.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-69.9	-35.3	178.9	-65.6	-174.8	0	0	0	113	Q499 L501 I550 F612 V893 D894 S899 L900 G901 Y916	Q499-L897 HydrophobicContact CG-CD1 4.21Å; L501-L897 HydrophobicContact CB-CB 4.32Å; L501-L897 HydrophobicContact CB-CD1 4.34Å; L501-L897 HydrophobicContact CB-CD2 3.92Å; L501-L897 HydrophobicContact CB-CG 4.41Å; L501-L897 HydrophobicContact CD2-CD2 4.25Å; I550-L897 HydrophobicContact CD1-CB 3.81Å; I550-L897 HydrophobicContact CG1-CB 4.19Å; I550-L897 HydrophobicContact CG2-CD1 4.26Å; F612-L897 HydrophobicContact CZ-CD2 3.94Å; F612-L897 HydrophobicContact CZ-CG 4.43Å; V893-L897 HydrophobicContact CG1-CD1 4.12Å; V893-L897 HydrophobicContact CG1-CG 4.49Å; V893-L897 WeakPolarHBondContact O-CB 3.47Å; V893-L897 WeakPolarHBondContact O-CG 3.43Å; V893-L897 PolarHBondContact O-N 2.73Å; D894-L897 PolarHBondContact O-N 2.72Å; L897-S899 VanDerWaalsContact C-N 3.28Å; L897-S899 PolarHBondContact O-N 3.43Å; L897-L900 HydrophobicContact CD2-CD1 4.26Å; L897-G901 PolarHBondContact O-N 2.66Å; L897-Y916 VanDerWaalsContact CD2-OH 3.3Å; L897-Y916 WeakPolarHBondContact CD2-OH 3.36Å
898	Q	89.9	Confident	87.5	Confident	28 Å²	28	32.6 Å²	32.6	13%	0.131	15%	0.149	C	C	.	.	H	α-helix	trans	-63.1	-37.4	169.6	-75.3	180	63.3	0	0	111.6	Y548 I550 L559 D894 F895 G901 R902	Y548-Q898 HydrophobicContact CE2-CG 4.31Å; I550-Q898 HydrophobicContact CD1-CB 4.37Å; I550-Q898 HydrophobicContact CD1-CG 3.53Å; L559-Q898 HydrophobicContact CD2-CG 4.33Å; D894-Q898 WeakPolarHBondContact O-CB 3.3Å; D894-Q898 VanDerWaalsContact O-CG 3.27Å; D894-Q898 WeakPolarHBondContact O-CG 3.47Å; D894-Q898 PolarHBondContact O-N 2.71Å; F895-Q898 PolarHBondContact O-N 2.74Å; Q898-G901 PolarHBondContact O-N 2.73Å; Q898-R902 WeakPolarHBondContact O-CG 3.37Å; Q898-R902 PolarHBondContact O-N 2.93Å
899	S	91.6	Very high	87.4	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63.8	-47.5	178.8	-59.5	0	0	0	0	111.4	Q882 G883 F895 F896 L897 G901 R902 L903	Q882-S899 PolarHBondContact NE2-OG 3.37Å; G883-S899 PolarHBondContact O-OG 2.87Å; F895-S899 WeakPolarHBondContact O-CB 3.33Å; F895-S899 PolarHBondContact O-N 3.24Å; F895-S899 PolarHBondContact O-OG 3.21Å; F896-S899 WeakPolarHBondContact O-CB 3.32Å; F896-S899 PolarHBondContact O-N 2.76Å; L897-S899 VanDerWaalsContact C-N 3.28Å; L897-S899 PolarHBondContact O-N 3.43Å; S899-G901 VanDerWaalsContact C-N 3.34Å; S899-G901 PolarHBondContact O-N 2.68Å; S899-R902 PolarHBondContact O-N 3.15Å; S899-L903 VanDerWaalsContact O-CG 3.31Å; S899-L903 WeakPolarHBondContact O-CG 3.39Å; S899-L903 PolarHBondContact O-N 3.19Å
900	L	92.2	Very high	87.5	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-61.7	-40.7	172.9	-63.7	-179.7	0	0	0	112.3	L501 M670 F896 L897 R902 L903 H904 L910 I915	L501-L900 HydrophobicContact CD2-CB 3.51Å; L501-L900 HydrophobicContact CD2-CD1 4.18Å; M670-L900 HydrophobicContact CE-CD1 3.78Å; M670-L900 HydrophobicContact CE-CD2 3.58Å; M670-L900 HydrophobicContact CE-CG 4.34Å; M670-L900 HydrophobicContact SD-CD1 3.68Å; M670-L900 HydrophobicContact SD-CD2 4.32Å; F896-L900 HydrophobicContact CD1-CD1 4.18Å; F896-L900 HydrophobicContact CE1-CD1 3.59Å; F896-L900 HydrophobicContact CE1-CG 4.32Å; F896-L900 HydrophobicContact CZ-CD1 3.85Å; F896-L900 HydrophobicContact CZ-CD2 4.42Å; F896-L900 HydrophobicContact CZ-CG 4.29Å; F896-L900 WeakPolarHBondContact O-CG 3.43Å; F896-L900 PolarHBondContact O-N 3.3Å; L897-L900 HydrophobicContact CD2-CD1 4.26Å; L900-R902 PolarHBondContact O-N 3.2Å; L900-L903 HydrophobicContact CD2-CD1 4.36Å; L900-L903 PolarHBondContact O-N 3.17Å; L900-H904 PolarHBondContact O-N 3.2Å; L900-L910 HydrophobicContact CB-CD1 4.18Å; L900-L910 VanDerWaalsContact O-CD1 3.26Å; L900-L910 WeakPolarHBondContact O-CD1 3.47Å; L900-I915 HydrophobicContact CD1-CD1 4.43Å
901	G	88.6	Confident	87.6	Confident	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-58.1	-45.8	174.4	0	0	0	0	0	113.4	Y548 L897 Q898 S899 H904 Q905	Y548-G901 WeakPolarHBondContact CD1-O 3.27Å; Y548-G901 VanDerWaalsContact CE1-C 3.49Å; L897-G901 PolarHBondContact O-N 2.66Å; Q898-G901 PolarHBondContact O-N 2.73Å; S899-G901 VanDerWaalsContact C-N 3.34Å; S899-G901 PolarHBondContact O-N 2.68Å; G901-H904 WeakPolarHBondContact O-CB 3.25Å; G901-H904 PolarHBondContact O-N 2.87Å; G901-Q905 WeakPolarHBondContact O-CG 3.34Å; G901-Q905 PolarHBondContact O-N 2.92Å; G901-Q905 VanDerWaalsContact O-N 3.1Å
902	R	87.5	Confident	87.5	Confident	56 Å²	56	12.9 Å²	12.9	21%	0.211	7%	0.07	C	C	.	.	H	α-helix	trans	-68.3	-34.8	176.3	-72.1	174	-175.8	152.7	5.7	112.9	Y548 I562 Q898 S899 L900 H904 Q905 A906	Y548-R902 HydrophobicContact CE1-CG 4.1Å; I562-R902 PolarHBondContact O-NH2 3.02Å; Q898-R902 WeakPolarHBondContact O-CG 3.37Å; Q898-R902 PolarHBondContact O-N 2.93Å; S899-R902 PolarHBondContact O-N 3.15Å; L900-R902 PolarHBondContact O-N 3.2Å; R902-H904 VanDerWaalsContact C-N 3.33Å; R902-Q905 PolarHBondContact O-N 2.83Å; R902-A906 WeakPolarHBondContact O-CB 3.46Å; R902-A906 PolarHBondContact O-N 2.98Å
903	L	89.2	Confident	87	Confident	1 Å²	1	14.4 Å²	14.4	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-62.1	-41.6	171.9	-70.5	169.1	0	0	0	111.2	I857 I859 Q882 S899 L900 Q905 A906 L908 L910	I857-L903 HydrophobicContact CG2-CD2 3.35Å; I859-L903 HydrophobicContact CD1-CD1 3.74Å; I859-L903 HydrophobicContact CD1-CD2 3.95Å; I859-L903 HydrophobicContact CG1-CD1 4.17Å; I859-L903 HydrophobicContact CG1-CD2 3.84Å; Q882-L903 HydrophobicContact CB-CD2 4.22Å; Q882-L903 HydrophobicContact CB-CG 4.45Å; Q882-L903 HydrophobicContact CG-CG 4.45Å; S899-L903 VanDerWaalsContact O-CG 3.31Å; S899-L903 WeakPolarHBondContact O-CG 3.39Å; S899-L903 PolarHBondContact O-N 3.19Å; L900-L903 HydrophobicContact CD2-CD1 4.36Å; L900-L903 PolarHBondContact O-N 3.17Å; L903-Q905 PolarHBondContact O-N 3.38Å; L903-A906 WeakPolarHBondContact O-CB 3.41Å; L903-A906 PolarHBondContact O-N 3.39Å; L903-L908 HydrophobicContact CB-CB 4.4Å; L903-L908 HydrophobicContact CB-CD2 4.05Å; L903-L908 WeakPolarHBondContact O-CB 3.38Å; L903-L908 PolarHBondContact O-N 2.8Å; L903-L910 HydrophobicContact CB-CD1 4.46Å
904	H	86.8	Confident	86.6	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-59.8	-45.3	172.8	-177.1	55.4	0	0	0	112.2	L503 T504 R546 L900 G901 R902 A906 G907 L908 L910	L503-H904 HydrophobicContact CD1-CB 4.14Å; L503-H904 HydrophobicContact CD2-CB 3.91Å; T504-H904 PolarHBondContact O-NE2 2.86Å; R546-H904 WeakPolarHBondContact CD-O 3.45Å; R546-H904 PolarHBondContact NH1-CE1 3.47Å; R546-H904 PolarHBondContact NH1-ND1 3.45Å; L900-H904 PolarHBondContact O-N 3.2Å; G901-H904 WeakPolarHBondContact O-CB 3.25Å; G901-H904 PolarHBondContact O-N 2.87Å; R902-H904 VanDerWaalsContact C-N 3.33Å; H904-A906 VanDerWaalsContact C-N 3.31Å; H904-A906 PolarHBondContact O-N 2.92Å; H904-G907 PolarHBondContact O-N 2.95Å; H904-G907 VanDerWaalsContact O-N 3.08Å; H904-L908 WeakPolarHBondContact CA-O 3.48Å; H904-L908 PolarHBondContact ND1-O 2.93Å; H904-L910 HydrophobicContact CB-CD1 4.32Å
905	Q	84.6	Confident	86.3	Confident	9 Å²	9	17.1 Å²	17.1	4%	0.042	9%	0.092	C	C	.	.	H	α-helix	trans	-63.5	-33.8	176.7	-66.9	-171.6	-62.8	0	0	113.6	R546 Y548 N561 G901 R902 L903 G907	R546-Q905 HydrophobicContact CB-CG 4.42Å; R546-Q905 PolarHBondContact O-NE2 3.18Å; R546-Q905 VanDerWaalsContact O-NE2 3.11Å; Y548-Q905 HydrophobicContact CD1-CG 4.17Å; N561-Q905 PolarHBondContact ND2-OE1 3.42Å; N561-Q905 VanDerWaalsContact ND2-OE1 3.16Å; G901-Q905 WeakPolarHBondContact O-CG 3.34Å; G901-Q905 PolarHBondContact O-N 2.92Å; G901-Q905 VanDerWaalsContact O-N 3.1Å; R902-Q905 PolarHBondContact O-N 2.83Å; L903-Q905 PolarHBondContact O-N 3.38Å; Q905-G907 PolarHBondContact O-N 2.9Å; Q905-G907 VanDerWaalsContact O-N 3.14Å
906	A	83.1	Confident	85.6	Confident	1 Å²	1	17 Å²	17	1%	0.008	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-15.5	174.7	0	0	0	0	0	113.2	R588 I857 T880 R902 L903 H904	R588-A906 VanDerWaalsContact CD-O 3.22Å; R588-A906 WeakPolarHBondContact CD-O 3.19Å; R588-A906 PolarHBondContact NH1-O 3.05Å; I857-A906 HydrophobicContact CD1-CB 3.88Å; I857-A906 HydrophobicContact CG1-CB 4.2Å; T880-A906 HydrophobicContact CG2-CB 3.87Å; R902-A906 WeakPolarHBondContact O-CB 3.46Å; R902-A906 PolarHBondContact O-N 2.98Å; L903-A906 WeakPolarHBondContact O-CB 3.41Å; L903-A906 PolarHBondContact O-N 3.39Å; H904-A906 VanDerWaalsContact C-N 3.31Å; H904-A906 PolarHBondContact O-N 2.92Å
907	G	81.7	Confident	84.4	Confident	14 Å²	14	18.6 Å²	18.6	14%	0.144	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	125.3	-10.3	-179.9	0	0	0	0	0	113.5	R546 H904 Q905	R546-G907 PolarHBondContact NH1-O 2.91Å; R546-G907 VanDerWaalsContact NH1-O 3.15Å; H904-G907 PolarHBondContact O-N 2.95Å; H904-G907 VanDerWaalsContact O-N 3.08Å; Q905-G907 PolarHBondContact O-N 2.9Å; Q905-G907 VanDerWaalsContact O-N 3.14Å
908	L	86	Confident	83.3	Confident	20 Å²	20	24.7 Å²	24.7	11%	0.105	15%	0.145	C	C	.	.			trans	-70.1	149.4	-172.6	-148.8	71.3	0	0	0	112.2	R546 V590 V672 I857 L903 H904 L910	R546-L908 PolarHBondContact NH1-O 3.48Å; R546-L908 VanDerWaalsContact NH1-O 3.07Å; V590-L908 HydrophobicContact CG2-CD1 3.57Å; V672-L908 HydrophobicContact CG1-CD2 4.14Å; V672-L908 HydrophobicContact CG2-CD2 4.05Å; I857-L908 HydrophobicContact CD1-CB 4.45Å; I857-L908 HydrophobicContact CD1-CD1 4.16Å; L903-L908 HydrophobicContact CB-CB 4.4Å; L903-L908 HydrophobicContact CB-CD2 4.05Å; L903-L908 WeakPolarHBondContact O-CB 3.38Å; L903-L908 PolarHBondContact O-N 2.8Å; H904-L908 WeakPolarHBondContact CA-O 3.48Å; H904-L908 PolarHBondContact ND1-O 2.93Å; L908-L910 HydrophobicContact CD2-CD2 4.01Å; L908-L910 HydrophobicContact CD2-CG 4.49Å
909	S	83.2	Confident	82.6	Confident	52 Å²	52	24.5 Å²	24.5	36%	0.364	15%	0.145	S	C	.	.			trans	-106.5	130.7	175.9	-60.3	0	0	0	0	108.9	N537	N537-S909 WeakPolarHBondContact OD1-CA 3.34Å; N537-S909 WeakPolarHBondContact OD1-CB 3.38Å
910	L	87	Confident	81.9	Confident	1 Å²	1	27 Å²	27	1%	0.005	16%	0.161	C	C	.	.			trans	-138.2	111	-166.9	-70.4	177.3	0	0	0	111.7	L503 N537 M670 V672 L900 L903 H904 L908 V912	L503-L910 HydrophobicContact CD1-CB 3.71Å; L503-L910 HydrophobicContact CD1-CD1 4.11Å; L503-L910 HydrophobicContact CD1-CG 4.5Å; N537-L910 PolarHBondContact ND2-N 2.88Å; N537-L910 PolarHBondContact OD1-N 3.02Å; M670-L910 HydrophobicContact CB-CD2 4.46Å; V672-L910 HydrophobicContact CG2-CD2 3.27Å; L900-L910 HydrophobicContact CB-CD1 4.18Å; L900-L910 VanDerWaalsContact O-CD1 3.26Å; L900-L910 WeakPolarHBondContact O-CD1 3.47Å; L903-L910 HydrophobicContact CB-CD1 4.46Å; H904-L910 HydrophobicContact CB-CD1 4.32Å; L908-L910 HydrophobicContact CD2-CD2 4.01Å; L908-L910 HydrophobicContact CD2-CG 4.49Å; L910-V912 HydrophobicContact CB-CG1 3.91Å; L910-V912 PolarHBondContact O-N 2.85Å
911	D	83.8	Confident	81.4	Confident	48 Å²	48	31.1 Å²	31.1	26%	0.257	18%	0.183	S	C	.	.			trans	-84	65.9	175.6	-78.1	-26.8	0	0	0	110.3	K176 N537 M670 H913 N914	K176-D911 IonicContact NZ-OD1 3.1Å; K176-D911 IonicContact NZ-OD2 2.96Å; K176-D911 PolarHBondContact NZ-OD2 2.71Å; N537-D911 PolarHBondContact ND2-OD1 2.84Å; M670-D911 PolarHBondContact O-N 3.34Å; D911-H913 PolarHBondContact O-N 3.01Å; D911-H913 VanDerWaalsContact O-N 3.08Å; D911-N914 PolarHBondContact O-N 2.87Å
912	V	83.9	Confident	81.4	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-18.3	-171.2	-64	0	0	0	0	115.8	L501 L503 M670 L910 N914 I915 Y916	L501-V912 HydrophobicContact CD2-CG1 4.35Å; L503-V912 HydrophobicContact CD1-CG1 3.66Å; L503-V912 HydrophobicContact CD1-CG2 4.41Å; L503-V912 HydrophobicContact CG-CG1 4.41Å; M670-V912 HydrophobicContact SD-CG1 4.15Å; L910-V912 HydrophobicContact CB-CG1 3.91Å; L910-V912 PolarHBondContact O-N 2.85Å; V912-N914 PolarHBondContact O-N 3.02Å; V912-I915 WeakPolarHBondContact O-CG1 3.41Å; V912-I915 PolarHBondContact O-N 3.34Å; V912-Y916 WeakPolarHBondContact O-CD2 3.32Å
913	H	78.3	Confident	81.4	Confident	34 Å²	34	29.4 Å²	29.4	16%	0.157	18%	0.179	C	C	.	.	H	α-helix	trans	-64.1	-28.5	-179.5	-59.5	-71.4	0	0	0	112.2	L529 S530 S533 D911 I915 Y916 G917	L529-H913 PolarHBondContact O-CE1 2.84Å; S530-H913 WeakPolarHBondContact CA-CE1 3.38Å; S530-H913 PolarHBondContact OG-ND1 2.76Å; S533-H913 WeakPolarHBondContact CB-NE2 3.15Å; S533-H913 PolarHBondContact OG-NE2 3.01Å; D911-H913 PolarHBondContact O-N 3.01Å; D911-H913 VanDerWaalsContact O-N 3.08Å; H913-I915 PolarHBondContact O-N 3.23Å; H913-I915 VanDerWaalsContact O-N 3.13Å; H913-Y916 PolarHBondContact O-N 3.47Å; H913-G917 PolarHBondContact O-N 2.87Å
914	N	80.1	Confident	81.2	Confident	75 Å²	75	31.9 Å²	31.9	40%	0.401	20%	0.195	S	C	.	.	H	α-helix	trans	-64.9	-18.2	-177.7	-60.4	-13.3	0	0	0	113.9	M669 D911 V912	M669-N914 HydrophobicContact CG-CB 3.74Å; M669-N914 VanDerWaalsContact O-CB 3.23Å; M669-N914 WeakPolarHBondContact O-CB 3.48Å; M669-N914 PolarHBondContact O-ND2 2.85Å; M669-N914 HydrophobicContact SD-CB 4.07Å; D911-N914 PolarHBondContact O-N 2.87Å; V912-N914 PolarHBondContact O-N 3.02Å
915	I	81.2	Confident	81.2	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.015	20%	0.2	C	C	.	.	H	α-helix	trans	-95.1	-14.5	174.3	58.2	160.4	0	0	0	114.1	F612 M666 M669 M670 F896 L900 V912 H913	F612-I915 HydrophobicContact CD1-CD1 4.16Å; F612-I915 HydrophobicContact CE1-CD1 3.82Å; M666-I915 HydrophobicContact CB-CG2 4.21Å; M666-I915 HydrophobicContact CE-CB 3.98Å; M666-I915 HydrophobicContact CE-CD1 3.58Å; M666-I915 HydrophobicContact CE-CG1 4.38Å; M666-I915 HydrophobicContact CE-CG2 3.93Å; M666-I915 HydrophobicContact CG-CG2 4.24Å; M669-I915 HydrophobicContact CB-CG2 4.34Å; M669-I915 HydrophobicContact CG-CG2 4.19Å; M670-I915 HydrophobicContact CG-CG1 4.33Å; M670-I915 HydrophobicContact CG-CG2 3.84Å; M670-I915 HydrophobicContact SD-CD1 3.67Å; M670-I915 HydrophobicContact SD-CG1 4.04Å; M670-I915 HydrophobicContact SD-CG2 4.24Å; F896-I915 HydrophobicContact CE1-CD1 4.33Å; L900-I915 HydrophobicContact CD1-CD1 4.43Å; V912-I915 WeakPolarHBondContact O-CG1 3.41Å; V912-I915 PolarHBondContact O-N 3.34Å; H913-I915 PolarHBondContact O-N 3.23Å; H913-I915 VanDerWaalsContact O-N 3.13Å
916	Y	76.6	Confident	81.2	Confident	14 Å²	14	38.8 Å²	38.8	6%	0.055	23%	0.228	C	C	.	.	H	α-helix	trans	-97.9	-43.5	178.1	-66.5	-62.2	0	0	0	112.8	L501 M611 F612 L897 V912 H913	L501-Y916 PolarHBondContact N-OH 3.23Å; M611-Y916 HydrophobicContact CE-CD1 4.44Å; M611-Y916 HydrophobicContact CE-CE1 3.94Å; F612-Y916 HydrophobicContact CD1-CE1 4.49Å; F612-Y916 HydrophobicContact CE1-CD1 4.19Å; F612-Y916 AromaticContact CE1-CE1 3.65Å; F612-Y916 HydrophobicContact CE1-CE1 3.65Å; F612-Y916 HydrophobicContact CZ-CE1 4.45Å; L897-Y916 VanDerWaalsContact CD2-OH 3.3Å; L897-Y916 WeakPolarHBondContact CD2-OH 3.36Å; V912-Y916 WeakPolarHBondContact O-CD2 3.32Å; H913-Y916 PolarHBondContact O-N 3.47Å
917	G	67.2	Low	81.4	Confident	34 Å²	34	39 Å²	39	35%	0.351	23%	0.229	S	C	.	.			trans	144.1	155.6	-174.4	0	0	0	0	0	111.9	H913	H913-G917 PolarHBondContact O-N 2.87Å
918	T	66.5	Low	81.8	Confident	127 Å²	127	39.2 Å²	39.2	78%	0.779	23%	0.228	S	C	*	.	P	Polyproline II helix	trans	-88.1	116.5	179.6	50.3	0	0	0	0	111.4
919	V	76.1	Confident	82.1	Confident	24 Å²	24	38.8 Å²	38.8	15%	0.145	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-60.7	128.4	168.6	-179	0	0	0	0	109.2	E526 A527 L921	E526-V919 HydrophobicContact CG-CG2 3.93Å; A527-V919 HydrophobicContact CB-CG1 4.47Å; V919-L921 PolarHBondContact O-N 3.39Å
920	P	75.5	Confident	82.5	Confident	52 Å²	52	36.3 Å²	36.3	34%	0.338	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-75.1	119.9	-178.6	29.4	-34.6	0	0	0	110.9	R486 M491	R486-P920 PolarHBondContact NH1-O 2.82Å; R486-P920 VanDerWaalsContact NH2-CG 3.33Å; M491-P920 HydrophobicContact SD-CG 4.08Å
921	L	83	Confident	82.8	Confident	88 Å²	88	36.3 Å²	36.3	46%	0.461	21%	0.209	S	C	.	.	S	Bend	trans	-94.5	156.1	-175.5	-58	171.6	0	0	0	112.5	R317 V919 V923	R317-L921 HydrophobicContact CB-CD2 4.28Å; R317-L921 HydrophobicContact CG-CD1 3.8Å; R317-L921 HydrophobicContact CG-CD2 4.33Å; V919-L921 PolarHBondContact O-N 3.39Å; L921-V923 HydrophobicContact CD2-CG1 4.12Å
922	P	88.4	Confident	83.2	Confident	19 Å²	19	34.3 Å²	34.3	12%	0.123	20%	0.198	C	C	.	.	S	Bend	cis	-65.1	153.2	-10.4	-17.7	31	0	0	0	112.4	V313 R317 F484 R486	V313-P922 HydrophobicContact CG2-CG 4.43Å; R317-P922 WeakPolarHBondContact O-CA 3.41Å; F484-P922 HydrophobicContact CE1-CB 4.44Å; F484-P922 HydrophobicContact CE2-CG 4.5Å; F484-P922 HydrophobicContact CZ-CB 4.09Å; F484-P922 HydrophobicContact CZ-CG 4.13Å; R486-P922 PolarHBondContact NH1-O 3.44Å
923	V	87.5	Confident	83.5	Confident	1 Å²	1	35 Å²	35	1%	0.006	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-60.5	160.3	176.5	-64.4	0	0	0	0	112.7	R317 R318 A527 I531 L921 T927	R317-V923 PolarHBondContact O-N 3Å; R318-V923 HydrophobicContact CB-CG2 3.99Å; R318-V923 HydrophobicContact CG-CG2 4.13Å; A527-V923 HydrophobicContact CB-CB 4.12Å; A527-V923 HydrophobicContact CB-CG1 3.88Å; I531-V923 HydrophobicContact CD1-CB 4.23Å; I531-V923 HydrophobicContact CD1-CG1 3.64Å; I531-V923 HydrophobicContact CD1-CG2 3.6Å; I531-V923 HydrophobicContact CG1-CG1 4.17Å; L921-V923 HydrophobicContact CD2-CG1 4.12Å; V923-T927 HydrophobicContact CG2-CG2 4.44Å
924	P	85.1	Confident	84	Confident	53 Å²	53	34.4 Å²	34.4	34%	0.344	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-53.2	154.5	171.2	-25	35.2	0	0	0	113.1	E926 T927	P924-E926 WeakPolarHBondContact CB-OE2 3.35Å; P924-E926 PolarHBondContact O-N 2.69Å; P924-T927 PolarHBondContact O-N 2.71Å; P924-T927 PolarHBondContact O-OG1 3.39Å
925	L	87	Confident	84.4	Confident	20 Å²	20	32.8 Å²	32.8	11%	0.105	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-27.5	-178.2	178.4	57.5	0	0	0	111.6	Y320 M425 Q426 F484 T927	Y320-L925 HydrophobicContact CD1-CD1 4.4Å; M425-L925 HydrophobicContact CB-CD1 4.41Å; M425-L925 HydrophobicContact CB-CD2 4.36Å; M425-L925 WeakPolarHBondContact O-CD2 3.45Å; Q426-L925 WeakPolarHBondContact CG-O 3.44Å; F484-L925 WeakPolarHBondContact O-CD2 3.47Å; L925-T927 VanDerWaalsContact C-N 3.28Å; L925-T927 PolarHBondContact O-N 3.16Å
926	E	84.7	Confident	84.8	Confident	134 Å²	134	33.3 Å²	33.3	63%	0.626	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-11.6	-177.6	-55.2	73	-161.6	0	0	112.8	P924	P924-E926 WeakPolarHBondContact CB-OE2 3.35Å; P924-E926 PolarHBondContact O-N 2.69Å
927	T	87.4	Confident	85.3	Confident	5 Å²	5	36.3 Å²	36.3	3%	0.031	21%	0.209	C	C	.	.	S	Bend	trans	-66.7	126	179	-55.6	0	0	0	0	110.2	Q426 A527 F528 V923 P924 L925	Q426-T927 PolarHBondContact NE2-O 3.19Å; A527-T927 HydrophobicContact CB-CG2 4.07Å; F528-T927 HydrophobicContact CB-CG2 3.89Å; V923-T927 HydrophobicContact CG2-CG2 4.44Å; P924-T927 PolarHBondContact O-N 2.71Å; P924-T927 PolarHBondContact O-OG1 3.39Å; L925-T927 VanDerWaalsContact C-N 3.28Å; L925-T927 PolarHBondContact O-N 3.16Å
928	P	89	Confident	86.5	Confident	19 Å²	19	37.4 Å²	37.4	12%	0.123	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-60.8	155	-169.1	-25	32	0	0	0	116.2	R318 F528	R318-P928 VanDerWaalsContact CZ-O 3.24Å; R318-P928 PolarHBondContact NH1-O 2.76Å; R318-P928 PolarHBondContact NH2-O 2.7Å; F528-P928 HydrophobicContact CD2-CB 3.97Å; F528-P928 HydrophobicContact CD2-CG 3.92Å; F528-P928 HydrophobicContact CE2-CB 3.88Å; F528-P928 HydrophobicContact CE2-CG 4.13Å; F528-P928 HydrophobicContact CG-CG 4.5Å
929	M	91.8	Very high	87	Confident	11 Å²	11	34.6 Å²	34.6	5%	0.054	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-59.5	141.5	168.8	-54.2	-155.3	178.4	0	0	111.3	I86 M96 D169 Y320 I423 Q426 P932	I86-M929 HydrophobicContact CG2-CE 4.13Å; I86-M929 HydrophobicContact CG2-SD 3.89Å; M96-M929 HydrophobicContact CB-SD 3.61Å; M96-M929 HydrophobicContact CE-CE 3.82Å; M96-M929 HydrophobicContact CE-SD 3.79Å; M96-M929 HydrophobicContact CG-SD 4.1Å; D169-M929 VanDerWaalsContact OD1-CA 3.31Å; D169-M929 WeakPolarHBondContact OD1-CA 3.43Å; Y320-M929 HydrophobicContact CE1-CE 4.14Å; Y320-M929 HydrophobicContact CE1-CG 4.45Å; Y320-M929 WeakPolarHBondContact OH-CG 3.39Å; I423-M929 HydrophobicContact CG1-CE 3.89Å; Q426-M929 VanDerWaalsContact OE1-CE 3.22Å; M929-P932 HydrophobicContact CB-CG 4.05Å
930	I	92.5	Very high	87.1	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.212	C	C	.	.	S	Bend	trans	-97.8	-33.1	179.3	-47.9	-55.4	0	0	0	111.2	D169 F528 I531 L532 V535 P932 L933 I934	D169-I930 HydrophobicContact CB-CB 4.5Å; D169-I930 PolarHBondContact OD1-N 2.9Å; F528-I930 HydrophobicContact CD2-CD1 3.87Å; F528-I930 HydrophobicContact CE2-CD1 3.87Å; I531-I930 HydrophobicContact CG2-CD1 3.9Å; I531-I930 HydrophobicContact CG2-CG1 3.66Å; L532-I930 HydrophobicContact CD2-CD1 4.36Å; L532-I930 HydrophobicContact CD2-CG2 3.7Å; L532-I930 HydrophobicContact CG-CD1 4.11Å; V535-I930 HydrophobicContact CG2-CG2 4.44Å; I930-P932 VanDerWaalsContact C-N 3.28Å; I930-P932 VanDerWaalsContact O-N 3.16Å; I930-L933 WeakPolarHBondContact O-CB 3.43Å; I930-L933 PolarHBondContact O-N 2.95Å; I930-I934 HydrophobicContact CG2-CD1 4.42Å
931	S	93.4	Very high	87.5	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.007	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-52.1	-33.9	180	46.8	0	0	0	0	114.8	I86 S87 L933 I934	I86-S931 WeakPolarHBondContact O-CB 3.47Å; I86-S931 PolarHBondContact O-OG 3.45Å; S87-S931 WeakPolarHBondContact OG-CB 3.3Å; S931-L933 PolarHBondContact O-N 2.92Å; S931-I934 PolarHBondContact O-N 3.26Å
932	P	92.7	Very high	87.7	Confident	6 Å²	6	35.4 Å²	35.4	4%	0.039	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-72.2	-2.6	175.2	-18.2	34.3	0	0	0	115.9	N95 M96 Q97 R514 M929 I930	N95-P932 HydrophobicContact CB-CB 4.09Å; M96-P932 HydrophobicContact CB-CG 4.12Å; Q97-P932 HydrophobicContact CB-CB 3.57Å; Q97-P932 HydrophobicContact CB-CG 3.74Å; R514-P932 VanDerWaalsContact CZ-O 3.27Å; R514-P932 PolarHBondContact NH2-O 3.09Å; M929-P932 HydrophobicContact CB-CG 4.05Å; I930-P932 VanDerWaalsContact C-N 3.28Å; I930-P932 VanDerWaalsContact O-N 3.16Å
933	L	90.2	Very high	87.4	Confident	15 Å²	15	37.1 Å²	37.1	8%	0.079	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-104.8	-7.1	-179.4	-52.2	178.4	0	0	0	112.6	I515 E518 F528 L532 I930 S931	I515-L933 HydrophobicContact CG1-CB 4.11Å; I515-L933 WeakPolarHBondContact CG1-O 3.35Å; E518-L933 HydrophobicContact CB-CD2 4.48Å; E518-L933 HydrophobicContact CG-CD2 3.84Å; F528-L933 HydrophobicContact CE2-CD1 3.94Å; F528-L933 HydrophobicContact CZ-CD1 3.71Å; L532-L933 HydrophobicContact CD1-CD1 4.34Å; L532-L933 HydrophobicContact CD2-CD1 4.23Å; I930-L933 WeakPolarHBondContact O-CB 3.43Å; I930-L933 PolarHBondContact O-N 2.95Å; S931-L933 PolarHBondContact O-N 2.92Å
934	I	88.9	Confident	87.3	Confident	21 Å²	21	39.2 Å²	39.2	11%	0.108	23%	0.23	C	C	.	.			trans	-88.7	119.2	179.4	-50.6	-54.3	0	0	0	108.3	E165 L168 I930 S931 W936	E165-I934 HydrophobicContact CG-CB 4.16Å; E165-I934 HydrophobicContact CG-CG2 4.2Å; L168-I934 HydrophobicContact CD1-CD1 3.76Å; L168-I934 HydrophobicContact CD1-CG1 3.75Å; L168-I934 HydrophobicContact CD1-CG2 4.08Å; I930-I934 HydrophobicContact CG2-CD1 4.42Å; S931-I934 PolarHBondContact O-N 3.26Å; I934-W936 HydrophobicContact CG2-CZ2 4.24Å
935	E	87.7	Confident	87	Confident	41 Å²	41	37.2 Å²	37.2	19%	0.192	22%	0.216	C	C	.	.			trans	-122.4	138.7	176.8	-64.3	177.3	173.2	0	0	109.9	L510 S511 R514	L510-E935 WeakPolarHBondContact CG-OE2 3.29Å; S511-E935 PolarHBondContact N-OE2 3.17Å; S511-E935 PolarHBondContact OG-N 3.03Å; R514-E935 WeakPolarHBondContact CD-OE1 3.17Å; R514-E935 IonicContact CZ-OE1 2.94Å; R514-E935 IonicContact NE-OE1 2.69Å; R514-E935 IonicContact NH1-OE1 3.31Å; R514-E935 PolarHBondContact NH1-OE1 2.67Å
936	W	90.3	Very high	86.2	Confident	14 Å²	14	38.2 Å²	38.2	5%	0.053	23%	0.225	C	C	.	.			trans	-100.1	165.4	-171.7	-63.3	105.1	0	0	0	112.1	D138 F141 F142 E161 F164 E165 R507 I934 H938	D138-W936 HydrophobicContact CB-CB 4.07Å; D138-W936 HydrophobicContact CB-CE3 4.08Å; F141-W936 HydrophobicContact CB-CZ3 4.48Å; F141-W936 HydrophobicContact CD1-CE3 4.39Å; F141-W936 HydrophobicContact CD1-CH2 4.07Å; F141-W936 AromaticContact CD1-CZ3 3.43Å; F141-W936 HydrophobicContact CD1-CZ3 3.43Å; F141-W936 VanDerWaalsContact CD1-CZ3 3.43Å; F141-W936 HydrophobicContact CD2-CZ3 4.41Å; F141-W936 AromaticContact CE1-CH2 3.84Å; F141-W936 HydrophobicContact CE1-CH2 3.84Å; F141-W936 AromaticContact CE1-CZ3 3.58Å; F141-W936 HydrophobicContact CE1-CZ3 3.58Å; F141-W936 AromaticContact CG-CZ3 3.86Å; F141-W936 HydrophobicContact CG-CZ3 3.86Å; F141-W936 HydrophobicContact CZ-CH2 4.46Å; F141-W936 HydrophobicContact CZ-CZ3 4.13Å; F142-W936 HydrophobicContact CE2-CE3 4.32Å; F142-W936 HydrophobicContact CE2-CH2 4.15Å; F142-W936 HydrophobicContact CE2-CZ3 4Å; F142-W936 AromaticContact CZ-CH2 3.65Å; F142-W936 HydrophobicContact CZ-CH2 3.65Å; F142-W936 HydrophobicContact CZ-CZ2 4.17Å; F142-W936 AromaticContact CZ-CZ3 3.92Å; F142-W936 HydrophobicContact CZ-CZ3 3.92Å; E161-W936 HydrophobicContact CB-CZ2 4.06Å; E161-W936 HydrophobicContact CG-CD2 4.06Å; E161-W936 HydrophobicContact CG-CG 4.28Å; E161-W936 HydrophobicContact CG-CZ2 4.1Å; F164-W936 HydrophobicContact CB-CH2 4.04Å; F164-W936 HydrophobicContact CB-CZ2 4.26Å; F164-W936 AromaticContact CD1-CH2 3.78Å; F164-W936 HydrophobicContact CD1-CH2 3.78Å; F164-W936 HydrophobicContact CD1-CZ2 4.43Å; F164-W936 HydrophobicContact CG-CH2 4.07Å; E165-W936 HydrophobicContact CG-CZ2 4.2Å; E165-W936 PolarHBondContact OE1-NE1 3.49Å; R507-W936 HydrophobicContact CG-CE3 4.04Å; R507-W936 HydrophobicContact CG-CZ3 4.41Å; I934-W936 HydrophobicContact CG2-CZ2 4.24Å; W936-H938 VanDerWaalsContact C-N 3.3Å; W936-H938 VanDerWaalsContact CB-CD2 3.49Å; W936-H938 WeakPolarHBondContact CB-CD2 3.48Å; W936-H938 WeakPolarHBondContact CB-NE2 3.45Å; W936-H938 AromaticContact CG-NE2 3.95Å; W936-H938 PolarHBondContact O-N 3.22Å
937	D	87.4	Confident	85.3	Confident	78 Å²	78	33.1 Å²	33.1	42%	0.417	20%	0.201	S	C	.	.			trans	-76.3	86.8	165.3	-168	-10.4	0	0	0	110.3	D138 T508 G939	D138-D937 WeakPolarHBondContact OD2-CB 3.47Å; D138-D937 PolarHBondContact OD2-N 3.15Å; D138-D937 VanDerWaalsContact OD2-N 3.07Å; T508-D937 HydrophobicContact CG2-CB 4.32Å; D937-G939 VanDerWaalsContact C-N 3.32Å; D937-G939 PolarHBondContact OD1-N 3.42Å; D937-G939 VanDerWaalsContact OD1-N 3.13Å
938	H	90.5	Very high	84.1	Confident	56 Å²	56	40.4 Å²	40.4	26%	0.259	23%	0.233	S	C	.	.			trans	-94.6	23.3	176.6	-76.2	-174.2	0	0	0	112.8	K136 E161 W936 A940	K136-H938 HydrophobicContact CB-CB 4.08Å; K136-H938 WeakPolarHBondContact CB-ND1 3.14Å; K136-H938 HydrophobicContact CD-CB 4Å; K136-H938 WeakPolarHBondContact CD-O 3.41Å; K136-H938 VanDerWaalsContact CE-O 3.3Å; K136-H938 WeakPolarHBondContact CE-O 3.46Å; K136-H938 HydrophobicContact CG-CB 4.11Å; K136-H938 PolarHBondContact NZ-O 3.31Å; E161-H938 VanDerWaalsContact CD-NE2 3.29Å; E161-H938 IonicContact OE1-CD2 3.33Å; E161-H938 IonicContact OE1-CE1 2.68Å; E161-H938 IonicContact OE1-NE2 2.67Å; E161-H938 PolarHBondContact OE1-NE2 3.05Å; E161-H938 IonicContact OE2-CE1 2.73Å; E161-H938 PolarHBondContact OE2-CE1 3.26Å; E161-H938 VanDerWaalsContact OE2-CE1 3.27Å; E161-H938 IonicContact OE2-NE2 3.27Å; E161-H938 PolarHBondContact OE2-NE2 3.41Å; E161-H938 VanDerWaalsContact OE2-NE2 3.1Å; W936-H938 VanDerWaalsContact C-N 3.3Å; W936-H938 VanDerWaalsContact CB-CD2 3.49Å; W936-H938 WeakPolarHBondContact CB-CD2 3.48Å; W936-H938 WeakPolarHBondContact CB-NE2 3.45Å; W936-H938 AromaticContact CG-NE2 3.95Å; W936-H938 PolarHBondContact O-N 3.22Å; H938-A940 VanDerWaalsContact C-N 3.26Å; H938-A940 PolarHBondContact O-N 2.89Å
939	G	78	Confident	82.6	Confident	68 Å²	68	42.9 Å²	42.9	70%	0.701	25%	0.245	S	C	*	.			trans	-64.4	-25.7	177.1	0	0	0	0	0	114.5	D937	D937-G939 VanDerWaalsContact C-N 3.32Å; D937-G939 PolarHBondContact OD1-N 3.42Å; D937-G939 VanDerWaalsContact OD1-N 3.13Å
940	A	78.2	Confident	80.9	Confident	47 Å²	47	44.7 Å²	44.7	39%	0.388	25%	0.254	S	S	.	.	S	Bend	trans	-97.6	144.5	178.3	0	0	0	0	0	112.9	H938 W942	H938-A940 VanDerWaalsContact C-N 3.26Å; H938-A940 PolarHBondContact O-N 2.89Å; A940-W942 HydrophobicContact CB-CZ2 4.35Å
941	D	84.6	Confident	79.1	Confident	98 Å²	98	49.4 Å²	49.4	52%	0.524	28%	0.279	S	S	.	.			trans	-103.7	134.2	170.5	-75.4	-34	0	0	0	111.6	A135 K136	A135-D941 HydrophobicContact CB-CB 4.24Å; K136-D941 WeakPolarHBondContact CD-OD1 3.35Å; K136-D941 WeakPolarHBondContact CE-OD1 3.27Å; K136-D941 IonicContact NZ-OD1 2.83Å; K136-D941 PolarHBondContact NZ-OD1 3.23Å; K136-D941 IonicContact NZ-OD2 3.43Å
942	W	87.5	Confident	76.9	Confident	36 Å²	36	51.9 Å²	51.9	14%	0.136	30%	0.299	C	S	.	.			trans	-115.3	141.9	-179.2	-56.7	99.2	0	0	0	110.2	A135 F137 A139 P146 A149 A940	A135-W942 WeakPolarHBondContact CA-O 3.37Å; A135-W942 WeakPolarHBondContact O-CB 3.47Å; A135-W942 VanDerWaalsContact O-CD1 3.27Å; A135-W942 PolarHBondContact O-N 3.4Å; F137-W942 PolarHBondContact O-NE1 3.46Å; A139-W942 HydrophobicContact CB-CH2 3.97Å; A139-W942 HydrophobicContact CB-CZ2 3.42Å; A139-W942 VanDerWaalsContact CB-CZ2 3.42Å; P146-W942 HydrophobicContact CB-CH2 3.8Å; P146-W942 HydrophobicContact CB-CZ3 3.9Å; P146-W942 HydrophobicContact CG-CH2 4.21Å; A149-W942 HydrophobicContact CB-CD2 4Å; A149-W942 HydrophobicContact CB-CE3 3.62Å; A149-W942 HydrophobicContact CB-CH2 3.8Å; A149-W942 HydrophobicContact CB-CZ2 4.15Å; A149-W942 HydrophobicContact CB-CZ3 3.53Å; A940-W942 HydrophobicContact CB-CZ2 4.35Å
943	P	81.4	Confident	74.7	Confident	56 Å²	56	53.6 Å²	53.6	36%	0.364	32%	0.318	S	S	.	.			trans	-56.5	145.8	-175.6	-29.9	38	0	0	0	114.9	K150 R157	K150-P943 HydrophobicContact CG-CG 3.85Å; R157-P943 PolarHBondContact NH2-O 2.74Å
944	V	84.7	Confident	72.4	Confident	45 Å²	45	55.4 Å²	55.4	27%	0.273	34%	0.34	S	S	.	.			trans	-130.2	140.9	173.9	-177.3	0	0	0	0	106.7	L134 A135 P154 L269 S946	L134-V944 HydrophobicContact CB-CG1 4.09Å; L134-V944 HydrophobicContact CB-CG2 3.76Å; L134-V944 HydrophobicContact CD1-CG1 4.02Å; L134-V944 WeakPolarHBondContact O-CG2 3.5Å; A135-V944 HydrophobicContact CB-CG2 4.38Å; P154-V944 HydrophobicContact CG-CG1 4.32Å; P154-V944 HydrophobicContact CG-CG2 4.26Å; L269-V944 HydrophobicContact CD2-CG1 4.31Å; V944-S946 PolarHBondContact O-N 2.63Å
945	V	79.2	Confident	70	Confident	10 Å²	10	61 Å²	61	6%	0.061	38%	0.376	C	S	.	.			trans	-64.1	126.7	179.5	-178.4	0	0	0	0	109.8	T193 W196 M950	T193-V945 HydrophobicContact CG2-CG2 4.13Å; W196-V945 HydrophobicContact CB-CB 4.5Å; W196-V945 HydrophobicContact CB-CG1 3.89Å; W196-V945 HydrophobicContact CB-CG2 3.72Å; W196-V945 HydrophobicContact CD2-CG1 4.26Å; W196-V945 HydrophobicContact CD2-CG2 3.92Å; W196-V945 HydrophobicContact CE3-CG2 3.89Å; W196-V945 HydrophobicContact CG-CB 4.42Å; W196-V945 HydrophobicContact CG-CG1 3.73Å; W196-V945 HydrophobicContact CG-CG2 3.87Å; V945-M950 HydrophobicContact CG1-CG 4.1Å; V945-M950 HydrophobicContact CG1-SD 4.27Å
946	S	70.4	Confident	67.8	Low	42 Å²	42	63.1 Å²	63.1	29%	0.294	41%	0.408	S	S	.	.			trans	-109.1	151.8	172.6	94.6	0	0	0	0	112.6	V944 K948 D949 M950	V944-S946 PolarHBondContact O-N 2.63Å; S946-K948 PolarHBondContact O-N 3.06Å; S946-K948 PolarHBondContact OG-N 3.03Å; S946-D949 VanDerWaalsContact CB-OD2 3.29Å; S946-D949 WeakPolarHBondContact CB-OD2 3.31Å; S946-D949 PolarHBondContact O-N 2.93Å; S946-D949 PolarHBondContact OG-N 3.28Å; S946-D949 PolarHBondContact OG-OD2 2.76Å; S946-M950 PolarHBondContact O-N 3.28Å
947	M	65	Low	65.4	Low	26 Å²	26	65.3 Å²	65.3	13%	0.128	44%	0.435	C	S	.	.	H	α-helix	trans	-56.4	-33.7	173.2	173.9	-81.3	-149	0	0	112.6	W117 L121 M950 L951	W117-M947 HydrophobicContact CB-CB 4.28Å; W117-M947 HydrophobicContact CB-CG 4.29Å; L121-M947 HydrophobicContact CD1-CE 3.96Å; L121-M947 HydrophobicContact CD2-CE 3.62Å; L121-M947 HydrophobicContact CD2-CG 4.24Å; L121-M947 HydrophobicContact CG-CE 4.46Å; M947-M950 PolarHBondContact O-N 3.22Å; M947-L951 HydrophobicContact CE-CD1 3.58Å; M947-L951 HydrophobicContact CE-CG 4.48Å; M947-L951 PolarHBondContact O-N 3.47Å; M947-L951 HydrophobicContact SD-CD1 3.59Å; M947-L951 VanDerWaalsContact SD-CD1 3.59Å; M947-L951 HydrophobicContact SD-CG 4.06Å
948	K	62	Low	63.4	Low	158 Å²	158	68.4 Å²	68.4	69%	0.687	45%	0.45	S	S	*	.	H	α-helix	trans	-64.9	-41.7	178.4	-65.3	-176.2	179.2	-179.9	0	111.6	S946 M950 L951 A952	S946-K948 PolarHBondContact O-N 3.06Å; S946-K948 PolarHBondContact OG-N 3.03Å; K948-M950 VanDerWaalsContact C-N 3.31Å; K948-M950 PolarHBondContact O-N 3.01Å; K948-L951 PolarHBondContact O-N 3.47Å; K948-A952 VanDerWaalsContact O-CB 3.31Å; K948-A952 WeakPolarHBondContact O-CB 3.4Å; K948-A952 PolarHBondContact O-N 3.08Å
949	D	57.5	Low	61.6	Low	71 Å²	71	68 Å²	68	38%	0.38	46%	0.457	S	S	.	.	H	α-helix	trans	-69.2	-30.6	178.1	-54.8	-59.6	0	0	0	112.2	W196 R199 S946	W196-D949 HydrophobicContact CZ2-CB 4.05Å; R199-D949 PolarHBondContact NH2-O 2.93Å; S946-D949 VanDerWaalsContact CB-OD2 3.29Å; S946-D949 WeakPolarHBondContact CB-OD2 3.31Å; S946-D949 PolarHBondContact O-N 2.93Å; S946-D949 PolarHBondContact OG-N 3.28Å; S946-D949 PolarHBondContact OG-OD2 2.76Å
950	M	57.8	Low	60.9	Low	49 Å²	49	67 Å²	67	24%	0.241	44%	0.442	C	S	.	.	H	α-helix	trans	-70	-49.7	172.6	-62.3	-156.6	89.3	0	0	111.6	R199 T270 V945 S946 M947 K948 A952 G953	R199-M950 PolarHBondContact NH1-O 3.34Å; T270-M950 HydrophobicContact CG2-CE 4.22Å; T270-M950 HydrophobicContact CG2-SD 3.48Å; T270-M950 WeakPolarHBondContact CG2-SD 3.22Å; V945-M950 HydrophobicContact CG1-CG 4.1Å; V945-M950 HydrophobicContact CG1-SD 4.27Å; S946-M950 PolarHBondContact O-N 3.28Å; M947-M950 PolarHBondContact O-N 3.22Å; K948-M950 VanDerWaalsContact C-N 3.31Å; K948-M950 PolarHBondContact O-N 3.01Å; M950-A952 VanDerWaalsContact C-N 3.31Å; M950-A952 PolarHBondContact O-N 3.35Å; M950-G953 PolarHBondContact O-N 3.48Å
951	L	53.5	Low	60.7	Low	100 Å²	100	68 Å²	68	52%	0.524	45%	0.447	S	S	.	.	H	α-helix	trans	-62.6	-36.2	179.3	-70.8	-174	0	0	0	113	M947 K948 G953	M947-L951 HydrophobicContact CE-CD1 3.58Å; M947-L951 HydrophobicContact CE-CG 4.48Å; M947-L951 PolarHBondContact O-N 3.47Å; M947-L951 HydrophobicContact SD-CD1 3.59Å; M947-L951 VanDerWaalsContact SD-CD1 3.59Å; M947-L951 HydrophobicContact SD-CG 4.06Å; K948-L951 PolarHBondContact O-N 3.47Å; L951-G953 PolarHBondContact O-N 3.29Å
952	A	47.2	Very low	60.3	Low	53 Å²	53	64.2 Å²	64.2	44%	0.438	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-7	-177.3	0	0	0	0	0	115.8	K948 M950	K948-A952 VanDerWaalsContact O-CB 3.31Å; K948-A952 WeakPolarHBondContact O-CB 3.4Å; K948-A952 PolarHBondContact O-N 3.08Å; M950-A952 VanDerWaalsContact C-N 3.31Å; M950-A952 PolarHBondContact O-N 3.35Å
953	G	46.1	Very low	59.8	Low	41 Å²	41	64.7 Å²	64.7	42%	0.423	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124	19.1	-172.2	0	0	0	0	0	116.6	M950 L951	M950-G953 PolarHBondContact O-N 3.48Å; L951-G953 PolarHBondContact O-N 3.29Å
954	G	42.6	Very low	59.7	Low	53 Å²	53	62.9 Å²	62.9	55%	0.546	42%	0.423	S	S	.	.			trans	75.6	123.3	166.2	0	0	0	0	0	116.7	G956	G954-G956 PolarHBondContact O-N 3.32Å
955	T	38.6	Very low	59.4	Low	140 Å²	140	64.7 Å²	64.7	86%	0.859	43%	0.431	S	S	*	.			trans	-86.7	79.9	178.4	39.8	0	0	0	0	112.8	G957	T955-G957 PolarHBondContact O-N 3.33Å
956	G	40.9	Very low	59.4	Low	85 Å²	85	64.3 Å²	64.3	88%	0.876	43%	0.429	S	S	*	.	S	Bend	trans	67.2	-6.7	157.9	0	0	0	0	0	118.6	G954	G954-G956 PolarHBondContact O-N 3.32Å
957	G	39.8	Very low	59.8	Low	59 Å²	59	63 Å²	63	61%	0.608	42%	0.419	S	S	*	.	S	Bend	trans	-80.2	157.1	168	0	0	0	0	0	112	T955 A959	T955-G957 PolarHBondContact O-N 3.33Å; G957-A959 PolarHBondContact O-N 2.93Å
958	L	46.3	Very low	60.3	Low	143 Å²	143	61.8 Å²	61.8	75%	0.749	41%	0.413	S	S	*	.			trans	-57.1	110.4	173.3	-71.3	170.1	0	0	0	109.9	A960 W1062	L958-A960 PolarHBondContact O-N 3.13Å; L958-W1062 HydrophobicContact CB-CH2 4.06Å; L958-W1062 HydrophobicContact CB-CZ2 3.81Å; L958-W1062 HydrophobicContact CD1-CH2 3.9Å; L958-W1062 HydrophobicContact CD1-CZ3 4.11Å; L958-W1062 HydrophobicContact CD2-CH2 3.87Å; L958-W1062 HydrophobicContact CD2-CZ2 4.2Å; L958-W1062 HydrophobicContact CG-CH2 4.16Å; L958-W1062 HydrophobicContact CG-CZ2 4.39Å
959	A	52.4	Low	60.9	Low	47 Å²	47	57.3 Å²	57.3	39%	0.388	39%	0.393	S	S	.	.			trans	-67.5	119.5	-169.4	0	0	0	0	0	111.4	G957 S961 I1005 W1062	G957-A959 PolarHBondContact O-N 2.93Å; A959-S961 VanDerWaalsContact C-N 3.26Å; A959-I1005 WeakPolarHBondContact O-CG2 3.36Å; A959-W1062 PolarHBondContact O-NE1 3.44Å
960	A	63.2	Low	61.3	Low	48 Å²	48	56.2 Å²	56.2	40%	0.397	39%	0.387	S	S	.	.	S	Bend	trans	-89.4	6.8	167.2	0	0	0	0	0	112.1	L958 V1060	L958-A960 PolarHBondContact O-N 3.13Å; A960-V1060 PolarHBondContact O-N 3.39Å
961	S	73.9	Confident	61.4	Low	69 Å²	69	58.6 Å²	58.6	48%	0.483	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	152.1	179.6	57.8	0	0	0	0	112.9	A959 I1058	A959-S961 VanDerWaalsContact C-N 3.26Å; S961-I1058 CarbonylContact C-O 3.59Å; S961-I1058 WeakPolarHBondContact CA-O 3.38Å
962	C	76	Confident	61.5	Low	17 Å²	17	60.4 Å²	60.4	12%	0.115	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	135.3	175.6	-174.7	0	0	0	0	108.9	A1001 I1005 I1058	C962-A1001 HydrophobicContact CB-CB 3.84Å; C962-I1005 HydrophobicContact CB-CD1 4.3Å; C962-I1005 HydrophobicContact CB-CG1 4.46Å; C962-I1058 PolarHBondContact N-O 3.23Å; C962-I1058 PolarHBondContact O-N 3.35Å
963	S	77.4	Confident	62.4	Low	47 Å²	47	61.8 Å²	61.8	33%	0.329	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	135.8	167	-67.5	0	0	0	0	109.6	K1055 F1056 N1057	S963-K1055 VanDerWaalsContact CB-CE 3.45Å; S963-K1055 WeakPolarHBondContact OG-CE 3.4Å; S963-K1055 PolarHBondContact OG-NZ 2.95Å; S963-K1055 VanDerWaalsContact OG-NZ 3.16Å; S963-F1056 WeakPolarHBondContact CA-O 3.23Å; S963-N1057 PolarHBondContact OG-OD1 2.83Å
964	I	79.9	Confident	63.6	Low	18 Å²	18	69.4 Å²	69.4	9%	0.092	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	120.1	166.6	-61.5	-176.8	0	0	0	107.4	I966 N997 R1000 F1056 I1058	I964-I966 HydrophobicContact CG2-CG1 4.13Å; I964-N997 HydrophobicContact CD1-CB 3.95Å; I964-R1000 HydrophobicContact CD1-CB 4.42Å; I964-R1000 HydrophobicContact CD1-CG 4.4Å; I964-F1056 PolarHBondContact N-O 3.21Å; I964-F1056 PolarHBondContact O-N 3.33Å; I964-I1058 HydrophobicContact CB-CD1 4.43Å; I964-I1058 HydrophobicContact CD1-CD1 3.56Å; I964-I1058 HydrophobicContact CG1-CD1 3.89Å
965	N	78.1	Confident	65.6	Low	82 Å²	82	68 Å²	68	44%	0.439	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	137.2	173.5	-57.7	-18.8	0	0	0	108.1	K1055	N965-K1055 WeakPolarHBondContact OD1-CG 3.46Å
966	I	79.3	Confident	67.7	Low	2 Å²	2	65.9 Å²	65.9	1%	0.01	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	128.5	179.5	-55.3	-170.6	0	0	0	108.7	I964 P968 D975 Y978 F989 V1054 F1056	I964-I966 HydrophobicContact CG2-CG1 4.13Å; I966-P968 WeakPolarHBondContact O-CD 3.47Å; I966-D975 HydrophobicContact CG2-CB 3.73Å; I966-Y978 HydrophobicContact CD1-CE2 4.04Å; I966-Y978 HydrophobicContact CG2-CD2 3.65Å; I966-Y978 HydrophobicContact CG2-CE2 3.75Å; I966-F989 HydrophobicContact CD1-CD2 4.36Å; I966-F989 HydrophobicContact CD1-CE2 3.4Å; I966-F989 VanDerWaalsContact CD1-CE2 3.4Å; I966-F989 HydrophobicContact CD1-CZ 3.78Å; I966-V1054 PolarHBondContact N-O 3.45Å; I966-V1054 PolarHBondContact O-N 2.92Å; I966-F1056 HydrophobicContact CD1-CD2 3.95Å; I966-F1056 HydrophobicContact CD1-CE2 3.9Å; I966-F1056 HydrophobicContact CG1-CD2 4.44Å
967	D	77.9	Confident	70	Confident	15 Å²	15	63.2 Å²	63.2	8%	0.08	36%	0.357	C	S	.	.			trans	-120.1	81.4	178.6	-169.1	-5.4	0	0	0	110.3	F969 N970 M973 D975 L1053	D967-F969 VanDerWaalsContact C-N 3.26Å; D967-F969 PolarHBondContact O-N 3.02Å; D967-N970 HydrophobicContact CB-CB 4.41Å; D967-N970 WeakPolarHBondContact OD1-CB 3.45Å; D967-N970 PolarHBondContact OD1-N 3.35Å; D967-N970 WeakPolarHBondContact OD2-CB 3.16Å; D967-N970 PolarHBondContact OD2-ND2 3.46Å; D967-M973 HydrophobicContact CB-CE 4.23Å; D967-M973 HydrophobicContact CB-CG 4.24Å; D967-D975 PolarHBondContact N-OD2 3.05Å; D967-L1053 HydrophobicContact CB-CD2 3.65Å
968	P	75.6	Confident	72.5	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-12	-175.6	35.4	-36.8	0	0	0	112.5	I966 L979 L1028	I966-P968 WeakPolarHBondContact O-CD 3.47Å; P968-L979 HydrophobicContact CB-CD2 3.83Å; P968-L979 HydrophobicContact CB-CG 4.08Å; P968-L979 HydrophobicContact CG-CD2 4.22Å; P968-L979 VanDerWaalsContact O-CD1 3.25Å; P968-L979 WeakPolarHBondContact O-CD1 3.12Å; P968-L979 WeakPolarHBondContact O-CG 3.38Å; P968-L1028 HydrophobicContact CG-CD1 4.31Å
969	F	75.4	Confident	74.4	Confident	64 Å²	64	56.2 Å²	56.2	28%	0.281	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-12.5	-175.3	-58.7	-65.9	0	0	0	113.4	D967 P971 L979 S1029 H1030	D967-F969 VanDerWaalsContact C-N 3.26Å; D967-F969 PolarHBondContact O-N 3.02Å; F969-P971 WeakPolarHBondContact O-CD 3.48Å; F969-L979 HydrophobicContact CD1-CD1 4.31Å; F969-L979 HydrophobicContact CD1-CD2 3.98Å; F969-L979 HydrophobicContact CE1-CD2 3.6Å; F969-L979 HydrophobicContact CZ-CD2 4.22Å; F969-S1029 WeakPolarHBondContact CE2-O 3.45Å; F969-S1029 WeakPolarHBondContact CZ-O 3.35Å; F969-H1030 AromaticContact CD1-CD2 3.73Å; F969-H1030 AromaticContact CE1-CD2 3.89Å
970	N	66.2	Low	76.2	Confident	48 Å²	48	56.6 Å²	56.6	26%	0.257	30%	0.3	S	S	.	.			trans	-92.8	112.8	178.4	-178.8	-11.8	0	0	0	111.2	D967 E972 M973	D967-N970 HydrophobicContact CB-CB 4.41Å; D967-N970 WeakPolarHBondContact OD1-CB 3.45Å; D967-N970 PolarHBondContact OD1-N 3.35Å; D967-N970 WeakPolarHBondContact OD2-CB 3.16Å; D967-N970 PolarHBondContact OD2-ND2 3.46Å; N970-E972 PolarHBondContact O-N 3.31Å; N970-E972 VanDerWaalsContact O-N 3.16Å; N970-E972 PolarHBondContact OD1-N 2.99Å; N970-E972 VanDerWaalsContact OD1-N 3.11Å; N970-M973 HydrophobicContact CB-CB 4.25Å; N970-M973 HydrophobicContact CB-CG 3.81Å; N970-M973 WeakPolarHBondContact ND2-CG 3.31Å; N970-M973 WeakPolarHBondContact O-CB 3.47Å; N970-M973 PolarHBondContact O-N 2.64Å
971	P	58.8	Low	77.7	Confident	100 Å²	100	54.7 Å²	54.7	65%	0.649	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-5.1	-175.7	30.1	-36.1	0	0	0	114.7	F969	F969-P971 WeakPolarHBondContact O-CD 3.48Å
972	E	56.3	Low	78.4	Confident	138 Å²	138	53 Å²	53	65%	0.645	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-11.9	166.1	-67.3	-154.1	155.3	0	0	113	K147 N970	K147-E972 VanDerWaalsContact CE-OE2 3.24Å; K147-E972 WeakPolarHBondContact CE-OE2 3.4Å; K147-E972 IonicContact NZ-OE1 2.85Å; K147-E972 PolarHBondContact NZ-OE1 3.29Å; K147-E972 IonicContact NZ-OE2 3.19Å; K147-E972 PolarHBondContact NZ-OE2 3.02Å; N970-E972 PolarHBondContact O-N 3.31Å; N970-E972 VanDerWaalsContact O-N 3.16Å; N970-E972 PolarHBondContact OD1-N 2.99Å; N970-E972 VanDerWaalsContact OD1-N 3.11Å
973	M	66	Low	79	Confident	82 Å²	82	52.5 Å²	52.5	40%	0.404	27%	0.265	S	S	.	.	S	Bend	trans	-96	144	-172.8	-66.1	-71.8	-78.8	0	0	112.3	D967 N970 D975	D967-M973 HydrophobicContact CB-CE 4.23Å; D967-M973 HydrophobicContact CB-CG 4.24Å; N970-M973 HydrophobicContact CB-CB 4.25Å; N970-M973 HydrophobicContact CB-CG 3.81Å; N970-M973 WeakPolarHBondContact ND2-CG 3.31Å; N970-M973 WeakPolarHBondContact O-CB 3.47Å; N970-M973 PolarHBondContact O-N 2.64Å; M973-D975 PolarHBondContact O-N 3.46Å
974	K	72.3	Confident	79.2	Confident	200 Å²	200	50.7 Å²	50.7	87%	0.87	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-6.4	-179.7	-66.8	-172.7	178.1	-177	0	114.5	F977	K974-F977 VanDerWaalsContact O-CD1 3.31Å; K974-F977 WeakPolarHBondContact O-CD1 3.31Å
975	D	82.6	Confident	78.8	Confident	24 Å²	24	51.9 Å²	51.9	13%	0.128	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-7.4	-175	-67.2	-37.9	0	0	0	113.7	I966 D967 M973 F977 Y978	I966-D975 HydrophobicContact CG2-CB 3.73Å; D967-D975 PolarHBondContact N-OD2 3.05Å; M973-D975 PolarHBondContact O-N 3.46Å; D975-F977 PolarHBondContact O-N 3.45Å; D975-Y978 HydrophobicContact CB-CD2 3.97Å; D975-Y978 HydrophobicContact CB-CE2 4.22Å; D975-Y978 WeakPolarHBondContact O-CB 3.15Å; D975-Y978 WeakPolarHBondContact O-CD2 2.97Å; D975-Y978 PolarHBondContact O-N 3.48Å
976	Q	83.3	Confident	78.8	Confident	96 Å²	96	52.4 Å²	52.4	45%	0.449	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-54.8	-29.9	-176.2	-165.8	-176.1	17.9	0	0	113.7	Y978 L979	Q976-Y978 PolarHBondContact O-N 2.87Å; Q976-Y978 VanDerWaalsContact O-N 3.11Å; Q976-L979 HydrophobicContact CG-CD1 4.41Å; Q976-L979 WeakPolarHBondContact O-CB 3.44Å; Q976-L979 PolarHBondContact O-N 3.28Å
977	F	89.9	Confident	79.2	Confident	29 Å²	29	53.8 Å²	53.8	13%	0.127	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-58.8	-23.7	177.8	81.6	-80.5	0	0	0	113.5	K974 D975 L979 E980 F1130 N1150 V1152 T1153	K974-F977 VanDerWaalsContact O-CD1 3.31Å; K974-F977 WeakPolarHBondContact O-CD1 3.31Å; D975-F977 PolarHBondContact O-N 3.45Å; F977-L979 PolarHBondContact O-N 3.13Å; F977-E980 WeakPolarHBondContact O-CB 3.02Å; F977-E980 PolarHBondContact O-N 2.82Å; F977-F1130 AromaticContact CD2-CE2 3.67Å; F977-F1130 HydrophobicContact CD2-CE2 3.67Å; F977-F1130 AromaticContact CD2-CZ 3.94Å; F977-F1130 HydrophobicContact CD2-CZ 3.94Å; F977-F1130 HydrophobicContact CE2-CE2 4.07Å; F977-F1130 AromaticContact CE2-CZ 3.85Å; F977-F1130 HydrophobicContact CE2-CZ 3.85Å; F977-F1130 WeakPolarHBondContact O-CE2 3.14Å; F977-N1150 WeakPolarHBondContact CD2-ND2 3.38Å; F977-N1150 WeakPolarHBondContact CE2-ND2 3.38Å; F977-N1150 WeakPolarHBondContact CZ-ND2 3.46Å; F977-V1152 HydrophobicContact CE2-CB 4.01Å; F977-V1152 HydrophobicContact CE2-CG1 4.01Å; F977-V1152 HydrophobicContact CZ-CB 4.16Å; F977-V1152 HydrophobicContact CZ-CG1 4.37Å; F977-V1152 HydrophobicContact CZ-CG2 4.29Å; F977-T1153 HydrophobicContact CD2-CG2 3.82Å; F977-T1153 HydrophobicContact CE2-CG2 4.02Å
978	Y	91.3	Very high	79.8	Confident	6 Å²	6	53.8 Å²	53.8	2%	0.024	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-62.3	-26.5	175.7	-71.5	-63.5	0	0	0	112.8	I966 D975 Q976 E980 H981 V987 F989 P990 V1152	I966-Y978 HydrophobicContact CD1-CE2 4.04Å; I966-Y978 HydrophobicContact CG2-CD2 3.65Å; I966-Y978 HydrophobicContact CG2-CE2 3.75Å; D975-Y978 HydrophobicContact CB-CD2 3.97Å; D975-Y978 HydrophobicContact CB-CE2 4.22Å; D975-Y978 WeakPolarHBondContact O-CB 3.15Å; D975-Y978 WeakPolarHBondContact O-CD2 2.97Å; D975-Y978 PolarHBondContact O-N 3.48Å; Q976-Y978 PolarHBondContact O-N 2.87Å; Q976-Y978 VanDerWaalsContact O-N 3.11Å; Y978-E980 PolarHBondContact O-N 3.17Å; Y978-H981 PolarHBondContact O-N 3.03Å; Y978-H981 VanDerWaalsContact O-N 3.15Å; Y978-V987 WeakPolarHBondContact O-CG1 3.37Å; Y978-F989 HydrophobicContact CD1-CD2 4.03Å; Y978-F989 AromaticContact CD1-CE2 3.86Å; Y978-F989 HydrophobicContact CD1-CE2 3.86Å; Y978-F989 HydrophobicContact CE1-CD2 4.01Å; Y978-F989 AromaticContact CE1-CE2 3.39Å; Y978-F989 HydrophobicContact CE1-CE2 3.39Å; Y978-F989 HydrophobicContact CE1-CZ 4.09Å; Y978-F989 HydrophobicContact CE2-CE2 4.16Å; Y978-F989 HydrophobicContact CG-CE2 4.4Å; Y978-F989 AromaticContact CZ-CE2 3.57Å; Y978-P990 HydrophobicContact CD1-CG 3.84Å; Y978-P990 HydrophobicContact CE1-CG 4.02Å; Y978-V1152 HydrophobicContact CE1-CG1 4.04Å
979	L	87.5	Confident	80.6	Confident	49 Å²	49	54 Å²	54	26%	0.257	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-62.2	-22.9	173.9	-61.7	-173.8	0	0	0	112.8	P968 F969 Q976 F977 H981 V982 V987	P968-L979 HydrophobicContact CB-CD2 3.83Å; P968-L979 HydrophobicContact CB-CG 4.08Å; P968-L979 HydrophobicContact CG-CD2 4.22Å; P968-L979 VanDerWaalsContact O-CD1 3.25Å; P968-L979 WeakPolarHBondContact O-CD1 3.12Å; P968-L979 WeakPolarHBondContact O-CG 3.38Å; F969-L979 HydrophobicContact CD1-CD1 4.31Å; F969-L979 HydrophobicContact CD1-CD2 3.98Å; F969-L979 HydrophobicContact CE1-CD2 3.6Å; F969-L979 HydrophobicContact CZ-CD2 4.22Å; Q976-L979 HydrophobicContact CG-CD1 4.41Å; Q976-L979 WeakPolarHBondContact O-CB 3.44Å; Q976-L979 PolarHBondContact O-N 3.28Å; F977-L979 PolarHBondContact O-N 3.13Å; L979-H981 VanDerWaalsContact C-N 3.33Å; L979-V982 WeakPolarHBondContact O-CG2 3.29Å; L979-V987 HydrophobicContact CD2-CG1 4.41Å
980	E	89.4	Confident	81.4	Confident	55 Å²	55	51 Å²	51	26%	0.257	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-85.2	-1.3	179.1	-64.4	-164.3	116.8	0	0	113.6	F977 Y978 V982 G1127 K1128 S1129 F1130	F977-E980 WeakPolarHBondContact O-CB 3.02Å; F977-E980 PolarHBondContact O-N 2.82Å; Y978-E980 PolarHBondContact O-N 3.17Å; E980-V982 PolarHBondContact O-N 3.32Å; E980-V982 VanDerWaalsContact O-N 3.12Å; E980-G1127 PolarHBondContact O-N 3.3Å; E980-K1128 VanDerWaalsContact CD-N 3.29Å; E980-K1128 PolarHBondContact OE1-N 2.84Å; E980-K1128 PolarHBondContact OE2-N 3.17Å; E980-S1129 WeakPolarHBondContact OE2-CA 3.31Å; E980-S1129 WeakPolarHBondContact OE2-CB 3.48Å; E980-S1129 PolarHBondContact OE2-N 3.01Å; E980-S1129 PolarHBondContact OE2-OG 3.07Å; E980-F1130 HydrophobicContact CB-CD2 4.29Å
981	H	94	Very high	82.7	Confident	8 Å²	8	49.3 Å²	49.3	4%	0.037	25%	0.25	C	S	.	.			trans	-87.4	62	172.7	-168.1	-95.7	0	0	0	111.2	Y978 L979 L988 P990 Y1126 F1130 D1156	Y978-H981 PolarHBondContact O-N 3.03Å; Y978-H981 VanDerWaalsContact O-N 3.15Å; L979-H981 VanDerWaalsContact C-N 3.33Å; H981-L988 PolarHBondContact ND1-O 2.86Å; H981-L988 PolarHBondContact O-N 2.74Å; H981-P990 HydrophobicContact CB-CG 4.03Å; H981-Y1126 AromaticContact CD2-CE1 3.6Å; H981-Y1126 AromaticContact NE2-CE1 3.74Å; H981-F1130 HydrophobicContact CB-CD2 4.03Å; H981-F1130 HydrophobicContact CB-CE1 4.45Å; H981-F1130 HydrophobicContact CB-CE2 3.7Å; H981-F1130 HydrophobicContact CB-CZ 3.95Å; H981-F1130 AromaticContact CD2-CD1 3.72Å; H981-F1130 AromaticContact CD2-CE1 3.6Å; H981-F1130 AromaticContact CD2-CZ 3.96Å; H981-D1156 IonicContact NE2-OD1 3.81Å; H981-D1156 IonicContact NE2-OD2 3.53Å
982	V	90.2	Very high	84.3	Confident	34 Å²	34	44.6 Å²	44.6	21%	0.206	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	128.7	-178.8	-167.9	0	0	0	0	110.5	L979 E980 R986 V987 E1125 Y1126	L979-V982 WeakPolarHBondContact O-CG2 3.29Å; E980-V982 PolarHBondContact O-N 3.32Å; E980-V982 VanDerWaalsContact O-N 3.12Å; V982-R986 CarbonylContact C-O 3.59Å; V982-R986 WeakPolarHBondContact CA-O 2.95Å; V982-V987 HydrophobicContact CG2-CG2 4.42Å; V982-E1125 HydrophobicContact CB-CB 3.85Å; V982-E1125 HydrophobicContact CG1-CB 3.8Å; V982-E1125 CarbonylContact O-C 3.58Å; V982-E1125 WeakPolarHBondContact O-CA 3.16Å; V982-E1125 PolarHBondContact O-N 2.74Å; V982-Y1126 PolarHBondContact O-N 3.02Å
983	I	88	Confident	86	Confident	6 Å²	6	38 Å²	38	3%	0.031	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	125.3	173.3	-56	-179.5	0	0	0	108.8	G985 R986 L988 Y1124 L1171 L1173	I983-G985 VanDerWaalsContact C-N 3.29Å; I983-G985 PolarHBondContact O-N 2.93Å; I983-R986 PolarHBondContact N-O 2.94Å; I983-R986 PolarHBondContact O-N 3.24Å; I983-L988 HydrophobicContact CB-CD1 4.02Å; I983-L988 HydrophobicContact CB-CG 4.47Å; I983-L988 HydrophobicContact CD1-CD1 4.35Å; I983-Y1124 HydrophobicContact CD1-CD1 4.15Å; I983-Y1124 HydrophobicContact CG1-CD1 4.36Å; I983-Y1124 HydrophobicContact CG2-CD1 4.15Å; I983-L1171 HydrophobicContact CG2-CD1 3.74Å; I983-L1171 HydrophobicContact CG2-CD2 4.11Å; I983-L1171 HydrophobicContact CG2-CG 4.44Å; I983-L1173 HydrophobicContact CD1-CD2 3.71Å; I983-L1173 HydrophobicContact CG2-CD2 4.25Å
984	D	80.5	Confident	87.2	Confident	9 Å²	9	34.1 Å²	34.1	5%	0.048	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	48.9	180	-149.5	52.7	0	0	0	112.4	R986 G1123 L1171 R1228 R1229	D984-R986 VanDerWaalsContact C-N 3.35Å; D984-R986 PolarHBondContact O-N 3.43Å; D984-G1123 PolarHBondContact N-O 3.36Å; D984-L1171 HydrophobicContact CB-CD2 3.91Å; D984-R1228 IonicContact OD1-CZ 2.82Å; D984-R1228 VanDerWaalsContact OD1-CZ 3.24Å; D984-R1228 IonicContact OD1-NE 3.45Å; D984-R1228 PolarHBondContact OD1-NE 3Å; D984-R1228 IonicContact OD1-NH2 3.84Å; D984-R1228 PolarHBondContact OD1-NH2 3.37Å; D984-R1228 WeakPolarHBondContact OD2-CA 3.45Å; D984-R1229 PolarHBondContact OD2-N 3.37Å
985	G	72.3	Confident	88.2	Confident	42 Å²	42	24.7 Å²	24.7	43%	0.433	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	20.1	-177.5	0	0	0	0	0	116.4	I983 E1125	I983-G985 VanDerWaalsContact C-N 3.29Å; I983-G985 PolarHBondContact O-N 2.93Å; G985-E1125 WeakPolarHBondContact CA-OE2 3.28Å; G985-E1125 PolarHBondContact N-OE2 3.47Å
986	R	78.9	Confident	88.8	Confident	94 Å²	94	23.8 Å²	23.8	36%	0.355	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	137.5	174.9	-50	-172.6	-144.6	-170.8	7.9	111.5	V982 I983 D984 L988	V982-R986 CarbonylContact C-O 3.59Å; V982-R986 WeakPolarHBondContact CA-O 2.95Å; I983-R986 PolarHBondContact N-O 2.94Å; I983-R986 PolarHBondContact O-N 3.24Å; D984-R986 VanDerWaalsContact C-N 3.35Å; D984-R986 PolarHBondContact O-N 3.43Å; R986-L988 HydrophobicContact CB-CD2 3.95Å; R986-L988 HydrophobicContact CB-CG 4.43Å; R986-L988 PolarHBondContact O-N 3.19Å
987	V	87.6	Confident	89.1	Confident	30 Å²	30	19.2 Å²	19.2	18%	0.182	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	111.4	163.8	-171.7	0	0	0	0	108.1	Y978 L979 V982 L1028	Y978-V987 WeakPolarHBondContact O-CG1 3.37Å; L979-V987 HydrophobicContact CD2-CG1 4.41Å; V982-V987 HydrophobicContact CG2-CG2 4.42Å; V987-L1028 HydrophobicContact CB-CB 4.11Å; V987-L1028 HydrophobicContact CG1-CB 3.79Å; V987-L1028 HydrophobicContact CG1-CD1 3.84Å; V987-L1028 HydrophobicContact CG1-CG 4.12Å; V987-L1028 PolarHBondContact O-N 3.03Å
988	L	89.6	Confident	89.2	Confident	16 Å²	16	17.8 Å²	17.8	8%	0.084	10%	0.097	C	C	.	.	B	Isolated β-bridge	trans	-103.9	140.9	174.6	-59	-173.1	0	0	0	109.1	H981 I983 R986 A1025 T1026 I1027 L1173	H981-L988 PolarHBondContact ND1-O 2.86Å; H981-L988 PolarHBondContact O-N 2.74Å; I983-L988 HydrophobicContact CB-CD1 4.02Å; I983-L988 HydrophobicContact CB-CG 4.47Å; I983-L988 HydrophobicContact CD1-CD1 4.35Å; R986-L988 HydrophobicContact CB-CD2 3.95Å; R986-L988 HydrophobicContact CB-CG 4.43Å; R986-L988 PolarHBondContact O-N 3.19Å; L988-A1025 HydrophobicContact CD1-CB 4.31Å; L988-A1025 HydrophobicContact CD2-CB 4.43Å; L988-T1026 WeakPolarHBondContact CA-O 3.27Å; L988-I1027 HydrophobicContact CD2-CG1 3.84Å; L988-L1173 HydrophobicContact CD1-CD1 4.13Å
989	F	91.9	Very high	89.3	Confident	5 Å²	5	17.5 Å²	17.5	2%	0.022	10%	0.095	C	C	.	.	P	Polyproline II helix	trans	-65	130.3	168.4	-170.3	-108.8	0	0	0	109.5	I966 Y978 G993 H994 T1026 F1056	I966-F989 HydrophobicContact CD1-CD2 4.36Å; I966-F989 HydrophobicContact CD1-CE2 3.4Å; I966-F989 VanDerWaalsContact CD1-CE2 3.4Å; I966-F989 HydrophobicContact CD1-CZ 3.78Å; Y978-F989 HydrophobicContact CD1-CD2 4.03Å; Y978-F989 AromaticContact CD1-CE2 3.86Å; Y978-F989 HydrophobicContact CD1-CE2 3.86Å; Y978-F989 HydrophobicContact CE1-CD2 4.01Å; Y978-F989 AromaticContact CE1-CE2 3.39Å; Y978-F989 HydrophobicContact CE1-CE2 3.39Å; Y978-F989 HydrophobicContact CE1-CZ 4.09Å; Y978-F989 HydrophobicContact CE2-CE2 4.16Å; Y978-F989 HydrophobicContact CG-CE2 4.4Å; Y978-F989 AromaticContact CZ-CE2 3.57Å; F989-G993 VanDerWaalsContact CE1-C 3.44Å; F989-H994 AromaticContact CD1-CE1 3.58Å; F989-H994 AromaticContact CD1-ND1 3.91Å; F989-H994 AromaticContact CD1-NE2 3.69Å; F989-H994 AromaticContact CE1-CE1 3.91Å; F989-H994 AromaticContact CE1-ND1 3.76Å; F989-T1026 HydrophobicContact CB-CG2 4.31Å; F989-T1026 PolarHBondContact N-O 2.86Å; F989-F1056 HydrophobicContact CD1-CE2 4.06Å; F989-F1056 AromaticContact CD1-CZ 3.78Å; F989-F1056 HydrophobicContact CD1-CZ 3.78Å; F989-F1056 HydrophobicContact CD2-CE2 4.16Å; F989-F1056 HydrophobicContact CD2-CZ 4.42Å; F989-F1056 AromaticContact CE1-CE2 3.89Å; F989-F1056 HydrophobicContact CE1-CE2 3.89Å; F989-F1056 AromaticContact CE1-CZ 3.98Å; F989-F1056 HydrophobicContact CE1-CZ 3.98Å; F989-F1056 HydrophobicContact CE2-CE2 4.02Å; F989-F1056 HydrophobicContact CG-CE2 4.2Å; F989-F1056 HydrophobicContact CG-CZ 4.01Å; F989-F1056 AromaticContact CZ-CE2 3.88Å; F989-F1056 HydrophobicContact CZ-CE2 3.88Å; F989-F1056 HydrophobicContact CZ-CZ 4.42Å
990	P	92.7	Very high	89.4	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.103	C	C	.	.	P	Polyproline II helix	trans	-63.5	141.5	-175.5	-19	28.2	0	0	0	112.3	Y978 H981 T992 G993 H994 F1130 V1152	Y978-P990 HydrophobicContact CD1-CG 3.84Å; Y978-P990 HydrophobicContact CE1-CG 4.02Å; H981-P990 HydrophobicContact CB-CG 4.03Å; P990-T992 PolarHBondContact O-N 3.14Å; P990-G993 WeakPolarHBondContact O-CA 3.46Å; P990-G993 PolarHBondContact O-N 2.69Å; P990-H994 PolarHBondContact O-N 3.47Å; P990-F1130 HydrophobicContact CB-CE1 4.33Å; P990-F1130 HydrophobicContact CB-CZ 4.42Å; P990-F1130 HydrophobicContact CG-CE1 3.95Å; P990-F1130 HydrophobicContact CG-CZ 3.57Å; P990-V1152 HydrophobicContact CB-CG1 3.94Å; P990-V1152 HydrophobicContact CG-CG1 3.85Å
991	F	92.8	Very high	89.2	Confident	12 Å²	12	17.8 Å²	17.8	5%	0.053	9%	0.091	C	C	.	.	H	α-helix	trans	-53.9	-38.4	170.5	176.2	-86.1	0	0	0	111.2	G993 H994 L995 V1020 V1022 L1159 P1174 M1177	F991-G993 VanDerWaalsContact C-N 3.32Å; F991-G993 PolarHBondContact O-N 2.82Å; F991-H994 PolarHBondContact O-N 2.8Å; F991-L995 HydrophobicContact CD1-CD1 4.26Å; F991-L995 HydrophobicContact CE1-CD1 4.09Å; F991-L995 HydrophobicContact CE1-CD2 4.43Å; F991-V1020 HydrophobicContact CZ-CG1 4.31Å; F991-V1022 HydrophobicContact CD2-CB 3.93Å; F991-V1022 HydrophobicContact CD2-CG2 3.43Å; F991-V1022 VanDerWaalsContact CD2-CG2 3.43Å; F991-V1022 HydrophobicContact CE2-CB 3.98Å; F991-V1022 HydrophobicContact CE2-CG2 3.46Å; F991-V1022 VanDerWaalsContact CE2-CG2 3.46Å; F991-V1022 HydrophobicContact CG-CG2 4.42Å; F991-V1022 HydrophobicContact CZ-CG2 4.48Å; F991-L1159 HydrophobicContact CB-CD1 4.44Å; F991-L1159 HydrophobicContact CD1-CD1 3.96Å; F991-P1174 HydrophobicContact CB-CB 4.36Å; F991-P1174 HydrophobicContact CB-CG 3.65Å; F991-P1174 HydrophobicContact CD1-CB 4.22Å; F991-P1174 HydrophobicContact CD1-CG 4.35Å; F991-P1174 HydrophobicContact CD2-CB 3.97Å; F991-P1174 HydrophobicContact CD2-CG 4.09Å; F991-P1174 VanDerWaalsContact CD2-O 3.24Å; F991-P1174 WeakPolarHBondContact CD2-O 3.41Å; F991-P1174 HydrophobicContact CE2-CB 4.31Å; F991-P1174 HydrophobicContact CG-CB 3.94Å; F991-P1174 HydrophobicContact CG-CG 3.79Å; F991-M1177 HydrophobicContact CE1-CB 4.36Å; F991-M1177 HydrophobicContact CE1-CE 3.77Å; F991-M1177 HydrophobicContact CZ-CB 4.12Å
992	T	93.3	Very high	88.9	Confident	1 Å²	1	17.7 Å²	17.7	1%	0.006	9%	0.091	C	C	.	.	H	α-helix	trans	-69	-27.2	175.5	59.8	0	0	0	0	113.4	P990 H994 L995 I996 V1152 L1155 D1156 L1159	P990-T992 PolarHBondContact O-N 3.14Å; T992-H994 VanDerWaalsContact C-N 3.28Å; T992-H994 PolarHBondContact O-N 3.49Å; T992-L995 HydrophobicContact CG2-CD1 4.45Å; T992-L995 WeakPolarHBondContact O-CB 3.42Å; T992-L995 PolarHBondContact O-N 3.16Å; T992-L995 VanDerWaalsContact O-N 3.15Å; T992-I996 WeakPolarHBondContact O-CG1 3.36Å; T992-I996 PolarHBondContact O-N 3.3Å; T992-V1152 WeakPolarHBondContact OG1-CG1 3.38Å; T992-V1152 PolarHBondContact OG1-O 2.9Å; T992-L1155 HydrophobicContact CG2-CB 3.59Å; T992-D1156 HydrophobicContact CG2-CB 4.17Å; T992-L1159 HydrophobicContact CG2-CD1 3.6Å; T992-L1159 HydrophobicContact CG2-CG 4.18Å
993	G	91.5	Very high	88.8	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-60.5	-37.8	173.3	0	0	0	0	0	111.9	F989 P990 F991 N997	F989-G993 VanDerWaalsContact CE1-C 3.44Å; P990-G993 WeakPolarHBondContact O-CA 3.46Å; P990-G993 PolarHBondContact O-N 2.69Å; F991-G993 VanDerWaalsContact C-N 3.32Å; F991-G993 PolarHBondContact O-N 2.82Å; G993-N997 WeakPolarHBondContact O-CB 3.37Å; G993-N997 VanDerWaalsContact O-CG 3.26Å; G993-N997 PolarHBondContact O-N 2.82Å
994	H	92.5	Very high	88.3	Confident	1 Å²	1	19.5 Å²	19.5	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-64.5	-42	173.7	-66.3	-61.2	0	0	0	112	F989 P990 F991 T992 N997 A998 F1056 I1069 A1077	F989-H994 AromaticContact CD1-CE1 3.58Å; F989-H994 AromaticContact CD1-ND1 3.91Å; F989-H994 AromaticContact CD1-NE2 3.69Å; F989-H994 AromaticContact CE1-CE1 3.91Å; F989-H994 AromaticContact CE1-ND1 3.76Å; P990-H994 PolarHBondContact O-N 3.47Å; F991-H994 PolarHBondContact O-N 2.8Å; T992-H994 VanDerWaalsContact C-N 3.28Å; T992-H994 PolarHBondContact O-N 3.49Å; H994-N997 PolarHBondContact O-N 2.83Å; H994-A998 PolarHBondContact O-N 3.42Å; H994-F1056 AromaticContact CE1-CE1 3.89Å; H994-I1069 HydrophobicContact CB-CD1 3.95Å; H994-I1069 VanDerWaalsContact O-CD1 3.31Å; H994-I1069 WeakPolarHBondContact O-CD1 3.33Å; H994-A1077 HydrophobicContact CB-CB 4.13Å
995	L	93.2	Very high	88.2	Confident	2 Å²	2	20.4 Å²	20.4	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-62.7	-47.6	178	-50.5	174.6	0	0	0	111.5	F991 T992 A998 W999 I1017 V1020 M1177 L1180	F991-L995 HydrophobicContact CD1-CD1 4.26Å; F991-L995 HydrophobicContact CE1-CD1 4.09Å; F991-L995 HydrophobicContact CE1-CD2 4.43Å; T992-L995 HydrophobicContact CG2-CD1 4.45Å; T992-L995 WeakPolarHBondContact O-CB 3.42Å; T992-L995 PolarHBondContact O-N 3.16Å; T992-L995 VanDerWaalsContact O-N 3.15Å; L995-A998 PolarHBondContact O-N 3.48Å; L995-W999 PolarHBondContact O-N 2.98Å; L995-I1017 HydrophobicContact CB-CD1 4.35Å; L995-V1020 HydrophobicContact CD2-CB 4.35Å; L995-V1020 HydrophobicContact CD2-CG1 3.84Å; L995-V1020 HydrophobicContact CD2-CG2 3.9Å; L995-M1177 HydrophobicContact CD1-CE 3.52Å; L995-M1177 HydrophobicContact CD2-CE 4.46Å; L995-L1180 HydrophobicContact CD1-CD2 3.78Å
996	I	93.9	Very high	88.5	Confident	4 Å²	4	24.2 Å²	24.2	2%	0.021	10%	0.102	C	C	.	.	H	α-helix	trans	-68.5	-36.4	-179.9	-64.8	-51.4	0	0	0	111.4	T992 W999 R1000 M1010 W1151 V1152 L1155 I1182	T992-I996 WeakPolarHBondContact O-CG1 3.36Å; T992-I996 PolarHBondContact O-N 3.3Å; I996-W999 HydrophobicContact CD1-CE3 3.71Å; I996-W999 HydrophobicContact CD1-CZ3 4.08Å; I996-W999 PolarHBondContact O-N 3.45Å; I996-R1000 VanDerWaalsContact O-CB 3.27Å; I996-R1000 WeakPolarHBondContact O-CB 3.35Å; I996-R1000 PolarHBondContact O-N 2.91Å; I996-M1010 HydrophobicContact CD1-CE 4.36Å; I996-M1010 HydrophobicContact CG2-CE 3.86Å; I996-W1151 HydrophobicContact CD1-CB 3.59Å; I996-W1151 HydrophobicContact CD1-CG 4.38Å; I996-W1151 HydrophobicContact CG1-CB 4.01Å; I996-V1152 HydrophobicContact CB-CG2 3.95Å; I996-V1152 HydrophobicContact CG1-CG2 3.91Å; I996-V1152 HydrophobicContact CG2-CG2 4Å; I996-L1155 HydrophobicContact CD1-CD1 3.74Å; I996-L1155 HydrophobicContact CG1-CD1 4.21Å; I996-I1182 HydrophobicContact CD1-CD1 4.45Å
997	N	90.8	Very high	88.4	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64.9	-40.6	172.1	-81.6	-10.1	0	0	0	112.2	I964 G993 H994 R1000 A1001 I1058	I964-N997 HydrophobicContact CD1-CB 3.95Å; G993-N997 WeakPolarHBondContact O-CB 3.37Å; G993-N997 VanDerWaalsContact O-CG 3.26Å; G993-N997 PolarHBondContact O-N 2.82Å; H994-N997 PolarHBondContact O-N 2.83Å; N997-R1000 PolarHBondContact O-N 3.29Å; N997-A1001 VanDerWaalsContact O-CB 3.26Å; N997-A1001 WeakPolarHBondContact O-CB 3.24Å; N997-A1001 PolarHBondContact O-N 3.37Å; N997-I1058 HydrophobicContact CB-CD1 3.82Å
998	A	91.5	Very high	88.2	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-63.9	-42.4	174.2	0	0	0	0	0	112.5	H994 L995 A1001 V1002 F1067 I1069	H994-A998 PolarHBondContact O-N 3.42Å; L995-A998 PolarHBondContact O-N 3.48Å; A998-A1001 PolarHBondContact O-N 2.96Å; A998-V1002 PolarHBondContact O-N 3.16Å; A998-F1067 HydrophobicContact CB-CD1 4.27Å; A998-F1067 HydrophobicContact CB-CD2 3.73Å; A998-F1067 HydrophobicContact CB-CE1 4.23Å; A998-F1067 HydrophobicContact CB-CE2 3.7Å; A998-F1067 HydrophobicContact CB-CG 4.03Å; A998-F1067 HydrophobicContact CB-CZ 3.95Å; A998-I1069 HydrophobicContact CB-CD1 4.41Å
999	W	93.3	Very high	87.9	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.5	-46.3	175.4	-178	18.5	0	0	0	112.1	L995 I996 A1001 V1002 C1003 M1010 T1013 V1015 I1081 W1151 I1182 P1184	L995-W999 PolarHBondContact O-N 2.98Å; I996-W999 HydrophobicContact CD1-CE3 3.71Å; I996-W999 HydrophobicContact CD1-CZ3 4.08Å; I996-W999 PolarHBondContact O-N 3.45Å; W999-A1001 VanDerWaalsContact C-N 3.34Å; W999-A1001 PolarHBondContact O-N 3.11Å; W999-V1002 PolarHBondContact O-N 2.86Å; W999-C1003 PolarHBondContact O-N 3.12Å; W999-C1003 PolarHBondContact O-SG 2.82Å; W999-M1010 HydrophobicContact CD2-CE 3.78Å; W999-M1010 HydrophobicContact CD2-CG 3.93Å; W999-M1010 HydrophobicContact CE3-CE 3.35Å; W999-M1010 HydrophobicContact CE3-CG 4.34Å; W999-M1010 HydrophobicContact CG-CE 4.46Å; W999-M1010 HydrophobicContact CG-CG 4.41Å; W999-M1010 HydrophobicContact CH2-CE 4.13Å; W999-M1010 HydrophobicContact CH2-CG 4.22Å; W999-M1010 HydrophobicContact CZ2-CG 3.83Å; W999-M1010 VanDerWaalsContact CZ2-O 3.23Å; W999-M1010 WeakPolarHBondContact CZ2-O 3.29Å; W999-M1010 HydrophobicContact CZ3-CE 3.53Å; W999-M1010 HydrophobicContact CZ3-CG 4.46Å; W999-T1013 WeakPolarHBondContact CZ2-O 3.14Å; W999-T1013 PolarHBondContact NE1-O 3.03Å; W999-V1015 VanDerWaalsContact CD1-CG1 3.5Å; W999-V1015 HydrophobicContact CD2-CG2 3.76Å; W999-V1015 HydrophobicContact CE3-CG2 4.42Å; W999-V1015 HydrophobicContact CG-CG1 4.37Å; W999-V1015 HydrophobicContact CG-CG2 3.85Å; W999-V1015 HydrophobicContact CZ2-CG2 4.28Å; W999-I1081 HydrophobicContact CB-CD1 4.07Å; W999-W1151 HydrophobicContact CH2-CD2 4.37Å; W999-W1151 HydrophobicContact CH2-CZ2 4.24Å; W999-W1151 AromaticContact CZ3-CD2 3.98Å; W999-W1151 HydrophobicContact CZ3-CD2 3.98Å; W999-W1151 HydrophobicContact CZ3-CE3 4.35Å; W999-W1151 HydrophobicContact CZ3-CG 4.2Å; W999-I1182 HydrophobicContact CE3-CD1 3.66Å; W999-I1182 HydrophobicContact CH2-CB 4.32Å; W999-I1182 HydrophobicContact CH2-CD1 4.41Å; W999-I1182 HydrophobicContact CH2-CG2 3.57Å; W999-I1182 HydrophobicContact CZ2-CG2 4.34Å; W999-I1182 HydrophobicContact CZ3-CB 4.35Å; W999-I1182 HydrophobicContact CZ3-CD1 3.61Å; W999-I1182 HydrophobicContact CZ3-CG2 3.77Å; W999-P1184 HydrophobicContact CH2-CB 4.34Å; W999-P1184 HydrophobicContact CH2-CG 4.44Å; W999-P1184 HydrophobicContact CZ2-CG 4.25Å
1000	R	89	Confident	87.7	Confident	110 Å²	110	31.3 Å²	31.3	42%	0.415	16%	0.158	S	C	.	.	H	α-helix	trans	-60	-42.6	174.8	-175.2	178.5	-71.2	172.6	-2.3	111.6	I964 I996 N997 C1003 K1004 M1010	I964-R1000 HydrophobicContact CD1-CB 4.42Å; I964-R1000 HydrophobicContact CD1-CG 4.4Å; I996-R1000 VanDerWaalsContact O-CB 3.27Å; I996-R1000 WeakPolarHBondContact O-CB 3.35Å; I996-R1000 PolarHBondContact O-N 2.91Å; N997-R1000 PolarHBondContact O-N 3.29Å; R1000-C1003 PolarHBondContact O-N 3.19Å; R1000-K1004 WeakPolarHBondContact O-CB 2.95Å; R1000-K1004 PolarHBondContact O-N 2.87Å; R1000-M1010 HydrophobicContact CB-SD 4.32Å
1001	A	86.7	Confident	87.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62.3	-45.4	175.7	0	0	0	0	0	112.2	C962 N997 A998 W999 C1003 K1004 I1005 I1058	C962-A1001 HydrophobicContact CB-CB 3.84Å; N997-A1001 VanDerWaalsContact O-CB 3.26Å; N997-A1001 WeakPolarHBondContact O-CB 3.24Å; N997-A1001 PolarHBondContact O-N 3.37Å; A998-A1001 PolarHBondContact O-N 2.96Å; W999-A1001 VanDerWaalsContact C-N 3.34Å; W999-A1001 PolarHBondContact O-N 3.11Å; A1001-C1003 VanDerWaalsContact C-N 3.33Å; A1001-C1003 PolarHBondContact O-N 2.8Å; A1001-K1004 PolarHBondContact O-N 3.19Å; A1001-I1005 VanDerWaalsContact O-CB 3.25Å; A1001-I1005 WeakPolarHBondContact O-CB 3.36Å; A1001-I1005 VanDerWaalsContact O-CG1 3.24Å; A1001-I1005 WeakPolarHBondContact O-CG1 3.38Å; A1001-I1005 PolarHBondContact O-N 2.57Å; A1001-I1058 HydrophobicContact CB-CB 4.06Å; A1001-I1058 HydrophobicContact CB-CD1 3.98Å; A1001-I1058 HydrophobicContact CB-CG2 3.63Å
1002	V	87.7	Confident	87	Confident	6 Å²	6	40.7 Å²	40.7	4%	0.036	20%	0.2	C	C	.	.	H	α-helix	trans	-58.5	-43.6	173.8	148	0	0	0	0	112.1	A998 W999 R1006 V1060 I1081 I1083	A998-V1002 PolarHBondContact O-N 3.16Å; W999-V1002 PolarHBondContact O-N 2.86Å; V1002-R1006 WeakPolarHBondContact O-CB 3.24Å; V1002-R1006 PolarHBondContact O-N 2.91Å; V1002-R1006 VanDerWaalsContact O-N 3.09Å; V1002-V1060 HydrophobicContact CG2-CG1 3.86Å; V1002-V1060 HydrophobicContact CG2-CG2 4.34Å; V1002-I1081 HydrophobicContact CB-CD1 4.17Å; V1002-I1081 HydrophobicContact CG1-CD1 4.49Å; V1002-I1081 HydrophobicContact CG2-CD1 4.08Å; V1002-I1081 HydrophobicContact CG2-CG1 4.24Å; V1002-I1081 HydrophobicContact CG2-CG2 3.51Å; V1002-I1083 HydrophobicContact CG1-CD1 3.86Å; V1002-I1083 HydrophobicContact CG1-CG1 3.97Å
1003	C	87	Confident	86.9	Confident	4 Å²	4	41.2 Å²	41.2	3%	0.027	20%	0.203	C	C	.	.	H	α-helix	trans	-66.3	-46	179.7	-65.1	0	0	0	0	111.3	W999 R1000 A1001 R1006 G1007 L1008 M1010	W999-C1003 PolarHBondContact O-N 3.12Å; W999-C1003 PolarHBondContact O-SG 2.82Å; R1000-C1003 PolarHBondContact O-N 3.19Å; A1001-C1003 VanDerWaalsContact C-N 3.33Å; A1001-C1003 PolarHBondContact O-N 2.8Å; C1003-R1006 CarbonylContact O-C 3.55Å; C1003-R1006 PolarHBondContact O-N 2.87Å; C1003-G1007 PolarHBondContact O-N 3.41Å; C1003-L1008 WeakPolarHBondContact CB-O 3.35Å; C1003-L1008 PolarHBondContact O-N 3.26Å; C1003-M1010 HydrophobicContact CB-CB 4.47Å
1004	K	77.8	Confident	86.9	Confident	73 Å²	73	42.9 Å²	42.9	32%	0.317	21%	0.214	S	C	.	.	H	α-helix	trans	-65.9	-39.7	177.9	-170.4	162.5	-175.2	169	0	112.6	D200 E202 R1000 A1001 R1006	D200-K1004 VanDerWaalsContact CG-NZ 3.26Å; D200-K1004 IonicContact OD1-NZ 3.42Å; D200-K1004 PolarHBondContact OD1-NZ 2.55Å; D200-K1004 IonicContact OD2-NZ 2.82Å; D200-K1004 PolarHBondContact OD2-NZ 3.34Å; E202-K1004 WeakPolarHBondContact OE2-CE 3.41Å; E202-K1004 IonicContact OE2-NZ 2.77Å; E202-K1004 PolarHBondContact OE2-NZ 3.26Å; R1000-K1004 WeakPolarHBondContact O-CB 2.95Å; R1000-K1004 PolarHBondContact O-N 2.87Å; A1001-K1004 PolarHBondContact O-N 3.19Å; K1004-R1006 VanDerWaalsContact C-N 3.29Å; K1004-R1006 PolarHBondContact O-N 2.72Å
1005	I	77.8	Confident	86.9	Confident	28 Å²	28	42.8 Å²	42.8	14%	0.144	21%	0.214	C	C	.	.	H	α-helix	trans	-64	-32.3	175	-75.6	168.3	0	0	0	112.2	A959 C962 A1001 V1060 W1062	A959-I1005 WeakPolarHBondContact O-CG2 3.36Å; C962-I1005 HydrophobicContact CB-CD1 4.3Å; C962-I1005 HydrophobicContact CB-CG1 4.46Å; A1001-I1005 VanDerWaalsContact O-CB 3.25Å; A1001-I1005 WeakPolarHBondContact O-CB 3.36Å; A1001-I1005 VanDerWaalsContact O-CG1 3.24Å; A1001-I1005 WeakPolarHBondContact O-CG1 3.38Å; A1001-I1005 PolarHBondContact O-N 2.57Å; I1005-V1060 HydrophobicContact CD1-CB 4.04Å; I1005-V1060 HydrophobicContact CD1-CG2 3.88Å; I1005-W1062 HydrophobicContact CG2-CZ2 4.08Å
1006	R	79	Confident	86.9	Confident	123 Å²	123	43.4 Å²	43.4	46%	0.464	22%	0.217	S	C	.	.	H	α-helix	trans	-101.3	-2.2	-177.8	-67.6	-174.7	171.7	-160.1	-1.7	114.9	V1002 C1003 K1004 L1008 W1062	V1002-R1006 WeakPolarHBondContact O-CB 3.24Å; V1002-R1006 PolarHBondContact O-N 2.91Å; V1002-R1006 VanDerWaalsContact O-N 3.09Å; C1003-R1006 CarbonylContact O-C 3.55Å; C1003-R1006 PolarHBondContact O-N 2.87Å; K1004-R1006 VanDerWaalsContact C-N 3.29Å; K1004-R1006 PolarHBondContact O-N 2.72Å; R1006-L1008 HydrophobicContact CB-CD1 3.85Å; R1006-L1008 HydrophobicContact CB-CG 4.01Å; R1006-W1062 PolarHBondContact NH2-O 3.44Å
1007	G	76.1	Confident	86.9	Confident	71 Å²	71	43.2 Å²	43.2	73%	0.732	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.1	39.9	-178.6	0	0	0	0	0	114	C1003	C1003-G1007 PolarHBondContact O-N 3.41Å
1008	L	84.9	Confident	87	Confident	76 Å²	76	44.9 Å²	44.9	40%	0.398	22%	0.224	S	C	.	.			trans	-115.5	148.3	-174.1	-60.6	174	0	0	0	112.5	C1003 R1006 M1010 T1013 I1083	C1003-L1008 WeakPolarHBondContact CB-O 3.35Å; C1003-L1008 PolarHBondContact O-N 3.26Å; R1006-L1008 HydrophobicContact CB-CD1 3.85Å; R1006-L1008 HydrophobicContact CB-CG 4.01Å; L1008-M1010 PolarHBondContact O-N 2.96Å; L1008-T1013 HydrophobicContact CD1-CG2 4.18Å; L1008-I1083 HydrophobicContact CD1-CD1 3.4Å
1009	E	82.5	Confident	87	Confident	118 Å²	118	49.6 Å²	49.6	55%	0.551	25%	0.249	S	C	*	.			trans	-78	117.9	172.7	-71.2	-178.4	-169.6	0	0	110.9	E1011 K1012 T1013	E1009-E1011 VanDerWaalsContact C-N 3.33Å; E1009-E1011 PolarHBondContact O-N 3.2Å; E1009-K1012 HydrophobicContact CB-CB 4.48Å; E1009-K1012 PolarHBondContact O-N 3.03Å; E1009-K1012 VanDerWaalsContact O-N 3.07Å; E1009-K1012 IonicContact OE1-NZ 3.07Å; E1009-K1012 VanDerWaalsContact OE2-CD 3.26Å; E1009-K1012 WeakPolarHBondContact OE2-CD 3.16Å; E1009-K1012 WeakPolarHBondContact OE2-CE 3.43Å; E1009-K1012 IonicContact OE2-NZ 2.79Å; E1009-K1012 PolarHBondContact OE2-NZ 3.42Å; E1009-T1013 WeakPolarHBondContact O-CB 3.12Å; E1009-T1013 PolarHBondContact O-N 2.86Å; E1009-T1013 PolarHBondContact O-OG1 2.85Å
1010	M	88.2	Confident	87	Confident	29 Å²	29	49.7 Å²	49.7	14%	0.143	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-54.6	-45.9	-179.1	-174.3	-179.6	162.3	0	0	112.4	I996 W999 R1000 C1003 L1008 K1012 T1013 W1151	I996-M1010 HydrophobicContact CD1-CE 4.36Å; I996-M1010 HydrophobicContact CG2-CE 3.86Å; W999-M1010 HydrophobicContact CD2-CE 3.78Å; W999-M1010 HydrophobicContact CD2-CG 3.93Å; W999-M1010 HydrophobicContact CE3-CE 3.35Å; W999-M1010 HydrophobicContact CE3-CG 4.34Å; W999-M1010 HydrophobicContact CG-CE 4.46Å; W999-M1010 HydrophobicContact CG-CG 4.41Å; W999-M1010 HydrophobicContact CH2-CE 4.13Å; W999-M1010 HydrophobicContact CH2-CG 4.22Å; W999-M1010 HydrophobicContact CZ2-CG 3.83Å; W999-M1010 VanDerWaalsContact CZ2-O 3.23Å; W999-M1010 WeakPolarHBondContact CZ2-O 3.29Å; W999-M1010 HydrophobicContact CZ3-CE 3.53Å; W999-M1010 HydrophobicContact CZ3-CG 4.46Å; R1000-M1010 HydrophobicContact CB-SD 4.32Å; C1003-M1010 HydrophobicContact CB-CB 4.47Å; L1008-M1010 PolarHBondContact O-N 2.96Å; M1010-K1012 PolarHBondContact O-N 3.26Å; M1010-T1013 PolarHBondContact O-N 2.8Å; M1010-T1013 VanDerWaalsContact O-N 3.1Å; M1010-W1151 HydrophobicContact CE-CG 4.48Å
1011	E	84.7	Confident	87	Confident	84 Å²	84	46.2 Å²	46.2	39%	0.393	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-63.1	-9.2	179.4	-66	-67.3	111.6	0	0	114.9	E1009 W1151 P1184	E1009-E1011 VanDerWaalsContact C-N 3.33Å; E1009-E1011 PolarHBondContact O-N 3.2Å; E1011-W1151 PolarHBondContact OE1-NE1 2.92Å; E1011-P1184 WeakPolarHBondContact O-CB 3.06Å; E1011-P1184 VanDerWaalsContact O-CG 3.3Å; E1011-P1184 WeakPolarHBondContact O-CG 3.19Å
1012	K	86.2	Confident	87.1	Confident	125 Å²	125	47.3 Å²	47.3	54%	0.543	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-120.7	1.7	176.7	-64	178.8	-173	147.1	0	113.7	E1009 M1010 P1014	E1009-K1012 HydrophobicContact CB-CB 4.48Å; E1009-K1012 PolarHBondContact O-N 3.03Å; E1009-K1012 VanDerWaalsContact O-N 3.07Å; E1009-K1012 IonicContact OE1-NZ 3.07Å; E1009-K1012 VanDerWaalsContact OE2-CD 3.26Å; E1009-K1012 WeakPolarHBondContact OE2-CD 3.16Å; E1009-K1012 WeakPolarHBondContact OE2-CE 3.43Å; E1009-K1012 IonicContact OE2-NZ 2.79Å; E1009-K1012 PolarHBondContact OE2-NZ 3.42Å; M1010-K1012 PolarHBondContact O-N 3.26Å; K1012-P1014 WeakPolarHBondContact O-CD 3.47Å
1013	T	90.1	Very high	86.8	Confident	12 Å²	12	53.1 Å²	53.1	7%	0.074	27%	0.267	C	S	.	.			trans	-108.1	94.8	-170.9	-58.9	0	0	0	0	110.7	W999 L1008 E1009 M1010 V1015 I1083	W999-T1013 WeakPolarHBondContact CZ2-O 3.14Å; W999-T1013 PolarHBondContact NE1-O 3.03Å; L1008-T1013 HydrophobicContact CD1-CG2 4.18Å; E1009-T1013 WeakPolarHBondContact O-CB 3.12Å; E1009-T1013 PolarHBondContact O-N 2.86Å; E1009-T1013 PolarHBondContact O-OG1 2.85Å; M1010-T1013 PolarHBondContact O-N 2.8Å; M1010-T1013 VanDerWaalsContact O-N 3.1Å; T1013-V1015 HydrophobicContact CG2-CG1 4.28Å; T1013-I1083 HydrophobicContact CG2-CD1 3.94Å; T1013-I1083 HydrophobicContact CG2-CG1 4.11Å; T1013-I1083 HydrophobicContact CG2-CG2 3.87Å
1014	P	91.6	Very high	86.2	Confident	34 Å²	34	58.6 Å²	58.6	22%	0.221	29%	0.287	C	S	.	.			trans	-66.7	134.9	176.3	28.4	-35	0	0	0	111.1	K1012 I1084 I1182	K1012-P1014 WeakPolarHBondContact O-CD 3.47Å; P1014-I1084 HydrophobicContact CB-CB 4.35Å; P1014-I1084 HydrophobicContact CG-CB 4.35Å; P1014-I1084 PolarHBondContact O-N 3.11Å; P1014-I1182 CarbonylContact C-O 3.18Å; P1014-I1182 VanDerWaalsContact CA-O 3.26Å; P1014-I1182 WeakPolarHBondContact CA-O 3.35Å
1015	V	92.9	Very high	86.1	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	151.2	-174.4	-71.3	0	0	0	0	113.1	W999 T1013 T1082 I1083 R1181 I1182	W999-V1015 VanDerWaalsContact CD1-CG1 3.5Å; W999-V1015 HydrophobicContact CD2-CG2 3.76Å; W999-V1015 HydrophobicContact CE3-CG2 4.42Å; W999-V1015 HydrophobicContact CG-CG1 4.37Å; W999-V1015 HydrophobicContact CG-CG2 3.85Å; W999-V1015 HydrophobicContact CZ2-CG2 4.28Å; T1013-V1015 HydrophobicContact CG2-CG1 4.28Å; V1015-T1082 WeakPolarHBondContact CA-O 3.43Å; V1015-I1083 HydrophobicContact CG1-CG1 4.31Å; V1015-R1181 WeakPolarHBondContact O-CA 3.37Å; V1015-I1182 HydrophobicContact CG2-CB 4.12Å; V1015-I1182 HydrophobicContact CG2-CD1 4.47Å; V1015-I1182 PolarHBondContact N-O 2.73Å; V1015-I1182 PolarHBondContact O-N 3.41Å
1016	L	92.7	Very high	86.3	Confident	14 Å²	14	55.9 Å²	55.9	7%	0.073	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	120.2	169.9	169.1	55.3	0	0	0	108.2	E1018 I1081 T1082 I1084 Y1179 L1180	L1016-E1018 HydrophobicContact CD1-CG 3.83Å; L1016-E1018 HydrophobicContact CD2-CG 4.3Å; L1016-E1018 HydrophobicContact CG-CG 3.84Å; L1016-I1081 CarbonylContact O-C 3.57Å; L1016-I1081 WeakPolarHBondContact O-CA 3.33Å; L1016-T1082 PolarHBondContact N-O 3.05Å; L1016-T1082 PolarHBondContact O-N 2.85Å; L1016-I1084 HydrophobicContact CB-CD1 4.12Å; L1016-I1084 HydrophobicContact CB-CG1 4.08Å; L1016-Y1179 HydrophobicContact CD1-CD2 3.62Å; L1016-Y1179 HydrophobicContact CD1-CE1 4.41Å; L1016-Y1179 HydrophobicContact CD1-CE2 3.28Å; L1016-Y1179 HydrophobicContact CD1-CG 4.32Å; L1016-Y1179 HydrophobicContact CD2-CE2 4.32Å; L1016-Y1179 HydrophobicContact CG-CE2 4.45Å; L1016-L1180 CarbonylContact C-O 3.52Å; L1016-L1180 WeakPolarHBondContact CA-O 3.43Å
1017	I	94.5	Very high	86.5	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	127.8	175.2	-50.6	-175.5	0	0	0	107.8	L995 V1020 F1067 R1080 I1081 L1180	L995-I1017 HydrophobicContact CB-CD1 4.35Å; I1017-V1020 HydrophobicContact CG2-CG2 3.47Å; I1017-V1020 VanDerWaalsContact CG2-CG2 3.47Å; I1017-F1067 HydrophobicContact CG2-CE1 4Å; I1017-F1067 HydrophobicContact CG2-CZ 4.39Å; I1017-R1080 CarbonylContact C-O 3.59Å; I1017-R1080 VanDerWaalsContact CA-O 3.29Å; I1017-R1080 WeakPolarHBondContact CA-O 3.47Å; I1017-R1080 WeakPolarHBondContact CG2-O 3.21Å; I1017-I1081 HydrophobicContact CD1-CD1 4.15Å; I1017-I1081 HydrophobicContact CG1-CB 4.49Å; I1017-I1081 HydrophobicContact CG1-CD1 4.05Å; I1017-I1081 HydrophobicContact CG1-CG1 4.09Å; I1017-L1180 HydrophobicContact CB-CB 4.35Å; I1017-L1180 HydrophobicContact CD1-CD2 4.15Å; I1017-L1180 PolarHBondContact N-O 3.38Å; I1017-L1180 PolarHBondContact O-N 2.87Å
1018	E	93.8	Very high	86.8	Confident	35 Å²	35	50.4 Å²	50.4	16%	0.164	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	153.2	-173.6	-61.7	177.6	139.6	0	0	111.1	L1016 V1020 R1080 R1178	L1016-E1018 HydrophobicContact CD1-CG 3.83Å; L1016-E1018 HydrophobicContact CD2-CG 4.3Å; L1016-E1018 HydrophobicContact CG-CG 3.84Å; E1018-V1020 PolarHBondContact O-N 2.94Å; E1018-R1080 HydrophobicContact CB-CB 4.28Å; E1018-R1080 PolarHBondContact N-O 2.97Å; E1018-R1080 PolarHBondContact O-N 3.41Å; E1018-R1080 IonicContact OE2-CZ 2.65Å; E1018-R1080 IonicContact OE2-NH1 2.8Å; E1018-R1080 PolarHBondContact OE2-NH1 2.88Å; E1018-R1178 VanDerWaalsContact CA-O 3.29Å; E1018-R1178 WeakPolarHBondContact CA-O 3.31Å
1019	D	91.5	Very high	85.8	Confident	99 Å²	99	49 Å²	49	53%	0.529	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	49	44.4	169.3	-61.5	-26.8	0	0	0	115.6	G1079 R1178	D1019-G1079 WeakPolarHBondContact O-CA 3.41Å; D1019-R1178 PolarHBondContact N-O 3.43Å
1020	V	92	Very high	84.6	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.012	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	131.8	-178.5	-174.1	0	0	0	0	111.6	F991 L995 I1017 E1018 F1067 S1078 R1176 M1177	F991-V1020 HydrophobicContact CZ-CG1 4.31Å; L995-V1020 HydrophobicContact CD2-CB 4.35Å; L995-V1020 HydrophobicContact CD2-CG1 3.84Å; L995-V1020 HydrophobicContact CD2-CG2 3.9Å; I1017-V1020 HydrophobicContact CG2-CG2 3.47Å; I1017-V1020 VanDerWaalsContact CG2-CG2 3.47Å; E1018-V1020 PolarHBondContact O-N 2.94Å; V1020-F1067 HydrophobicContact CG2-CZ 4.26Å; V1020-S1078 WeakPolarHBondContact CA-O 3.49Å; V1020-R1176 VanDerWaalsContact O-CA 3.26Å; V1020-R1176 WeakPolarHBondContact O-CA 3.47Å; V1020-M1177 PolarHBondContact N-O 3.25Å; V1020-M1177 PolarHBondContact O-N 2.91Å
1021	H	90	Very high	82.8	Confident	37 Å²	37	49.7 Å²	49.7	17%	0.171	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	133.4	170.1	-77.6	-122.7	0	0	0	110.2	Y1023 A1077 S1078	H1021-Y1023 HydrophobicContact CB-CE1 4.32Å; H1021-Y1023 HydrophobicContact CB-CE2 4.29Å; H1021-A1077 CarbonylContact O-C 3.59Å; H1021-A1077 VanDerWaalsContact O-CA 3.3Å; H1021-A1077 WeakPolarHBondContact O-CA 3.38Å; H1021-S1078 PolarHBondContact N-O 2.77Å; H1021-S1078 PolarHBondContact O-N 2.82Å
1022	V	87.7	Confident	81	Confident	23 Å²	23	49.2 Å²	49.2	14%	0.139	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	120.9	169.3	173.6	0	0	0	0	108.5	F991 R1024 A1077 T1175	F991-V1022 HydrophobicContact CD2-CB 3.93Å; F991-V1022 HydrophobicContact CD2-CG2 3.43Å; F991-V1022 VanDerWaalsContact CD2-CG2 3.43Å; F991-V1022 HydrophobicContact CE2-CB 3.98Å; F991-V1022 HydrophobicContact CE2-CG2 3.46Å; F991-V1022 VanDerWaalsContact CE2-CG2 3.46Å; F991-V1022 HydrophobicContact CG-CG2 4.42Å; F991-V1022 HydrophobicContact CZ-CG2 4.48Å; V1022-R1024 WeakPolarHBondContact CG1-O 3.2Å; V1022-A1077 HydrophobicContact CG2-CB 3.89Å; V1022-T1175 PolarHBondContact N-O 3.42Å
1023	Y	81.8	Confident	78.8	Confident	127 Å²	127	49.9 Å²	49.9	50%	0.498	26%	0.259	S	S	.	.			trans	-93.7	-25.2	-174.1	-54.3	-84.2	0	0	0	112.7	H1021 L1075 A1076 S1078	H1021-Y1023 HydrophobicContact CB-CE1 4.32Å; H1021-Y1023 HydrophobicContact CB-CE2 4.29Å; Y1023-L1075 HydrophobicContact CD2-CD2 3.88Å; Y1023-L1075 HydrophobicContact CD2-CG 3.89Å; Y1023-L1075 HydrophobicContact CE2-CD2 3.55Å; Y1023-L1075 HydrophobicContact CE2-CG 3.94Å; Y1023-A1076 PolarHBondContact N-O 3.48Å; Y1023-S1078 PolarHBondContact OH-OG 2.66Å
1024	R	75.1	Confident	76.3	Confident	120 Å²	120	53.8 Å²	53.8	45%	0.453	28%	0.277	S	S	.	.			trans	-146	132.4	-175.6	162.7	179.3	167.8	128.1	-1.3	108.5	V1022 E1071	V1022-R1024 WeakPolarHBondContact CG1-O 3.2Å; R1024-E1071 IonicContact CZ-OE1 3.16Å; R1024-E1071 IonicContact CZ-OE2 3.5Å; R1024-E1071 IonicContact NE-OE1 2.76Å; R1024-E1071 IonicContact NE-OE2 3.21Å; R1024-E1071 PolarHBondContact NE-OE2 3.13Å; R1024-E1071 VanDerWaalsContact NH2-CD 3.33Å; R1024-E1071 IonicContact NH2-OE1 3.81Å; R1024-E1071 PolarHBondContact NH2-OE1 3.08Å; R1024-E1071 IonicContact NH2-OE2 3.91Å; R1024-E1071 PolarHBondContact NH2-OE2 2.98Å
1025	A	75.3	Confident	73.7	Confident	44 Å²	44	54.4 Å²	54.4	36%	0.364	29%	0.285	S	S	.	.			trans	-79.9	118.6	161.7	0	0	0	0	0	108.7	L988	L988-A1025 HydrophobicContact CD1-CB 4.31Å; L988-A1025 HydrophobicContact CD2-CB 4.43Å
1026	T	82.4	Confident	71	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.318	C	S	.	.			trans	-65	135.7	170.2	-57.3	0	0	0	0	109.4	L988 F989 L1028 V1054 F1056 E1071	L988-T1026 WeakPolarHBondContact CA-O 3.27Å; F989-T1026 HydrophobicContact CB-CG2 4.31Å; F989-T1026 PolarHBondContact N-O 2.86Å; T1026-L1028 HydrophobicContact CG2-CD2 4.24Å; T1026-V1054 HydrophobicContact CG2-CG1 4.11Å; T1026-F1056 HydrophobicContact CG2-CZ 4Å; T1026-E1071 VanDerWaalsContact CB-OE2 3.31Å; T1026-E1071 WeakPolarHBondContact CB-OE2 3.43Å; T1026-E1071 VanDerWaalsContact CG2-CD 3.45Å; T1026-E1071 HydrophobicContact CG2-CG 4.15Å; T1026-E1071 WeakPolarHBondContact CG2-OE2 3.29Å; T1026-E1071 PolarHBondContact OG1-OE2 3.43Å
1027	I	83.4	Confident	68.3	Low	71 Å²	71	68.2 Å²	68.2	36%	0.364	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-104.2	135.7	177.5	-57.8	174.9	0	0	0	108.1	L988	L988-I1027 HydrophobicContact CD2-CG1 3.84Å
1028	L	81.5	Confident	65.6	Low	8 Å²	8	72.9 Å²	72.9	4%	0.042	37%	0.374	C	S	.	.			trans	-102.3	95.8	177.7	-50.9	179.8	0	0	0	109.1	P968 V987 T1026 V1054	P968-L1028 HydrophobicContact CG-CD1 4.31Å; V987-L1028 HydrophobicContact CB-CB 4.11Å; V987-L1028 HydrophobicContact CG1-CB 3.79Å; V987-L1028 HydrophobicContact CG1-CD1 3.84Å; V987-L1028 HydrophobicContact CG1-CG 4.12Å; V987-L1028 PolarHBondContact O-N 3.03Å; T1026-L1028 HydrophobicContact CG2-CD2 4.24Å; L1028-V1054 HydrophobicContact CD2-CB 4.39Å; L1028-V1054 HydrophobicContact CD2-CG1 4.35Å; L1028-V1054 HydrophobicContact CD2-CG2 3.82Å
1029	S	64.6	Low	62.9	Low	46 Å²	46	80.7 Å²	80.7	32%	0.322	40%	0.402	S	S	.	.			trans	-102.3	147.6	-175.5	40.7	0	0	0	0	113.4	F969 Q1034	F969-S1029 WeakPolarHBondContact CE2-O 3.45Å; F969-S1029 WeakPolarHBondContact CZ-O 3.35Å; S1029-Q1034 PolarHBondContact OG-OE1 2.78Å; S1029-Q1034 VanDerWaalsContact OG-OE1 3.12Å
1030	H	56.4	Low	60.4	Low	108 Å²	108	85.4 Å²	85.4	50%	0.5	42%	0.418	S	S	.	.			trans	-79.2	142.7	180	-157.8	-104.1	0	0	0	110.9	F969 S1032 E1033	F969-H1030 AromaticContact CD1-CD2 3.73Å; F969-H1030 AromaticContact CE1-CD2 3.89Å; H1030-S1032 PolarHBondContact ND1-OG 3.49Å; H1030-S1032 PolarHBondContact O-N 2.89Å; H1030-E1033 PolarHBondContact O-N 3.06Å
1031	P	50.4	Low	57.8	Low	54 Å²	54	89 Å²	89	35%	0.351	45%	0.448	S	S	.	.	H	α-helix	trans	-58.4	-25.4	-168.9	-28.7	36.1	0	0	0	116.3	A1035 I1052	P1031-A1035 WeakPolarHBondContact O-CB 3.27Å; P1031-A1035 PolarHBondContact O-N 3.22Å; P1031-A1035 VanDerWaalsContact O-N 3.13Å; P1031-I1052 HydrophobicContact CB-CD1 4.29Å; P1031-I1052 HydrophobicContact CG-CD1 4.5Å
1032	S	47.2	Very low	54.9	Low	74 Å²	74	94.6 Å²	94.6	52%	0.517	48%	0.478	S	S	.	.	H	α-helix	trans	-66.7	-36.5	-175.7	42.3	0	0	0	0	114.4	H1030	H1030-S1032 PolarHBondContact ND1-OG 3.49Å; H1030-S1032 PolarHBondContact O-N 2.89Å
1033	E	39.1	Very low	51.9	Low	138 Å²	138	96.6 Å²	96.6	65%	0.645	50%	0.504	S	S	*	.	H	α-helix	trans	-70.9	-37.8	179.5	-65.7	-169.9	126.1	0	0	111.8	H1030	H1030-E1033 PolarHBondContact O-N 3.06Å
1034	Q	37.6	Very low	49.5	Very low	95 Å²	95	98.9 Å²	98.9	44%	0.444	53%	0.525	S	S	.	.	H	α-helix	trans	-80.3	-38.9	-173.2	-147.8	153.3	-16.1	0	0	111.3	S1029 Q1036 Q1037 D1038	S1029-Q1034 PolarHBondContact OG-OE1 2.78Å; S1029-Q1034 VanDerWaalsContact OG-OE1 3.12Å; Q1034-Q1036 PolarHBondContact O-N 2.84Å; Q1034-Q1037 PolarHBondContact O-N 2.82Å; Q1034-D1038 PolarHBondContact O-N 3.48Å
1035	A	37.9	Very low	47.3	Very low	47 Å²	47	101.1 Å²	101.1	39%	0.388	54%	0.54	S	S	.	.	H	α-helix	trans	-63.9	-17.4	174.5	0	0	0	0	0	114.4	P1031 R1039	P1031-A1035 WeakPolarHBondContact O-CB 3.27Å; P1031-A1035 PolarHBondContact O-N 3.22Å; P1031-A1035 VanDerWaalsContact O-N 3.13Å; A1035-R1039 WeakPolarHBondContact O-CG 3.3Å
1036	Q	36.6	Very low	45.1	Very low	149 Å²	149	105.1 Å²	105.1	70%	0.696	56%	0.562	S	S	*	*	H	α-helix	trans	-77.9	-26.7	170.9	-79.9	-169.1	-12.2	0	0	113.3	Q1034	Q1034-Q1036 PolarHBondContact O-N 2.84Å
1037	Q	36	Very low	42.6	Very low	155 Å²	155	111 Å²	111	72%	0.724	60%	0.602	S	S	*	*	H	α-helix	trans	-83.8	-43.2	178.2	-67.1	-170.6	-23.3	0	0	111.7	Q1034 R1039 F1040	Q1034-Q1037 PolarHBondContact O-N 2.82Å; Q1037-R1039 VanDerWaalsContact C-N 3.32Å; Q1037-R1039 PolarHBondContact O-N 3.35Å; Q1037-F1040 PolarHBondContact O-N 3.17Å
1038	D	37.3	Very low	40.2	Very low	99 Å²	99	113.6 Å²	113.6	53%	0.529	62%	0.616	S	S	.	*	H	α-helix	trans	-72.2	-20.4	-174.8	-69.3	-34.9	0	0	0	114.2	Q1034 F1040 A1041	Q1034-D1038 PolarHBondContact O-N 3.48Å; D1038-F1040 PolarHBondContact O-N 2.92Å; D1038-F1040 VanDerWaalsContact O-N 3.09Å; D1038-A1041 PolarHBondContact O-N 2.85Å
1039	R	37.1	Very low	38	Very low	198 Å²	198	122.4 Å²	122.4	75%	0.747	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-18.6	173.9	-83.3	-176.1	-160.6	-162.3	8.8	114.3	A1035 Q1037	A1035-R1039 WeakPolarHBondContact O-CG 3.3Å; Q1037-R1039 VanDerWaalsContact C-N 3.32Å; Q1037-R1039 PolarHBondContact O-N 3.35Å
1040	F	38.4	Very low	36.6	Very low	199 Å²	199	127 Å²	127	87%	0.873	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-3.2	174.8	-80.6	-83.2	0	0	0	114	Q1037 D1038	Q1037-F1040 PolarHBondContact O-N 3.17Å; D1038-F1040 PolarHBondContact O-N 2.92Å; D1038-F1040 VanDerWaalsContact O-N 3.09Å
1041	A	38.5	Very low	36.1	Very low	77 Å²	77	128.9 Å²	128.9	64%	0.636	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	-27	-173.4	0	0	0	0	0	114.9	D1038	D1038-A1041 PolarHBondContact O-N 2.85Å
1042	L	28.4	Very low	36.1	Very low	154 Å²	154	131.2 Å²	131.2	81%	0.806	69%	0.69	S	S	*	*	S	Bend	trans	-135.9	118.7	-178.6	-69.2	169.5	0	0	0	110
1043	G	26	Very low	36.7	Very low	66 Å²	66	131.4 Å²	131.4	68%	0.68	69%	0.685	S	S	*	*			trans	-83.6	139.5	-171.6	0	0	0	0	0	114.8	Q1045	G1043-Q1045 PolarHBondContact O-N 2.84Å
1044	D	29.9	Very low	38.3	Very low	175 Å²	175	126 Å²	126	94%	0.936	66%	0.662	S	S	*	*	S	Bend	trans	34.2	52.7	159.2	-63.3	-4.8	0	0	0	117.8
1045	Q	29.4	Very low	40.2	Very low	167 Å²	167	124.8 Å²	124.8	78%	0.78	66%	0.655	S	S	*	*			trans	-118.1	138.8	154.2	-71.8	-161.5	-19.3	0	0	110.9	G1043 C1047	G1043-Q1045 PolarHBondContact O-N 2.84Å; Q1045-C1047 PolarHBondContact O-N 3.16Å
1046	P	28.2	Very low	42.4	Very low	127 Å²	127	122.5 Å²	122.5	83%	0.825	64%	0.636	S	S	*	*			trans	-68.2	108.9	179.2	27.9	-33.5	0	0	0	110	L1048	P1046-L1048 PolarHBondContact O-N 3.09Å
1047	C	31.3	Very low	44.7	Very low	125 Å²	125	117.4 Å²	117.4	85%	0.845	61%	0.613	S	S	*	*			trans	-66.3	105.4	179.1	-63.8	0	0	0	0	110.2	Q1045 Q1049	Q1045-C1047 PolarHBondContact O-N 3.16Å; C1047-Q1049 PolarHBondContact O-N 3.32Å
1048	L	32.6	Very low	47.2	Very low	125 Å²	125	110 Å²	110	65%	0.654	58%	0.579	S	S	*	*			trans	-46.9	129.1	168.2	-81.5	161.3	0	0	0	110.1	P1046 H1050	P1046-L1048 PolarHBondContact O-N 3.09Å; L1048-H1050 PolarHBondContact O-N 2.9Å; L1048-H1050 PolarHBondContact O-ND1 2.78Å
1049	Q	34.6	Very low	49.6	Very low	193 Å²	193	108.6 Å²	108.6	90%	0.902	57%	0.571	S	S	*	*			trans	-66.2	76.5	178.1	-74.4	-173.2	-19.8	0	0	111.7	C1047 H1051	C1047-Q1049 PolarHBondContact O-N 3.32Å; Q1049-H1051 PolarHBondContact O-N 3.05Å
1050	H	36.7	Very low	51.9	Low	143 Å²	143	99.8 Å²	99.8	66%	0.662	54%	0.539	S	S	*	.			trans	-73.9	116.5	166.8	-69.6	73.6	0	0	0	107.9	L1048 I1052	L1048-H1050 PolarHBondContact O-N 2.9Å; L1048-H1050 PolarHBondContact O-ND1 2.78Å; H1050-I1052 WeakPolarHBondContact O-CG1 3.37Å; H1050-I1052 PolarHBondContact O-N 3.1Å; H1050-I1052 VanDerWaalsContact O-N 3.08Å
1051	H	44.4	Very low	54	Low	146 Å²	146	91.6 Å²	91.6	68%	0.676	51%	0.511	S	S	*	.			trans	-55.6	115.6	160.8	-68.7	-92.1	0	0	0	107.6	Q1049 L1053	Q1049-H1051 PolarHBondContact O-N 3.05Å; H1051-L1053 VanDerWaalsContact C-N 3.26Å; H1051-L1053 PolarHBondContact O-N 2.94Å
1052	I	49.8	Very low	55.5	Low	103 Å²	103	92.8 Å²	92.8	53%	0.528	50%	0.499	S	S	.	.			trans	-77.6	82.3	-173.2	-54.6	-176.9	0	0	0	109	P1031 H1050	P1031-I1052 HydrophobicContact CB-CD1 4.29Å; P1031-I1052 HydrophobicContact CG-CD1 4.5Å; H1050-I1052 WeakPolarHBondContact O-CG1 3.37Å; H1050-I1052 PolarHBondContact O-N 3.1Å; H1050-I1052 VanDerWaalsContact O-N 3.08Å
1053	L	60.5	Low	57.7	Low	79 Å²	79	92.2 Å²	92.2	41%	0.414	50%	0.503	S	S	.	.			trans	-66	125.7	173.5	-67.7	166.9	0	0	0	110	D967 H1051 K1055	D967-L1053 HydrophobicContact CB-CD2 3.65Å; H1051-L1053 VanDerWaalsContact C-N 3.26Å; H1051-L1053 PolarHBondContact O-N 2.94Å; L1053-K1055 PolarHBondContact O-N 3.37Å; L1053-K1055 VanDerWaalsContact O-N 3.17Å
1054	V	72.7	Confident	60.5	Low	24 Å²	24	92.1 Å²	92.1	15%	0.145	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	106.8	170.8	178.4	0	0	0	0	108	I966 T1026 L1028 F1056	I966-V1054 PolarHBondContact N-O 3.45Å; I966-V1054 PolarHBondContact O-N 2.92Å; T1026-V1054 HydrophobicContact CG2-CG1 4.11Å; L1028-V1054 HydrophobicContact CD2-CB 4.39Å; L1028-V1054 HydrophobicContact CD2-CG1 4.35Å; L1028-V1054 HydrophobicContact CD2-CG2 3.82Å; V1054-F1056 HydrophobicContact CG1-CD2 4.42Å; V1054-F1056 HydrophobicContact CG1-CE2 3.86Å; V1054-F1056 HydrophobicContact CG1-CZ 4.03Å
1055	K	77.8	Confident	63.1	Low	69 Å²	69	84.3 Å²	84.3	30%	0.3	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	116.5	-177.7	-176.6	173.2	-168.5	-159.3	0	111.5	S963 N965 L1053 N1057 G1072	S963-K1055 VanDerWaalsContact CB-CE 3.45Å; S963-K1055 WeakPolarHBondContact OG-CE 3.4Å; S963-K1055 PolarHBondContact OG-NZ 2.95Å; S963-K1055 VanDerWaalsContact OG-NZ 3.16Å; N965-K1055 WeakPolarHBondContact OD1-CG 3.46Å; L1053-K1055 PolarHBondContact O-N 3.37Å; L1053-K1055 VanDerWaalsContact O-N 3.17Å; K1055-N1057 WeakPolarHBondContact CE-OD1 3.39Å; K1055-N1057 PolarHBondContact NZ-OD1 3.48Å; K1055-G1072 PolarHBondContact O-N 2.73Å
1056	F	85.2	Confident	66.1	Low	0 Å²	0	80.5 Å²	80.5	0%	0	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	121.4	167.5	-68.7	-68.1	0	0	0	110.6	S963 I964 I966 F989 H994 T1026 V1054 I1069 L1070 E1071	S963-F1056 WeakPolarHBondContact CA-O 3.23Å; I964-F1056 PolarHBondContact N-O 3.21Å; I964-F1056 PolarHBondContact O-N 3.33Å; I966-F1056 HydrophobicContact CD1-CD2 3.95Å; I966-F1056 HydrophobicContact CD1-CE2 3.9Å; I966-F1056 HydrophobicContact CG1-CD2 4.44Å; F989-F1056 HydrophobicContact CD1-CE2 4.06Å; F989-F1056 AromaticContact CD1-CZ 3.78Å; F989-F1056 HydrophobicContact CD1-CZ 3.78Å; F989-F1056 HydrophobicContact CD2-CE2 4.16Å; F989-F1056 HydrophobicContact CD2-CZ 4.42Å; F989-F1056 AromaticContact CE1-CE2 3.89Å; F989-F1056 HydrophobicContact CE1-CE2 3.89Å; F989-F1056 AromaticContact CE1-CZ 3.98Å; F989-F1056 HydrophobicContact CE1-CZ 3.98Å; F989-F1056 HydrophobicContact CE2-CE2 4.02Å; F989-F1056 HydrophobicContact CG-CE2 4.2Å; F989-F1056 HydrophobicContact CG-CZ 4.01Å; F989-F1056 AromaticContact CZ-CE2 3.88Å; F989-F1056 HydrophobicContact CZ-CE2 3.88Å; F989-F1056 HydrophobicContact CZ-CZ 4.42Å; H994-F1056 AromaticContact CE1-CE1 3.89Å; T1026-F1056 HydrophobicContact CG2-CZ 4Å; V1054-F1056 HydrophobicContact CG1-CD2 4.42Å; V1054-F1056 HydrophobicContact CG1-CE2 3.86Å; V1054-F1056 HydrophobicContact CG1-CZ 4.03Å; F1056-I1069 HydrophobicContact CB-CG2 4.1Å; F1056-I1069 HydrophobicContact CD1-CG2 3.68Å; F1056-I1069 HydrophobicContact CE1-CG2 4.47Å; F1056-I1069 HydrophobicContact CG-CG2 4.17Å; F1056-L1070 CarbonylContact C-O 3.47Å; F1056-L1070 VanDerWaalsContact CA-O 3.32Å; F1056-L1070 WeakPolarHBondContact CA-O 3.38Å; F1056-E1071 HydrophobicContact CD1-CB 4.39Å; F1056-E1071 HydrophobicContact CE1-CB 4.11Å; F1056-E1071 HydrophobicContact CE1-CG 4.29Å
1057	N	83.3	Confident	69.2	Low	41 Å²	41	74.6 Å²	74.6	22%	0.219	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	121.1	168.4	-57.3	-60.4	0	0	0	108.4	S963 K1055 L1070 G1072	S963-N1057 PolarHBondContact OG-OD1 2.83Å; K1055-N1057 WeakPolarHBondContact CE-OD1 3.39Å; K1055-N1057 PolarHBondContact NZ-OD1 3.48Å; N1057-L1070 HydrophobicContact CB-CB 4.29Å; N1057-L1070 PolarHBondContact N-O 3.08Å; N1057-L1070 PolarHBondContact O-N 3.17Å; N1057-G1072 PolarHBondContact ND2-O 2.77Å; N1057-G1072 VanDerWaalsContact ND2-O 3.1Å
1058	I	88.8	Confident	72.1	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.005	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	118.1	-173.7	-55.5	165.5	0	0	0	108.5	S961 C962 I964 N997 A1001 V1060 E1068 I1069	S961-I1058 CarbonylContact C-O 3.59Å; S961-I1058 WeakPolarHBondContact CA-O 3.38Å; C962-I1058 PolarHBondContact N-O 3.23Å; C962-I1058 PolarHBondContact O-N 3.35Å; I964-I1058 HydrophobicContact CB-CD1 4.43Å; I964-I1058 HydrophobicContact CD1-CD1 3.56Å; I964-I1058 HydrophobicContact CG1-CD1 3.89Å; N997-I1058 HydrophobicContact CB-CD1 3.82Å; A1001-I1058 HydrophobicContact CB-CB 4.06Å; A1001-I1058 HydrophobicContact CB-CD1 3.98Å; A1001-I1058 HydrophobicContact CB-CG2 3.63Å; I1058-V1060 HydrophobicContact CG2-CG2 4.28Å; I1058-E1068 CarbonylContact C-O 3.33Å; I1058-E1068 WeakPolarHBondContact CA-O 3.3Å; I1058-I1069 HydrophobicContact CG1-CG1 4.22Å; I1058-I1069 HydrophobicContact CG1-CG2 4.19Å; I1058-I1069 HydrophobicContact CG2-CG1 4.3Å
1059	L	87.1	Confident	74.9	Confident	68 Å²	68	67.4 Å²	67.4	36%	0.356	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	138.6	177.1	-71.7	150.9	0	0	0	109.1	F1067 E1068 L1070	L1059-F1067 WeakPolarHBondContact O-CA 3.47Å; L1059-F1067 WeakPolarHBondContact O-CB 3.46Å; L1059-E1068 HydrophobicContact CB-CB 4.41Å; L1059-E1068 PolarHBondContact N-O 3.22Å; L1059-E1068 PolarHBondContact O-N 3.33Å; L1059-L1070 HydrophobicContact CD1-CD1 4.08Å
1060	V	86.4	Confident	77.5	Confident	13 Å²	13	60 Å²	60	8%	0.079	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	116.8	178.7	-174.3	0	0	0	0	110.9	A960 V1002 I1005 I1058 W1062 N1066 F1067	A960-V1060 PolarHBondContact O-N 3.39Å; V1002-V1060 HydrophobicContact CG2-CG1 3.86Å; V1002-V1060 HydrophobicContact CG2-CG2 4.34Å; I1005-V1060 HydrophobicContact CD1-CB 4.04Å; I1005-V1060 HydrophobicContact CD1-CG2 3.88Å; I1058-V1060 HydrophobicContact CG2-CG2 4.28Å; V1060-W1062 PolarHBondContact O-N 3.04Å; V1060-W1062 VanDerWaalsContact O-N 3.14Å; V1060-N1066 WeakPolarHBondContact CA-O 3.43Å; V1060-F1067 HydrophobicContact CG2-CB 4.31Å
1061	G	82.1	Confident	79.6	Confident	28 Å²	28	54.9 Å²	54.9	29%	0.289	29%	0.289	S	S	.	.			trans	-70.4	102.7	175.9	0	0	0	0	0	111.8	T1063 T1064 G1065 N1066	G1061-T1063 VanDerWaalsContact C-N 3.26Å; G1061-T1063 PolarHBondContact O-N 3.24Å; G1061-T1064 PolarHBondContact O-N 3.17Å; G1061-T1064 VanDerWaalsContact O-N 3.16Å; G1061-T1064 PolarHBondContact O-OG1 3.39Å; G1061-G1065 PolarHBondContact O-N 2.97Å; G1061-N1066 PolarHBondContact N-O 3.4Å
1062	W	70.8	Confident	81	Confident	102 Å²	102	49.6 Å²	49.6	39%	0.386	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.5	-38.7	-171.1	-97.6	59.3	0	0	0	115.9	L958 A959 I1005 R1006 V1060	L958-W1062 HydrophobicContact CB-CH2 4.06Å; L958-W1062 HydrophobicContact CB-CZ2 3.81Å; L958-W1062 HydrophobicContact CD1-CH2 3.9Å; L958-W1062 HydrophobicContact CD1-CZ3 4.11Å; L958-W1062 HydrophobicContact CD2-CH2 3.87Å; L958-W1062 HydrophobicContact CD2-CZ2 4.2Å; L958-W1062 HydrophobicContact CG-CH2 4.16Å; L958-W1062 HydrophobicContact CG-CZ2 4.39Å; A959-W1062 PolarHBondContact O-NE1 3.44Å; I1005-W1062 HydrophobicContact CG2-CZ2 4.08Å; R1006-W1062 PolarHBondContact NH2-O 3.44Å; V1060-W1062 PolarHBondContact O-N 3.04Å; V1060-W1062 VanDerWaalsContact O-N 3.14Å
1063	T	74.4	Confident	82.1	Confident	142 Å²	142	52.2 Å²	52.2	87%	0.871	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-24	-178.3	50	0	0	0	0	114.6	G1061	G1061-T1063 VanDerWaalsContact C-N 3.26Å; G1061-T1063 PolarHBondContact O-N 3.24Å
1064	T	84	Confident	82.9	Confident	64 Å²	64	51.4 Å²	51.4	39%	0.393	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-30.1	-177.6	54.4	0	0	0	0	112.7	G1061 N1066 R1080	G1061-T1064 PolarHBondContact O-N 3.17Å; G1061-T1064 VanDerWaalsContact O-N 3.16Å; G1061-T1064 PolarHBondContact O-OG1 3.39Å; T1064-N1066 PolarHBondContact OG1-N 3.15Å; T1064-R1080 PolarHBondContact O-NE 2.82Å; T1064-R1080 PolarHBondContact O-NH2 2.73Å
1065	G	85	Confident	83.5	Confident	11 Å²	11	53.4 Å²	53.4	11%	0.113	30%	0.3	C	S	.	.			trans	80.4	-2.1	-167.4	0	0	0	0	0	113.6	G1061 R1080 I1081	G1061-G1065 PolarHBondContact O-N 2.97Å; G1065-R1080 CarbonylContact O-C 3.52Å; G1065-R1080 WeakPolarHBondContact O-CA 3.02Å; G1065-I1081 VanDerWaalsContact CA-O 3.24Å; G1065-I1081 WeakPolarHBondContact CA-O 3.41Å; G1065-I1081 WeakPolarHBondContact O-CG2 3.47Å; G1065-I1081 PolarHBondContact O-N 3.34Å
1066	N	91.7	Very high	84	Confident	86 Å²	86	50.1 Å²	50.1	46%	0.46	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	139.1	-178.7	-63.3	9.8	0	0	0	110.2	V1060 G1061 T1064 G1079	V1060-N1066 WeakPolarHBondContact CA-O 3.43Å; G1061-N1066 PolarHBondContact N-O 3.4Å; T1064-N1066 PolarHBondContact OG1-N 3.15Å; N1066-G1079 CarbonylContact C-O 3.57Å; N1066-G1079 WeakPolarHBondContact CA-O 3.22Å
1067	F	93.1	Very high	84.3	Confident	3 Å²	3	50.1 Å²	50.1	1%	0.013	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	150.1	175	74.5	-91.8	0	0	0	112.5	A998 I1017 V1020 L1059 V1060 I1069 S1078 G1079 I1081	A998-F1067 HydrophobicContact CB-CD1 4.27Å; A998-F1067 HydrophobicContact CB-CD2 3.73Å; A998-F1067 HydrophobicContact CB-CE1 4.23Å; A998-F1067 HydrophobicContact CB-CE2 3.7Å; A998-F1067 HydrophobicContact CB-CG 4.03Å; A998-F1067 HydrophobicContact CB-CZ 3.95Å; I1017-F1067 HydrophobicContact CG2-CE1 4Å; I1017-F1067 HydrophobicContact CG2-CZ 4.39Å; V1020-F1067 HydrophobicContact CG2-CZ 4.26Å; L1059-F1067 WeakPolarHBondContact O-CA 3.47Å; L1059-F1067 WeakPolarHBondContact O-CB 3.46Å; V1060-F1067 HydrophobicContact CG2-CB 4.31Å; F1067-I1069 HydrophobicContact CD2-CD1 4.28Å; F1067-I1069 HydrophobicContact CD2-CG1 3.98Å; F1067-I1069 HydrophobicContact CE2-CD1 4.09Å; F1067-I1069 HydrophobicContact CE2-CG1 4.18Å; F1067-S1078 VanDerWaalsContact O-CA 3.32Å; F1067-S1078 WeakPolarHBondContact O-CA 3.26Å; F1067-G1079 VanDerWaalsContact CD1-C 3.43Å; F1067-G1079 VanDerWaalsContact CE1-C 3.41Å; F1067-G1079 PolarHBondContact N-O 3.18Å; F1067-G1079 PolarHBondContact O-N 3.27Å; F1067-I1081 HydrophobicContact CB-CG2 4.38Å; F1067-I1081 HydrophobicContact CD1-CB 4.07Å; F1067-I1081 HydrophobicContact CD1-CG2 3.78Å; F1067-I1081 HydrophobicContact CE1-CB 4.4Å; F1067-I1081 HydrophobicContact CG-CG2 4.43Å
1068	E	92.6	Very high	84.8	Confident	99 Å²	99	48.9 Å²	48.9	46%	0.463	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	138.2	175.1	-67.5	177	178.2	0	0	108.8	I1058 L1059 L1075	I1058-E1068 CarbonylContact C-O 3.33Å; I1058-E1068 WeakPolarHBondContact CA-O 3.3Å; L1059-E1068 HydrophobicContact CB-CB 4.41Å; L1059-E1068 PolarHBondContact N-O 3.22Å; L1059-E1068 PolarHBondContact O-N 3.33Å; E1068-L1075 HydrophobicContact CB-CD1 4.04Å; E1068-L1075 HydrophobicContact CG-CD1 4.35Å
1069	I	91.9	Very high	85	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	117.4	179.8	-52.8	-173.2	0	0	0	108.6	H994 A998 F1056 I1058 F1067 A1076 A1077	H994-I1069 HydrophobicContact CB-CD1 3.95Å; H994-I1069 VanDerWaalsContact O-CD1 3.31Å; H994-I1069 WeakPolarHBondContact O-CD1 3.33Å; A998-I1069 HydrophobicContact CB-CD1 4.41Å; F1056-I1069 HydrophobicContact CB-CG2 4.1Å; F1056-I1069 HydrophobicContact CD1-CG2 3.68Å; F1056-I1069 HydrophobicContact CE1-CG2 4.47Å; F1056-I1069 HydrophobicContact CG-CG2 4.17Å; I1058-I1069 HydrophobicContact CG1-CG1 4.22Å; I1058-I1069 HydrophobicContact CG1-CG2 4.19Å; I1058-I1069 HydrophobicContact CG2-CG1 4.3Å; F1067-I1069 HydrophobicContact CD2-CD1 4.28Å; F1067-I1069 HydrophobicContact CD2-CG1 3.98Å; F1067-I1069 HydrophobicContact CE2-CD1 4.09Å; F1067-I1069 HydrophobicContact CE2-CG1 4.18Å; I1069-A1076 PolarHBondContact O-N 2.8Å; I1069-A1077 HydrophobicContact CB-CB 4.24Å; I1069-A1077 HydrophobicContact CD1-CB 4.36Å; I1069-A1077 HydrophobicContact CG1-CB 4.43Å; I1069-A1077 PolarHBondContact N-O 2.83Å; I1069-A1077 PolarHBondContact O-N 2.9Å
1070	L	88.5	Confident	85.3	Confident	37 Å²	37	50.5 Å²	50.5	19%	0.194	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.7	178.2	-48.1	176.8	0	0	0	110.1	F1056 N1057 L1059 G1072 S1074 L1075	F1056-L1070 CarbonylContact C-O 3.47Å; F1056-L1070 VanDerWaalsContact CA-O 3.32Å; F1056-L1070 WeakPolarHBondContact CA-O 3.38Å; N1057-L1070 HydrophobicContact CB-CB 4.29Å; N1057-L1070 PolarHBondContact N-O 3.08Å; N1057-L1070 PolarHBondContact O-N 3.17Å; L1059-L1070 HydrophobicContact CD1-CD1 4.08Å; L1070-G1072 WeakPolarHBondContact CB-O 3.2Å; L1070-S1074 CarbonylContact C-O 3.58Å; L1070-S1074 VanDerWaalsContact CA-O 3.28Å; L1070-S1074 WeakPolarHBondContact CA-O 3.37Å; L1070-L1075 HydrophobicContact CD2-CB 4.22Å; L1070-L1075 HydrophobicContact CD2-CD1 3.96Å
1071	E	81.9	Confident	85.7	Confident	36 Å²	36	50.1 Å²	50.1	17%	0.168	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	101.3	165	-173.5	-169.1	150.1	0	0	107.3	R1024 T1026 F1056 D1073 S1074 A1076	R1024-E1071 IonicContact CZ-OE1 3.16Å; R1024-E1071 IonicContact CZ-OE2 3.5Å; R1024-E1071 IonicContact NE-OE1 2.76Å; R1024-E1071 IonicContact NE-OE2 3.21Å; R1024-E1071 PolarHBondContact NE-OE2 3.13Å; R1024-E1071 VanDerWaalsContact NH2-CD 3.33Å; R1024-E1071 IonicContact NH2-OE1 3.81Å; R1024-E1071 PolarHBondContact NH2-OE1 3.08Å; R1024-E1071 IonicContact NH2-OE2 3.91Å; R1024-E1071 PolarHBondContact NH2-OE2 2.98Å; T1026-E1071 VanDerWaalsContact CB-OE2 3.31Å; T1026-E1071 WeakPolarHBondContact CB-OE2 3.43Å; T1026-E1071 VanDerWaalsContact CG2-CD 3.45Å; T1026-E1071 HydrophobicContact CG2-CG 4.15Å; T1026-E1071 WeakPolarHBondContact CG2-OE2 3.29Å; T1026-E1071 PolarHBondContact OG1-OE2 3.43Å; F1056-E1071 HydrophobicContact CD1-CB 4.39Å; F1056-E1071 HydrophobicContact CE1-CB 4.11Å; F1056-E1071 HydrophobicContact CE1-CG 4.29Å; E1071-D1073 PolarHBondContact O-N 2.94Å; E1071-D1073 VanDerWaalsContact O-N 3.14Å; E1071-S1074 PolarHBondContact N-O 3.09Å; E1071-S1074 PolarHBondContact O-N 3.38Å; E1071-A1076 HydrophobicContact CB-CB 4.26Å
1072	G	73.3	Confident	86.1	Confident	35 Å²	35	51.3 Å²	51.3	36%	0.361	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	-114.1	-161.4	0	0	0	0	0	110.6	K1055 N1057 L1070	K1055-G1072 PolarHBondContact O-N 2.73Å; N1057-G1072 PolarHBondContact ND2-O 2.77Å; N1057-G1072 VanDerWaalsContact ND2-O 3.1Å; L1070-G1072 WeakPolarHBondContact CB-O 3.2Å
1073	D	73	Confident	87	Confident	158 Å²	158	47.9 Å²	47.9	85%	0.845	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-0.6	175.9	-58.4	-42.9	0	0	0	113.5	E1071	E1071-D1073 PolarHBondContact O-N 2.94Å; E1071-D1073 VanDerWaalsContact O-N 3.14Å
1074	S	77.5	Confident	87.4	Confident	63 Å²	63	43 Å²	43	44%	0.441	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	129.8	-176.3	-68.2	0	0	0	0	112.6	L1070 E1071 A1076	L1070-S1074 CarbonylContact C-O 3.58Å; L1070-S1074 VanDerWaalsContact CA-O 3.28Å; L1070-S1074 WeakPolarHBondContact CA-O 3.37Å; E1071-S1074 PolarHBondContact N-O 3.09Å; E1071-S1074 PolarHBondContact O-N 3.38Å; S1074-A1076 PolarHBondContact O-N 2.96Å; S1074-A1076 VanDerWaalsContact O-N 3.15Å
1075	L	85.3	Confident	86.8	Confident	66 Å²	66	48.4 Å²	48.4	35%	0.346	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	112.6	176.5	-175.2	67.3	0	0	0	111.6	Y1023 E1068 L1070 A1077	Y1023-L1075 HydrophobicContact CD2-CD2 3.88Å; Y1023-L1075 HydrophobicContact CD2-CG 3.89Å; Y1023-L1075 HydrophobicContact CE2-CD2 3.55Å; Y1023-L1075 HydrophobicContact CE2-CG 3.94Å; E1068-L1075 HydrophobicContact CB-CD1 4.04Å; E1068-L1075 HydrophobicContact CG-CD1 4.35Å; L1070-L1075 HydrophobicContact CD2-CB 4.22Å; L1070-L1075 HydrophobicContact CD2-CD1 3.96Å; L1075-A1077 WeakPolarHBondContact CD1-O 3.46Å
1076	A	88.1	Confident	85.6	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-47	176.1	0	0	0	0	0	111.5	Y1023 I1069 E1071 S1074	Y1023-A1076 PolarHBondContact N-O 3.48Å; I1069-A1076 PolarHBondContact O-N 2.8Å; E1071-A1076 HydrophobicContact CB-CB 4.26Å; S1074-A1076 PolarHBondContact O-N 2.96Å; S1074-A1076 VanDerWaalsContact O-N 3.15Å
1077	A	91.7	Very high	84	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	153.4	-177.3	0	0	0	0	0	112.6	H994 H1021 V1022 I1069 L1075	H994-A1077 HydrophobicContact CB-CB 4.13Å; H1021-A1077 CarbonylContact O-C 3.59Å; H1021-A1077 VanDerWaalsContact O-CA 3.3Å; H1021-A1077 WeakPolarHBondContact O-CA 3.38Å; V1022-A1077 HydrophobicContact CG2-CB 3.89Å; I1069-A1077 HydrophobicContact CB-CB 4.24Å; I1069-A1077 HydrophobicContact CD1-CB 4.36Å; I1069-A1077 HydrophobicContact CG1-CB 4.43Å; I1069-A1077 PolarHBondContact N-O 2.83Å; I1069-A1077 PolarHBondContact O-N 2.9Å; L1075-A1077 WeakPolarHBondContact CD1-O 3.46Å
1078	S	93.7	Very high	82	Confident	15 Å²	15	66.2 Å²	66.2	11%	0.105	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	165	168.1	76.7	0	0	0	0	111.3	V1020 H1021 Y1023 F1067	V1020-S1078 WeakPolarHBondContact CA-O 3.49Å; H1021-S1078 PolarHBondContact N-O 2.77Å; H1021-S1078 PolarHBondContact O-N 2.82Å; Y1023-S1078 PolarHBondContact OH-OG 2.66Å; F1067-S1078 VanDerWaalsContact O-CA 3.32Å; F1067-S1078 WeakPolarHBondContact O-CA 3.26Å
1079	G	93.4	Very high	80.4	Confident	11 Å²	11	68.9 Å²	68.9	11%	0.113	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.6	-155.4	173.4	0	0	0	0	0	112.2	D1019 N1066 F1067	D1019-G1079 WeakPolarHBondContact O-CA 3.41Å; N1066-G1079 CarbonylContact C-O 3.57Å; N1066-G1079 WeakPolarHBondContact CA-O 3.22Å; F1067-G1079 VanDerWaalsContact CD1-C 3.43Å; F1067-G1079 VanDerWaalsContact CE1-C 3.41Å; F1067-G1079 PolarHBondContact N-O 3.18Å; F1067-G1079 PolarHBondContact O-N 3.27Å
1080	R	94	Very high	78.9	Confident	91 Å²	91	72.9 Å²	72.9	34%	0.343	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	144.6	174.9	-171.2	179.7	-172	-129.6	0.7	110.9	I1017 E1018 T1064 G1065	I1017-R1080 CarbonylContact C-O 3.59Å; I1017-R1080 VanDerWaalsContact CA-O 3.29Å; I1017-R1080 WeakPolarHBondContact CA-O 3.47Å; I1017-R1080 WeakPolarHBondContact CG2-O 3.21Å; E1018-R1080 HydrophobicContact CB-CB 4.28Å; E1018-R1080 PolarHBondContact N-O 2.97Å; E1018-R1080 PolarHBondContact O-N 3.41Å; E1018-R1080 IonicContact OE2-CZ 2.65Å; E1018-R1080 IonicContact OE2-NH1 2.8Å; E1018-R1080 PolarHBondContact OE2-NH1 2.88Å; T1064-R1080 PolarHBondContact O-NE 2.82Å; T1064-R1080 PolarHBondContact O-NH2 2.73Å; G1065-R1080 CarbonylContact O-C 3.52Å; G1065-R1080 WeakPolarHBondContact O-CA 3.02Å
1081	I	93.4	Very high	77.9	Confident	5 Å²	5	71.3 Å²	71.3	3%	0.026	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	134.1	178.9	-177.2	163.8	0	0	0	110.8	W999 V1002 L1016 I1017 G1065 F1067	W999-I1081 HydrophobicContact CB-CD1 4.07Å; V1002-I1081 HydrophobicContact CB-CD1 4.17Å; V1002-I1081 HydrophobicContact CG1-CD1 4.49Å; V1002-I1081 HydrophobicContact CG2-CD1 4.08Å; V1002-I1081 HydrophobicContact CG2-CG1 4.24Å; V1002-I1081 HydrophobicContact CG2-CG2 3.51Å; L1016-I1081 CarbonylContact O-C 3.57Å; L1016-I1081 WeakPolarHBondContact O-CA 3.33Å; I1017-I1081 HydrophobicContact CD1-CD1 4.15Å; I1017-I1081 HydrophobicContact CG1-CB 4.49Å; I1017-I1081 HydrophobicContact CG1-CD1 4.05Å; I1017-I1081 HydrophobicContact CG1-CG1 4.09Å; G1065-I1081 VanDerWaalsContact CA-O 3.24Å; G1065-I1081 WeakPolarHBondContact CA-O 3.41Å; G1065-I1081 WeakPolarHBondContact O-CG2 3.47Å; G1065-I1081 PolarHBondContact O-N 3.34Å; F1067-I1081 HydrophobicContact CB-CG2 4.38Å; F1067-I1081 HydrophobicContact CD1-CB 4.07Å; F1067-I1081 HydrophobicContact CD1-CG2 3.78Å; F1067-I1081 HydrophobicContact CE1-CB 4.4Å; F1067-I1081 HydrophobicContact CG-CG2 4.43Å
1082	T	91	Very high	77.3	Confident	54 Å²	54	71.7 Å²	71.7	33%	0.331	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	138.2	-177.5	-46.1	0	0	0	0	109.3	V1015 L1016	V1015-T1082 WeakPolarHBondContact CA-O 3.43Å; L1016-T1082 PolarHBondContact N-O 3.05Å; L1016-T1082 PolarHBondContact O-N 2.85Å
1083	I	89	Confident	77.4	Confident	29 Å²	29	71.1 Å²	71.1	15%	0.149	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	134.4	172	-60.2	-179.6	0	0	0	108.5	V1002 L1008 T1013 V1015	V1002-I1083 HydrophobicContact CG1-CD1 3.86Å; V1002-I1083 HydrophobicContact CG1-CG1 3.97Å; L1008-I1083 HydrophobicContact CD1-CD1 3.4Å; T1013-I1083 HydrophobicContact CG2-CD1 3.94Å; T1013-I1083 HydrophobicContact CG2-CG1 4.11Å; T1013-I1083 HydrophobicContact CG2-CG2 3.87Å; V1015-I1083 HydrophobicContact CG1-CG1 4.31Å
1084	I	84.2	Confident	77.4	Confident	40 Å²	40	67.8 Å²	67.8	21%	0.205	34%	0.339	C	S	.	.			trans	-85.7	130.3	-178.7	-55.5	175.9	0	0	0	109	P1014 L1016 R1181	P1014-I1084 HydrophobicContact CB-CB 4.35Å; P1014-I1084 HydrophobicContact CG-CB 4.35Å; P1014-I1084 PolarHBondContact O-N 3.11Å; L1016-I1084 HydrophobicContact CB-CD1 4.12Å; L1016-I1084 HydrophobicContact CB-CG1 4.08Å; I1084-R1181 HydrophobicContact CD1-CG 3.84Å
1085	Q	71.5	Confident	77.1	Confident	178 Å²	178	68.3 Å²	68.3	83%	0.832	34%	0.337	S	S	*	.			trans	-122.2	-21.6	178.6	-66.3	-171	-41.3	0	0	114.1
1086	D	59.7	Low	76.7	Confident	129 Å²	129	67 Å²	67	69%	0.69	33%	0.329	S	S	*	.			trans	-118.4	145.2	178.8	-69.2	-62.5	0	0	0	111.8
1087	E	57	Low	75.9	Confident	153 Å²	153	71 Å²	71	72%	0.715	36%	0.362	S	S	*	.			trans	-84.2	-7.5	-177.4	-65.6	-159.1	111.5	0	0	114.8	R1089 K1186	E1087-R1089 PolarHBondContact O-N 3.13Å; E1087-K1186 IonicContact OE1-NZ 3.6Å
1088	E	52	Low	74.9	Confident	192 Å²	192	78 Å²	78	90%	0.897	39%	0.394	S	S	*	.			trans	-59.9	-9.7	-165.1	-63.3	-162.9	143.4	0	0	116.8
1089	R	57.8	Low	73.9	Confident	154 Å²	154	77.9 Å²	77.9	58%	0.581	39%	0.392	S	S	*	.	S	Bend	trans	-95.5	101.4	174.3	-72.2	-174.9	175.3	-174.2	-2.2	111.2	E1087 S1091 R1181	E1087-R1089 PolarHBondContact O-N 3.13Å; R1089-S1091 PolarHBondContact O-N 3.1Å; R1089-R1181 PolarHBondContact O-NH1 3.03Å
1090	S	60.4	Low	72.7	Confident	84 Å²	84	81.7 Å²	81.7	59%	0.587	42%	0.415	S	S	*	.			trans	-48.2	126.5	166.4	-179.8	0	0	0	0	111.3
1091	S	68.4	Low	71.6	Confident	4 Å²	4	79.5 Å²	79.5	3%	0.028	41%	0.41	C	S	.	.			trans	-91.5	166.3	175.2	74.3	0	0	0	0	112.6	R1089 Y1093 E1094 E1217	R1089-S1091 PolarHBondContact O-N 3.1Å; S1091-Y1093 WeakPolarHBondContact OG-CD2 3.44Å; S1091-Y1093 WeakPolarHBondContact OG-CE2 3.31Å; S1091-Y1093 VanDerWaalsContact OG-CG 3.24Å; S1091-Y1093 PolarHBondContact OG-N 2.83Å; S1091-E1094 PolarHBondContact N-OE2 3.23Å; S1091-E1094 VanDerWaalsContact N-OE2 3.08Å; S1091-E1094 WeakPolarHBondContact OG-CB 3.32Å; S1091-E1094 VanDerWaalsContact OG-CD 3.3Å; S1091-E1094 WeakPolarHBondContact OG-CG 3.43Å; S1091-E1094 PolarHBondContact OG-N 3.27Å; S1091-E1094 PolarHBondContact OG-OE2 3.07Å; S1091-E1217 WeakPolarHBondContact CA-OE2 3.44Å; S1091-E1217 VanDerWaalsContact CB-OE2 3.27Å; S1091-E1217 WeakPolarHBondContact CB-OE2 3.4Å
1092	L	68.7	Low	70.4	Confident	45 Å²	45	84.4 Å²	84.4	24%	0.236	43%	0.428	C	S	.	.	S	Bend	trans	-68.5	-33.5	166	-81.8	168.8	0	0	0	112.3	N1095 F1096 V1099 A1212 E1217	L1092-N1095 CarbonylContact O-C 3.56Å; L1092-N1095 VanDerWaalsContact O-C 3.23Å; L1092-N1095 PolarHBondContact O-N 3.49Å; L1092-F1096 PolarHBondContact O-N 2.59Å; L1092-F1096 VanDerWaalsContact O-N 3.1Å; L1092-V1099 HydrophobicContact CD2-CG2 4.49Å; L1092-A1212 HydrophobicContact CB-CB 4.09Å; L1092-E1217 HydrophobicContact CB-CG 4.24Å; L1092-E1217 WeakPolarHBondContact CB-OE1 3.12Å; L1092-E1217 HydrophobicContact CD1-CG 4.33Å; L1092-E1217 WeakPolarHBondContact CD1-OE1 3.29Å; L1092-E1217 VanDerWaalsContact CG-OE1 3.23Å; L1092-E1217 WeakPolarHBondContact CG-OE1 3.33Å; L1092-E1217 PolarHBondContact N-OE1 2.94Å; L1092-E1217 PolarHBondContact N-OE2 2.73Å
1093	Y	75.8	Confident	68.8	Low	22 Å²	22	90.9 Å²	90.9	9%	0.086	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-71.8	-30	-177.6	55	-110.9	0	0	0	113.9	S1091 N1095 F1096 R1181 D1183 K1186 G1214 G1215 E1217	S1091-Y1093 WeakPolarHBondContact OG-CD2 3.44Å; S1091-Y1093 WeakPolarHBondContact OG-CE2 3.31Å; S1091-Y1093 VanDerWaalsContact OG-CG 3.24Å; S1091-Y1093 PolarHBondContact OG-N 2.83Å; Y1093-N1095 PolarHBondContact O-N 2.97Å; Y1093-F1096 WeakPolarHBondContact O-CB 3.43Å; Y1093-F1096 PolarHBondContact O-N 3.15Å; Y1093-R1181 HydrophobicContact CE1-CG 4.4Å; Y1093-R1181 PolarHBondContact OH-NE 2.96Å; Y1093-R1181 VanDerWaalsContact OH-NE 3.13Å; Y1093-D1183 WeakPolarHBondContact OH-CB 3.32Å; Y1093-K1186 HydrophobicContact CE2-CD 3.69Å; Y1093-G1214 WeakPolarHBondContact CB-O 3.41Å; Y1093-G1215 WeakPolarHBondContact CE1-O 3.42Å; Y1093-E1217 HydrophobicContact CD1-CB 3.92Å; Y1093-E1217 HydrophobicContact CE1-CB 4.24Å
1094	E	73.3	Confident	67.2	Low	88 Å²	88	96.6 Å²	96.6	41%	0.411	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-65.3	-18.7	172.5	-77.9	154.4	-177.5	0	0	112.2	S1091 K1186	S1091-E1094 PolarHBondContact N-OE2 3.23Å; S1091-E1094 VanDerWaalsContact N-OE2 3.08Å; S1091-E1094 WeakPolarHBondContact OG-CB 3.32Å; S1091-E1094 VanDerWaalsContact OG-CD 3.3Å; S1091-E1094 WeakPolarHBondContact OG-CG 3.43Å; S1091-E1094 PolarHBondContact OG-N 3.27Å; S1091-E1094 PolarHBondContact OG-OE2 3.07Å; E1094-K1186 IonicContact OE1-NZ 2.87Å; E1094-K1186 PolarHBondContact OE1-NZ 3.41Å
1095	N	71.9	Confident	66	Low	74 Å²	74	95.4 Å²	95.4	40%	0.396	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-122.9	30.4	177.1	-87.4	-72.5	0	0	0	112.6	L1092 Y1093 A1097 H1098	L1092-N1095 CarbonylContact O-C 3.56Å; L1092-N1095 VanDerWaalsContact O-C 3.23Å; L1092-N1095 PolarHBondContact O-N 3.49Å; Y1093-N1095 PolarHBondContact O-N 2.97Å; N1095-A1097 PolarHBondContact O-N 3Å; N1095-H1098 WeakPolarHBondContact O-CB 3.38Å; N1095-H1098 PolarHBondContact O-N 3.33Å; N1095-H1098 PolarHBondContact OD1-CE1 3.29Å; N1095-H1098 PolarHBondContact OD1-ND1 3.08Å
1096	F	75.6	Confident	65.3	Low	40 Å²	40	94 Å²	94	18%	0.175	47%	0.47	C	S	.	.	G	3₁₀ helix	trans	-48.3	-34	-173.3	-176.9	-99.6	0	0	0	115.1	L1092 Y1093 H1098 V1099 E1201 R1203 A1212	L1092-F1096 PolarHBondContact O-N 2.59Å; L1092-F1096 VanDerWaalsContact O-N 3.1Å; Y1093-F1096 WeakPolarHBondContact O-CB 3.43Å; Y1093-F1096 PolarHBondContact O-N 3.15Å; F1096-H1098 VanDerWaalsContact C-N 3.26Å; F1096-H1098 PolarHBondContact O-N 3.08Å; F1096-V1099 PolarHBondContact O-N 2.78Å; F1096-E1201 HydrophobicContact CE1-CB 4.07Å; F1096-E1201 HydrophobicContact CE1-CG 4.02Å; F1096-E1201 HydrophobicContact CZ-CB 3.81Å; F1096-E1201 HydrophobicContact CZ-CG 3.78Å; F1096-E1201 WeakPolarHBondContact CZ-O 3.39Å; F1096-R1203 HydrophobicContact CE1-CG 4.24Å; F1096-R1203 HydrophobicContact CE2-CB 4.13Å; F1096-R1203 HydrophobicContact CE2-CG 3.96Å; F1096-R1203 HydrophobicContact CZ-CB 4.32Å; F1096-R1203 HydrophobicContact CZ-CG 3.65Å; F1096-R1203 PolarHBondContact O-NH1 3.01Å; F1096-A1212 HydrophobicContact CD2-CB 4.25Å; F1096-A1212 WeakPolarHBondContact CE2-O 3.36Å
1097	A	71.6	Confident	65.7	Low	83 Å²	83	93.7 Å²	93.7	69%	0.686	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-63.8	-25.7	176.6	0	0	0	0	0	114.4	N1095	N1095-A1097 PolarHBondContact O-N 3Å
1098	H	71.4	Confident	66.5	Low	147 Å²	147	89.8 Å²	89.8	68%	0.681	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-84.6	-6.7	-177.9	-66.2	117.6	0	0	0	114.1	N1095 F1096 P1100	N1095-H1098 WeakPolarHBondContact O-CB 3.38Å; N1095-H1098 PolarHBondContact O-N 3.33Å; N1095-H1098 PolarHBondContact OD1-CE1 3.29Å; N1095-H1098 PolarHBondContact OD1-ND1 3.08Å; F1096-H1098 VanDerWaalsContact C-N 3.26Å; F1096-H1098 PolarHBondContact O-N 3.08Å; H1098-P1100 WeakPolarHBondContact O-CD 3.44Å
1099	V	72.2	Confident	68	Low	12 Å²	12	84 Å²	84	7%	0.073	42%	0.415	C	S	.	.	S	Bend	trans	-69.3	115.6	173.5	-176.7	0	0	0	0	108.7	L1092 F1096 R1203 D1205	L1092-V1099 HydrophobicContact CD2-CG2 4.49Å; F1096-V1099 PolarHBondContact O-N 2.78Å; V1099-R1203 HydrophobicContact CB-CB 4.19Å; V1099-R1203 HydrophobicContact CG1-CB 3.88Å; V1099-D1205 HydrophobicContact CG1-CB 4.24Å
1100	P	68.2	Low	69.5	Low	91 Å²	91	76.8 Å²	76.8	59%	0.591	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-77.1	142.9	-170.3	31.2	-34.9	0	0	0	112	H1098	H1098-P1100 WeakPolarHBondContact O-CD 3.44Å
1101	L	70.8	Confident	70.8	Confident	46 Å²	46	76.3 Å²	76.3	24%	0.241	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-102.3	151.8	174.6	-60.8	172.3	0	0	0	110	R1107 D1141 R1142	L1101-R1107 VanDerWaalsContact CB-NH2 3.32Å; L1101-D1141 HydrophobicContact CD2-CB 4.48Å; L1101-R1142 HydrophobicContact CD2-CB 4.16Å
1102	R	67.3	Low	71.8	Confident	107 Å²	107	78.1 Å²	78.1	40%	0.404	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-67.4	135.4	177.7	-67.7	174.3	172.9	159.5	-1.9	111	R1107 D1141	R1102-R1107 PolarHBondContact O-NH2 3.28Å; R1102-D1141 PolarHBondContact N-OD2 3.43Å
1103	E	57.2	Low	72.6	Confident	190 Å²	190	80.6 Å²	80.6	89%	0.888	41%	0.409	S	S	*	.	S	Bend	trans	-83.6	-25.3	-176.3	-60.7	-171	140.9	0	0	113.3	C1105	E1103-C1105 PolarHBondContact O-N 2.95Å
1104	E	56.9	Low	73.1	Confident	149 Å²	149	80.3 Å²	80.3	70%	0.696	41%	0.409	S	S	*	.	S	Bend	trans	-84.8	8.6	-165.3	-52.4	-177.1	134.5	0	0	116.3	R2084	E1104-R2084 IonicContact OE2-CZ 3.35Å; E1104-R2084 IonicContact OE2-NH1 3.31Å; E1104-R2084 PolarHBondContact OE2-NH1 3.13Å; E1104-R2084 IonicContact OE2-NH2 3.46Å; E1104-R2084 PolarHBondContact OE2-NH2 3.14Å
1105	C	57.4	Low	73.9	Confident	16 Å²	16	76.1 Å²	76.1	11%	0.108	39%	0.39	C	S	.	.			trans	-118	129.5	-164.9	-156.4	0	0	0	0	114	E1103 R1107 N1138 A1139 Y2080	E1103-C1105 PolarHBondContact O-N 2.95Å; C1105-R1107 PolarHBondContact O-N 3.1Å; C1105-N1138 PolarHBondContact SG-OD1 3.15Å; C1105-A1139 HydrophobicContact CB-CB 4.47Å; C1105-Y2080 HydrophobicContact CB-CE2 4.41Å
1106	E	58.6	Low	74.7	Confident	148 Å²	148	73.2 Å²	73.2	69%	0.692	37%	0.373	S	S	*	.			trans	-62.8	102.1	164.9	-72	-175.7	122.7	0	0	108.9	I1108 N1138	E1106-I1108 VanDerWaalsContact C-N 3.3Å; E1106-I1108 PolarHBondContact O-N 3.17Å; E1106-N1138 PolarHBondContact O-ND2 2.9Å; E1106-N1138 PolarHBondContact O-OD1 3.26Å
1107	R	66.9	Low	75.2	Confident	123 Å²	123	72.5 Å²	72.5	46%	0.464	37%	0.37	S	S	.	.			trans	-75.2	79	-173.9	-63.7	-171.8	-177	173.5	2.5	112.2	L1101 R1102 C1105	L1101-R1107 VanDerWaalsContact CB-NH2 3.32Å; R1102-R1107 PolarHBondContact O-NH2 3.28Å; C1105-R1107 PolarHBondContact O-N 3.1Å
1108	I	74.1	Confident	75.8	Confident	70 Å²	70	68.8 Å²	68.8	36%	0.359	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-89.8	135.9	165.8	-63.9	170	0	0	0	107.7	E1106 N1138 A2076	E1106-I1108 VanDerWaalsContact C-N 3.3Å; E1106-I1108 PolarHBondContact O-N 3.17Å; I1108-N1138 WeakPolarHBondContact O-CB 3.37Å; I1108-N1138 PolarHBondContact O-N 2.95Å; I1108-A2076 HydrophobicContact CB-CB 4.21Å; I1108-A2076 HydrophobicContact CD1-CB 3.64Å; I1108-A2076 HydrophobicContact CG2-CB 4.1Å
1109	E	83.7	Confident	76.6	Confident	71 Å²	71	61.8 Å²	61.8	33%	0.332	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	144.9	-178	-61.3	-128.2	129.7	0	0	112.4	Q1135 A1136 R1142 G2073	E1109-Q1135 PolarHBondContact OE2-NE2 2.98Å; E1109-A1136 CarbonylContact C-O 3.26Å; E1109-A1136 WeakPolarHBondContact CA-O 3.41Å; E1109-R1142 IonicContact OE1-CZ 3.3Å; E1109-R1142 IonicContact OE1-NH2 3.44Å; E1109-R1142 PolarHBondContact OE1-NH2 2.96Å; E1109-G2073 WeakPolarHBondContact O-CA 3.28Å
1110	L	88.2	Confident	77.3	Confident	2 Å²	2	62.2 Å²	62.2	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	126.2	168.2	-60	168	0	0	0	107.4	D1114 V1115 Q1135 A1136 L1164 R2077	L1110-D1114 HydrophobicContact CB-CB 3.89Å; L1110-D1114 HydrophobicContact CD2-CB 3.73Å; L1110-D1114 HydrophobicContact CG-CB 4.44Å; L1110-V1115 HydrophobicContact CB-CG2 3.76Å; L1110-V1115 HydrophobicContact CD1-CG2 4.29Å; L1110-Q1135 WeakPolarHBondContact O-CA 3.44Å; L1110-A1136 HydrophobicContact CB-CB 4.2Å; L1110-A1136 HydrophobicContact CD1-CB 4.13Å; L1110-A1136 PolarHBondContact N-O 2.9Å; L1110-A1136 PolarHBondContact O-N 2.97Å; L1110-L1164 HydrophobicContact CD1-CD2 4.12Å; L1110-R2077 HydrophobicContact CD2-CB 4.34Å
1111	T	89	Confident	77.9	Confident	75 Å²	75	59 Å²	59	46%	0.46	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	164.9	167.4	65.6	0	0	0	0	110.5	V1113 D1114 V1115	T1111-V1113 PolarHBondContact O-N 3.21Å; T1111-V1113 VanDerWaalsContact O-N 3.07Å; T1111-V1113 PolarHBondContact OG1-N 2.98Å; T1111-D1114 WeakPolarHBondContact CB-OD2 3.49Å; T1111-D1114 PolarHBondContact N-OD2 3.23Å; T1111-D1114 PolarHBondContact O-N 2.94Å; T1111-D1114 PolarHBondContact OG1-N 2.86Å; T1111-D1114 PolarHBondContact OG1-OD2 2.84Å; T1111-V1115 WeakPolarHBondContact O-CG2 3.29Å; T1111-V1115 PolarHBondContact O-N 2.99Å
1112	T	89.2	Confident	78.4	Confident	42 Å²	42	57.3 Å²	57.3	26%	0.258	28%	0.276	S	S	.	.	H	α-helix	trans	-41.1	-42.7	163.5	-57.3	0	0	0	0	112.5	V1115 Y1116 I1133 Y1134	T1112-V1115 PolarHBondContact O-N 2.83Å; T1112-Y1116 HydrophobicContact CG2-CD2 3.66Å; T1112-Y1116 HydrophobicContact CG2-CE2 3.89Å; T1112-Y1116 WeakPolarHBondContact O-CD2 3.49Å; T1112-Y1116 PolarHBondContact O-N 3Å; T1112-I1133 WeakPolarHBondContact CB-O 3.34Å; T1112-I1133 PolarHBondContact OG1-O 2.67Å; T1112-Y1134 PolarHBondContact N-O 3.46Å; T1112-Y1134 WeakPolarHBondContact OG1-CA 3.29Å; T1112-Y1134 PolarHBondContact OG1-O 3.48Å
1113	V	84.9	Confident	79.1	Confident	97 Å²	97	52.2 Å²	52.2	59%	0.588	26%	0.257	S	S	*	.	H	α-helix	trans	-69.4	-39	-179	-176.5	0	0	0	0	112.1	T1111 K1117	T1111-V1113 PolarHBondContact O-N 3.21Å; T1111-V1113 VanDerWaalsContact O-N 3.07Å; T1111-V1113 PolarHBondContact OG1-N 2.98Å; V1113-K1117 WeakPolarHBondContact O-CB 3.35Å; V1113-K1117 PolarHBondContact O-N 3.12Å; V1113-K1117 VanDerWaalsContact O-N 3.11Å
1114	D	87.1	Confident	80.6	Confident	15 Å²	15	43.4 Å²	43.4	8%	0.08	22%	0.215	C	C	.	.	H	α-helix	trans	-66.1	-41.5	174	-61.6	-85	0	0	0	111.5	L1110 T1111 K1117 E1118 Y2074	L1110-D1114 HydrophobicContact CB-CB 3.89Å; L1110-D1114 HydrophobicContact CD2-CB 3.73Å; L1110-D1114 HydrophobicContact CG-CB 4.44Å; T1111-D1114 WeakPolarHBondContact CB-OD2 3.49Å; T1111-D1114 PolarHBondContact N-OD2 3.23Å; T1111-D1114 PolarHBondContact O-N 2.94Å; T1111-D1114 PolarHBondContact OG1-N 2.86Å; T1111-D1114 PolarHBondContact OG1-OD2 2.84Å; D1114-K1117 PolarHBondContact O-N 3.25Å; D1114-E1118 PolarHBondContact O-N 3.33Å; D1114-E1118 VanDerWaalsContact O-N 3.16Å; D1114-Y2074 VanDerWaalsContact OD1-CB 3.25Å; D1114-Y2074 WeakPolarHBondContact OD1-CB 3.2Å; D1114-Y2074 PolarHBondContact OD1-N 2.94Å
1115	V	89.1	Confident	82	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.5	-52.5	179.8	172.9	0	0	0	0	111.2	L1110 T1111 T1112 K1117 E1118 L1119 I1133 A1136 L1164	L1110-V1115 HydrophobicContact CB-CG2 3.76Å; L1110-V1115 HydrophobicContact CD1-CG2 4.29Å; T1111-V1115 WeakPolarHBondContact O-CG2 3.29Å; T1111-V1115 PolarHBondContact O-N 2.99Å; T1112-V1115 PolarHBondContact O-N 2.83Å; V1115-K1117 VanDerWaalsContact C-N 3.28Å; V1115-K1117 PolarHBondContact O-N 3.2Å; V1115-E1118 PolarHBondContact O-N 2.99Å; V1115-L1119 HydrophobicContact CG1-CD1 4.2Å; V1115-L1119 WeakPolarHBondContact O-CG 3.4Å; V1115-L1119 PolarHBondContact O-N 3.25Å; V1115-L1119 VanDerWaalsContact O-N 3.14Å; V1115-I1133 HydrophobicContact CB-CG2 4.46Å; V1115-I1133 HydrophobicContact CG1-CB 4.09Å; V1115-I1133 HydrophobicContact CG1-CD1 3.85Å; V1115-I1133 HydrophobicContact CG1-CG2 4.03Å; V1115-I1133 HydrophobicContact CG2-CG2 4.06Å; V1115-A1136 HydrophobicContact CG2-CB 3.75Å; V1115-L1164 HydrophobicContact CG1-CD1 4.12Å; V1115-L1164 HydrophobicContact CG1-CD2 4.18Å; V1115-L1164 HydrophobicContact CG2-CD2 4.11Å
1116	Y	89.3	Confident	83.6	Confident	13 Å²	13	37.4 Å²	37.4	5%	0.051	19%	0.185	C	C	.	.	H	α-helix	trans	-75.5	-16.3	-177.9	-69.3	-71	0	0	0	113.3	T1112 L1119 L1120 Y1126 F1130 R1131 C1132 I1133 Q1160	T1112-Y1116 HydrophobicContact CG2-CD2 3.66Å; T1112-Y1116 HydrophobicContact CG2-CE2 3.89Å; T1112-Y1116 WeakPolarHBondContact O-CD2 3.49Å; T1112-Y1116 PolarHBondContact O-N 3Å; Y1116-L1119 HydrophobicContact CD1-CD1 3.74Å; Y1116-L1119 HydrophobicContact CE1-CD1 3.71Å; Y1116-L1120 WeakPolarHBondContact O-CB 3.29Å; Y1116-L1120 PolarHBondContact O-N 3.4Å; Y1116-Y1126 HydrophobicContact CD1-CD2 4.21Å; Y1116-Y1126 HydrophobicContact CE1-CD2 4.12Å; Y1116-F1130 PolarHBondContact OH-O 3.36Å; Y1116-R1131 HydrophobicContact CD1-CG 3.89Å; Y1116-R1131 HydrophobicContact CD2-CB 3.87Å; Y1116-R1131 HydrophobicContact CD2-CG 3.76Å; Y1116-R1131 HydrophobicContact CE1-CB 4.44Å; Y1116-R1131 HydrophobicContact CE1-CG 4.09Å; Y1116-R1131 HydrophobicContact CE2-CB 3.7Å; Y1116-R1131 HydrophobicContact CE2-CG 3.99Å; Y1116-R1131 HydrophobicContact CG-CB 4.36Å; Y1116-R1131 HydrophobicContact CG-CG 3.75Å; Y1116-R1131 VanDerWaalsContact CZ-CA 3.42Å; Y1116-R1131 WeakPolarHBondContact OH-CA 3.33Å; Y1116-C1132 PolarHBondContact OH-N 2.98Å; Y1116-I1133 HydrophobicContact CE2-CB 4.07Å; Y1116-I1133 WeakPolarHBondContact OH-CG1 3.27Å; Y1116-I1133 PolarHBondContact OH-N 3.21Å; Y1116-Q1160 VanDerWaalsContact CZ-OE1 3.28Å; Y1116-Q1160 PolarHBondContact OH-OE1 2.98Å
1117	K	85.3	Confident	84.8	Confident	25 Å²	25	31.1 Å²	31.1	11%	0.109	16%	0.16	C	C	.	.	H	α-helix	trans	-69.8	-46	167	-178.2	172.4	-70.8	170.3	0	112.5	V1113 D1114 V1115 L1119 L1120 L1121 V2217 E2222	V1113-K1117 WeakPolarHBondContact O-CB 3.35Å; V1113-K1117 PolarHBondContact O-N 3.12Å; V1113-K1117 VanDerWaalsContact O-N 3.11Å; D1114-K1117 PolarHBondContact O-N 3.25Å; V1115-K1117 VanDerWaalsContact C-N 3.28Å; V1115-K1117 PolarHBondContact O-N 3.2Å; K1117-L1119 VanDerWaalsContact C-N 3.28Å; K1117-L1119 PolarHBondContact O-N 3.39Å; K1117-L1120 PolarHBondContact O-N 2.93Å; K1117-L1121 HydrophobicContact CG-CD1 4.48Å; K1117-L1121 PolarHBondContact O-N 3.1Å; K1117-L1121 VanDerWaalsContact O-N 3.11Å; K1117-V2217 HydrophobicContact CD-CG1 4.01Å; K1117-V2217 HydrophobicContact CG-CG1 3.96Å; K1117-E2222 IonicContact NZ-OE1 2.69Å; K1117-E2222 PolarHBondContact NZ-OE1 3.03Å
1118	E	85.5	Confident	85.7	Confident	5 Å²	5	33.3 Å²	33.3	2%	0.023	17%	0.173	C	C	.	.	H	α-helix	trans	-58.3	-40.9	172.9	174.2	89.5	170.3	0	0	111.2	D1114 V1115 R1122 L1164 Y2074 R2077	D1114-E1118 PolarHBondContact O-N 3.33Å; D1114-E1118 VanDerWaalsContact O-N 3.16Å; V1115-E1118 PolarHBondContact O-N 2.99Å; E1118-R1122 WeakPolarHBondContact O-CG 3.32Å; E1118-R1122 IonicContact OE1-CZ 2.83Å; E1118-R1122 IonicContact OE1-NE 2.72Å; E1118-R1122 IonicContact OE1-NH2 3.14Å; E1118-R1122 PolarHBondContact OE1-NH2 3.32Å; E1118-L1164 HydrophobicContact CB-CD1 4.49Å; E1118-L1164 HydrophobicContact CG-CD1 4.08Å; E1118-Y2074 HydrophobicContact CB-CD2 4.41Å; E1118-Y2074 HydrophobicContact CB-CE2 4.08Å; E1118-Y2074 VanDerWaalsContact OE2-CE2 3.28Å; E1118-Y2074 WeakPolarHBondContact OE2-CE2 3.45Å; E1118-R2077 VanDerWaalsContact CD-NE 3.26Å; E1118-R2077 IonicContact OE1-CZ 3.53Å; E1118-R2077 VanDerWaalsContact OE1-CZ 3.27Å; E1118-R2077 IonicContact OE1-NE 2.98Å; E1118-R2077 PolarHBondContact OE1-NE 2.94Å; E1118-R2077 IonicContact OE1-NH2 2.71Å; E1118-R2077 PolarHBondContact OE1-NH2 3.14Å; E1118-R2077 IonicContact OE2-NE 2.99Å
1119	L	88.5	Confident	86.4	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-72	-42.1	177.7	-66.1	174.1	0	0	0	112.3	V1115 Y1116 K1117 L1121 R1122 G1123 Y1124 Y1126 Q1160	V1115-L1119 HydrophobicContact CG1-CD1 4.2Å; V1115-L1119 WeakPolarHBondContact O-CG 3.4Å; V1115-L1119 PolarHBondContact O-N 3.25Å; V1115-L1119 VanDerWaalsContact O-N 3.14Å; Y1116-L1119 HydrophobicContact CD1-CD1 3.74Å; Y1116-L1119 HydrophobicContact CE1-CD1 3.71Å; K1117-L1119 VanDerWaalsContact C-N 3.28Å; K1117-L1119 PolarHBondContact O-N 3.39Å; L1119-L1121 VanDerWaalsContact C-N 3.34Å; L1119-L1121 PolarHBondContact O-N 2.93Å; L1119-R1122 PolarHBondContact O-N 3.26Å; L1119-R1122 VanDerWaalsContact O-N 3.16Å; L1119-G1123 PolarHBondContact O-N 3Å; L1119-G1123 VanDerWaalsContact O-N 3.12Å; L1119-Y1124 HydrophobicContact CB-CD2 4Å; L1119-Y1124 HydrophobicContact CD2-CD2 3.83Å; L1119-Y1124 HydrophobicContact CD2-CE2 4.09Å; L1119-Y1124 VanDerWaalsContact O-CD2 3.3Å; L1119-Y1124 WeakPolarHBondContact O-CD2 3.31Å; L1119-Y1124 PolarHBondContact O-N 3.38Å; L1119-Y1126 HydrophobicContact CD1-CE2 4.36Å; L1119-Q1160 HydrophobicContact CD1-CB 4.25Å; L1119-Q1160 HydrophobicContact CD1-CG 4.41Å
1120	L	85.1	Confident	86.8	Confident	22 Å²	22	28.4 Å²	28.4	12%	0.115	15%	0.153	C	C	.	.	H	α-helix	trans	-57.9	-44.1	177.6	179.4	60.5	0	0	0	112.5	Y1116 K1117 R1122 G1123 Y1124 E1125 D2216 V2221	Y1116-L1120 WeakPolarHBondContact O-CB 3.29Å; Y1116-L1120 PolarHBondContact O-N 3.4Å; K1117-L1120 PolarHBondContact O-N 2.93Å; L1120-R1122 VanDerWaalsContact C-N 3.3Å; L1120-R1122 PolarHBondContact O-N 2.93Å; L1120-G1123 WeakPolarHBondContact O-CA 3.35Å; L1120-G1123 PolarHBondContact O-N 3.15Å; L1120-Y1124 WeakPolarHBondContact CA-O 3.31Å; L1120-Y1124 PolarHBondContact N-O 2.84Å; L1120-E1125 HydrophobicContact CD1-CB 4.44Å; L1120-E1125 HydrophobicContact CD1-CG 3.52Å; L1120-D2216 HydrophobicContact CG-CB 4.49Å; L1120-V2221 HydrophobicContact CD2-CG1 4.46Å
1121	L	81.6	Confident	87.1	Confident	22 Å²	22	33.7 Å²	33.7	12%	0.115	17%	0.173	C	C	.	.	H	α-helix	trans	-59.7	-38.2	177.4	-79.4	163.7	0	0	0	112.8	K1117 L1119 G1123 R1228 E2049 Y2074 D2216 V2217 I2239	K1117-L1121 HydrophobicContact CG-CD1 4.48Å; K1117-L1121 PolarHBondContact O-N 3.1Å; K1117-L1121 VanDerWaalsContact O-N 3.11Å; L1119-L1121 VanDerWaalsContact C-N 3.34Å; L1119-L1121 PolarHBondContact O-N 2.93Å; L1121-G1123 VanDerWaalsContact C-N 3.3Å; L1121-G1123 PolarHBondContact O-N 2.75Å; L1121-R1228 PolarHBondContact O-NH1 3.34Å; L1121-E2049 HydrophobicContact CD1-CG 4.31Å; L1121-E2049 HydrophobicContact CD2-CG 4.03Å; L1121-Y2074 HydrophobicContact CD1-CE2 4.33Å; L1121-Y2074 WeakPolarHBondContact CD1-OH 3.28Å; L1121-D2216 HydrophobicContact CD2-CB 3.78Å; L1121-D2216 HydrophobicContact CG-CB 4.35Å; L1121-V2217 HydrophobicContact CD1-CG1 3.81Å; L1121-V2217 HydrophobicContact CD2-CG1 4.03Å; L1121-V2217 HydrophobicContact CG-CG1 4.12Å; L1121-I2239 HydrophobicContact CD2-CB 4.05Å; L1121-I2239 HydrophobicContact CD2-CG1 4.14Å; L1121-I2239 HydrophobicContact CD2-CG2 4.12Å
1122	R	81.8	Confident	87.2	Confident	11 Å²	11	30.4 Å²	30.4	4%	0.042	15%	0.153	C	C	.	.	H	α-helix	trans	-72.1	-23	175	-62.6	176.3	-167.1	-162.8	5.1	113.1	E1118 L1119 L1120 Y1124 L1163 E1166 M1168 R1228	E1118-R1122 WeakPolarHBondContact O-CG 3.32Å; E1118-R1122 IonicContact OE1-CZ 2.83Å; E1118-R1122 IonicContact OE1-NE 2.72Å; E1118-R1122 IonicContact OE1-NH2 3.14Å; E1118-R1122 PolarHBondContact OE1-NH2 3.32Å; L1119-R1122 PolarHBondContact O-N 3.26Å; L1119-R1122 VanDerWaalsContact O-N 3.16Å; L1120-R1122 VanDerWaalsContact C-N 3.3Å; L1120-R1122 PolarHBondContact O-N 2.93Å; R1122-Y1124 HydrophobicContact CB-CD2 4.01Å; R1122-Y1124 HydrophobicContact CB-CE2 3.73Å; R1122-L1163 PolarHBondContact NH1-O 3Å; R1122-E1166 PolarHBondContact NH1-O 3.31Å; R1122-E1166 PolarHBondContact NH2-O 3.33Å; R1122-M1168 PolarHBondContact NE-O 2.61Å; R1122-R1228 PolarHBondContact O-NH1 2.54Å
1123	G	81.3	Confident	87.4	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	118	11.5	176.8	0	0	0	0	0	115.6	D984 L1119 L1120 L1121	D984-G1123 PolarHBondContact N-O 3.36Å; L1119-G1123 PolarHBondContact O-N 3Å; L1119-G1123 VanDerWaalsContact O-N 3.12Å; L1120-G1123 WeakPolarHBondContact O-CA 3.35Å; L1120-G1123 PolarHBondContact O-N 3.15Å; L1121-G1123 VanDerWaalsContact C-N 3.3Å; L1121-G1123 PolarHBondContact O-N 2.75Å
1124	Y	88.5	Confident	87.7	Confident	5 Å²	5	26.2 Å²	26.2	2%	0.02	12%	0.122	C	C	.	.	B	Isolated β-bridge	trans	-92.1	112.8	172.8	-42	-89.2	0	0	0	109.8	I983 L1119 L1120 R1122 Y1126 L1163 L1171 K1172	I983-Y1124 HydrophobicContact CD1-CD1 4.15Å; I983-Y1124 HydrophobicContact CG1-CD1 4.36Å; I983-Y1124 HydrophobicContact CG2-CD1 4.15Å; L1119-Y1124 HydrophobicContact CB-CD2 4Å; L1119-Y1124 HydrophobicContact CD2-CD2 3.83Å; L1119-Y1124 HydrophobicContact CD2-CE2 4.09Å; L1119-Y1124 VanDerWaalsContact O-CD2 3.3Å; L1119-Y1124 WeakPolarHBondContact O-CD2 3.31Å; L1119-Y1124 PolarHBondContact O-N 3.38Å; L1120-Y1124 WeakPolarHBondContact CA-O 3.31Å; L1120-Y1124 PolarHBondContact N-O 2.84Å; R1122-Y1124 HydrophobicContact CB-CD2 4.01Å; R1122-Y1124 HydrophobicContact CB-CE2 3.73Å; Y1124-Y1126 VanDerWaalsContact CB-CE2 3.42Å; Y1124-Y1126 HydrophobicContact CD1-CE2 4.34Å; Y1124-Y1126 HydrophobicContact CG-CE2 4.05Å; Y1124-L1163 HydrophobicContact CE1-CD1 3.98Å; Y1124-L1163 HydrophobicContact CE2-CD1 4.43Å; Y1124-L1171 HydrophobicContact CD1-CD1 3.8Å; Y1124-L1171 HydrophobicContact CD2-CD1 4.4Å; Y1124-L1171 HydrophobicContact CE1-CD1 3.52Å; Y1124-L1171 HydrophobicContact CE2-CD1 4.16Å; Y1124-L1171 HydrophobicContact CG-CD1 4.22Å; Y1124-K1172 WeakPolarHBondContact CE1-O 3.43Å; Y1124-K1172 PolarHBondContact OH-N 2.86Å; Y1124-K1172 PolarHBondContact OH-O 2.78Å
1125	E	86.9	Confident	87.8	Confident	32 Å²	32	27.8 Å²	27.8	15%	0.15	13%	0.129	C	C	.	.			trans	-103.7	28.3	-168.5	-77.8	155.4	-158.5	0	0	112.3	V982 G985 L1120 G1127 R2238	V982-E1125 HydrophobicContact CB-CB 3.85Å; V982-E1125 HydrophobicContact CG1-CB 3.8Å; V982-E1125 CarbonylContact O-C 3.58Å; V982-E1125 WeakPolarHBondContact O-CA 3.16Å; V982-E1125 PolarHBondContact O-N 2.74Å; G985-E1125 WeakPolarHBondContact CA-OE2 3.28Å; G985-E1125 PolarHBondContact N-OE2 3.47Å; L1120-E1125 HydrophobicContact CD1-CB 4.44Å; L1120-E1125 HydrophobicContact CD1-CG 3.52Å; E1125-G1127 PolarHBondContact O-N 2.66Å; E1125-R2238 IonicContact OE1-CZ 3.64Å; E1125-R2238 IonicContact OE1-NH1 2.76Å; E1125-R2238 PolarHBondContact OE1-NH1 3.44Å; E1125-R2238 IonicContact OE1-NH2 3.52Å; E1125-R2238 PolarHBondContact OE1-NH2 3.2Å; E1125-R2238 IonicContact OE2-NH1 3.24Å
1126	Y	90	Very high	87.8	Confident	7 Å²	7	27.8 Å²	27.8	3%	0.027	13%	0.129	C	C	.	.			trans	-39.7	125.7	-178.6	-65.4	-67.5	0	0	0	113.7	H981 V982 Y1116 L1119 Y1124 F1130 R1131 D1156 Q1160	H981-Y1126 AromaticContact CD2-CE1 3.6Å; H981-Y1126 AromaticContact NE2-CE1 3.74Å; V982-Y1126 PolarHBondContact O-N 3.02Å; Y1116-Y1126 HydrophobicContact CD1-CD2 4.21Å; Y1116-Y1126 HydrophobicContact CE1-CD2 4.12Å; L1119-Y1126 HydrophobicContact CD1-CE2 4.36Å; Y1124-Y1126 VanDerWaalsContact CB-CE2 3.42Å; Y1124-Y1126 HydrophobicContact CD1-CE2 4.34Å; Y1124-Y1126 HydrophobicContact CG-CE2 4.05Å; Y1126-F1130 HydrophobicContact CD1-CB 3.54Å; Y1126-F1130 HydrophobicContact CD1-CD1 4.43Å; Y1126-F1130 HydrophobicContact CD1-CG 4.12Å; Y1126-F1130 HydrophobicContact CE1-CB 4.29Å; Y1126-F1130 HydrophobicContact CE1-CD1 4.43Å; Y1126-F1130 HydrophobicContact CG-CB 4.15Å; Y1126-R1131 PolarHBondContact O-NE 3.08Å; Y1126-R1131 PolarHBondContact O-NH2 3.21Å; Y1126-D1156 WeakPolarHBondContact CE1-OD2 3.46Å; Y1126-D1156 PolarHBondContact OH-OD2 2.94Å; Y1126-Q1160 HydrophobicContact CE2-CG 3.69Å; Y1126-Q1160 WeakPolarHBondContact OH-CG 3.23Å
1127	G	85.1	Confident	87.6	Confident	16 Å²	16	27.3 Å²	27.3	17%	0.165	13%	0.127	C	C	.	.			trans	-81.7	-175.8	169.2	0	0	0	0	0	112.8	E980 E1125 S1129 F1130 R1131	E980-G1127 PolarHBondContact O-N 3.3Å; E1125-G1127 PolarHBondContact O-N 2.66Å; G1127-S1129 PolarHBondContact O-N 3.39Å; G1127-F1130 PolarHBondContact O-N 2.95Å; G1127-F1130 VanDerWaalsContact O-N 3.15Å; G1127-R1131 WeakPolarHBondContact O-CG 3.44Å; G1127-R1131 PolarHBondContact O-N 3.07Å
1128	K	85.1	Confident	87.3	Confident	169 Å²	169	26.3 Å²	26.3	74%	0.735	12%	0.123	S	C	*	.	G	3₁₀ helix	trans	-56.1	-44.4	-164.5	-84.9	175.9	174.9	168	0	113.6	E980 F1130 R1131	E980-K1128 VanDerWaalsContact CD-N 3.29Å; E980-K1128 PolarHBondContact OE1-N 2.84Å; E980-K1128 PolarHBondContact OE2-N 3.17Å; K1128-F1130 VanDerWaalsContact C-N 3.26Å; K1128-F1130 PolarHBondContact O-N 2.84Å; K1128-R1131 PolarHBondContact O-N 3.41Å; K1128-R1131 VanDerWaalsContact O-N 3.14Å
1129	S	88.2	Confident	86.9	Confident	39 Å²	39	26.2 Å²	26.2	27%	0.273	12%	0.123	S	C	.	.	G	3₁₀ helix	trans	-65.1	-27.2	-176	-56	0	0	0	0	113.5	E980 G1127 C1132 T1153	E980-S1129 WeakPolarHBondContact OE2-CA 3.31Å; E980-S1129 WeakPolarHBondContact OE2-CB 3.48Å; E980-S1129 PolarHBondContact OE2-N 3.01Å; E980-S1129 PolarHBondContact OE2-OG 3.07Å; G1127-S1129 PolarHBondContact O-N 3.39Å; S1129-C1132 PolarHBondContact O-SG 2.94Å; S1129-T1153 WeakPolarHBondContact O-CB 3.34Å; S1129-T1153 WeakPolarHBondContact O-CG2 3.32Å
1130	F	93.9	Very high	86.5	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-94.9	-4.2	177.4	-78	-88	0	0	0	113.6	F977 E980 H981 P990 Y1116 Y1126 G1127 K1128 C1132 V1152 T1153 D1156 Q1160	F977-F1130 AromaticContact CD2-CE2 3.67Å; F977-F1130 HydrophobicContact CD2-CE2 3.67Å; F977-F1130 AromaticContact CD2-CZ 3.94Å; F977-F1130 HydrophobicContact CD2-CZ 3.94Å; F977-F1130 HydrophobicContact CE2-CE2 4.07Å; F977-F1130 AromaticContact CE2-CZ 3.85Å; F977-F1130 HydrophobicContact CE2-CZ 3.85Å; F977-F1130 WeakPolarHBondContact O-CE2 3.14Å; E980-F1130 HydrophobicContact CB-CD2 4.29Å; H981-F1130 HydrophobicContact CB-CD2 4.03Å; H981-F1130 HydrophobicContact CB-CE1 4.45Å; H981-F1130 HydrophobicContact CB-CE2 3.7Å; H981-F1130 HydrophobicContact CB-CZ 3.95Å; H981-F1130 AromaticContact CD2-CD1 3.72Å; H981-F1130 AromaticContact CD2-CE1 3.6Å; H981-F1130 AromaticContact CD2-CZ 3.96Å; P990-F1130 HydrophobicContact CB-CE1 4.33Å; P990-F1130 HydrophobicContact CB-CZ 4.42Å; P990-F1130 HydrophobicContact CG-CE1 3.95Å; P990-F1130 HydrophobicContact CG-CZ 3.57Å; Y1116-F1130 PolarHBondContact OH-O 3.36Å; Y1126-F1130 HydrophobicContact CD1-CB 3.54Å; Y1126-F1130 HydrophobicContact CD1-CD1 4.43Å; Y1126-F1130 HydrophobicContact CD1-CG 4.12Å; Y1126-F1130 HydrophobicContact CE1-CB 4.29Å; Y1126-F1130 HydrophobicContact CE1-CD1 4.43Å; Y1126-F1130 HydrophobicContact CG-CB 4.15Å; G1127-F1130 PolarHBondContact O-N 2.95Å; G1127-F1130 VanDerWaalsContact O-N 3.15Å; K1128-F1130 VanDerWaalsContact C-N 3.26Å; K1128-F1130 PolarHBondContact O-N 2.84Å; F1130-C1132 PolarHBondContact O-N 2.96Å; F1130-V1152 HydrophobicContact CE1-CG1 4.28Å; F1130-V1152 HydrophobicContact CZ-CG1 4.12Å; F1130-T1153 HydrophobicContact CD1-CG2 3.81Å; F1130-T1153 HydrophobicContact CD2-CG2 3.97Å; F1130-T1153 HydrophobicContact CE1-CG2 3.67Å; F1130-T1153 HydrophobicContact CE2-CG2 3.82Å; F1130-T1153 HydrophobicContact CG-CG2 3.95Å; F1130-T1153 HydrophobicContact CZ-CG2 3.66Å; F1130-D1156 HydrophobicContact CD1-CB 3.93Å; F1130-D1156 HydrophobicContact CE1-CB 3.94Å; F1130-Q1160 PolarHBondContact O-NE2 3.26Å; F1130-Q1160 VanDerWaalsContact O-NE2 3.14Å; F1130-Q1160 PolarHBondContact O-OE1 3.17Å
1131	R	92.8	Very high	86.3	Confident	113 Å²	113	25.5 Å²	25.5	43%	0.426	12%	0.12	S	C	.	.			trans	-83	50.5	176.4	-69.9	-174.3	-167.6	-179.6	8.3	113	Y1116 Y1126 G1127 K1128	Y1116-R1131 HydrophobicContact CD1-CG 3.89Å; Y1116-R1131 HydrophobicContact CD2-CB 3.87Å; Y1116-R1131 HydrophobicContact CD2-CG 3.76Å; Y1116-R1131 HydrophobicContact CE1-CB 4.44Å; Y1116-R1131 HydrophobicContact CE1-CG 4.09Å; Y1116-R1131 HydrophobicContact CE2-CB 3.7Å; Y1116-R1131 HydrophobicContact CE2-CG 3.99Å; Y1116-R1131 HydrophobicContact CG-CB 4.36Å; Y1116-R1131 HydrophobicContact CG-CG 3.75Å; Y1116-R1131 VanDerWaalsContact CZ-CA 3.42Å; Y1116-R1131 WeakPolarHBondContact OH-CA 3.33Å; Y1126-R1131 PolarHBondContact O-NE 3.08Å; Y1126-R1131 PolarHBondContact O-NH2 3.21Å; G1127-R1131 WeakPolarHBondContact O-CG 3.44Å; G1127-R1131 PolarHBondContact O-N 3.07Å; K1128-R1131 PolarHBondContact O-N 3.41Å; K1128-R1131 VanDerWaalsContact O-N 3.14Å
1132	C	92.7	Very high	86.6	Confident	5 Å²	5	28 Å²	28	3%	0.034	13%	0.128	C	C	.	.			trans	-81	-11.6	-174.1	-53	0	0	0	0	114.9	Y1116 S1129 F1130 Y1134 I1145 L1146 A1157	Y1116-C1132 PolarHBondContact OH-N 2.98Å; S1129-C1132 PolarHBondContact O-SG 2.94Å; F1130-C1132 PolarHBondContact O-N 2.96Å; C1132-Y1134 PolarHBondContact O-N 3.45Å; C1132-Y1134 VanDerWaalsContact O-N 3.11Å; C1132-I1145 HydrophobicContact CB-CG2 4Å; C1132-I1145 CarbonylContact O-C 3.47Å; C1132-I1145 WeakPolarHBondContact O-CA 3.49Å; C1132-L1146 HydrophobicContact CB-CB 4.07Å; C1132-L1146 WeakPolarHBondContact O-CB 3.39Å; C1132-L1146 PolarHBondContact O-N 3Å; C1132-A1157 HydrophobicContact CB-CB 3.76Å
1133	I	92.7	Very high	87	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	110.9	175.6	-60.9	170.9	0	0	0	109.4	T1112 V1115 Y1116 A1136 I1145 A1157 Q1160	T1112-I1133 WeakPolarHBondContact CB-O 3.34Å; T1112-I1133 PolarHBondContact OG1-O 2.67Å; V1115-I1133 HydrophobicContact CB-CG2 4.46Å; V1115-I1133 HydrophobicContact CG1-CB 4.09Å; V1115-I1133 HydrophobicContact CG1-CD1 3.85Å; V1115-I1133 HydrophobicContact CG1-CG2 4.03Å; V1115-I1133 HydrophobicContact CG2-CG2 4.06Å; Y1116-I1133 HydrophobicContact CE2-CB 4.07Å; Y1116-I1133 WeakPolarHBondContact OH-CG1 3.27Å; Y1116-I1133 PolarHBondContact OH-N 3.21Å; I1133-A1136 HydrophobicContact CG2-CB 4.37Å; I1133-I1145 HydrophobicContact CG1-CG1 4.45Å; I1133-A1157 HydrophobicContact CG1-CB 4.29Å; I1133-Q1160 HydrophobicContact CD1-CB 3.82Å
1134	Y	90.6	Very high	87.5	Confident	52 Å²	52	28.4 Å²	28.4	20%	0.204	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	-48.9	179.9	-173.1	-112.9	0	0	0	111.7	T1112 C1132 S1144 L1146 D1195 K1197 I1199	T1112-Y1134 PolarHBondContact N-O 3.46Å; T1112-Y1134 WeakPolarHBondContact OG1-CA 3.29Å; T1112-Y1134 PolarHBondContact OG1-O 3.48Å; C1132-Y1134 PolarHBondContact O-N 3.45Å; C1132-Y1134 VanDerWaalsContact O-N 3.11Å; Y1134-S1144 WeakPolarHBondContact CB-O 3.1Å; Y1134-S1144 PolarHBondContact N-O 3.4Å; Y1134-L1146 HydrophobicContact CD2-CD1 3.9Å; Y1134-L1146 HydrophobicContact CG-CD1 4.29Å; Y1134-D1195 PolarHBondContact OH-OD2 2.67Å; Y1134-K1197 HydrophobicContact CD2-CD 4.47Å; Y1134-K1197 HydrophobicContact CE2-CD 4.13Å; Y1134-I1199 HydrophobicContact CD1-CD1 3.81Å; Y1134-I1199 HydrophobicContact CE1-CD1 3.96Å; Y1134-I1199 HydrophobicContact CG-CD1 4.17Å
1135	Q	90.2	Very high	87.7	Confident	48 Å²	48	28.1 Å²	28.1	22%	0.224	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	156.6	173.6	86.4	-149.5	82.8	0	0	110.2	E1109 L1110 T1143 S1144	E1109-Q1135 PolarHBondContact OE2-NE2 2.98Å; L1110-Q1135 WeakPolarHBondContact O-CA 3.44Å; Q1135-T1143 WeakPolarHBondContact O-CA 3.28Å; Q1135-S1144 VanDerWaalsContact CD-OG 3.25Å; Q1135-S1144 WeakPolarHBondContact CG-OG 3.43Å; Q1135-S1144 PolarHBondContact N-O 2.87Å; Q1135-S1144 PolarHBondContact O-N 2.88Å; Q1135-S1144 PolarHBondContact OE1-OG 3.03Å
1136	A	89.6	Confident	88	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	152	170.4	0	0	0	0	0	110.1	E1109 L1110 V1115 I1133 T1143 L1164	E1109-A1136 CarbonylContact C-O 3.26Å; E1109-A1136 WeakPolarHBondContact CA-O 3.41Å; L1110-A1136 HydrophobicContact CB-CB 4.2Å; L1110-A1136 HydrophobicContact CD1-CB 4.13Å; L1110-A1136 PolarHBondContact N-O 2.9Å; L1110-A1136 PolarHBondContact O-N 2.97Å; V1115-A1136 HydrophobicContact CG2-CB 3.75Å; I1133-A1136 HydrophobicContact CG2-CB 4.37Å; A1136-T1143 HydrophobicContact CB-CG2 3.66Å; A1136-L1164 HydrophobicContact CB-CD2 3.63Å
1137	C	85.1	Confident	88.1	Confident	2 Å²	2	29.4 Å²	29.4	1%	0.014	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	152.8	160.6	65.5	0	0	0	0	110.5	A1139 G1140 D1141 R1142	C1137-A1139 PolarHBondContact O-N 2.9Å; C1137-A1139 VanDerWaalsContact O-N 3.08Å; C1137-G1140 PolarHBondContact O-N 3Å; C1137-G1140 PolarHBondContact SG-N 2.98Å; C1137-D1141 PolarHBondContact SG-N 3.27Å; C1137-D1141 PolarHBondContact SG-OD1 3.1Å; C1137-R1142 PolarHBondContact N-O 3.11Å; C1137-R1142 PolarHBondContact SG-N 2.92Å; C1137-R1142 VanDerWaalsContact SG-N 3.41Å; C1137-R1142 PolarHBondContact SG-O 3.15Å; C1137-R1142 VanDerWaalsContact SG-O 3.41Å
1138	N	77.9	Confident	88.3	Confident	4 Å²	4	31.9 Å²	31.9	2%	0.021	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-25.6	174.8	60.2	-17.3	0	0	0	115	C1105 E1106 I1108 R2077	C1105-N1138 PolarHBondContact SG-OD1 3.15Å; E1106-N1138 PolarHBondContact O-ND2 2.9Å; E1106-N1138 PolarHBondContact O-OD1 3.26Å; I1108-N1138 WeakPolarHBondContact O-CB 3.37Å; I1108-N1138 PolarHBondContact O-N 2.95Å; N1138-R2077 HydrophobicContact CB-CB 4.25Å; N1138-R2077 PolarHBondContact O-NH1 3.33Å
1139	A	77	Confident	88.4	Confident	3 Å²	3	26.5 Å²	26.5	3%	0.025	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-19.1	175.4	0	0	0	0	0	115	C1105 C1137 D1141	C1105-A1139 HydrophobicContact CB-CB 4.47Å; C1137-A1139 PolarHBondContact O-N 2.9Å; C1137-A1139 VanDerWaalsContact O-N 3.08Å; A1139-D1141 PolarHBondContact O-N 3Å
1140	G	79.8	Confident	88.6	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	77.4	1.7	-178.5	0	0	0	0	0	116.9	C1137 M1165	C1137-G1140 PolarHBondContact O-N 3Å; C1137-G1140 PolarHBondContact SG-N 2.98Å; G1140-M1165 WeakPolarHBondContact O-CG 3.34Å
1141	D	81.8	Confident	88.5	Confident	7 Å²	7	27 Å²	27	4%	0.037	14%	0.138	C	C	.	.	S	Bend	trans	-83.1	-19	-177.7	60.8	-11.2	0	0	0	114.2	L1101 R1102 C1137 A1139 M1165 R1203 C1204	L1101-D1141 HydrophobicContact CD2-CB 4.48Å; R1102-D1141 PolarHBondContact N-OD2 3.43Å; C1137-D1141 PolarHBondContact SG-N 3.27Å; C1137-D1141 PolarHBondContact SG-OD1 3.1Å; A1139-D1141 PolarHBondContact O-N 3Å; D1141-M1165 HydrophobicContact CB-SD 4.08Å; D1141-R1203 WeakPolarHBondContact O-CA 3.23Å; D1141-C1204 PolarHBondContact O-N 2.91Å
1142	R	87.5	Confident	88.6	Confident	76 Å²	76	21.7 Å²	21.7	29%	0.287	12%	0.118	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.2	166.9	-174.2	-173.7	74.4	175.5	3.5	111.5	L1101 E1109 C1137	L1101-R1142 HydrophobicContact CD2-CB 4.16Å; E1109-R1142 IonicContact OE1-CZ 3.3Å; E1109-R1142 IonicContact OE1-NH2 3.44Å; E1109-R1142 PolarHBondContact OE1-NH2 2.96Å; C1137-R1142 PolarHBondContact N-O 3.11Å; C1137-R1142 PolarHBondContact SG-N 2.92Å; C1137-R1142 VanDerWaalsContact SG-N 3.41Å; C1137-R1142 PolarHBondContact SG-O 3.15Å; C1137-R1142 VanDerWaalsContact SG-O 3.41Å
1143	T	90.5	Very high	88.7	Confident	1 Å²	1	21.5 Å²	21.5	1%	0.006	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	159.2	171.8	58.6	0	0	0	0	112.1	Q1135 A1136 T1161 A1202	Q1135-T1143 WeakPolarHBondContact O-CA 3.28Å; A1136-T1143 HydrophobicContact CB-CG2 3.66Å; T1143-T1161 HydrophobicContact CG2-CG2 3.65Å; T1143-T1161 WeakPolarHBondContact OG1-CG2 3.33Å; T1143-T1161 PolarHBondContact OG1-OG1 3.47Å; T1143-A1202 PolarHBondContact N-O 3.13Å; T1143-A1202 PolarHBondContact O-N 3.15Å
1144	S	91.7	Very high	88.8	Confident	17 Å²	17	21.5 Å²	21.5	12%	0.119	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	126.7	168.1	-55.1	0	0	0	0	108	Y1134 Q1135	Y1134-S1144 WeakPolarHBondContact CB-O 3.1Å; Y1134-S1144 PolarHBondContact N-O 3.4Å; Q1135-S1144 VanDerWaalsContact CD-OG 3.25Å; Q1135-S1144 WeakPolarHBondContact CG-OG 3.43Å; Q1135-S1144 PolarHBondContact N-O 2.87Å; Q1135-S1144 PolarHBondContact O-N 2.88Å; Q1135-S1144 PolarHBondContact OE1-OG 3.03Å
1145	I	93.1	Very high	88.9	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.6	-171.9	-58.6	178.6	0	0	0	110.3	C1132 I1133 F1154 A1157 L1158 I1199 V1200 A1202	C1132-I1145 HydrophobicContact CB-CG2 4Å; C1132-I1145 CarbonylContact O-C 3.47Å; C1132-I1145 WeakPolarHBondContact O-CA 3.49Å; I1133-I1145 HydrophobicContact CG1-CG1 4.45Å; I1145-F1154 HydrophobicContact CB-CE2 4.03Å; I1145-F1154 HydrophobicContact CG2-CD2 3.67Å; I1145-F1154 HydrophobicContact CG2-CE2 3.68Å; I1145-A1157 HydrophobicContact CD1-CB 4.3Å; I1145-A1157 HydrophobicContact CG2-CB 3.64Å; I1145-L1158 HydrophobicContact CD1-CD2 3.4Å; I1145-L1158 VanDerWaalsContact CD1-CD2 3.4Å; I1145-L1158 HydrophobicContact CD1-CG 3.8Å; I1145-I1199 CarbonylContact O-C 3.48Å; I1145-I1199 WeakPolarHBondContact O-CA 3.32Å; I1145-I1199 VanDerWaalsContact O-CG2 3.3Å; I1145-I1199 WeakPolarHBondContact O-CG2 3.4Å; I1145-V1200 PolarHBondContact N-O 2.96Å; I1145-V1200 PolarHBondContact O-N 3.35Å; I1145-A1202 HydrophobicContact CD1-CB 3.8Å; I1145-A1202 HydrophobicContact CG1-CB 4.27Å
1146	L	92.7	Very high	89	Confident	43 Å²	43	17.2 Å²	17.2	23%	0.225	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	133.4	175.3	-126.3	79.2	0	0	0	111.1	C1132 Y1134 K1197 E1198 I1199	C1132-L1146 HydrophobicContact CB-CB 4.07Å; C1132-L1146 WeakPolarHBondContact O-CB 3.39Å; C1132-L1146 PolarHBondContact O-N 3Å; Y1134-L1146 HydrophobicContact CD2-CD1 3.9Å; Y1134-L1146 HydrophobicContact CG-CD1 4.29Å; L1146-K1197 HydrophobicContact CD1-CB 4.01Å; L1146-K1197 HydrophobicContact CD1-CD 3.92Å; L1146-K1197 HydrophobicContact CD1-CG 4.5Å; L1146-K1197 HydrophobicContact CD2-CD 4.41Å; L1146-K1197 HydrophobicContact CG-CB 4.48Å; L1146-E1198 CarbonylContact C-O 3.55Å; L1146-E1198 WeakPolarHBondContact CA-O 3.26Å; L1146-I1199 HydrophobicContact CD1-CG1 4.45Å
1147	W	92.6	Very high	89.2	Confident	22 Å²	22	17.2 Å²	17.2	8%	0.083	10%	0.099	C	C	.	.			trans	-92.4	125.6	160.9	-178	-118.6	0	0	0	109.1	W1151 F1154 H1187 L1188 V1191 E1198	W1147-W1151 AromaticContact CH2-CD2 3.78Å; W1147-W1151 HydrophobicContact CH2-CD2 3.78Å; W1147-W1151 AromaticContact CH2-CE2 3.73Å; W1147-W1151 HydrophobicContact CH2-CE3 4.26Å; W1147-W1151 HydrophobicContact CH2-CG 4.02Å; W1147-W1151 HydrophobicContact CH2-CZ2 4.17Å; W1147-W1151 AromaticContact CH2-NE1 3.94Å; W1147-W1151 HydrophobicContact CZ3-CD2 4.22Å; W1147-W1151 HydrophobicContact CZ3-CE3 4.3Å; W1147-F1154 HydrophobicContact CE3-CB 3.84Å; W1147-F1154 HydrophobicContact CE3-CD2 4.03Å; W1147-F1154 AromaticContact CE3-CG 3.9Å; W1147-F1154 HydrophobicContact CE3-CG 3.9Å; W1147-F1154 HydrophobicContact CZ3-CB 3.7Å; W1147-F1154 HydrophobicContact CZ3-CD1 4.48Å; W1147-F1154 HydrophobicContact CZ3-CG 4Å; W1147-H1187 AromaticContact CD2-NE2 3.65Å; W1147-H1187 AromaticContact CE3-NE2 3.44Å; W1147-H1187 AromaticContact CZ3-NE2 3.76Å; W1147-L1188 HydrophobicContact CZ2-CD2 4.45Å; W1147-V1191 HydrophobicContact CB-CG1 4.39Å; W1147-V1191 HydrophobicContact CB-CG2 4.38Å; W1147-V1191 HydrophobicContact CG-CG2 4.24Å; W1147-E1198 HydrophobicContact CB-CB 4.28Å; W1147-E1198 PolarHBondContact N-O 3.27Å
1148	N	88.5	Confident	89.4	Confident	69 Å²	69	17.1 Å²	17.1	37%	0.369	10%	0.098	S	C	.	.			trans	-121.8	15.7	-179	65.4	-11	0	0	0	112.3	N1150 T1153	N1148-N1150 VanDerWaalsContact C-N 3.26Å; N1148-N1150 PolarHBondContact O-N 3.18Å; N1148-N1150 WeakPolarHBondContact OD1-CB 3.21Å; N1148-N1150 PolarHBondContact OD1-N 3.12Å; N1148-N1150 VanDerWaalsContact OD1-N 3.07Å; N1148-N1150 PolarHBondContact OD1-O 2.94Å; N1148-T1153 PolarHBondContact ND2-OG1 3.33Å; N1148-T1153 PolarHBondContact OD1-OG1 3.06Å; N1148-T1153 VanDerWaalsContact OD1-OG1 3.08Å
1149	G	87.9	Confident	89.9	Confident	56 Å²	56	17.3 Å²	17.3	58%	0.577	10%	0.099	S	C	*	.	S	Bend	trans	73.6	9.6	-173.8	0	0	0	0	0	114.9
1150	N	91.4	Very high	90.5	Very high	37 Å²	37	17.1 Å²	17.1	20%	0.198	10%	0.098	C	C	.	.			trans	-125.9	108.8	-177.3	-176.7	-7.5	0	0	0	112.2	F977 N1148 V1152 T1153 F1154	F977-N1150 WeakPolarHBondContact CD2-ND2 3.38Å; F977-N1150 WeakPolarHBondContact CE2-ND2 3.38Å; F977-N1150 WeakPolarHBondContact CZ-ND2 3.46Å; N1148-N1150 VanDerWaalsContact C-N 3.26Å; N1148-N1150 PolarHBondContact O-N 3.18Å; N1148-N1150 WeakPolarHBondContact OD1-CB 3.21Å; N1148-N1150 PolarHBondContact OD1-N 3.12Å; N1148-N1150 VanDerWaalsContact OD1-N 3.07Å; N1148-N1150 PolarHBondContact OD1-O 2.94Å; N1150-V1152 VanDerWaalsContact C-N 3.26Å; N1150-V1152 PolarHBondContact O-N 2.95Å; N1150-V1152 WeakPolarHBondContact OD1-CB 3.4Å; N1150-V1152 PolarHBondContact OD1-N 3.22Å; N1150-T1153 WeakPolarHBondContact CB-OG1 3.31Å; N1150-T1153 PolarHBondContact O-N 3.25Å; N1150-T1153 PolarHBondContact O-OG1 2.87Å; N1150-F1154 PolarHBondContact O-N 2.99Å; N1150-F1154 VanDerWaalsContact O-N 3.07Å
1151	W	93.2	Very high	90.8	Very high	11 Å²	11	17.1 Å²	17.1	4%	0.042	10%	0.098	C	C	.	.	H	α-helix	trans	-58	-31.1	178.1	-71.5	104.9	0	0	0	114.4	I996 W999 M1010 E1011 W1147 L1155 I1182 P1184 H1187 V1216	I996-W1151 HydrophobicContact CD1-CB 3.59Å; I996-W1151 HydrophobicContact CD1-CG 4.38Å; I996-W1151 HydrophobicContact CG1-CB 4.01Å; W999-W1151 HydrophobicContact CH2-CD2 4.37Å; W999-W1151 HydrophobicContact CH2-CZ2 4.24Å; W999-W1151 AromaticContact CZ3-CD2 3.98Å; W999-W1151 HydrophobicContact CZ3-CD2 3.98Å; W999-W1151 HydrophobicContact CZ3-CE3 4.35Å; W999-W1151 HydrophobicContact CZ3-CG 4.2Å; M1010-W1151 HydrophobicContact CE-CG 4.48Å; E1011-W1151 PolarHBondContact OE1-NE1 2.92Å; W1147-W1151 AromaticContact CH2-CD2 3.78Å; W1147-W1151 HydrophobicContact CH2-CD2 3.78Å; W1147-W1151 AromaticContact CH2-CE2 3.73Å; W1147-W1151 HydrophobicContact CH2-CE3 4.26Å; W1147-W1151 HydrophobicContact CH2-CG 4.02Å; W1147-W1151 HydrophobicContact CH2-CZ2 4.17Å; W1147-W1151 AromaticContact CH2-NE1 3.94Å; W1147-W1151 HydrophobicContact CZ3-CD2 4.22Å; W1147-W1151 HydrophobicContact CZ3-CE3 4.3Å; W1151-L1155 WeakPolarHBondContact O-CB 3.38Å; W1151-L1155 VanDerWaalsContact O-CG 3.26Å; W1151-L1155 WeakPolarHBondContact O-CG 2.99Å; W1151-L1155 PolarHBondContact O-N 3.48Å; W1151-I1182 HydrophobicContact CE3-CG2 4.24Å; W1151-I1182 HydrophobicContact CH2-CG2 3.78Å; W1151-I1182 HydrophobicContact CZ2-CG2 4.5Å; W1151-I1182 HydrophobicContact CZ3-CG2 3.63Å; W1151-P1184 HydrophobicContact CH2-CB 4.17Å; W1151-P1184 HydrophobicContact CZ2-CB 3.71Å; W1151-H1187 HydrophobicContact CH2-CB 3.79Å; W1151-H1187 AromaticContact CH2-CD2 3.68Å; W1151-H1187 AromaticContact CH2-CG 3.67Å; W1151-V1216 HydrophobicContact CZ3-CG2 3.92Å
1152	V	94.3	Very high	90.9	Very high	3 Å²	3	17.8 Å²	17.8	2%	0.018	10%	0.104	C	C	.	.	H	α-helix	trans	-67	-48.3	-179	179.4	0	0	0	0	110.5	F977 Y978 P990 T992 I996 F1130 N1150 D1156	F977-V1152 HydrophobicContact CE2-CB 4.01Å; F977-V1152 HydrophobicContact CE2-CG1 4.01Å; F977-V1152 HydrophobicContact CZ-CB 4.16Å; F977-V1152 HydrophobicContact CZ-CG1 4.37Å; F977-V1152 HydrophobicContact CZ-CG2 4.29Å; Y978-V1152 HydrophobicContact CE1-CG1 4.04Å; P990-V1152 HydrophobicContact CB-CG1 3.94Å; P990-V1152 HydrophobicContact CG-CG1 3.85Å; T992-V1152 WeakPolarHBondContact OG1-CG1 3.38Å; T992-V1152 PolarHBondContact OG1-O 2.9Å; I996-V1152 HydrophobicContact CB-CG2 3.95Å; I996-V1152 HydrophobicContact CG1-CG2 3.91Å; I996-V1152 HydrophobicContact CG2-CG2 4Å; F1130-V1152 HydrophobicContact CE1-CG1 4.28Å; F1130-V1152 HydrophobicContact CZ-CG1 4.12Å; N1150-V1152 VanDerWaalsContact C-N 3.26Å; N1150-V1152 PolarHBondContact O-N 2.95Å; N1150-V1152 WeakPolarHBondContact OD1-CB 3.4Å; N1150-V1152 PolarHBondContact OD1-N 3.22Å; V1152-D1156 WeakPolarHBondContact O-CB 3.47Å; V1152-D1156 PolarHBondContact O-N 3.3Å; V1152-D1156 VanDerWaalsContact O-N 3.07Å
1153	T	94	Very high	90.7	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-72.5	-37.3	-179.6	45.4	0	0	0	0	112.1	F977 S1129 F1130 N1148 N1150 D1156 A1157	F977-T1153 HydrophobicContact CD2-CG2 3.82Å; F977-T1153 HydrophobicContact CE2-CG2 4.02Å; S1129-T1153 WeakPolarHBondContact O-CB 3.34Å; S1129-T1153 WeakPolarHBondContact O-CG2 3.32Å; F1130-T1153 HydrophobicContact CD1-CG2 3.81Å; F1130-T1153 HydrophobicContact CD2-CG2 3.97Å; F1130-T1153 HydrophobicContact CE1-CG2 3.67Å; F1130-T1153 HydrophobicContact CE2-CG2 3.82Å; F1130-T1153 HydrophobicContact CG-CG2 3.95Å; F1130-T1153 HydrophobicContact CZ-CG2 3.66Å; N1148-T1153 PolarHBondContact ND2-OG1 3.33Å; N1148-T1153 PolarHBondContact OD1-OG1 3.06Å; N1148-T1153 VanDerWaalsContact OD1-OG1 3.08Å; N1150-T1153 WeakPolarHBondContact CB-OG1 3.31Å; N1150-T1153 PolarHBondContact O-N 3.25Å; N1150-T1153 PolarHBondContact O-OG1 2.87Å; T1153-D1156 PolarHBondContact O-N 3.42Å; T1153-A1157 WeakPolarHBondContact O-CB 3.45Å; T1153-A1157 PolarHBondContact O-N 3.05Å
1154	F	94.6	Very high	90.3	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-64.8	-47.8	175.6	179.4	-98.1	0	0	0	112.2	I1145 W1147 N1150 D1156 A1157 L1158 H1187 V1200 A1213 V1216	I1145-F1154 HydrophobicContact CB-CE2 4.03Å; I1145-F1154 HydrophobicContact CG2-CD2 3.67Å; I1145-F1154 HydrophobicContact CG2-CE2 3.68Å; W1147-F1154 HydrophobicContact CE3-CB 3.84Å; W1147-F1154 HydrophobicContact CE3-CD2 4.03Å; W1147-F1154 AromaticContact CE3-CG 3.9Å; W1147-F1154 HydrophobicContact CE3-CG 3.9Å; W1147-F1154 HydrophobicContact CZ3-CB 3.7Å; W1147-F1154 HydrophobicContact CZ3-CD1 4.48Å; W1147-F1154 HydrophobicContact CZ3-CG 4Å; N1150-F1154 PolarHBondContact O-N 2.99Å; N1150-F1154 VanDerWaalsContact O-N 3.07Å; F1154-D1156 VanDerWaalsContact C-N 3.29Å; F1154-D1156 PolarHBondContact O-N 3.18Å; F1154-A1157 PolarHBondContact O-N 3.25Å; F1154-L1158 HydrophobicContact CD1-CD1 4.25Å; F1154-L1158 HydrophobicContact CE1-CD1 3.66Å; F1154-L1158 HydrophobicContact CE1-CG 4.45Å; F1154-L1158 HydrophobicContact CZ-CD1 4.11Å; F1154-L1158 PolarHBondContact O-N 3.4Å; F1154-H1187 AromaticContact CD1-CE1 3.98Å; F1154-H1187 AromaticContact CE1-CE1 3.51Å; F1154-H1187 AromaticContact CE1-ND1 3.99Å; F1154-H1187 AromaticContact CE2-CE1 3.87Å; F1154-H1187 AromaticContact CZ-CE1 3.47Å; F1154-H1187 VanDerWaalsContact CZ-CE1 3.47Å; F1154-H1187 WeakPolarHBondContact CZ-CE1 3.45Å; F1154-V1200 HydrophobicContact CE2-CB 4.14Å; F1154-V1200 HydrophobicContact CE2-CG2 4.33Å; F1154-V1200 HydrophobicContact CZ-CB 4.37Å; F1154-V1200 HydrophobicContact CZ-CG1 4.36Å; F1154-A1213 HydrophobicContact CZ-CB 3.98Å; F1154-V1216 HydrophobicContact CE1-CB 4.49Å; F1154-V1216 HydrophobicContact CE1-CG2 4.02Å
1155	L	93.1	Very high	89.7	Confident	6 Å²	6	14.8 Å²	14.8	3%	0.031	9%	0.092	C	C	.	.	H	α-helix	trans	-63.7	-36.3	176	-70.5	179.6	0	0	0	111.5	T992 I996 W1151 L1158 L1159 L1180 I1182 V1216	T992-L1155 HydrophobicContact CG2-CB 3.59Å; I996-L1155 HydrophobicContact CD1-CD1 3.74Å; I996-L1155 HydrophobicContact CG1-CD1 4.21Å; W1151-L1155 WeakPolarHBondContact O-CB 3.38Å; W1151-L1155 VanDerWaalsContact O-CG 3.26Å; W1151-L1155 WeakPolarHBondContact O-CG 2.99Å; W1151-L1155 PolarHBondContact O-N 3.48Å; L1155-L1158 HydrophobicContact CD2-CD1 4.3Å; L1155-L1158 WeakPolarHBondContact O-CB 3.42Å; L1155-L1158 PolarHBondContact O-N 2.89Å; L1155-L1159 PolarHBondContact O-N 3.48Å; L1155-L1180 HydrophobicContact CD1-CD2 4.43Å; L1155-L1180 HydrophobicContact CD2-CD1 4.36Å; L1155-I1182 HydrophobicContact CD1-CD1 4.15Å; L1155-V1216 HydrophobicContact CD2-CG1 3.73Å; L1155-V1216 HydrophobicContact CD2-CG2 4.31Å
1156	D	93.4	Very high	88.7	Confident	4 Å²	4	18.4 Å²	18.4	2%	0.021	11%	0.109	C	C	.	.	H	α-helix	trans	-69	-37.8	179.8	-164.7	73.2	0	0	0	111.5	H981 T992 Y1126 F1130 V1152 T1153 F1154 L1158 L1159 Q1160	H981-D1156 IonicContact NE2-OD1 3.81Å; H981-D1156 IonicContact NE2-OD2 3.53Å; T992-D1156 HydrophobicContact CG2-CB 4.17Å; Y1126-D1156 WeakPolarHBondContact CE1-OD2 3.46Å; Y1126-D1156 PolarHBondContact OH-OD2 2.94Å; F1130-D1156 HydrophobicContact CD1-CB 3.93Å; F1130-D1156 HydrophobicContact CE1-CB 3.94Å; V1152-D1156 WeakPolarHBondContact O-CB 3.47Å; V1152-D1156 PolarHBondContact O-N 3.3Å; V1152-D1156 VanDerWaalsContact O-N 3.07Å; T1153-D1156 PolarHBondContact O-N 3.42Å; F1154-D1156 VanDerWaalsContact C-N 3.29Å; F1154-D1156 PolarHBondContact O-N 3.18Å; D1156-L1158 PolarHBondContact O-N 3.31Å; D1156-L1159 CarbonylContact O-C 3.49Å; D1156-L1159 WeakPolarHBondContact O-CA 3.27Å; D1156-L1159 WeakPolarHBondContact O-CB 3.15Å; D1156-L1159 PolarHBondContact O-N 2.82Å; D1156-Q1160 VanDerWaalsContact O-CG 3.27Å; D1156-Q1160 WeakPolarHBondContact O-CG 3.32Å; D1156-Q1160 PolarHBondContact O-N 3.23Å; D1156-Q1160 PolarHBondContact OD2-NE2 3.3Å
1157	A	92.2	Very high	87.3	Confident	0 Å²	0	18 Å²	18	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.1	-23.3	172.9	0	0	0	0	0	114	C1132 I1133 I1145 T1153 F1154 T1161	C1132-A1157 HydrophobicContact CB-CB 3.76Å; I1133-A1157 HydrophobicContact CG1-CB 4.29Å; I1145-A1157 HydrophobicContact CD1-CB 4.3Å; I1145-A1157 HydrophobicContact CG2-CB 3.64Å; T1153-A1157 WeakPolarHBondContact O-CB 3.45Å; T1153-A1157 PolarHBondContact O-N 3.05Å; F1154-A1157 PolarHBondContact O-N 3.25Å; A1157-T1161 PolarHBondContact O-N 3.18Å; A1157-T1161 PolarHBondContact O-OG1 3.01Å
1158	L	89.7	Confident	85.9	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-75.9	-38.2	168.2	-67.7	166.2	0	0	0	112.4	I1145 F1154 L1155 D1156 Q1160 T1161 A1162 A1202 F1211 A1213 V1216	I1145-L1158 HydrophobicContact CD1-CD2 3.4Å; I1145-L1158 VanDerWaalsContact CD1-CD2 3.4Å; I1145-L1158 HydrophobicContact CD1-CG 3.8Å; F1154-L1158 HydrophobicContact CD1-CD1 4.25Å; F1154-L1158 HydrophobicContact CE1-CD1 3.66Å; F1154-L1158 HydrophobicContact CE1-CG 4.45Å; F1154-L1158 HydrophobicContact CZ-CD1 4.11Å; F1154-L1158 PolarHBondContact O-N 3.4Å; L1155-L1158 HydrophobicContact CD2-CD1 4.3Å; L1155-L1158 WeakPolarHBondContact O-CB 3.42Å; L1155-L1158 PolarHBondContact O-N 2.89Å; D1156-L1158 PolarHBondContact O-N 3.31Å; L1158-Q1160 VanDerWaalsContact C-N 3.33Å; L1158-T1161 WeakPolarHBondContact O-CB 3.31Å; L1158-T1161 PolarHBondContact O-N 2.86Å; L1158-A1162 PolarHBondContact O-N 3.08Å; L1158-A1162 VanDerWaalsContact O-N 3.11Å; L1158-A1202 HydrophobicContact CD2-CB 3.72Å; L1158-F1211 HydrophobicContact CB-CD2 3.79Å; L1158-F1211 HydrophobicContact CB-CE1 4.39Å; L1158-F1211 HydrophobicContact CB-CE2 3.36Å; L1158-F1211 HydrophobicContact CB-CG 4.47Å; L1158-F1211 HydrophobicContact CB-CZ 3.71Å; L1158-F1211 HydrophobicContact CD1-CD2 4.14Å; L1158-F1211 HydrophobicContact CD1-CE2 3.95Å; L1158-F1211 HydrophobicContact CD2-CD2 3.95Å; L1158-F1211 HydrophobicContact CD2-CE2 4.36Å; L1158-F1211 HydrophobicContact CD2-CG 4.5Å; L1158-F1211 HydrophobicContact CG-CD2 4.2Å; L1158-F1211 HydrophobicContact CG-CE2 4.1Å; L1158-F1211 WeakPolarHBondContact O-CE1 3.26Å; L1158-A1213 HydrophobicContact CD1-CB 4.18Å; L1158-A1213 HydrophobicContact CD2-CB 3.56Å; L1158-A1213 HydrophobicContact CG-CB 4.47Å; L1158-V1216 HydrophobicContact CD1-CB 4.46Å; L1158-V1216 HydrophobicContact CD1-CG1 4.02Å
1159	L	88.5	Confident	84.8	Confident	8 Å²	8	20.2 Å²	20.2	4%	0.042	12%	0.118	C	C	.	.	H	α-helix	trans	-61	-43.8	170.2	-51.3	-175.1	0	0	0	110.8	F991 T992 L1155 D1156 T1161 A1162 L1163 P1174 F1211 L1221	F991-L1159 HydrophobicContact CB-CD1 4.44Å; F991-L1159 HydrophobicContact CD1-CD1 3.96Å; T992-L1159 HydrophobicContact CG2-CD1 3.6Å; T992-L1159 HydrophobicContact CG2-CG 4.18Å; L1155-L1159 PolarHBondContact O-N 3.48Å; D1156-L1159 CarbonylContact O-C 3.49Å; D1156-L1159 WeakPolarHBondContact O-CA 3.27Å; D1156-L1159 WeakPolarHBondContact O-CB 3.15Å; D1156-L1159 PolarHBondContact O-N 2.82Å; L1159-T1161 VanDerWaalsContact C-N 3.3Å; L1159-T1161 PolarHBondContact O-N 3.3Å; L1159-A1162 PolarHBondContact O-N 2.96Å; L1159-L1163 WeakPolarHBondContact O-CG 3.34Å; L1159-L1163 PolarHBondContact O-N 3.22Å; L1159-P1174 HydrophobicContact CD1-CB 4.34Å; L1159-P1174 HydrophobicContact CD1-CG 4.03Å; L1159-F1211 HydrophobicContact CD2-CZ 4.09Å; L1159-L1221 HydrophobicContact CD2-CD1 3.74Å; L1159-L1221 HydrophobicContact CD2-CD2 3.53Å; L1159-L1221 HydrophobicContact CD2-CG 4.3Å
1160	Q	90.2	Very high	84	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-59.5	-37.9	173.8	-64.5	165.9	22.3	0	0	112	Y1116 L1119 Y1126 F1130 I1133 D1156 L1158 L1163 L1164	Y1116-Q1160 VanDerWaalsContact CZ-OE1 3.28Å; Y1116-Q1160 PolarHBondContact OH-OE1 2.98Å; L1119-Q1160 HydrophobicContact CD1-CB 4.25Å; L1119-Q1160 HydrophobicContact CD1-CG 4.41Å; Y1126-Q1160 HydrophobicContact CE2-CG 3.69Å; Y1126-Q1160 WeakPolarHBondContact OH-CG 3.23Å; F1130-Q1160 PolarHBondContact O-NE2 3.26Å; F1130-Q1160 VanDerWaalsContact O-NE2 3.14Å; F1130-Q1160 PolarHBondContact O-OE1 3.17Å; I1133-Q1160 HydrophobicContact CD1-CB 3.82Å; D1156-Q1160 VanDerWaalsContact O-CG 3.27Å; D1156-Q1160 WeakPolarHBondContact O-CG 3.32Å; D1156-Q1160 PolarHBondContact O-N 3.23Å; D1156-Q1160 PolarHBondContact OD2-NE2 3.3Å; L1158-Q1160 VanDerWaalsContact C-N 3.33Å; Q1160-L1163 PolarHBondContact O-N 2.89Å; Q1160-L1164 PolarHBondContact O-N 3.15Å
1161	T	86.7	Confident	83.6	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-61.7	-45.1	174	-67.4	0	0	0	0	111.4	T1143 A1157 L1158 L1159 L1163 L1164 M1165 C1204	T1143-T1161 HydrophobicContact CG2-CG2 3.65Å; T1143-T1161 WeakPolarHBondContact OG1-CG2 3.33Å; T1143-T1161 PolarHBondContact OG1-OG1 3.47Å; A1157-T1161 PolarHBondContact O-N 3.18Å; A1157-T1161 PolarHBondContact O-OG1 3.01Å; L1158-T1161 WeakPolarHBondContact O-CB 3.31Å; L1158-T1161 PolarHBondContact O-N 2.86Å; L1159-T1161 VanDerWaalsContact C-N 3.3Å; L1159-T1161 PolarHBondContact O-N 3.3Å; T1161-L1163 PolarHBondContact O-N 3.16Å; T1161-L1164 WeakPolarHBondContact O-CB 3.36Å; T1161-L1164 PolarHBondContact O-N 2.8Å; T1161-L1164 VanDerWaalsContact O-N 3.09Å; T1161-M1165 PolarHBondContact O-N 3.17Å; T1161-C1204 HydrophobicContact CG2-CB 4.33Å
1162	A	82.1	Confident	83.2	Confident	20 Å²	20	18.4 Å²	18.4	17%	0.165	10%	0.097	C	C	.	.	H	α-helix	trans	-62	-41.7	175.4	0	0	0	0	0	112.4	L1158 L1159 L1164 M1165 F1211 L1221	L1158-A1162 PolarHBondContact O-N 3.08Å; L1158-A1162 VanDerWaalsContact O-N 3.11Å; L1159-A1162 PolarHBondContact O-N 2.96Å; A1162-L1164 PolarHBondContact O-N 3.14Å; A1162-M1165 PolarHBondContact O-N 3Å; A1162-F1211 HydrophobicContact CB-CD1 4.2Å; A1162-F1211 HydrophobicContact CB-CE1 4.04Å; A1162-L1221 HydrophobicContact CB-CD2 4.09Å
1163	L	83.9	Confident	82.8	Confident	16 Å²	16	20 Å²	20	8%	0.084	10%	0.104	C	C	.	.	H	α-helix	trans	-62.1	-24.9	174	-67.7	170.4	0	0	0	113.1	R1122 Y1124 L1159 Q1160 T1161 K1172 A1223	R1122-L1163 PolarHBondContact NH1-O 3Å; Y1124-L1163 HydrophobicContact CE1-CD1 3.98Å; Y1124-L1163 HydrophobicContact CE2-CD1 4.43Å; L1159-L1163 WeakPolarHBondContact O-CG 3.34Å; L1159-L1163 PolarHBondContact O-N 3.22Å; Q1160-L1163 PolarHBondContact O-N 2.89Å; T1161-L1163 PolarHBondContact O-N 3.16Å; L1163-K1172 HydrophobicContact CD2-CB 4.12Å; L1163-A1223 HydrophobicContact CD2-CB 4.46Å
1164	L	83.1	Confident	82.5	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-79.1	-23.2	-179.3	-151.8	74.3	0	0	0	113.7	L1110 V1115 E1118 A1136 Q1160 T1161 A1162 R2077	L1110-L1164 HydrophobicContact CD1-CD2 4.12Å; V1115-L1164 HydrophobicContact CG1-CD1 4.12Å; V1115-L1164 HydrophobicContact CG1-CD2 4.18Å; V1115-L1164 HydrophobicContact CG2-CD2 4.11Å; E1118-L1164 HydrophobicContact CB-CD1 4.49Å; E1118-L1164 HydrophobicContact CG-CD1 4.08Å; A1136-L1164 HydrophobicContact CB-CD2 3.63Å; Q1160-L1164 PolarHBondContact O-N 3.15Å; T1161-L1164 WeakPolarHBondContact O-CB 3.36Å; T1161-L1164 PolarHBondContact O-N 2.8Å; T1161-L1164 VanDerWaalsContact O-N 3.09Å; A1162-L1164 PolarHBondContact O-N 3.14Å; L1164-R2077 VanDerWaalsContact O-CZ 3.3Å; L1164-R2077 PolarHBondContact O-NH1 3.01Å; L1164-R2077 PolarHBondContact O-NH2 2.91Å
1165	M	78.9	Confident	82	Confident	16 Å²	16	22.4 Å²	22.4	8%	0.079	12%	0.12	C	C	.	.	H	α-helix	trans	-68.8	-32	177	-82.3	-150.8	-57.2	0	0	113.6	G1140 D1141 T1161 A1162 C1204 A1206	G1140-M1165 WeakPolarHBondContact O-CG 3.34Å; D1141-M1165 HydrophobicContact CB-SD 4.08Å; T1161-M1165 PolarHBondContact O-N 3.17Å; A1162-M1165 PolarHBondContact O-N 3Å; M1165-C1204 HydrophobicContact CE-CB 3.97Å; M1165-C1204 VanDerWaalsContact CE-SG 3.51Å; M1165-C1204 HydrophobicContact CG-CB 4.34Å; M1165-C1204 HydrophobicContact SD-CB 3.85Å; M1165-A1206 HydrophobicContact CE-CB 3.98Å; M1165-A1206 HydrophobicContact SD-CB 4.36Å
1166	E	72	Confident	81.7	Confident	76 Å²	76	25.4 Å²	25.4	36%	0.355	13%	0.131	S	C	.	.	S	Bend	trans	-83.5	140.9	171.3	-62.6	-172.8	149.3	0	0	109.7	R1122 K1172 R2077	R1122-E1166 PolarHBondContact NH1-O 3.31Å; R1122-E1166 PolarHBondContact NH2-O 3.33Å; E1166-K1172 IonicContact OE1-NZ 3.82Å; E1166-K1172 PolarHBondContact OE1-NZ 3.38Å; E1166-K1172 IonicContact OE2-NZ 2.78Å; E1166-K1172 PolarHBondContact OE2-NZ 3.19Å; E1166-R2077 PolarHBondContact O-NH2 3.06Å
1167	K	63.1	Low	81.6	Confident	33 Å²	33	25.5 Å²	25.5	14%	0.143	13%	0.131	C	C	.	.			trans	-102.2	104.4	154.3	-163.1	-170.6	-173.9	-163.7	0	108.6	N2052 F2081	K1167-N2052 PolarHBondContact NZ-OD1 2.7Å; K1167-F2081 HydrophobicContact CB-CB 4.41Å; K1167-F2081 HydrophobicContact CB-CD1 3.61Å; K1167-F2081 HydrophobicContact CB-CD2 3.8Å; K1167-F2081 HydrophobicContact CB-CE1 3.68Å; K1167-F2081 HydrophobicContact CB-CE2 3.88Å; K1167-F2081 HydrophobicContact CB-CG 3.67Å; K1167-F2081 HydrophobicContact CB-CZ 3.82Å; K1167-F2081 HydrophobicContact CD-CB 3.74Å; K1167-F2081 HydrophobicContact CD-CD2 3.96Å; K1167-F2081 HydrophobicContact CD-CG 3.85Å; K1167-F2081 HydrophobicContact CG-CD2 4.31Å; K1167-F2081 HydrophobicContact CG-CG 4.3Å
1168	M	63.8	Low	81.5	Confident	53 Å²	53	32.1 Å²	32.1	26%	0.261	16%	0.156	S	C	.	.			trans	-136.5	140.4	169	-66.8	-169.3	179.9	0	0	108.5	R1122 T1170 K1172 I1744	R1122-M1168 PolarHBondContact NE-O 2.61Å; M1168-T1170 PolarHBondContact O-N 2.94Å; M1168-T1170 VanDerWaalsContact O-N 3.11Å; M1168-K1172 PolarHBondContact SD-NZ 3.06Å; M1168-I1744 HydrophobicContact CE-CD1 4.27Å
1169	D	64.8	Low	81.6	Confident	86 Å²	86	33.8 Å²	33.8	46%	0.46	16%	0.163	S	C	.	.	S	Bend	trans	-82.2	20.7	-178.9	-53.7	-16.6	0	0	0	111.6	N2052	D1169-N2052 PolarHBondContact OD2-ND2 3.02Å
1170	T	71.9	Confident	81.8	Confident	43 Å²	43	33.4 Å²	33.4	26%	0.264	16%	0.161	S	C	.	.	S	Bend	trans	-112.3	143.2	-174.2	55.2	0	0	0	0	112.4	M1168 T1225	M1168-T1170 PolarHBondContact O-N 2.94Å; M1168-T1170 VanDerWaalsContact O-N 3.11Å; T1170-T1225 HydrophobicContact CG2-CG2 4.15Å
1171	L	81.7	Confident	81.9	Confident	5 Å²	5	33.9 Å²	33.9	3%	0.026	16%	0.163	C	C	.	.			trans	-75.8	127.7	170.1	-174.8	67.9	0	0	0	109.3	I983 D984 Y1124 T1225 V1226 R1228	I983-L1171 HydrophobicContact CG2-CD1 3.74Å; I983-L1171 HydrophobicContact CG2-CD2 4.11Å; I983-L1171 HydrophobicContact CG2-CG 4.44Å; D984-L1171 HydrophobicContact CB-CD2 3.91Å; Y1124-L1171 HydrophobicContact CD1-CD1 3.8Å; Y1124-L1171 HydrophobicContact CD2-CD1 4.4Å; Y1124-L1171 HydrophobicContact CE1-CD1 3.52Å; Y1124-L1171 HydrophobicContact CE2-CD1 4.16Å; Y1124-L1171 HydrophobicContact CG-CD1 4.22Å; L1171-T1225 CarbonylContact O-C 3.55Å; L1171-T1225 WeakPolarHBondContact O-CA 3.47Å; L1171-V1226 PolarHBondContact O-N 2.91Å; L1171-R1228 HydrophobicContact CB-CG 3.88Å; L1171-R1228 HydrophobicContact CD2-CG 4.18Å
1172	K	85.2	Confident	82.2	Confident	18 Å²	18	33.9 Å²	33.9	8%	0.078	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	134.2	175.7	-67.5	-173.7	176.9	179.5	0	110	Y1124 L1163 E1166 M1168 A1223 Q1224	Y1124-K1172 WeakPolarHBondContact CE1-O 3.43Å; Y1124-K1172 PolarHBondContact OH-N 2.86Å; Y1124-K1172 PolarHBondContact OH-O 2.78Å; L1163-K1172 HydrophobicContact CD2-CB 4.12Å; E1166-K1172 IonicContact OE1-NZ 3.82Å; E1166-K1172 PolarHBondContact OE1-NZ 3.38Å; E1166-K1172 IonicContact OE2-NZ 2.78Å; E1166-K1172 PolarHBondContact OE2-NZ 3.19Å; M1168-K1172 PolarHBondContact SD-NZ 3.06Å; K1172-A1223 HydrophobicContact CB-CB 4.06Å; K1172-Q1224 CarbonylContact C-O 3.58Å; K1172-Q1224 WeakPolarHBondContact CA-O 3.01Å
1173	L	85.9	Confident	82.6	Confident	35 Å²	35	33.7 Å²	33.7	18%	0.183	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	138.8	172.4	-70.1	-177.8	0	0	0	110.8	I983 L988 T1175 A1223 Q1224 V1226	I983-L1173 HydrophobicContact CD1-CD2 3.71Å; I983-L1173 HydrophobicContact CG2-CD2 4.25Å; L988-L1173 HydrophobicContact CD1-CD1 4.13Å; L1173-T1175 PolarHBondContact O-N 3.17Å; L1173-A1223 CarbonylContact O-C 3.53Å; L1173-A1223 WeakPolarHBondContact O-CA 3.2Å; L1173-A1223 WeakPolarHBondContact O-CB 3.38Å; L1173-Q1224 PolarHBondContact N-O 2.85Å; L1173-Q1224 PolarHBondContact O-N 2.88Å; L1173-V1226 HydrophobicContact CB-CG2 3.94Å; L1173-V1226 HydrophobicContact CD1-CG2 4.03Å; L1173-V1226 HydrophobicContact CG-CG2 3.81Å
1174	P	86.9	Confident	83	Confident	24 Å²	24	33 Å²	33	16%	0.156	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	123.8	170.6	28.7	-34.9	0	0	0	109.4	F991 L1159 L1221	F991-P1174 HydrophobicContact CB-CB 4.36Å; F991-P1174 HydrophobicContact CB-CG 3.65Å; F991-P1174 HydrophobicContact CD1-CB 4.22Å; F991-P1174 HydrophobicContact CD1-CG 4.35Å; F991-P1174 HydrophobicContact CD2-CB 3.97Å; F991-P1174 HydrophobicContact CD2-CG 4.09Å; F991-P1174 VanDerWaalsContact CD2-O 3.24Å; F991-P1174 WeakPolarHBondContact CD2-O 3.41Å; F991-P1174 HydrophobicContact CE2-CB 4.31Å; F991-P1174 HydrophobicContact CG-CB 3.94Å; F991-P1174 HydrophobicContact CG-CG 3.79Å; L1159-P1174 HydrophobicContact CD1-CB 4.34Å; L1159-P1174 HydrophobicContact CD1-CG 4.03Å; P1174-L1221 HydrophobicContact CB-CD1 4.35Å
1175	T	84.8	Confident	83.2	Confident	28 Å²	28	37.5 Å²	37.5	17%	0.172	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	-23.2	177.9	58.5	0	0	0	0	112.5	V1022 L1173 V1222 Q1224	V1022-T1175 PolarHBondContact N-O 3.42Å; L1173-T1175 PolarHBondContact O-N 3.17Å; T1175-V1222 PolarHBondContact N-O 2.79Å; T1175-Q1224 HydrophobicContact CG2-CB 4.3Å; T1175-Q1224 HydrophobicContact CG2-CG 4.38Å
1176	R	87.8	Confident	83.6	Confident	69 Å²	69	39.4 Å²	39.4	26%	0.26	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	153	-176.6	-61.1	167.5	52.9	177.2	3.2	112.6	V1020 V1222 D1928	V1020-R1176 VanDerWaalsContact O-CA 3.26Å; V1020-R1176 WeakPolarHBondContact O-CA 3.47Å; R1176-V1222 HydrophobicContact CB-CB 4.26Å; R1176-V1222 PolarHBondContact N-O 2.93Å; R1176-V1222 PolarHBondContact O-N 3.05Å; R1176-D1928 IonicContact CZ-OD2 2.75Å; R1176-D1928 VanDerWaalsContact NH1-CB 3.27Å; R1176-D1928 IonicContact NH1-OD2 2.82Å; R1176-D1928 PolarHBondContact NH1-OD2 2.82Å; R1176-D1928 IonicContact NH2-OD2 2.71Å; R1176-D1928 PolarHBondContact NH2-OD2 3.33Å
1177	M	90	Very high	84.6	Confident	6 Å²	6	35.8 Å²	35.8	3%	0.03	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	128.2	168.4	-168.4	-151.1	-55.5	0	0	110.2	F991 L995 V1020 L1180 V1218 L1221	F991-M1177 HydrophobicContact CE1-CB 4.36Å; F991-M1177 HydrophobicContact CE1-CE 3.77Å; F991-M1177 HydrophobicContact CZ-CB 4.12Å; L995-M1177 HydrophobicContact CD1-CE 3.52Å; L995-M1177 HydrophobicContact CD2-CE 4.46Å; V1020-M1177 PolarHBondContact N-O 3.25Å; V1020-M1177 PolarHBondContact O-N 2.91Å; M1177-L1180 HydrophobicContact CE-CB 4.3Å; M1177-L1180 HydrophobicContact CE-CD2 4.19Å; M1177-L1180 HydrophobicContact SD-CB 3.41Å; M1177-L1180 WeakPolarHBondContact SD-CB 3.31Å; M1177-L1180 HydrophobicContact SD-CD2 4.35Å; M1177-L1180 HydrophobicContact SD-CG 4.47Å; M1177-V1218 HydrophobicContact CG-CG1 3.92Å; M1177-V1218 HydrophobicContact SD-CG1 3.8Å; M1177-V1218 HydrophobicContact SD-CG2 4.23Å; M1177-L1221 HydrophobicContact CB-CD1 4.28Å; M1177-L1221 HydrophobicContact CG-CD1 4.29Å
1178	R	90.7	Very high	85.8	Confident	138 Å²	138	38 Å²	38	52%	0.521	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	-36.6	-178.1	-170.7	178.3	172.8	-169.6	-6.6	114	E1018 D1019 E1220	E1018-R1178 VanDerWaalsContact CA-O 3.29Å; E1018-R1178 WeakPolarHBondContact CA-O 3.31Å; D1019-R1178 PolarHBondContact N-O 3.43Å; R1178-E1220 HydrophobicContact CB-CB 3.89Å; R1178-E1220 WeakPolarHBondContact CD-OE2 3.39Å; R1178-E1220 IonicContact CZ-OE1 2.71Å; R1178-E1220 IonicContact CZ-OE2 3.74Å; R1178-E1220 PolarHBondContact N-O 3.28Å; R1178-E1220 IonicContact NE-OE2 2.69Å; R1178-E1220 IonicContact NH1-OE1 2.77Å; R1178-E1220 PolarHBondContact NH1-OE1 3.09Å; R1178-E1220 IonicContact NH1-OE2 2.75Å; R1178-E1220 PolarHBondContact NH1-OE2 3.13Å
1179	Y	91.7	Very high	86.9	Confident	35 Å²	35	42.6 Å²	42.6	14%	0.137	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	126	-170.5	-177	-83.4	0	0	0	111.9	L1016 R1181 E1217 V1218 R1219	L1016-Y1179 HydrophobicContact CD1-CD2 3.62Å; L1016-Y1179 HydrophobicContact CD1-CE1 4.41Å; L1016-Y1179 HydrophobicContact CD1-CE2 3.28Å; L1016-Y1179 HydrophobicContact CD1-CG 4.32Å; L1016-Y1179 HydrophobicContact CD2-CE2 4.32Å; L1016-Y1179 HydrophobicContact CG-CE2 4.45Å; Y1179-R1181 HydrophobicContact CE1-CB 3.96Å; Y1179-E1217 HydrophobicContact CE1-CG 4.09Å; Y1179-V1218 WeakPolarHBondContact O-CA 3.31Å; Y1179-R1219 HydrophobicContact CD1-CB 4.42Å; Y1179-R1219 HydrophobicContact CD1-CG 4.07Å; Y1179-R1219 PolarHBondContact N-O 2.98Å; Y1179-R1219 PolarHBondContact O-N 3.43Å
1180	L	92.6	Very high	87.9	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	125.6	168.4	159.7	64.7	0	0	0	109.9	L995 L1016 I1017 L1155 M1177 I1182 V1216 E1217 V1218	L995-L1180 HydrophobicContact CD1-CD2 3.78Å; L1016-L1180 CarbonylContact C-O 3.52Å; L1016-L1180 WeakPolarHBondContact CA-O 3.43Å; I1017-L1180 HydrophobicContact CB-CB 4.35Å; I1017-L1180 HydrophobicContact CD1-CD2 4.15Å; I1017-L1180 PolarHBondContact N-O 3.38Å; I1017-L1180 PolarHBondContact O-N 2.87Å; L1155-L1180 HydrophobicContact CD1-CD2 4.43Å; L1155-L1180 HydrophobicContact CD2-CD1 4.36Å; M1177-L1180 HydrophobicContact CE-CB 4.3Å; M1177-L1180 HydrophobicContact CE-CD2 4.19Å; M1177-L1180 HydrophobicContact SD-CB 3.41Å; M1177-L1180 WeakPolarHBondContact SD-CB 3.31Å; M1177-L1180 HydrophobicContact SD-CD2 4.35Å; M1177-L1180 HydrophobicContact SD-CG 4.47Å; L1180-I1182 HydrophobicContact CD1-CD1 4.28Å; L1180-I1182 HydrophobicContact CD1-CG1 3.66Å; L1180-I1182 HydrophobicContact CD2-CD1 4.18Å; L1180-I1182 HydrophobicContact CD2-CG1 4.37Å; L1180-I1182 HydrophobicContact CG-CD1 4.34Å; L1180-I1182 HydrophobicContact CG-CG1 3.99Å; L1180-V1216 HydrophobicContact CD1-CG1 3.84Å; L1180-E1217 CarbonylContact C-O 3.56Å; L1180-E1217 WeakPolarHBondContact CA-O 3.5Å; L1180-V1218 HydrophobicContact CB-CG2 4.19Å; L1180-V1218 HydrophobicContact CD1-CG2 3.61Å; L1180-V1218 HydrophobicContact CG-CG2 4.45Å
1181	R	91.9	Very high	88.7	Confident	9 Å²	9	40 Å²	40	3%	0.034	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	129.9	168.3	-179.9	175.3	-176.7	179	-1.6	109.2	V1015 I1084 R1089 Y1093 Y1179 V1216 E1217	V1015-R1181 WeakPolarHBondContact O-CA 3.37Å; I1084-R1181 HydrophobicContact CD1-CG 3.84Å; R1089-R1181 PolarHBondContact O-NH1 3.03Å; Y1093-R1181 HydrophobicContact CE1-CG 4.4Å; Y1093-R1181 PolarHBondContact OH-NE 2.96Å; Y1093-R1181 VanDerWaalsContact OH-NE 3.13Å; Y1179-R1181 HydrophobicContact CE1-CB 3.96Å; R1181-V1216 WeakPolarHBondContact O-CA 3.41Å; R1181-E1217 HydrophobicContact CB-CB 4.38Å; R1181-E1217 PolarHBondContact N-O 3.36Å; R1181-E1217 PolarHBondContact O-N 2.8Å
1182	I	92.7	Very high	89.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	124.8	171.6	-52.7	173.4	0	0	0	108.6	I996 W999 P1014 V1015 W1151 L1155 L1180 V1216	I996-I1182 HydrophobicContact CD1-CD1 4.45Å; W999-I1182 HydrophobicContact CE3-CD1 3.66Å; W999-I1182 HydrophobicContact CH2-CB 4.32Å; W999-I1182 HydrophobicContact CH2-CD1 4.41Å; W999-I1182 HydrophobicContact CH2-CG2 3.57Å; W999-I1182 HydrophobicContact CZ2-CG2 4.34Å; W999-I1182 HydrophobicContact CZ3-CB 4.35Å; W999-I1182 HydrophobicContact CZ3-CD1 3.61Å; W999-I1182 HydrophobicContact CZ3-CG2 3.77Å; P1014-I1182 CarbonylContact C-O 3.18Å; P1014-I1182 VanDerWaalsContact CA-O 3.26Å; P1014-I1182 WeakPolarHBondContact CA-O 3.35Å; V1015-I1182 HydrophobicContact CG2-CB 4.12Å; V1015-I1182 HydrophobicContact CG2-CD1 4.47Å; V1015-I1182 PolarHBondContact N-O 2.73Å; V1015-I1182 PolarHBondContact O-N 3.41Å; W1151-I1182 HydrophobicContact CE3-CG2 4.24Å; W1151-I1182 HydrophobicContact CH2-CG2 3.78Å; W1151-I1182 HydrophobicContact CZ2-CG2 4.5Å; W1151-I1182 HydrophobicContact CZ3-CG2 3.63Å; L1155-I1182 HydrophobicContact CD1-CD1 4.15Å; L1180-I1182 HydrophobicContact CD1-CD1 4.28Å; L1180-I1182 HydrophobicContact CD1-CG1 3.66Å; L1180-I1182 HydrophobicContact CD2-CD1 4.18Å; L1180-I1182 HydrophobicContact CD2-CG1 4.37Å; L1180-I1182 HydrophobicContact CG-CD1 4.34Å; L1180-I1182 HydrophobicContact CG-CG1 3.99Å; I1182-V1216 HydrophobicContact CG2-CG2 4.4Å
1183	D	91.5	Very high	89.1	Confident	17 Å²	17	52 Å²	52	9%	0.091	24%	0.239	C	C	.	.			trans	-119.4	97	169.8	-173	-39.8	0	0	0	107.9	Y1093 E1185 K1186 H1187 G1215	Y1093-D1183 WeakPolarHBondContact OH-CB 3.32Å; D1183-E1185 VanDerWaalsContact C-N 3.32Å; D1183-E1185 PolarHBondContact O-N 2.7Å; D1183-E1185 PolarHBondContact OD1-N 2.96Å; D1183-K1186 HydrophobicContact CB-CB 4.1Å; D1183-K1186 HydrophobicContact CB-CD 4.49Å; D1183-K1186 HydrophobicContact CB-CG 4.48Å; D1183-K1186 PolarHBondContact O-N 3.34Å; D1183-K1186 WeakPolarHBondContact OD1-CB 3.36Å; D1183-K1186 WeakPolarHBondContact OD1-CG 3.44Å; D1183-K1186 PolarHBondContact OD1-N 2.89Å; D1183-K1186 WeakPolarHBondContact OD2-CD 3.37Å; D1183-K1186 WeakPolarHBondContact OD2-CE 3.48Å; D1183-K1186 WeakPolarHBondContact OD2-CG 3.46Å; D1183-K1186 IonicContact OD2-NZ 2.7Å; D1183-H1187 WeakPolarHBondContact O-CB 3.38Å; D1183-H1187 PolarHBondContact O-N 3.22Å; D1183-G1215 PolarHBondContact N-O 2.92Å
1184	P	91.7	Very high	88.8	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-66.9	-33.5	-172.6	26.8	-34.5	0	0	0	112.3	W999 E1011 W1151 H1187 L1188	W999-P1184 HydrophobicContact CH2-CB 4.34Å; W999-P1184 HydrophobicContact CH2-CG 4.44Å; W999-P1184 HydrophobicContact CZ2-CG 4.25Å; E1011-P1184 WeakPolarHBondContact O-CB 3.06Å; E1011-P1184 VanDerWaalsContact O-CG 3.3Å; E1011-P1184 WeakPolarHBondContact O-CG 3.19Å; W1151-P1184 HydrophobicContact CH2-CB 4.17Å; W1151-P1184 HydrophobicContact CZ2-CB 3.71Å; P1184-H1187 PolarHBondContact O-N 3.31Å; P1184-L1188 WeakPolarHBondContact O-CG 3.38Å; P1184-L1188 PolarHBondContact O-N 3.04Å
1185	E	88	Confident	88.4	Confident	96 Å²	96	58.7 Å²	58.7	45%	0.449	27%	0.273	S	S	.	.	H	α-helix	trans	-66.8	-46.7	175.4	-83.3	-147.8	-177.1	0	0	112.3	D1183 H1187 K1189	D1183-E1185 VanDerWaalsContact C-N 3.32Å; D1183-E1185 PolarHBondContact O-N 2.7Å; D1183-E1185 PolarHBondContact OD1-N 2.96Å; E1185-H1187 VanDerWaalsContact C-N 3.27Å; E1185-H1187 PolarHBondContact O-N 3.45Å; E1185-K1189 WeakPolarHBondContact O-CB 3.26Å; E1185-K1189 VanDerWaalsContact O-CD 3.25Å; E1185-K1189 WeakPolarHBondContact O-CD 3.42Å; E1185-K1189 WeakPolarHBondContact O-CG 3.23Å; E1185-K1189 PolarHBondContact O-N 3.41Å; E1185-K1189 IonicContact OE2-NZ 3.25Å; E1185-K1189 PolarHBondContact OE2-NZ 2.63Å
1186	K	87.5	Confident	88.2	Confident	55 Å²	55	64.8 Å²	64.8	24%	0.239	30%	0.304	C	S	.	.	H	α-helix	trans	-67.4	-29.9	176.3	-68.2	-178.8	-170.8	165.9	0	111.3	E1087 Y1093 E1094 D1183 S1190	E1087-K1186 IonicContact OE1-NZ 3.6Å; Y1093-K1186 HydrophobicContact CE2-CD 3.69Å; E1094-K1186 IonicContact OE1-NZ 2.87Å; E1094-K1186 PolarHBondContact OE1-NZ 3.41Å; D1183-K1186 HydrophobicContact CB-CB 4.1Å; D1183-K1186 HydrophobicContact CB-CD 4.49Å; D1183-K1186 HydrophobicContact CB-CG 4.48Å; D1183-K1186 PolarHBondContact O-N 3.34Å; D1183-K1186 WeakPolarHBondContact OD1-CB 3.36Å; D1183-K1186 WeakPolarHBondContact OD1-CG 3.44Å; D1183-K1186 PolarHBondContact OD1-N 2.89Å; D1183-K1186 WeakPolarHBondContact OD2-CD 3.37Å; D1183-K1186 WeakPolarHBondContact OD2-CE 3.48Å; D1183-K1186 WeakPolarHBondContact OD2-CG 3.46Å; D1183-K1186 IonicContact OD2-NZ 2.7Å; K1186-S1190 PolarHBondContact O-N 2.93Å; K1186-S1190 PolarHBondContact O-OG 3.42Å
1187	H	92.2	Very high	88	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-65.7	-54.2	173	-177.7	83.2	0	0	0	112.4	W1147 W1151 F1154 D1183 P1184 E1185 K1189 S1190 V1191 G1215	W1147-H1187 AromaticContact CD2-NE2 3.65Å; W1147-H1187 AromaticContact CE3-NE2 3.44Å; W1147-H1187 AromaticContact CZ3-NE2 3.76Å; W1151-H1187 HydrophobicContact CH2-CB 3.79Å; W1151-H1187 AromaticContact CH2-CD2 3.68Å; W1151-H1187 AromaticContact CH2-CG 3.67Å; F1154-H1187 AromaticContact CD1-CE1 3.98Å; F1154-H1187 AromaticContact CE1-CE1 3.51Å; F1154-H1187 AromaticContact CE1-ND1 3.99Å; F1154-H1187 AromaticContact CE2-CE1 3.87Å; F1154-H1187 AromaticContact CZ-CE1 3.47Å; F1154-H1187 VanDerWaalsContact CZ-CE1 3.47Å; F1154-H1187 WeakPolarHBondContact CZ-CE1 3.45Å; D1183-H1187 WeakPolarHBondContact O-CB 3.38Å; D1183-H1187 PolarHBondContact O-N 3.22Å; P1184-H1187 PolarHBondContact O-N 3.31Å; E1185-H1187 VanDerWaalsContact C-N 3.27Å; E1185-H1187 PolarHBondContact O-N 3.45Å; H1187-K1189 PolarHBondContact O-N 2.85Å; H1187-S1190 WeakPolarHBondContact O-CA 3.41Å; H1187-S1190 WeakPolarHBondContact O-CB 2.99Å; H1187-S1190 PolarHBondContact O-N 3.06Å; H1187-S1190 PolarHBondContact O-OG 3.44Å; H1187-V1191 PolarHBondContact O-N 3.46Å; H1187-G1215 VanDerWaalsContact CA-N 3.32Å
1188	L	87.9	Confident	88.1	Confident	81 Å²	81	68.9 Å²	68.9	42%	0.424	33%	0.325	S	S	.	.	H	α-helix	trans	-61.2	-32	-179.9	-68.4	172.1	0	0	0	112.6	W1147 P1184 S1190	W1147-L1188 HydrophobicContact CZ2-CD2 4.45Å; P1184-L1188 WeakPolarHBondContact O-CG 3.38Å; P1184-L1188 PolarHBondContact O-N 3.04Å; L1188-S1190 PolarHBondContact O-N 3.47Å
1189	K	87.1	Confident	88.2	Confident	148 Å²	148	62.8 Å²	62.8	64%	0.643	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-11.5	173.3	-68.2	163.4	-164.2	165.3	0	114.2	E1185 H1187	E1185-K1189 WeakPolarHBondContact O-CB 3.26Å; E1185-K1189 VanDerWaalsContact O-CD 3.25Å; E1185-K1189 WeakPolarHBondContact O-CD 3.42Å; E1185-K1189 WeakPolarHBondContact O-CG 3.23Å; E1185-K1189 PolarHBondContact O-N 3.41Å; E1185-K1189 IonicContact OE2-NZ 3.25Å; E1185-K1189 PolarHBondContact OE2-NZ 2.63Å; H1187-K1189 PolarHBondContact O-N 2.85Å
1190	S	86.8	Confident	88.2	Confident	37 Å²	37	61.3 Å²	61.3	26%	0.259	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-4.5	-177.2	72.2	0	0	0	0	114.7	K1186 H1187 L1188 G1214	K1186-S1190 PolarHBondContact O-N 2.93Å; K1186-S1190 PolarHBondContact O-OG 3.42Å; H1187-S1190 WeakPolarHBondContact O-CA 3.41Å; H1187-S1190 WeakPolarHBondContact O-CB 2.99Å; H1187-S1190 PolarHBondContact O-N 3.06Å; H1187-S1190 PolarHBondContact O-OG 3.44Å; L1188-S1190 PolarHBondContact O-N 3.47Å; S1190-G1214 WeakPolarHBondContact OG-CA 3.25Å
1191	V	88.9	Confident	88.1	Confident	37 Å²	37	64.3 Å²	64.3	22%	0.224	31%	0.311	C	S	.	.			trans	-71.6	130	177.7	178.8	0	0	0	0	110.1	W1147 H1187 E1198 V1200	W1147-V1191 HydrophobicContact CB-CG1 4.39Å; W1147-V1191 HydrophobicContact CB-CG2 4.38Å; W1147-V1191 HydrophobicContact CG-CG2 4.24Å; H1187-V1191 PolarHBondContact O-N 3.46Å; V1191-E1198 HydrophobicContact CG1-CB 3.58Å; V1191-E1198 HydrophobicContact CG1-CG 3.81Å; V1191-V1200 HydrophobicContact CG2-CG2 3.96Å
1192	I	89	Confident	88	Confident	105 Å²	105	63.9 Å²	63.9	54%	0.538	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	139.6	-178.6	-41.3	179	0	0	0	108.7	I1199	I1192-I1199 PolarHBondContact N-O 3.22Å; I1192-I1199 PolarHBondContact O-N 3.08Å
1193	R	85.1	Confident	87.7	Confident	172 Å²	172	65.9 Å²	65.9	65%	0.649	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	129.9	169.9	-95.1	-174.3	-172.9	-169	2.5	112.2	K1197 E1198	R1193-K1197 VanDerWaalsContact CA-O 3.31Å; R1193-K1197 WeakPolarHBondContact CA-O 3.41Å; R1193-E1198 HydrophobicContact CG-CG 3.68Å; R1193-E1198 IonicContact CZ-OE1 3.91Å; R1193-E1198 VanDerWaalsContact CZ-OE1 3.26Å; R1193-E1198 IonicContact NE-OE1 2.72Å; R1193-E1198 PolarHBondContact NE-OE1 3.26Å; R1193-E1198 IonicContact NH2-OE1 3.1Å; R1193-E1198 PolarHBondContact NH2-OE1 3.13Å
1194	L	80.3	Confident	87.2	Confident	91 Å²	91	65.3 Å²	65.3	48%	0.476	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	137.5	172	-145.5	85.2	0	0	0	108.2	D1196 K1197 I1199	L1194-D1196 PolarHBondContact O-N 3.3Å; L1194-K1197 PolarHBondContact N-O 3.38Å; L1194-K1197 WeakPolarHBondContact O-CA 3.33Å; L1194-K1197 PolarHBondContact O-N 2.78Å; L1194-K1197 VanDerWaalsContact O-O 3.07Å; L1194-I1199 HydrophobicContact CB-CD1 3.63Å; L1194-I1199 HydrophobicContact CB-CG1 4.47Å
1195	D	77.8	Confident	86.5	Confident	108 Å²	108	66.4 Å²	66.4	58%	0.578	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	42.4	177.2	-49.7	-35.7	0	0	0	113.9	Y1134 K1197	Y1134-D1195 PolarHBondContact OH-OD2 2.67Å; D1195-K1197 PolarHBondContact O-N 3.12Å; D1195-K1197 VanDerWaalsContact O-N 3.13Å
1196	D	81.5	Confident	85.6	Confident	155 Å²	155	64.1 Å²	64.1	83%	0.829	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	16.1	-173	-70.9	-40	0	0	0	116.2	L1194	L1194-D1196 PolarHBondContact O-N 3.3Å
1197	K	83.5	Confident	84.9	Confident	97 Å²	97	67.5 Å²	67.5	42%	0.422	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	153.3	174.8	-59.8	176.8	-165.8	175.9	0	111.3	Y1134 L1146 R1193 L1194 D1195 I1199	Y1134-K1197 HydrophobicContact CD2-CD 4.47Å; Y1134-K1197 HydrophobicContact CE2-CD 4.13Å; L1146-K1197 HydrophobicContact CD1-CB 4.01Å; L1146-K1197 HydrophobicContact CD1-CD 3.92Å; L1146-K1197 HydrophobicContact CD1-CG 4.5Å; L1146-K1197 HydrophobicContact CD2-CD 4.41Å; L1146-K1197 HydrophobicContact CG-CB 4.48Å; R1193-K1197 VanDerWaalsContact CA-O 3.31Å; R1193-K1197 WeakPolarHBondContact CA-O 3.41Å; L1194-K1197 PolarHBondContact N-O 3.38Å; L1194-K1197 WeakPolarHBondContact O-CA 3.33Å; L1194-K1197 PolarHBondContact O-N 2.78Å; L1194-K1197 VanDerWaalsContact O-O 3.07Å; D1195-K1197 PolarHBondContact O-N 3.12Å; D1195-K1197 VanDerWaalsContact O-N 3.13Å; K1197-I1199 HydrophobicContact CB-CG1 4.41Å
1198	E	91.8	Very high	84	Confident	64 Å²	64	69.8 Å²	69.8	30%	0.299	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	128.5	175.9	-81.2	166.6	-151.6	0	0	109.6	L1146 W1147 V1191 R1193	L1146-E1198 CarbonylContact C-O 3.55Å; L1146-E1198 WeakPolarHBondContact CA-O 3.26Å; W1147-E1198 HydrophobicContact CB-CB 4.28Å; W1147-E1198 PolarHBondContact N-O 3.27Å; V1191-E1198 HydrophobicContact CG1-CB 3.58Å; V1191-E1198 HydrophobicContact CG1-CG 3.81Å; R1193-E1198 HydrophobicContact CG-CG 3.68Å; R1193-E1198 IonicContact CZ-OE1 3.91Å; R1193-E1198 VanDerWaalsContact CZ-OE1 3.26Å; R1193-E1198 IonicContact NE-OE1 2.72Å; R1193-E1198 PolarHBondContact NE-OE1 3.26Å; R1193-E1198 IonicContact NH2-OE1 3.1Å; R1193-E1198 PolarHBondContact NH2-OE1 3.13Å
1199	I	92.1	Very high	83.3	Confident	11 Å²	11	69.8 Å²	69.8	6%	0.056	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	148.6	-166.4	-28.3	-177.9	0	0	0	110.8	Y1134 I1145 L1146 I1192 L1194 K1197	Y1134-I1199 HydrophobicContact CD1-CD1 3.81Å; Y1134-I1199 HydrophobicContact CE1-CD1 3.96Å; Y1134-I1199 HydrophobicContact CG-CD1 4.17Å; I1145-I1199 CarbonylContact O-C 3.48Å; I1145-I1199 WeakPolarHBondContact O-CA 3.32Å; I1145-I1199 VanDerWaalsContact O-CG2 3.3Å; I1145-I1199 WeakPolarHBondContact O-CG2 3.4Å; L1146-I1199 HydrophobicContact CD1-CG1 4.45Å; I1192-I1199 PolarHBondContact N-O 3.22Å; I1192-I1199 PolarHBondContact O-N 3.08Å; L1194-I1199 HydrophobicContact CB-CD1 3.63Å; L1194-I1199 HydrophobicContact CB-CG1 4.47Å; K1197-I1199 HydrophobicContact CB-CG1 4.41Å
1200	V	92.3	Very high	82.7	Confident	3 Å²	3	62.8 Å²	62.8	2%	0.018	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	133.5	176.2	-179.3	0	0	0	0	108.9	I1145 F1154 V1191 A1213	I1145-V1200 PolarHBondContact N-O 2.96Å; I1145-V1200 PolarHBondContact O-N 3.35Å; F1154-V1200 HydrophobicContact CE2-CB 4.14Å; F1154-V1200 HydrophobicContact CE2-CG2 4.33Å; F1154-V1200 HydrophobicContact CZ-CB 4.37Å; F1154-V1200 HydrophobicContact CZ-CG1 4.36Å; V1191-V1200 HydrophobicContact CG2-CG2 3.96Å; V1200-A1213 HydrophobicContact CG1-CB 4.21Å
1201	E	90.3	Very high	82.7	Confident	65 Å²	65	61.2 Å²	61.2	30%	0.304	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	135.8	171.3	-164.4	-168.9	145.8	0	0	109.6	F1096 R1203	F1096-E1201 HydrophobicContact CE1-CB 4.07Å; F1096-E1201 HydrophobicContact CE1-CG 4.02Å; F1096-E1201 HydrophobicContact CZ-CB 3.81Å; F1096-E1201 HydrophobicContact CZ-CG 3.78Å; F1096-E1201 WeakPolarHBondContact CZ-O 3.39Å; E1201-R1203 IonicContact OE1-CZ 3.61Å; E1201-R1203 VanDerWaalsContact OE1-CZ 3.24Å; E1201-R1203 IonicContact OE1-NE 2.71Å; E1201-R1203 PolarHBondContact OE1-NE 2.86Å; E1201-R1203 IonicContact OE1-NH2 2.89Å; E1201-R1203 PolarHBondContact OE1-NH2 3.17Å; E1201-R1203 IonicContact OE2-NH2 3.9Å
1202	A	89.8	Confident	82.6	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	141.7	176.8	0	0	0	0	0	110.8	T1143 I1145 L1158 A1212 A1213	T1143-A1202 PolarHBondContact N-O 3.13Å; T1143-A1202 PolarHBondContact O-N 3.15Å; I1145-A1202 HydrophobicContact CD1-CB 3.8Å; I1145-A1202 HydrophobicContact CG1-CB 4.27Å; L1158-A1202 HydrophobicContact CD2-CB 3.72Å; A1202-A1212 WeakPolarHBondContact CA-O 3.39Å; A1202-A1213 HydrophobicContact CB-CB 3.66Å
1203	R	87.4	Confident	82.6	Confident	42 Å²	42	54.5 Å²	54.5	16%	0.158	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	136.4	177.7	-69.4	179.7	-173.3	-171.9	6.9	110.9	F1096 V1099 D1141 E1201 F1211 A1212	F1096-R1203 HydrophobicContact CE1-CG 4.24Å; F1096-R1203 HydrophobicContact CE2-CB 4.13Å; F1096-R1203 HydrophobicContact CE2-CG 3.96Å; F1096-R1203 HydrophobicContact CZ-CB 4.32Å; F1096-R1203 HydrophobicContact CZ-CG 3.65Å; F1096-R1203 PolarHBondContact O-NH1 3.01Å; V1099-R1203 HydrophobicContact CB-CB 4.19Å; V1099-R1203 HydrophobicContact CG1-CB 3.88Å; D1141-R1203 WeakPolarHBondContact O-CA 3.23Å; E1201-R1203 IonicContact OE1-CZ 3.61Å; E1201-R1203 VanDerWaalsContact OE1-CZ 3.24Å; E1201-R1203 IonicContact OE1-NE 2.71Å; E1201-R1203 PolarHBondContact OE1-NE 2.86Å; E1201-R1203 IonicContact OE1-NH2 2.89Å; E1201-R1203 PolarHBondContact OE1-NH2 3.17Å; E1201-R1203 IonicContact OE2-NH2 3.9Å; R1203-F1211 WeakPolarHBondContact O-CA 3.14Å; R1203-F1211 VanDerWaalsContact O-CB 3.25Å; R1203-F1211 WeakPolarHBondContact O-CB 3.4Å; R1203-A1212 PolarHBondContact N-O 2.89Å; R1203-A1212 PolarHBondContact O-N 3.4Å
1204	C	80.9	Confident	82.8	Confident	4 Å²	4	47 Å²	47	3%	0.027	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121	-175.8	-146.7	0	0	0	0	110.3	D1141 T1161 M1165 G1210 F1211	D1141-C1204 PolarHBondContact O-N 2.91Å; T1161-C1204 HydrophobicContact CG2-CB 4.33Å; M1165-C1204 HydrophobicContact CE-CB 3.97Å; M1165-C1204 VanDerWaalsContact CE-SG 3.51Å; M1165-C1204 HydrophobicContact CG-CB 4.34Å; M1165-C1204 HydrophobicContact SD-CB 3.85Å; C1204-G1210 CarbonylContact C-O 3.57Å; C1204-G1210 WeakPolarHBondContact CA-O 3.31Å; C1204-G1210 PolarHBondContact SG-O 2.96Å; C1204-F1211 HydrophobicContact CB-CB 4.48Å
1205	D	76.4	Confident	83.2	Confident	24 Å²	24	42.7 Å²	42.7	13%	0.128	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	110.7	174.3	172.5	30.5	0	0	0	110.2	V1099 T1207 T1208 N1209 G1210	V1099-D1205 HydrophobicContact CG1-CB 4.24Å; D1205-T1207 PolarHBondContact O-N 3.28Å; D1205-T1207 WeakPolarHBondContact OD1-CB 3.16Å; D1205-T1207 PolarHBondContact OD1-N 3.38Å; D1205-T1207 PolarHBondContact OD1-OG1 2.82Å; D1205-T1208 PolarHBondContact O-N 3.37Å; D1205-T1208 WeakPolarHBondContact OD2-CB 3.49Å; D1205-T1208 WeakPolarHBondContact OD2-CG2 3.43Å; D1205-T1208 PolarHBondContact OD2-N 2.99Å; D1205-T1208 PolarHBondContact OD2-OG1 2.82Å; D1205-N1209 PolarHBondContact O-N 3.29Å; D1205-N1209 VanDerWaalsContact O-N 3.09Å; D1205-G1210 PolarHBondContact N-O 3.35Å; D1205-G1210 PolarHBondContact O-N 3.41Å
1206	A	69.3	Low	83.9	Confident	47 Å²	47	37.5 Å²	37.5	39%	0.388	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-12.5	176.3	0	0	0	0	0	113.6	M1165	M1165-A1206 HydrophobicContact CE-CB 3.98Å; M1165-A1206 HydrophobicContact SD-CB 4.36Å
1207	T	72.3	Confident	84.3	Confident	126 Å²	126	30.1 Å²	30.1	77%	0.773	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-37.7	-180	-30.1	0	0	0	0	112.1	D1205	D1205-T1207 PolarHBondContact O-N 3.28Å; D1205-T1207 WeakPolarHBondContact OD1-CB 3.16Å; D1205-T1207 PolarHBondContact OD1-N 3.38Å; D1205-T1207 PolarHBondContact OD1-OG1 2.82Å
1208	T	73.8	Confident	84.6	Confident	48 Å²	48	25.6 Å²	25.6	29%	0.294	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	0.3	176.3	52.6	0	0	0	0	113.7	D1205 G1210 E1220	D1205-T1208 PolarHBondContact O-N 3.37Å; D1205-T1208 WeakPolarHBondContact OD2-CB 3.49Å; D1205-T1208 WeakPolarHBondContact OD2-CG2 3.43Å; D1205-T1208 PolarHBondContact OD2-N 2.99Å; D1205-T1208 PolarHBondContact OD2-OG1 2.82Å; T1208-G1210 PolarHBondContact O-N 3.06Å; T1208-E1220 PolarHBondContact O-N 2.84Å
1209	N	74.2	Confident	84.4	Confident	82 Å²	82	26.7 Å²	26.7	44%	0.439	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	46	50.7	-171.8	-147.8	54.1	0	0	0	111.8	D1205 E1220 L1221	D1205-N1209 PolarHBondContact O-N 3.29Å; D1205-N1209 VanDerWaalsContact O-N 3.09Å; N1209-E1220 PolarHBondContact O-N 3.15Å; N1209-L1221 PolarHBondContact ND2-O 3.32Å; N1209-L1221 PolarHBondContact O-N 2.92Å; N1209-L1221 VanDerWaalsContact O-N 3.14Å
1210	G	74.4	Confident	84.1	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	-179.1	-168.8	0	0	0	0	0	112.5	C1204 D1205 T1208 V1218	C1204-G1210 CarbonylContact C-O 3.57Å; C1204-G1210 WeakPolarHBondContact CA-O 3.31Å; C1204-G1210 PolarHBondContact SG-O 2.96Å; D1205-G1210 PolarHBondContact N-O 3.35Å; D1205-G1210 PolarHBondContact O-N 3.41Å; T1208-G1210 PolarHBondContact O-N 3.06Å; G1210-V1218 CarbonylContact C-O 3.59Å; G1210-V1218 WeakPolarHBondContact CA-O 3.42Å
1211	F	86	Confident	83.8	Confident	4 Å²	4	30.7 Å²	30.7	2%	0.018	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	157.8	-173.7	42.5	-103	0	0	0	112.2	L1158 L1159 A1162 R1203 C1204 V1218 L1221	L1158-F1211 HydrophobicContact CB-CD2 3.79Å; L1158-F1211 HydrophobicContact CB-CE1 4.39Å; L1158-F1211 HydrophobicContact CB-CE2 3.36Å; L1158-F1211 HydrophobicContact CB-CG 4.47Å; L1158-F1211 HydrophobicContact CB-CZ 3.71Å; L1158-F1211 HydrophobicContact CD1-CD2 4.14Å; L1158-F1211 HydrophobicContact CD1-CE2 3.95Å; L1158-F1211 HydrophobicContact CD2-CD2 3.95Å; L1158-F1211 HydrophobicContact CD2-CE2 4.36Å; L1158-F1211 HydrophobicContact CD2-CG 4.5Å; L1158-F1211 HydrophobicContact CG-CD2 4.2Å; L1158-F1211 HydrophobicContact CG-CE2 4.1Å; L1158-F1211 WeakPolarHBondContact O-CE1 3.26Å; L1159-F1211 HydrophobicContact CD2-CZ 4.09Å; A1162-F1211 HydrophobicContact CB-CD1 4.2Å; A1162-F1211 HydrophobicContact CB-CE1 4.04Å; R1203-F1211 WeakPolarHBondContact O-CA 3.14Å; R1203-F1211 VanDerWaalsContact O-CB 3.25Å; R1203-F1211 WeakPolarHBondContact O-CB 3.4Å; C1204-F1211 HydrophobicContact CB-CB 4.48Å; F1211-V1218 HydrophobicContact CD2-CB 3.83Å; F1211-V1218 HydrophobicContact CD2-CG2 4.14Å; F1211-V1218 HydrophobicContact CE1-CB 4.38Å; F1211-V1218 HydrophobicContact CE1-CG1 4.29Å; F1211-V1218 HydrophobicContact CE2-CB 3.35Å; F1211-V1218 HydrophobicContact CE2-CG1 4.02Å; F1211-V1218 HydrophobicContact CE2-CG2 3.34Å; F1211-V1218 HydrophobicContact CZ-CB 3.67Å; F1211-V1218 HydrophobicContact CZ-CG1 3.77Å; F1211-V1218 HydrophobicContact CZ-CG2 3.84Å; F1211-V1218 PolarHBondContact N-O 3.06Å; F1211-V1218 PolarHBondContact O-N 3.04Å; F1211-L1221 HydrophobicContact CE1-CD2 4Å; F1211-L1221 HydrophobicContact CZ-CD2 4.47Å
1212	A	86.9	Confident	83.5	Confident	2 Å²	2	30.2 Å²	30.2	2%	0.017	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	142.8	170.4	0	0	0	0	0	110	L1092 F1096 A1202 R1203 V1216	L1092-A1212 HydrophobicContact CB-CB 4.09Å; F1096-A1212 HydrophobicContact CD2-CB 4.25Å; F1096-A1212 WeakPolarHBondContact CE2-O 3.36Å; A1202-A1212 WeakPolarHBondContact CA-O 3.39Å; R1203-A1212 PolarHBondContact N-O 2.89Å; R1203-A1212 PolarHBondContact O-N 3.4Å; A1212-V1216 WeakPolarHBondContact CA-O 3.39Å
1213	A	89.6	Confident	83.1	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	114.5	175.6	0	0	0	0	0	111	F1154 L1158 V1200 A1202 G1215 V1216	F1154-A1213 HydrophobicContact CZ-CB 3.98Å; L1158-A1213 HydrophobicContact CD1-CB 4.18Å; L1158-A1213 HydrophobicContact CD2-CB 3.56Å; L1158-A1213 HydrophobicContact CG-CB 4.47Å; V1200-A1213 HydrophobicContact CG1-CB 4.21Å; A1202-A1213 HydrophobicContact CB-CB 3.66Å; A1213-G1215 PolarHBondContact O-N 2.83Å; A1213-V1216 PolarHBondContact N-O 2.85Å; A1213-V1216 WeakPolarHBondContact O-CB 3.25Å; A1213-V1216 PolarHBondContact O-N 2.8Å
1214	G	88.6	Confident	82.7	Confident	14 Å²	14	32.7 Å²	32.7	14%	0.144	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	-128.9	-174	0	0	0	0	0	111.9	Y1093 S1190 V1216	Y1093-G1214 WeakPolarHBondContact CB-O 3.41Å; S1190-G1214 WeakPolarHBondContact OG-CA 3.25Å; G1214-V1216 PolarHBondContact O-N 2.74Å
1215	G	89.5	Confident	82.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	14.4	174.9	0	0	0	0	0	115.5	Y1093 D1183 H1187 A1213	Y1093-G1215 WeakPolarHBondContact CE1-O 3.42Å; D1183-G1215 PolarHBondContact N-O 2.92Å; H1187-G1215 VanDerWaalsContact CA-N 3.32Å; A1213-G1215 PolarHBondContact O-N 2.83Å
1216	V	92.1	Very high	82.5	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	137.4	-178.8	-179.1	0	0	0	0	111.2	W1151 F1154 L1155 L1158 L1180 R1181 I1182 A1212 A1213 G1214 V1218	W1151-V1216 HydrophobicContact CZ3-CG2 3.92Å; F1154-V1216 HydrophobicContact CE1-CB 4.49Å; F1154-V1216 HydrophobicContact CE1-CG2 4.02Å; L1155-V1216 HydrophobicContact CD2-CG1 3.73Å; L1155-V1216 HydrophobicContact CD2-CG2 4.31Å; L1158-V1216 HydrophobicContact CD1-CB 4.46Å; L1158-V1216 HydrophobicContact CD1-CG1 4.02Å; L1180-V1216 HydrophobicContact CD1-CG1 3.84Å; R1181-V1216 WeakPolarHBondContact O-CA 3.41Å; I1182-V1216 HydrophobicContact CG2-CG2 4.4Å; A1212-V1216 WeakPolarHBondContact CA-O 3.39Å; A1213-V1216 PolarHBondContact N-O 2.85Å; A1213-V1216 WeakPolarHBondContact O-CB 3.25Å; A1213-V1216 PolarHBondContact O-N 2.8Å; G1214-V1216 PolarHBondContact O-N 2.74Å; V1216-V1218 HydrophobicContact CG1-CG2 4.48Å
1217	E	90.1	Very high	82.4	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	129.1	174.2	166.7	175	-154.5	0	0	110.1	S1091 L1092 Y1093 Y1179 L1180 R1181 R1219	S1091-E1217 WeakPolarHBondContact CA-OE2 3.44Å; S1091-E1217 VanDerWaalsContact CB-OE2 3.27Å; S1091-E1217 WeakPolarHBondContact CB-OE2 3.4Å; L1092-E1217 HydrophobicContact CB-CG 4.24Å; L1092-E1217 WeakPolarHBondContact CB-OE1 3.12Å; L1092-E1217 HydrophobicContact CD1-CG 4.33Å; L1092-E1217 WeakPolarHBondContact CD1-OE1 3.29Å; L1092-E1217 VanDerWaalsContact CG-OE1 3.23Å; L1092-E1217 WeakPolarHBondContact CG-OE1 3.33Å; L1092-E1217 PolarHBondContact N-OE1 2.94Å; L1092-E1217 PolarHBondContact N-OE2 2.73Å; Y1093-E1217 HydrophobicContact CD1-CB 3.92Å; Y1093-E1217 HydrophobicContact CE1-CB 4.24Å; Y1179-E1217 HydrophobicContact CE1-CG 4.09Å; L1180-E1217 CarbonylContact C-O 3.56Å; L1180-E1217 WeakPolarHBondContact CA-O 3.5Å; R1181-E1217 HydrophobicContact CB-CB 4.38Å; R1181-E1217 PolarHBondContact N-O 3.36Å; R1181-E1217 PolarHBondContact O-N 2.8Å; E1217-R1219 IonicContact OE1-CZ 3.91Å; E1217-R1219 IonicContact OE1-NE 3.46Å; E1217-R1219 PolarHBondContact OE1-NE 3.05Å; E1217-R1219 IonicContact OE1-NH2 3.34Å; E1217-R1219 PolarHBondContact OE1-NH2 2.76Å
1218	V	89.6	Confident	82.3	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.012	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	141.3	175	173.2	0	0	0	0	110.2	M1177 Y1179 L1180 G1210 F1211 V1216 L1221	M1177-V1218 HydrophobicContact CG-CG1 3.92Å; M1177-V1218 HydrophobicContact SD-CG1 3.8Å; M1177-V1218 HydrophobicContact SD-CG2 4.23Å; Y1179-V1218 WeakPolarHBondContact O-CA 3.31Å; L1180-V1218 HydrophobicContact CB-CG2 4.19Å; L1180-V1218 HydrophobicContact CD1-CG2 3.61Å; L1180-V1218 HydrophobicContact CG-CG2 4.45Å; G1210-V1218 CarbonylContact C-O 3.59Å; G1210-V1218 WeakPolarHBondContact CA-O 3.42Å; F1211-V1218 HydrophobicContact CD2-CB 3.83Å; F1211-V1218 HydrophobicContact CD2-CG2 4.14Å; F1211-V1218 HydrophobicContact CE1-CB 4.38Å; F1211-V1218 HydrophobicContact CE1-CG1 4.29Å; F1211-V1218 HydrophobicContact CE2-CB 3.35Å; F1211-V1218 HydrophobicContact CE2-CG1 4.02Å; F1211-V1218 HydrophobicContact CE2-CG2 3.34Å; F1211-V1218 HydrophobicContact CZ-CB 3.67Å; F1211-V1218 HydrophobicContact CZ-CG1 3.77Å; F1211-V1218 HydrophobicContact CZ-CG2 3.84Å; F1211-V1218 PolarHBondContact N-O 3.06Å; F1211-V1218 PolarHBondContact O-N 3.04Å; V1216-V1218 HydrophobicContact CG1-CG2 4.48Å; V1218-L1221 HydrophobicContact CG1-CB 4.34Å
1219	R	87.3	Confident	81.7	Confident	87 Å²	87	39.4 Å²	39.4	33%	0.328	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	145.3	175.3	-50.8	179.4	-175.4	-173.3	2.4	110.7	Y1179 E1217	Y1179-R1219 HydrophobicContact CD1-CB 4.42Å; Y1179-R1219 HydrophobicContact CD1-CG 4.07Å; Y1179-R1219 PolarHBondContact N-O 2.98Å; Y1179-R1219 PolarHBondContact O-N 3.43Å; E1217-R1219 IonicContact OE1-CZ 3.91Å; E1217-R1219 IonicContact OE1-NE 3.46Å; E1217-R1219 PolarHBondContact OE1-NE 3.05Å; E1217-R1219 IonicContact OE1-NH2 3.34Å; E1217-R1219 PolarHBondContact OE1-NH2 2.76Å
1220	E	85.4	Confident	80.7	Confident	88 Å²	88	39 Å²	39	41%	0.411	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	51	58	179.5	-65.3	170.5	-137.2	0	0	112.7	R1178 T1208 N1209	R1178-E1220 HydrophobicContact CB-CB 3.89Å; R1178-E1220 WeakPolarHBondContact CD-OE2 3.39Å; R1178-E1220 IonicContact CZ-OE1 2.71Å; R1178-E1220 IonicContact CZ-OE2 3.74Å; R1178-E1220 PolarHBondContact N-O 3.28Å; R1178-E1220 IonicContact NE-OE2 2.69Å; R1178-E1220 IonicContact NH1-OE1 2.77Å; R1178-E1220 PolarHBondContact NH1-OE1 3.09Å; R1178-E1220 IonicContact NH1-OE2 2.75Å; R1178-E1220 PolarHBondContact NH1-OE2 3.13Å; T1208-E1220 PolarHBondContact O-N 2.84Å; N1209-E1220 PolarHBondContact O-N 3.15Å
1221	L	85.8	Confident	79.7	Confident	9 Å²	9	42.6 Å²	42.6	5%	0.047	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	137.6	164.2	178.4	68.9	0	0	0	109.3	L1159 A1162 P1174 M1177 N1209 F1211 V1218	L1159-L1221 HydrophobicContact CD2-CD1 3.74Å; L1159-L1221 HydrophobicContact CD2-CD2 3.53Å; L1159-L1221 HydrophobicContact CD2-CG 4.3Å; A1162-L1221 HydrophobicContact CB-CD2 4.09Å; P1174-L1221 HydrophobicContact CB-CD1 4.35Å; M1177-L1221 HydrophobicContact CB-CD1 4.28Å; M1177-L1221 HydrophobicContact CG-CD1 4.29Å; N1209-L1221 PolarHBondContact ND2-O 3.32Å; N1209-L1221 PolarHBondContact O-N 2.92Å; N1209-L1221 VanDerWaalsContact O-N 3.14Å; F1211-L1221 HydrophobicContact CE1-CD2 4Å; F1211-L1221 HydrophobicContact CZ-CD2 4.47Å; V1218-L1221 HydrophobicContact CG1-CB 4.34Å
1222	V	83.9	Confident	77.6	Confident	55 Å²	55	50.2 Å²	50.2	33%	0.333	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	125.3	175.9	-176	0	0	0	0	110.7	T1175 R1176	T1175-V1222 PolarHBondContact N-O 2.79Å; R1176-V1222 HydrophobicContact CB-CB 4.26Å; R1176-V1222 PolarHBondContact N-O 2.93Å; R1176-V1222 PolarHBondContact O-N 3.05Å
1223	A	81.7	Confident	75.6	Confident	29 Å²	29	54 Å²	54	24%	0.24	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	137.6	173.7	0	0	0	0	0	110.7	L1163 K1172 L1173	L1163-A1223 HydrophobicContact CD2-CB 4.46Å; K1172-A1223 HydrophobicContact CB-CB 4.06Å; L1173-A1223 CarbonylContact O-C 3.53Å; L1173-A1223 WeakPolarHBondContact O-CA 3.2Å; L1173-A1223 WeakPolarHBondContact O-CB 3.38Å
1224	Q	79.3	Confident	74.2	Confident	65 Å²	65	56.9 Å²	56.9	30%	0.304	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	143.9	-175.1	-69.8	-178.5	-22.1	0	0	111.3	K1172 L1173 T1175 V1226	K1172-Q1224 CarbonylContact C-O 3.58Å; K1172-Q1224 WeakPolarHBondContact CA-O 3.01Å; L1173-Q1224 PolarHBondContact N-O 2.85Å; L1173-Q1224 PolarHBondContact O-N 2.88Å; T1175-Q1224 HydrophobicContact CG2-CB 4.3Å; T1175-Q1224 HydrophobicContact CG2-CG 4.38Å; Q1224-V1226 WeakPolarHBondContact O-CG2 3.19Å; Q1224-V1226 PolarHBondContact O-N 2.97Å
1225	T	77.4	Confident	73.3	Confident	24 Å²	24	64.4 Å²	64.4	15%	0.147	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	124.6	179.6	-65.4	0	0	0	0	111.4	T1170 L1171 I1736 D1737	T1170-T1225 HydrophobicContact CG2-CG2 4.15Å; L1171-T1225 CarbonylContact O-C 3.55Å; L1171-T1225 WeakPolarHBondContact O-CA 3.47Å; T1225-I1736 HydrophobicContact CG2-CD1 4.12Å; T1225-D1737 WeakPolarHBondContact CB-OD1 3.29Å; T1225-D1737 VanDerWaalsContact CB-OD2 3.31Å; T1225-D1737 WeakPolarHBondContact CB-OD2 3.34Å; T1225-D1737 PolarHBondContact N-OD2 3.23Å; T1225-D1737 PolarHBondContact OG1-OD1 2.6Å; T1225-D1737 PolarHBondContact OG1-OD2 2.76Å
1226	V	75.5	Confident	72.8	Confident	50 Å²	50	65.9 Å²	65.9	30%	0.303	35%	0.345	S	S	.	.			trans	-108.7	136.2	-177.9	-170.7	0	0	0	0	109.8	L1171 L1173 Q1224 R1228	L1171-V1226 PolarHBondContact O-N 2.91Å; L1173-V1226 HydrophobicContact CB-CG2 3.94Å; L1173-V1226 HydrophobicContact CD1-CG2 4.03Å; L1173-V1226 HydrophobicContact CG-CG2 3.81Å; Q1224-V1226 WeakPolarHBondContact O-CG2 3.19Å; Q1224-V1226 PolarHBondContact O-N 2.97Å; V1226-R1228 PolarHBondContact O-N 3.02Å
1227	P	67.8	Low	72.5	Confident	102 Å²	102	66.7 Å²	66.7	66%	0.662	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-65.8	121.6	174.5	26.8	-33.9	0	0	0	110.8
1228	R	68.8	Low	72.3	Confident	77 Å²	77	67.6 Å²	67.6	29%	0.291	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-62.9	144	171.8	-65	-165.7	67.7	171.5	2.4	111.1	D984 L1121 R1122 L1171 V1226	D984-R1228 IonicContact OD1-CZ 2.82Å; D984-R1228 VanDerWaalsContact OD1-CZ 3.24Å; D984-R1228 IonicContact OD1-NE 3.45Å; D984-R1228 PolarHBondContact OD1-NE 3Å; D984-R1228 IonicContact OD1-NH2 3.84Å; D984-R1228 PolarHBondContact OD1-NH2 3.37Å; D984-R1228 WeakPolarHBondContact OD2-CA 3.45Å; L1121-R1228 PolarHBondContact O-NH1 3.34Å; R1122-R1228 PolarHBondContact O-NH1 2.54Å; L1171-R1228 HydrophobicContact CB-CG 3.88Å; L1171-R1228 HydrophobicContact CD2-CG 4.18Å; V1226-R1228 PolarHBondContact O-N 3.02Å
1229	R	61	Low	72.3	Confident	138 Å²	138	67.5 Å²	67.5	52%	0.521	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-77.6	123.6	-179.5	-158.9	-178.7	-166.5	-176.9	2.1	109.6	D984 H1231	D984-R1229 PolarHBondContact OD2-N 3.37Å; R1229-H1231 PolarHBondContact O-CD2 3.01Å; R1229-H1231 PolarHBondContact O-N 3.42Å; R1229-H1231 VanDerWaalsContact O-N 3.16Å
1230	L	54.4	Low	72.3	Confident	73 Å²	73	66.2 Å²	66.2	38%	0.382	35%	0.352	S	S	.	.			trans	-66.4	112.1	157.1	-76.5	165.2	0	0	0	107.2	H1232 T1688	L1230-H1232 VanDerWaalsContact C-N 3.31Å; L1230-H1232 PolarHBondContact O-N 3.38Å; L1230-T1688 HydrophobicContact CD1-CG2 3.86Å; L1230-T1688 WeakPolarHBondContact CD1-OG1 3.32Å
1231	H	52.7	Low	72.5	Confident	75 Å²	75	62.9 Å²	62.9	35%	0.347	34%	0.337	S	S	.	.			trans	-68.6	87.1	179	-73.9	-102.6	0	0	0	109.9	R1229 G1233 V1234	R1229-H1231 PolarHBondContact O-CD2 3.01Å; R1229-H1231 PolarHBondContact O-N 3.42Å; R1229-H1231 VanDerWaalsContact O-N 3.16Å; H1231-G1233 PolarHBondContact O-N 2.92Å; H1231-V1234 HydrophobicContact CB-CB 4.08Å; H1231-V1234 HydrophobicContact CB-CG2 4.11Å; H1231-V1234 CarbonylContact O-C 3.51Å; H1231-V1234 PolarHBondContact O-N 3.26Å
1232	H	42.8	Very low	72.6	Confident	164 Å²	164	65.9 Å²	65.9	76%	0.759	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.3	-174.3	-71.7	-54	0	0	0	114.4	L1230 V1234	L1230-H1232 VanDerWaalsContact C-N 3.31Å; L1230-H1232 PolarHBondContact O-N 3.38Å; H1232-V1234 VanDerWaalsContact C-N 3.25Å; H1232-V1234 PolarHBondContact O-N 2.97Å
1233	G	45.3	Very low	72.8	Confident	81 Å²	81	64.6 Å²	64.6	84%	0.835	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-9.7	172.1	0	0	0	0	0	114.6	H1231	H1231-G1233 PolarHBondContact O-N 2.92Å
1234	V	58.8	Low	73.3	Confident	62 Å²	62	64.1 Å²	64.1	38%	0.376	33%	0.333	S	S	.	.			trans	-128.3	62.4	-168.9	-160.9	0	0	0	0	110.5	H1231 H1232 I2261	H1231-V1234 HydrophobicContact CB-CB 4.08Å; H1231-V1234 HydrophobicContact CB-CG2 4.11Å; H1231-V1234 CarbonylContact O-C 3.51Å; H1231-V1234 PolarHBondContact O-N 3.26Å; H1232-V1234 VanDerWaalsContact C-N 3.25Å; H1232-V1234 PolarHBondContact O-N 2.97Å; V1234-I2261 HydrophobicContact CG1-CB 4.44Å; V1234-I2261 HydrophobicContact CG1-CD1 3.76Å; V1234-I2261 HydrophobicContact CG1-CG1 4.24Å; V1234-I2261 HydrophobicContact CG1-CG2 3.39Å
1235	K	69.1	Low	73.8	Confident	171 Å²	171	63.9 Å²	63.9	74%	0.743	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-86.1	126.6	-178.4	-147.6	177.8	-169.9	179.4	0	109.8
1236	P	80.2	Confident	74.5	Confident	32 Å²	32	63.1 Å²	63.1	21%	0.208	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-67	136.7	-179.7	26.9	-34.2	0	0	0	111.6	F2260 I2261	P1236-F2260 CarbonylContact C-O 3.56Å; P1236-F2260 WeakPolarHBondContact CA-O 3.36Å; P1236-I2261 HydrophobicContact CB-CG1 4.37Å
1237	T	84.8	Confident	75.3	Confident	17 Å²	17	65.6 Å²	65.6	10%	0.104	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	130.4	166.9	-57.2	0	0	0	0	108.7	E1239 F2260	T1237-E1239 HydrophobicContact CG2-CG 4.08Å; T1237-F2260 HydrophobicContact CG2-CE1 3.75Å; T1237-F2260 HydrophobicContact CG2-CE2 4.14Å; T1237-F2260 HydrophobicContact CG2-CZ 3.51Å; T1237-F2260 PolarHBondContact N-O 2.9Å; T1237-F2260 PolarHBondContact O-N 3.13Å
1238	L	87.6	Confident	76.3	Confident	18 Å²	18	61.4 Å²	61.4	9%	0.094	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	124.2	175.9	-55.2	177.9	0	0	0	107.9	L1668 T1673 F2249 W2252 S2258 C2259	L1238-L1668 HydrophobicContact CB-CB 4.26Å; L1238-L1668 HydrophobicContact CB-CD1 4.08Å; L1238-L1668 PolarHBondContact O-N 3.44Å; L1238-T1673 HydrophobicContact CD1-CG2 3.79Å; L1238-F2249 HydrophobicContact CD2-CE1 4.46Å; L1238-F2249 HydrophobicContact CD2-CZ 3.79Å; L1238-W2252 HydrophobicContact CD1-CH2 4.47Å; L1238-S2258 WeakPolarHBondContact CA-O 3.45Å; L1238-C2259 HydrophobicContact CD2-CB 4.21Å; L1238-C2259 WeakPolarHBondContact CD2-SG 3.22Å
1239	E	87.9	Confident	77.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	152	176.5	-51.6	176.3	119.4	0	0	110.1	T1237 H1665 L1666 R2177 F2257 S2258 F2260	T1237-E1239 HydrophobicContact CG2-CG 4.08Å; E1239-H1665 HydrophobicContact CB-CB 4.16Å; E1239-H1665 HydrophobicContact CG-CB 4.44Å; E1239-H1665 IonicContact OE2-CD2 3.21Å; E1239-H1665 PolarHBondContact OE2-CD2 2.79Å; E1239-H1665 VanDerWaalsContact OE2-CD2 3.26Å; E1239-H1665 IonicContact OE2-CG 2.81Å; E1239-L1666 CarbonylContact C-O 3.59Å; E1239-L1666 VanDerWaalsContact CA-O 3.22Å; E1239-L1666 WeakPolarHBondContact CA-O 3.3Å; E1239-R2177 IonicContact OE1-NH2 3.21Å; E1239-R2177 PolarHBondContact OE1-NH2 3.02Å; E1239-R2177 IonicContact OE2-NH2 2.71Å; E1239-F2257 CarbonylContact O-C 3.52Å; E1239-F2257 VanDerWaalsContact O-CA 3.23Å; E1239-F2257 WeakPolarHBondContact O-CA 3.06Å; E1239-S2258 PolarHBondContact N-O 2.96Å; E1239-S2258 VanDerWaalsContact N-O 3.08Å; E1239-S2258 PolarHBondContact O-N 3.27Å; E1239-F2260 HydrophobicContact CG-CE1 4.23Å; E1239-F2260 WeakPolarHBondContact OE2-CE1 3.38Å
1240	Q	88.9	Confident	78.5	Confident	60 Å²	60	57.9 Å²	57.9	28%	0.28	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	134.8	165.9	-176.5	179.6	49.4	0	0	109.1	K1242 L1666 L1668 F2257	Q1240-K1242 HydrophobicContact CG-CG 4.43Å; Q1240-L1666 PolarHBondContact N-O 3.41Å; Q1240-L1666 PolarHBondContact O-N 3.19Å; Q1240-L1668 HydrophobicContact CB-CD1 4.37Å; Q1240-L1668 HydrophobicContact CB-CD2 4.36Å; Q1240-L1668 HydrophobicContact CB-CG 4.36Å; Q1240-F2257 HydrophobicContact CB-CD1 4.14Å; Q1240-F2257 HydrophobicContact CB-CE1 4.33Å; Q1240-F2257 HydrophobicContact CG-CD1 4.14Å; Q1240-F2257 HydrophobicContact CG-CE1 3.99Å
1241	V	89.9	Confident	80	Confident	18 Å²	18	54.9 Å²	54.9	11%	0.109	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	120.9	174	-171.9	0	0	0	0	109.1	Y1663 R1664 I2256	V1241-Y1663 HydrophobicContact CG1-CD1 4.36Å; V1241-R1664 WeakPolarHBondContact CA-O 3.33Å; V1241-I2256 HydrophobicContact CB-CB 4.14Å; V1241-I2256 HydrophobicContact CB-CG2 3.9Å; V1241-I2256 HydrophobicContact CG2-CB 4.47Å; V1241-I2256 HydrophobicContact CG2-CG2 3.77Å; V1241-I2256 PolarHBondContact N-O 3.36Å
1242	K	87	Confident	81.5	Confident	73 Å²	73	51.3 Å²	51.3	32%	0.317	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	166.4	173.1	-63.6	-169	-164.8	163.4	0	110.6	Q1240 D1362 Y1663 R1664 L1666	Q1240-K1242 HydrophobicContact CG-CG 4.43Å; K1242-D1362 IonicContact NZ-OD2 3.3Å; K1242-D1362 PolarHBondContact NZ-OD2 3.2Å; K1242-Y1663 WeakPolarHBondContact O-CA 3.5Å; K1242-R1664 PolarHBondContact N-O 2.71Å; K1242-R1664 PolarHBondContact O-N 2.85Å; K1242-L1666 HydrophobicContact CD-CD1 3.72Å; K1242-L1666 HydrophobicContact CG-CD1 4.28Å
1243	F	88.6	Confident	83.3	Confident	28 Å²	28	49 Å²	49	12%	0.123	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	133.1	167.1	-168.9	-87.2	0	0	0	109.6	Y1245 M1654 R1656 C1662 Y1663	F1243-Y1245 AromaticContact CD1-CD1 3.98Å; F1243-Y1245 HydrophobicContact CD1-CD1 3.98Å; F1243-Y1245 AromaticContact CD1-CE1 3.78Å; F1243-Y1245 HydrophobicContact CD1-CE1 3.78Å; F1243-Y1245 HydrophobicContact CD1-CE2 4.39Å; F1243-Y1245 HydrophobicContact CD1-CG 4.36Å; F1243-Y1245 AromaticContact CD1-CZ 3.99Å; F1243-Y1245 AromaticContact CE1-CD1 3.57Å; F1243-Y1245 HydrophobicContact CE1-CD1 3.57Å; F1243-Y1245 AromaticContact CE1-CE1 3.57Å; F1243-Y1245 HydrophobicContact CE1-CE1 3.57Å; F1243-Y1245 HydrophobicContact CE1-CG 4.27Å; F1243-M1654 HydrophobicContact CE2-CB 3.6Å; F1243-M1654 HydrophobicContact CZ-CB 4.07Å; F1243-R1656 HydrophobicContact CE1-CB 3.92Å; F1243-R1656 HydrophobicContact CE1-CG 4.49Å; F1243-R1656 HydrophobicContact CE2-CB 3.82Å; F1243-R1656 VanDerWaalsContact CE2-CD 3.49Å; F1243-R1656 HydrophobicContact CE2-CG 4.32Å; F1243-R1656 HydrophobicContact CZ-CB 3.47Å; F1243-R1656 VanDerWaalsContact CZ-CB 3.47Å; F1243-R1656 HydrophobicContact CZ-CG 4.28Å; F1243-C1662 CarbonylContact C-O 3.57Å; F1243-C1662 WeakPolarHBondContact CA-O 3.45Å; F1243-Y1663 HydrophobicContact CB-CE1 4.42Å; F1243-Y1663 HydrophobicContact CD2-CD1 4.23Å; F1243-Y1663 HydrophobicContact CD2-CD2 4.41Å; F1243-Y1663 AromaticContact CD2-CE1 3.84Å; F1243-Y1663 HydrophobicContact CD2-CE1 3.84Å; F1243-Y1663 HydrophobicContact CD2-CE2 4Å; F1243-Y1663 HydrophobicContact CD2-CG 4.49Å; F1243-Y1663 AromaticContact CD2-CZ 3.68Å; F1243-Y1663 HydrophobicContact CE2-CE2 4.19Å
1244	F	90.6	Very high	84.5	Confident	19 Å²	19	49.9 Å²	49.9	8%	0.083	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	122.2	180	177.4	-98.7	0	0	0	110	P1366 I1367 I1370 Q1537 G1661 C1662 R1664	F1244-P1366 HydrophobicContact CB-CB 4.18Å; F1244-P1366 HydrophobicContact CD1-CB 3.81Å; F1244-P1366 HydrophobicContact CD2-CB 3.38Å; F1244-P1366 HydrophobicContact CD2-CG 3.66Å; F1244-P1366 HydrophobicContact CE1-CB 3.94Å; F1244-P1366 HydrophobicContact CE2-CB 3.53Å; F1244-P1366 HydrophobicContact CE2-CG 3.95Å; F1244-P1366 HydrophobicContact CG-CB 3.51Å; F1244-P1366 HydrophobicContact CG-CG 4.15Å; F1244-P1366 HydrophobicContact CZ-CB 3.8Å; F1244-I1367 HydrophobicContact CE1-CG1 4.37Å; F1244-I1367 HydrophobicContact CZ-CD1 4.44Å; F1244-I1367 HydrophobicContact CZ-CG1 3.9Å; F1244-I1370 HydrophobicContact CD1-CD1 4.11Å; F1244-I1370 HydrophobicContact CE1-CD1 3.83Å; F1244-Q1537 HydrophobicContact CE2-CG 4.22Å; F1244-Q1537 VanDerWaalsContact CZ-CD 3.47Å; F1244-Q1537 HydrophobicContact CZ-CG 3.85Å; F1244-Q1537 VanDerWaalsContact CZ-NE2 3.25Å; F1244-G1661 CarbonylContact O-C 3.49Å; F1244-G1661 WeakPolarHBondContact O-CA 3.36Å; F1244-C1662 PolarHBondContact N-O 3.49Å; F1244-C1662 PolarHBondContact O-N 3.01Å; F1244-R1664 HydrophobicContact CB-CB 4.44Å; F1244-R1664 HydrophobicContact CB-CG 4.1Å
1245	Y	91.4	Very high	85.3	Confident	59 Å²	59	48 Å²	48	23%	0.231	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	134.5	178.5	-58.1	-79.2	0	0	0	110.9	F1243 K1247 Q1537 K1659	F1243-Y1245 AromaticContact CD1-CD1 3.98Å; F1243-Y1245 HydrophobicContact CD1-CD1 3.98Å; F1243-Y1245 AromaticContact CD1-CE1 3.78Å; F1243-Y1245 HydrophobicContact CD1-CE1 3.78Å; F1243-Y1245 HydrophobicContact CD1-CE2 4.39Å; F1243-Y1245 HydrophobicContact CD1-CG 4.36Å; F1243-Y1245 AromaticContact CD1-CZ 3.99Å; F1243-Y1245 AromaticContact CE1-CD1 3.57Å; F1243-Y1245 HydrophobicContact CE1-CD1 3.57Å; F1243-Y1245 AromaticContact CE1-CE1 3.57Å; F1243-Y1245 HydrophobicContact CE1-CE1 3.57Å; F1243-Y1245 HydrophobicContact CE1-CG 4.27Å; Y1245-K1247 PolarHBondContact O-N 3.01Å; Y1245-Q1537 PolarHBondContact O-NE2 2.9Å; Y1245-K1659 HydrophobicContact CD1-CB 3.69Å; Y1245-K1659 HydrophobicContact CD1-CD 3.96Å; Y1245-K1659 HydrophobicContact CD1-CG 4.46Å; Y1245-K1659 HydrophobicContact CE1-CB 3.97Å; Y1245-K1659 HydrophobicContact CE1-CD 4.33Å; Y1245-K1659 HydrophobicContact CG-CD 4.46Å
1246	Y	91.6	Very high	85.5	Confident	8 Å²	8	44.3 Å²	44.3	3%	0.031	22%	0.222	C	C	.	.	S	Bend	trans	-68.2	-33.1	179.5	-60.7	-39.8	0	0	0	113.6	I1370 S1535 Y1536 L1650 S1652 W1660 C1662	Y1246-I1370 HydrophobicContact CD1-CD1 3.99Å; Y1246-I1370 HydrophobicContact CE1-CD1 3.85Å; Y1246-I1370 HydrophobicContact CE1-CG1 4.43Å; Y1246-S1535 CarbonylContact O-C 3.49Å; Y1246-S1535 WeakPolarHBondContact O-CA 3.49Å; Y1246-S1535 WeakPolarHBondContact O-CB 3.39Å; Y1246-S1535 PolarHBondContact O-OG 3.08Å; Y1246-S1535 VanDerWaalsContact O-OG 3.14Å; Y1246-Y1536 PolarHBondContact O-N 3.34Å; Y1246-L1650 HydrophobicContact CE2-CD1 3.99Å; Y1246-S1652 PolarHBondContact OH-O 3.04Å; Y1246-W1660 HydrophobicContact CD2-CB 4.03Å; Y1246-W1660 HydrophobicContact CE2-CB 4.45Å; Y1246-W1660 PolarHBondContact N-O 2.83Å; Y1246-W1660 VanDerWaalsContact N-O 3.16Å; Y1246-C1662 HydrophobicContact CE1-CB 4.17Å
1247	K	91.6	Very high	85.2	Confident	102 Å²	102	47.7 Å²	47.7	44%	0.443	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	101.1	-178.1	-64.1	177.9	-176.3	173	0	108.7	Y1245 Y1536	Y1245-K1247 PolarHBondContact O-N 3.01Å; K1247-Y1536 HydrophobicContact CB-CD1 4.41Å; K1247-Y1536 HydrophobicContact CB-CE1 3.82Å; K1247-Y1536 HydrophobicContact CB-CE2 4.5Å; K1247-Y1536 HydrophobicContact CD-CE1 4.21Å; K1247-Y1536 HydrophobicContact CG-CD1 4.12Å; K1247-Y1536 HydrophobicContact CG-CE1 3.76Å
1248	N	89.8	Confident	84.9	Confident	14 Å²	14	51.6 Å²	51.6	8%	0.075	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	105.7	-174.7	-159.9	-4.5	0	0	0	111.7	H1250 C1251 D1254 Y1536 Q1537 R1538	N1248-H1250 VanDerWaalsContact C-N 3.26Å; N1248-H1250 PolarHBondContact O-N 3.05Å; N1248-H1250 PolarHBondContact OD1-N 3.45Å; N1248-C1251 HydrophobicContact CB-CB 4.45Å; N1248-C1251 WeakPolarHBondContact ND2-CA 3.38Å; N1248-D1254 PolarHBondContact ND2-OD2 3.14Å; N1248-Y1536 PolarHBondContact N-O 2.95Å; N1248-Y1536 VanDerWaalsContact N-O 3.12Å; N1248-Q1537 VanDerWaalsContact CB-OE1 3.29Å; N1248-R1538 PolarHBondContact O-N 3.02Å
1249	D	87.4	Confident	84.7	Confident	53 Å²	53	52.4 Å²	52.4	28%	0.283	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-15.5	177.8	-61	-79	0	0	0	114.4	Y1536 R1538	D1249-Y1536 PolarHBondContact OD1-OH 3.17Å; D1249-R1538 WeakPolarHBondContact O-CB 3.41Å; D1249-R1538 IonicContact OD1-NH1 3.57Å
1250	H	88.3	Confident	84.4	Confident	89 Å²	89	55.1 Å²	55.1	41%	0.412	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.7	47.8	-169	-53.7	-49.2	0	0	0	112	N1248 M1252 Q1253 D1540	N1248-H1250 VanDerWaalsContact C-N 3.26Å; N1248-H1250 PolarHBondContact O-N 3.05Å; N1248-H1250 PolarHBondContact OD1-N 3.45Å; H1250-M1252 PolarHBondContact O-N 3.39Å; H1250-Q1253 HydrophobicContact CB-CG 3.91Å; H1250-Q1253 VanDerWaalsContact CB-NE2 3.29Å; H1250-Q1253 WeakPolarHBondContact O-CB 3.48Å; H1250-Q1253 WeakPolarHBondContact O-CG 3.33Å; H1250-Q1253 PolarHBondContact O-N 2.75Å; H1250-D1540 IonicContact CE1-OD1 3.68Å; H1250-D1540 IonicContact CG-OD1 3.83Å; H1250-D1540 IonicContact ND1-OD1 3.93Å; H1250-D1540 PolarHBondContact ND1-OD1 2.95Å; H1250-D1540 IonicContact ND1-OD2 3.63Å
1251	C	86.1	Confident	84.3	Confident	9 Å²	9	57 Å²	57	6%	0.061	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-59.3	-23.6	-166.7	67.2	0	0	0	0	114.5	N1248 Q1253 D1254 I1363 Q1537 R1538	N1248-C1251 HydrophobicContact CB-CB 4.45Å; N1248-C1251 WeakPolarHBondContact ND2-CA 3.38Å; C1251-Q1253 PolarHBondContact O-N 2.78Å; C1251-D1254 PolarHBondContact O-N 2.82Å; C1251-I1363 HydrophobicContact CB-CD1 4.5Å; C1251-I1363 WeakPolarHBondContact SG-CD1 3.26Å; C1251-Q1537 HydrophobicContact CB-CB 4.3Å; C1251-R1538 PolarHBondContact N-O 3.38Å; C1251-R1538 PolarHBondContact SG-O 3.01Å
1252	M	83.6	Confident	84.1	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-68.6	-16.7	176.4	-60.5	-51.6	-57.2	0	0	113.9	H1250 D1254 T1255 R1258 K1259 L1262 M1360 I1363 D1539	H1250-M1252 PolarHBondContact O-N 3.39Å; M1252-D1254 PolarHBondContact O-N 2.9Å; M1252-T1255 CarbonylContact O-C 3.55Å; M1252-T1255 PolarHBondContact O-N 2.99Å; M1252-T1255 VanDerWaalsContact O-N 3.13Å; M1252-R1258 HydrophobicContact CE-CG 4.5Å; M1252-K1259 HydrophobicContact CB-CB 4.08Å; M1252-K1259 HydrophobicContact CB-CD 3.89Å; M1252-K1259 HydrophobicContact CB-CG 3.87Å; M1252-L1262 HydrophobicContact CE-CD1 3.5Å; M1252-L1262 VanDerWaalsContact CE-CD1 3.5Å; M1252-M1360 HydrophobicContact CE-CE 4.39Å; M1252-M1360 HydrophobicContact CE-SD 3.79Å; M1252-M1360 HydrophobicContact SD-SD 3.96Å; M1252-I1363 HydrophobicContact SD-CD1 4.38Å; M1252-D1539 HydrophobicContact CG-CB 4.32Å; M1252-D1539 WeakPolarHBondContact CG-O 3.3Å
1253	Q	81.7	Confident	84	Confident	116 Å²	116	56 Å²	56	54%	0.542	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-63.8	-27.3	176.2	-67.3	-173.1	22.7	0	0	112.8	H1250 C1251 T1255 K1259	H1250-Q1253 HydrophobicContact CB-CG 3.91Å; H1250-Q1253 VanDerWaalsContact CB-NE2 3.29Å; H1250-Q1253 WeakPolarHBondContact O-CB 3.48Å; H1250-Q1253 WeakPolarHBondContact O-CG 3.33Å; H1250-Q1253 PolarHBondContact O-N 2.75Å; C1251-Q1253 PolarHBondContact O-N 2.78Å; Q1253-T1255 PolarHBondContact O-N 3.19Å; Q1253-K1259 HydrophobicContact CG-CD 4.48Å
1254	D	70.5	Confident	83.9	Confident	99 Å²	99	59.6 Å²	59.6	53%	0.529	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-73.7	-6.6	177	-65.5	-60.1	0	0	0	113.2	N1248 C1251 M1252	N1248-D1254 PolarHBondContact ND2-OD2 3.14Å; C1251-D1254 PolarHBondContact O-N 2.82Å; M1252-D1254 PolarHBondContact O-N 2.9Å
1255	T	74.8	Confident	83.8	Confident	22 Å²	22	58.7 Å²	58.7	14%	0.135	30%	0.303	C	S	.	.	S	Bend	trans	-132.2	64.4	175	56.5	0	0	0	0	112.3	M1252 Q1253 S1257 R1258 K1259 M1360	M1252-T1255 CarbonylContact O-C 3.55Å; M1252-T1255 PolarHBondContact O-N 2.99Å; M1252-T1255 VanDerWaalsContact O-N 3.13Å; Q1253-T1255 PolarHBondContact O-N 3.19Å; T1255-S1257 VanDerWaalsContact C-N 3.32Å; T1255-S1257 PolarHBondContact O-N 3.01Å; T1255-S1257 VanDerWaalsContact O-N 3.12Å; T1255-R1258 WeakPolarHBondContact O-CA 3.32Å; T1255-R1258 PolarHBondContact O-N 3.41Å; T1255-K1259 PolarHBondContact O-N 3.09Å; T1255-M1360 HydrophobicContact CG2-CE 3.9Å
1256	P	73	Confident	83.6	Confident	93 Å²	93	56.3 Å²	56.3	60%	0.604	30%	0.295	S	S	*	.	H	α-helix	trans	-61.3	-30.9	-163.8	22.9	-34.4	0	0	0	115.1	A1260	P1256-A1260 WeakPolarHBondContact O-CB 3.34Å; P1256-A1260 PolarHBondContact O-N 2.82Å; P1256-A1260 VanDerWaalsContact O-N 3.07Å
1257	S	73.8	Confident	83.3	Confident	104 Å²	104	59.7 Å²	59.7	73%	0.727	32%	0.316	S	S	*	.	H	α-helix	trans	-66.2	-36.3	173.7	52.6	0	0	0	0	112.8	T1255 Q1261	T1255-S1257 VanDerWaalsContact C-N 3.32Å; T1255-S1257 PolarHBondContact O-N 3.01Å; T1255-S1257 VanDerWaalsContact O-N 3.12Å; S1257-Q1261 PolarHBondContact O-N 3.45Å
1258	R	78.3	Confident	83.1	Confident	98 Å²	98	55.7 Å²	55.7	37%	0.37	30%	0.299	S	S	.	.	H	α-helix	trans	-79.4	-37.8	178.9	-164.6	173.7	177	113.4	-3	111.1	M1252 T1255 Q1261 L1262	M1252-R1258 HydrophobicContact CE-CG 4.5Å; T1255-R1258 WeakPolarHBondContact O-CA 3.32Å; T1255-R1258 PolarHBondContact O-N 3.41Å; R1258-Q1261 PolarHBondContact O-N 2.58Å; R1258-L1262 HydrophobicContact CG-CD1 4.02Å; R1258-L1262 WeakPolarHBondContact O-CB 3.29Å; R1258-L1262 WeakPolarHBondContact O-CD1 3.36Å; R1258-L1262 WeakPolarHBondContact O-CG 3.37Å; R1258-L1262 PolarHBondContact O-N 3.07Å
1259	K	83.4	Confident	83	Confident	35 Å²	35	55 Å²	55	15%	0.152	30%	0.295	C	S	.	.	H	α-helix	trans	-57.3	-49.4	170.7	-167.5	177.6	173.7	75.2	0	111.1	M1252 Q1253 T1255 Q1261 L1262 D1263 D1540	M1252-K1259 HydrophobicContact CB-CB 4.08Å; M1252-K1259 HydrophobicContact CB-CD 3.89Å; M1252-K1259 HydrophobicContact CB-CG 3.87Å; Q1253-K1259 HydrophobicContact CG-CD 4.48Å; T1255-K1259 PolarHBondContact O-N 3.09Å; K1259-Q1261 VanDerWaalsContact C-N 3.29Å; K1259-Q1261 PolarHBondContact O-N 3.46Å; K1259-L1262 CarbonylContact O-C 3.55Å; K1259-L1262 PolarHBondContact O-N 3.21Å; K1259-D1263 PolarHBondContact O-N 2.86Å; K1259-D1540 IonicContact NZ-OD2 2.71Å; K1259-D1540 PolarHBondContact NZ-OD2 2.76Å
1260	A	83.2	Confident	82.8	Confident	58 Å²	58	55.7 Å²	55.7	48%	0.479	30%	0.297	S	S	.	.	H	α-helix	trans	-60.9	-33.4	178.4	0	0	0	0	0	114.1	P1256 K1264	P1256-A1260 WeakPolarHBondContact O-CB 3.34Å; P1256-A1260 PolarHBondContact O-N 2.82Å; P1256-A1260 VanDerWaalsContact O-N 3.07Å; A1260-K1264 PolarHBondContact O-N 2.85Å
1261	Q	84.8	Confident	82.6	Confident	99 Å²	99	52.9 Å²	52.9	46%	0.463	29%	0.285	S	S	.	.	H	α-helix	trans	-67.4	-44.2	172.1	-177.1	-179.4	6.1	0	0	111.5	S1257 R1258 K1259 K1264 Y1265 I1353	S1257-Q1261 PolarHBondContact O-N 3.45Å; R1258-Q1261 PolarHBondContact O-N 2.58Å; K1259-Q1261 VanDerWaalsContact C-N 3.29Å; K1259-Q1261 PolarHBondContact O-N 3.46Å; Q1261-K1264 PolarHBondContact O-N 2.83Å; Q1261-Y1265 PolarHBondContact O-N 2.97Å; Q1261-I1353 HydrophobicContact CG-CD1 4.46Å
1262	L	86.2	Confident	82.6	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-69.5	-41.4	-179.5	-74.4	160.8	0	0	0	112.2	M1252 R1258 K1259 K1264 Y1265 T1266 I1353 M1541	M1252-L1262 HydrophobicContact CE-CD1 3.5Å; M1252-L1262 VanDerWaalsContact CE-CD1 3.5Å; R1258-L1262 HydrophobicContact CG-CD1 4.02Å; R1258-L1262 WeakPolarHBondContact O-CB 3.29Å; R1258-L1262 WeakPolarHBondContact O-CD1 3.36Å; R1258-L1262 WeakPolarHBondContact O-CG 3.37Å; R1258-L1262 PolarHBondContact O-N 3.07Å; K1259-L1262 CarbonylContact O-C 3.55Å; K1259-L1262 PolarHBondContact O-N 3.21Å; L1262-K1264 VanDerWaalsContact C-N 3.31Å; L1262-K1264 PolarHBondContact O-N 2.86Å; L1262-Y1265 PolarHBondContact O-N 3.21Å; L1262-Y1265 VanDerWaalsContact O-N 3.1Å; L1262-T1266 WeakPolarHBondContact O-CB 3.47Å; L1262-T1266 PolarHBondContact O-N 2.99Å; L1262-T1266 PolarHBondContact O-OG1 3.11Å; L1262-I1353 HydrophobicContact CD2-CB 3.89Å; L1262-I1353 HydrophobicContact CD2-CD1 3.95Å; L1262-I1353 HydrophobicContact CD2-CG1 3.76Å; L1262-I1353 VanDerWaalsContact CD2-O 3.25Å; L1262-I1353 WeakPolarHBondContact CD2-O 3.32Å; L1262-M1541 HydrophobicContact CB-CE 3.94Å
1263	D	85.6	Confident	82.6	Confident	67 Å²	67	52.7 Å²	52.7	36%	0.358	28%	0.283	S	S	.	.	H	α-helix	trans	-53.6	-48	173.4	-62.7	-28.3	0	0	0	110.6	K1259 Y1265 T1267 M1541	K1259-D1263 PolarHBondContact O-N 2.86Å; D1263-Y1265 PolarHBondContact O-N 3.32Å; D1263-T1267 PolarHBondContact O-N 2.77Å; D1263-T1267 PolarHBondContact O-OG1 3.24Å; D1263-M1541 WeakPolarHBondContact OD1-CE 3.16Å
1264	K	86	Confident	82.5	Confident	105 Å²	105	50.3 Å²	50.3	46%	0.457	27%	0.274	S	S	.	.	H	α-helix	trans	-63.3	-41.9	176.3	-168.6	-169.3	177.4	-161.5	0	112.2	A1260 Q1261 L1262 F1268 Y1306	A1260-K1264 PolarHBondContact O-N 2.85Å; Q1261-K1264 PolarHBondContact O-N 2.83Å; L1262-K1264 VanDerWaalsContact C-N 3.31Å; L1262-K1264 PolarHBondContact O-N 2.86Å; K1264-F1268 WeakPolarHBondContact O-CB 3.27Å; K1264-F1268 PolarHBondContact O-N 3.01Å; K1264-Y1306 HydrophobicContact CD-CE1 4.05Å; K1264-Y1306 HydrophobicContact CD-CE2 4.02Å; K1264-Y1306 HydrophobicContact CG-CE1 4.17Å
1265	Y	89.2	Confident	83	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-69.8	-42.8	-178.9	-175.9	-116.5	0	0	0	112.2	Q1261 L1262 D1263 F1268 C1269 C1316 V1319 D1352 I1353 L1354	Q1261-Y1265 PolarHBondContact O-N 2.97Å; L1262-Y1265 PolarHBondContact O-N 3.21Å; L1262-Y1265 VanDerWaalsContact O-N 3.1Å; D1263-Y1265 PolarHBondContact O-N 3.32Å; Y1265-F1268 WeakPolarHBondContact O-CB 3.43Å; Y1265-F1268 PolarHBondContact O-N 3.49Å; Y1265-C1269 VanDerWaalsContact CZ-SG 3.54Å; Y1265-C1269 PolarHBondContact O-N 2.84Å; Y1265-C1269 PolarHBondContact O-SG 2.87Å; Y1265-C1269 VanDerWaalsContact O-SG 3.38Å; Y1265-C1316 HydrophobicContact CE2-CB 3.62Å; Y1265-C1316 WeakPolarHBondContact CE2-SG 3.09Å; Y1265-C1316 WeakPolarHBondContact OH-CA 3.28Å; Y1265-C1316 PolarHBondContact OH-O 2.81Å; Y1265-V1319 HydrophobicContact CD2-CG2 4.32Å; Y1265-V1319 HydrophobicContact CE2-CB 4.23Å; Y1265-V1319 HydrophobicContact CE2-CG2 3.45Å; Y1265-V1319 VanDerWaalsContact CE2-CG2 3.45Å; Y1265-V1319 PolarHBondContact OH-N 3.15Å; Y1265-D1352 PolarHBondContact OH-OD2 2.66Å; Y1265-I1353 HydrophobicContact CD1-CD1 3.75Å; Y1265-I1353 HydrophobicContact CD1-CG1 3.49Å; Y1265-I1353 VanDerWaalsContact CD1-CG1 3.49Å; Y1265-I1353 HydrophobicContact CE1-CD1 4.35Å; Y1265-I1353 HydrophobicContact CE1-CG1 3.72Å; Y1265-I1353 HydrophobicContact CG-CD1 3.9Å; Y1265-I1353 HydrophobicContact CG-CG1 4.17Å; Y1265-L1354 HydrophobicContact CD1-CB 3.8Å; Y1265-L1354 HydrophobicContact CE1-CB 3.75Å
1266	T	87.5	Confident	83.2	Confident	9 Å²	9	50.2 Å²	50.2	6%	0.055	26%	0.264	C	S	.	.	H	α-helix	trans	-61	-50.5	179.9	-55.9	0	0	0	0	112	L1262 F1268 C1269 E1270 L1354 M1541	L1262-T1266 WeakPolarHBondContact O-CB 3.47Å; L1262-T1266 PolarHBondContact O-N 2.99Å; L1262-T1266 PolarHBondContact O-OG1 3.11Å; T1266-F1268 PolarHBondContact O-N 2.68Å; T1266-C1269 WeakPolarHBondContact O-CB 3.44Å; T1266-C1269 PolarHBondContact O-N 3.32Å; T1266-C1269 VanDerWaalsContact O-N 3.14Å; T1266-E1270 WeakPolarHBondContact O-CG 3.24Å; T1266-E1270 PolarHBondContact O-N 3.22Å; T1266-L1354 HydrophobicContact CG2-CD1 4.36Å; T1266-L1354 HydrophobicContact CG2-CD2 4.13Å; T1266-L1354 WeakPolarHBondContact OG1-CD1 3.44Å; T1266-M1541 HydrophobicContact CG2-SD 3.95Å; T1266-M1541 PolarHBondContact OG1-SD 3.05Å
1267	T	84.5	Confident	83.3	Confident	79 Å²	79	46.1 Å²	46.1	49%	0.485	24%	0.237	S	C	.	.	H	α-helix	trans	-60.6	-35.8	177.1	-56.6	0	0	0	0	111.9	D1263 E1270 D1271	D1263-T1267 PolarHBondContact O-N 2.77Å; D1263-T1267 PolarHBondContact O-OG1 3.24Å; T1267-E1270 PolarHBondContact O-N 3.27Å; T1267-D1271 PolarHBondContact O-N 3.04Å
1268	F	87.6	Confident	83.4	Confident	17 Å²	17	46.7 Å²	46.7	8%	0.075	23%	0.232	C	C	.	.	H	α-helix	trans	-68.9	-38.1	176.6	-168.6	-94.7	0	0	0	112.6	K1264 Y1265 T1266 E1270 L1272 L1302 D1303 Y1306 L1307 V1319	K1264-F1268 WeakPolarHBondContact O-CB 3.27Å; K1264-F1268 PolarHBondContact O-N 3.01Å; Y1265-F1268 WeakPolarHBondContact O-CB 3.43Å; Y1265-F1268 PolarHBondContact O-N 3.49Å; T1266-F1268 PolarHBondContact O-N 2.68Å; F1268-E1270 VanDerWaalsContact C-N 3.33Å; F1268-L1272 VanDerWaalsContact O-CB 3.3Å; F1268-L1272 WeakPolarHBondContact O-CB 3.45Å; F1268-L1272 PolarHBondContact O-N 2.88Å; F1268-L1302 HydrophobicContact CD2-CD2 4.07Å; F1268-L1302 HydrophobicContact CE2-CD2 3.68Å; F1268-L1302 HydrophobicContact CZ-CD2 3.97Å; F1268-D1303 HydrophobicContact CE2-CB 4.46Å; F1268-Y1306 HydrophobicContact CB-CE1 4.14Å; F1268-Y1306 HydrophobicContact CD1-CD1 4.3Å; F1268-Y1306 HydrophobicContact CD1-CE1 4.38Å; F1268-Y1306 AromaticContact CD2-CD1 3.77Å; F1268-Y1306 HydrophobicContact CD2-CD1 3.77Å; F1268-Y1306 HydrophobicContact CD2-CE1 4.24Å; F1268-Y1306 HydrophobicContact CE1-CD1 4.48Å; F1268-Y1306 AromaticContact CE2-CD1 3.95Å; F1268-Y1306 HydrophobicContact CE2-CD1 3.95Å; F1268-Y1306 AromaticContact CG-CD1 3.94Å; F1268-Y1306 HydrophobicContact CG-CD1 3.94Å; F1268-Y1306 HydrophobicContact CG-CE1 4Å; F1268-Y1306 HydrophobicContact CZ-CD1 4.3Å; F1268-L1307 HydrophobicContact CE1-CD1 3.99Å; F1268-L1307 HydrophobicContact CZ-CB 3.94Å; F1268-L1307 HydrophobicContact CZ-CD1 4.06Å; F1268-V1319 HydrophobicContact CD1-CG2 3.77Å; F1268-V1319 HydrophobicContact CE1-CG1 4.04Å; F1268-V1319 HydrophobicContact CE1-CG2 4.06Å
1269	C	86.8	Confident	83.4	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62	-38.9	170.5	-71.3	0	0	0	0	112	Y1265 T1266 L1273 I1318 L1354 L1491	Y1265-C1269 VanDerWaalsContact CZ-SG 3.54Å; Y1265-C1269 PolarHBondContact O-N 2.84Å; Y1265-C1269 PolarHBondContact O-SG 2.87Å; Y1265-C1269 VanDerWaalsContact O-SG 3.38Å; T1266-C1269 WeakPolarHBondContact O-CB 3.44Å; T1266-C1269 PolarHBondContact O-N 3.32Å; T1266-C1269 VanDerWaalsContact O-N 3.14Å; C1269-L1273 WeakPolarHBondContact O-CB 3.34Å; C1269-L1273 PolarHBondContact O-N 2.66Å; C1269-I1318 HydrophobicContact CB-CG2 4.24Å; C1269-L1354 HydrophobicContact CB-CD2 4.37Å; C1269-L1491 HydrophobicContact CB-CD2 4.35Å
1270	E	84.4	Confident	82.9	Confident	67 Å²	67	44.9 Å²	44.9	31%	0.313	23%	0.231	S	C	.	.	H	α-helix	trans	-67.9	-45.9	177	-69.1	176.2	154.3	0	0	112.7	T1266 T1267 F1268 L1272 L1273 N1274 N1488	T1266-E1270 WeakPolarHBondContact O-CG 3.24Å; T1266-E1270 PolarHBondContact O-N 3.22Å; T1267-E1270 PolarHBondContact O-N 3.27Å; F1268-E1270 VanDerWaalsContact C-N 3.33Å; E1270-L1272 VanDerWaalsContact C-N 3.32Å; E1270-L1272 PolarHBondContact O-N 3.24Å; E1270-L1273 PolarHBondContact O-N 3.13Å; E1270-N1274 PolarHBondContact O-N 2.61Å; E1270-N1274 PolarHBondContact O-ND2 3.43Å; E1270-N1488 PolarHBondContact OE1-ND2 2.97Å
1271	D	83.4	Confident	82.2	Confident	30 Å²	30	42.8 Å²	42.8	16%	0.16	22%	0.215	C	C	.	.	H	α-helix	trans	-60.2	-42	174.5	-89.5	-45.9	0	0	0	111.3	T1267 N1274 R1275 V1300 L1302	T1267-D1271 PolarHBondContact O-N 3.04Å; D1271-N1274 PolarHBondContact O-N 2.77Å; D1271-R1275 PolarHBondContact O-N 3.5Å; D1271-R1275 VanDerWaalsContact O-N 3.14Å; D1271-V1300 PolarHBondContact OD1-N 3.38Å; D1271-L1302 HydrophobicContact CB-CD2 3.94Å
1272	L	85.6	Confident	81.3	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-71	-35.8	178.2	-168.4	64.6	0	0	0	112.4	F1268 E1270 R1275 C1276 L1302 V1319 L1322 N1323 I1326	F1268-L1272 VanDerWaalsContact O-CB 3.3Å; F1268-L1272 WeakPolarHBondContact O-CB 3.45Å; F1268-L1272 PolarHBondContact O-N 2.88Å; E1270-L1272 VanDerWaalsContact C-N 3.32Å; E1270-L1272 PolarHBondContact O-N 3.24Å; L1272-R1275 PolarHBondContact O-N 3.25Å; L1272-C1276 WeakPolarHBondContact O-CB 3.27Å; L1272-C1276 PolarHBondContact O-N 3.34Å; L1272-L1302 HydrophobicContact CB-CD2 4.45Å; L1272-L1302 HydrophobicContact CD1-CD1 3.92Å; L1272-V1319 HydrophobicContact CD2-CB 4.24Å; L1272-V1319 HydrophobicContact CD2-CG1 3.89Å; L1272-V1319 HydrophobicContact CD2-CG2 4.25Å; L1272-L1322 HydrophobicContact CD2-CB 3.77Å; L1272-L1322 HydrophobicContact CG-CB 3.89Å; L1272-N1323 HydrophobicContact CD2-CB 4.44Å; L1272-I1326 HydrophobicContact CD1-CD1 3.63Å; L1272-I1326 HydrophobicContact CG-CD1 4.2Å
1273	L	83.9	Confident	80.4	Confident	7 Å²	7	44.3 Å²	44.3	4%	0.037	24%	0.238	C	C	.	.	H	α-helix	trans	-63.1	-45.5	173.3	177.5	66.9	0	0	0	111.3	C1269 E1270 R1275 C1276 I1277 L1322 L1491 V1494	C1269-L1273 WeakPolarHBondContact O-CB 3.34Å; C1269-L1273 PolarHBondContact O-N 2.66Å; E1270-L1273 PolarHBondContact O-N 3.13Å; L1273-R1275 VanDerWaalsContact C-N 3.32Å; L1273-R1275 PolarHBondContact O-N 2.92Å; L1273-C1276 CarbonylContact O-C 3.59Å; L1273-C1276 WeakPolarHBondContact O-CA 3.34Å; L1273-C1276 WeakPolarHBondContact O-CB 3.43Å; L1273-C1276 PolarHBondContact O-N 3.47Å; L1273-C1276 VanDerWaalsContact O-N 3.08Å; L1273-I1277 HydrophobicContact CD1-CD1 4.31Å; L1273-I1277 HydrophobicContact CG-CD1 3.99Å; L1273-I1277 WeakPolarHBondContact O-CG1 3.48Å; L1273-I1277 PolarHBondContact O-N 3.25Å; L1273-L1322 HydrophobicContact CB-CD1 4.13Å; L1273-L1322 HydrophobicContact CD1-CD2 3.85Å; L1273-L1491 HydrophobicContact CD2-CB 4.05Å; L1273-L1491 HydrophobicContact CD2-CD1 3.97Å; L1273-V1494 HydrophobicContact CD1-CB 4.02Å; L1273-V1494 HydrophobicContact CD1-CG1 3.88Å; L1273-V1494 HydrophobicContact CD1-CG2 4.08Å
1274	N	79.2	Confident	79.5	Confident	66 Å²	66	42 Å²	42	35%	0.353	23%	0.225	S	C	.	.	H	α-helix	trans	-58.5	-44.8	175.7	-79.5	-65.3	0	0	0	111.1	E1270 D1271 C1276 I1277 D1278	E1270-N1274 PolarHBondContact O-N 2.61Å; E1270-N1274 PolarHBondContact O-ND2 3.43Å; D1271-N1274 PolarHBondContact O-N 2.77Å; N1274-C1276 VanDerWaalsContact C-N 3.33Å; N1274-C1276 PolarHBondContact O-N 3.39Å; N1274-I1277 PolarHBondContact O-N 3.36Å; N1274-D1278 PolarHBondContact O-N 2.95Å
1275	R	81.1	Confident	78.5	Confident	117 Å²	117	40.6 Å²	40.6	44%	0.442	23%	0.226	S	C	.	.	H	α-helix	trans	-61.6	-38.8	173	-174.1	177.2	175.7	-163.7	-4.2	112.5	D1271 L1272 L1273 D1278 V1279 I1326	D1271-R1275 PolarHBondContact O-N 3.5Å; D1271-R1275 VanDerWaalsContact O-N 3.14Å; L1272-R1275 PolarHBondContact O-N 3.25Å; L1273-R1275 VanDerWaalsContact C-N 3.32Å; L1273-R1275 PolarHBondContact O-N 2.92Å; R1275-D1278 PolarHBondContact O-N 3.24Å; R1275-V1279 WeakPolarHBondContact O-CB 3.37Å; R1275-V1279 WeakPolarHBondContact O-CG2 3.36Å; R1275-V1279 PolarHBondContact O-N 3.29Å; R1275-I1326 HydrophobicContact CB-CD1 4.22Å; R1275-I1326 HydrophobicContact CG-CD1 4.01Å
1276	C	79.8	Confident	77.3	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.007	25%	0.254	C	S	.	.	H	α-helix	trans	-65.5	-36.9	175.1	-171.1	0	0	0	0	112	L1272 L1273 N1274 V1279 R1280 L1322 I1326	L1272-C1276 WeakPolarHBondContact O-CB 3.27Å; L1272-C1276 PolarHBondContact O-N 3.34Å; L1273-C1276 CarbonylContact O-C 3.59Å; L1273-C1276 WeakPolarHBondContact O-CA 3.34Å; L1273-C1276 WeakPolarHBondContact O-CB 3.43Å; L1273-C1276 PolarHBondContact O-N 3.47Å; L1273-C1276 VanDerWaalsContact O-N 3.08Å; N1274-C1276 VanDerWaalsContact C-N 3.33Å; N1274-C1276 PolarHBondContact O-N 3.39Å; C1276-V1279 PolarHBondContact O-N 2.97Å; C1276-R1280 WeakPolarHBondContact O-CA 3.49Å; C1276-R1280 WeakPolarHBondContact O-CB 3.3Å; C1276-R1280 PolarHBondContact O-N 3.1Å; C1276-L1322 HydrophobicContact CB-CD2 4.23Å; C1276-I1326 HydrophobicContact CB-CD1 4.01Å; C1276-I1326 HydrophobicContact CB-CG1 3.98Å
1277	I	75.8	Confident	76.1	Confident	7 Å²	7	48.2 Å²	48.2	4%	0.036	27%	0.267	C	S	.	.	H	α-helix	trans	-67.6	-39.5	175.7	-69.2	162.4	0	0	0	111.1	L1273 N1274 G1281 L1284 L1290 I1293	L1273-I1277 HydrophobicContact CD1-CD1 4.31Å; L1273-I1277 HydrophobicContact CG-CD1 3.99Å; L1273-I1277 WeakPolarHBondContact O-CG1 3.48Å; L1273-I1277 PolarHBondContact O-N 3.25Å; N1274-I1277 PolarHBondContact O-N 3.36Å; I1277-G1281 WeakPolarHBondContact O-CA 3.5Å; I1277-G1281 PolarHBondContact O-N 2.83Å; I1277-L1284 HydrophobicContact CG1-CD1 3.97Å; I1277-L1290 HydrophobicContact CG2-CD2 3.99Å; I1277-I1293 HydrophobicContact CD1-CG2 3.63Å
1278	D	76.1	Confident	75.2	Confident	117 Å²	117	45.8 Å²	45.8	63%	0.626	25%	0.25	S	S	*	.	H	α-helix	trans	-73.3	-26.4	177.8	-73.7	-19.5	0	0	0	113.1	N1274 R1275 R1294	N1274-D1278 PolarHBondContact O-N 2.95Å; R1275-D1278 PolarHBondContact O-N 3.24Å; D1278-R1294 IonicContact OD1-NH2 2.85Å; D1278-R1294 PolarHBondContact OD1-NH2 3.36Å
1279	V	76.5	Confident	74	Confident	62 Å²	62	48.3 Å²	48.3	38%	0.376	27%	0.27	S	S	.	.	H	α-helix	trans	-90.9	-30	176.8	175.4	0	0	0	0	113.5	R1275 C1276	R1275-V1279 WeakPolarHBondContact O-CB 3.37Å; R1275-V1279 WeakPolarHBondContact O-CG2 3.36Å; R1275-V1279 PolarHBondContact O-N 3.29Å; C1276-V1279 PolarHBondContact O-N 2.97Å
1280	R	73.8	Confident	72.8	Confident	33 Å²	33	49.9 Å²	49.9	13%	0.125	28%	0.278	C	S	.	.	H	α-helix	trans	-126.4	14.7	-173.9	-60.3	-61	-177.4	-124.2	-16.3	114.8	C1276 A1282 L1283 L1284 L1325 I1326 E1328	C1276-R1280 WeakPolarHBondContact O-CA 3.49Å; C1276-R1280 WeakPolarHBondContact O-CB 3.3Å; C1276-R1280 PolarHBondContact O-N 3.1Å; R1280-A1282 PolarHBondContact O-N 3.13Å; R1280-L1283 HydrophobicContact CB-CB 4.47Å; R1280-L1283 WeakPolarHBondContact O-CB 3.41Å; R1280-L1283 PolarHBondContact O-N 3.04Å; R1280-L1284 PolarHBondContact O-N 2.68Å; R1280-L1284 VanDerWaalsContact O-N 3.1Å; R1280-L1325 PolarHBondContact NE-O 3.11Å; R1280-L1325 PolarHBondContact NH2-O 2.78Å; R1280-I1326 PolarHBondContact NH2-O 2.85Å; R1280-E1328 PolarHBondContact NH2-O 3Å
1281	G	67.7	Low	71.7	Confident	14 Å²	14	51.6 Å²	51.6	14%	0.144	30%	0.298	C	S	.	.	H	α-helix	trans	-50.1	-38.7	-176.6	0	0	0	0	0	114.1	I1277 L1283 L1284 T1285	I1277-G1281 WeakPolarHBondContact O-CA 3.5Å; I1277-G1281 PolarHBondContact O-N 2.83Å; G1281-L1283 PolarHBondContact O-N 2.88Å; G1281-L1284 PolarHBondContact O-N 3.25Å; G1281-T1285 PolarHBondContact O-N 3.22Å; G1281-T1285 PolarHBondContact O-OG1 2.69Å
1282	A	66.6	Low	70.6	Confident	85 Å²	85	54.3 Å²	54.3	70%	0.702	31%	0.308	S	S	*	.	H	α-helix	trans	-63.4	-37.8	176.4	0	0	0	0	0	113.8	R1280 T1285	R1280-A1282 PolarHBondContact O-N 3.13Å; A1282-T1285 VanDerWaalsContact C-OG1 3.31Å; A1282-T1285 VanDerWaalsContact CA-OG1 3.31Å; A1282-T1285 WeakPolarHBondContact CA-OG1 3.13Å; A1282-T1285 PolarHBondContact O-OG1 3.06Å
1283	L	68.3	Low	69.5	Low	47 Å²	47	54.7 Å²	54.7	25%	0.246	31%	0.31	C	S	.	.	H	α-helix	trans	-69.3	-44	175.6	-170.8	65.5	0	0	0	110.1	R1280 G1281 T1285 S1286 A1333 L1338	R1280-L1283 HydrophobicContact CB-CB 4.47Å; R1280-L1283 WeakPolarHBondContact O-CB 3.41Å; R1280-L1283 PolarHBondContact O-N 3.04Å; G1281-L1283 PolarHBondContact O-N 2.88Å; L1283-T1285 PolarHBondContact O-N 3.3Å; L1283-S1286 WeakPolarHBondContact O-CB 3.35Å; L1283-S1286 PolarHBondContact O-N 3.18Å; L1283-S1286 PolarHBondContact O-OG 3.14Å; L1283-A1333 HydrophobicContact CD1-CB 4.28Å; L1283-L1338 HydrophobicContact CD1-CD1 4.17Å; L1283-L1338 HydrophobicContact CD2-CD2 4.35Å
1284	L	66.4	Low	68.2	Low	18 Å²	18	62.1 Å²	62.1	9%	0.094	34%	0.338	C	S	.	.	H	α-helix	trans	-66.6	-34.2	178.7	-64.5	173	0	0	0	112.6	I1277 R1280 G1281 S1286 R1287 L1288 V1494	I1277-L1284 HydrophobicContact CG1-CD1 3.97Å; R1280-L1284 PolarHBondContact O-N 2.68Å; R1280-L1284 VanDerWaalsContact O-N 3.1Å; G1281-L1284 PolarHBondContact O-N 3.25Å; L1284-S1286 PolarHBondContact O-N 3.04Å; L1284-S1286 VanDerWaalsContact O-N 3.14Å; L1284-R1287 PolarHBondContact O-N 3.5Å; L1284-L1288 PolarHBondContact O-N 3.39Å; L1284-V1494 HydrophobicContact CD2-CG1 4.11Å
1285	T	65.3	Low	66.7	Low	76 Å²	76	62.2 Å²	62.2	47%	0.466	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-17.6	173.5	41.6	0	0	0	0	114.6	G1281 A1282 L1283 R1287 L1288 L1290	G1281-T1285 PolarHBondContact O-N 3.22Å; G1281-T1285 PolarHBondContact O-OG1 2.69Å; A1282-T1285 VanDerWaalsContact C-OG1 3.31Å; A1282-T1285 VanDerWaalsContact CA-OG1 3.31Å; A1282-T1285 WeakPolarHBondContact CA-OG1 3.13Å; A1282-T1285 PolarHBondContact O-OG1 3.06Å; L1283-T1285 PolarHBondContact O-N 3.3Å; T1285-R1287 PolarHBondContact O-N 3.45Å; T1285-L1288 WeakPolarHBondContact CA-O 3.42Å; T1285-L1290 HydrophobicContact CG2-CB 4.18Å; T1285-L1290 HydrophobicContact CG2-CD1 3.47Å; T1285-L1290 VanDerWaalsContact CG2-CD1 3.47Å; T1285-L1290 HydrophobicContact CG2-CG 3.59Å
1286	S	62.8	Low	65	Low	84 Å²	84	61 Å²	61	59%	0.587	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-16.3	174.7	73	0	0	0	0	113.5	L1283 L1284	L1283-S1286 WeakPolarHBondContact O-CB 3.35Å; L1283-S1286 PolarHBondContact O-N 3.18Å; L1283-S1286 PolarHBondContact O-OG 3.14Å; L1284-S1286 PolarHBondContact O-N 3.04Å; L1284-S1286 VanDerWaalsContact O-N 3.14Å
1287	R	61.7	Low	63.5	Low	86 Å²	86	70.3 Å²	70.3	33%	0.325	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.2	-18.9	-177.2	-64.6	-172.3	176.8	-168.5	-1.3	114.9	L1284 T1285 A1497	L1284-R1287 PolarHBondContact O-N 3.5Å; T1285-R1287 PolarHBondContact O-N 3.45Å; R1287-A1497 HydrophobicContact CB-CB 4.23Å; R1287-A1497 WeakPolarHBondContact CD-O 3.37Å; R1287-A1497 PolarHBondContact NH1-O 3.09Å
1288	L	65.6	Low	62.3	Low	27 Å²	27	79 Å²	79	14%	0.141	44%	0.435	C	S	.	.	S	Bend	trans	-140.3	150.4	-175.3	-70.4	172.2	0	0	0	113	L1284 T1285 L1290 I1293 V1494 A1497	L1284-L1288 PolarHBondContact O-N 3.39Å; T1285-L1288 WeakPolarHBondContact CA-O 3.42Å; L1288-L1290 PolarHBondContact O-N 2.95Å; L1288-I1293 HydrophobicContact CB-CD1 3.87Å; L1288-I1293 HydrophobicContact CD1-CD1 3.86Å; L1288-I1293 HydrophobicContact CG-CD1 4.42Å; L1288-V1494 HydrophobicContact CD1-CB 4.48Å; L1288-V1494 HydrophobicContact CD1-CG2 3.92Å; L1288-A1497 HydrophobicContact CD1-CB 3.59Å; L1288-A1497 HydrophobicContact CD2-CB 4.07Å; L1288-A1497 HydrophobicContact CG-CB 3.68Å
1289	S	63.1	Low	61	Low	70 Å²	70	78.8 Å²	78.8	49%	0.49	44%	0.443	S	S	.	.			trans	-85.3	97.2	177.4	-164.5	0	0	0	0	111.9	S1291 K1292	S1289-S1291 PolarHBondContact O-N 2.98Å; S1289-S1291 PolarHBondContact OG-OG 3.37Å; S1289-S1291 VanDerWaalsContact OG-OG 3.14Å; S1289-K1292 PolarHBondContact O-N 2.69Å
1290	L	60.9	Low	60	Low	33 Å²	33	80.1 Å²	80.1	17%	0.173	45%	0.451	C	S	.	.	H	α-helix	trans	-55	-18.2	-179.2	-80.8	-172.1	0	0	0	115	I1277 T1285 L1288 K1292 I1293 R1294	I1277-L1290 HydrophobicContact CG2-CD2 3.99Å; T1285-L1290 HydrophobicContact CG2-CB 4.18Å; T1285-L1290 HydrophobicContact CG2-CD1 3.47Å; T1285-L1290 VanDerWaalsContact CG2-CD1 3.47Å; T1285-L1290 HydrophobicContact CG2-CG 3.59Å; L1288-L1290 PolarHBondContact O-N 2.95Å; L1290-K1292 PolarHBondContact O-N 3.4Å; L1290-I1293 HydrophobicContact CD2-CD1 4.44Å; L1290-R1294 PolarHBondContact O-N 3.47Å
1291	S	62	Low	59.4	Low	104 Å²	104	86.5 Å²	86.5	73%	0.727	49%	0.487	S	S	*	.	H	α-helix	trans	-66.6	-22.4	179.5	54	0	0	0	0	114.2	S1289	S1289-S1291 PolarHBondContact O-N 2.98Å; S1289-S1291 PolarHBondContact OG-OG 3.37Å; S1289-S1291 VanDerWaalsContact OG-OG 3.14Å
1292	K	60.3	Low	59.5	Low	87 Å²	87	87.5 Å²	87.5	38%	0.378	49%	0.489	S	S	.	.	H	α-helix	trans	-96.5	-33.1	176.5	-70.3	177	169.7	-173.4	0	112.8	S1289 L1290 R1294 Y1512 E1513	S1289-K1292 PolarHBondContact O-N 2.69Å; L1290-K1292 PolarHBondContact O-N 3.4Å; K1292-R1294 VanDerWaalsContact C-N 3.33Å; K1292-R1294 PolarHBondContact O-N 2.89Å; K1292-Y1512 WeakPolarHBondContact CE-O 3.2Å; K1292-Y1512 PolarHBondContact NZ-O 3.05Å; K1292-E1513 WeakPolarHBondContact CB-OE1 3.42Å; K1292-E1513 WeakPolarHBondContact CD-OE2 3.36Å; K1292-E1513 IonicContact NZ-OE2 3.99Å
1293	I	62.7	Low	60.1	Low	7 Å²	7	87.2 Å²	87.2	4%	0.036	48%	0.475	C	S	.	.	H	α-helix	trans	-67	-29.2	-178.7	-60.7	175.2	0	0	0	112.8	I1277 L1288 L1290 A1295 A1490 V1494	I1277-I1293 HydrophobicContact CD1-CG2 3.63Å; L1288-I1293 HydrophobicContact CB-CD1 3.87Å; L1288-I1293 HydrophobicContact CD1-CD1 3.86Å; L1288-I1293 HydrophobicContact CG-CD1 4.42Å; L1290-I1293 HydrophobicContact CD2-CD1 4.44Å; I1293-A1295 VanDerWaalsContact C-N 3.29Å; I1293-A1295 PolarHBondContact O-N 3.43Å; I1293-A1490 HydrophobicContact CG2-CB 4.22Å; I1293-V1494 HydrophobicContact CD1-CG2 4.21Å
1294	R	57.4	Low	60.6	Low	163 Å²	163	87.1 Å²	87.1	62%	0.615	49%	0.486	S	S	*	.			trans	-77.9	68.8	-177.3	-82.3	-173.3	156.3	173.5	-5.6	113.8	D1278 L1290 K1292	D1278-R1294 IonicContact OD1-NH2 2.85Å; D1278-R1294 PolarHBondContact OD1-NH2 3.36Å; L1290-R1294 PolarHBondContact O-N 3.47Å; K1292-R1294 VanDerWaalsContact C-N 3.33Å; K1292-R1294 PolarHBondContact O-N 2.89Å
1295	A	47.5	Very low	61.2	Low	69 Å²	69	93.3 Å²	93.3	57%	0.57	51%	0.514	S	S	*	.			trans	-113.3	77.3	-179.2	0	0	0	0	0	114.6	I1293	I1293-A1295 VanDerWaalsContact C-N 3.29Å; I1293-A1295 PolarHBondContact O-N 3.43Å
1296	S	44.8	Very low	62.1	Low	92 Å²	92	91 Å²	91	64%	0.643	50%	0.497	S	S	*	.			trans	88.8	150.9	157.4	95.1	0	0	0	0	121.4
1297	K	49.3	Very low	63.1	Low	196 Å²	196	87.9 Å²	87.9	85%	0.852	47%	0.474	S	S	*	.			trans	79	164.9	165.3	-69.6	170.8	-176	169	0	117.9
1298	K	49	Very low	64.1	Low	188 Å²	188	89.7 Å²	89.7	82%	0.817	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-93.4	139.9	-162.2	-64.5	177.3	177.6	177.9	0	110.1	V1300	K1298-V1300 PolarHBondContact O-N 3.22Å
1299	S	48.6	Very low	65	Low	114 Å²	114	93.9 Å²	93.9	80%	0.797	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-49.5	121.9	164.5	171.1	0	0	0	0	110.8
1300	V	57.1	Low	66.1	Low	90 Å²	90	90.7 Å²	90.7	55%	0.545	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-90.7	157.1	162.7	-175.4	0	0	0	0	108.5	D1271 K1298 L1302	D1271-V1300 PolarHBondContact OD1-N 3.38Å; K1298-V1300 PolarHBondContact O-N 3.22Å; V1300-L1302 PolarHBondContact O-N 3.04Å
1301	L	60.7	Low	67.1	Low	166 Å²	166	91.4 Å²	91.4	87%	0.869	49%	0.486	S	S	*	.			trans	-74.7	109	176.3	-131.8	152.5	0	0	0	108.6	D1303	L1301-D1303 PolarHBondContact O-N 3.01Å
1302	L	69.7	Low	68.1	Low	36 Å²	36	90.4 Å²	90.4	19%	0.188	48%	0.484	C	S	.	.			trans	-58.4	126.5	-179	-75.7	163.1	0	0	0	111.3	F1268 D1271 L1272 V1300 G1304	F1268-L1302 HydrophobicContact CD2-CD2 4.07Å; F1268-L1302 HydrophobicContact CE2-CD2 3.68Å; F1268-L1302 HydrophobicContact CZ-CD2 3.97Å; D1271-L1302 HydrophobicContact CB-CD2 3.94Å; L1272-L1302 HydrophobicContact CB-CD2 4.45Å; L1272-L1302 HydrophobicContact CD1-CD1 3.92Å; V1300-L1302 PolarHBondContact O-N 3.04Å; L1302-G1304 PolarHBondContact O-N 3.16Å
1303	D	78.7	Confident	69	Low	78 Å²	78	89.4 Å²	89.4	42%	0.417	48%	0.483	S	S	.	.			trans	-68.4	110.1	172.4	179.2	-10.7	0	0	0	110.2	F1268 L1301 E1305 Y1306 L1307	F1268-D1303 HydrophobicContact CE2-CB 4.46Å; L1301-D1303 PolarHBondContact O-N 3.01Å; D1303-E1305 PolarHBondContact OD1-N 3.32Å; D1303-Y1306 PolarHBondContact OD1-N 3.43Å; D1303-Y1306 WeakPolarHBondContact OD2-CB 3.23Å; D1303-L1307 WeakPolarHBondContact O-CB 3.08Å; D1303-L1307 PolarHBondContact O-N 2.92Å
1304	G	78.4	Confident	69.6	Low	46 Å²	46	96.8 Å²	96.8	47%	0.474	52%	0.515	S	S	.	.	H	α-helix	trans	-72.9	-22.4	-179.2	0	0	0	0	0	114.6	L1302 Q1308	L1302-G1304 PolarHBondContact O-N 3.16Å; G1304-Q1308 WeakPolarHBondContact O-CG 3.19Å; G1304-Q1308 PolarHBondContact O-N 3.35Å
1305	E	80.1	Confident	70.8	Confident	147 Å²	147	94.5 Å²	94.5	69%	0.687	51%	0.51	S	S	*	.	H	α-helix	trans	-79.7	-42.4	176.3	-171.2	167.4	-144	0	0	109.8	D1303 L1307 Q1308 Q1309	D1303-E1305 PolarHBondContact OD1-N 3.32Å; E1305-L1307 VanDerWaalsContact C-N 3.34Å; E1305-L1307 PolarHBondContact O-N 3.4Å; E1305-Q1308 PolarHBondContact O-N 2.91Å; E1305-Q1309 WeakPolarHBondContact O-CG 3.15Å; E1305-Q1309 PolarHBondContact O-N 2.85Å; E1305-Q1309 VanDerWaalsContact O-N 3.1Å
1306	Y	83.7	Confident	72.7	Confident	27 Å²	27	91.7 Å²	91.7	11%	0.106	49%	0.485	C	S	.	.	H	α-helix	trans	-66	-33.9	171.4	-167.5	-122	0	0	0	112.6	K1264 F1268 D1303 Q1308 Q1309 C1310	K1264-Y1306 HydrophobicContact CD-CE1 4.05Å; K1264-Y1306 HydrophobicContact CD-CE2 4.02Å; K1264-Y1306 HydrophobicContact CG-CE1 4.17Å; F1268-Y1306 HydrophobicContact CB-CE1 4.14Å; F1268-Y1306 HydrophobicContact CD1-CD1 4.3Å; F1268-Y1306 HydrophobicContact CD1-CE1 4.38Å; F1268-Y1306 AromaticContact CD2-CD1 3.77Å; F1268-Y1306 HydrophobicContact CD2-CD1 3.77Å; F1268-Y1306 HydrophobicContact CD2-CE1 4.24Å; F1268-Y1306 HydrophobicContact CE1-CD1 4.48Å; F1268-Y1306 AromaticContact CE2-CD1 3.95Å; F1268-Y1306 HydrophobicContact CE2-CD1 3.95Å; F1268-Y1306 AromaticContact CG-CD1 3.94Å; F1268-Y1306 HydrophobicContact CG-CD1 3.94Å; F1268-Y1306 HydrophobicContact CG-CE1 4Å; F1268-Y1306 HydrophobicContact CZ-CD1 4.3Å; D1303-Y1306 PolarHBondContact OD1-N 3.43Å; D1303-Y1306 WeakPolarHBondContact OD2-CB 3.23Å; Y1306-Q1308 PolarHBondContact O-N 3.43Å; Y1306-Q1309 PolarHBondContact O-N 3.25Å; Y1306-C1310 PolarHBondContact O-N 3.27Å; Y1306-C1310 PolarHBondContact O-SG 2.77Å; Y1306-C1310 VanDerWaalsContact O-SG 3.35Å
1307	L	84.1	Confident	74.7	Confident	20 Å²	20	87.4 Å²	87.4	11%	0.105	46%	0.456	C	S	.	.	H	α-helix	trans	-57.5	-46.4	171.7	-176.1	57.9	0	0	0	111.8	F1268 D1303 E1305 C1310 I1311 V1319	F1268-L1307 HydrophobicContact CE1-CD1 3.99Å; F1268-L1307 HydrophobicContact CZ-CB 3.94Å; F1268-L1307 HydrophobicContact CZ-CD1 4.06Å; D1303-L1307 WeakPolarHBondContact O-CB 3.08Å; D1303-L1307 PolarHBondContact O-N 2.92Å; E1305-L1307 VanDerWaalsContact C-N 3.34Å; E1305-L1307 PolarHBondContact O-N 3.4Å; L1307-C1310 PolarHBondContact O-N 3.46Å; L1307-I1311 HydrophobicContact CD1-CD1 3.92Å; L1307-I1311 HydrophobicContact CD1-CG1 4.31Å; L1307-I1311 HydrophobicContact CG-CD1 3.84Å; L1307-I1311 WeakPolarHBondContact O-CB 3.46Å; L1307-I1311 VanDerWaalsContact O-CG1 3.32Å; L1307-I1311 WeakPolarHBondContact O-CG1 3.07Å; L1307-I1311 PolarHBondContact O-N 3.44Å; L1307-V1319 HydrophobicContact CD1-CG1 3.69Å
1308	Q	83.4	Confident	76.6	Confident	124 Å²	124	78.1 Å²	78.1	58%	0.579	42%	0.415	S	S	*	.	H	α-helix	trans	-66.9	-36.6	178.6	-71.3	-67.2	-39.9	0	0	112.2	G1304 E1305 Y1306 I1311 A1312	G1304-Q1308 WeakPolarHBondContact O-CG 3.19Å; G1304-Q1308 PolarHBondContact O-N 3.35Å; E1305-Q1308 PolarHBondContact O-N 2.91Å; Y1306-Q1308 PolarHBondContact O-N 3.43Å; Q1308-I1311 PolarHBondContact O-N 3.39Å; Q1308-A1312 WeakPolarHBondContact O-CB 3.09Å; Q1308-A1312 PolarHBondContact O-N 2.91Å; Q1308-A1312 VanDerWaalsContact O-N 3.12Å
1309	Q	83.9	Confident	78.5	Confident	115 Å²	115	69.1 Å²	69.1	54%	0.537	38%	0.376	S	S	.	.	H	α-helix	trans	-61.3	-47.1	172	-69.5	176.8	2.2	0	0	111.7	E1305 Y1306 I1311 A1312 D1313	E1305-Q1309 WeakPolarHBondContact O-CG 3.15Å; E1305-Q1309 PolarHBondContact O-N 2.85Å; E1305-Q1309 VanDerWaalsContact O-N 3.1Å; Y1306-Q1309 PolarHBondContact O-N 3.25Å; Q1309-I1311 PolarHBondContact O-N 3.33Å; Q1309-A1312 PolarHBondContact O-N 3.25Å; Q1309-D1313 PolarHBondContact O-N 2.99Å
1310	C	84.9	Confident	80.2	Confident	3 Å²	3	66.5 Å²	66.5	2%	0.02	35%	0.351	C	S	.	.	H	α-helix	trans	-66.3	-33.8	177.2	-68.9	0	0	0	0	113.2	Y1306 L1307 A1312 C1316 V1319	Y1306-C1310 PolarHBondContact O-N 3.27Å; Y1306-C1310 PolarHBondContact O-SG 2.77Å; Y1306-C1310 VanDerWaalsContact O-SG 3.35Å; L1307-C1310 PolarHBondContact O-N 3.46Å; C1310-A1312 VanDerWaalsContact C-N 3.28Å; C1310-A1312 PolarHBondContact O-N 2.8Å; C1310-C1316 HydrophobicContact CB-CB 3.93Å; C1310-C1316 WeakPolarHBondContact O-CB 3.31Å; C1310-V1319 HydrophobicContact CB-CB 4.07Å; C1310-V1319 HydrophobicContact CB-CG1 3.64Å; C1310-V1319 HydrophobicContact CB-CG2 4.36Å
1311	I	83.2	Confident	81.6	Confident	47 Å²	47	62.2 Å²	62.2	24%	0.241	33%	0.325	C	S	.	.	H	α-helix	trans	-70.6	-27.2	175.7	-72.8	170.3	0	0	0	111.6	L1307 Q1308 Q1309 N1323	L1307-I1311 HydrophobicContact CD1-CD1 3.92Å; L1307-I1311 HydrophobicContact CD1-CG1 4.31Å; L1307-I1311 HydrophobicContact CG-CD1 3.84Å; L1307-I1311 WeakPolarHBondContact O-CB 3.46Å; L1307-I1311 VanDerWaalsContact O-CG1 3.32Å; L1307-I1311 WeakPolarHBondContact O-CG1 3.07Å; L1307-I1311 PolarHBondContact O-N 3.44Å; Q1308-I1311 PolarHBondContact O-N 3.39Å; Q1309-I1311 PolarHBondContact O-N 3.33Å; I1311-N1323 HydrophobicContact CD1-CB 4.36Å
1312	A	81.8	Confident	82.8	Confident	84 Å²	84	54.3 Å²	54.3	69%	0.694	28%	0.284	S	S	*	.	H	α-helix	trans	-85.2	-30.3	178	0	0	0	0	0	114.2	Q1308 Q1309 C1310	Q1308-A1312 WeakPolarHBondContact O-CB 3.09Å; Q1308-A1312 PolarHBondContact O-N 2.91Å; Q1308-A1312 VanDerWaalsContact O-N 3.12Å; Q1309-A1312 PolarHBondContact O-N 3.25Å; C1310-A1312 VanDerWaalsContact C-N 3.28Å; C1310-A1312 PolarHBondContact O-N 2.8Å
1313	D	79.8	Confident	83.6	Confident	65 Å²	65	53 Å²	53	35%	0.348	28%	0.277	S	S	.	.			trans	-82.2	116.9	173.1	-166.7	-14.2	0	0	0	110.9	Q1309 K1315 C1316	Q1309-D1313 PolarHBondContact O-N 2.99Å; D1313-K1315 PolarHBondContact O-N 3.17Å; D1313-K1315 WeakPolarHBondContact OD1-CB 3.5Å; D1313-K1315 WeakPolarHBondContact OD1-CG 3.37Å; D1313-K1315 PolarHBondContact OD1-N 3.48Å; D1313-C1316 PolarHBondContact O-N 3.02Å
1314	K	76.1	Confident	83.8	Confident	162 Å²	162	52.6 Å²	52.6	70%	0.704	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-54.8	-26.2	174.8	-67.4	-167.4	174.8	-165.9	0	113	C1316 S1351	K1314-C1316 PolarHBondContact O-N 3.17Å; K1314-S1351 PolarHBondContact O-OG 3.38Å
1315	K	82.3	Confident	83.8	Confident	116 Å²	116	51 Å²	51	50%	0.504	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-76.8	4.8	179.1	-51.9	167.3	-176.1	161.5	0	114.2	D1313 S1351 D1352 I1353	D1313-K1315 PolarHBondContact O-N 3.17Å; D1313-K1315 WeakPolarHBondContact OD1-CB 3.5Å; D1313-K1315 WeakPolarHBondContact OD1-CG 3.37Å; D1313-K1315 PolarHBondContact OD1-N 3.48Å; K1315-S1351 VanDerWaalsContact CA-O 3.3Å; K1315-S1351 WeakPolarHBondContact CA-O 3.47Å; K1315-D1352 WeakPolarHBondContact O-CA 3.29Å; K1315-I1353 HydrophobicContact CB-CG2 3.73Å; K1315-I1353 HydrophobicContact CD-CG2 4.43Å; K1315-I1353 PolarHBondContact O-N 3.43Å
1316	C	87.8	Confident	83.8	Confident	9 Å²	9	45 Å²	45	6%	0.061	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-116.4	39.3	176.2	-70.1	0	0	0	0	111.7	Y1265 C1310 D1313 K1314 I1318 V1319 H1320	Y1265-C1316 HydrophobicContact CE2-CB 3.62Å; Y1265-C1316 WeakPolarHBondContact CE2-SG 3.09Å; Y1265-C1316 WeakPolarHBondContact OH-CA 3.28Å; Y1265-C1316 PolarHBondContact OH-O 2.81Å; C1310-C1316 HydrophobicContact CB-CB 3.93Å; C1310-C1316 WeakPolarHBondContact O-CB 3.31Å; D1313-C1316 PolarHBondContact O-N 3.02Å; K1314-C1316 PolarHBondContact O-N 3.17Å; C1316-I1318 VanDerWaalsContact C-N 3.28Å; C1316-I1318 PolarHBondContact O-N 2.93Å; C1316-V1319 PolarHBondContact O-N 2.7Å; C1316-V1319 VanDerWaalsContact O-N 3.1Å; C1316-H1320 PolarHBondContact O-N 3.22Å
1317	A	86.4	Confident	83.7	Confident	3 Å²	3	50 Å²	50	3%	0.025	25%	0.249	C	C	.	.	H	α-helix	trans	-61.5	-28.4	-173.9	0	0	0	0	0	114.3	H1320 L1321 W1344 H1348 D1352	A1317-H1320 PolarHBondContact O-N 3.27Å; A1317-L1321 WeakPolarHBondContact O-CB 3.18Å; A1317-L1321 PolarHBondContact O-N 2.58Å; A1317-W1344 HydrophobicContact CB-CH2 3.93Å; A1317-W1344 HydrophobicContact CB-CZ3 4.4Å; A1317-H1348 HydrophobicContact CB-CB 4.12Å; A1317-D1352 HydrophobicContact CB-CB 4.21Å; A1317-D1352 PolarHBondContact N-OD2 3.37Å; A1317-D1352 VanDerWaalsContact N-OD2 3.08Å
1318	I	88.5	Confident	83	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-44.2	173.3	-69.1	171.2	0	0	0	110.8	C1269 C1316 L1321 L1322 D1352 L1354 W1355 L1491 L1495	C1269-I1318 HydrophobicContact CB-CG2 4.24Å; C1316-I1318 VanDerWaalsContact C-N 3.28Å; C1316-I1318 PolarHBondContact O-N 2.93Å; I1318-L1321 PolarHBondContact O-N 3.1Å; I1318-L1322 HydrophobicContact CG2-CD1 3.83Å; I1318-L1322 HydrophobicContact CG2-CG 4.4Å; I1318-L1322 WeakPolarHBondContact O-CB 3.36Å; I1318-L1322 WeakPolarHBondContact O-CG 3.38Å; I1318-L1322 PolarHBondContact O-N 2.77Å; I1318-D1352 WeakPolarHBondContact CB-OD2 3.17Å; I1318-D1352 WeakPolarHBondContact CD1-OD1 3.39Å; I1318-D1352 HydrophobicContact CG1-CB 4.44Å; I1318-D1352 WeakPolarHBondContact CG1-OD2 3.46Å; I1318-D1352 PolarHBondContact N-OD2 3.21Å; I1318-L1354 HydrophobicContact CD1-CB 4.37Å; I1318-L1354 HydrophobicContact CD1-CD2 4.43Å; I1318-L1354 HydrophobicContact CD1-CG 4.48Å; I1318-W1355 HydrophobicContact CD1-CB 4.24Å; I1318-L1491 HydrophobicContact CG2-CD1 4.25Å; I1318-L1495 HydrophobicContact CD1-CD1 3.7Å; I1318-L1495 HydrophobicContact CG1-CD1 3.96Å; I1318-L1495 HydrophobicContact CG1-CD2 4.26Å; I1318-L1495 HydrophobicContact CG2-CD2 4.39Å
1319	V	88.3	Confident	81.9	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.9	-42.6	176	165.4	0	0	0	0	111.2	Y1265 F1268 L1272 L1307 C1310 C1316 L1321 N1323	Y1265-V1319 HydrophobicContact CD2-CG2 4.32Å; Y1265-V1319 HydrophobicContact CE2-CB 4.23Å; Y1265-V1319 HydrophobicContact CE2-CG2 3.45Å; Y1265-V1319 VanDerWaalsContact CE2-CG2 3.45Å; Y1265-V1319 PolarHBondContact OH-N 3.15Å; F1268-V1319 HydrophobicContact CD1-CG2 3.77Å; F1268-V1319 HydrophobicContact CE1-CG1 4.04Å; F1268-V1319 HydrophobicContact CE1-CG2 4.06Å; L1272-V1319 HydrophobicContact CD2-CB 4.24Å; L1272-V1319 HydrophobicContact CD2-CG1 3.89Å; L1272-V1319 HydrophobicContact CD2-CG2 4.25Å; L1307-V1319 HydrophobicContact CD1-CG1 3.69Å; C1310-V1319 HydrophobicContact CB-CB 4.07Å; C1310-V1319 HydrophobicContact CB-CG1 3.64Å; C1310-V1319 HydrophobicContact CB-CG2 4.36Å; C1316-V1319 PolarHBondContact O-N 2.7Å; C1316-V1319 VanDerWaalsContact O-N 3.1Å; V1319-L1321 PolarHBondContact O-N 3.47Å; V1319-N1323 VanDerWaalsContact O-CB 3.27Å; V1319-N1323 WeakPolarHBondContact O-CB 3.48Å; V1319-N1323 PolarHBondContact O-N 3.29Å
1320	H	85.9	Confident	80.8	Confident	59 Å²	59	50.6 Å²	50.6	27%	0.273	26%	0.256	S	S	.	.	H	α-helix	trans	-60.8	-44.8	176.2	-170.5	98.4	0	0	0	111.8	C1316 A1317 N1323 K1324 W1344	C1316-H1320 PolarHBondContact O-N 3.22Å; A1317-H1320 PolarHBondContact O-N 3.27Å; H1320-N1323 PolarHBondContact O-N 3.05Å; H1320-K1324 VanDerWaalsContact O-CB 3.3Å; H1320-K1324 WeakPolarHBondContact O-CB 3.35Å; H1320-K1324 PolarHBondContact O-N 2.75Å; H1320-W1344 HydrophobicContact CB-CH2 3.9Å; H1320-W1344 AromaticContact CD2-CH2 3.47Å; H1320-W1344 VanDerWaalsContact CD2-CH2 3.47Å; H1320-W1344 WeakPolarHBondContact CD2-CH2 3.39Å; H1320-W1344 AromaticContact CD2-CZ2 3.58Å; H1320-W1344 AromaticContact CG-CH2 3.86Å
1321	L	86	Confident	79.4	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.4	-50.2	178.3	-175	70.7	0	0	0	112.2	A1317 I1318 V1319 K1324 L1325 L1341 W1344 F1345 L1495 I1498	A1317-L1321 WeakPolarHBondContact O-CB 3.18Å; A1317-L1321 PolarHBondContact O-N 2.58Å; I1318-L1321 PolarHBondContact O-N 3.1Å; V1319-L1321 PolarHBondContact O-N 3.47Å; L1321-K1324 PolarHBondContact O-N 2.95Å; L1321-L1325 HydrophobicContact CG-CD1 4.47Å; L1321-L1325 WeakPolarHBondContact O-CG 3.41Å; L1321-L1325 PolarHBondContact O-N 3.15Å; L1321-L1341 HydrophobicContact CD1-CB 4.47Å; L1321-L1341 HydrophobicContact CD1-CD2 3.97Å; L1321-L1341 HydrophobicContact CD1-CG 4.31Å; L1321-W1344 HydrophobicContact CB-CZ3 4.2Å; L1321-W1344 HydrophobicContact CD1-CE3 4.25Å; L1321-W1344 HydrophobicContact CD1-CZ3 4.37Å; L1321-F1345 HydrophobicContact CD1-CB 4.23Å; L1321-F1345 HydrophobicContact CD2-CB 4.37Å; L1321-F1345 HydrophobicContact CD2-CD2 3.64Å; L1321-F1345 HydrophobicContact CD2-CE2 4.01Å; L1321-F1345 HydrophobicContact CD2-CG 3.94Å; L1321-L1495 HydrophobicContact CD2-CD2 3.75Å; L1321-I1498 HydrophobicContact CD1-CG2 4.44Å; L1321-I1498 HydrophobicContact CD2-CD1 3.98Å; L1321-I1498 HydrophobicContact CD2-CG2 4.36Å
1322	L	85.5	Confident	77.8	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.5	-38.5	-179.4	-68.2	172.9	0	0	0	111.7	L1272 L1273 C1276 I1318 L1325 I1326 L1491	L1272-L1322 HydrophobicContact CD2-CB 3.77Å; L1272-L1322 HydrophobicContact CG-CB 3.89Å; L1273-L1322 HydrophobicContact CB-CD1 4.13Å; L1273-L1322 HydrophobicContact CD1-CD2 3.85Å; C1276-L1322 HydrophobicContact CB-CD2 4.23Å; I1318-L1322 HydrophobicContact CG2-CD1 3.83Å; I1318-L1322 HydrophobicContact CG2-CG 4.4Å; I1318-L1322 WeakPolarHBondContact O-CB 3.36Å; I1318-L1322 WeakPolarHBondContact O-CG 3.38Å; I1318-L1322 PolarHBondContact O-N 2.77Å; L1322-L1325 PolarHBondContact O-N 3.19Å; L1322-I1326 WeakPolarHBondContact O-CD1 3.3Å; L1322-I1326 WeakPolarHBondContact O-CG1 3.36Å; L1322-I1326 PolarHBondContact O-N 3.22Å; L1322-I1326 VanDerWaalsContact O-N 3.16Å; L1322-L1491 HydrophobicContact CD1-CD1 4.49Å
1323	N	86.3	Confident	76.5	Confident	8 Å²	8	59.6 Å²	59.6	4%	0.043	30%	0.295	C	S	.	.	H	α-helix	trans	-67.4	-42.5	175.5	-164.9	75.3	0	0	0	111.7	L1272 I1311 V1319 H1320 L1325 I1326 E1327	L1272-N1323 HydrophobicContact CD2-CB 4.44Å; I1311-N1323 HydrophobicContact CD1-CB 4.36Å; V1319-N1323 VanDerWaalsContact O-CB 3.27Å; V1319-N1323 WeakPolarHBondContact O-CB 3.48Å; V1319-N1323 PolarHBondContact O-N 3.29Å; H1320-N1323 PolarHBondContact O-N 3.05Å; N1323-L1325 VanDerWaalsContact C-N 3.33Å; N1323-L1325 PolarHBondContact O-N 2.8Å; N1323-I1326 CarbonylContact O-C 3.55Å; N1323-I1326 WeakPolarHBondContact O-CA 3.49Å; N1323-I1326 WeakPolarHBondContact O-CB 3.35Å; N1323-I1326 PolarHBondContact O-N 2.69Å; N1323-E1327 PolarHBondContact ND2-OE1 3.37Å; N1323-E1327 PolarHBondContact ND2-OE2 3.24Å; N1323-E1327 PolarHBondContact O-N 2.91Å
1324	K	82.8	Confident	75.6	Confident	70 Å²	70	59 Å²	59	30%	0.304	30%	0.297	S	S	.	.	H	α-helix	trans	-60.8	-41.6	176.2	-168.9	175.3	-177.2	-175	0	111.7	H1320 L1321 I1326 E1327 E1328 L1341	H1320-K1324 VanDerWaalsContact O-CB 3.3Å; H1320-K1324 WeakPolarHBondContact O-CB 3.35Å; H1320-K1324 PolarHBondContact O-N 2.75Å; L1321-K1324 PolarHBondContact O-N 2.95Å; K1324-I1326 VanDerWaalsContact C-N 3.28Å; K1324-I1326 PolarHBondContact O-N 2.85Å; K1324-E1327 PolarHBondContact O-N 2.71Å; K1324-E1328 HydrophobicContact CG-CG 4.46Å; K1324-E1328 WeakPolarHBondContact O-CG 3.23Å; K1324-E1328 PolarHBondContact O-N 3.07Å; K1324-L1341 HydrophobicContact CD-CD1 4.13Å; K1324-L1341 HydrophobicContact CD-CG 4.38Å
1325	L	79	Confident	75.1	Confident	13 Å²	13	58.9 Å²	58.9	7%	0.068	30%	0.298	C	S	.	.	H	α-helix	trans	-59.7	-35.5	172.1	-76.1	166.4	0	0	0	112.9	R1280 L1321 L1322 N1323 L1341 I1498	R1280-L1325 PolarHBondContact NE-O 3.11Å; R1280-L1325 PolarHBondContact NH2-O 2.78Å; L1321-L1325 HydrophobicContact CG-CD1 4.47Å; L1321-L1325 WeakPolarHBondContact O-CG 3.41Å; L1321-L1325 PolarHBondContact O-N 3.15Å; L1322-L1325 PolarHBondContact O-N 3.19Å; N1323-L1325 VanDerWaalsContact C-N 3.33Å; N1323-L1325 PolarHBondContact O-N 2.8Å; L1325-L1341 HydrophobicContact CD2-CD2 3.63Å; L1325-L1341 HydrophobicContact CG-CD2 3.72Å; L1325-I1498 HydrophobicContact CD1-CD1 3.69Å
1326	I	81.1	Confident	74.4	Confident	19 Å²	19	60.1 Å²	60.1	10%	0.097	31%	0.306	C	S	.	.	H	α-helix	trans	-74	-31.3	176.3	-68.6	162.4	0	0	0	112.1	L1272 R1275 C1276 R1280 L1322 N1323 K1324	L1272-I1326 HydrophobicContact CD1-CD1 3.63Å; L1272-I1326 HydrophobicContact CG-CD1 4.2Å; R1275-I1326 HydrophobicContact CB-CD1 4.22Å; R1275-I1326 HydrophobicContact CG-CD1 4.01Å; C1276-I1326 HydrophobicContact CB-CD1 4.01Å; C1276-I1326 HydrophobicContact CB-CG1 3.98Å; R1280-I1326 PolarHBondContact NH2-O 2.85Å; L1322-I1326 WeakPolarHBondContact O-CD1 3.3Å; L1322-I1326 WeakPolarHBondContact O-CG1 3.36Å; L1322-I1326 PolarHBondContact O-N 3.22Å; L1322-I1326 VanDerWaalsContact O-N 3.16Å; N1323-I1326 CarbonylContact O-C 3.55Å; N1323-I1326 WeakPolarHBondContact O-CA 3.49Å; N1323-I1326 WeakPolarHBondContact O-CB 3.35Å; N1323-I1326 PolarHBondContact O-N 2.69Å; K1324-I1326 VanDerWaalsContact C-N 3.28Å; K1324-I1326 PolarHBondContact O-N 2.85Å
1327	E	80.8	Confident	73.5	Confident	134 Å²	134	60.8 Å²	60.8	63%	0.626	31%	0.312	S	S	*	.	H	α-helix	trans	-89.8	-26	-175.9	-72.6	178.3	176.9	0	0	115	N1323 K1324	N1323-E1327 PolarHBondContact ND2-OE1 3.37Å; N1323-E1327 PolarHBondContact ND2-OE2 3.24Å; N1323-E1327 PolarHBondContact O-N 2.91Å; K1324-E1327 PolarHBondContact O-N 2.71Å
1328	E	69.7	Low	72.7	Confident	59 Å²	59	61.9 Å²	61.9	28%	0.276	32%	0.317	S	S	.	.	S	Bend	trans	-53.9	135.4	177.4	-81.6	-72.4	161.9	0	0	112.9	R1280 K1324	R1280-E1328 PolarHBondContact NH2-O 3Å; K1324-E1328 HydrophobicContact CG-CG 4.46Å; K1324-E1328 WeakPolarHBondContact O-CG 3.23Å; K1324-E1328 PolarHBondContact O-N 3.07Å
1329	P	60.4	Low	71.9	Confident	56 Å²	56	65.6 Å²	65.6	36%	0.364	34%	0.343	S	S	.	.			trans	-64.4	138.9	175.6	-22	33.2	0	0	0	112.8	H1331 L1332	P1329-H1331 WeakPolarHBondContact CB-NE2 3.36Å; P1329-H1331 PolarHBondContact O-N 2.9Å; P1329-L1332 HydrophobicContact CB-CD1 4.44Å; P1329-L1332 HydrophobicContact CG-CD1 4.07Å; P1329-L1332 PolarHBondContact O-N 2.81Å
1330	E	60.3	Low	71.4	Confident	155 Å²	155	71.5 Å²	71.5	72%	0.724	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-54.8	-27.5	-176.6	-68.4	-174.4	138.6	0	0	114.6	L1332 A1333	E1330-L1332 VanDerWaalsContact C-N 3.32Å; E1330-A1333 WeakPolarHBondContact O-CB 3.37Å
1331	H	55.2	Low	70.9	Confident	172 Å²	172	69 Å²	69	80%	0.796	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-81.3	-4.2	-180	33.4	-84.6	0	0	0	114.3	P1329	P1329-H1331 WeakPolarHBondContact CB-NE2 3.36Å; P1329-H1331 PolarHBondContact O-N 2.9Å
1332	L	49.6	Very low	70.5	Confident	86 Å²	86	69.7 Å²	69.7	45%	0.45	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-95.8	6.1	174.1	-88.2	161.5	0	0	0	113.9	P1329 E1330 S1334 A1337	P1329-L1332 HydrophobicContact CB-CD1 4.44Å; P1329-L1332 HydrophobicContact CG-CD1 4.07Å; P1329-L1332 PolarHBondContact O-N 2.81Å; E1330-L1332 VanDerWaalsContact C-N 3.32Å; L1332-S1334 PolarHBondContact O-N 2.96Å; L1332-S1334 PolarHBondContact O-OG 3.33Å; L1332-A1337 VanDerWaalsContact O-CB 3.3Å; L1332-A1337 WeakPolarHBondContact O-CB 3.44Å
1333	A	54.5	Low	70.1	Confident	65 Å²	65	75.8 Å²	75.8	54%	0.537	39%	0.391	S	S	.	.			trans	-68.7	50.9	178.9	0	0	0	0	0	114.8	L1283 E1330	L1283-A1333 HydrophobicContact CD1-CB 4.28Å; E1330-A1333 WeakPolarHBondContact O-CB 3.37Å
1334	S	61.1	Low	70	Confident	54 Å²	54	77.9 Å²	77.9	38%	0.378	40%	0.398	S	S	.	.	S	Bend	trans	-86.9	157.7	170.8	65.6	0	0	0	0	111.2	L1332 Q1336 A1337 L1338	L1332-S1334 PolarHBondContact O-N 2.96Å; L1332-S1334 PolarHBondContact O-OG 3.33Å; S1334-Q1336 PolarHBondContact O-N 3.01Å; S1334-A1337 PolarHBondContact O-N 3.46Å; S1334-A1337 PolarHBondContact OG-N 3.32Å; S1334-L1338 PolarHBondContact O-N 3.18Å
1335	E	65.8	Low	69.9	Low	158 Å²	158	74.7 Å²	74.7	74%	0.738	39%	0.385	S	S	*	.	H	α-helix	trans	-59.4	-26.6	169.7	-68.5	-164	111.7	0	0	112.5	L1338 S1339	E1335-L1338 PolarHBondContact O-N 3.07Å; E1335-S1339 VanDerWaalsContact O-CB 3.32Å; E1335-S1339 WeakPolarHBondContact O-CB 3.44Å; E1335-S1339 PolarHBondContact O-N 3.07Å
1336	Q	68.2	Low	69.7	Low	142 Å²	142	77.2 Å²	77.2	66%	0.664	40%	0.397	S	S	*	.	H	α-helix	trans	-67.9	-44.5	179.6	-168.2	169.3	-6.5	0	0	111.8	S1334 S1339 E1340	S1334-Q1336 PolarHBondContact O-N 3.01Å; Q1336-S1339 WeakPolarHBondContact O-CB 3.37Å; Q1336-S1339 PolarHBondContact O-N 3.44Å; Q1336-E1340 PolarHBondContact O-N 2.9Å
1337	A	67.6	Low	69.4	Low	23 Å²	23	81.6 Å²	81.6	19%	0.19	42%	0.417	C	S	.	.	H	α-helix	trans	-65.3	-38.4	174.1	0	0	0	0	0	112.2	L1332 S1334 S1339 E1340 L1341	L1332-A1337 VanDerWaalsContact O-CB 3.3Å; L1332-A1337 WeakPolarHBondContact O-CB 3.44Å; S1334-A1337 PolarHBondContact O-N 3.46Å; S1334-A1337 PolarHBondContact OG-N 3.32Å; A1337-S1339 VanDerWaalsContact C-N 3.33Å; A1337-E1340 PolarHBondContact O-N 3.36Å; A1337-L1341 WeakPolarHBondContact O-CD1 3.46Å; A1337-L1341 PolarHBondContact O-N 2.73Å
1338	L	69.6	Low	69.4	Low	26 Å²	26	77.5 Å²	77.5	14%	0.136	40%	0.398	C	S	.	.	H	α-helix	trans	-64.4	-36	171.9	-82.1	172.3	0	0	0	112.4	L1283 S1334 E1335 S1342	L1283-L1338 HydrophobicContact CD1-CD1 4.17Å; L1283-L1338 HydrophobicContact CD2-CD2 4.35Å; S1334-L1338 PolarHBondContact O-N 3.18Å; E1335-L1338 PolarHBondContact O-N 3.07Å; L1338-S1342 WeakPolarHBondContact O-CB 3.49Å; L1338-S1342 PolarHBondContact O-N 3.36Å
1339	S	73	Confident	69.8	Low	78 Å²	78	74.9 Å²	74.9	55%	0.545	39%	0.387	S	S	.	.	H	α-helix	trans	-66.6	-42.4	175.4	-169.7	0	0	0	0	111.7	E1335 Q1336 A1337 S1342 K1343	E1335-S1339 VanDerWaalsContact O-CB 3.32Å; E1335-S1339 WeakPolarHBondContact O-CB 3.44Å; E1335-S1339 PolarHBondContact O-N 3.07Å; Q1336-S1339 WeakPolarHBondContact O-CB 3.37Å; Q1336-S1339 PolarHBondContact O-N 3.44Å; A1337-S1339 VanDerWaalsContact C-N 3.33Å; S1339-S1342 WeakPolarHBondContact O-CB 3.31Å; S1339-S1342 PolarHBondContact O-N 3.49Å; S1339-K1343 WeakPolarHBondContact O-CB 3.27Å; S1339-K1343 PolarHBondContact O-N 3.04Å
1340	E	76.9	Confident	70.6	Confident	124 Å²	124	73.8 Å²	73.8	58%	0.579	38%	0.378	S	S	*	.	H	α-helix	trans	-65.9	-41.3	174.9	-72.4	-178.6	-166.5	0	0	112.6	Q1336 A1337 W1344	Q1336-E1340 PolarHBondContact O-N 2.9Å; A1337-E1340 PolarHBondContact O-N 3.36Å; E1340-W1344 WeakPolarHBondContact O-CB 3.46Å; E1340-W1344 PolarHBondContact O-N 3.02Å
1341	L	76.3	Confident	71.4	Confident	8 Å²	8	68.9 Å²	68.9	4%	0.042	36%	0.36	C	S	.	.	H	α-helix	trans	-65.2	-38.7	171.5	-99.1	80.9	0	0	0	112.4	L1321 K1324 L1325 A1337 W1344 F1345	L1321-L1341 HydrophobicContact CD1-CB 4.47Å; L1321-L1341 HydrophobicContact CD1-CD2 3.97Å; L1321-L1341 HydrophobicContact CD1-CG 4.31Å; K1324-L1341 HydrophobicContact CD-CD1 4.13Å; K1324-L1341 HydrophobicContact CD-CG 4.38Å; L1325-L1341 HydrophobicContact CD2-CD2 3.63Å; L1325-L1341 HydrophobicContact CG-CD2 3.72Å; A1337-L1341 WeakPolarHBondContact O-CD1 3.46Å; A1337-L1341 PolarHBondContact O-N 2.73Å; L1341-W1344 PolarHBondContact O-N 2.81Å; L1341-F1345 WeakPolarHBondContact O-CB 3.19Å; L1341-F1345 PolarHBondContact O-N 3.16Å
1342	S	76.7	Confident	73	Confident	14 Å²	14	60.7 Å²	60.7	10%	0.098	32%	0.323	C	S	.	.	H	α-helix	trans	-62.3	-47.7	176.8	-165.1	0	0	0	0	111	L1338 S1339 F1345 I1346 I1498	L1338-S1342 WeakPolarHBondContact O-CB 3.49Å; L1338-S1342 PolarHBondContact O-N 3.36Å; S1339-S1342 WeakPolarHBondContact O-CB 3.31Å; S1339-S1342 PolarHBondContact O-N 3.49Å; S1342-F1345 PolarHBondContact O-N 3.15Å; S1342-I1346 VanDerWaalsContact O-CG1 3.31Å; S1342-I1346 WeakPolarHBondContact O-CG1 3.15Å; S1342-I1346 PolarHBondContact O-N 2.96Å; S1342-I1498 VanDerWaalsContact CB-O 3.25Å; S1342-I1498 WeakPolarHBondContact CB-O 3.46Å; S1342-I1498 PolarHBondContact OG-O 2.99Å
1343	K	78.2	Confident	74.8	Confident	127 Å²	127	57.5 Å²	57.5	55%	0.552	31%	0.306	S	S	*	.	H	α-helix	trans	-62.7	-46.3	176	-174.4	173.6	-177.1	-77.5	0	112.1	S1339 F1345 I1346 E1347	S1339-K1343 WeakPolarHBondContact O-CB 3.27Å; S1339-K1343 PolarHBondContact O-N 3.04Å; K1343-F1345 VanDerWaalsContact C-N 3.29Å; K1343-F1345 PolarHBondContact O-N 3.26Å; K1343-I1346 PolarHBondContact O-N 3.27Å; K1343-E1347 WeakPolarHBondContact CE-OE1 3.5Å; K1343-E1347 IonicContact NZ-OE1 2.75Å; K1343-E1347 PolarHBondContact NZ-OE1 3.32Å; K1343-E1347 WeakPolarHBondContact O-CG 3.34Å; K1343-E1347 PolarHBondContact O-N 3.19Å
1344	W	83.4	Confident	76.4	Confident	53 Å²	53	54.4 Å²	54.4	20%	0.201	28%	0.28	C	S	.	.	H	α-helix	trans	-59.5	-41.5	175.6	-178.2	85.6	0	0	0	111.7	A1317 H1320 L1321 E1340 L1341 E1347 H1348	A1317-W1344 HydrophobicContact CB-CH2 3.93Å; A1317-W1344 HydrophobicContact CB-CZ3 4.4Å; H1320-W1344 HydrophobicContact CB-CH2 3.9Å; H1320-W1344 AromaticContact CD2-CH2 3.47Å; H1320-W1344 VanDerWaalsContact CD2-CH2 3.47Å; H1320-W1344 WeakPolarHBondContact CD2-CH2 3.39Å; H1320-W1344 AromaticContact CD2-CZ2 3.58Å; H1320-W1344 AromaticContact CG-CH2 3.86Å; L1321-W1344 HydrophobicContact CB-CZ3 4.2Å; L1321-W1344 HydrophobicContact CD1-CE3 4.25Å; L1321-W1344 HydrophobicContact CD1-CZ3 4.37Å; E1340-W1344 WeakPolarHBondContact O-CB 3.46Å; E1340-W1344 PolarHBondContact O-N 3.02Å; L1341-W1344 PolarHBondContact O-N 2.81Å; W1344-E1347 PolarHBondContact O-N 3.17Å; W1344-H1348 AromaticContact CD1-CE1 3.54Å; W1344-H1348 AromaticContact CD1-ND1 3.61Å; W1344-H1348 AromaticContact CD2-ND1 3.9Å; W1344-H1348 AromaticContact CE2-CD2 4Å; W1344-H1348 AromaticContact CE2-CE1 3.85Å; W1344-H1348 AromaticContact CE2-CG 3.69Å; W1344-H1348 AromaticContact CE2-ND1 3.57Å; W1344-H1348 AromaticContact CG-ND1 3.93Å; W1344-H1348 HydrophobicContact CH2-CB 4.07Å; W1344-H1348 HydrophobicContact CZ2-CB 4.03Å; W1344-H1348 AromaticContact CZ2-CD2 3.85Å; W1344-H1348 AromaticContact CZ2-CG 3.72Å; W1344-H1348 HydrophobicContact CZ3-CB 4.36Å; W1344-H1348 AromaticContact NE1-CD2 3.99Å; W1344-H1348 AromaticContact NE1-CE1 3.24Å; W1344-H1348 PolarHBondContact NE1-CE1 2.96Å; W1344-H1348 AromaticContact NE1-CG 3.89Å; W1344-H1348 AromaticContact NE1-ND1 3.4Å; W1344-H1348 PolarHBondContact NE1-ND1 3.11Å; W1344-H1348 AromaticContact NE1-NE2 3.6Å; W1344-H1348 WeakPolarHBondContact O-CB 3.19Å; W1344-H1348 PolarHBondContact O-N 3.21Å; W1344-H1348 VanDerWaalsContact O-N 3.12Å; W1344-H1348 PolarHBondContact O-ND1 3.16Å
1345	F	80.1	Confident	77.6	Confident	3 Å²	3	51.9 Å²	51.9	1%	0.013	26%	0.262	C	S	.	.	H	α-helix	trans	-65.2	-42.3	176	-177.6	-120.6	0	0	0	111.9	L1321 L1341 S1342 K1343 E1347 H1348 A1349 W1355 L1495	L1321-F1345 HydrophobicContact CD1-CB 4.23Å; L1321-F1345 HydrophobicContact CD2-CB 4.37Å; L1321-F1345 HydrophobicContact CD2-CD2 3.64Å; L1321-F1345 HydrophobicContact CD2-CE2 4.01Å; L1321-F1345 HydrophobicContact CD2-CG 3.94Å; L1341-F1345 WeakPolarHBondContact O-CB 3.19Å; L1341-F1345 PolarHBondContact O-N 3.16Å; S1342-F1345 PolarHBondContact O-N 3.15Å; K1343-F1345 VanDerWaalsContact C-N 3.29Å; K1343-F1345 PolarHBondContact O-N 3.26Å; F1345-E1347 VanDerWaalsContact C-N 3.26Å; F1345-E1347 PolarHBondContact O-N 3.34Å; F1345-H1348 PolarHBondContact O-N 3.07Å; F1345-H1348 VanDerWaalsContact O-N 3.14Å; F1345-A1349 HydrophobicContact CD1-CB 4.44Å; F1345-A1349 HydrophobicContact CD2-CB 3.82Å; F1345-A1349 HydrophobicContact CE1-CB 4.15Å; F1345-A1349 HydrophobicContact CE2-CB 3.49Å; F1345-A1349 VanDerWaalsContact CE2-CB 3.49Å; F1345-A1349 HydrophobicContact CG-CB 4.29Å; F1345-A1349 HydrophobicContact CZ-CB 3.66Å; F1345-A1349 WeakPolarHBondContact O-CA 3.41Å; F1345-A1349 WeakPolarHBondContact O-CB 3.49Å; F1345-A1349 PolarHBondContact O-N 3.08Å; F1345-W1355 HydrophobicContact CE1-CH2 4.27Å; F1345-W1355 HydrophobicContact CE1-CZ2 4.37Å; F1345-W1355 HydrophobicContact CZ-CD2 4.43Å; F1345-W1355 HydrophobicContact CZ-CE3 4.33Å; F1345-W1355 HydrophobicContact CZ-CH2 4.09Å; F1345-W1355 HydrophobicContact CZ-CZ2 4.2Å; F1345-W1355 HydrophobicContact CZ-CZ3 4.17Å; F1345-L1495 HydrophobicContact CE1-CB 4.26Å; F1345-L1495 HydrophobicContact CE2-CD2 4.12Å; F1345-L1495 HydrophobicContact CZ-CB 4.02Å; F1345-L1495 HydrophobicContact CZ-CD2 3.94Å; F1345-L1495 HydrophobicContact CZ-CG 4.39Å
1346	I	75.1	Confident	78.5	Confident	65 Å²	65	45.5 Å²	45.5	33%	0.333	23%	0.234	S	C	.	.	H	α-helix	trans	-58.8	-39.4	174.2	-68.4	161.4	0	0	0	111.2	S1342 K1343 H1348 T1389	S1342-I1346 VanDerWaalsContact O-CG1 3.31Å; S1342-I1346 WeakPolarHBondContact O-CG1 3.15Å; S1342-I1346 PolarHBondContact O-N 2.96Å; K1343-I1346 PolarHBondContact O-N 3.27Å; I1346-H1348 VanDerWaalsContact C-N 3.34Å; I1346-H1348 PolarHBondContact O-N 2.96Å; I1346-T1389 WeakPolarHBondContact O-CG2 3.3Å
1347	E	75.1	Confident	79.3	Confident	111 Å²	111	38.8 Å²	38.8	52%	0.519	20%	0.202	S	C	.	.	H	α-helix	trans	-71.7	-19.9	177.8	-70.8	168.8	179	0	0	114.4	K1343 W1344 F1345	K1343-E1347 WeakPolarHBondContact CE-OE1 3.5Å; K1343-E1347 IonicContact NZ-OE1 2.75Å; K1343-E1347 PolarHBondContact NZ-OE1 3.32Å; K1343-E1347 WeakPolarHBondContact O-CG 3.34Å; K1343-E1347 PolarHBondContact O-N 3.19Å; W1344-E1347 PolarHBondContact O-N 3.17Å; F1345-E1347 VanDerWaalsContact C-N 3.26Å; F1345-E1347 PolarHBondContact O-N 3.34Å
1348	H	80.9	Confident	79.9	Confident	49 Å²	49	37.8 Å²	37.8	23%	0.227	19%	0.194	C	C	.	.	H	α-helix	trans	-125	-18.9	-170.5	-65.8	75.6	0	0	0	115.3	A1317 W1344 F1345 I1346 D1350 S1351	A1317-H1348 HydrophobicContact CB-CB 4.12Å; W1344-H1348 AromaticContact CD1-CE1 3.54Å; W1344-H1348 AromaticContact CD1-ND1 3.61Å; W1344-H1348 AromaticContact CD2-ND1 3.9Å; W1344-H1348 AromaticContact CE2-CD2 4Å; W1344-H1348 AromaticContact CE2-CE1 3.85Å; W1344-H1348 AromaticContact CE2-CG 3.69Å; W1344-H1348 AromaticContact CE2-ND1 3.57Å; W1344-H1348 AromaticContact CG-ND1 3.93Å; W1344-H1348 HydrophobicContact CH2-CB 4.07Å; W1344-H1348 HydrophobicContact CZ2-CB 4.03Å; W1344-H1348 AromaticContact CZ2-CD2 3.85Å; W1344-H1348 AromaticContact CZ2-CG 3.72Å; W1344-H1348 HydrophobicContact CZ3-CB 4.36Å; W1344-H1348 AromaticContact NE1-CD2 3.99Å; W1344-H1348 AromaticContact NE1-CE1 3.24Å; W1344-H1348 PolarHBondContact NE1-CE1 2.96Å; W1344-H1348 AromaticContact NE1-CG 3.89Å; W1344-H1348 AromaticContact NE1-ND1 3.4Å; W1344-H1348 PolarHBondContact NE1-ND1 3.11Å; W1344-H1348 AromaticContact NE1-NE2 3.6Å; W1344-H1348 WeakPolarHBondContact O-CB 3.19Å; W1344-H1348 PolarHBondContact O-N 3.21Å; W1344-H1348 VanDerWaalsContact O-N 3.12Å; W1344-H1348 PolarHBondContact O-ND1 3.16Å; F1345-H1348 PolarHBondContact O-N 3.07Å; F1345-H1348 VanDerWaalsContact O-N 3.14Å; I1346-H1348 VanDerWaalsContact C-N 3.34Å; I1346-H1348 PolarHBondContact O-N 2.96Å; H1348-D1350 VanDerWaalsContact C-N 3.28Å; H1348-D1350 PolarHBondContact O-N 2.88Å; H1348-S1351 PolarHBondContact O-N 3.02Å; H1348-S1351 PolarHBondContact O-OG 3.06Å
1349	A	77.2	Confident	80.4	Confident	4 Å²	4	36.7 Å²	36.7	3%	0.033	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-57.7	-40.8	-175.9	0	0	0	0	0	111.9	F1345 S1351 D1352 W1355	F1345-A1349 HydrophobicContact CD1-CB 4.44Å; F1345-A1349 HydrophobicContact CD2-CB 3.82Å; F1345-A1349 HydrophobicContact CE1-CB 4.15Å; F1345-A1349 HydrophobicContact CE2-CB 3.49Å; F1345-A1349 VanDerWaalsContact CE2-CB 3.49Å; F1345-A1349 HydrophobicContact CG-CB 4.29Å; F1345-A1349 HydrophobicContact CZ-CB 3.66Å; F1345-A1349 WeakPolarHBondContact O-CA 3.41Å; F1345-A1349 WeakPolarHBondContact O-CB 3.49Å; F1345-A1349 PolarHBondContact O-N 3.08Å; A1349-S1351 PolarHBondContact O-N 3.16Å; A1349-D1352 PolarHBondContact O-N 3.01Å; A1349-W1355 HydrophobicContact CB-CG 4.4Å
1350	D	77	Confident	80.9	Confident	32 Å²	32	33.6 Å²	33.6	17%	0.171	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-72.2	1.7	-178.5	-69.8	-42.3	0	0	0	114.4	H1348 N1356 T1389 A1391 R1455	H1348-D1350 VanDerWaalsContact C-N 3.28Å; H1348-D1350 PolarHBondContact O-N 2.88Å; D1350-N1356 VanDerWaalsContact C-ND2 3.34Å; D1350-N1356 WeakPolarHBondContact CA-ND2 3.42Å; D1350-N1356 PolarHBondContact O-ND2 3.46Å; D1350-N1356 PolarHBondContact OD1-ND2 3.46Å; D1350-T1389 WeakPolarHBondContact OD2-CG2 3.29Å; D1350-T1389 PolarHBondContact OD2-OG1 2.65Å; D1350-A1391 HydrophobicContact CB-CB 4.36Å; D1350-R1455 IonicContact OD1-NH2 2.68Å; D1350-R1455 PolarHBondContact OD1-NH2 2.68Å
1351	S	78.9	Confident	81.2	Confident	52 Å²	52	29 Å²	29	36%	0.364	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-100.1	-10.2	167.2	72.4	0	0	0	0	114.9	K1314 K1315 H1348 A1349	K1314-S1351 PolarHBondContact O-OG 3.38Å; K1315-S1351 VanDerWaalsContact CA-O 3.3Å; K1315-S1351 WeakPolarHBondContact CA-O 3.47Å; H1348-S1351 PolarHBondContact O-N 3.02Å; H1348-S1351 PolarHBondContact O-OG 3.06Å; A1349-S1351 PolarHBondContact O-N 3.16Å
1352	D	88.8	Confident	81.5	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.005	15%	0.152	C	C	.	.			trans	-76.2	133.1	-175.5	-178.5	-74.8	0	0	0	113.1	Y1265 K1315 A1317 I1318 A1349 L1354 W1355 N1356	Y1265-D1352 PolarHBondContact OH-OD2 2.66Å; K1315-D1352 WeakPolarHBondContact O-CA 3.29Å; A1317-D1352 HydrophobicContact CB-CB 4.21Å; A1317-D1352 PolarHBondContact N-OD2 3.37Å; A1317-D1352 VanDerWaalsContact N-OD2 3.08Å; I1318-D1352 WeakPolarHBondContact CB-OD2 3.17Å; I1318-D1352 WeakPolarHBondContact CD1-OD1 3.39Å; I1318-D1352 HydrophobicContact CG1-CB 4.44Å; I1318-D1352 WeakPolarHBondContact CG1-OD2 3.46Å; I1318-D1352 PolarHBondContact N-OD2 3.21Å; A1349-D1352 PolarHBondContact O-N 3.01Å; D1352-L1354 VanDerWaalsContact C-N 3.32Å; D1352-L1354 PolarHBondContact O-N 2.65Å; D1352-L1354 WeakPolarHBondContact OD1-CA 3.23Å; D1352-L1354 WeakPolarHBondContact OD1-CB 3.41Å; D1352-L1354 PolarHBondContact OD1-N 3.09Å; D1352-W1355 HydrophobicContact CB-CB 3.84Å; D1352-W1355 PolarHBondContact O-N 3.05Å; D1352-W1355 PolarHBondContact OD1-N 2.85Å; D1352-N1356 PolarHBondContact O-N 3.46Å
1353	I	87	Confident	82	Confident	18 Å²	18	30.3 Å²	30.3	9%	0.092	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-28.3	-174.4	63.5	176	0	0	0	114.7	Q1261 L1262 Y1265 K1315 C1357	Q1261-I1353 HydrophobicContact CG-CD1 4.46Å; L1262-I1353 HydrophobicContact CD2-CB 3.89Å; L1262-I1353 HydrophobicContact CD2-CD1 3.95Å; L1262-I1353 HydrophobicContact CD2-CG1 3.76Å; L1262-I1353 VanDerWaalsContact CD2-O 3.25Å; L1262-I1353 WeakPolarHBondContact CD2-O 3.32Å; Y1265-I1353 HydrophobicContact CD1-CD1 3.75Å; Y1265-I1353 HydrophobicContact CD1-CG1 3.49Å; Y1265-I1353 VanDerWaalsContact CD1-CG1 3.49Å; Y1265-I1353 HydrophobicContact CE1-CD1 4.35Å; Y1265-I1353 HydrophobicContact CE1-CG1 3.72Å; Y1265-I1353 HydrophobicContact CG-CD1 3.9Å; Y1265-I1353 HydrophobicContact CG-CG1 4.17Å; K1315-I1353 HydrophobicContact CB-CG2 3.73Å; K1315-I1353 HydrophobicContact CD-CG2 4.43Å; K1315-I1353 PolarHBondContact O-N 3.43Å; I1353-C1357 WeakPolarHBondContact O-CA 3.44Å; I1353-C1357 PolarHBondContact O-N 2.92Å
1354	L	88.4	Confident	82.6	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.005	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-40.6	178.9	173.8	58.5	0	0	0	110.9	Y1265 T1266 C1269 I1318 D1352 N1356 C1357 L1491 M1541 M1542	Y1265-L1354 HydrophobicContact CD1-CB 3.8Å; Y1265-L1354 HydrophobicContact CE1-CB 3.75Å; T1266-L1354 HydrophobicContact CG2-CD1 4.36Å; T1266-L1354 HydrophobicContact CG2-CD2 4.13Å; T1266-L1354 WeakPolarHBondContact OG1-CD1 3.44Å; C1269-L1354 HydrophobicContact CB-CD2 4.37Å; I1318-L1354 HydrophobicContact CD1-CB 4.37Å; I1318-L1354 HydrophobicContact CD1-CD2 4.43Å; I1318-L1354 HydrophobicContact CD1-CG 4.48Å; D1352-L1354 VanDerWaalsContact C-N 3.32Å; D1352-L1354 PolarHBondContact O-N 2.65Å; D1352-L1354 WeakPolarHBondContact OD1-CA 3.23Å; D1352-L1354 WeakPolarHBondContact OD1-CB 3.41Å; D1352-L1354 PolarHBondContact OD1-N 3.09Å; L1354-N1356 PolarHBondContact O-N 2.83Å; L1354-C1357 WeakPolarHBondContact O-CB 3.08Å; L1354-C1357 PolarHBondContact O-N 3.02Å; L1354-L1491 HydrophobicContact CD2-CD2 3.79Å; L1354-M1541 HydrophobicContact CD1-CB 3.97Å; L1354-M1541 HydrophobicContact CD1-CG 4.29Å; L1354-M1542 HydrophobicContact CD1-CE 4.35Å; L1354-M1542 HydrophobicContact CG-CE 4.04Å; L1354-M1542 WeakPolarHBondContact O-CE 3.41Å
1355	W	86.4	Confident	82.9	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-38.3	174.7	-170.3	-108.9	0	0	0	112.1	I1318 F1345 A1349 D1352 R1455 F1485 L1495 M1496 M1542 Q1543	I1318-W1355 HydrophobicContact CD1-CB 4.24Å; F1345-W1355 HydrophobicContact CE1-CH2 4.27Å; F1345-W1355 HydrophobicContact CE1-CZ2 4.37Å; F1345-W1355 HydrophobicContact CZ-CD2 4.43Å; F1345-W1355 HydrophobicContact CZ-CE3 4.33Å; F1345-W1355 HydrophobicContact CZ-CH2 4.09Å; F1345-W1355 HydrophobicContact CZ-CZ2 4.2Å; F1345-W1355 HydrophobicContact CZ-CZ3 4.17Å; A1349-W1355 HydrophobicContact CB-CG 4.4Å; D1352-W1355 HydrophobicContact CB-CB 3.84Å; D1352-W1355 PolarHBondContact O-N 3.05Å; D1352-W1355 PolarHBondContact OD1-N 2.85Å; W1355-R1455 VanDerWaalsContact CD1-NH1 3.3Å; W1355-R1455 PolarHBondContact O-NH1 2.62Å; W1355-F1485 HydrophobicContact CE3-CZ 4.35Å; W1355-F1485 AromaticContact CH2-CZ 3.71Å; W1355-F1485 HydrophobicContact CH2-CZ 3.71Å; W1355-F1485 HydrophobicContact CZ2-CZ 4.38Å; W1355-F1485 HydrophobicContact CZ3-CE1 4.12Å; W1355-F1485 AromaticContact CZ3-CZ 3.67Å; W1355-F1485 HydrophobicContact CZ3-CZ 3.67Å; W1355-L1495 HydrophobicContact CE3-CD1 3.77Å; W1355-L1495 HydrophobicContact CH2-CB 4.2Å; W1355-L1495 HydrophobicContact CZ3-CB 3.71Å; W1355-L1495 HydrophobicContact CZ3-CD1 3.64Å; W1355-L1495 HydrophobicContact CZ3-CG 4.31Å; W1355-M1496 HydrophobicContact CH2-SD 4.21Å; W1355-M1542 HydrophobicContact CE3-CE 4.33Å; W1355-Q1543 PolarHBondContact O-NE2 3.26Å
1356	N	84.7	Confident	83.3	Confident	25 Å²	25	21.8 Å²	21.8	13%	0.134	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.7	36.4	-179.2	-77.6	-7.8	0	0	0	112.6	D1350 D1352 L1354 T1359 R1455	D1350-N1356 VanDerWaalsContact C-ND2 3.34Å; D1350-N1356 WeakPolarHBondContact CA-ND2 3.42Å; D1350-N1356 PolarHBondContact O-ND2 3.46Å; D1350-N1356 PolarHBondContact OD1-ND2 3.46Å; D1352-N1356 PolarHBondContact O-N 3.46Å; L1354-N1356 PolarHBondContact O-N 2.83Å; N1356-T1359 WeakPolarHBondContact CA-OG1 3.49Å; N1356-T1359 WeakPolarHBondContact CB-OG1 3.21Å; N1356-T1359 VanDerWaalsContact CG-OG1 3.24Å; N1356-T1359 PolarHBondContact O-OG1 3.19Å; N1356-T1359 PolarHBondContact OD1-OG1 3.21Å; N1356-R1455 PolarHBondContact OD1-NH1 3.11Å; N1356-R1455 PolarHBondContact OD1-NH2 3.2Å
1357	C	83.3	Confident	84	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.007	10%	0.098	C	C	.	.	S	Bend	trans	-60.8	-52.9	173.6	-174.3	0	0	0	0	111.1	I1353 L1354 T1359 M1360 D1539	I1353-C1357 WeakPolarHBondContact O-CA 3.44Å; I1353-C1357 PolarHBondContact O-N 2.92Å; L1354-C1357 WeakPolarHBondContact O-CB 3.08Å; L1354-C1357 PolarHBondContact O-N 3.02Å; C1357-T1359 PolarHBondContact O-N 3.41Å; C1357-M1360 VanDerWaalsContact O-CG 3.3Å; C1357-M1360 WeakPolarHBondContact O-CG 2.97Å; C1357-D1539 HydrophobicContact CB-CB 4.49Å
1358	S	81	Confident	84.7	Confident	1 Å²	1	13.4 Å²	13.4	1%	0.007	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-23.6	-179.4	55.1	0	0	0	0	114.6	M1360 I1363 N1483 Q1543	S1358-M1360 VanDerWaalsContact C-N 3.35Å; S1358-I1363 WeakPolarHBondContact O-CG2 3.25Å; S1358-N1483 PolarHBondContact OG-OD1 3.33Å; S1358-Q1543 WeakPolarHBondContact OG-CB 3.49Å; S1358-Q1543 PolarHBondContact OG-OE1 2.82Å
1359	T	80.7	Confident	85	Confident	3 Å²	3	11.1 Å²	11.1	2%	0.018	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	15.6	-178.4	46.3	0	0	0	0	113.9	N1356 C1357 V1364 F1392 L1395	N1356-T1359 WeakPolarHBondContact CA-OG1 3.49Å; N1356-T1359 WeakPolarHBondContact CB-OG1 3.21Å; N1356-T1359 VanDerWaalsContact CG-OG1 3.24Å; N1356-T1359 PolarHBondContact O-OG1 3.19Å; N1356-T1359 PolarHBondContact OD1-OG1 3.21Å; C1357-T1359 PolarHBondContact O-N 3.41Å; T1359-V1364 WeakPolarHBondContact O-CG2 3.24Å; T1359-F1392 HydrophobicContact CG2-CD2 4.21Å; T1359-F1392 HydrophobicContact CG2-CE2 3.63Å; T1359-F1392 HydrophobicContact CG2-CZ 3.9Å; T1359-L1395 WeakPolarHBondContact O-CD2 3.21Å
1360	M	82.8	Confident	85.5	Confident	14 Å²	14	11 Å²	11	7%	0.069	6%	0.062	C	C	.	.	S	Bend	trans	-72.4	152.6	177	68.9	-177.1	-113.8	0	0	114	M1252 T1255 C1357 S1358 D1362 I1363 V1364	M1252-M1360 HydrophobicContact CE-CE 4.39Å; M1252-M1360 HydrophobicContact CE-SD 3.79Å; M1252-M1360 HydrophobicContact SD-SD 3.96Å; T1255-M1360 HydrophobicContact CG2-CE 3.9Å; C1357-M1360 VanDerWaalsContact O-CG 3.3Å; C1357-M1360 WeakPolarHBondContact O-CG 2.97Å; S1358-M1360 VanDerWaalsContact C-N 3.35Å; M1360-D1362 HydrophobicContact CE-CB 3.78Å; M1360-D1362 PolarHBondContact O-N 3.05Å; M1360-I1363 HydrophobicContact CG-CB 4.46Å; M1360-I1363 HydrophobicContact CG-CD1 3.76Å; M1360-I1363 HydrophobicContact CG-CG1 3.9Å; M1360-I1363 WeakPolarHBondContact O-CB 3.41Å; M1360-I1363 PolarHBondContact O-N 3.2Å; M1360-I1363 HydrophobicContact SD-CD1 4.45Å; M1360-V1364 PolarHBondContact O-N 3.36Å
1361	E	84.1	Confident	86.1	Confident	28 Å²	28	9.6 Å²	9.6	13%	0.131	5%	0.054	C	C	.	.	H	α-helix	trans	-48.4	-49	-177	169.2	164.7	-156.7	0	0	114.9	I1363 V1364 K1365 L1399 K1669	E1361-I1363 PolarHBondContact O-N 3.47Å; E1361-V1364 PolarHBondContact O-N 3.14Å; E1361-K1365 HydrophobicContact CG-CB 4.48Å; E1361-K1365 VanDerWaalsContact O-CB 3.28Å; E1361-K1365 WeakPolarHBondContact O-CB 3.38Å; E1361-K1365 PolarHBondContact O-N 3.14Å; E1361-L1399 HydrophobicContact CB-CD1 4.37Å; E1361-L1399 HydrophobicContact CB-CD2 3.92Å; E1361-L1399 VanDerWaalsContact CD-CD2 3.43Å; E1361-L1399 HydrophobicContact CG-CD2 3.45Å; E1361-L1399 VanDerWaalsContact CG-CD2 3.45Å; E1361-L1399 WeakPolarHBondContact OE1-CD2 3.34Å; E1361-K1669 WeakPolarHBondContact OE2-CE 3.2Å; E1361-K1669 IonicContact OE2-NZ 3.92Å; E1361-K1669 PolarHBondContact OE2-NZ 2.59Å
1362	D	82.1	Confident	86.3	Confident	41 Å²	41	7.4 Å²	7.4	22%	0.219	4%	0.038	C	C	.	.	H	α-helix	trans	-60.7	-14.9	179.7	-62.3	60	0	0	0	113.6	K1242 M1360 P1366 L1666 K1669	K1242-D1362 IonicContact NZ-OD2 3.3Å; K1242-D1362 PolarHBondContact NZ-OD2 3.2Å; M1360-D1362 HydrophobicContact CE-CB 3.78Å; M1360-D1362 PolarHBondContact O-N 3.05Å; D1362-P1366 WeakPolarHBondContact O-CG 3.45Å; D1362-L1666 HydrophobicContact CB-CD1 4.24Å; D1362-K1669 IonicContact OD1-NZ 3.11Å
1363	I	87.2	Confident	86	Confident	7 Å²	7	7.9 Å²	7.9	4%	0.036	4%	0.041	C	C	.	.	H	α-helix	trans	-101.5	-49.5	175.2	-58.7	176	0	0	0	110.5	C1251 M1252 S1358 M1360 E1361 P1366 I1367 Q1537	C1251-I1363 HydrophobicContact CB-CD1 4.5Å; C1251-I1363 WeakPolarHBondContact SG-CD1 3.26Å; M1252-I1363 HydrophobicContact SD-CD1 4.38Å; S1358-I1363 WeakPolarHBondContact O-CG2 3.25Å; M1360-I1363 HydrophobicContact CG-CB 4.46Å; M1360-I1363 HydrophobicContact CG-CD1 3.76Å; M1360-I1363 HydrophobicContact CG-CG1 3.9Å; M1360-I1363 WeakPolarHBondContact O-CB 3.41Å; M1360-I1363 PolarHBondContact O-N 3.2Å; M1360-I1363 HydrophobicContact SD-CD1 4.45Å; E1361-I1363 PolarHBondContact O-N 3.47Å; I1363-P1366 WeakPolarHBondContact O-CD 3.31Å; I1363-I1367 HydrophobicContact CG2-CD1 4.28Å; I1363-I1367 WeakPolarHBondContact O-CD1 3.4Å; I1363-I1367 WeakPolarHBondContact O-CG1 3.46Å; I1363-Q1537 HydrophobicContact CG2-CB 3.77Å; I1363-Q1537 HydrophobicContact CG2-CG 3.91Å
1364	V	90	Very high	85.9	Confident	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-75.1	-41.2	-171.7	175.6	0	0	0	0	112.5	T1359 M1360 E1361 I1367 L1368 F1392 L1399 F1481	T1359-V1364 WeakPolarHBondContact O-CG2 3.24Å; M1360-V1364 PolarHBondContact O-N 3.36Å; E1361-V1364 PolarHBondContact O-N 3.14Å; V1364-I1367 PolarHBondContact O-N 3.29Å; V1364-I1367 VanDerWaalsContact O-N 3.17Å; V1364-L1368 HydrophobicContact CG1-CD1 3.77Å; V1364-L1368 HydrophobicContact CG1-CG 4.18Å; V1364-L1368 WeakPolarHBondContact O-CG 3.38Å; V1364-L1368 PolarHBondContact O-N 3.07Å; V1364-F1392 HydrophobicContact CG1-CE2 4.49Å; V1364-F1392 HydrophobicContact CG1-CZ 4.43Å; V1364-F1392 HydrophobicContact CG2-CE2 4.24Å; V1364-F1392 HydrophobicContact CG2-CZ 4.38Å; V1364-L1399 HydrophobicContact CB-CD1 4.12Å; V1364-L1399 HydrophobicContact CG1-CD1 3.97Å; V1364-F1481 HydrophobicContact CG2-CZ 4.38Å
1365	K	89.2	Confident	85.4	Confident	2 Å²	2	7.4 Å²	7.4	1%	0.009	4%	0.038	C	C	.	.	H	α-helix	trans	-60.5	-47.8	179.9	170.5	59.6	174.8	175.8	0	112.3	E1361 I1367 L1368 D1369 L1399 S1402 L1666	E1361-K1365 HydrophobicContact CG-CB 4.48Å; E1361-K1365 VanDerWaalsContact O-CB 3.28Å; E1361-K1365 WeakPolarHBondContact O-CB 3.38Å; E1361-K1365 PolarHBondContact O-N 3.14Å; K1365-I1367 VanDerWaalsContact C-N 3.25Å; K1365-I1367 PolarHBondContact O-N 3.32Å; K1365-L1368 PolarHBondContact O-N 3.24Å; K1365-D1369 WeakPolarHBondContact CE-OD1 3.37Å; K1365-D1369 VanDerWaalsContact CE-OD2 3.3Å; K1365-D1369 WeakPolarHBondContact CE-OD2 3.14Å; K1365-D1369 IonicContact NZ-OD1 2.65Å; K1365-D1369 PolarHBondContact NZ-OD1 3Å; K1365-D1369 IonicContact NZ-OD2 3.21Å; K1365-D1369 PolarHBondContact NZ-OD2 2.78Å; K1365-D1369 PolarHBondContact O-N 2.77Å; K1365-L1399 HydrophobicContact CB-CB 4.43Å; K1365-L1399 HydrophobicContact CB-CD1 4.28Å; K1365-L1399 HydrophobicContact CB-CD2 4.44Å; K1365-L1399 HydrophobicContact CD-CB 4.33Å; K1365-L1399 WeakPolarHBondContact CD-O 3.48Å; K1365-L1399 WeakPolarHBondContact CE-O 3.44Å; K1365-L1399 PolarHBondContact NZ-O 3.23Å; K1365-S1402 VanDerWaalsContact CE-OG 3.22Å; K1365-S1402 WeakPolarHBondContact CE-OG 3.32Å; K1365-S1402 PolarHBondContact NZ-OG 3.12Å; K1365-L1666 HydrophobicContact CB-CD2 4.21Å; K1365-L1666 HydrophobicContact CG-CD2 4.15Å
1366	P	89.1	Confident	84.4	Confident	2 Å²	2	10.5 Å²	10.5	1%	0.013	6%	0.06	C	C	.	.	H	α-helix	trans	-54.8	-37.1	173.2	-32.3	39.6	0	0	0	114.8	F1244 D1362 I1363 I1370 R1664 L1666	F1244-P1366 HydrophobicContact CB-CB 4.18Å; F1244-P1366 HydrophobicContact CD1-CB 3.81Å; F1244-P1366 HydrophobicContact CD2-CB 3.38Å; F1244-P1366 HydrophobicContact CD2-CG 3.66Å; F1244-P1366 HydrophobicContact CE1-CB 3.94Å; F1244-P1366 HydrophobicContact CE2-CB 3.53Å; F1244-P1366 HydrophobicContact CE2-CG 3.95Å; F1244-P1366 HydrophobicContact CG-CB 3.51Å; F1244-P1366 HydrophobicContact CG-CG 4.15Å; F1244-P1366 HydrophobicContact CZ-CB 3.8Å; D1362-P1366 WeakPolarHBondContact O-CG 3.45Å; I1363-P1366 WeakPolarHBondContact O-CD 3.31Å; P1366-I1370 VanDerWaalsContact O-CG1 3.3Å; P1366-I1370 WeakPolarHBondContact O-CG1 3.2Å; P1366-I1370 PolarHBondContact O-N 2.72Å; P1366-R1664 HydrophobicContact CB-CB 4.3Å; P1366-R1664 HydrophobicContact CB-CG 4.01Å; P1366-R1664 HydrophobicContact CG-CB 4.35Å; P1366-R1664 PolarHBondContact O-NE 2.91Å; P1366-L1666 HydrophobicContact CG-CD2 3.88Å
1367	I	90.3	Very high	83.6	Confident	1 Å²	1	10.1 Å²	10.1	1%	0.005	6%	0.061	C	C	.	.	H	α-helix	trans	-72.1	-43.6	-179.8	-68.1	173.5	0	0	0	111	F1244 I1363 V1364 K1365 D1369 I1370 V1371 F1481 Q1537 V1545 L1547	F1244-I1367 HydrophobicContact CE1-CG1 4.37Å; F1244-I1367 HydrophobicContact CZ-CD1 4.44Å; F1244-I1367 HydrophobicContact CZ-CG1 3.9Å; I1363-I1367 HydrophobicContact CG2-CD1 4.28Å; I1363-I1367 WeakPolarHBondContact O-CD1 3.4Å; I1363-I1367 WeakPolarHBondContact O-CG1 3.46Å; V1364-I1367 PolarHBondContact O-N 3.29Å; V1364-I1367 VanDerWaalsContact O-N 3.17Å; K1365-I1367 VanDerWaalsContact C-N 3.25Å; K1365-I1367 PolarHBondContact O-N 3.32Å; I1367-D1369 VanDerWaalsContact C-N 3.33Å; I1367-D1369 PolarHBondContact O-N 2.73Å; I1367-I1370 WeakPolarHBondContact O-CB 3.4Å; I1367-I1370 PolarHBondContact O-N 2.78Å; I1367-I1370 VanDerWaalsContact O-N 3.12Å; I1367-V1371 PolarHBondContact O-N 2.88Å; I1367-V1371 VanDerWaalsContact O-N 3.14Å; I1367-F1481 HydrophobicContact CD1-CE2 4.44Å; I1367-F1481 HydrophobicContact CG2-CD2 3.76Å; I1367-F1481 HydrophobicContact CG2-CE2 4.01Å; I1367-Q1537 HydrophobicContact CD1-CG 4.15Å; I1367-V1545 HydrophobicContact CD1-CG1 3.56Å; I1367-L1547 HydrophobicContact CG2-CB 4.02Å; I1367-L1547 HydrophobicContact CG2-CD1 4.02Å; I1367-L1547 HydrophobicContact CG2-CD2 4.15Å; I1367-L1547 HydrophobicContact CG2-CG 4.28Å
1368	L	89.5	Confident	83.1	Confident	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-63.9	-38.1	173.5	-64.4	172.3	0	0	0	111.6	V1364 K1365 I1370 V1371 L1372 C1396 L1399 Q1400 L1450	V1364-L1368 HydrophobicContact CG1-CD1 3.77Å; V1364-L1368 HydrophobicContact CG1-CG 4.18Å; V1364-L1368 WeakPolarHBondContact O-CG 3.38Å; V1364-L1368 PolarHBondContact O-N 3.07Å; K1365-L1368 PolarHBondContact O-N 3.24Å; L1368-I1370 VanDerWaalsContact C-N 3.3Å; L1368-I1370 PolarHBondContact O-N 3.05Å; L1368-V1371 PolarHBondContact O-N 3.2Å; L1368-L1372 WeakPolarHBondContact O-CB 3.34Å; L1368-L1372 PolarHBondContact O-N 3.33Å; L1368-C1396 HydrophobicContact CD1-CB 3.83Å; L1368-L1399 HydrophobicContact CD1-CB 4.43Å; L1368-Q1400 HydrophobicContact CB-CG 4.06Å; L1368-Q1400 HydrophobicContact CD1-CG 3.97Å; L1368-Q1400 HydrophobicContact CG-CG 4.49Å; L1368-L1450 HydrophobicContact CD2-CD2 3.65Å
1369	D	86.3	Confident	82.6	Confident	1 Å²	1	12.5 Å²	12.5	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-70.9	-20.6	173.2	-83	18.5	0	0	0	112.8	K1365 I1367 E1373 R1664 R2177	K1365-D1369 WeakPolarHBondContact CE-OD1 3.37Å; K1365-D1369 VanDerWaalsContact CE-OD2 3.3Å; K1365-D1369 WeakPolarHBondContact CE-OD2 3.14Å; K1365-D1369 IonicContact NZ-OD1 2.65Å; K1365-D1369 PolarHBondContact NZ-OD1 3Å; K1365-D1369 IonicContact NZ-OD2 3.21Å; K1365-D1369 PolarHBondContact NZ-OD2 2.78Å; K1365-D1369 PolarHBondContact O-N 2.77Å; I1367-D1369 VanDerWaalsContact C-N 3.33Å; I1367-D1369 PolarHBondContact O-N 2.73Å; D1369-E1373 VanDerWaalsContact O-CB 3.26Å; D1369-E1373 WeakPolarHBondContact O-CB 3.28Å; D1369-E1373 VanDerWaalsContact O-CG 3.25Å; D1369-E1373 WeakPolarHBondContact O-CG 3.38Å; D1369-E1373 PolarHBondContact O-N 3.04Å; D1369-R1664 PolarHBondContact O-NH2 2.91Å; D1369-R1664 VanDerWaalsContact O-NH2 3.11Å; D1369-R2177 IonicContact OD2-CZ 3.24Å; D1369-R2177 IonicContact OD2-NH1 2.73Å; D1369-R2177 PolarHBondContact OD2-NH1 3.05Å; D1369-R2177 IonicContact OD2-NH2 3.41Å
1370	I	89.2	Confident	82.5	Confident	2 Å²	2	12.5 Å²	12.5	1%	0.01	8%	0.077	C	C	.	.	H	α-helix	trans	-71.1	-41.5	166.9	-71.2	162.2	0	0	0	110.6	F1244 Y1246 P1366 I1367 L1368 N1374 I1534 L1547	F1244-I1370 HydrophobicContact CD1-CD1 4.11Å; F1244-I1370 HydrophobicContact CE1-CD1 3.83Å; Y1246-I1370 HydrophobicContact CD1-CD1 3.99Å; Y1246-I1370 HydrophobicContact CE1-CD1 3.85Å; Y1246-I1370 HydrophobicContact CE1-CG1 4.43Å; P1366-I1370 VanDerWaalsContact O-CG1 3.3Å; P1366-I1370 WeakPolarHBondContact O-CG1 3.2Å; P1366-I1370 PolarHBondContact O-N 2.72Å; I1367-I1370 WeakPolarHBondContact O-CB 3.4Å; I1367-I1370 PolarHBondContact O-N 2.78Å; I1367-I1370 VanDerWaalsContact O-N 3.12Å; L1368-I1370 VanDerWaalsContact C-N 3.3Å; L1368-I1370 PolarHBondContact O-N 3.05Å; I1370-N1374 PolarHBondContact O-N 2.94Å; I1370-N1374 PolarHBondContact O-ND2 2.78Å; I1370-I1534 HydrophobicContact CG2-CG2 4.21Å; I1370-L1547 HydrophobicContact CB-CD2 4.15Å; I1370-L1547 HydrophobicContact CG2-CD2 3.65Å
1371	V	89	Confident	82.7	Confident	1 Å²	1	14.4 Å²	14.4	1%	0.006	9%	0.086	C	C	.	.	H	α-helix	trans	-64.2	-54.6	177	175.8	0	0	0	0	110.5	I1367 L1368 E1373 N1374 N1375 L1450 F1479 L1547	I1367-V1371 PolarHBondContact O-N 2.88Å; I1367-V1371 VanDerWaalsContact O-N 3.14Å; L1368-V1371 PolarHBondContact O-N 3.2Å; V1371-E1373 VanDerWaalsContact C-N 3.31Å; V1371-E1373 PolarHBondContact O-N 2.83Å; V1371-N1374 CarbonylContact O-C 3.53Å; V1371-N1374 PolarHBondContact O-N 3.36Å; V1371-N1375 PolarHBondContact O-N 2.98Å; V1371-N1375 PolarHBondContact O-OD1 3.34Å; V1371-L1450 HydrophobicContact CG1-CB 4.24Å; V1371-L1450 HydrophobicContact CG2-CD1 4.1Å; V1371-L1450 HydrophobicContact CG2-CD2 4.4Å; V1371-F1479 HydrophobicContact CB-CD2 4.35Å; V1371-F1479 HydrophobicContact CG1-CB 4.43Å; V1371-F1479 HydrophobicContact CG1-CD2 3.86Å; V1371-F1479 HydrophobicContact CG1-CE2 4.47Å; V1371-F1479 HydrophobicContact CG1-CG 4.33Å; V1371-F1479 HydrophobicContact CG2-CB 3.92Å; V1371-F1479 HydrophobicContact CG2-CD1 4.27Å; V1371-F1479 HydrophobicContact CG2-CD2 4.16Å; V1371-F1479 HydrophobicContact CG2-CG 3.87Å; V1371-L1547 HydrophobicContact CG2-CD1 3.79Å; V1371-L1547 HydrophobicContact CG2-CD2 4.23Å
1372	L	83.9	Confident	83	Confident	6 Å²	6	13.1 Å²	13.1	3%	0.031	8%	0.08	C	C	.	.	H	α-helix	trans	-53.4	-45	178.7	179.1	71.1	0	0	0	112.5	L1368 N1374 N1375 H1403 V1406	L1368-L1372 WeakPolarHBondContact O-CB 3.34Å; L1368-L1372 PolarHBondContact O-N 3.33Å; L1372-N1374 PolarHBondContact O-N 3.14Å; L1372-N1374 VanDerWaalsContact O-N 3.15Å; L1372-N1375 PolarHBondContact O-N 3.15Å; L1372-N1375 VanDerWaalsContact O-N 3.16Å; L1372-H1403 HydrophobicContact CD2-CB 4.37Å; L1372-V1406 HydrophobicContact CD1-CG2 3.53Å; L1372-V1406 HydrophobicContact CD2-CG2 3.6Å; L1372-V1406 HydrophobicContact CG-CG2 4.21Å
1373	E	82	Confident	83.4	Confident	12 Å²	12	11.1 Å²	11.1	6%	0.056	7%	0.069	C	C	.	.	H	α-helix	trans	-67.4	-11.9	179.7	-78.6	179	-156.9	0	0	114.6	D1369 V1371 N1616 H1651 R1664	D1369-E1373 VanDerWaalsContact O-CB 3.26Å; D1369-E1373 WeakPolarHBondContact O-CB 3.28Å; D1369-E1373 VanDerWaalsContact O-CG 3.25Å; D1369-E1373 WeakPolarHBondContact O-CG 3.38Å; D1369-E1373 PolarHBondContact O-N 3.04Å; V1371-E1373 VanDerWaalsContact C-N 3.31Å; V1371-E1373 PolarHBondContact O-N 2.83Å; E1373-N1616 PolarHBondContact O-ND2 3.19Å; E1373-H1651 HydrophobicContact CB-CB 4.45Å; E1373-H1651 VanDerWaalsContact O-CB 3.32Å; E1373-H1651 WeakPolarHBondContact O-CB 3.4Å; E1373-H1651 IonicContact OE2-CD2 3.84Å; E1373-R1664 IonicContact OE1-CZ 3.43Å; E1373-R1664 VanDerWaalsContact OE1-CZ 3.23Å; E1373-R1664 IonicContact OE1-NH1 2.68Å; E1373-R1664 PolarHBondContact OE1-NH1 3.39Å; E1373-R1664 IonicContact OE1-NH2 3.49Å; E1373-R1664 PolarHBondContact OE1-NH2 3.09Å; E1373-R1664 IonicContact OE2-CZ 3.49Å; E1373-R1664 IonicContact OE2-NH1 3.74Å; E1373-R1664 PolarHBondContact OE2-NH1 2.94Å; E1373-R1664 IonicContact OE2-NH2 2.77Å; E1373-R1664 PolarHBondContact OE2-NH2 3.45Å
1374	N	84.8	Confident	83.6	Confident	6 Å²	6	11.1 Å²	11.1	3%	0.032	7%	0.069	C	C	.	.	H	α-helix	trans	-109.5	2.2	175.5	-68	-70.5	0	0	0	113.4	I1370 V1371 L1372 R1475 F1479 N1616 L1650 H1651	I1370-N1374 PolarHBondContact O-N 2.94Å; I1370-N1374 PolarHBondContact O-ND2 2.78Å; V1371-N1374 CarbonylContact O-C 3.53Å; V1371-N1374 PolarHBondContact O-N 3.36Å; L1372-N1374 PolarHBondContact O-N 3.14Å; L1372-N1374 VanDerWaalsContact O-N 3.15Å; N1374-R1475 PolarHBondContact O-NH2 3.21Å; N1374-F1479 HydrophobicContact CB-CE2 3.84Å; N1374-F1479 HydrophobicContact CB-CZ 3.7Å; N1374-N1616 VanDerWaalsContact C-ND2 3.35Å; N1374-N1616 WeakPolarHBondContact CA-ND2 3.37Å; N1374-L1650 WeakPolarHBondContact OD1-CA 3.21Å; N1374-H1651 PolarHBondContact OD1-N 3.34Å
1375	N	77.5	Confident	83.7	Confident	3 Å²	3	11.1 Å²	11.1	2%	0.016	7%	0.069	C	C	.	.	S	Bend	trans	-89.2	160.5	171.8	-66	-16.2	0	0	0	111.3	V1371 L1372 D1380 R1475 N1616	V1371-N1375 PolarHBondContact O-N 2.98Å; V1371-N1375 PolarHBondContact O-OD1 3.34Å; L1372-N1375 PolarHBondContact O-N 3.15Å; L1372-N1375 VanDerWaalsContact O-N 3.16Å; N1375-D1380 PolarHBondContact ND2-OD1 2.83Å; N1375-R1475 PolarHBondContact OD1-NH2 3.33Å; N1375-N1616 WeakPolarHBondContact O-CB 3.19Å; N1375-N1616 PolarHBondContact O-ND2 2.96Å
1376	S	66.6	Low	83.6	Confident	65 Å²	65	12.8 Å²	12.8	46%	0.455	8%	0.077	S	C	.	.	S	Bend	trans	-96.4	108.9	177.4	52.1	0	0	0	0	110.8
1377	G	66.8	Low	83.4	Confident	16 Å²	16	13.3 Å²	13.3	17%	0.165	8%	0.08	C	C	.	.	S	Bend	trans	94.1	-163.5	-174.7	0	0	0	0	0	113
1378	H	72.7	Confident	82.7	Confident	10 Å²	10	16.4 Å²	16.4	5%	0.046	9%	0.092	C	C	.	.	S	Bend	trans	-114	19.1	-175.4	-61.4	-80.6	0	0	0	113.7	H1403 L1405 V1406 K1407 E1611	H1378-H1403 AromaticContact CE1-CE1 3.83Å; H1378-H1403 AromaticContact ND1-CE1 3.48Å; H1378-H1403 PolarHBondContact ND1-CE1 3.34Å; H1378-L1405 HydrophobicContact CB-CB 4.12Å; H1378-L1405 VanDerWaalsContact CB-O 3.28Å; H1378-L1405 WeakPolarHBondContact CB-O 3.47Å; H1378-V1406 HydrophobicContact CB-CG2 4.5Å; H1378-V1406 WeakPolarHBondContact O-CA 3.48Å; H1378-K1407 PolarHBondContact O-N 2.81Å; H1378-E1611 IonicContact CD2-OE2 2.83Å; H1378-E1611 IonicContact CE1-OE1 3.23Å; H1378-E1611 PolarHBondContact CE1-OE1 3.07Å; H1378-E1611 IonicContact CE1-OE2 2.82Å; H1378-E1611 VanDerWaalsContact NE2-CD 3.31Å; H1378-E1611 IonicContact NE2-OE1 3.18Å; H1378-E1611 PolarHBondContact NE2-OE1 3.03Å; H1378-E1611 IonicContact NE2-OE2 2.74Å; H1378-E1611 PolarHBondContact NE2-OE2 2.85Å
1379	S	71.7	Confident	82.2	Confident	43 Å²	43	17.7 Å²	17.7	30%	0.301	10%	0.1	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	106.3	-177.9	58.1	0	0	0	0	111.4	K1407	S1379-K1407 WeakPolarHBondContact CA-O 3.37Å
1380	D	78.7	Confident	82	Confident	2 Å²	2	18.1 Å²	18.1	1%	0.011	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	126.5	176.4	-78.9	-3.5	0	0	0	111	N1375 I1382 Q1400 K1407 V1408 A1409	N1375-D1380 PolarHBondContact ND2-OD1 2.83Å; D1380-I1382 HydrophobicContact CB-CD1 4.26Å; D1380-I1382 HydrophobicContact CB-CG1 4.12Å; D1380-Q1400 PolarHBondContact OD2-NE2 2.96Å; D1380-K1407 PolarHBondContact N-O 2.81Å; D1380-K1407 VanDerWaalsContact N-O 3.09Å; D1380-V1408 HydrophobicContact CB-CG1 3.97Å; D1380-V1408 HydrophobicContact CB-CG2 4.46Å; D1380-V1408 CarbonylContact O-C 3.55Å; D1380-V1408 WeakPolarHBondContact O-CA 3.48Å; D1380-V1408 WeakPolarHBondContact O-CG1 3.42Å; D1380-A1409 PolarHBondContact O-N 3.12Å
1381	H	85.7	Confident	81.5	Confident	55 Å²	55	20 Å²	20	26%	0.255	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	112.4	166.4	-71.7	89.8	0	0	0	110.6	D1449 L1450 K2347	H1381-D1449 PolarHBondContact N-OD2 2.87Å; H1381-D1449 IonicContact ND1-OD2 3.71Å; H1381-D1449 PolarHBondContact O-N 2.88Å; H1381-L1450 PolarHBondContact O-N 3.4Å; H1381-K2347 PolarHBondContact NE2-NZ 2.9Å; H1381-K2347 VanDerWaalsContact NE2-NZ 3.16Å
1382	I	90.3	Very high	81.3	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	130.1	-173.3	-52.8	-172.4	0	0	0	110.8	D1380 V1408 A1409 W1410 T1411 L1450 I1452	D1380-I1382 HydrophobicContact CB-CD1 4.26Å; D1380-I1382 HydrophobicContact CB-CG1 4.12Å; I1382-V1408 HydrophobicContact CB-CG1 4.46Å; I1382-V1408 HydrophobicContact CD1-CG1 3.5Å; I1382-V1408 VanDerWaalsContact CD1-CG1 3.5Å; I1382-V1408 HydrophobicContact CG1-CG1 3.76Å; I1382-A1409 PolarHBondContact N-O 2.82Å; I1382-W1410 HydrophobicContact CB-CD2 4.29Å; I1382-W1410 HydrophobicContact CB-CE3 4.44Å; I1382-W1410 HydrophobicContact CB-CZ2 4.49Å; I1382-W1410 HydrophobicContact CD1-CZ2 3.91Å; I1382-W1410 HydrophobicContact CG2-CD2 4.35Å; I1382-W1410 HydrophobicContact CG2-CE3 4.08Å; I1382-W1410 HydrophobicContact CG2-CH2 3.82Å; I1382-W1410 HydrophobicContact CG2-CZ2 4.09Å; I1382-W1410 HydrophobicContact CG2-CZ3 3.82Å; I1382-W1410 CarbonylContact O-C 3.44Å; I1382-T1411 PolarHBondContact O-N 3.07Å; I1382-L1450 WeakPolarHBondContact CA-O 3.41Å; I1382-L1450 HydrophobicContact CD1-CD2 4.27Å; I1382-L1450 HydrophobicContact CG1-CB 4.18Å; I1382-L1450 HydrophobicContact CG2-CB 4.22Å; I1382-L1450 HydrophobicContact CG2-CD2 4.25Å; I1382-L1450 HydrophobicContact CG2-CG 4.32Å; I1382-I1452 HydrophobicContact CG2-CD1 3.73Å; I1382-I1452 HydrophobicContact CG2-CG1 4.11Å
1383	V	91.3	Very high	81.3	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	132.2	171.5	59.4	0	0	0	0	111.6	F1385 T1411 Y1430 H1448 L1450 A1451 I1452	V1383-F1385 HydrophobicContact CB-CE2 4.33Å; V1383-F1385 HydrophobicContact CG1-CD2 4.25Å; V1383-F1385 HydrophobicContact CG1-CE2 3.54Å; V1383-F1385 HydrophobicContact CG1-CZ 4.08Å; V1383-F1385 HydrophobicContact CG2-CD2 4.13Å; V1383-F1385 HydrophobicContact CG2-CE1 4.26Å; V1383-F1385 HydrophobicContact CG2-CE2 3.81Å; V1383-F1385 HydrophobicContact CG2-CG 4.48Å; V1383-F1385 HydrophobicContact CG2-CZ 3.88Å; V1383-T1411 CarbonylContact C-O 3.58Å; V1383-T1411 VanDerWaalsContact CA-O 3.29Å; V1383-T1411 WeakPolarHBondContact CA-O 3.49Å; V1383-Y1430 HydrophobicContact CG2-CE1 4.13Å; V1383-H1448 HydrophobicContact CG1-CB 4.05Å; V1383-L1450 PolarHBondContact N-O 2.55Å; V1383-A1451 HydrophobicContact CG1-CB 3.9Å; V1383-A1451 CarbonylContact O-C 3.59Å; V1383-A1451 VanDerWaalsContact O-CA 3.28Å; V1383-A1451 WeakPolarHBondContact O-CA 3.14Å; V1383-I1452 PolarHBondContact O-N 3.1Å
1384	M	92	Very high	81.2	Confident	6 Å²	6	23.2 Å²	23.2	3%	0.03	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123	168	-173.9	173	179	0	0	109.7	P1387 F1392 A1393 W1410 T1411 L1412 G1413 I1452 D1454	M1384-P1387 HydrophobicContact CE-CB 4.03Å; M1384-P1387 HydrophobicContact CG-CB 4.27Å; M1384-P1387 HydrophobicContact SD-CB 4.07Å; M1384-F1392 HydrophobicContact CE-CB 4.49Å; M1384-F1392 HydrophobicContact CE-CD1 4.04Å; M1384-F1392 HydrophobicContact SD-CD1 4.37Å; M1384-A1393 HydrophobicContact SD-CB 4.31Å; M1384-W1410 HydrophobicContact CB-CZ3 4.47Å; M1384-T1411 PolarHBondContact N-O 3.36Å; M1384-L1412 HydrophobicContact CB-CD2 3.95Å; M1384-G1413 PolarHBondContact O-N 2.73Å; M1384-I1452 HydrophobicContact CB-CB 4.2Å; M1384-I1452 HydrophobicContact CG-CB 4.11Å; M1384-I1452 HydrophobicContact CG-CG2 4.09Å; M1384-I1452 HydrophobicContact SD-CG2 4.41Å; M1384-D1454 HydrophobicContact CE-CB 3.87Å
1385	F	90.6	Very high	81.2	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	138.3	-179.5	-70.8	-83.6	0	0	0	111.6	V1383 G1413 Y1430 M1434 A1451 I1452 L1453 T1470 F1473	V1383-F1385 HydrophobicContact CB-CE2 4.33Å; V1383-F1385 HydrophobicContact CG1-CD2 4.25Å; V1383-F1385 HydrophobicContact CG1-CE2 3.54Å; V1383-F1385 HydrophobicContact CG1-CZ 4.08Å; V1383-F1385 HydrophobicContact CG2-CD2 4.13Å; V1383-F1385 HydrophobicContact CG2-CE1 4.26Å; V1383-F1385 HydrophobicContact CG2-CE2 3.81Å; V1383-F1385 HydrophobicContact CG2-CG 4.48Å; V1383-F1385 HydrophobicContact CG2-CZ 3.88Å; F1385-G1413 CarbonylContact C-O 3.54Å; F1385-G1413 WeakPolarHBondContact CA-O 3.19Å; F1385-Y1430 VanDerWaalsContact CE1-OH 3.28Å; F1385-Y1430 WeakPolarHBondContact CE1-OH 3.44Å; F1385-Y1430 WeakPolarHBondContact CZ-OH 3.37Å; F1385-M1434 HydrophobicContact CD1-CE 4.4Å; F1385-M1434 HydrophobicContact CD1-CG 4.05Å; F1385-M1434 HydrophobicContact CD1-SD 4.34Å; F1385-M1434 HydrophobicContact CE1-CE 3.96Å; F1385-M1434 HydrophobicContact CE1-CG 4.2Å; F1385-M1434 HydrophobicContact CE1-SD 3.89Å; F1385-M1434 HydrophobicContact CZ-CE 4.23Å; F1385-A1451 HydrophobicContact CD2-CB 4.37Å; F1385-A1451 HydrophobicContact CE2-CB 4.08Å; F1385-I1452 PolarHBondContact N-O 3.42Å; F1385-I1452 VanDerWaalsContact N-O 3.09Å; F1385-L1453 HydrophobicContact CB-CD2 3.79Å; F1385-L1453 HydrophobicContact CD2-CD2 4.46Å; F1385-T1470 HydrophobicContact CD2-CG2 4.28Å; F1385-T1470 HydrophobicContact CE2-CG2 4.01Å; F1385-F1473 HydrophobicContact CE1-CD2 4.47Å; F1385-F1473 HydrophobicContact CE1-CE2 4.44Å; F1385-F1473 HydrophobicContact CE1-CZ 4.47Å; F1385-F1473 HydrophobicContact CZ-CB 4.2Å; F1385-F1473 HydrophobicContact CZ-CD1 4.11Å; F1385-F1473 AromaticContact CZ-CD2 3.89Å; F1385-F1473 HydrophobicContact CZ-CD2 3.89Å; F1385-F1473 HydrophobicContact CZ-CE1 4.47Å; F1385-F1473 HydrophobicContact CZ-CE2 4.3Å; F1385-F1473 AromaticContact CZ-CG 3.8Å; F1385-F1473 HydrophobicContact CZ-CG 3.8Å
1386	E	88.1	Confident	81.6	Confident	37 Å²	37	25.8 Å²	25.8	17%	0.173	15%	0.147	C	C	.	.	S	Bend	trans	49.4	45	179.6	-67.4	175.9	-139.2	0	0	115.9	G1413 V1456 K1460 Y1466	E1386-G1413 PolarHBondContact N-O 3.22Å; E1386-V1456 HydrophobicContact CB-CG1 4.26Å; E1386-V1456 HydrophobicContact CB-CG2 4.21Å; E1386-K1460 VanDerWaalsContact CD-NZ 3.31Å; E1386-K1460 VanDerWaalsContact OE1-CE 3.31Å; E1386-K1460 WeakPolarHBondContact OE1-CE 3.33Å; E1386-K1460 IonicContact OE1-NZ 2.82Å; E1386-K1460 PolarHBondContact OE1-NZ 3.33Å; E1386-K1460 VanDerWaalsContact OE2-CE 3.3Å; E1386-K1460 WeakPolarHBondContact OE2-CE 3.44Å; E1386-K1460 IonicContact OE2-NZ 3.21Å; E1386-K1460 PolarHBondContact OE2-NZ 2.7Å; E1386-K1460 VanDerWaalsContact OE2-NZ 3.14Å; E1386-Y1466 WeakPolarHBondContact OE1-CE2 3.5Å; E1386-Y1466 PolarHBondContact OE1-OH 2.88Å
1387	P	84.8	Confident	82.3	Confident	14 Å²	14	23.5 Å²	23.5	9%	0.091	13%	0.131	C	C	.	.			trans	-61.1	138.7	175.8	26.6	-34.4	0	0	0	112.2	M1384 L1412 V1417 L1420	M1384-P1387 HydrophobicContact CE-CB 4.03Å; M1384-P1387 HydrophobicContact CG-CB 4.27Å; M1384-P1387 HydrophobicContact SD-CB 4.07Å; P1387-L1412 HydrophobicContact CG-CB 4.23Å; P1387-L1412 HydrophobicContact CG-CD2 4.34Å; P1387-V1417 HydrophobicContact CG-CG1 4.26Å; P1387-L1420 HydrophobicContact CB-CD1 4.46Å; P1387-L1420 HydrophobicContact CG-CD1 3.96Å
1388	R	76.4	Confident	82.8	Confident	65 Å²	65	27.3 Å²	27.3	25%	0.245	15%	0.147	C	C	.	.	S	Bend	trans	-84.8	-32.2	171	-74.7	-179.3	-72.5	-160.1	-4.2	112.8	D1454	R1388-D1454 IonicContact NH2-OD2 3.61Å
1389	T	78.5	Confident	83.3	Confident	28 Å²	28	27.2 Å²	27.2	17%	0.172	15%	0.147	C	C	.	.			trans	-143.6	165	-179	68.6	0	0	0	0	108.5	I1346 D1350	I1346-T1389 WeakPolarHBondContact O-CG2 3.3Å; D1350-T1389 WeakPolarHBondContact OD2-CG2 3.29Å; D1350-T1389 PolarHBondContact OD2-OG1 2.65Å
1390	T	80.7	Confident	83.5	Confident	9 Å²	9	25.3 Å²	25.3	6%	0.055	13%	0.134	C	C	.	.	S	Bend	trans	-81.8	-15.5	171.2	49.4	0	0	0	0	113.1	F1392 A1393 E1394 L1412 A1423 F1427	T1390-F1392 VanDerWaalsContact C-N 3.32Å; T1390-F1392 PolarHBondContact O-N 2.67Å; T1390-F1392 VanDerWaalsContact O-N 3.14Å; T1390-A1393 WeakPolarHBondContact O-CA 3.22Å; T1390-A1393 WeakPolarHBondContact O-CB 3.13Å; T1390-A1393 PolarHBondContact O-N 2.78Å; T1390-E1394 WeakPolarHBondContact CB-OE1 3.37Å; T1390-E1394 PolarHBondContact O-N 2.89Å; T1390-E1394 PolarHBondContact OG1-OE1 3.4Å; T1390-L1412 HydrophobicContact CG2-CD1 4.32Å; T1390-A1423 HydrophobicContact CG2-CB 4.29Å; T1390-F1427 HydrophobicContact CG2-CD2 4.21Å; T1390-F1427 HydrophobicContact CG2-CE2 4.01Å
1391	A	79.6	Confident	83	Confident	43 Å²	43	27.2 Å²	27.2	36%	0.355	15%	0.145	S	C	.	.	H	α-helix	trans	-56.5	-36.8	-167.7	0	0	0	0	0	114.8	D1350 L1395	D1350-A1391 HydrophobicContact CB-CB 4.36Å; A1391-L1395 WeakPolarHBondContact O-CB 3.1Å; A1391-L1395 PolarHBondContact O-N 2.87Å
1392	F	84.3	Confident	82.5	Confident	9 Å²	9	24.8 Å²	24.8	4%	0.039	13%	0.134	C	C	.	.	H	α-helix	trans	-75.7	-34.6	176.6	-172.3	-120.3	0	0	0	112.9	T1359 V1364 M1384 T1390 L1395 C1396 I1452 F1481	T1359-F1392 HydrophobicContact CG2-CD2 4.21Å; T1359-F1392 HydrophobicContact CG2-CE2 3.63Å; T1359-F1392 HydrophobicContact CG2-CZ 3.9Å; V1364-F1392 HydrophobicContact CG1-CE2 4.49Å; V1364-F1392 HydrophobicContact CG1-CZ 4.43Å; V1364-F1392 HydrophobicContact CG2-CE2 4.24Å; V1364-F1392 HydrophobicContact CG2-CZ 4.38Å; M1384-F1392 HydrophobicContact CE-CB 4.49Å; M1384-F1392 HydrophobicContact CE-CD1 4.04Å; M1384-F1392 HydrophobicContact SD-CD1 4.37Å; T1390-F1392 VanDerWaalsContact C-N 3.32Å; T1390-F1392 PolarHBondContact O-N 2.67Å; T1390-F1392 VanDerWaalsContact O-N 3.14Å; F1392-L1395 HydrophobicContact CD2-CD2 4.17Å; F1392-L1395 HydrophobicContact CE2-CD2 4.35Å; F1392-L1395 PolarHBondContact O-N 3.36Å; F1392-C1396 VanDerWaalsContact CZ-SG 3.54Å; F1392-C1396 WeakPolarHBondContact O-CB 3.44Å; F1392-C1396 PolarHBondContact O-N 3.31Å; F1392-C1396 PolarHBondContact O-SG 3.03Å; F1392-I1452 HydrophobicContact CD1-CG2 4.38Å; F1392-I1452 HydrophobicContact CE1-CG2 3.94Å; F1392-F1481 AromaticContact CE1-CE1 3.97Å; F1392-F1481 HydrophobicContact CE1-CE1 3.97Å; F1392-F1481 HydrophobicContact CE1-CZ 4.39Å; F1392-F1481 AromaticContact CZ-CE1 3.89Å; F1392-F1481 HydrophobicContact CZ-CE1 3.89Å; F1392-F1481 AromaticContact CZ-CZ 3.86Å; F1392-F1481 HydrophobicContact CZ-CZ 3.86Å
1393	A	84.3	Confident	81.9	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-67.1	-41.1	172.8	0	0	0	0	0	111.1	M1384 T1390 C1396 S1397 W1410 L1412 F1427	M1384-A1393 HydrophobicContact SD-CB 4.31Å; T1390-A1393 WeakPolarHBondContact O-CA 3.22Å; T1390-A1393 WeakPolarHBondContact O-CB 3.13Å; T1390-A1393 PolarHBondContact O-N 2.78Å; A1393-C1396 PolarHBondContact O-N 2.85Å; A1393-S1397 WeakPolarHBondContact O-CB 3.46Å; A1393-S1397 PolarHBondContact O-N 2.76Å; A1393-W1410 HydrophobicContact CB-CE3 3.75Å; A1393-W1410 HydrophobicContact CB-CH2 4.36Å; A1393-W1410 HydrophobicContact CB-CZ3 3.61Å; A1393-L1412 HydrophobicContact CB-CD2 4.24Å; A1393-F1427 HydrophobicContact CB-CE1 4.11Å; A1393-F1427 HydrophobicContact CB-CZ 4.06Å
1394	E	81	Confident	81.1	Confident	76 Å²	76	25.4 Å²	25.4	36%	0.355	14%	0.138	S	C	.	.	H	α-helix	trans	-61.7	-42.1	172.6	-71.8	170.6	-134.8	0	0	112.4	T1390 N1398 F1427	T1390-E1394 WeakPolarHBondContact CB-OE1 3.37Å; T1390-E1394 PolarHBondContact O-N 2.89Å; T1390-E1394 PolarHBondContact OG1-OE1 3.4Å; E1394-N1398 WeakPolarHBondContact O-CB 3.33Å; E1394-N1398 PolarHBondContact O-N 3.06Å; E1394-N1398 PolarHBondContact O-ND2 2.81Å; E1394-F1427 HydrophobicContact CG-CE2 4.19Å; E1394-F1427 HydrophobicContact CG-CZ 3.91Å
1395	L	84.1	Confident	80.2	Confident	63 Å²	63	26.3 Å²	26.3	33%	0.33	14%	0.143	S	C	.	.	H	α-helix	trans	-59.2	-57.3	173.7	177.2	62	0	0	0	110.5	T1359 A1391 F1392 S1397 N1398 L1399	T1359-L1395 WeakPolarHBondContact O-CD2 3.21Å; A1391-L1395 WeakPolarHBondContact O-CB 3.1Å; A1391-L1395 PolarHBondContact O-N 2.87Å; F1392-L1395 HydrophobicContact CD2-CD2 4.17Å; F1392-L1395 HydrophobicContact CE2-CD2 4.35Å; F1392-L1395 PolarHBondContact O-N 3.36Å; L1395-S1397 VanDerWaalsContact C-N 3.31Å; L1395-S1397 PolarHBondContact O-N 3.05Å; L1395-N1398 PolarHBondContact O-N 2.69Å; L1395-N1398 VanDerWaalsContact O-N 3.14Å; L1395-L1399 HydrophobicContact CD1-CD1 4.14Å; L1395-L1399 HydrophobicContact CD1-CD2 4.5Å; L1395-L1399 HydrophobicContact CD1-CG 4.16Å; L1395-L1399 HydrophobicContact CG-CD1 4.07Å; L1395-L1399 HydrophobicContact CG-CG 4.43Å; L1395-L1399 VanDerWaalsContact O-CG 3.29Å; L1395-L1399 WeakPolarHBondContact O-CG 3.41Å; L1395-L1399 PolarHBondContact O-N 2.63Å
1396	C	85.4	Confident	79.5	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.007	14%	0.144	C	C	.	.	H	α-helix	trans	-58.2	-42.2	-178.6	-69.8	0	0	0	0	112.4	L1368 F1392 A1393 L1399 Q1400 W1410	L1368-C1396 HydrophobicContact CD1-CB 3.83Å; F1392-C1396 VanDerWaalsContact CZ-SG 3.54Å; F1392-C1396 WeakPolarHBondContact O-CB 3.44Å; F1392-C1396 PolarHBondContact O-N 3.31Å; F1392-C1396 PolarHBondContact O-SG 3.03Å; A1393-C1396 PolarHBondContact O-N 2.85Å; C1396-L1399 PolarHBondContact O-N 2.73Å; C1396-Q1400 PolarHBondContact O-N 3Å; C1396-W1410 HydrophobicContact CB-CH2 3.4Å; C1396-W1410 HydrophobicContact CB-CZ2 3.41Å; C1396-W1410 VanDerWaalsContact CB-CZ2 3.41Å
1397	S	80.8	Confident	78.6	Confident	17 Å²	17	26.9 Å²	26.9	12%	0.119	15%	0.145	C	C	.	.	H	α-helix	trans	-56.5	-54.3	172.7	-171	0	0	0	0	111.3	A1393 L1395 L1399 Q1400 V1401	A1393-S1397 WeakPolarHBondContact O-CB 3.46Å; A1393-S1397 PolarHBondContact O-N 2.76Å; L1395-S1397 VanDerWaalsContact C-N 3.31Å; L1395-S1397 PolarHBondContact O-N 3.05Å; S1397-L1399 PolarHBondContact O-N 3.34Å; S1397-Q1400 PolarHBondContact O-N 3.45Å; S1397-Q1400 VanDerWaalsContact O-N 3.09Å; S1397-V1401 WeakPolarHBondContact O-CG2 3.24Å; S1397-V1401 PolarHBondContact O-N 2.93Å
1398	N	77.8	Confident	78.2	Confident	95 Å²	95	27.9 Å²	27.9	51%	0.508	15%	0.151	S	C	.	.	H	α-helix	trans	-59.3	-30.7	177.6	-83.7	-71.7	0	0	0	113.9	E1394 L1395	E1394-N1398 WeakPolarHBondContact O-CB 3.33Å; E1394-N1398 PolarHBondContact O-N 3.06Å; E1394-N1398 PolarHBondContact O-ND2 2.81Å; L1395-N1398 PolarHBondContact O-N 2.69Å; L1395-N1398 VanDerWaalsContact O-N 3.14Å
1399	L	82.4	Confident	78.3	Confident	9 Å²	9	26.4 Å²	26.4	5%	0.047	15%	0.152	C	C	.	.	H	α-helix	trans	-72.8	-37	175.7	-68	-179.5	0	0	0	112.3	E1361 V1364 K1365 L1368 L1395 C1396 S1397 S1402	E1361-L1399 HydrophobicContact CB-CD1 4.37Å; E1361-L1399 HydrophobicContact CB-CD2 3.92Å; E1361-L1399 VanDerWaalsContact CD-CD2 3.43Å; E1361-L1399 HydrophobicContact CG-CD2 3.45Å; E1361-L1399 VanDerWaalsContact CG-CD2 3.45Å; E1361-L1399 WeakPolarHBondContact OE1-CD2 3.34Å; V1364-L1399 HydrophobicContact CB-CD1 4.12Å; V1364-L1399 HydrophobicContact CG1-CD1 3.97Å; K1365-L1399 HydrophobicContact CB-CB 4.43Å; K1365-L1399 HydrophobicContact CB-CD1 4.28Å; K1365-L1399 HydrophobicContact CB-CD2 4.44Å; K1365-L1399 HydrophobicContact CD-CB 4.33Å; K1365-L1399 WeakPolarHBondContact CD-O 3.48Å; K1365-L1399 WeakPolarHBondContact CE-O 3.44Å; K1365-L1399 PolarHBondContact NZ-O 3.23Å; L1368-L1399 HydrophobicContact CD1-CB 4.43Å; L1395-L1399 HydrophobicContact CD1-CD1 4.14Å; L1395-L1399 HydrophobicContact CD1-CD2 4.5Å; L1395-L1399 HydrophobicContact CD1-CG 4.16Å; L1395-L1399 HydrophobicContact CG-CD1 4.07Å; L1395-L1399 HydrophobicContact CG-CG 4.43Å; L1395-L1399 VanDerWaalsContact O-CG 3.29Å; L1395-L1399 WeakPolarHBondContact O-CG 3.41Å; L1395-L1399 PolarHBondContact O-N 2.63Å; C1396-L1399 PolarHBondContact O-N 2.73Å; S1397-L1399 PolarHBondContact O-N 3.34Å; L1399-S1402 PolarHBondContact O-OG 3.25Å
1400	Q	77.2	Confident	78.7	Confident	3 Å²	3	25.5 Å²	25.5	1%	0.014	15%	0.146	C	C	.	.	H	α-helix	trans	-72.8	-42.2	179.7	-73.3	176.6	-71.4	0	0	112.9	L1368 D1380 C1396 S1397 S1402 H1403 V1406 V1408	L1368-Q1400 HydrophobicContact CB-CG 4.06Å; L1368-Q1400 HydrophobicContact CD1-CG 3.97Å; L1368-Q1400 HydrophobicContact CG-CG 4.49Å; D1380-Q1400 PolarHBondContact OD2-NE2 2.96Å; C1396-Q1400 PolarHBondContact O-N 3Å; S1397-Q1400 PolarHBondContact O-N 3.45Å; S1397-Q1400 VanDerWaalsContact O-N 3.09Å; Q1400-S1402 PolarHBondContact O-N 2.91Å; Q1400-H1403 PolarHBondContact O-N 3.37Å; Q1400-V1406 HydrophobicContact CB-CG1 4.36Å; Q1400-V1408 HydrophobicContact CB-CG2 3.81Å; Q1400-V1408 HydrophobicContact CG-CG2 4.48Å
1401	V	68.4	Low	79	Confident	41 Å²	41	25.7 Å²	25.7	25%	0.248	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	10.1	179.8	-118.5	0	0	0	0	115.3	S1397 R2262	S1397-V1401 WeakPolarHBondContact O-CG2 3.24Å; S1397-V1401 PolarHBondContact O-N 2.93Å; V1401-R2262 VanDerWaalsContact CG1-NH1 3.31Å; V1401-R2262 WeakPolarHBondContact O-CD 3.45Å; V1401-R2262 PolarHBondContact O-NH1 3.02Å
1402	S	74	Confident	79.4	Confident	4 Å²	4	23.7 Å²	23.7	3%	0.028	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-29.7	160.6	56.5	0	0	0	0	112.6	K1365 L1399 Q1400 F2260	K1365-S1402 VanDerWaalsContact CE-OG 3.22Å; K1365-S1402 WeakPolarHBondContact CE-OG 3.32Å; K1365-S1402 PolarHBondContact NZ-OG 3.12Å; L1399-S1402 PolarHBondContact O-OG 3.25Å; Q1400-S1402 PolarHBondContact O-N 2.91Å; S1402-F2260 WeakPolarHBondContact O-CZ 3.2Å
1403	H	78.4	Confident	79.5	Confident	5 Å²	5	23.3 Å²	23.3	2%	0.023	13%	0.129	C	C	.	.	S	Bend	trans	-71.6	130.7	174.6	-170.1	-83.3	0	0	0	110.2	L1372 H1378 Q1400 L1405 V1406 R2177	L1372-H1403 HydrophobicContact CD2-CB 4.37Å; H1378-H1403 AromaticContact CE1-CE1 3.83Å; H1378-H1403 AromaticContact ND1-CE1 3.48Å; H1378-H1403 PolarHBondContact ND1-CE1 3.34Å; Q1400-H1403 PolarHBondContact O-N 3.37Å; H1403-L1405 VanDerWaalsContact C-N 3.33Å; H1403-L1405 PolarHBondContact ND1-N 2.71Å; H1403-L1405 PolarHBondContact O-N 3Å; H1403-V1406 HydrophobicContact CB-CB 4.01Å; H1403-V1406 HydrophobicContact CB-CG2 3.77Å; H1403-V1406 WeakPolarHBondContact ND1-CG2 3.19Å; H1403-V1406 PolarHBondContact O-N 2.97Å; H1403-R2177 VanDerWaalsContact CD2-CD 3.42Å; H1403-R2177 WeakPolarHBondContact CD2-CD 3.24Å; H1403-R2177 WeakPolarHBondContact NE2-CD 3.31Å
1404	P	74.9	Confident	79.5	Confident	9 Å²	9	23.3 Å²	23.3	6%	0.058	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-21.6	-166.6	26.5	-34.6	0	0	0	115.6	T2234 F2260 R2262	P1404-T2234 HydrophobicContact CB-CG2 3.78Å; P1404-T2234 HydrophobicContact CG-CG2 4.25Å; P1404-F2260 HydrophobicContact CB-CD2 4.29Å; P1404-F2260 HydrophobicContact CB-CE2 3.96Å; P1404-F2260 HydrophobicContact CG-CE2 4.25Å; P1404-R2262 HydrophobicContact CB-CG 4.19Å
1405	L	73.3	Confident	79.5	Confident	25 Å²	25	22 Å²	22	13%	0.131	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-6.4	-178.3	-65.9	167	0	0	0	114	H1378 H1403 Q2314	H1378-L1405 HydrophobicContact CB-CB 4.12Å; H1378-L1405 VanDerWaalsContact CB-O 3.28Å; H1378-L1405 WeakPolarHBondContact CB-O 3.47Å; H1403-L1405 VanDerWaalsContact C-N 3.33Å; H1403-L1405 PolarHBondContact ND1-N 2.71Å; H1403-L1405 PolarHBondContact O-N 3Å; L1405-Q2314 HydrophobicContact CD2-CG 4.11Å
1406	V	74.8	Confident	79.1	Confident	3 Å²	3	24 Å²	24	2%	0.018	14%	0.138	C	C	.	.			trans	-81.6	134.7	-166.2	156.8	0	0	0	0	114.2	L1372 H1378 Q1400 H1403 V1408	L1372-V1406 HydrophobicContact CD1-CG2 3.53Å; L1372-V1406 HydrophobicContact CD2-CG2 3.6Å; L1372-V1406 HydrophobicContact CG-CG2 4.21Å; H1378-V1406 HydrophobicContact CB-CG2 4.5Å; H1378-V1406 WeakPolarHBondContact O-CA 3.48Å; Q1400-V1406 HydrophobicContact CB-CG1 4.36Å; H1403-V1406 HydrophobicContact CB-CB 4.01Å; H1403-V1406 HydrophobicContact CB-CG2 3.77Å; H1403-V1406 WeakPolarHBondContact ND1-CG2 3.19Å; H1403-V1406 PolarHBondContact O-N 2.97Å; V1406-V1408 HydrophobicContact CG1-CG2 3.49Å; V1406-V1408 VanDerWaalsContact CG1-CG2 3.49Å
1407	K	69.8	Low	78.8	Confident	46 Å²	46	24 Å²	24	20%	0.2	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	146.3	158.2	-73.4	168.9	176.7	162.7	0	109	H1378 S1379 D1380 T2265 E2317 R2318 D2321	H1378-K1407 PolarHBondContact O-N 2.81Å; S1379-K1407 WeakPolarHBondContact CA-O 3.37Å; D1380-K1407 PolarHBondContact N-O 2.81Å; D1380-K1407 VanDerWaalsContact N-O 3.09Å; K1407-T2265 HydrophobicContact CG-CG2 4.16Å; K1407-E2317 PolarHBondContact NZ-O 3.38Å; K1407-R2318 VanDerWaalsContact CE-O 3.27Å; K1407-R2318 WeakPolarHBondContact CE-O 3.44Å; K1407-R2318 PolarHBondContact NZ-O 2.68Å; K1407-D2321 WeakPolarHBondContact CD-OD1 3.45Å; K1407-D2321 WeakPolarHBondContact CE-OD1 3.47Å; K1407-D2321 IonicContact NZ-OD1 3.83Å; K1407-D2321 PolarHBondContact NZ-OD1 2.98Å
1408	V	75.6	Confident	78.4	Confident	35 Å²	35	28.1 Å²	28.1	21%	0.212	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	120.3	177.2	-165.6	0	0	0	0	109.8	D1380 I1382 Q1400 V1406 W1410	D1380-V1408 HydrophobicContact CB-CG1 3.97Å; D1380-V1408 HydrophobicContact CB-CG2 4.46Å; D1380-V1408 CarbonylContact O-C 3.55Å; D1380-V1408 WeakPolarHBondContact O-CA 3.48Å; D1380-V1408 WeakPolarHBondContact O-CG1 3.42Å; I1382-V1408 HydrophobicContact CB-CG1 4.46Å; I1382-V1408 HydrophobicContact CD1-CG1 3.5Å; I1382-V1408 VanDerWaalsContact CD1-CG1 3.5Å; I1382-V1408 HydrophobicContact CG1-CG1 3.76Å; Q1400-V1408 HydrophobicContact CB-CG2 3.81Å; Q1400-V1408 HydrophobicContact CG-CG2 4.48Å; V1406-V1408 HydrophobicContact CG1-CG2 3.49Å; V1406-V1408 VanDerWaalsContact CG1-CG2 3.49Å; V1408-W1410 HydrophobicContact CG1-CG 4.35Å
1409	A	79.5	Confident	78.1	Confident	34 Å²	34	30.1 Å²	30.1	28%	0.281	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	104.1	172	0	0	0	0	0	108.7	D1380 I1382	D1380-A1409 PolarHBondContact O-N 3.12Å; I1382-A1409 PolarHBondContact N-O 2.82Å
1410	W	86.2	Confident	77.6	Confident	9 Å²	9	31.1 Å²	31.1	3%	0.034	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	136	179.2	-83.1	80.9	0	0	0	112.3	I1382 M1384 A1393 C1396 V1408 F1427 N1428 I1452	I1382-W1410 HydrophobicContact CB-CD2 4.29Å; I1382-W1410 HydrophobicContact CB-CE3 4.44Å; I1382-W1410 HydrophobicContact CB-CZ2 4.49Å; I1382-W1410 HydrophobicContact CD1-CZ2 3.91Å; I1382-W1410 HydrophobicContact CG2-CD2 4.35Å; I1382-W1410 HydrophobicContact CG2-CE3 4.08Å; I1382-W1410 HydrophobicContact CG2-CH2 3.82Å; I1382-W1410 HydrophobicContact CG2-CZ2 4.09Å; I1382-W1410 HydrophobicContact CG2-CZ3 3.82Å; I1382-W1410 CarbonylContact O-C 3.44Å; M1384-W1410 HydrophobicContact CB-CZ3 4.47Å; A1393-W1410 HydrophobicContact CB-CE3 3.75Å; A1393-W1410 HydrophobicContact CB-CH2 4.36Å; A1393-W1410 HydrophobicContact CB-CZ3 3.61Å; C1396-W1410 HydrophobicContact CB-CH2 3.4Å; C1396-W1410 HydrophobicContact CB-CZ2 3.41Å; C1396-W1410 VanDerWaalsContact CB-CZ2 3.41Å; V1408-W1410 HydrophobicContact CG1-CG 4.35Å; W1410-F1427 HydrophobicContact CB-CD1 3.54Å; W1410-F1427 HydrophobicContact CB-CE1 3.89Å; W1410-F1427 HydrophobicContact CD2-CE1 4.4Å; W1410-F1427 HydrophobicContact CG-CD1 4.26Å; W1410-F1427 HydrophobicContact CG-CE1 4.11Å; W1410-N1428 PolarHBondContact O-N 2.96Å; W1410-N1428 PolarHBondContact O-ND2 2.71Å; W1410-I1452 HydrophobicContact CH2-CD1 3.53Å; W1410-I1452 HydrophobicContact CZ3-CD1 3.88Å
1411	T	87.3	Confident	76.7	Confident	13 Å²	13	40.4 Å²	40.4	8%	0.08	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	137.1	178.7	-48.3	0	0	0	0	110.3	I1382 V1383 M1384 N1428 Y1430 H1448	I1382-T1411 PolarHBondContact O-N 3.07Å; V1383-T1411 CarbonylContact C-O 3.58Å; V1383-T1411 VanDerWaalsContact CA-O 3.29Å; V1383-T1411 WeakPolarHBondContact CA-O 3.49Å; M1384-T1411 PolarHBondContact N-O 3.36Å; T1411-N1428 CarbonylContact C-O 3.56Å; T1411-N1428 VanDerWaalsContact CA-O 3.29Å; T1411-N1428 WeakPolarHBondContact CA-O 3.38Å; T1411-N1428 HydrophobicContact CG2-CB 4.02Å; T1411-Y1430 HydrophobicContact CG2-CD1 3.41Å; T1411-Y1430 VanDerWaalsContact CG2-CD1 3.41Å; T1411-Y1430 HydrophobicContact CG2-CE1 3.44Å; T1411-Y1430 VanDerWaalsContact CG2-CE1 3.44Å; T1411-H1448 PolarHBondContact OG1-NE2 2.69Å
1412	L	88.4	Confident	76	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	121.4	173.7	-51.6	180	0	0	0	109.3	M1384 P1387 T1390 A1393 V1417 L1420 A1423 F1427 N1428 L1429 Y1430	M1384-L1412 HydrophobicContact CB-CD2 3.95Å; P1387-L1412 HydrophobicContact CG-CB 4.23Å; P1387-L1412 HydrophobicContact CG-CD2 4.34Å; T1390-L1412 HydrophobicContact CG2-CD1 4.32Å; A1393-L1412 HydrophobicContact CB-CD2 4.24Å; L1412-V1417 HydrophobicContact CB-CG1 4.25Å; L1412-L1420 HydrophobicContact CD1-CD1 4.24Å; L1412-A1423 HydrophobicContact CD1-CB 4.4Å; L1412-F1427 HydrophobicContact CD1-CB 4.05Å; L1412-F1427 HydrophobicContact CD1-CD2 4.15Å; L1412-F1427 HydrophobicContact CD1-CG 4.1Å; L1412-F1427 HydrophobicContact CG-CB 4.09Å; L1412-F1427 HydrophobicContact CG-CG 4.32Å; L1412-N1428 PolarHBondContact N-O 2.94Å; L1412-L1429 HydrophobicContact CB-CD2 3.82Å; L1412-L1429 HydrophobicContact CD1-CD2 3.98Å; L1412-L1429 HydrophobicContact CG-CD2 4.19Å; L1412-Y1430 PolarHBondContact O-N 3Å; L1412-Y1430 VanDerWaalsContact O-N 3.09Å
1413	G	85.5	Confident	75	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	138.2	-176.2	0	0	0	0	0	112.9	M1384 F1385 E1386 Y1430	M1384-G1413 PolarHBondContact O-N 2.73Å; F1385-G1413 CarbonylContact C-O 3.54Å; F1385-G1413 WeakPolarHBondContact CA-O 3.19Å; E1386-G1413 PolarHBondContact N-O 3.22Å; G1413-Y1430 WeakPolarHBondContact CA-O 3.35Å
1414	G	84.8	Confident	73.7	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.272	C	S	.	.	S	Bend	trans	146.5	178.3	169.7	0	0	0	0	0	115	N1416 Y1430 T1431 T1432	G1414-N1416 VanDerWaalsContact C-N 3.33Å; G1414-N1416 PolarHBondContact O-N 3.22Å; G1414-Y1430 PolarHBondContact N-O 3.14Å; G1414-T1431 WeakPolarHBondContact O-CA 3.48Å; G1414-T1432 CarbonylContact C-O 3.46Å; G1414-T1432 VanDerWaalsContact CA-O 3.27Å; G1414-T1432 WeakPolarHBondContact CA-O 3.5Å
1415	P	80.3	Confident	72.9	Confident	50 Å²	50	60.6 Å²	60.6	33%	0.325	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-23	-172.7	26.9	-35.1	0	0	0	114.3	T1432	P1415-T1432 WeakPolarHBondContact CD-O 3.26Å
1416	N	76.1	Confident	72.4	Confident	104 Å²	104	64.2 Å²	64.2	56%	0.556	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	0.8	-173	-66.4	-37	0	0	0	114.6	G1414 T1418 Q1419	G1414-N1416 VanDerWaalsContact C-N 3.33Å; G1414-N1416 PolarHBondContact O-N 3.22Å; N1416-T1418 PolarHBondContact O-N 2.96Å; N1416-T1418 VanDerWaalsContact O-N 3.13Å; N1416-Q1419 WeakPolarHBondContact O-CB 3.34Å; N1416-Q1419 PolarHBondContact O-N 3.29Å; N1416-Q1419 PolarHBondContact OD1-NE2 2.87Å
1417	V	78.3	Confident	72.6	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.012	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-62.5	-26.6	-170.7	-60	0	0	0	0	113.5	P1387 L1412 Q1419 L1420	P1387-V1417 HydrophobicContact CG-CG1 4.26Å; L1412-V1417 HydrophobicContact CB-CG1 4.25Å; V1417-Q1419 PolarHBondContact O-N 3.42Å; V1417-Q1419 VanDerWaalsContact O-N 3.12Å; V1417-L1420 WeakPolarHBondContact O-CB 3.34Å; V1417-L1420 PolarHBondContact O-N 2.97Å
1418	T	73.3	Confident	73	Confident	102 Å²	102	67.5 Å²	67.5	63%	0.626	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-66.3	-6	174.2	52.6	0	0	0	0	114.6	N1416	N1416-T1418 PolarHBondContact O-N 2.96Å; N1416-T1418 VanDerWaalsContact O-N 3.13Å
1419	Q	71.4	Confident	73.4	Confident	138 Å²	138	68.9 Å²	68.9	65%	0.645	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-98.2	-8.2	177.2	-54.8	179.7	31.1	0	0	112.6	N1416 V1417 K1421	N1416-Q1419 WeakPolarHBondContact O-CB 3.34Å; N1416-Q1419 PolarHBondContact O-N 3.29Å; N1416-Q1419 PolarHBondContact OD1-NE2 2.87Å; V1417-Q1419 PolarHBondContact O-N 3.42Å; V1417-Q1419 VanDerWaalsContact O-N 3.12Å; Q1419-K1421 PolarHBondContact O-N 3.45Å
1420	L	73	Confident	73.5	Confident	30 Å²	30	68.2 Å²	68.2	16%	0.157	34%	0.34	C	S	.	.			trans	-80.9	82.7	-179.1	-63.3	174	0	0	0	111.1	P1387 L1412 V1417 E1422 A1423	P1387-L1420 HydrophobicContact CB-CD1 4.46Å; P1387-L1420 HydrophobicContact CG-CD1 3.96Å; L1412-L1420 HydrophobicContact CD1-CD1 4.24Å; V1417-L1420 WeakPolarHBondContact O-CB 3.34Å; V1417-L1420 PolarHBondContact O-N 2.97Å; L1420-E1422 PolarHBondContact O-N 3.2Å; L1420-A1423 HydrophobicContact CB-CB 4.43Å; L1420-A1423 PolarHBondContact O-N 3.09Å; L1420-A1423 VanDerWaalsContact O-N 3.15Å
1421	K	56.6	Low	73.2	Confident	198 Å²	198	72 Å²	72	86%	0.861	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-12.5	-173.1	-71.2	-169.7	173.4	-171.8	0	117.7	Q1419	Q1419-K1421 PolarHBondContact O-N 3.45Å
1422	E	54.2	Low	72.8	Confident	166 Å²	166	72.9 Å²	72.9	78%	0.776	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-4.1	-173.7	-63.9	177.5	140.7	0	0	112.8	L1420	L1420-E1422 PolarHBondContact O-N 3.2Å
1423	A	53	Low	72.3	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	38%	0.383	C	S	.	.			trans	-82.5	-23.3	-170	0	0	0	0	0	116	T1390 L1412 L1420 Q1425 Q1426 F1427 L1429	T1390-A1423 HydrophobicContact CG2-CB 4.29Å; L1412-A1423 HydrophobicContact CD1-CB 4.4Å; L1420-A1423 HydrophobicContact CB-CB 4.43Å; L1420-A1423 PolarHBondContact O-N 3.09Å; L1420-A1423 VanDerWaalsContact O-N 3.15Å; A1423-Q1425 PolarHBondContact O-N 3.01Å; A1423-Q1426 PolarHBondContact O-N 3.17Å; A1423-Q1426 VanDerWaalsContact O-N 3.15Å; A1423-F1427 HydrophobicContact CB-CD2 4.21Å; A1423-F1427 PolarHBondContact O-N 3.23Å; A1423-L1429 HydrophobicContact CB-CD1 4.33Å; A1423-L1429 HydrophobicContact CB-CD2 4.03Å
1424	D	52.2	Low	71.9	Confident	137 Å²	137	75.5 Å²	75.5	73%	0.733	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-4.6	-163.7	-76.3	-18.4	0	0	0	117.1
1425	Q	56.2	Low	71.4	Confident	180 Å²	180	80.1 Å²	80.1	84%	0.841	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.9	-1.6	179.4	-66	-166.4	-0.7	0	0	115.4	A1423	A1423-Q1425 PolarHBondContact O-N 3.01Å
1426	Q	64.4	Low	70.8	Confident	101 Å²	101	83.6 Å²	83.6	47%	0.472	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.6	-13.7	-171.7	-168.5	155.4	-20.9	0	0	115.5	A1423	A1423-Q1426 PolarHBondContact O-N 3.17Å; A1423-Q1426 VanDerWaalsContact O-N 3.15Å
1427	F	78.2	Confident	69.9	Low	17 Å²	17	87.9 Å²	87.9	8%	0.075	44%	0.437	C	S	.	.			trans	-130.6	140.6	-176.1	-59.6	-62.8	0	0	0	111.9	T1390 A1393 E1394 W1410 L1412 A1423 L1429	T1390-F1427 HydrophobicContact CG2-CD2 4.21Å; T1390-F1427 HydrophobicContact CG2-CE2 4.01Å; A1393-F1427 HydrophobicContact CB-CE1 4.11Å; A1393-F1427 HydrophobicContact CB-CZ 4.06Å; E1394-F1427 HydrophobicContact CG-CE2 4.19Å; E1394-F1427 HydrophobicContact CG-CZ 3.91Å; W1410-F1427 HydrophobicContact CB-CD1 3.54Å; W1410-F1427 HydrophobicContact CB-CE1 3.89Å; W1410-F1427 HydrophobicContact CD2-CE1 4.4Å; W1410-F1427 HydrophobicContact CG-CD1 4.26Å; W1410-F1427 HydrophobicContact CG-CE1 4.11Å; L1412-F1427 HydrophobicContact CD1-CB 4.05Å; L1412-F1427 HydrophobicContact CD1-CD2 4.15Å; L1412-F1427 HydrophobicContact CD1-CG 4.1Å; L1412-F1427 HydrophobicContact CG-CB 4.09Å; L1412-F1427 HydrophobicContact CG-CG 4.32Å; A1423-F1427 HydrophobicContact CB-CD2 4.21Å; A1423-F1427 PolarHBondContact O-N 3.23Å; F1427-L1429 HydrophobicContact CB-CD2 4.49Å
1428	N	79	Confident	69.4	Low	101 Å²	101	95.5 Å²	95.5	54%	0.54	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	141.1	166.1	-63.8	-52.9	0	0	0	109.1	W1410 T1411 L1412	W1410-N1428 PolarHBondContact O-N 2.96Å; W1410-N1428 PolarHBondContact O-ND2 2.71Å; T1411-N1428 CarbonylContact C-O 3.56Å; T1411-N1428 VanDerWaalsContact CA-O 3.29Å; T1411-N1428 WeakPolarHBondContact CA-O 3.38Å; T1411-N1428 HydrophobicContact CG2-CB 4.02Å; L1412-N1428 PolarHBondContact N-O 2.94Å
1429	L	82.4	Confident	69.2	Low	63 Å²	63	91.2 Å²	91.2	33%	0.33	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	137.4	-178.7	-57.3	-178.8	0	0	0	110.6	L1412 A1423 F1427	L1412-L1429 HydrophobicContact CB-CD2 3.82Å; L1412-L1429 HydrophobicContact CD1-CD2 3.98Å; L1412-L1429 HydrophobicContact CG-CD2 4.19Å; A1423-L1429 HydrophobicContact CB-CD1 4.33Å; A1423-L1429 HydrophobicContact CB-CD2 4.03Å; F1427-L1429 HydrophobicContact CB-CD2 4.49Å
1430	Y	82.3	Confident	69.3	Low	21 Å²	21	91 Å²	91	8%	0.082	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	135.4	162.7	70.6	-90.1	0	0	0	112.9	V1383 F1385 T1411 L1412 G1413 G1414 T1432 Q1445 F1473	V1383-Y1430 HydrophobicContact CG2-CE1 4.13Å; F1385-Y1430 VanDerWaalsContact CE1-OH 3.28Å; F1385-Y1430 WeakPolarHBondContact CE1-OH 3.44Å; F1385-Y1430 WeakPolarHBondContact CZ-OH 3.37Å; T1411-Y1430 HydrophobicContact CG2-CD1 3.41Å; T1411-Y1430 VanDerWaalsContact CG2-CD1 3.41Å; T1411-Y1430 HydrophobicContact CG2-CE1 3.44Å; T1411-Y1430 VanDerWaalsContact CG2-CE1 3.44Å; L1412-Y1430 PolarHBondContact O-N 3Å; L1412-Y1430 VanDerWaalsContact O-N 3.09Å; G1413-Y1430 WeakPolarHBondContact CA-O 3.35Å; G1414-Y1430 PolarHBondContact N-O 3.14Å; Y1430-T1432 HydrophobicContact CD2-CG2 4.2Å; Y1430-T1432 HydrophobicContact CE2-CG2 3.72Å; Y1430-Q1445 HydrophobicContact CD1-CG 4.48Å; Y1430-Q1445 HydrophobicContact CG-CG 4.44Å; Y1430-F1473 AromaticContact CE2-CE1 3.73Å; Y1430-F1473 HydrophobicContact CE2-CE1 3.73Å; Y1430-F1473 HydrophobicContact CE2-CZ 4.36Å; Y1430-F1473 AromaticContact CZ-CE1 3.74Å; Y1430-F1473 WeakPolarHBondContact OH-CD1 3.36Å; Y1430-F1473 WeakPolarHBondContact OH-CE1 3.47Å
1431	T	80.6	Confident	69.1	Low	89 Å²	89	90.7 Å²	90.7	55%	0.546	45%	0.45	S	S	.	.			trans	-85.6	117.4	176.9	-33.6	0	0	0	0	109.3	G1414	G1414-T1431 WeakPolarHBondContact O-CA 3.48Å
1432	T	77.6	Confident	69.8	Low	30 Å²	30	83.7 Å²	83.7	18%	0.184	43%	0.425	C	S	.	.			trans	-144.9	155	169.7	-151.8	0	0	0	0	110.4	G1414 P1415 Y1430 M1434 F1473	G1414-T1432 CarbonylContact C-O 3.46Å; G1414-T1432 VanDerWaalsContact CA-O 3.27Å; G1414-T1432 WeakPolarHBondContact CA-O 3.5Å; P1415-T1432 WeakPolarHBondContact CD-O 3.26Å; Y1430-T1432 HydrophobicContact CD2-CG2 4.2Å; Y1430-T1432 HydrophobicContact CE2-CG2 3.72Å; T1432-M1434 HydrophobicContact CG2-CG 4.04Å; T1432-M1434 HydrophobicContact CG2-SD 3.81Å; T1432-F1473 HydrophobicContact CG2-CZ 4.37Å
1433	N	79.8	Confident	70.3	Confident	52 Å²	52	78.8 Å²	78.8	28%	0.278	42%	0.42	S	S	.	.			trans	-110.9	107.8	177.8	-172.8	14.1	0	0	0	110.2	D1435 E1436 V1439	N1433-D1435 PolarHBondContact O-N 2.85Å; N1433-D1435 PolarHBondContact OD1-N 2.75Å; N1433-E1436 HydrophobicContact CB-CG 4.47Å; N1433-E1436 WeakPolarHBondContact CB-OE1 3.5Å; N1433-E1436 PolarHBondContact ND2-OE1 3.41Å; N1433-V1439 WeakPolarHBondContact O-CG2 3.4Å
1434	M	77	Confident	70.9	Confident	4 Å²	4	85 Å²	85	2%	0.02	45%	0.453	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	3.2	-176.1	-62.3	-68	-74.1	0	0	113.5	F1385 T1432 V1439 Y1466 E1469 F1473	F1385-M1434 HydrophobicContact CD1-CE 4.4Å; F1385-M1434 HydrophobicContact CD1-CG 4.05Å; F1385-M1434 HydrophobicContact CD1-SD 4.34Å; F1385-M1434 HydrophobicContact CE1-CE 3.96Å; F1385-M1434 HydrophobicContact CE1-CG 4.2Å; F1385-M1434 HydrophobicContact CE1-SD 3.89Å; F1385-M1434 HydrophobicContact CZ-CE 4.23Å; T1432-M1434 HydrophobicContact CG2-CG 4.04Å; T1432-M1434 HydrophobicContact CG2-SD 3.81Å; M1434-V1439 HydrophobicContact SD-CG1 4.39Å; M1434-V1439 HydrophobicContact SD-CG2 4.38Å; M1434-Y1466 HydrophobicContact CB-CD2 3.96Å; M1434-Y1466 HydrophobicContact CB-CE2 3.31Å; M1434-Y1466 HydrophobicContact CG-CE2 4.37Å; M1434-Y1466 WeakPolarHBondContact O-CD2 3.38Å; M1434-E1469 HydrophobicContact CE-CB 3.83Å; M1434-F1473 HydrophobicContact CE-CD2 4.1Å; M1434-F1473 HydrophobicContact CE-CE2 3.7Å; M1434-F1473 HydrophobicContact SD-CD2 4.5Å; M1434-F1473 HydrophobicContact SD-CE2 3.59Å; M1434-F1473 VanDerWaalsContact SD-CE2 3.59Å; M1434-F1473 HydrophobicContact SD-CZ 3.96Å
1435	D	73.4	Confident	71.9	Confident	97 Å²	97	80.6 Å²	80.6	52%	0.519	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	6.4	176.4	-66.6	-22	0	0	0	113.2	N1433 K1460 Y1466	N1433-D1435 PolarHBondContact O-N 2.85Å; N1433-D1435 PolarHBondContact OD1-N 2.75Å; D1435-K1460 WeakPolarHBondContact OD1-CD 3.38Å; D1435-K1460 WeakPolarHBondContact OD1-CE 3.42Å; D1435-K1460 IonicContact OD1-NZ 3.99Å; D1435-K1460 PolarHBondContact OD1-NZ 3.34Å; D1435-K1460 IonicContact OD2-NZ 2.69Å; D1435-K1460 PolarHBondContact OD2-NZ 3Å; D1435-Y1466 WeakPolarHBondContact OD1-CD2 3.35Å
1436	E	67.2	Low	73.1	Confident	123 Å²	123	75.5 Å²	75.5	58%	0.575	41%	0.406	S	S	*	.	S	Bend	trans	-97.5	150.7	176	-73	171.4	-143.5	0	0	111.7	N1433 E1438	N1433-E1436 HydrophobicContact CB-CG 4.47Å; N1433-E1436 WeakPolarHBondContact CB-OE1 3.5Å; N1433-E1436 PolarHBondContact ND2-OE1 3.41Å; E1436-E1438 PolarHBondContact O-N 3.49Å
1437	E	58	Low	74	Confident	194 Å²	194	75.2 Å²	75.2	91%	0.907	41%	0.408	S	S	*	.	S	Bend	trans	-74.4	-14.2	-164.5	-65.4	-170.8	138.1	0	0	115.9
1438	E	66.7	Low	74.5	Confident	162 Å²	162	74.7 Å²	74.7	76%	0.757	41%	0.405	S	S	*	.			trans	-142.2	86.3	174.5	-70.8	-165.7	138.5	0	0	112.7	E1436	E1436-E1438 PolarHBondContact O-N 3.49Å
1439	V	69	Low	75	Confident	12 Å²	12	70.4 Å²	70.4	7%	0.073	38%	0.382	C	S	.	.			trans	-81.1	125.1	168.6	-171.5	0	0	0	0	109.6	N1433 M1434 E1469 K1472 F1473	N1433-V1439 WeakPolarHBondContact O-CG2 3.4Å; M1434-V1439 HydrophobicContact SD-CG1 4.39Å; M1434-V1439 HydrophobicContact SD-CG2 4.38Å; V1439-E1469 WeakPolarHBondContact CA-OE2 3.27Å; V1439-E1469 VanDerWaalsContact CB-OE2 3.27Å; V1439-E1469 WeakPolarHBondContact CB-OE2 3.41Å; V1439-E1469 HydrophobicContact CG2-CG 4.45Å; V1439-E1469 PolarHBondContact N-OE2 3.11Å; V1439-K1472 VanDerWaalsContact O-CD 3.31Å; V1439-K1472 WeakPolarHBondContact O-CD 3.25Å; V1439-K1472 PolarHBondContact O-NZ 2.96Å; V1439-F1473 HydrophobicContact CG1-CE2 4.09Å; V1439-F1473 HydrophobicContact CG1-CZ 3.84Å
1440	N	73.8	Confident	75.5	Confident	133 Å²	133	67.4 Å²	67.4	71%	0.711	37%	0.367	S	S	*	.			trans	-118.6	98.3	174.8	-79.9	-59	0	0	0	109.6
1441	P	70.4	Confident	76	Confident	25 Å²	25	66.4 Å²	66.4	16%	0.162	36%	0.363	C	S	.	.			trans	-65.8	149.6	179.6	25.1	-33.6	0	0	0	113.1	Q1445 L1446 F1473	P1441-Q1445 HydrophobicContact CB-CB 3.81Å; P1441-L1446 HydrophobicContact CB-CD2 4.43Å; P1441-L1446 HydrophobicContact CB-CG 4.4Å; P1441-L1446 HydrophobicContact CG-CD2 3.66Å; P1441-L1446 HydrophobicContact CG-CG 4.1Å; P1441-F1473 HydrophobicContact CB-CD1 4.02Å; P1441-F1473 HydrophobicContact CB-CE1 3.65Å; P1441-F1473 HydrophobicContact CB-CZ 4.03Å; P1441-F1473 HydrophobicContact CG-CE1 4.38Å; P1441-F1473 HydrophobicContact CG-CZ 4.47Å
1442	S	69.9	Low	76.7	Confident	50 Å²	50	62.2 Å²	62.2	35%	0.35	34%	0.337	S	S	.	.			trans	-72.3	166.6	171.3	74	0	0	0	0	111.9	D1444 Q1445 L1446	S1442-D1444 PolarHBondContact O-N 2.83Å; S1442-D1444 VanDerWaalsContact O-N 3.14Å; S1442-Q1445 WeakPolarHBondContact O-CB 3.36Å; S1442-Q1445 PolarHBondContact O-N 3.42Å; S1442-Q1445 WeakPolarHBondContact OG-CG 3.13Å; S1442-L1446 PolarHBondContact O-N 3.38Å
1443	G	65.2	Low	77.4	Confident	64 Å²	64	60.8 Å²	60.8	66%	0.66	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-53.9	-34.4	177.9	0	0	0	0	0	113.7	Q1445	G1443-Q1445 VanDerWaalsContact C-N 3.29Å; G1443-Q1445 PolarHBondContact O-N 3.11Å
1444	D	65.7	Low	77.9	Confident	131 Å²	131	58.8 Å²	58.8	70%	0.701	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-76	-13.7	179.5	-40	-70.7	0	0	0	113.9	S1442	S1442-D1444 PolarHBondContact O-N 2.83Å; S1442-D1444 VanDerWaalsContact O-N 3.14Å
1445	Q	72.3	Confident	78.4	Confident	43 Å²	43	58.7 Å²	58.7	20%	0.201	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-102.5	-9	-175.9	-66.8	169.8	-7.9	0	0	113.1	Y1430 P1441 S1442 G1443 H1448 F1473	Y1430-Q1445 HydrophobicContact CD1-CG 4.48Å; Y1430-Q1445 HydrophobicContact CG-CG 4.44Å; P1441-Q1445 HydrophobicContact CB-CB 3.81Å; S1442-Q1445 WeakPolarHBondContact O-CB 3.36Å; S1442-Q1445 PolarHBondContact O-N 3.42Å; S1442-Q1445 WeakPolarHBondContact OG-CG 3.13Å; G1443-Q1445 VanDerWaalsContact C-N 3.29Å; G1443-Q1445 PolarHBondContact O-N 3.11Å; Q1445-H1448 PolarHBondContact O-CE1 2.64Å; Q1445-H1448 PolarHBondContact O-ND1 3.15Å; Q1445-F1473 HydrophobicContact CB-CD1 4.39Å; Q1445-F1473 HydrophobicContact CB-CE1 4.3Å; Q1445-F1473 WeakPolarHBondContact O-CD1 3.22Å
1446	L	81.4	Confident	79.1	Confident	73 Å²	73	54.1 Å²	54.1	38%	0.382	29%	0.293	S	S	.	.			trans	-82.7	168	179.1	-76.1	167.1	0	0	0	112.5	P1441 S1442 H1448 K1472	P1441-L1446 HydrophobicContact CB-CD2 4.43Å; P1441-L1446 HydrophobicContact CB-CG 4.4Å; P1441-L1446 HydrophobicContact CG-CD2 3.66Å; P1441-L1446 HydrophobicContact CG-CG 4.1Å; S1442-L1446 PolarHBondContact O-N 3.38Å; L1446-H1448 PolarHBondContact O-N 3.25Å; L1446-K1472 WeakPolarHBondContact CD2-O 3.49Å
1447	N	84.9	Confident	80.1	Confident	96 Å²	96	48.2 Å²	48.2	51%	0.513	27%	0.265	S	S	.	.			trans	60.2	37	171	-57.3	-37.7	0	0	0	115.8	F1473 R1475	N1447-F1473 PolarHBondContact N-O 3.34Å; N1447-R1475 HydrophobicContact CB-CB 4.29Å
1448	H	88.8	Confident	81.2	Confident	5 Å²	5	39.1 Å²	39.1	2%	0.023	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	144.8	166.9	-70.9	83.7	0	0	0	111.1	V1383 T1411 Q1445 L1446 F1473 L1474 R1475	V1383-H1448 HydrophobicContact CG1-CB 4.05Å; T1411-H1448 PolarHBondContact OG1-NE2 2.69Å; Q1445-H1448 PolarHBondContact O-CE1 2.64Å; Q1445-H1448 PolarHBondContact O-ND1 3.15Å; L1446-H1448 PolarHBondContact O-N 3.25Å; H1448-F1473 PolarHBondContact N-O 3.48Å; H1448-L1474 HydrophobicContact CB-CD2 4.38Å; H1448-L1474 WeakPolarHBondContact O-CA 3.46Å; H1448-L1474 WeakPolarHBondContact O-CD2 3.33Å; H1448-R1475 PolarHBondContact O-N 3.01Å
1449	D	89	Confident	81.8	Confident	11 Å²	11	34 Å²	34	6%	0.059	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-37.9	177.5	-64.2	-73.1	0	0	0	112.1	H1381 R1475 F1479	H1381-D1449 PolarHBondContact N-OD2 2.87Å; H1381-D1449 IonicContact ND1-OD2 3.71Å; H1381-D1449 PolarHBondContact O-N 2.88Å; D1449-R1475 WeakPolarHBondContact OD1-CD 3.46Å; D1449-R1475 IonicContact OD1-CZ 2.7Å; D1449-R1475 IonicContact OD1-NE 3.93Å; D1449-R1475 PolarHBondContact OD1-NE 3.33Å; D1449-R1475 IonicContact OD1-NH2 2.63Å; D1449-F1479 PolarHBondContact O-N 3.12Å
1450	L	92.8	Very high	82.4	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	131.4	179.9	-176.7	59.5	0	0	0	111.4	L1368 V1371 H1381 I1382 V1383 I1452 F1479 F1481 L1547	L1368-L1450 HydrophobicContact CD2-CD2 3.65Å; V1371-L1450 HydrophobicContact CG1-CB 4.24Å; V1371-L1450 HydrophobicContact CG2-CD1 4.1Å; V1371-L1450 HydrophobicContact CG2-CD2 4.4Å; H1381-L1450 PolarHBondContact O-N 3.4Å; I1382-L1450 WeakPolarHBondContact CA-O 3.41Å; I1382-L1450 HydrophobicContact CD1-CD2 4.27Å; I1382-L1450 HydrophobicContact CG1-CB 4.18Å; I1382-L1450 HydrophobicContact CG2-CB 4.22Å; I1382-L1450 HydrophobicContact CG2-CD2 4.25Å; I1382-L1450 HydrophobicContact CG2-CG 4.32Å; V1383-L1450 PolarHBondContact N-O 2.55Å; L1450-I1452 HydrophobicContact CD2-CD1 4.14Å; L1450-I1452 HydrophobicContact CD2-CG1 4.06Å; L1450-I1452 HydrophobicContact CG-CG1 4.03Å; L1450-F1479 WeakPolarHBondContact CA-O 3.48Å; L1450-F1479 HydrophobicContact CD1-CB 3.76Å; L1450-F1481 HydrophobicContact CD1-CB 4.1Å; L1450-L1547 HydrophobicContact CD1-CD1 4.42Å
1451	A	93.5	Very high	82.4	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	145	162.5	0	0	0	0	0	110.3	V1383 F1385 T1470 L1474 F1479 L1480 F1481	V1383-A1451 HydrophobicContact CG1-CB 3.9Å; V1383-A1451 CarbonylContact O-C 3.59Å; V1383-A1451 VanDerWaalsContact O-CA 3.28Å; V1383-A1451 WeakPolarHBondContact O-CA 3.14Å; F1385-A1451 HydrophobicContact CD2-CB 4.37Å; F1385-A1451 HydrophobicContact CE2-CB 4.08Å; A1451-T1470 HydrophobicContact CB-CG2 4.06Å; A1451-L1474 HydrophobicContact CB-CD1 4.45Å; A1451-L1474 HydrophobicContact CB-CD2 3.85Å; A1451-L1474 HydrophobicContact CB-CG 4.32Å; A1451-F1479 PolarHBondContact N-O 3.2Å; A1451-L1480 HydrophobicContact CB-CD1 3.59Å; A1451-L1480 WeakPolarHBondContact O-CA 3.4Å; A1451-F1481 PolarHBondContact O-N 2.8Å
1452	I	94	Very high	83	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	125.6	-178.2	-58.6	-176.9	0	0	0	110.1	I1382 V1383 M1384 F1385 F1392 W1410 L1450 F1481	I1382-I1452 HydrophobicContact CG2-CD1 3.73Å; I1382-I1452 HydrophobicContact CG2-CG1 4.11Å; V1383-I1452 PolarHBondContact O-N 3.1Å; M1384-I1452 HydrophobicContact CB-CB 4.2Å; M1384-I1452 HydrophobicContact CG-CB 4.11Å; M1384-I1452 HydrophobicContact CG-CG2 4.09Å; M1384-I1452 HydrophobicContact SD-CG2 4.41Å; F1385-I1452 PolarHBondContact N-O 3.42Å; F1385-I1452 VanDerWaalsContact N-O 3.09Å; F1392-I1452 HydrophobicContact CD1-CG2 4.38Å; F1392-I1452 HydrophobicContact CE1-CG2 3.94Å; W1410-I1452 HydrophobicContact CH2-CD1 3.53Å; W1410-I1452 HydrophobicContact CZ3-CD1 3.88Å; L1450-I1452 HydrophobicContact CD2-CD1 4.14Å; L1450-I1452 HydrophobicContact CD2-CG1 4.06Å; L1450-I1452 HydrophobicContact CG-CG1 4.03Å; I1452-F1481 HydrophobicContact CG1-CB 4.21Å; I1452-F1481 HydrophobicContact CG2-CD1 3.97Å
1453	L	92.9	Very high	83.8	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	95.9	175.2	-63.7	176.6	0	0	0	110.1	F1385 V1456 L1457 Y1466 L1467 L1480 F1481 V1482 N1483	F1385-L1453 HydrophobicContact CB-CD2 3.79Å; F1385-L1453 HydrophobicContact CD2-CD2 4.46Å; L1453-V1456 HydrophobicContact CD2-CB 4.28Å; L1453-V1456 HydrophobicContact CD2-CG1 4.36Å; L1453-V1456 HydrophobicContact CD2-CG2 4.28Å; L1453-L1457 HydrophobicContact CD1-CD1 4.09Å; L1453-L1457 HydrophobicContact CD1-CD2 3.99Å; L1453-L1457 HydrophobicContact CD1-CG 4.09Å; L1453-Y1466 HydrophobicContact CD1-CE1 4.44Å; L1453-Y1466 HydrophobicContact CD2-CE1 3.87Å; L1453-L1467 HydrophobicContact CD1-CD2 4.28Å; L1453-L1480 HydrophobicContact CD1-CD1 3.86Å; L1453-L1480 HydrophobicContact CD1-CD2 4.34Å; L1453-L1480 HydrophobicContact CG-CD1 3.97Å; L1453-F1481 PolarHBondContact N-O 3.49Å; L1453-V1482 WeakPolarHBondContact O-CA 3.38Å; L1453-N1483 PolarHBondContact O-N 3.07Å
1454	D	90.2	Very high	84.8	Confident	10 Å²	10	37.1 Å²	37.1	5%	0.053	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	105.2	173	176.4	60	0	0	0	111.3	M1384 R1388 V1456 N1483	M1384-D1454 HydrophobicContact CE-CB 3.87Å; R1388-D1454 IonicContact NH2-OD2 3.61Å; D1454-V1456 WeakPolarHBondContact O-CG2 3.44Å; D1454-V1456 PolarHBondContact O-N 3.21Å; D1454-N1483 PolarHBondContact OD1-ND2 2.99Å
1455	R	87.6	Confident	85.7	Confident	1 Å²	1	32.9 Å²	32.9	0%	0.004	17%	0.168	C	C	.	.	S	Bend	trans	54.2	42.2	171.2	-60.1	165.2	-68.5	-160.3	6.9	111.7	D1350 W1355 N1356 K1459 N1483 E1484 F1485	D1350-R1455 IonicContact OD1-NH2 2.68Å; D1350-R1455 PolarHBondContact OD1-NH2 2.68Å; W1355-R1455 VanDerWaalsContact CD1-NH1 3.3Å; W1355-R1455 PolarHBondContact O-NH1 2.62Å; N1356-R1455 PolarHBondContact OD1-NH1 3.11Å; N1356-R1455 PolarHBondContact OD1-NH2 3.2Å; R1455-K1459 WeakPolarHBondContact O-CE 3.1Å; R1455-K1459 PolarHBondContact O-NZ 2.99Å; R1455-N1483 PolarHBondContact N-O 2.96Å; R1455-E1484 WeakPolarHBondContact CA-OE1 3.14Å; R1455-F1485 HydrophobicContact CB-CE2 4.02Å; R1455-F1485 HydrophobicContact CG-CD2 4.18Å; R1455-F1485 HydrophobicContact CG-CE2 3.68Å; R1455-F1485 HydrophobicContact CG-CZ 4.28Å
1456	V	87.5	Confident	86.6	Confident	1 Å²	1	31 Å²	31	1%	0.006	16%	0.159	C	C	.	.			trans	-99.3	-48.3	-179.1	-179.7	0	0	0	0	111	E1386 L1453 D1454 C1458 K1459 Y1466 E1484	E1386-V1456 HydrophobicContact CB-CG1 4.26Å; E1386-V1456 HydrophobicContact CB-CG2 4.21Å; L1453-V1456 HydrophobicContact CD2-CB 4.28Å; L1453-V1456 HydrophobicContact CD2-CG1 4.36Å; L1453-V1456 HydrophobicContact CD2-CG2 4.28Å; D1454-V1456 WeakPolarHBondContact O-CG2 3.44Å; D1454-V1456 PolarHBondContact O-N 3.21Å; V1456-C1458 VanDerWaalsContact C-N 3.32Å; V1456-C1458 PolarHBondContact O-N 3.16Å; V1456-K1459 VanDerWaalsContact O-CB 3.3Å; V1456-K1459 WeakPolarHBondContact O-CB 3.34Å; V1456-K1459 PolarHBondContact O-N 2.87Å; V1456-Y1466 HydrophobicContact CG1-CE1 4.23Å; V1456-E1484 PolarHBondContact N-OE1 3.42Å
1457	L	88	Confident	87	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-68.2	-29.5	-167.7	-63.9	177.8	0	0	0	112.5	L1453 K1459 K1460 I1463 Y1466 L1467 V1482 E1484 W1522	L1453-L1457 HydrophobicContact CD1-CD1 4.09Å; L1453-L1457 HydrophobicContact CD1-CD2 3.99Å; L1453-L1457 HydrophobicContact CD1-CG 4.09Å; L1457-K1459 PolarHBondContact O-N 3.31Å; L1457-K1459 VanDerWaalsContact O-N 3.11Å; L1457-K1460 PolarHBondContact O-N 3.19Å; L1457-I1463 HydrophobicContact CD1-CG2 4.41Å; L1457-I1463 HydrophobicContact CD2-CG2 4.42Å; L1457-Y1466 HydrophobicContact CD2-CD1 3.65Å; L1457-Y1466 HydrophobicContact CD2-CE1 4.23Å; L1457-Y1466 HydrophobicContact CD2-CG 4.31Å; L1457-L1467 HydrophobicContact CD1-CD2 4.16Å; L1457-V1482 HydrophobicContact CD1-CG1 3.95Å; L1457-E1484 HydrophobicContact CB-CG 4.45Å; L1457-E1484 PolarHBondContact N-OE1 3.21Å; L1457-W1522 HydrophobicContact CB-CH2 3.6Å; L1457-W1522 HydrophobicContact CB-CZ3 3.96Å; L1457-W1522 HydrophobicContact CD1-CH2 4.25Å; L1457-W1522 HydrophobicContact CD1-CZ3 3.78Å
1458	C	82.4	Confident	87.2	Confident	2 Å²	2	27.2 Å²	27.2	1%	0.014	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-60.5	-17.8	172.3	67.4	0	0	0	0	114	V1456 E1484 M1515 F1516	V1456-C1458 VanDerWaalsContact C-N 3.32Å; V1456-C1458 PolarHBondContact O-N 3.16Å; C1458-E1484 WeakPolarHBondContact CB-OE2 3.18Å; C1458-E1484 PolarHBondContact N-OE1 3.49Å; C1458-M1515 WeakPolarHBondContact CA-O 3.43Å; C1458-F1516 HydrophobicContact CB-CD1 3.9Å; C1458-F1516 HydrophobicContact CB-CE1 3.98Å
1459	K	78.5	Confident	87.1	Confident	55 Å²	55	28 Å²	28	24%	0.239	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-88.7	-15.1	175.9	-51.4	170.1	-167.7	146.3	0	112.7	R1455 V1456 L1457 M1496	R1455-K1459 WeakPolarHBondContact O-CE 3.1Å; R1455-K1459 PolarHBondContact O-NZ 2.99Å; V1456-K1459 VanDerWaalsContact O-CB 3.3Å; V1456-K1459 WeakPolarHBondContact O-CB 3.34Å; V1456-K1459 PolarHBondContact O-N 2.87Å; L1457-K1459 PolarHBondContact O-N 3.31Å; L1457-K1459 VanDerWaalsContact O-N 3.11Å; K1459-M1496 HydrophobicContact CG-CE 4.23Å
1460	K	80.9	Confident	87.1	Confident	10 Å²	10	27.5 Å²	27.5	4%	0.043	14%	0.137	C	C	.	.			trans	-95	135.5	-165.9	-57.6	-58.4	-174.8	159.9	0	112.6	E1386 D1435 L1457 Y1466 R1511	E1386-K1460 VanDerWaalsContact CD-NZ 3.31Å; E1386-K1460 VanDerWaalsContact OE1-CE 3.31Å; E1386-K1460 WeakPolarHBondContact OE1-CE 3.33Å; E1386-K1460 IonicContact OE1-NZ 2.82Å; E1386-K1460 PolarHBondContact OE1-NZ 3.33Å; E1386-K1460 VanDerWaalsContact OE2-CE 3.3Å; E1386-K1460 WeakPolarHBondContact OE2-CE 3.44Å; E1386-K1460 IonicContact OE2-NZ 3.21Å; E1386-K1460 PolarHBondContact OE2-NZ 2.7Å; E1386-K1460 VanDerWaalsContact OE2-NZ 3.14Å; D1435-K1460 WeakPolarHBondContact OD1-CD 3.38Å; D1435-K1460 WeakPolarHBondContact OD1-CE 3.42Å; D1435-K1460 IonicContact OD1-NZ 3.99Å; D1435-K1460 PolarHBondContact OD1-NZ 3.34Å; D1435-K1460 IonicContact OD2-NZ 2.69Å; D1435-K1460 PolarHBondContact OD2-NZ 3Å; L1457-K1460 PolarHBondContact O-N 3.19Å; K1460-Y1466 HydrophobicContact CD-CD2 3.9Å; K1460-Y1466 HydrophobicContact CD-CE2 3.96Å; K1460-Y1466 HydrophobicContact CG-CD2 4.01Å; K1460-Y1466 HydrophobicContact CG-CE2 4.31Å; K1460-Y1466 HydrophobicContact CG-CG 4.28Å; K1460-Y1466 VanDerWaalsContact NZ-CE2 3.34Å; K1460-R1511 PolarHBondContact O-NH1 2.84Å; K1460-R1511 PolarHBondContact O-NH2 3.16Å
1461	K	73.9	Confident	87	Confident	180 Å²	180	29.6 Å²	29.6	78%	0.783	15%	0.146	S	C	*	.	S	Bend	trans	-68.4	-53.6	177.7	-73.8	-169.4	175	-172.1	0	111.7	R1511	K1461-R1511 PolarHBondContact O-NH2 3.24Å
1462	N	83.4	Confident	86.7	Confident	98 Å²	98	33 Å²	33	52%	0.524	16%	0.161	S	C	.	.			trans	-109	92.5	177.4	-171.6	-11.7	0	0	0	110.4	I1464 A1465 Y1466	N1462-I1464 VanDerWaalsContact C-N 3.3Å; N1462-I1464 PolarHBondContact O-N 3.12Å; N1462-I1464 PolarHBondContact OD1-N 2.85Å; N1462-A1465 HydrophobicContact CB-CB 4.04Å; N1462-A1465 VanDerWaalsContact CG-CB 3.48Å; N1462-A1465 WeakPolarHBondContact ND2-CB 3.47Å; N1462-A1465 PolarHBondContact O-N 3.11Å; N1462-A1465 PolarHBondContact OD1-N 3.05Å; N1462-A1465 VanDerWaalsContact OD1-N 3.08Å; N1462-Y1466 PolarHBondContact O-N 2.88Å
1463	I	86.7	Confident	86.5	Confident	9 Å²	9	33 Å²	33	5%	0.046	16%	0.161	C	C	.	.	H	α-helix	trans	-62.1	-38.4	-179.5	-65.2	172.1	0	0	0	111.1	L1457 Y1466 L1467 L1517 W1522 L1525	L1457-I1463 HydrophobicContact CD1-CG2 4.41Å; L1457-I1463 HydrophobicContact CD2-CG2 4.42Å; I1463-Y1466 PolarHBondContact O-N 3.34Å; I1463-L1467 HydrophobicContact CG2-CD1 3.93Å; I1463-L1467 HydrophobicContact CG2-CG 4.39Å; I1463-L1467 VanDerWaalsContact O-CG 3.31Å; I1463-L1467 WeakPolarHBondContact O-CG 3.47Å; I1463-L1467 PolarHBondContact O-N 3.49Å; I1463-L1517 HydrophobicContact CD1-CD1 3.94Å; I1463-W1522 HydrophobicContact CD1-CH2 4.06Å; I1463-W1522 HydrophobicContact CD1-CZ3 4.21Å; I1463-W1522 HydrophobicContact CG2-CZ3 4.16Å; I1463-L1525 HydrophobicContact CD1-CD1 4.29Å; I1463-L1525 HydrophobicContact CG2-CD1 4.38Å
1464	I	86.9	Confident	86.3	Confident	53 Å²	53	33.2 Å²	33.2	27%	0.272	16%	0.162	S	C	.	.	H	α-helix	trans	-67.5	-45.7	-177.6	-63.7	178	0	0	0	110.6	N1462 Y1466 L1467 H1468 L1525 Q1528	N1462-I1464 VanDerWaalsContact C-N 3.3Å; N1462-I1464 PolarHBondContact O-N 3.12Å; N1462-I1464 PolarHBondContact OD1-N 2.85Å; I1464-Y1466 PolarHBondContact O-N 3.06Å; I1464-L1467 PolarHBondContact O-N 3.05Å; I1464-H1468 PolarHBondContact O-CD2 3.22Å; I1464-H1468 PolarHBondContact O-N 2.67Å; I1464-L1525 HydrophobicContact CD1-CD2 3.94Å; I1464-L1525 HydrophobicContact CG1-CD2 3.89Å; I1464-Q1528 HydrophobicContact CD1-CB 4.28Å
1465	A	85.1	Confident	86.1	Confident	42 Å²	42	34.4 Å²	34.4	35%	0.347	17%	0.165	S	C	.	.	H	α-helix	trans	-59.9	-45.7	175.5	0	0	0	0	0	112.1	N1462 L1467 H1468 E1469	N1462-A1465 HydrophobicContact CB-CB 4.04Å; N1462-A1465 VanDerWaalsContact CG-CB 3.48Å; N1462-A1465 WeakPolarHBondContact ND2-CB 3.47Å; N1462-A1465 PolarHBondContact O-N 3.11Å; N1462-A1465 PolarHBondContact OD1-N 3.05Å; N1462-A1465 VanDerWaalsContact OD1-N 3.08Å; A1465-L1467 VanDerWaalsContact C-N 3.3Å; A1465-L1467 PolarHBondContact O-N 2.95Å; A1465-H1468 WeakPolarHBondContact O-CB 3.38Å; A1465-H1468 PolarHBondContact O-N 2.7Å; A1465-E1469 PolarHBondContact O-N 2.96Å
1466	Y	90.3	Very high	85.6	Confident	3 Å²	3	37.7 Å²	37.7	1%	0.012	19%	0.187	C	C	.	.	H	α-helix	trans	-60	-39.1	177.7	-164.9	-81.7	0	0	0	112.4	E1386 M1434 D1435 L1453 V1456 L1457 K1460 N1462 I1463 I1464 T1470	E1386-Y1466 WeakPolarHBondContact OE1-CE2 3.5Å; E1386-Y1466 PolarHBondContact OE1-OH 2.88Å; M1434-Y1466 HydrophobicContact CB-CD2 3.96Å; M1434-Y1466 HydrophobicContact CB-CE2 3.31Å; M1434-Y1466 HydrophobicContact CG-CE2 4.37Å; M1434-Y1466 WeakPolarHBondContact O-CD2 3.38Å; D1435-Y1466 WeakPolarHBondContact OD1-CD2 3.35Å; L1453-Y1466 HydrophobicContact CD1-CE1 4.44Å; L1453-Y1466 HydrophobicContact CD2-CE1 3.87Å; V1456-Y1466 HydrophobicContact CG1-CE1 4.23Å; L1457-Y1466 HydrophobicContact CD2-CD1 3.65Å; L1457-Y1466 HydrophobicContact CD2-CE1 4.23Å; L1457-Y1466 HydrophobicContact CD2-CG 4.31Å; K1460-Y1466 HydrophobicContact CD-CD2 3.9Å; K1460-Y1466 HydrophobicContact CD-CE2 3.96Å; K1460-Y1466 HydrophobicContact CG-CD2 4.01Å; K1460-Y1466 HydrophobicContact CG-CE2 4.31Å; K1460-Y1466 HydrophobicContact CG-CG 4.28Å; K1460-Y1466 VanDerWaalsContact NZ-CE2 3.34Å; N1462-Y1466 PolarHBondContact O-N 2.88Å; I1463-Y1466 PolarHBondContact O-N 3.34Å; I1464-Y1466 PolarHBondContact O-N 3.06Å; Y1466-T1470 WeakPolarHBondContact O-CB 3.33Å; Y1466-T1470 PolarHBondContact O-N 2.74Å; Y1466-T1470 PolarHBondContact O-OG1 2.99Å
1467	L	90.6	Very high	85.3	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-67.8	-36.3	174.1	-71.5	172.7	0	0	0	112.5	L1453 L1457 I1463 I1464 A1465 T1470 K1471 L1480 F1526 A1529 F1531	L1453-L1467 HydrophobicContact CD1-CD2 4.28Å; L1457-L1467 HydrophobicContact CD1-CD2 4.16Å; I1463-L1467 HydrophobicContact CG2-CD1 3.93Å; I1463-L1467 HydrophobicContact CG2-CG 4.39Å; I1463-L1467 VanDerWaalsContact O-CG 3.31Å; I1463-L1467 WeakPolarHBondContact O-CG 3.47Å; I1463-L1467 PolarHBondContact O-N 3.49Å; I1464-L1467 PolarHBondContact O-N 3.05Å; A1465-L1467 VanDerWaalsContact C-N 3.3Å; A1465-L1467 PolarHBondContact O-N 2.95Å; L1467-T1470 PolarHBondContact O-N 2.82Å; L1467-K1471 VanDerWaalsContact O-CB 3.3Å; L1467-K1471 WeakPolarHBondContact O-CB 3.5Å; L1467-K1471 PolarHBondContact O-N 3.31Å; L1467-L1480 HydrophobicContact CD2-CD2 3.65Å; L1467-F1526 HydrophobicContact CD1-CD1 4.25Å; L1467-A1529 HydrophobicContact CB-CB 3.84Å; L1467-A1529 HydrophobicContact CD1-CB 3.9Å; L1467-F1531 HydrophobicContact CB-CE2 4.39Å
1468	H	88.1	Confident	85.3	Confident	90 Å²	90	38.7 Å²	38.7	42%	0.417	19%	0.192	S	C	.	.	H	α-helix	trans	-64.3	-43.5	173.2	-91.2	-86	0	0	0	112.4	I1464 A1465 K1471	I1464-H1468 PolarHBondContact O-CD2 3.22Å; I1464-H1468 PolarHBondContact O-N 2.67Å; A1465-H1468 WeakPolarHBondContact O-CB 3.38Å; A1465-H1468 PolarHBondContact O-N 2.7Å; H1468-K1471 WeakPolarHBondContact O-CB 3.25Å; H1468-K1471 PolarHBondContact O-N 3.41Å
1469	E	87.8	Confident	85.9	Confident	22 Å²	22	38.6 Å²	38.6	10%	0.103	19%	0.192	C	C	.	.	H	α-helix	trans	-66.8	-41.9	175.8	-63.8	-54.3	92.4	0	0	111.1	M1434 V1439 A1465 K1471 K1472 F1473	M1434-E1469 HydrophobicContact CE-CB 3.83Å; V1439-E1469 WeakPolarHBondContact CA-OE2 3.27Å; V1439-E1469 VanDerWaalsContact CB-OE2 3.27Å; V1439-E1469 WeakPolarHBondContact CB-OE2 3.41Å; V1439-E1469 HydrophobicContact CG2-CG 4.45Å; V1439-E1469 PolarHBondContact N-OE2 3.11Å; A1465-E1469 PolarHBondContact O-N 2.96Å; E1469-K1471 PolarHBondContact O-N 2.65Å; E1469-K1472 WeakPolarHBondContact O-CB 3.19Å; E1469-K1472 PolarHBondContact O-N 3.41Å; E1469-K1472 VanDerWaalsContact O-N 3.11Å; E1469-K1472 WeakPolarHBondContact OE1-CE 3.5Å; E1469-K1472 IonicContact OE1-NZ 3.76Å; E1469-K1472 PolarHBondContact OE1-NZ 3.13Å; E1469-K1472 IonicContact OE2-NZ 2.74Å; E1469-K1472 PolarHBondContact OE2-NZ 3.05Å; E1469-F1473 WeakPolarHBondContact O-CD2 3.39Å
1470	T	89	Confident	86.6	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.6	-36.9	174.5	-54.2	0	0	0	0	111.8	F1385 A1451 Y1466 L1467 K1472 F1473 L1480	F1385-T1470 HydrophobicContact CD2-CG2 4.28Å; F1385-T1470 HydrophobicContact CE2-CG2 4.01Å; A1451-T1470 HydrophobicContact CB-CG2 4.06Å; Y1466-T1470 WeakPolarHBondContact O-CB 3.33Å; Y1466-T1470 PolarHBondContact O-N 2.74Å; Y1466-T1470 PolarHBondContact O-OG1 2.99Å; L1467-T1470 PolarHBondContact O-N 2.82Å; T1470-K1472 PolarHBondContact O-N 3.47Å; T1470-F1473 PolarHBondContact O-N 3.02Å; T1470-L1480 HydrophobicContact CG2-CD1 3.94Å; T1470-L1480 HydrophobicContact CG2-CD2 4.46Å
1471	K	89.3	Confident	87.3	Confident	45 Å²	45	35.6 Å²	35.6	20%	0.196	18%	0.179	C	C	.	.	H	α-helix	trans	-65	-17.6	178.7	-173.7	166.6	167.8	166.1	0	114.1	L1467 H1468 E1469 A1529 G1530 F1531 K1550	L1467-K1471 VanDerWaalsContact O-CB 3.3Å; L1467-K1471 WeakPolarHBondContact O-CB 3.5Å; L1467-K1471 PolarHBondContact O-N 3.31Å; H1468-K1471 WeakPolarHBondContact O-CB 3.25Å; H1468-K1471 PolarHBondContact O-N 3.41Å; E1469-K1471 PolarHBondContact O-N 2.65Å; K1471-A1529 PolarHBondContact NZ-O 3.32Å; K1471-A1529 VanDerWaalsContact NZ-O 3.08Å; K1471-G1530 PolarHBondContact NZ-O 3.03Å; K1471-F1531 HydrophobicContact CB-CE2 4.29Å; K1471-F1531 HydrophobicContact CB-CZ 3.85Å; K1471-F1531 HydrophobicContact CD-CE2 3.93Å; K1471-F1531 HydrophobicContact CD-CZ 3.99Å; K1471-F1531 HydrophobicContact CG-CE2 4.46Å; K1471-F1531 HydrophobicContact CG-CZ 4.05Å; K1471-K1550 HydrophobicContact CD-CG 4.4Å; K1471-K1550 HydrophobicContact CG-CD 3.89Å; K1471-K1550 HydrophobicContact CG-CG 4.06Å; K1471-K1550 PolarHBondContact O-NZ 3.35Å
1472	K	87.5	Confident	88.3	Confident	72 Å²	72	27 Å²	27	31%	0.313	14%	0.141	S	C	.	.	H	α-helix	trans	-72.3	-32.7	174.6	-64	175.1	171.8	172.1	0	113.4	V1439 L1446 E1469 T1470	V1439-K1472 VanDerWaalsContact O-CD 3.31Å; V1439-K1472 WeakPolarHBondContact O-CD 3.25Å; V1439-K1472 PolarHBondContact O-NZ 2.96Å; L1446-K1472 WeakPolarHBondContact CD2-O 3.49Å; E1469-K1472 WeakPolarHBondContact O-CB 3.19Å; E1469-K1472 PolarHBondContact O-N 3.41Å; E1469-K1472 VanDerWaalsContact O-N 3.11Å; E1469-K1472 WeakPolarHBondContact OE1-CE 3.5Å; E1469-K1472 IonicContact OE1-NZ 3.76Å; E1469-K1472 PolarHBondContact OE1-NZ 3.13Å; E1469-K1472 IonicContact OE2-NZ 2.74Å; E1469-K1472 PolarHBondContact OE2-NZ 3.05Å; T1470-K1472 PolarHBondContact O-N 3.47Å
1473	F	89.8	Confident	88.8	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-79.1	-20.8	-176.5	-67.7	-99.8	0	0	0	113.2	F1385 Y1430 T1432 M1434 V1439 P1441 Q1445 N1447 H1448 E1469 T1470	F1385-F1473 HydrophobicContact CE1-CD2 4.47Å; F1385-F1473 HydrophobicContact CE1-CE2 4.44Å; F1385-F1473 HydrophobicContact CE1-CZ 4.47Å; F1385-F1473 HydrophobicContact CZ-CB 4.2Å; F1385-F1473 HydrophobicContact CZ-CD1 4.11Å; F1385-F1473 AromaticContact CZ-CD2 3.89Å; F1385-F1473 HydrophobicContact CZ-CD2 3.89Å; F1385-F1473 HydrophobicContact CZ-CE1 4.47Å; F1385-F1473 HydrophobicContact CZ-CE2 4.3Å; F1385-F1473 AromaticContact CZ-CG 3.8Å; F1385-F1473 HydrophobicContact CZ-CG 3.8Å; Y1430-F1473 AromaticContact CE2-CE1 3.73Å; Y1430-F1473 HydrophobicContact CE2-CE1 3.73Å; Y1430-F1473 HydrophobicContact CE2-CZ 4.36Å; Y1430-F1473 AromaticContact CZ-CE1 3.74Å; Y1430-F1473 WeakPolarHBondContact OH-CD1 3.36Å; Y1430-F1473 WeakPolarHBondContact OH-CE1 3.47Å; T1432-F1473 HydrophobicContact CG2-CZ 4.37Å; M1434-F1473 HydrophobicContact CE-CD2 4.1Å; M1434-F1473 HydrophobicContact CE-CE2 3.7Å; M1434-F1473 HydrophobicContact SD-CD2 4.5Å; M1434-F1473 HydrophobicContact SD-CE2 3.59Å; M1434-F1473 VanDerWaalsContact SD-CE2 3.59Å; M1434-F1473 HydrophobicContact SD-CZ 3.96Å; V1439-F1473 HydrophobicContact CG1-CE2 4.09Å; V1439-F1473 HydrophobicContact CG1-CZ 3.84Å; P1441-F1473 HydrophobicContact CB-CD1 4.02Å; P1441-F1473 HydrophobicContact CB-CE1 3.65Å; P1441-F1473 HydrophobicContact CB-CZ 4.03Å; P1441-F1473 HydrophobicContact CG-CE1 4.38Å; P1441-F1473 HydrophobicContact CG-CZ 4.47Å; Q1445-F1473 HydrophobicContact CB-CD1 4.39Å; Q1445-F1473 HydrophobicContact CB-CE1 4.3Å; Q1445-F1473 WeakPolarHBondContact O-CD1 3.22Å; N1447-F1473 PolarHBondContact N-O 3.34Å; H1448-F1473 PolarHBondContact N-O 3.48Å; E1469-F1473 WeakPolarHBondContact O-CD2 3.39Å; T1470-F1473 PolarHBondContact O-N 3.02Å
1474	L	88.7	Confident	89	Confident	4 Å²	4	22 Å²	22	2%	0.021	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	142.2	-178.5	-67.4	174.6	0	0	0	112.8	H1448 A1451 F1479 L1480 F1531 K1550	H1448-L1474 HydrophobicContact CB-CD2 4.38Å; H1448-L1474 WeakPolarHBondContact O-CA 3.46Å; H1448-L1474 WeakPolarHBondContact O-CD2 3.33Å; A1451-L1474 HydrophobicContact CB-CD1 4.45Å; A1451-L1474 HydrophobicContact CB-CD2 3.85Å; A1451-L1474 HydrophobicContact CB-CG 4.32Å; L1474-F1479 WeakPolarHBondContact CD1-O 3.46Å; L1474-F1479 VanDerWaalsContact CD2-O 3.28Å; L1474-F1479 WeakPolarHBondContact CD2-O 3.5Å; L1474-L1480 HydrophobicContact CD1-CB 4.39Å; L1474-F1531 HydrophobicContact CD1-CE1 4.23Å; L1474-K1550 HydrophobicContact CB-CD 4.17Å; L1474-K1550 PolarHBondContact O-NZ 3.27Å
1475	R	85.4	Confident	89.1	Confident	36 Å²	36	19.5 Å²	19.5	14%	0.136	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	161.5	166.7	72.9	176.5	177.6	94.2	4.4	111.3	N1374 N1375 N1447 H1448 D1449 D1477 G1478 K1550	N1374-R1475 PolarHBondContact O-NH2 3.21Å; N1375-R1475 PolarHBondContact OD1-NH2 3.33Å; N1447-R1475 HydrophobicContact CB-CB 4.29Å; H1448-R1475 PolarHBondContact O-N 3.01Å; D1449-R1475 WeakPolarHBondContact OD1-CD 3.46Å; D1449-R1475 IonicContact OD1-CZ 2.7Å; D1449-R1475 IonicContact OD1-NE 3.93Å; D1449-R1475 PolarHBondContact OD1-NE 3.33Å; D1449-R1475 IonicContact OD1-NH2 2.63Å; R1475-D1477 IonicContact CZ-OD1 2.96Å; R1475-D1477 IonicContact CZ-OD2 2.72Å; R1475-D1477 IonicContact NE-OD1 3.62Å; R1475-D1477 IonicContact NH1-OD1 3.92Å; R1475-D1477 PolarHBondContact NH1-OD1 2.85Å; R1475-D1477 IonicContact NH1-OD2 2.61Å; R1475-D1477 PolarHBondContact NH1-OD2 3.32Å; R1475-D1477 IonicContact NH2-OD2 2.73Å; R1475-D1477 PolarHBondContact O-N 2.97Å; R1475-G1478 PolarHBondContact O-N 3.11Å; R1475-K1550 WeakPolarHBondContact O-CD 3.16Å
1476	P	78.3	Confident	89.3	Confident	70 Å²	70	17.8 Å²	17.8	46%	0.455	9%	0.087	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-49.8	-35.9	-166.7	-31.8	37.6	0	0	0	115.9	K1550	P1476-K1550 VanDerWaalsContact O-CD 3.26Å; P1476-K1550 WeakPolarHBondContact O-CD 3.04Å; P1476-K1550 WeakPolarHBondContact O-CE 3.22Å; P1476-K1550 VanDerWaalsContact O-CG 3.22Å; P1476-K1550 WeakPolarHBondContact O-CG 3.09Å
1477	D	80.3	Confident	89.1	Confident	22 Å²	22	19.3 Å²	19.3	12%	0.118	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	16.5	-177.7	68	-51.4	0	0	0	113.3	R1475 R1549	R1475-D1477 IonicContact CZ-OD1 2.96Å; R1475-D1477 IonicContact CZ-OD2 2.72Å; R1475-D1477 IonicContact NE-OD1 3.62Å; R1475-D1477 IonicContact NH1-OD1 3.92Å; R1475-D1477 PolarHBondContact NH1-OD1 2.85Å; R1475-D1477 IonicContact NH1-OD2 2.61Å; R1475-D1477 PolarHBondContact NH1-OD2 3.32Å; R1475-D1477 IonicContact NH2-OD2 2.73Å; R1475-D1477 PolarHBondContact O-N 2.97Å; D1477-R1549 WeakPolarHBondContact O-CG 3.48Å; D1477-R1549 PolarHBondContact O-NE 3.31Å; D1477-R1549 IonicContact OD2-CZ 3.9Å; D1477-R1549 IonicContact OD2-NH2 2.61Å; D1477-R1549 PolarHBondContact OD2-NH2 3.49Å
1478	G	88.4	Confident	88.7	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	166.2	-176	0	0	0	0	0	114.9	R1475 K1550	R1475-G1478 PolarHBondContact O-N 3.11Å; G1478-K1550 VanDerWaalsContact O-CB 3.31Å; G1478-K1550 WeakPolarHBondContact O-CB 3.29Å; G1478-K1550 PolarHBondContact O-N 2.89Å
1479	F	94.1	Very high	88.4	Confident	0 Å²	0	18 Å²	18	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	156.3	-171.7	-66.5	-92.6	0	0	0	113.6	V1371 N1374 D1449 L1450 A1451 L1474 I1534 L1547 R1549	V1371-F1479 HydrophobicContact CB-CD2 4.35Å; V1371-F1479 HydrophobicContact CG1-CB 4.43Å; V1371-F1479 HydrophobicContact CG1-CD2 3.86Å; V1371-F1479 HydrophobicContact CG1-CE2 4.47Å; V1371-F1479 HydrophobicContact CG1-CG 4.33Å; V1371-F1479 HydrophobicContact CG2-CB 3.92Å; V1371-F1479 HydrophobicContact CG2-CD1 4.27Å; V1371-F1479 HydrophobicContact CG2-CD2 4.16Å; V1371-F1479 HydrophobicContact CG2-CG 3.87Å; N1374-F1479 HydrophobicContact CB-CE2 3.84Å; N1374-F1479 HydrophobicContact CB-CZ 3.7Å; D1449-F1479 PolarHBondContact O-N 3.12Å; L1450-F1479 WeakPolarHBondContact CA-O 3.48Å; L1450-F1479 HydrophobicContact CD1-CB 3.76Å; A1451-F1479 PolarHBondContact N-O 3.2Å; L1474-F1479 WeakPolarHBondContact CD1-O 3.46Å; L1474-F1479 VanDerWaalsContact CD2-O 3.28Å; L1474-F1479 WeakPolarHBondContact CD2-O 3.5Å; F1479-I1534 HydrophobicContact CE1-CG1 4.21Å; F1479-L1547 HydrophobicContact CB-CD1 4.09Å; F1479-L1547 HydrophobicContact CD1-CD1 4.06Å; F1479-L1547 HydrophobicContact CD1-CD2 4.08Å; F1479-L1547 HydrophobicContact CD1-CG 4.08Å; F1479-L1547 HydrophobicContact CE1-CD2 4.35Å; F1479-L1547 HydrophobicContact CG-CD1 4.45Å; F1479-R1549 HydrophobicContact CD1-CB 3.89Å; F1479-R1549 HydrophobicContact CD1-CG 3.92Å; F1479-R1549 HydrophobicContact CE1-CB 3.88Å; F1479-R1549 HydrophobicContact CE1-CG 3.74Å; F1479-R1549 HydrophobicContact CE2-CG 4.43Å; F1479-R1549 HydrophobicContact CG-CG 4.36Å; F1479-R1549 HydrophobicContact CZ-CG 4.01Å
1480	L	95.1	Very high	87.9	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	120.3	174.7	-179.7	60.6	0	0	0	109.3	A1451 L1453 L1467 T1470 L1474 V1482 F1531 I1548	A1451-L1480 HydrophobicContact CB-CD1 3.59Å; A1451-L1480 WeakPolarHBondContact O-CA 3.4Å; L1453-L1480 HydrophobicContact CD1-CD1 3.86Å; L1453-L1480 HydrophobicContact CD1-CD2 4.34Å; L1453-L1480 HydrophobicContact CG-CD1 3.97Å; L1467-L1480 HydrophobicContact CD2-CD2 3.65Å; T1470-L1480 HydrophobicContact CG2-CD1 3.94Å; T1470-L1480 HydrophobicContact CG2-CD2 4.46Å; L1474-L1480 HydrophobicContact CD1-CB 4.39Å; L1480-V1482 HydrophobicContact CD2-CG2 4.39Å; L1480-V1482 HydrophobicContact CG-CG2 4Å; L1480-F1531 HydrophobicContact CB-CE1 4.09Å; L1480-F1531 HydrophobicContact CD2-CE1 3.96Å; L1480-F1531 HydrophobicContact CD2-CE2 4.45Å; L1480-F1531 HydrophobicContact CD2-CZ 3.88Å; L1480-I1548 HydrophobicContact CB-CG1 3.88Å; L1480-I1548 HydrophobicContact CD2-CD1 4.12Å; L1480-I1548 HydrophobicContact CD2-CG1 4.37Å; L1480-I1548 HydrophobicContact CG-CD1 4.49Å; L1480-I1548 HydrophobicContact CG-CG1 4.31Å; L1480-I1548 PolarHBondContact N-O 3.42Å; L1480-I1548 PolarHBondContact O-N 3.34Å
1481	F	95.3	Very high	87.7	Confident	2 Å²	2	18.2 Å²	18.2	1%	0.009	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	127.2	172.3	-179.9	-76.6	0	0	0	108.9	V1364 I1367 F1392 L1450 A1451 I1452 L1453 N1483 V1545 Y1546	V1364-F1481 HydrophobicContact CG2-CZ 4.38Å; I1367-F1481 HydrophobicContact CD1-CE2 4.44Å; I1367-F1481 HydrophobicContact CG2-CD2 3.76Å; I1367-F1481 HydrophobicContact CG2-CE2 4.01Å; F1392-F1481 AromaticContact CE1-CE1 3.97Å; F1392-F1481 HydrophobicContact CE1-CE1 3.97Å; F1392-F1481 HydrophobicContact CE1-CZ 4.39Å; F1392-F1481 AromaticContact CZ-CE1 3.89Å; F1392-F1481 HydrophobicContact CZ-CE1 3.89Å; F1392-F1481 AromaticContact CZ-CZ 3.86Å; F1392-F1481 HydrophobicContact CZ-CZ 3.86Å; L1450-F1481 HydrophobicContact CD1-CB 4.1Å; A1451-F1481 PolarHBondContact O-N 2.8Å; I1452-F1481 HydrophobicContact CG1-CB 4.21Å; I1452-F1481 HydrophobicContact CG2-CD1 3.97Å; L1453-F1481 PolarHBondContact N-O 3.49Å; F1481-N1483 HydrophobicContact CE1-CB 3.97Å; F1481-V1545 HydrophobicContact CD2-CG1 4.16Å; F1481-V1545 HydrophobicContact CE1-CG1 4.19Å; F1481-V1545 HydrophobicContact CE2-CG1 3.45Å; F1481-V1545 VanDerWaalsContact CE2-CG1 3.45Å; F1481-V1545 HydrophobicContact CZ-CB 4.46Å; F1481-V1545 HydrophobicContact CZ-CG1 3.47Å; F1481-V1545 VanDerWaalsContact CZ-CG1 3.47Å; F1481-V1545 HydrophobicContact CZ-CG2 4.08Å; F1481-Y1546 WeakPolarHBondContact CA-O 3.31Å
1482	V	94.4	Very high	87.3	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	121.7	177.9	-173.9	0	0	0	0	109.2	L1453 L1457 L1480 E1484 F1526 V1545 Y1546	L1453-V1482 WeakPolarHBondContact O-CA 3.38Å; L1457-V1482 HydrophobicContact CD1-CG1 3.95Å; L1480-V1482 HydrophobicContact CD2-CG2 4.39Å; L1480-V1482 HydrophobicContact CG-CG2 4Å; V1482-E1484 HydrophobicContact CG1-CB 4.42Å; V1482-E1484 HydrophobicContact CG1-CG 4.01Å; V1482-F1526 HydrophobicContact CB-CZ 4.36Å; V1482-F1526 HydrophobicContact CG1-CZ 4.27Å; V1482-F1526 HydrophobicContact CG2-CE1 4.3Å; V1482-F1526 HydrophobicContact CG2-CZ 4.38Å; V1482-V1545 CarbonylContact O-C 3.49Å; V1482-V1545 WeakPolarHBondContact O-CA 3.5Å; V1482-Y1546 HydrophobicContact CB-CD2 4.46Å; V1482-Y1546 PolarHBondContact N-O 3.44Å; V1482-Y1546 PolarHBondContact O-N 3.27Å
1483	N	92.9	Very high	86.8	Confident	0 Å²	0	12.7 Å²	12.7	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	117.6	168.4	178.2	48.5	0	0	0	108.7	S1358 L1453 D1454 R1455 F1481 Q1543 V1545	S1358-N1483 PolarHBondContact OG-OD1 3.33Å; L1453-N1483 PolarHBondContact O-N 3.07Å; D1454-N1483 PolarHBondContact OD1-ND2 2.99Å; R1455-N1483 PolarHBondContact N-O 2.96Å; F1481-N1483 HydrophobicContact CE1-CB 3.97Å; N1483-Q1543 PolarHBondContact ND2-OE1 2.85Å; N1483-Q1543 PolarHBondContact OD1-OE1 3.11Å; N1483-V1545 HydrophobicContact CB-CG2 4.15Å
1484	E	92.1	Very high	86.3	Confident	1 Å²	1	12.8 Å²	12.8	1%	0.005	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	159	-175.5	-93.1	-62.8	174.4	0	0	113.8	R1455 V1456 L1457 C1458 V1482 W1522 Q1543 T1544	R1455-E1484 WeakPolarHBondContact CA-OE1 3.14Å; V1456-E1484 PolarHBondContact N-OE1 3.42Å; L1457-E1484 HydrophobicContact CB-CG 4.45Å; L1457-E1484 PolarHBondContact N-OE1 3.21Å; C1458-E1484 WeakPolarHBondContact CB-OE2 3.18Å; C1458-E1484 PolarHBondContact N-OE1 3.49Å; V1482-E1484 HydrophobicContact CG1-CB 4.42Å; V1482-E1484 HydrophobicContact CG1-CG 4.01Å; E1484-W1522 HydrophobicContact CB-CZ2 3.86Å; E1484-W1522 HydrophobicContact CG-CH2 3.93Å; E1484-W1522 HydrophobicContact CG-CZ2 3.71Å; E1484-Q1543 WeakPolarHBondContact O-CA 3.43Å; E1484-T1544 PolarHBondContact N-O 3.45Å; E1484-T1544 PolarHBondContact O-N 3.25Å
1485	F	89.3	Confident	86	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	126.6	178.7	-67	-82.5	0	0	0	111.4	W1355 R1455 A1492 M1496 F1516 M1542 Q1543	W1355-F1485 HydrophobicContact CE3-CZ 4.35Å; W1355-F1485 AromaticContact CH2-CZ 3.71Å; W1355-F1485 HydrophobicContact CH2-CZ 3.71Å; W1355-F1485 HydrophobicContact CZ2-CZ 4.38Å; W1355-F1485 HydrophobicContact CZ3-CE1 4.12Å; W1355-F1485 AromaticContact CZ3-CZ 3.67Å; W1355-F1485 HydrophobicContact CZ3-CZ 3.67Å; R1455-F1485 HydrophobicContact CB-CE2 4.02Å; R1455-F1485 HydrophobicContact CG-CD2 4.18Å; R1455-F1485 HydrophobicContact CG-CE2 3.68Å; R1455-F1485 HydrophobicContact CG-CZ 4.28Å; F1485-A1492 HydrophobicContact CD1-CB 3.44Å; F1485-A1492 VanDerWaalsContact CD1-CB 3.44Å; F1485-A1492 HydrophobicContact CE1-CB 3.73Å; F1485-A1492 HydrophobicContact CG-CB 4.04Å; F1485-M1496 HydrophobicContact CE2-CG 4.41Å; F1485-M1496 HydrophobicContact CE2-SD 4.3Å; F1485-F1516 HydrophobicContact CB-CD1 3.64Å; F1485-F1516 HydrophobicContact CB-CE1 3.95Å; F1485-F1516 HydrophobicContact CB-CG 4.34Å; F1485-F1516 HydrophobicContact CD2-CD1 4.18Å; F1485-F1516 AromaticContact CD2-CE1 3.69Å; F1485-F1516 HydrophobicContact CD2-CE1 3.69Å; F1485-F1516 HydrophobicContact CE2-CE1 4.45Å; F1485-F1516 HydrophobicContact CG-CD1 4.18Å; F1485-F1516 AromaticContact CG-CE1 3.96Å; F1485-F1516 HydrophobicContact CG-CE1 3.96Å; F1485-M1542 HydrophobicContact CD1-CG 3.72Å; F1485-M1542 HydrophobicContact CD1-SD 4.28Å; F1485-M1542 HydrophobicContact CE1-CE 4.25Å; F1485-M1542 HydrophobicContact CE1-CG 3.91Å; F1485-M1542 HydrophobicContact CE1-SD 3.91Å; F1485-Q1543 HydrophobicContact CD1-CG 3.9Å; F1485-Q1543 HydrophobicContact CE1-CG 4.05Å; F1485-Q1543 HydrophobicContact CG-CG 4.43Å
1486	T	89.8	Confident	85.5	Confident	7 Å²	7	11.1 Å²	11.1	4%	0.043	7%	0.069	C	C	.	.			trans	-135.8	-5.6	-175.2	53	0	0	0	0	113.8	M1542 T1544	T1486-M1542 PolarHBondContact N-O 2.78Å; T1486-T1544 WeakPolarHBondContact CG2-OG1 3.4Å; T1486-T1544 PolarHBondContact OG1-N 3.32Å; T1486-T1544 PolarHBondContact OG1-OG1 2.99Å
1487	S	85.7	Confident	85.2	Confident	35 Å²	35	8.4 Å²	8.4	25%	0.245	5%	0.053	C	C	.	.	S	Bend	trans	-154.4	167.5	-177.6	-66.4	0	0	0	0	110	F1489 M1542	S1487-F1489 VanDerWaalsContact C-N 3.33Å; S1487-F1489 PolarHBondContact O-N 3.4Å; S1487-M1542 PolarHBondContact N-O 2.94Å; S1487-M1542 VanDerWaalsContact N-O 3.1Å; S1487-M1542 WeakPolarHBondContact O-CA 3.41Å
1488	N	81.6	Confident	85	Confident	40 Å²	40	7.7 Å²	7.7	21%	0.214	5%	0.049	C	C	.	.			trans	45.3	51.2	-177.6	-155.8	-16.3	0	0	0	114.6	E1270 A1490 L1491 A1492 M1541	E1270-N1488 PolarHBondContact OE1-ND2 2.97Å; N1488-A1490 PolarHBondContact O-N 3.35Å; N1488-A1490 VanDerWaalsContact O-N 3.09Å; N1488-L1491 PolarHBondContact O-N 3.4Å; N1488-A1492 PolarHBondContact O-N 3.37Å; N1488-M1541 VanDerWaalsContact CB-O 3.25Å; N1488-M1541 WeakPolarHBondContact CB-O 3.48Å
1489	F	81.8	Confident	84.1	Confident	22 Å²	22	8.5 Å²	8.5	10%	0.096	6%	0.057	C	C	.	.	H	α-helix	trans	-58.5	-25.4	-175	-53.6	-57	0	0	0	113.8	S1487 S1493 Y1512 F1516 E1518	S1487-F1489 VanDerWaalsContact C-N 3.33Å; S1487-F1489 PolarHBondContact O-N 3.4Å; F1489-S1493 VanDerWaalsContact O-CB 3.27Å; F1489-S1493 WeakPolarHBondContact O-CB 3.27Å; F1489-S1493 PolarHBondContact O-N 3.44Å; F1489-S1493 PolarHBondContact O-OG 2.79Å; F1489-Y1512 HydrophobicContact CB-CD1 3.91Å; F1489-Y1512 HydrophobicContact CB-CE1 4.29Å; F1489-Y1512 AromaticContact CD2-CD1 3.46Å; F1489-Y1512 HydrophobicContact CD2-CD1 3.46Å; F1489-Y1512 VanDerWaalsContact CD2-CD1 3.46Å; F1489-Y1512 HydrophobicContact CD2-CD2 4.29Å; F1489-Y1512 AromaticContact CD2-CE1 3.84Å; F1489-Y1512 HydrophobicContact CD2-CE1 3.84Å; F1489-Y1512 AromaticContact CD2-CG 3.74Å; F1489-Y1512 HydrophobicContact CD2-CG 3.74Å; F1489-Y1512 HydrophobicContact CE2-CD1 4.25Å; F1489-Y1512 HydrophobicContact CE2-CD2 4.34Å; F1489-Y1512 HydrophobicContact CE2-CG 4.06Å; F1489-Y1512 AromaticContact CG-CD1 3.92Å; F1489-Y1512 HydrophobicContact CG-CD1 3.92Å; F1489-Y1512 HydrophobicContact CG-CE1 4.47Å; F1489-Y1512 HydrophobicContact CG-CG 4.4Å; F1489-F1516 HydrophobicContact CD1-CB 3.74Å; F1489-F1516 HydrophobicContact CD1-CD2 4.31Å; F1489-F1516 HydrophobicContact CD1-CG 4.21Å; F1489-F1516 HydrophobicContact CE1-CB 3.92Å; F1489-E1518 HydrophobicContact CE2-CG 4.36Å; F1489-E1518 HydrophobicContact CZ-CG 4.11Å
1490	A	77.4	Confident	82.7	Confident	27 Å²	27	10.7 Å²	10.7	22%	0.223	7%	0.072	C	C	.	.	H	α-helix	trans	-64	-47.8	178.9	0	0	0	0	0	112.5	I1293 N1488 V1494	I1293-A1490 HydrophobicContact CG2-CB 4.22Å; N1488-A1490 PolarHBondContact O-N 3.35Å; N1488-A1490 VanDerWaalsContact O-N 3.09Å; A1490-V1494 PolarHBondContact O-N 3.38Å
1491	L	84.2	Confident	80.7	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-69.6	-44.1	177	-179.3	61.4	0	0	0	111.1	C1269 L1273 I1318 L1322 L1354 N1488 S1493 V1494 L1495 M1542	C1269-L1491 HydrophobicContact CB-CD2 4.35Å; L1273-L1491 HydrophobicContact CD2-CB 4.05Å; L1273-L1491 HydrophobicContact CD2-CD1 3.97Å; I1318-L1491 HydrophobicContact CG2-CD1 4.25Å; L1322-L1491 HydrophobicContact CD1-CD1 4.49Å; L1354-L1491 HydrophobicContact CD2-CD2 3.79Å; N1488-L1491 PolarHBondContact O-N 3.4Å; L1491-S1493 PolarHBondContact O-N 2.96Å; L1491-V1494 PolarHBondContact O-N 3.1Å; L1491-L1495 HydrophobicContact CD1-CD1 3.97Å; L1491-L1495 HydrophobicContact CD1-CG 4.23Å; L1491-L1495 HydrophobicContact CG-CD1 3.93Å; L1491-L1495 WeakPolarHBondContact O-CG 3.18Å; L1491-L1495 PolarHBondContact O-N 3.47Å; L1491-L1495 VanDerWaalsContact O-N 3.15Å; L1491-M1542 HydrophobicContact CD2-SD 4.38Å
1492	A	81.8	Confident	78.7	Confident	0 Å²	0	19 Å²	19	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-58.4	-44.7	178.1	0	0	0	0	0	112.9	F1485 N1488 V1494 M1496 F1516 M1542	F1485-A1492 HydrophobicContact CD1-CB 3.44Å; F1485-A1492 VanDerWaalsContact CD1-CB 3.44Å; F1485-A1492 HydrophobicContact CE1-CB 3.73Å; F1485-A1492 HydrophobicContact CG-CB 4.04Å; N1488-A1492 PolarHBondContact O-N 3.37Å; A1492-V1494 PolarHBondContact O-N 2.99Å; A1492-M1496 WeakPolarHBondContact O-CB 3.38Å; A1492-M1496 VanDerWaalsContact O-CG 3.3Å; A1492-M1496 WeakPolarHBondContact O-CG 3.17Å; A1492-M1496 PolarHBondContact O-N 2.74Å; A1492-F1516 HydrophobicContact CB-CE2 4.25Å; A1492-F1516 HydrophobicContact CB-CZ 4.12Å; A1492-M1542 HydrophobicContact CB-SD 4.42Å
1493	S	77.1	Confident	76.6	Confident	1 Å²	1	20.7 Å²	20.7	1%	0.007	16%	0.155	C	C	.	.	H	α-helix	trans	-56.7	-49.8	176.9	-71.4	0	0	0	0	112.5	F1489 L1491 M1496 A1497 F1516	F1489-S1493 VanDerWaalsContact O-CB 3.27Å; F1489-S1493 WeakPolarHBondContact O-CB 3.27Å; F1489-S1493 PolarHBondContact O-N 3.44Å; F1489-S1493 PolarHBondContact O-OG 2.79Å; L1491-S1493 PolarHBondContact O-N 2.96Å; S1493-M1496 PolarHBondContact O-N 2.68Å; S1493-A1497 WeakPolarHBondContact O-CB 3.38Å; S1493-A1497 PolarHBondContact O-N 2.89Å; S1493-F1516 WeakPolarHBondContact OG-CE2 3.27Å
1494	V	78.6	Confident	74.7	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-66.9	-43.1	-175.8	172.8	0	0	0	0	111.3	L1273 L1284 L1288 I1293 A1490 L1491 A1492 M1496 A1497 I1498	L1273-V1494 HydrophobicContact CD1-CB 4.02Å; L1273-V1494 HydrophobicContact CD1-CG1 3.88Å; L1273-V1494 HydrophobicContact CD1-CG2 4.08Å; L1284-V1494 HydrophobicContact CD2-CG1 4.11Å; L1288-V1494 HydrophobicContact CD1-CB 4.48Å; L1288-V1494 HydrophobicContact CD1-CG2 3.92Å; I1293-V1494 HydrophobicContact CD1-CG2 4.21Å; A1490-V1494 PolarHBondContact O-N 3.38Å; L1491-V1494 PolarHBondContact O-N 3.1Å; A1492-V1494 PolarHBondContact O-N 2.99Å; V1494-M1496 VanDerWaalsContact C-N 3.34Å; V1494-M1496 PolarHBondContact O-N 3.48Å; V1494-A1497 PolarHBondContact O-N 3.47Å; V1494-I1498 HydrophobicContact CG1-CD1 3.98Å; V1494-I1498 WeakPolarHBondContact O-CD1 3.25Å; V1494-I1498 VanDerWaalsContact O-CG1 3.31Å; V1494-I1498 WeakPolarHBondContact O-CG1 3.41Å; V1494-I1498 PolarHBondContact O-N 2.85Å
1495	L	81.7	Confident	72.8	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.1	-39.6	176.6	-65.3	174	0	0	0	112.1	I1318 L1321 F1345 W1355 L1491 I1498 G1499	I1318-L1495 HydrophobicContact CD1-CD1 3.7Å; I1318-L1495 HydrophobicContact CG1-CD1 3.96Å; I1318-L1495 HydrophobicContact CG1-CD2 4.26Å; I1318-L1495 HydrophobicContact CG2-CD2 4.39Å; L1321-L1495 HydrophobicContact CD2-CD2 3.75Å; F1345-L1495 HydrophobicContact CE1-CB 4.26Å; F1345-L1495 HydrophobicContact CE2-CD2 4.12Å; F1345-L1495 HydrophobicContact CZ-CB 4.02Å; F1345-L1495 HydrophobicContact CZ-CD2 3.94Å; F1345-L1495 HydrophobicContact CZ-CG 4.39Å; W1355-L1495 HydrophobicContact CE3-CD1 3.77Å; W1355-L1495 HydrophobicContact CH2-CB 4.2Å; W1355-L1495 HydrophobicContact CZ3-CB 3.71Å; W1355-L1495 HydrophobicContact CZ3-CD1 3.64Å; W1355-L1495 HydrophobicContact CZ3-CG 4.31Å; L1491-L1495 HydrophobicContact CD1-CD1 3.97Å; L1491-L1495 HydrophobicContact CD1-CG 4.23Å; L1491-L1495 HydrophobicContact CG-CD1 3.93Å; L1491-L1495 WeakPolarHBondContact O-CG 3.18Å; L1491-L1495 PolarHBondContact O-N 3.47Å; L1491-L1495 VanDerWaalsContact O-N 3.15Å; L1495-I1498 PolarHBondContact O-N 2.97Å; L1495-G1499 PolarHBondContact O-N 3.25Å
1496	M	76.7	Confident	71.2	Confident	5 Å²	5	32 Å²	32	3%	0.025	23%	0.232	C	C	.	.	H	α-helix	trans	-70.1	-37.8	177.3	-72.2	-69.9	-74.9	0	0	113.1	W1355 K1459 F1485 A1492 S1493 V1494 I1498 G1499 S1500 M1515 F1516	W1355-M1496 HydrophobicContact CH2-SD 4.21Å; K1459-M1496 HydrophobicContact CG-CE 4.23Å; F1485-M1496 HydrophobicContact CE2-CG 4.41Å; F1485-M1496 HydrophobicContact CE2-SD 4.3Å; A1492-M1496 WeakPolarHBondContact O-CB 3.38Å; A1492-M1496 VanDerWaalsContact O-CG 3.3Å; A1492-M1496 WeakPolarHBondContact O-CG 3.17Å; A1492-M1496 PolarHBondContact O-N 2.74Å; S1493-M1496 PolarHBondContact O-N 2.68Å; V1494-M1496 VanDerWaalsContact C-N 3.34Å; V1494-M1496 PolarHBondContact O-N 3.48Å; M1496-I1498 VanDerWaalsContact C-N 3.28Å; M1496-I1498 PolarHBondContact O-N 3.09Å; M1496-G1499 PolarHBondContact O-N 3.06Å; M1496-S1500 PolarHBondContact O-N 3.18Å; M1496-M1515 HydrophobicContact CB-CE 4.05Å; M1496-M1515 HydrophobicContact CE-CE 4.06Å; M1496-F1516 HydrophobicContact CB-CZ 4.45Å; M1496-F1516 HydrophobicContact CG-CZ 4.06Å
1497	A	71.8	Confident	69.7	Low	14 Å²	14	39.5 Å²	39.5	12%	0.116	27%	0.266	C	S	.	.	H	α-helix	trans	-70.4	-22.4	177.2	0	0	0	0	0	114	R1287 L1288 S1493 V1494	R1287-A1497 HydrophobicContact CB-CB 4.23Å; R1287-A1497 WeakPolarHBondContact CD-O 3.37Å; R1287-A1497 PolarHBondContact NH1-O 3.09Å; L1288-A1497 HydrophobicContact CD1-CB 3.59Å; L1288-A1497 HydrophobicContact CD2-CB 4.07Å; L1288-A1497 HydrophobicContact CG-CB 3.68Å; S1493-A1497 WeakPolarHBondContact O-CB 3.38Å; S1493-A1497 PolarHBondContact O-N 2.89Å; V1494-A1497 PolarHBondContact O-N 3.47Å
1498	I	74.6	Confident	68.6	Low	7 Å²	7	40.5 Å²	40.5	4%	0.036	27%	0.269	C	S	.	.	H	α-helix	trans	-77.4	-49.1	168	-64	160.1	0	0	0	109.6	L1321 L1325 S1342 V1494 L1495 M1496 S1500	L1321-I1498 HydrophobicContact CD1-CG2 4.44Å; L1321-I1498 HydrophobicContact CD2-CD1 3.98Å; L1321-I1498 HydrophobicContact CD2-CG2 4.36Å; L1325-I1498 HydrophobicContact CD1-CD1 3.69Å; S1342-I1498 VanDerWaalsContact CB-O 3.25Å; S1342-I1498 WeakPolarHBondContact CB-O 3.46Å; S1342-I1498 PolarHBondContact OG-O 2.99Å; V1494-I1498 HydrophobicContact CG1-CD1 3.98Å; V1494-I1498 WeakPolarHBondContact O-CD1 3.25Å; V1494-I1498 VanDerWaalsContact O-CG1 3.31Å; V1494-I1498 WeakPolarHBondContact O-CG1 3.41Å; V1494-I1498 PolarHBondContact O-N 2.85Å; L1495-I1498 PolarHBondContact O-N 2.97Å; M1496-I1498 VanDerWaalsContact C-N 3.28Å; M1496-I1498 PolarHBondContact O-N 3.09Å; I1498-S1500 PolarHBondContact O-N 3.49Å
1499	G	69.9	Low	67.7	Low	16 Å²	16	48 Å²	48	17%	0.165	30%	0.303	C	S	.	.	H	α-helix	trans	-76.4	-14.4	-174	0	0	0	0	0	116.8	L1495 M1496	L1495-G1499 PolarHBondContact O-N 3.25Å; M1496-G1499 PolarHBondContact O-N 3.06Å
1500	S	65.7	Low	66.9	Low	46 Å²	46	50.4 Å²	50.4	32%	0.322	32%	0.322	S	S	.	.			trans	-155.2	104.1	-179.3	-169.3	0	0	0	0	112.6	M1496 I1498 G1502	M1496-S1500 PolarHBondContact O-N 3.18Å; I1498-S1500 PolarHBondContact O-N 3.49Å; S1500-G1502 PolarHBondContact O-N 3.47Å
1501	P	52.6	Low	66.6	Low	96 Å²	96	50.4 Å²	50.4	62%	0.623	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	110.5	176.6	28.9	-32.2	0	0	0	111.5
1502	G	53.9	Low	65.7	Low	82 Å²	82	55.8 Å²	55.8	85%	0.845	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	125.3	12.5	167.3	0	0	0	0	0	117.9	S1500	S1500-G1502 PolarHBondContact O-N 3.47Å
1503	A	49.5	Very low	65.1	Low	34 Å²	34	57 Å²	57	28%	0.281	34%	0.343	S	S	.	.			trans	-88.6	137.2	178.6	0	0	0	0	0	113.2	M1515	A1503-M1515 HydrophobicContact CB-CE 3.67Å; A1503-M1515 HydrophobicContact CB-SD 4.2Å
1504	G	52.6	Low	64.6	Low	43 Å²	43	57.1 Å²	57.1	44%	0.443	35%	0.345	S	S	.	.			trans	102.5	128.7	170.5	0	0	0	0	0	115.4
1505	D	52.7	Low	64.3	Low	82 Å²	82	57.7 Å²	57.7	44%	0.439	35%	0.348	S	S	.	.			trans	-92.2	120.6	161.7	-171.8	-37.4	0	0	0	108.2	Q1507	D1505-Q1507 PolarHBondContact O-N 3.33Å; D1505-Q1507 WeakPolarHBondContact OD1-CB 3.43Å; D1505-Q1507 PolarHBondContact OD1-N 2.73Å
1506	P	55.4	Low	64.4	Low	113 Å²	113	57.7 Å²	57.7	73%	0.734	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-10.7	-178.5	-24.2	35	0	0	0	115.7
1507	Q	57.6	Low	64.9	Low	166 Å²	166	57.9 Å²	57.9	78%	0.776	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-8.6	-172.8	-56.1	-164.8	22.7	0	0	115.2	D1505 Q1509	D1505-Q1507 PolarHBondContact O-N 3.33Å; D1505-Q1507 WeakPolarHBondContact OD1-CB 3.43Å; D1505-Q1507 PolarHBondContact OD1-N 2.73Å; Q1507-Q1509 PolarHBondContact O-N 3.48Å
1508	D	63.4	Low	65.7	Low	55 Å²	55	62.2 Å²	62.2	29%	0.294	37%	0.367	S	S	.	.			trans	-71.9	97.4	177.3	-175	-4.5	0	0	0	111.5	S1510 R1511	D1508-S1510 VanDerWaalsContact CG-OG 3.28Å; D1508-S1510 PolarHBondContact O-N 3.23Å; D1508-S1510 VanDerWaalsContact OD1-CB 3.31Å; D1508-S1510 WeakPolarHBondContact OD1-CB 3.49Å; D1508-S1510 PolarHBondContact OD1-N 2.93Å; D1508-S1510 PolarHBondContact OD1-OG 3.2Å; D1508-S1510 PolarHBondContact OD2-OG 3.39Å; D1508-R1511 PolarHBondContact O-N 3.49Å; D1508-R1511 WeakPolarHBondContact OD2-CD 3.38Å; D1508-R1511 IonicContact OD2-CZ 3.73Å; D1508-R1511 IonicContact OD2-NE 3.48Å; D1508-R1511 PolarHBondContact OD2-NE 2.82Å; D1508-R1511 IonicContact OD2-NH2 3.89Å
1509	Q	63.6	Low	66.4	Low	198 Å²	198	62.5 Å²	62.5	93%	0.925	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-8.3	179.7	-63.3	-170.5	5.2	0	0	114.3	Q1507 R1511	Q1507-Q1509 PolarHBondContact O-N 3.48Å; Q1509-R1511 VanDerWaalsContact C-N 3.29Å
1510	S	64.6	Low	67.3	Low	73 Å²	73	66.3 Å²	66.3	51%	0.51	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-15.1	174.7	73.5	0	0	0	0	113.2	D1508 L1517	D1508-S1510 VanDerWaalsContact CG-OG 3.28Å; D1508-S1510 PolarHBondContact O-N 3.23Å; D1508-S1510 VanDerWaalsContact OD1-CB 3.31Å; D1508-S1510 WeakPolarHBondContact OD1-CB 3.49Å; D1508-S1510 PolarHBondContact OD1-N 2.93Å; D1508-S1510 PolarHBondContact OD1-OG 3.2Å; D1508-S1510 PolarHBondContact OD2-OG 3.39Å; S1510-L1517 WeakPolarHBondContact O-CD2 3.34Å
1511	R	70.3	Confident	68.5	Low	26 Å²	26	66.9 Å²	66.9	10%	0.098	38%	0.384	C	S	.	.	S	Bend	trans	-116.2	142.4	-174.5	-58.4	179.9	-161	-145.7	8	111.4	K1460 K1461 D1508 Q1509 E1513 G1514 F1516 L1517	K1460-R1511 PolarHBondContact O-NH1 2.84Å; K1460-R1511 PolarHBondContact O-NH2 3.16Å; K1461-R1511 PolarHBondContact O-NH2 3.24Å; D1508-R1511 PolarHBondContact O-N 3.49Å; D1508-R1511 WeakPolarHBondContact OD2-CD 3.38Å; D1508-R1511 IonicContact OD2-CZ 3.73Å; D1508-R1511 IonicContact OD2-NE 3.48Å; D1508-R1511 PolarHBondContact OD2-NE 2.82Å; D1508-R1511 IonicContact OD2-NH2 3.89Å; Q1509-R1511 VanDerWaalsContact C-N 3.29Å; R1511-E1513 VanDerWaalsContact C-N 3.32Å; R1511-E1513 PolarHBondContact O-N 3.39Å; R1511-G1514 VanDerWaalsContact CD-C 3.5Å; R1511-G1514 WeakPolarHBondContact CD-O 3.44Å; R1511-F1516 CarbonylContact C-O 3.57Å; R1511-F1516 WeakPolarHBondContact CA-O 3.44Å; R1511-F1516 WeakPolarHBondContact CB-O 3.4Å; R1511-L1517 HydrophobicContact CB-CD2 4.49Å; R1511-L1517 HydrophobicContact CG-CD2 3.91Å; R1511-L1517 HydrophobicContact CG-CG 4.2Å
1512	Y	66.8	Low	70.3	Confident	113 Å²	113	62.3 Å²	62.3	44%	0.443	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-40.6	-175.4	-163.6	-100.1	0	0	0	112.3	K1292 F1489 F1516	K1292-Y1512 WeakPolarHBondContact CE-O 3.2Å; K1292-Y1512 PolarHBondContact NZ-O 3.05Å; F1489-Y1512 HydrophobicContact CB-CD1 3.91Å; F1489-Y1512 HydrophobicContact CB-CE1 4.29Å; F1489-Y1512 AromaticContact CD2-CD1 3.46Å; F1489-Y1512 HydrophobicContact CD2-CD1 3.46Å; F1489-Y1512 VanDerWaalsContact CD2-CD1 3.46Å; F1489-Y1512 HydrophobicContact CD2-CD2 4.29Å; F1489-Y1512 AromaticContact CD2-CE1 3.84Å; F1489-Y1512 HydrophobicContact CD2-CE1 3.84Å; F1489-Y1512 AromaticContact CD2-CG 3.74Å; F1489-Y1512 HydrophobicContact CD2-CG 3.74Å; F1489-Y1512 HydrophobicContact CE2-CD1 4.25Å; F1489-Y1512 HydrophobicContact CE2-CD2 4.34Å; F1489-Y1512 HydrophobicContact CE2-CG 4.06Å; F1489-Y1512 AromaticContact CG-CD1 3.92Å; F1489-Y1512 HydrophobicContact CG-CD1 3.92Å; F1489-Y1512 HydrophobicContact CG-CE1 4.47Å; F1489-Y1512 HydrophobicContact CG-CG 4.4Å; Y1512-F1516 PolarHBondContact N-O 3.05Å
1513	E	67.3	Low	72.1	Confident	25 Å²	25	60.8 Å²	60.8	12%	0.117	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.9	17.7	-179.7	-69.7	-74	-166.2	0	0	113.2	K1292 R1511 M1515 F1516	K1292-E1513 WeakPolarHBondContact CB-OE1 3.42Å; K1292-E1513 WeakPolarHBondContact CD-OE2 3.36Å; K1292-E1513 IonicContact NZ-OE2 3.99Å; R1511-E1513 VanDerWaalsContact C-N 3.32Å; R1511-E1513 PolarHBondContact O-N 3.39Å; E1513-M1515 PolarHBondContact O-N 3.04Å; E1513-M1515 VanDerWaalsContact O-N 3.11Å; E1513-F1516 HydrophobicContact CB-CD2 4.25Å
1514	G	68.2	Low	74	Confident	5 Å²	5	64.8 Å²	64.8	5%	0.052	34%	0.338	C	S	.	.	S	Bend	trans	70.8	-6.4	-166.5	0	0	0	0	0	114.1	R1511	R1511-G1514 VanDerWaalsContact CD-C 3.5Å; R1511-G1514 WeakPolarHBondContact CD-O 3.44Å
1515	M	72.4	Confident	75.8	Confident	13 Å²	13	64.1 Å²	64.1	6%	0.064	32%	0.324	C	S	.	.	S	Bend	trans	-114.7	-46.1	177.4	-64.3	-178.3	63.1	0	0	113.4	C1458 M1496 A1503 E1513	C1458-M1515 WeakPolarHBondContact CA-O 3.43Å; M1496-M1515 HydrophobicContact CB-CE 4.05Å; M1496-M1515 HydrophobicContact CE-CE 4.06Å; A1503-M1515 HydrophobicContact CB-CE 3.67Å; A1503-M1515 HydrophobicContact CB-SD 4.2Å; E1513-M1515 PolarHBondContact O-N 3.04Å; E1513-M1515 VanDerWaalsContact O-N 3.11Å
1516	F	84	Confident	77.7	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.303	C	S	.	.			trans	-108.5	156.7	-167	-50	-62	0	0	0	114.7	C1458 F1485 F1489 A1492 S1493 M1496 R1511 Y1512 E1513	C1458-F1516 HydrophobicContact CB-CD1 3.9Å; C1458-F1516 HydrophobicContact CB-CE1 3.98Å; F1485-F1516 HydrophobicContact CB-CD1 3.64Å; F1485-F1516 HydrophobicContact CB-CE1 3.95Å; F1485-F1516 HydrophobicContact CB-CG 4.34Å; F1485-F1516 HydrophobicContact CD2-CD1 4.18Å; F1485-F1516 AromaticContact CD2-CE1 3.69Å; F1485-F1516 HydrophobicContact CD2-CE1 3.69Å; F1485-F1516 HydrophobicContact CE2-CE1 4.45Å; F1485-F1516 HydrophobicContact CG-CD1 4.18Å; F1485-F1516 AromaticContact CG-CE1 3.96Å; F1485-F1516 HydrophobicContact CG-CE1 3.96Å; F1489-F1516 HydrophobicContact CD1-CB 3.74Å; F1489-F1516 HydrophobicContact CD1-CD2 4.31Å; F1489-F1516 HydrophobicContact CD1-CG 4.21Å; F1489-F1516 HydrophobicContact CE1-CB 3.92Å; A1492-F1516 HydrophobicContact CB-CE2 4.25Å; A1492-F1516 HydrophobicContact CB-CZ 4.12Å; S1493-F1516 WeakPolarHBondContact OG-CE2 3.27Å; M1496-F1516 HydrophobicContact CB-CZ 4.45Å; M1496-F1516 HydrophobicContact CG-CZ 4.06Å; R1511-F1516 CarbonylContact C-O 3.57Å; R1511-F1516 WeakPolarHBondContact CA-O 3.44Å; R1511-F1516 WeakPolarHBondContact CB-O 3.4Å; Y1512-F1516 PolarHBondContact N-O 3.05Å; E1513-F1516 HydrophobicContact CB-CD2 4.25Å
1517	L	86.7	Confident	79.3	Confident	8 Å²	8	59.2 Å²	59.2	4%	0.042	29%	0.291	C	S	.	.			trans	-132.4	149.1	-176.3	-73.3	168.4	0	0	0	111.4	I1463 S1510 R1511 N1521 W1522 L1525	I1463-L1517 HydrophobicContact CD1-CD1 3.94Å; S1510-L1517 WeakPolarHBondContact O-CD2 3.34Å; R1511-L1517 HydrophobicContact CB-CD2 4.49Å; R1511-L1517 HydrophobicContact CG-CD2 3.91Å; R1511-L1517 HydrophobicContact CG-CG 4.2Å; L1517-N1521 HydrophobicContact CD2-CB 4.15Å; L1517-W1522 HydrophobicContact CB-CD2 4.45Å; L1517-W1522 HydrophobicContact CB-CZ2 4.24Å; L1517-W1522 HydrophobicContact CD1-CD2 4.37Å; L1517-W1522 HydrophobicContact CD1-CH2 4.24Å; L1517-W1522 HydrophobicContact CD1-CZ2 4.13Å; L1517-W1522 HydrophobicContact CD1-CZ3 4.44Å; L1517-W1522 PolarHBondContact O-NE1 2.68Å; L1517-L1525 HydrophobicContact CD1-CD1 3.5Å; L1517-L1525 VanDerWaalsContact CD1-CD1 3.5Å
1518	E	87.4	Confident	80.8	Confident	106 Å²	106	57.2 Å²	57.2	50%	0.495	28%	0.282	S	S	.	.			trans	-76.9	158.4	171.3	-64.5	-177.2	165.4	0	0	111.8	F1489 D1520 N1521 W1522	F1489-E1518 HydrophobicContact CE2-CG 4.36Å; F1489-E1518 HydrophobicContact CZ-CG 4.11Å; E1518-D1520 PolarHBondContact O-N 3.04Å; E1518-N1521 PolarHBondContact O-N 3.26Å; E1518-W1522 PolarHBondContact O-N 2.89Å
1519	H	90.6	Very high	82.1	Confident	12 Å²	12	54.7 Å²	54.7	6%	0.056	27%	0.269	C	S	.	.	H	α-helix	trans	-48.4	-51.6	-177.5	179.6	72.1	0	0	0	113.3	N1521 W1522 L1523 Y1536 Y1546	H1519-N1521 PolarHBondContact O-N 3.18Å; H1519-N1521 VanDerWaalsContact O-N 3.1Å; H1519-W1522 WeakPolarHBondContact O-CB 3.22Å; H1519-W1522 PolarHBondContact O-N 2.69Å; H1519-W1522 VanDerWaalsContact O-N 3.09Å; H1519-L1523 PolarHBondContact O-N 3.25Å; H1519-Y1536 AromaticContact CE1-CD1 3.95Å; H1519-Y1536 AromaticContact CE1-CD2 3.95Å; H1519-Y1536 AromaticContact CE1-CG 3.83Å; H1519-Y1546 AromaticContact CE1-CE1 3.7Å; H1519-Y1546 AromaticContact ND1-CE1 3.54Å; H1519-Y1546 AromaticContact ND1-CZ 3.67Å; H1519-Y1546 PolarHBondContact ND1-OH 3Å
1520	D	88.3	Confident	83.3	Confident	97 Å²	97	46 Å²	46	52%	0.519	23%	0.232	S	C	.	.	H	α-helix	trans	-65.8	-15.1	-177.3	-63.1	5.1	0	0	0	113.8	E1518 K1524	E1518-D1520 PolarHBondContact O-N 3.04Å; D1520-K1524 VanDerWaalsContact O-CD 3.31Å; D1520-K1524 WeakPolarHBondContact O-CD 3.13Å; D1520-K1524 WeakPolarHBondContact O-CE 3.44Å; D1520-K1524 WeakPolarHBondContact O-CG 3.33Å; D1520-K1524 PolarHBondContact O-NZ 3.02Å; D1520-K1524 VanDerWaalsContact O-NZ 3.11Å
1521	N	89.6	Confident	84.6	Confident	57 Å²	57	42.6 Å²	42.6	31%	0.305	21%	0.208	S	C	.	.	H	α-helix	trans	-90.5	-34.5	174.6	-70	-8.7	0	0	0	111.5	L1517 E1518 H1519 K1524 L1525	L1517-N1521 HydrophobicContact CD2-CB 4.15Å; E1518-N1521 PolarHBondContact O-N 3.26Å; H1519-N1521 PolarHBondContact O-N 3.18Å; H1519-N1521 VanDerWaalsContact O-N 3.1Å; N1521-K1524 PolarHBondContact O-N 3.44Å; N1521-K1524 PolarHBondContact OD1-NZ 2.97Å; N1521-K1524 VanDerWaalsContact OD1-NZ 3.17Å; N1521-L1525 WeakPolarHBondContact O-CG 3.28Å; N1521-L1525 PolarHBondContact O-N 3.31Å
1522	W	91.8	Very high	85.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-58.6	-45.9	169.4	-76.8	112.6	0	0	0	111.9	L1457 I1463 E1484 L1517 E1518 H1519 K1524 L1525 F1526 Y1546	L1457-W1522 HydrophobicContact CB-CH2 3.6Å; L1457-W1522 HydrophobicContact CB-CZ3 3.96Å; L1457-W1522 HydrophobicContact CD1-CH2 4.25Å; L1457-W1522 HydrophobicContact CD1-CZ3 3.78Å; I1463-W1522 HydrophobicContact CD1-CH2 4.06Å; I1463-W1522 HydrophobicContact CD1-CZ3 4.21Å; I1463-W1522 HydrophobicContact CG2-CZ3 4.16Å; E1484-W1522 HydrophobicContact CB-CZ2 3.86Å; E1484-W1522 HydrophobicContact CG-CH2 3.93Å; E1484-W1522 HydrophobicContact CG-CZ2 3.71Å; L1517-W1522 HydrophobicContact CB-CD2 4.45Å; L1517-W1522 HydrophobicContact CB-CZ2 4.24Å; L1517-W1522 HydrophobicContact CD1-CD2 4.37Å; L1517-W1522 HydrophobicContact CD1-CH2 4.24Å; L1517-W1522 HydrophobicContact CD1-CZ2 4.13Å; L1517-W1522 HydrophobicContact CD1-CZ3 4.44Å; L1517-W1522 PolarHBondContact O-NE1 2.68Å; E1518-W1522 PolarHBondContact O-N 2.89Å; H1519-W1522 WeakPolarHBondContact O-CB 3.22Å; H1519-W1522 PolarHBondContact O-N 2.69Å; H1519-W1522 VanDerWaalsContact O-N 3.09Å; W1522-K1524 VanDerWaalsContact C-N 3.28Å; W1522-K1524 PolarHBondContact O-N 3.37Å; W1522-L1525 HydrophobicContact CE3-CD1 4.4Å; W1522-L1525 PolarHBondContact O-N 2.88Å; W1522-L1525 VanDerWaalsContact O-N 3.11Å; W1522-F1526 HydrophobicContact CB-CE2 3.89Å; W1522-F1526 HydrophobicContact CB-CZ 4.11Å; W1522-F1526 HydrophobicContact CD2-CZ 4.34Å; W1522-F1526 AromaticContact CE3-CE1 3.91Å; W1522-F1526 HydrophobicContact CE3-CE1 3.91Å; W1522-F1526 AromaticContact CE3-CZ 3.79Å; W1522-F1526 HydrophobicContact CE3-CZ 3.79Å; W1522-F1526 HydrophobicContact CZ3-CE1 4.49Å; W1522-F1526 VanDerWaalsContact O-CD2 3.24Å; W1522-F1526 WeakPolarHBondContact O-CD2 3.32Å; W1522-F1526 VanDerWaalsContact O-CG 3.32Å; W1522-F1526 WeakPolarHBondContact O-CG 3.07Å; W1522-F1526 PolarHBondContact O-N 3.11Å; W1522-Y1546 HydrophobicContact CB-CE2 4.44Å; W1522-Y1546 HydrophobicContact CG-CE2 4.42Å
1523	L	91.2	Very high	86.8	Confident	51 Å²	51	39.7 Å²	39.7	27%	0.267	20%	0.201	S	C	.	.	H	α-helix	trans	-58.6	-38.6	-179.7	-60.3	-169.3	0	0	0	112.9	H1519 F1526 D1527 L1533 Y1546	H1519-L1523 PolarHBondContact O-N 3.25Å; L1523-F1526 HydrophobicContact CD2-CD2 4.46Å; L1523-D1527 PolarHBondContact O-N 3.47Å; L1523-L1533 HydrophobicContact CD1-CD2 4.31Å; L1523-L1533 HydrophobicContact CD2-CD1 3.92Å; L1523-L1533 HydrophobicContact CD2-CD2 3.76Å; L1523-L1533 HydrophobicContact CD2-CG 4.43Å; L1523-Y1546 HydrophobicContact CD2-CD1 4.15Å; L1523-Y1546 HydrophobicContact CD2-CE1 3.78Å
1524	K	89.2	Confident	88	Confident	118 Å²	118	38.5 Å²	38.5	51%	0.513	20%	0.196	S	C	.	.	H	α-helix	trans	-69	-37.9	177	-65.2	164.7	-164.9	141.7	0	112.3	D1520 N1521 W1522 Q1528	D1520-K1524 VanDerWaalsContact O-CD 3.31Å; D1520-K1524 WeakPolarHBondContact O-CD 3.13Å; D1520-K1524 WeakPolarHBondContact O-CE 3.44Å; D1520-K1524 WeakPolarHBondContact O-CG 3.33Å; D1520-K1524 PolarHBondContact O-NZ 3.02Å; D1520-K1524 VanDerWaalsContact O-NZ 3.11Å; N1521-K1524 PolarHBondContact O-N 3.44Å; N1521-K1524 PolarHBondContact OD1-NZ 2.97Å; N1521-K1524 VanDerWaalsContact OD1-NZ 3.17Å; W1522-K1524 VanDerWaalsContact C-N 3.28Å; W1522-K1524 PolarHBondContact O-N 3.37Å; K1524-Q1528 WeakPolarHBondContact O-CB 3.36Å; K1524-Q1528 VanDerWaalsContact O-CG 3.26Å; K1524-Q1528 WeakPolarHBondContact O-CG 3.45Å; K1524-Q1528 PolarHBondContact O-N 2.83Å
1525	L	90.4	Very high	89.2	Confident	28 Å²	28	38.3 Å²	38.3	15%	0.147	19%	0.194	C	C	.	.	H	α-helix	trans	-67.8	-37.6	177.6	-73	169.4	0	0	0	112.2	I1463 I1464 L1517 N1521 W1522 Q1528 A1529	I1463-L1525 HydrophobicContact CD1-CD1 4.29Å; I1463-L1525 HydrophobicContact CG2-CD1 4.38Å; I1464-L1525 HydrophobicContact CD1-CD2 3.94Å; I1464-L1525 HydrophobicContact CG1-CD2 3.89Å; L1517-L1525 HydrophobicContact CD1-CD1 3.5Å; L1517-L1525 VanDerWaalsContact CD1-CD1 3.5Å; N1521-L1525 WeakPolarHBondContact O-CG 3.28Å; N1521-L1525 PolarHBondContact O-N 3.31Å; W1522-L1525 HydrophobicContact CE3-CD1 4.4Å; W1522-L1525 PolarHBondContact O-N 2.88Å; W1522-L1525 VanDerWaalsContact O-N 3.11Å; L1525-Q1528 PolarHBondContact O-N 3.44Å; L1525-A1529 PolarHBondContact O-N 2.96Å
1526	F	93.5	Very high	90.3	Very high	3 Å²	3	39 Å²	39	1%	0.013	20%	0.196	C	C	.	.	H	α-helix	trans	-66.3	-41.7	177.5	-59.3	-35.6	0	0	0	112.4	L1467 V1482 W1522 L1523 A1529 G1530 F1531 Y1546 I1548	L1467-F1526 HydrophobicContact CD1-CD1 4.25Å; V1482-F1526 HydrophobicContact CB-CZ 4.36Å; V1482-F1526 HydrophobicContact CG1-CZ 4.27Å; V1482-F1526 HydrophobicContact CG2-CE1 4.3Å; V1482-F1526 HydrophobicContact CG2-CZ 4.38Å; W1522-F1526 HydrophobicContact CB-CE2 3.89Å; W1522-F1526 HydrophobicContact CB-CZ 4.11Å; W1522-F1526 HydrophobicContact CD2-CZ 4.34Å; W1522-F1526 AromaticContact CE3-CE1 3.91Å; W1522-F1526 HydrophobicContact CE3-CE1 3.91Å; W1522-F1526 AromaticContact CE3-CZ 3.79Å; W1522-F1526 HydrophobicContact CE3-CZ 3.79Å; W1522-F1526 HydrophobicContact CZ3-CE1 4.49Å; W1522-F1526 VanDerWaalsContact O-CD2 3.24Å; W1522-F1526 WeakPolarHBondContact O-CD2 3.32Å; W1522-F1526 VanDerWaalsContact O-CG 3.32Å; W1522-F1526 WeakPolarHBondContact O-CG 3.07Å; W1522-F1526 PolarHBondContact O-N 3.11Å; L1523-F1526 HydrophobicContact CD2-CD2 4.46Å; F1526-A1529 PolarHBondContact O-N 2.82Å; F1526-G1530 PolarHBondContact O-N 3.07Å; F1526-F1531 PolarHBondContact O-N 3.17Å; F1526-Y1546 AromaticContact CE2-CD1 3.81Å; F1526-Y1546 HydrophobicContact CE2-CD1 3.81Å; F1526-Y1546 HydrophobicContact CE2-CD2 4.04Å; F1526-Y1546 HydrophobicContact CE2-CE1 4.14Å; F1526-Y1546 HydrophobicContact CE2-CE2 4.36Å; F1526-Y1546 AromaticContact CE2-CG 3.75Å; F1526-Y1546 HydrophobicContact CE2-CG 3.75Å; F1526-Y1546 HydrophobicContact CZ-CD2 4.16Å; F1526-Y1546 HydrophobicContact CZ-CG 4.26Å; F1526-I1548 HydrophobicContact CB-CD1 3.97Å; F1526-I1548 HydrophobicContact CD1-CD1 3.49Å; F1526-I1548 VanDerWaalsContact CD1-CD1 3.49Å; F1526-I1548 HydrophobicContact CD2-CD1 4.26Å; F1526-I1548 HydrophobicContact CD2-CG2 4.05Å; F1526-I1548 HydrophobicContact CE1-CD1 4Å; F1526-I1548 HydrophobicContact CE2-CG2 4.5Å; F1526-I1548 HydrophobicContact CG-CD1 3.65Å; F1526-I1548 HydrophobicContact CG-CG2 4.31Å
1527	D	88.5	Confident	90.7	Very high	90 Å²	90	39.2 Å²	39.2	48%	0.481	20%	0.197	S	C	.	.	H	α-helix	trans	-65.2	-42.4	173.6	-179.1	50.4	0	0	0	111.9	L1523 A1529 G1530 R1551	L1523-D1527 PolarHBondContact O-N 3.47Å; D1527-A1529 VanDerWaalsContact C-N 3.3Å; D1527-A1529 PolarHBondContact O-N 3.35Å; D1527-G1530 WeakPolarHBondContact O-CA 3.42Å; D1527-G1530 PolarHBondContact O-N 3.08Å; D1527-R1551 IonicContact OD1-CZ 2.78Å; D1527-R1551 IonicContact OD1-NH1 3.17Å; D1527-R1551 PolarHBondContact OD1-NH1 2.86Å; D1527-R1551 IonicContact OD1-NH2 3.81Å; D1527-R1551 PolarHBondContact OD1-NH2 2.89Å
1528	Q	89.5	Confident	90.9	Very high	124 Å²	124	42 Å²	42	58%	0.579	21%	0.207	S	C	*	.	H	α-helix	trans	-62.4	-31.3	176.1	-75.6	175.3	-2.6	0	0	113.8	I1464 K1524 L1525 G1530	I1464-Q1528 HydrophobicContact CD1-CB 4.28Å; K1524-Q1528 WeakPolarHBondContact O-CB 3.36Å; K1524-Q1528 VanDerWaalsContact O-CG 3.26Å; K1524-Q1528 WeakPolarHBondContact O-CG 3.45Å; K1524-Q1528 PolarHBondContact O-N 2.83Å; L1525-Q1528 PolarHBondContact O-N 3.44Å; Q1528-G1530 PolarHBondContact O-N 3.31Å
1529	A	89.8	Confident	90.9	Very high	2 Å²	2	37.1 Å²	37.1	2%	0.017	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-1.3	171.7	0	0	0	0	0	113.5	L1467 K1471 L1525 F1526 D1527 F1531	L1467-A1529 HydrophobicContact CB-CB 3.84Å; L1467-A1529 HydrophobicContact CD1-CB 3.9Å; K1471-A1529 PolarHBondContact NZ-O 3.32Å; K1471-A1529 VanDerWaalsContact NZ-O 3.08Å; L1525-A1529 PolarHBondContact O-N 2.96Å; F1526-A1529 PolarHBondContact O-N 2.82Å; D1527-A1529 VanDerWaalsContact C-N 3.3Å; D1527-A1529 PolarHBondContact O-N 3.35Å; A1529-F1531 HydrophobicContact CB-CD2 3.87Å; A1529-F1531 HydrophobicContact CB-CE2 4.11Å
1530	G	89.4	Confident	90.5	Very high	14 Å²	14	39.7 Å²	39.7	14%	0.144	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	49.4	-179.7	0	0	0	0	0	113.4	K1471 F1526 D1527 Q1528 R1551	K1471-G1530 PolarHBondContact NZ-O 3.03Å; F1526-G1530 PolarHBondContact O-N 3.07Å; D1527-G1530 WeakPolarHBondContact O-CA 3.42Å; D1527-G1530 PolarHBondContact O-N 3.08Å; Q1528-G1530 PolarHBondContact O-N 3.31Å; G1530-R1551 WeakPolarHBondContact O-CB 3.36Å; G1530-R1551 PolarHBondContact O-N 2.99Å
1531	F	92.1	Very high	90.3	Very high	3 Å²	3	36 Å²	36	1%	0.013	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	148.9	168.5	-69.3	-97.1	0	0	0	110.6	L1467 K1471 L1474 L1480 F1526 A1529 I1548 R1549 K1550 R1551	L1467-F1531 HydrophobicContact CB-CE2 4.39Å; K1471-F1531 HydrophobicContact CB-CE2 4.29Å; K1471-F1531 HydrophobicContact CB-CZ 3.85Å; K1471-F1531 HydrophobicContact CD-CE2 3.93Å; K1471-F1531 HydrophobicContact CD-CZ 3.99Å; K1471-F1531 HydrophobicContact CG-CE2 4.46Å; K1471-F1531 HydrophobicContact CG-CZ 4.05Å; L1474-F1531 HydrophobicContact CD1-CE1 4.23Å; L1480-F1531 HydrophobicContact CB-CE1 4.09Å; L1480-F1531 HydrophobicContact CD2-CE1 3.96Å; L1480-F1531 HydrophobicContact CD2-CE2 4.45Å; L1480-F1531 HydrophobicContact CD2-CZ 3.88Å; F1526-F1531 PolarHBondContact O-N 3.17Å; A1529-F1531 HydrophobicContact CB-CD2 3.87Å; A1529-F1531 HydrophobicContact CB-CE2 4.11Å; F1531-I1548 HydrophobicContact CB-CB 4.12Å; F1531-I1548 HydrophobicContact CB-CD1 3.83Å; F1531-I1548 HydrophobicContact CB-CG1 4Å; F1531-I1548 HydrophobicContact CD1-CD1 4.17Å; F1531-I1548 HydrophobicContact CD1-CG1 3.94Å; F1531-I1548 HydrophobicContact CD2-CD1 4.45Å; F1531-I1548 HydrophobicContact CG-CD1 3.93Å; F1531-I1548 HydrophobicContact CG-CG1 4.13Å; F1531-R1549 CarbonylContact C-O 3.52Å; F1531-R1549 VanDerWaalsContact CA-O 3.3Å; F1531-R1549 WeakPolarHBondContact CA-O 3.37Å; F1531-K1550 HydrophobicContact CD1-CB 4.49Å; F1531-K1550 HydrophobicContact CE1-CB 4.35Å; F1531-R1551 PolarHBondContact O-NH2 2.83Å
1532	N	90.5	Very high	90.2	Very high	36 Å²	36	33.4 Å²	33.4	19%	0.193	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	134.9	174.1	-72.7	2.2	0	0	0	110.5	I1534 I1548 R1549 R1551	N1532-I1534 PolarHBondContact O-N 3.42Å; N1532-I1548 CarbonylContact O-C 3.54Å; N1532-I1548 WeakPolarHBondContact O-CA 3.38Å; N1532-I1548 WeakPolarHBondContact O-CB 3.33Å; N1532-R1549 PolarHBondContact N-O 3.42Å; N1532-R1549 PolarHBondContact O-N 3.02Å; N1532-R1551 VanDerWaalsContact OD1-CZ 3.29Å; N1532-R1551 PolarHBondContact OD1-NE 3.27Å; N1532-R1551 PolarHBondContact OD1-NH2 3.25Å
1533	L	92.9	Very high	90.1	Very high	41 Å²	41	33.4 Å²	33.4	22%	0.215	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	112.6	177.5	177.6	70.9	0	0	0	111	L1523 Y1536 Y1546 I1548	L1523-L1533 HydrophobicContact CD1-CD2 4.31Å; L1523-L1533 HydrophobicContact CD2-CD1 3.92Å; L1523-L1533 HydrophobicContact CD2-CD2 3.76Å; L1523-L1533 HydrophobicContact CD2-CG 4.43Å; L1533-Y1536 HydrophobicContact CD2-CD1 4.24Å; L1533-Y1546 HydrophobicContact CD1-CD1 4.19Å; L1533-I1548 HydrophobicContact CD1-CG2 4.05Å
1534	I	92.8	Very high	90.2	Very high	1 Å²	1	31 Å²	31	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-53.1	-179.9	-55.1	-51.1	0	0	0	111.1	I1370 F1479 N1532 L1547 R1549 L1648 L1650	I1370-I1534 HydrophobicContact CG2-CG2 4.21Å; F1479-I1534 HydrophobicContact CE1-CG1 4.21Å; N1532-I1534 PolarHBondContact O-N 3.42Å; I1534-L1547 HydrophobicContact CB-CB 4.45Å; I1534-L1547 HydrophobicContact CB-CD2 4.2Å; I1534-L1547 HydrophobicContact CB-CG 4.25Å; I1534-L1547 WeakPolarHBondContact CB-O 3.2Å; I1534-L1547 HydrophobicContact CG2-CD2 3.91Å; I1534-L1547 HydrophobicContact CG2-CG 4.5Å; I1534-L1547 PolarHBondContact N-O 3.44Å; I1534-R1549 HydrophobicContact CD1-CB 3.8Å; I1534-R1549 HydrophobicContact CG1-CB 3.75Å; I1534-L1648 HydrophobicContact CD1-CB 4.15Å; I1534-L1648 HydrophobicContact CD1-CD2 4.14Å; I1534-L1650 HydrophobicContact CD1-CD2 4.24Å; I1534-L1650 HydrophobicContact CG2-CD1 3.87Å; I1534-L1650 HydrophobicContact CG2-CD2 3.77Å; I1534-L1650 HydrophobicContact CG2-CG 4.45Å
1535	S	92.8	Very high	90.5	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	148.2	-175.1	163	0	0	0	0	111.2	Y1246 Y1546 L1547	Y1246-S1535 CarbonylContact O-C 3.49Å; Y1246-S1535 WeakPolarHBondContact O-CA 3.49Å; Y1246-S1535 WeakPolarHBondContact O-CB 3.39Å; Y1246-S1535 PolarHBondContact O-OG 3.08Å; Y1246-S1535 VanDerWaalsContact O-OG 3.14Å; S1535-Y1546 WeakPolarHBondContact O-CA 3.25Å; S1535-L1547 PolarHBondContact N-O 3.02Å; S1535-L1547 VanDerWaalsContact N-O 3.11Å; S1535-L1547 PolarHBondContact O-N 2.92Å
1536	Y	94.2	Very high	90.7	Very high	28 Å²	28	24 Å²	24	11%	0.11	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	146.4	163.4	71.2	-106.4	0	0	0	111.5	Y1246 K1247 N1248 D1249 H1519 L1533 R1538 V1545	Y1246-Y1536 PolarHBondContact O-N 3.34Å; K1247-Y1536 HydrophobicContact CB-CD1 4.41Å; K1247-Y1536 HydrophobicContact CB-CE1 3.82Å; K1247-Y1536 HydrophobicContact CB-CE2 4.5Å; K1247-Y1536 HydrophobicContact CD-CE1 4.21Å; K1247-Y1536 HydrophobicContact CG-CD1 4.12Å; K1247-Y1536 HydrophobicContact CG-CE1 3.76Å; N1248-Y1536 PolarHBondContact N-O 2.95Å; N1248-Y1536 VanDerWaalsContact N-O 3.12Å; D1249-Y1536 PolarHBondContact OD1-OH 3.17Å; H1519-Y1536 AromaticContact CE1-CD1 3.95Å; H1519-Y1536 AromaticContact CE1-CD2 3.95Å; H1519-Y1536 AromaticContact CE1-CG 3.83Å; L1533-Y1536 HydrophobicContact CD2-CD1 4.24Å; Y1536-R1538 HydrophobicContact CD2-CG 3.88Å; Y1536-R1538 HydrophobicContact CE2-CG 4.17Å; Y1536-V1545 CarbonylContact C-O 3.48Å; Y1536-V1545 VanDerWaalsContact CA-O 3.24Å; Y1536-V1545 WeakPolarHBondContact CA-O 3.4Å
1537	Q	93.2	Very high	90.8	Very high	4 Å²	4	23.9 Å²	23.9	2%	0.019	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	113.7	177.9	-55	-67.1	-50.2	0	0	108.3	F1244 Y1245 N1248 C1251 I1363 I1367 V1545	F1244-Q1537 HydrophobicContact CE2-CG 4.22Å; F1244-Q1537 VanDerWaalsContact CZ-CD 3.47Å; F1244-Q1537 HydrophobicContact CZ-CG 3.85Å; F1244-Q1537 VanDerWaalsContact CZ-NE2 3.25Å; Y1245-Q1537 PolarHBondContact O-NE2 2.9Å; N1248-Q1537 VanDerWaalsContact CB-OE1 3.29Å; C1251-Q1537 HydrophobicContact CB-CB 4.3Å; I1363-Q1537 HydrophobicContact CG2-CB 3.77Å; I1363-Q1537 HydrophobicContact CG2-CG 3.91Å; I1367-Q1537 HydrophobicContact CD1-CG 4.15Å; Q1537-V1545 PolarHBondContact N-O 2.97Å; Q1537-V1545 PolarHBondContact O-N 3.45Å
1538	R	91.9	Very high	91.1	Very high	68 Å²	68	19.6 Å²	19.6	26%	0.257	10%	0.096	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	131.3	-179.2	-59	177.4	67.8	176.7	2.8	109.7	N1248 D1249 C1251 Y1536 D1540 T1544	N1248-R1538 PolarHBondContact O-N 3.02Å; D1249-R1538 WeakPolarHBondContact O-CB 3.41Å; D1249-R1538 IonicContact OD1-NH1 3.57Å; C1251-R1538 PolarHBondContact N-O 3.38Å; C1251-R1538 PolarHBondContact SG-O 3.01Å; Y1536-R1538 HydrophobicContact CD2-CG 3.88Å; Y1536-R1538 HydrophobicContact CE2-CG 4.17Å; R1538-D1540 PolarHBondContact O-N 3.3Å; R1538-T1544 HydrophobicContact CG-CG2 3.73Å
1539	D	87.1	Confident	91.3	Very high	2 Å²	2	14.4 Å²	14.4	1%	0.011	7%	0.071	C	C	.	.			trans	-86.7	0.7	-171.7	68.5	6.3	0	0	0	115.2	M1252 C1357 M1541 M1542 Q1543	M1252-D1539 HydrophobicContact CG-CB 4.32Å; M1252-D1539 WeakPolarHBondContact CG-O 3.3Å; C1357-D1539 HydrophobicContact CB-CB 4.49Å; D1539-M1541 WeakPolarHBondContact O-CG 3.41Å; D1539-M1541 PolarHBondContact O-N 2.94Å; D1539-M1541 WeakPolarHBondContact OD1-CA 3.21Å; D1539-M1541 PolarHBondContact OD1-N 3.28Å; D1539-M1542 PolarHBondContact OD1-N 3.14Å; D1539-Q1543 VanDerWaalsContact CG-O 3.24Å; D1539-Q1543 PolarHBondContact N-O 3.04Å; D1539-Q1543 PolarHBondContact OD1-N 3.1Å; D1539-Q1543 VanDerWaalsContact OD1-O 3.1Å; D1539-Q1543 PolarHBondContact OD2-N 3.42Å
1540	D	80.8	Confident	91.3	Very high	67 Å²	67	15.5 Å²	15.5	36%	0.358	8%	0.076	S	C	.	.	S	Bend	trans	62.3	-5.3	-166.4	-62.3	-48.5	0	0	0	116	H1250 K1259 R1538	H1250-D1540 IonicContact CE1-OD1 3.68Å; H1250-D1540 IonicContact CG-OD1 3.83Å; H1250-D1540 IonicContact ND1-OD1 3.93Å; H1250-D1540 PolarHBondContact ND1-OD1 2.95Å; H1250-D1540 IonicContact ND1-OD2 3.63Å; K1259-D1540 IonicContact NZ-OD2 2.71Å; K1259-D1540 PolarHBondContact NZ-OD2 2.76Å; R1538-D1540 PolarHBondContact O-N 3.3Å
1541	M	85.1	Confident	91.1	Very high	20 Å²	20	19.8 Å²	19.8	10%	0.099	9%	0.088	C	C	.	.	S	Bend	trans	-108.8	-58.3	-165.8	-65.2	-64	-167.1	0	0	113.1	L1262 D1263 T1266 L1354 N1488 D1539	L1262-M1541 HydrophobicContact CB-CE 3.94Å; D1263-M1541 WeakPolarHBondContact OD1-CE 3.16Å; T1266-M1541 HydrophobicContact CG2-SD 3.95Å; T1266-M1541 PolarHBondContact OG1-SD 3.05Å; L1354-M1541 HydrophobicContact CD1-CB 3.97Å; L1354-M1541 HydrophobicContact CD1-CG 4.29Å; N1488-M1541 VanDerWaalsContact CB-O 3.25Å; N1488-M1541 WeakPolarHBondContact CB-O 3.48Å; D1539-M1541 WeakPolarHBondContact O-CG 3.41Å; D1539-M1541 PolarHBondContact O-N 2.94Å; D1539-M1541 WeakPolarHBondContact OD1-CA 3.21Å; D1539-M1541 PolarHBondContact OD1-N 3.28Å
1542	M	87	Confident	90.2	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.005	10%	0.102	C	C	.	.	S	Bend	trans	-157.5	-38	-162.3	-170.6	165.5	56.8	0	0	113.8	L1354 W1355 F1485 T1486 S1487 L1491 A1492 D1539	L1354-M1542 HydrophobicContact CD1-CE 4.35Å; L1354-M1542 HydrophobicContact CG-CE 4.04Å; L1354-M1542 WeakPolarHBondContact O-CE 3.41Å; W1355-M1542 HydrophobicContact CE3-CE 4.33Å; F1485-M1542 HydrophobicContact CD1-CG 3.72Å; F1485-M1542 HydrophobicContact CD1-SD 4.28Å; F1485-M1542 HydrophobicContact CE1-CE 4.25Å; F1485-M1542 HydrophobicContact CE1-CG 3.91Å; F1485-M1542 HydrophobicContact CE1-SD 3.91Å; T1486-M1542 PolarHBondContact N-O 2.78Å; S1487-M1542 PolarHBondContact N-O 2.94Å; S1487-M1542 VanDerWaalsContact N-O 3.1Å; S1487-M1542 WeakPolarHBondContact O-CA 3.41Å; L1491-M1542 HydrophobicContact CD2-SD 4.38Å; A1492-M1542 HydrophobicContact CB-SD 4.42Å; D1539-M1542 PolarHBondContact OD1-N 3.14Å
1543	Q	90.9	Very high	89.3	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	157.4	-170.7	-72.7	168.6	43.1	0	0	112.8	W1355 S1358 N1483 E1484 F1485 D1539	W1355-Q1543 PolarHBondContact O-NE2 3.26Å; S1358-Q1543 WeakPolarHBondContact OG-CB 3.49Å; S1358-Q1543 PolarHBondContact OG-OE1 2.82Å; N1483-Q1543 PolarHBondContact ND2-OE1 2.85Å; N1483-Q1543 PolarHBondContact OD1-OE1 3.11Å; E1484-Q1543 WeakPolarHBondContact O-CA 3.43Å; F1485-Q1543 HydrophobicContact CD1-CG 3.9Å; F1485-Q1543 HydrophobicContact CE1-CG 4.05Å; F1485-Q1543 HydrophobicContact CG-CG 4.43Å; D1539-Q1543 VanDerWaalsContact CG-O 3.24Å; D1539-Q1543 PolarHBondContact N-O 3.04Å; D1539-Q1543 PolarHBondContact OD1-N 3.1Å; D1539-Q1543 VanDerWaalsContact OD1-O 3.1Å; D1539-Q1543 PolarHBondContact OD2-N 3.42Å
1544	T	93.3	Very high	88.1	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	131	168	-57.5	0	0	0	0	109.4	E1484 T1486 R1538 Y1546	E1484-T1544 PolarHBondContact N-O 3.45Å; E1484-T1544 PolarHBondContact O-N 3.25Å; T1486-T1544 WeakPolarHBondContact CG2-OG1 3.4Å; T1486-T1544 PolarHBondContact OG1-N 3.32Å; T1486-T1544 PolarHBondContact OG1-OG1 2.99Å; R1538-T1544 HydrophobicContact CG-CG2 3.73Å; T1544-Y1546 HydrophobicContact CG2-CD1 4.18Å; T1544-Y1546 HydrophobicContact CG2-CD2 4.09Å; T1544-Y1546 HydrophobicContact CG2-CE1 3.71Å; T1544-Y1546 HydrophobicContact CG2-CE2 3.61Å; T1544-Y1546 HydrophobicContact CG2-CG 4.36Å
1545	V	94.5	Very high	86.7	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	132	167.1	172.9	0	0	0	0	108.9	I1367 F1481 V1482 N1483 Y1536 Q1537	I1367-V1545 HydrophobicContact CD1-CG1 3.56Å; F1481-V1545 HydrophobicContact CD2-CG1 4.16Å; F1481-V1545 HydrophobicContact CE1-CG1 4.19Å; F1481-V1545 HydrophobicContact CE2-CG1 3.45Å; F1481-V1545 VanDerWaalsContact CE2-CG1 3.45Å; F1481-V1545 HydrophobicContact CZ-CB 4.46Å; F1481-V1545 HydrophobicContact CZ-CG1 3.47Å; F1481-V1545 VanDerWaalsContact CZ-CG1 3.47Å; F1481-V1545 HydrophobicContact CZ-CG2 4.08Å; V1482-V1545 CarbonylContact O-C 3.49Å; V1482-V1545 WeakPolarHBondContact O-CA 3.5Å; N1483-V1545 HydrophobicContact CB-CG2 4.15Å; Y1536-V1545 CarbonylContact C-O 3.48Å; Y1536-V1545 VanDerWaalsContact CA-O 3.24Å; Y1536-V1545 WeakPolarHBondContact CA-O 3.4Å; Q1537-V1545 PolarHBondContact N-O 2.97Å; Q1537-V1545 PolarHBondContact O-N 3.45Å
1546	Y	95.7	Very high	85.6	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	140.6	173.3	-53.2	-93.7	0	0	0	110	F1481 V1482 H1519 W1522 L1523 F1526 L1533 S1535 T1544	F1481-Y1546 WeakPolarHBondContact CA-O 3.31Å; V1482-Y1546 HydrophobicContact CB-CD2 4.46Å; V1482-Y1546 PolarHBondContact N-O 3.44Å; V1482-Y1546 PolarHBondContact O-N 3.27Å; H1519-Y1546 AromaticContact CE1-CE1 3.7Å; H1519-Y1546 AromaticContact ND1-CE1 3.54Å; H1519-Y1546 AromaticContact ND1-CZ 3.67Å; H1519-Y1546 PolarHBondContact ND1-OH 3Å; W1522-Y1546 HydrophobicContact CB-CE2 4.44Å; W1522-Y1546 HydrophobicContact CG-CE2 4.42Å; L1523-Y1546 HydrophobicContact CD2-CD1 4.15Å; L1523-Y1546 HydrophobicContact CD2-CE1 3.78Å; F1526-Y1546 AromaticContact CE2-CD1 3.81Å; F1526-Y1546 HydrophobicContact CE2-CD1 3.81Å; F1526-Y1546 HydrophobicContact CE2-CD2 4.04Å; F1526-Y1546 HydrophobicContact CE2-CE1 4.14Å; F1526-Y1546 HydrophobicContact CE2-CE2 4.36Å; F1526-Y1546 AromaticContact CE2-CG 3.75Å; F1526-Y1546 HydrophobicContact CE2-CG 3.75Å; F1526-Y1546 HydrophobicContact CZ-CD2 4.16Å; F1526-Y1546 HydrophobicContact CZ-CG 4.26Å; L1533-Y1546 HydrophobicContact CD1-CD1 4.19Å; S1535-Y1546 WeakPolarHBondContact O-CA 3.25Å; T1544-Y1546 HydrophobicContact CG2-CD1 4.18Å; T1544-Y1546 HydrophobicContact CG2-CD2 4.09Å; T1544-Y1546 HydrophobicContact CG2-CE1 3.71Å; T1544-Y1546 HydrophobicContact CG2-CE2 3.61Å; T1544-Y1546 HydrophobicContact CG2-CG 4.36Å
1547	L	95.1	Very high	84.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	123.9	159.5	-176.7	70.5	0	0	0	107.7	I1367 I1370 V1371 L1450 F1479 I1534 S1535	I1367-L1547 HydrophobicContact CG2-CB 4.02Å; I1367-L1547 HydrophobicContact CG2-CD1 4.02Å; I1367-L1547 HydrophobicContact CG2-CD2 4.15Å; I1367-L1547 HydrophobicContact CG2-CG 4.28Å; I1370-L1547 HydrophobicContact CB-CD2 4.15Å; I1370-L1547 HydrophobicContact CG2-CD2 3.65Å; V1371-L1547 HydrophobicContact CG2-CD1 3.79Å; V1371-L1547 HydrophobicContact CG2-CD2 4.23Å; L1450-L1547 HydrophobicContact CD1-CD1 4.42Å; F1479-L1547 HydrophobicContact CB-CD1 4.09Å; F1479-L1547 HydrophobicContact CD1-CD1 4.06Å; F1479-L1547 HydrophobicContact CD1-CD2 4.08Å; F1479-L1547 HydrophobicContact CD1-CG 4.08Å; F1479-L1547 HydrophobicContact CE1-CD2 4.35Å; F1479-L1547 HydrophobicContact CG-CD1 4.45Å; I1534-L1547 HydrophobicContact CB-CB 4.45Å; I1534-L1547 HydrophobicContact CB-CD2 4.2Å; I1534-L1547 HydrophobicContact CB-CG 4.25Å; I1534-L1547 WeakPolarHBondContact CB-O 3.2Å; I1534-L1547 HydrophobicContact CG2-CD2 3.91Å; I1534-L1547 HydrophobicContact CG2-CG 4.5Å; I1534-L1547 PolarHBondContact N-O 3.44Å; S1535-L1547 PolarHBondContact N-O 3.02Å; S1535-L1547 VanDerWaalsContact N-O 3.11Å; S1535-L1547 PolarHBondContact O-N 2.92Å
1548	I	94.9	Very high	84.2	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	144.4	176.5	68.8	-174.6	0	0	0	109.8	L1480 F1526 F1531 N1532 L1533	L1480-I1548 HydrophobicContact CB-CG1 3.88Å; L1480-I1548 HydrophobicContact CD2-CD1 4.12Å; L1480-I1548 HydrophobicContact CD2-CG1 4.37Å; L1480-I1548 HydrophobicContact CG-CD1 4.49Å; L1480-I1548 HydrophobicContact CG-CG1 4.31Å; L1480-I1548 PolarHBondContact N-O 3.42Å; L1480-I1548 PolarHBondContact O-N 3.34Å; F1526-I1548 HydrophobicContact CB-CD1 3.97Å; F1526-I1548 HydrophobicContact CD1-CD1 3.49Å; F1526-I1548 VanDerWaalsContact CD1-CD1 3.49Å; F1526-I1548 HydrophobicContact CD2-CD1 4.26Å; F1526-I1548 HydrophobicContact CD2-CG2 4.05Å; F1526-I1548 HydrophobicContact CE1-CD1 4Å; F1526-I1548 HydrophobicContact CE2-CG2 4.5Å; F1526-I1548 HydrophobicContact CG-CD1 3.65Å; F1526-I1548 HydrophobicContact CG-CG2 4.31Å; F1531-I1548 HydrophobicContact CB-CB 4.12Å; F1531-I1548 HydrophobicContact CB-CD1 3.83Å; F1531-I1548 HydrophobicContact CB-CG1 4Å; F1531-I1548 HydrophobicContact CD1-CD1 4.17Å; F1531-I1548 HydrophobicContact CD1-CG1 3.94Å; F1531-I1548 HydrophobicContact CD2-CD1 4.45Å; F1531-I1548 HydrophobicContact CG-CD1 3.93Å; F1531-I1548 HydrophobicContact CG-CG1 4.13Å; N1532-I1548 CarbonylContact O-C 3.54Å; N1532-I1548 WeakPolarHBondContact O-CA 3.38Å; N1532-I1548 WeakPolarHBondContact O-CB 3.33Å; L1533-I1548 HydrophobicContact CD1-CG2 4.05Å
1549	R	92.1	Very high	83.9	Confident	15 Å²	15	50.5 Å²	50.5	6%	0.057	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	142.8	-178.7	-165	179.7	-176.2	-168.4	-3.3	109.9	D1477 F1479 F1531 N1532 I1534 R1551 L1648 D1649	D1477-R1549 WeakPolarHBondContact O-CG 3.48Å; D1477-R1549 PolarHBondContact O-NE 3.31Å; D1477-R1549 IonicContact OD2-CZ 3.9Å; D1477-R1549 IonicContact OD2-NH2 2.61Å; D1477-R1549 PolarHBondContact OD2-NH2 3.49Å; F1479-R1549 HydrophobicContact CD1-CB 3.89Å; F1479-R1549 HydrophobicContact CD1-CG 3.92Å; F1479-R1549 HydrophobicContact CE1-CB 3.88Å; F1479-R1549 HydrophobicContact CE1-CG 3.74Å; F1479-R1549 HydrophobicContact CE2-CG 4.43Å; F1479-R1549 HydrophobicContact CG-CG 4.36Å; F1479-R1549 HydrophobicContact CZ-CG 4.01Å; F1531-R1549 CarbonylContact C-O 3.52Å; F1531-R1549 VanDerWaalsContact CA-O 3.3Å; F1531-R1549 WeakPolarHBondContact CA-O 3.37Å; N1532-R1549 PolarHBondContact N-O 3.42Å; N1532-R1549 PolarHBondContact O-N 3.02Å; I1534-R1549 HydrophobicContact CD1-CB 3.8Å; I1534-R1549 HydrophobicContact CG1-CB 3.75Å; R1549-R1551 PolarHBondContact O-N 3.07Å; R1549-L1648 PolarHBondContact NH1-O 3.33Å; R1549-D1649 IonicContact CZ-OD2 3.73Å; R1549-D1649 PolarHBondContact NH1-O 3.09Å; R1549-D1649 IonicContact NH1-OD2 2.78Å; R1549-D1649 PolarHBondContact NH1-OD2 2.82Å; R1549-D1649 IonicContact NH2-OD2 2.67Å; R1549-D1649 PolarHBondContact NH2-OD2 3.44Å
1550	K	90.5	Very high	84	Confident	26 Å²	26	54.1 Å²	54.1	11%	0.113	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	127	172.6	-173	169.5	161.6	172	0	108.6	K1471 L1474 R1475 P1476 G1478 F1531	K1471-K1550 HydrophobicContact CD-CG 4.4Å; K1471-K1550 HydrophobicContact CG-CD 3.89Å; K1471-K1550 HydrophobicContact CG-CG 4.06Å; K1471-K1550 PolarHBondContact O-NZ 3.35Å; L1474-K1550 HydrophobicContact CB-CD 4.17Å; L1474-K1550 PolarHBondContact O-NZ 3.27Å; R1475-K1550 WeakPolarHBondContact O-CD 3.16Å; P1476-K1550 VanDerWaalsContact O-CD 3.26Å; P1476-K1550 WeakPolarHBondContact O-CD 3.04Å; P1476-K1550 WeakPolarHBondContact O-CE 3.22Å; P1476-K1550 VanDerWaalsContact O-CG 3.22Å; P1476-K1550 WeakPolarHBondContact O-CG 3.09Å; G1478-K1550 VanDerWaalsContact O-CB 3.31Å; G1478-K1550 WeakPolarHBondContact O-CB 3.29Å; G1478-K1550 PolarHBondContact O-N 2.89Å; F1531-K1550 HydrophobicContact CD1-CB 4.49Å; F1531-K1550 HydrophobicContact CE1-CB 4.35Å
1551	R	85.7	Confident	84.4	Confident	104 Å²	104	51.5 Å²	51.5	39%	0.392	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-69.7	122.6	176.4	-170	175.3	-64.8	161	5.1	107.9	D1527 G1530 F1531 N1532 R1549	D1527-R1551 IonicContact OD1-CZ 2.78Å; D1527-R1551 IonicContact OD1-NH1 3.17Å; D1527-R1551 PolarHBondContact OD1-NH1 2.86Å; D1527-R1551 IonicContact OD1-NH2 3.81Å; D1527-R1551 PolarHBondContact OD1-NH2 2.89Å; G1530-R1551 WeakPolarHBondContact O-CB 3.36Å; G1530-R1551 PolarHBondContact O-N 2.99Å; F1531-R1551 PolarHBondContact O-NH2 2.83Å; N1532-R1551 VanDerWaalsContact OD1-CZ 3.29Å; N1532-R1551 PolarHBondContact OD1-NE 3.27Å; N1532-R1551 PolarHBondContact OD1-NH2 3.25Å; R1549-R1551 PolarHBondContact O-N 3.07Å
1552	P	73.6	Confident	84.7	Confident	47 Å²	47	53.9 Å²	53.9	31%	0.305	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-66.7	159.9	-176.9	27.8	-35.1	0	0	0	111.7
1553	E	71	Confident	84.8	Confident	192 Å²	192	53.9 Å²	53.9	90%	0.897	27%	0.271	S	S	*	.	S	Bend	trans	-83.5	-11.8	-177.6	-63.4	-172.7	175.3	0	0	113.6
1554	M	66.8	Low	84.6	Confident	152 Å²	152	56 Å²	56	75%	0.749	28%	0.283	S	S	*	.	S	Bend	trans	-126.9	154.7	171.9	-57.8	-166.9	-166.6	0	0	110.2
1555	E	65	Low	84.2	Confident	191 Å²	191	58.6 Å²	58.6	89%	0.893	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-83.3	124.8	172.2	-79.9	-177.9	144	0	0	110.7
1556	N	68.6	Low	83.8	Confident	42 Å²	42	59.4 Å²	59.4	23%	0.225	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-84.5	127.4	-179.6	-64.2	-0.9	0	0	0	110	P1558 E1588	N1556-P1558 WeakPolarHBondContact O-CD 3.45Å; N1556-E1588 PolarHBondContact ND2-O 2.86Å; N1556-E1588 PolarHBondContact ND2-OE2 3.13Å; N1556-E1588 WeakPolarHBondContact OD1-CB 3.35Å
1557	I	76.8	Confident	83.1	Confident	101 Å²	101	64.1 Å²	64.1	52%	0.518	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-83.2	122.4	-176.4	-55.4	178.1	0	0	0	109.8	D1589 T1590	I1557-D1589 WeakPolarHBondContact CB-OD1 3.42Å; I1557-T1590 PolarHBondContact O-N 3.35Å; I1557-T1590 VanDerWaalsContact O-N 3.14Å
1558	P	81.7	Confident	82.5	Confident	59 Å²	59	66.5 Å²	66.5	38%	0.383	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119.3	-178.3	32.9	-32.8	0	0	0	112.4	N1556 W1592 M1646	N1556-P1558 WeakPolarHBondContact O-CD 3.45Å; P1558-W1592 VanDerWaalsContact CB-CD1 3.47Å; P1558-W1592 HydrophobicContact CB-CG 4.37Å; P1558-M1646 HydrophobicContact CB-CE 3.57Å; P1558-M1646 HydrophobicContact CG-CE 3.86Å
1559	H	86.4	Confident	82.3	Confident	41 Å²	41	66.6 Å²	66.6	19%	0.19	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	104	173.9	-64.6	-69.6	0	0	0	111	T1578 Y1582 T1590 W1592	H1559-T1578 HydrophobicContact CB-CG2 3.85Å; H1559-Y1582 AromaticContact CD2-CD1 3.7Å; H1559-Y1582 AromaticContact CD2-CG 3.8Å; H1559-Y1582 AromaticContact CE1-CD1 3.84Å; H1559-Y1582 AromaticContact CE1-CE1 3.44Å; H1559-Y1582 VanDerWaalsContact CE1-CE1 3.44Å; H1559-Y1582 WeakPolarHBondContact CE1-CE1 3.05Å; H1559-Y1582 AromaticContact CE1-CZ 3.66Å; H1559-Y1582 AromaticContact NE2-CD1 3.29Å; H1559-Y1582 VanDerWaalsContact NE2-CD1 3.29Å; H1559-Y1582 WeakPolarHBondContact NE2-CD1 3.36Å; H1559-Y1582 AromaticContact NE2-CE1 3.35Å; H1559-Y1582 WeakPolarHBondContact NE2-CE1 3.3Å; H1559-Y1582 AromaticContact NE2-CG 3.88Å; H1559-Y1582 AromaticContact NE2-CZ 3.99Å; H1559-T1590 PolarHBondContact N-O 2.79Å; H1559-W1592 PolarHBondContact O-N 3.18Å
1560	V	87.8	Confident	82	Confident	78 Å²	78	71 Å²	71	47%	0.473	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	131.8	-173.5	-179	0	0	0	0	112.5	V1562 W1592 V1594 M1646	V1560-V1562 HydrophobicContact CG1-CG2 4.35Å; V1560-W1592 WeakPolarHBondContact CA-O 3.27Å; V1560-W1592 HydrophobicContact CG2-CB 4.13Å; V1560-V1594 HydrophobicContact CG1-CB 4.36Å; V1560-V1594 HydrophobicContact CG1-CG2 3.81Å; V1560-M1646 HydrophobicContact CG2-CE 3.79Å
1561	V	90.3	Very high	82.1	Confident	12 Å²	12	70.2 Å²	70.2	7%	0.073	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	123.1	170.9	-175.2	0	0	0	0	109.8	P1574 L1575 T1578 W1592 V1594	V1561-P1574 HydrophobicContact CG1-CB 4.24Å; V1561-L1575 HydrophobicContact CB-CD1 4.33Å; V1561-L1575 HydrophobicContact CG1-CB 4.15Å; V1561-L1575 HydrophobicContact CG2-CD1 4.21Å; V1561-T1578 HydrophobicContact CG2-CG2 4.22Å; V1561-W1592 PolarHBondContact N-O 3.06Å; V1561-V1594 PolarHBondContact O-N 2.83Å
1562	V	90.3	Very high	82.3	Confident	71 Å²	71	65.5 Å²	65.5	43%	0.43	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	111.9	-176.8	-177.8	0	0	0	0	110.8	V1560 N1564 V1594	V1560-V1562 HydrophobicContact CG1-CG2 4.35Å; V1562-N1564 HydrophobicContact CG1-CB 4.34Å; V1562-N1564 WeakPolarHBondContact CG1-ND2 3.33Å; V1562-V1594 CarbonylContact C-O 3.54Å; V1562-V1594 WeakPolarHBondContact CA-O 3.48Å
1563	A	89.7	Confident	82.9	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	37%	0.369	C	S	.	.			trans	-106.5	54.8	-171	0	0	0	0	0	113	W1571 V1593 V1594 N1600 I1602	A1563-W1571 HydrophobicContact CB-CB 4.06Å; A1563-W1571 HydrophobicContact CB-CD2 3.61Å; A1563-W1571 HydrophobicContact CB-CE3 4.09Å; A1563-W1571 HydrophobicContact CB-CG 3.58Å; A1563-V1593 HydrophobicContact CB-CG1 4Å; A1563-V1594 PolarHBondContact N-O 3.05Å; A1563-N1600 PolarHBondContact O-ND2 2.83Å; A1563-I1602 HydrophobicContact CB-CD1 4.11Å
1564	N	86.5	Confident	83.7	Confident	46 Å²	46	64 Å²	64	25%	0.246	35%	0.346	C	S	.	.			trans	-86.5	-23.6	-171.6	-89.3	-23.9	0	0	0	115.9	V1562 S1595 N1596 R1597	V1562-N1564 HydrophobicContact CG1-CB 4.34Å; V1562-N1564 WeakPolarHBondContact CG1-ND2 3.33Å; N1564-S1595 WeakPolarHBondContact OD1-CA 3.46Å; N1564-S1595 PolarHBondContact OD1-OG 3.29Å; N1564-N1596 PolarHBondContact ND2-OD1 2.78Å; N1564-N1596 PolarHBondContact OD1-N 2.83Å; N1564-N1596 PolarHBondContact OD1-OD1 2.88Å; N1564-R1597 WeakPolarHBondContact O-CD 3.01Å; N1564-R1597 PolarHBondContact O-NH1 2.9Å; N1564-R1597 VanDerWaalsContact O-NH1 3.11Å; N1564-R1597 PolarHBondContact OD1-N 3.14Å
1565	D	85.6	Confident	84.8	Confident	53 Å²	53	56.8 Å²	56.8	28%	0.283	31%	0.31	S	S	.	.			trans	-80.1	133.2	176.2	-159.4	-75	0	0	0	110.7	T1567 S1568 W1571	D1565-T1567 WeakPolarHBondContact OD1-CA 3.33Å; D1565-T1567 WeakPolarHBondContact OD1-CB 3.4Å; D1565-T1567 PolarHBondContact OD1-N 2.73Å; D1565-T1567 PolarHBondContact OD1-OG1 3.44Å; D1565-T1567 PolarHBondContact OD2-OG1 2.78Å; D1565-S1568 PolarHBondContact OD1-N 2.83Å; D1565-S1568 PolarHBondContact OD1-OG 3.4Å; D1565-W1571 PolarHBondContact O-NE1 2.92Å
1566	V	84.8	Confident	85.9	Confident	17 Å²	17	49.3 Å²	49.3	10%	0.103	28%	0.275	C	S	.	.	S	Bend	trans	-120.7	16.4	-174.4	-48.8	0	0	0	0	111.6	R1597 W2187 Y2191	V1566-R1597 VanDerWaalsContact CG2-NH2 3.28Å; V1566-W2187 HydrophobicContact CB-CH2 3.88Å; V1566-W2187 HydrophobicContact CB-CZ2 3.87Å; V1566-W2187 HydrophobicContact CG1-CH2 4.49Å; V1566-W2187 HydrophobicContact CG1-CZ2 4Å; V1566-Y2191 HydrophobicContact CB-CE2 3.9Å; V1566-Y2191 HydrophobicContact CG1-CE2 4.01Å; V1566-Y2191 HydrophobicContact CG2-CE2 3.96Å
1567	T	81.5	Confident	86.6	Confident	99 Å²	99	50 Å²	50	61%	0.607	28%	0.283	S	S	*	.	S	Bend	trans	-131	-49.9	-163.8	12.6	0	0	0	0	111.7	D1565	D1565-T1567 WeakPolarHBondContact OD1-CA 3.33Å; D1565-T1567 WeakPolarHBondContact OD1-CB 3.4Å; D1565-T1567 PolarHBondContact OD1-N 2.73Å; D1565-T1567 PolarHBondContact OD1-OG1 3.44Å; D1565-T1567 PolarHBondContact OD2-OG1 2.78Å
1568	S	83.7	Confident	87	Confident	50 Å²	50	46.5 Å²	46.5	35%	0.35	27%	0.267	S	S	.	.	S	Bend	trans	-106	-13.2	175.5	55	0	0	0	0	113.7	D1565 D1570 V2135	D1565-S1568 PolarHBondContact OD1-N 2.83Å; D1565-S1568 PolarHBondContact OD1-OG 3.4Å; S1568-D1570 VanDerWaalsContact C-N 3.3Å; S1568-D1570 WeakPolarHBondContact CB-OD1 3.43Å; S1568-D1570 PolarHBondContact O-N 2.89Å; S1568-D1570 PolarHBondContact OG-OD1 3.07Å; S1568-V2135 VanDerWaalsContact O-CG1 3.23Å; S1568-V2135 WeakPolarHBondContact O-CG1 3.38Å
1569	F	89.4	Confident	87.1	Confident	2 Å²	2	44 Å²	44	1%	0.009	25%	0.25	C	C	.	.			trans	61	30.3	174.5	-58.8	-91.2	0	0	0	114.8	W1571 L1572 F2138 V2139 W2187	F1569-W1571 HydrophobicContact CD1-CH2 4.35Å; F1569-W1571 AromaticContact CD1-CZ2 3.66Å; F1569-W1571 HydrophobicContact CD1-CZ2 3.66Å; F1569-W1571 HydrophobicContact CE1-CZ2 4.27Å; F1569-W1571 PolarHBondContact O-N 3.3Å; F1569-L1572 VanDerWaalsContact O-CB 3.23Å; F1569-L1572 WeakPolarHBondContact O-CB 3.17Å; F1569-L1572 PolarHBondContact O-N 3.06Å; F1569-F2138 HydrophobicContact CD1-CB 3.97Å; F1569-F2138 AromaticContact CD1-CD1 3.72Å; F1569-F2138 HydrophobicContact CD1-CD1 3.72Å; F1569-F2138 HydrophobicContact CD1-CG 4.14Å; F1569-F2138 HydrophobicContact CD2-CB 4.21Å; F1569-F2138 HydrophobicContact CE1-CB 4.14Å; F1569-F2138 AromaticContact CE1-CD1 3.72Å; F1569-F2138 HydrophobicContact CE1-CD1 3.72Å; F1569-F2138 HydrophobicContact CE1-CG 4.37Å; F1569-F2138 HydrophobicContact CE2-CB 4.37Å; F1569-F2138 HydrophobicContact CG-CB 4.02Å; F1569-F2138 HydrophobicContact CZ-CB 4.33Å; F1569-V2139 HydrophobicContact CD2-CG2 3.85Å; F1569-V2139 HydrophobicContact CE2-CG2 3.82Å; F1569-W2187 HydrophobicContact CE1-CD2 4.34Å; F1569-W2187 AromaticContact CE1-CE3 3.98Å; F1569-W2187 HydrophobicContact CE1-CE3 3.98Å; F1569-W2187 AromaticContact CE1-CH2 3.56Å; F1569-W2187 HydrophobicContact CE1-CH2 3.56Å; F1569-W2187 AromaticContact CE1-CZ2 3.92Å; F1569-W2187 HydrophobicContact CE1-CZ2 3.92Å; F1569-W2187 AromaticContact CE1-CZ3 3.59Å; F1569-W2187 HydrophobicContact CE1-CZ3 3.59Å; F1569-W2187 HydrophobicContact CZ-CE3 4.42Å; F1569-W2187 AromaticContact CZ-CH2 3.77Å; F1569-W2187 HydrophobicContact CZ-CH2 3.77Å; F1569-W2187 AromaticContact CZ-CZ3 3.7Å; F1569-W2187 HydrophobicContact CZ-CZ3 3.7Å
1570	D	86.6	Confident	86.6	Confident	109 Å²	109	49 Å²	49	58%	0.583	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-26.7	-177.5	-59.6	11.5	0	0	0	114.7	S1568 L1572 P1574	S1568-D1570 VanDerWaalsContact C-N 3.3Å; S1568-D1570 WeakPolarHBondContact CB-OD1 3.43Å; S1568-D1570 PolarHBondContact O-N 2.89Å; S1568-D1570 PolarHBondContact OG-OD1 3.07Å; D1570-L1572 VanDerWaalsContact C-N 3.28Å; D1570-L1572 PolarHBondContact O-N 3.48Å; D1570-P1574 WeakPolarHBondContact O-CD 3.46Å
1571	W	91.4	Very high	86	Confident	9 Å²	9	49.1 Å²	49.1	3%	0.034	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-11.1	177.7	53.8	-97.6	0	0	0	114.3	A1563 D1565 F1569 L1575 L1605 F2138 W2187	A1563-W1571 HydrophobicContact CB-CB 4.06Å; A1563-W1571 HydrophobicContact CB-CD2 3.61Å; A1563-W1571 HydrophobicContact CB-CE3 4.09Å; A1563-W1571 HydrophobicContact CB-CG 3.58Å; D1565-W1571 PolarHBondContact O-NE1 2.92Å; F1569-W1571 HydrophobicContact CD1-CH2 4.35Å; F1569-W1571 AromaticContact CD1-CZ2 3.66Å; F1569-W1571 HydrophobicContact CD1-CZ2 3.66Å; F1569-W1571 HydrophobicContact CE1-CZ2 4.27Å; F1569-W1571 PolarHBondContact O-N 3.3Å; W1571-L1575 HydrophobicContact CE3-CD2 4.19Å; W1571-L1575 HydrophobicContact CZ3-CD2 4.19Å; W1571-L1575 VanDerWaalsContact O-CB 3.29Å; W1571-L1575 WeakPolarHBondContact O-CB 3.28Å; W1571-L1575 PolarHBondContact O-N 2.84Å; W1571-L1605 HydrophobicContact CH2-CD2 3.7Å; W1571-L1605 HydrophobicContact CZ3-CD2 3.68Å; W1571-F2138 HydrophobicContact CH2-CD1 4.43Å; W1571-F2138 AromaticContact CH2-CE1 3.87Å; W1571-F2138 HydrophobicContact CH2-CE1 3.87Å; W1571-F2138 HydrophobicContact CH2-CZ 4.37Å; W1571-W2187 AromaticContact CZ2-NE1 3.99Å
1572	L	90.3	Very high	85.1	Confident	4 Å²	4	52 Å²	52	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-61.1	-52.1	-177.8	-170.1	76.6	0	0	0	111.2	F1569 D1570 L1575 Q1576 F2130 V2135 F2138	F1569-L1572 VanDerWaalsContact O-CB 3.23Å; F1569-L1572 WeakPolarHBondContact O-CB 3.17Å; F1569-L1572 PolarHBondContact O-N 3.06Å; D1570-L1572 VanDerWaalsContact C-N 3.28Å; D1570-L1572 PolarHBondContact O-N 3.48Å; L1572-L1575 PolarHBondContact O-N 2.98Å; L1572-Q1576 WeakPolarHBondContact O-CB 3.45Å; L1572-Q1576 VanDerWaalsContact O-CG 3.28Å; L1572-Q1576 WeakPolarHBondContact O-CG 3.42Å; L1572-Q1576 PolarHBondContact O-N 2.96Å; L1572-Q1576 PolarHBondContact O-OE1 3.45Å; L1572-F2130 HydrophobicContact CD1-CD2 4.46Å; L1572-F2130 HydrophobicContact CD1-CE2 3.48Å; L1572-F2130 VanDerWaalsContact CD1-CE2 3.48Å; L1572-F2130 HydrophobicContact CD1-CZ 3.66Å; L1572-V2135 HydrophobicContact CD2-CG2 4.3Å; L1572-F2138 HydrophobicContact CD1-CD2 3.74Å; L1572-F2138 HydrophobicContact CD1-CE2 3.4Å; L1572-F2138 VanDerWaalsContact CD1-CE2 3.4Å; L1572-F2138 HydrophobicContact CD1-CG 4.49Å; L1572-F2138 HydrophobicContact CD1-CZ 3.91Å; L1572-F2138 HydrophobicContact CD2-CD2 4.22Å
1573	Q	86.5	Confident	83.7	Confident	147 Å²	147	48.9 Å²	48.9	69%	0.687	26%	0.263	S	S	*	.	H	α-helix	trans	-62.4	-50.1	179.1	-110.9	-173.5	-12.1	0	0	112.7	L1575 Q1576 S1577	Q1573-L1575 VanDerWaalsContact C-N 3.31Å; Q1573-L1575 PolarHBondContact O-N 2.89Å; Q1573-Q1576 PolarHBondContact O-N 2.83Å; Q1573-S1577 WeakPolarHBondContact O-CB 3.35Å; Q1573-S1577 PolarHBondContact O-N 2.87Å; Q1573-S1577 PolarHBondContact O-OG 2.98Å
1574	P	88.4	Confident	82.3	Confident	62 Å²	62	53.4 Å²	53.4	40%	0.403	28%	0.283	S	S	.	.	H	α-helix	trans	-52.6	-45.3	171.9	-29.7	36	0	0	0	113.4	V1561 D1570 S1577 T1578	V1561-P1574 HydrophobicContact CG1-CB 4.24Å; D1570-P1574 WeakPolarHBondContact O-CD 3.46Å; P1574-S1577 PolarHBondContact O-N 2.9Å; P1574-T1578 PolarHBondContact O-N 3.23Å; P1574-T1578 PolarHBondContact O-OG1 3.25Å; P1574-T1578 VanDerWaalsContact O-OG1 3.05Å
1575	L	89.7	Confident	81.3	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-67.7	-41.5	179.8	-174.7	54	0	0	0	112.2	V1561 W1571 L1572 Q1573 S1577 T1578 L1579 V1591 V1593 L1605 L1609 F2130	V1561-L1575 HydrophobicContact CB-CD1 4.33Å; V1561-L1575 HydrophobicContact CG1-CB 4.15Å; V1561-L1575 HydrophobicContact CG2-CD1 4.21Å; W1571-L1575 HydrophobicContact CE3-CD2 4.19Å; W1571-L1575 HydrophobicContact CZ3-CD2 4.19Å; W1571-L1575 VanDerWaalsContact O-CB 3.29Å; W1571-L1575 WeakPolarHBondContact O-CB 3.28Å; W1571-L1575 PolarHBondContact O-N 2.84Å; L1572-L1575 PolarHBondContact O-N 2.98Å; Q1573-L1575 VanDerWaalsContact C-N 3.31Å; Q1573-L1575 PolarHBondContact O-N 2.89Å; L1575-S1577 VanDerWaalsContact C-N 3.35Å; L1575-T1578 PolarHBondContact O-N 3.28Å; L1575-L1579 HydrophobicContact CD1-CD1 4.23Å; L1575-L1579 HydrophobicContact CD1-CG 4.2Å; L1575-L1579 HydrophobicContact CG-CD1 4.09Å; L1575-L1579 WeakPolarHBondContact O-CB 3.33Å; L1575-L1579 VanDerWaalsContact O-CG 3.27Å; L1575-L1579 WeakPolarHBondContact O-CG 3.38Å; L1575-L1579 PolarHBondContact O-N 3.32Å; L1575-V1591 HydrophobicContact CD1-CG1 4.01Å; L1575-V1593 HydrophobicContact CD1-CG2 3.78Å; L1575-V1593 HydrophobicContact CD2-CG1 4.05Å; L1575-V1593 HydrophobicContact CD2-CG2 4.02Å; L1575-L1605 HydrophobicContact CD2-CD2 4.33Å; L1575-L1609 HydrophobicContact CD2-CD1 4.18Å; L1575-F2130 HydrophobicContact CB-CE1 4.27Å; L1575-F2130 HydrophobicContact CB-CZ 4.2Å; L1575-F2130 HydrophobicContact CD2-CE1 4.25Å; L1575-F2130 HydrophobicContact CD2-CZ 3.81Å; L1575-F2130 HydrophobicContact CG-CE1 3.9Å; L1575-F2130 HydrophobicContact CG-CZ 3.93Å
1576	Q	88.2	Confident	79.9	Confident	33 Å²	33	58.7 Å²	58.7	15%	0.154	32%	0.322	C	S	.	.	H	α-helix	trans	-56.8	-49.3	171.9	-73.9	167.8	-39.3	0	0	110.6	L1572 Q1573 T1578 L1579 E1580 F2130 Q2133	L1572-Q1576 WeakPolarHBondContact O-CB 3.45Å; L1572-Q1576 VanDerWaalsContact O-CG 3.28Å; L1572-Q1576 WeakPolarHBondContact O-CG 3.42Å; L1572-Q1576 PolarHBondContact O-N 2.96Å; L1572-Q1576 PolarHBondContact O-OE1 3.45Å; Q1573-Q1576 PolarHBondContact O-N 2.83Å; Q1576-T1578 PolarHBondContact O-N 3.37Å; Q1576-L1579 PolarHBondContact O-N 3.42Å; Q1576-E1580 WeakPolarHBondContact O-CB 3.35Å; Q1576-E1580 PolarHBondContact O-N 2.94Å; Q1576-F2130 HydrophobicContact CB-CE1 4.35Å; Q1576-F2130 HydrophobicContact CG-CD1 3.85Å; Q1576-F2130 HydrophobicContact CG-CE1 3.48Å; Q1576-F2130 VanDerWaalsContact CG-CE1 3.48Å; Q1576-F2130 HydrophobicContact CG-CZ 4.1Å; Q1576-F2130 PolarHBondContact NE2-O 3.19Å; Q1576-Q2133 PolarHBondContact NE2-O 2.7Å
1577	S	83.8	Confident	78.7	Confident	58 Å²	58	60.1 Å²	60.1	41%	0.406	33%	0.333	S	S	.	.	H	α-helix	trans	-61.3	-40.9	178	-58.7	0	0	0	0	112.9	Q1573 P1574 L1575 N1581	Q1573-S1577 WeakPolarHBondContact O-CB 3.35Å; Q1573-S1577 PolarHBondContact O-N 2.87Å; Q1573-S1577 PolarHBondContact O-OG 2.98Å; P1574-S1577 PolarHBondContact O-N 2.9Å; L1575-S1577 VanDerWaalsContact C-N 3.35Å; S1577-N1581 VanDerWaalsContact O-CB 3.3Å; S1577-N1581 WeakPolarHBondContact O-CB 3.27Å; S1577-N1581 PolarHBondContact O-N 3.41Å; S1577-N1581 PolarHBondContact O-ND2 2.97Å
1578	T	84.8	Confident	77.9	Confident	27 Å²	27	60 Å²	60	17%	0.166	33%	0.325	C	S	.	.	H	α-helix	trans	-68	-41.5	177	-58.2	0	0	0	0	111.8	H1559 V1561 P1574 L1575 Q1576 N1581 Y1582 V1591	H1559-T1578 HydrophobicContact CB-CG2 3.85Å; V1561-T1578 HydrophobicContact CG2-CG2 4.22Å; P1574-T1578 PolarHBondContact O-N 3.23Å; P1574-T1578 PolarHBondContact O-OG1 3.25Å; P1574-T1578 VanDerWaalsContact O-OG1 3.05Å; L1575-T1578 PolarHBondContact O-N 3.28Å; Q1576-T1578 PolarHBondContact O-N 3.37Å; T1578-N1581 PolarHBondContact O-N 3.48Å; T1578-Y1582 HydrophobicContact CG2-CD2 4.13Å; T1578-Y1582 WeakPolarHBondContact O-CB 3.47Å; T1578-Y1582 WeakPolarHBondContact O-CD2 3.02Å; T1578-Y1582 PolarHBondContact O-N 3.34Å; T1578-V1591 HydrophobicContact CG2-CG1 3.79Å; T1578-V1591 HydrophobicContact CG2-CG2 3.99Å
1579	L	82.6	Confident	77.5	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.026	31%	0.314	C	S	.	.	I	π-helix	trans	-64.3	-47	176.8	-69.8	168.2	0	0	0	111.4	L1575 Q1576 N1581 Y1582 A1583 V1591 L1609 I1618 F2130	L1575-L1579 HydrophobicContact CD1-CD1 4.23Å; L1575-L1579 HydrophobicContact CD1-CG 4.2Å; L1575-L1579 HydrophobicContact CG-CD1 4.09Å; L1575-L1579 WeakPolarHBondContact O-CB 3.33Å; L1575-L1579 VanDerWaalsContact O-CG 3.27Å; L1575-L1579 WeakPolarHBondContact O-CG 3.38Å; L1575-L1579 PolarHBondContact O-N 3.32Å; Q1576-L1579 PolarHBondContact O-N 3.42Å; L1579-N1581 VanDerWaalsContact C-N 3.3Å; L1579-N1581 PolarHBondContact O-N 2.9Å; L1579-Y1582 PolarHBondContact O-N 3.04Å; L1579-A1583 HydrophobicContact CB-CB 4.4Å; L1579-A1583 HydrophobicContact CD2-CB 4.05Å; L1579-A1583 WeakPolarHBondContact O-CB 3.32Å; L1579-A1583 PolarHBondContact O-N 2.93Å; L1579-V1591 HydrophobicContact CD2-CB 4.4Å; L1579-V1591 HydrophobicContact CD2-CG1 4.19Å; L1579-V1591 HydrophobicContact CD2-CG2 4.39Å; L1579-L1609 HydrophobicContact CD1-CD1 4.41Å; L1579-L1609 HydrophobicContact CD1-CD2 3.77Å; L1579-I1618 HydrophobicContact CD2-CD1 3.46Å; L1579-I1618 VanDerWaalsContact CD2-CD1 3.46Å; L1579-F2130 HydrophobicContact CD1-CD1 3.55Å; L1579-F2130 HydrophobicContact CD1-CE1 3.58Å
1580	E	76.3	Confident	77.3	Confident	146 Å²	146	58.8 Å²	58.8	68%	0.682	32%	0.315	S	S	*	.	I	π-helix	trans	-60.5	-39	177.6	-169.7	169.7	-129	0	0	112.2	Q1576	Q1576-E1580 WeakPolarHBondContact O-CB 3.35Å; Q1576-E1580 PolarHBondContact O-N 2.94Å
1581	N	75.5	Confident	77.4	Confident	81 Å²	81	53.6 Å²	53.6	43%	0.433	29%	0.288	S	S	.	.	I	π-helix	trans	-79.1	-24.6	179.5	-83.4	-83.1	0	0	0	115.3	S1577 T1578 L1579 K1585	S1577-N1581 VanDerWaalsContact O-CB 3.3Å; S1577-N1581 WeakPolarHBondContact O-CB 3.27Å; S1577-N1581 PolarHBondContact O-N 3.41Å; S1577-N1581 PolarHBondContact O-ND2 2.97Å; T1578-N1581 PolarHBondContact O-N 3.48Å; L1579-N1581 VanDerWaalsContact C-N 3.3Å; L1579-N1581 PolarHBondContact O-N 2.9Å; N1581-K1585 VanDerWaalsContact O-CD 3.23Å; N1581-K1585 WeakPolarHBondContact O-CD 3.44Å; N1581-K1585 WeakPolarHBondContact O-CE 3.41Å; N1581-K1585 PolarHBondContact O-NZ 2.85Å
1582	Y	70.9	Confident	77.3	Confident	73 Å²	73	53.3 Å²	53.3	29%	0.286	29%	0.286	S	S	.	.	I	π-helix	trans	-134	-28.8	-167.6	-62.6	-82.7	0	0	0	115.7	H1559 T1578 L1579 F1584 K1585 K1617	H1559-Y1582 AromaticContact CD2-CD1 3.7Å; H1559-Y1582 AromaticContact CD2-CG 3.8Å; H1559-Y1582 AromaticContact CE1-CD1 3.84Å; H1559-Y1582 AromaticContact CE1-CE1 3.44Å; H1559-Y1582 VanDerWaalsContact CE1-CE1 3.44Å; H1559-Y1582 WeakPolarHBondContact CE1-CE1 3.05Å; H1559-Y1582 AromaticContact CE1-CZ 3.66Å; H1559-Y1582 AromaticContact NE2-CD1 3.29Å; H1559-Y1582 VanDerWaalsContact NE2-CD1 3.29Å; H1559-Y1582 WeakPolarHBondContact NE2-CD1 3.36Å; H1559-Y1582 AromaticContact NE2-CE1 3.35Å; H1559-Y1582 WeakPolarHBondContact NE2-CE1 3.3Å; H1559-Y1582 AromaticContact NE2-CG 3.88Å; H1559-Y1582 AromaticContact NE2-CZ 3.99Å; T1578-Y1582 HydrophobicContact CG2-CD2 4.13Å; T1578-Y1582 WeakPolarHBondContact O-CB 3.47Å; T1578-Y1582 WeakPolarHBondContact O-CD2 3.02Å; T1578-Y1582 PolarHBondContact O-N 3.34Å; L1579-Y1582 PolarHBondContact O-N 3.04Å; Y1582-F1584 VanDerWaalsContact C-N 3.28Å; Y1582-F1584 PolarHBondContact O-N 2.67Å; Y1582-K1585 HydrophobicContact CD1-CD 4.45Å; Y1582-K1585 PolarHBondContact O-N 2.86Å; Y1582-K1617 PolarHBondContact O-NZ 2.78Å
1583	A	62	Low	77.4	Confident	5 Å²	5	53.1 Å²	53.1	4%	0.041	29%	0.286	C	S	.	.	I	π-helix	trans	-66.7	-30.5	-178.1	0	0	0	0	0	112.7	L1579	L1579-A1583 HydrophobicContact CB-CB 4.4Å; L1579-A1583 HydrophobicContact CD2-CB 4.05Å; L1579-A1583 WeakPolarHBondContact O-CB 3.32Å; L1579-A1583 PolarHBondContact O-N 2.93Å
1584	F	60	Low	77.6	Confident	95 Å²	95	46.3 Å²	46.3	42%	0.417	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-0.7	-179.6	-60.7	-78.7	0	0	0	114.7	Y1582 H1613 K2327	Y1582-F1584 VanDerWaalsContact C-N 3.28Å; Y1582-F1584 PolarHBondContact O-N 2.67Å; F1584-H1613 AromaticContact CZ-CE1 3.84Å; F1584-H1613 AromaticContact CZ-ND1 3.51Å; F1584-K2327 HydrophobicContact CE1-CD 4.44Å
1585	K	64.7	Low	77.7	Confident	97 Å²	97	43.4 Å²	43.4	42%	0.422	24%	0.235	S	C	.	.	S	Bend	trans	-78.2	151.5	175.3	-77	179.4	177.6	146.3	0	111.3	N1581 Y1582 S1587 K1617	N1581-K1585 VanDerWaalsContact O-CD 3.23Å; N1581-K1585 WeakPolarHBondContact O-CD 3.44Å; N1581-K1585 WeakPolarHBondContact O-CE 3.41Å; N1581-K1585 PolarHBondContact O-NZ 2.85Å; Y1582-K1585 HydrophobicContact CD1-CD 4.45Å; Y1582-K1585 PolarHBondContact O-N 2.86Å; K1585-S1587 VanDerWaalsContact C-N 3.32Å; K1585-S1587 PolarHBondContact O-N 2.73Å; K1585-K1617 PolarHBondContact O-NZ 3.41Å
1586	A	56.5	Low	77.5	Confident	113 Å²	113	45.1 Å²	45.1	93%	0.934	24%	0.244	S	C	*	.	S	Bend	trans	-79.8	-4.7	-179.3	0	0	0	0	0	114.9
1587	S	58.9	Low	77.2	Confident	47 Å²	47	47.7 Å²	47.7	33%	0.329	25%	0.253	S	S	.	.	S	Bend	trans	-68.6	158.4	167.4	47.1	0	0	0	0	111.1	K1585 D1589 K1617	K1585-S1587 VanDerWaalsContact C-N 3.32Å; K1585-S1587 PolarHBondContact O-N 2.73Å; S1587-D1589 WeakPolarHBondContact CB-OD2 3.41Å; S1587-D1589 PolarHBondContact O-N 2.82Å; S1587-D1589 PolarHBondContact OG-OD2 2.63Å; S1587-K1617 WeakPolarHBondContact O-CE 3.44Å; S1587-K1617 PolarHBondContact O-NZ 2.98Å
1588	E	65.5	Low	77.1	Confident	96 Å²	96	46.2 Å²	46.2	45%	0.449	24%	0.241	S	C	.	.			trans	-82.2	12.4	177.1	-68.6	-162.9	-154	0	0	114.3	N1556 T1590	N1556-E1588 PolarHBondContact ND2-O 2.86Å; N1556-E1588 PolarHBondContact ND2-OE2 3.13Å; N1556-E1588 WeakPolarHBondContact OD1-CB 3.35Å; E1588-T1590 WeakPolarHBondContact O-CG2 2.95Å
1589	D	76.2	Confident	77	Confident	23 Å²	23	48.6 Å²	48.6	12%	0.123	25%	0.247	C	C	.	.			trans	-55.5	138	179.1	-50.1	-39.6	0	0	0	112.7	I1557 S1587 K1617	I1557-D1589 WeakPolarHBondContact CB-OD1 3.42Å; S1587-D1589 WeakPolarHBondContact CB-OD2 3.41Å; S1587-D1589 PolarHBondContact O-N 2.82Å; S1587-D1589 PolarHBondContact OG-OD2 2.63Å; D1589-K1617 WeakPolarHBondContact O-CD 3.41Å; D1589-K1617 VanDerWaalsContact O-CE 3.23Å; D1589-K1617 WeakPolarHBondContact O-CE 3.2Å
1590	T	84.4	Confident	77.3	Confident	5 Å²	5	48.3 Å²	48.3	3%	0.031	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	150.8	-174.6	60.6	0	0	0	0	113.3	I1557 H1559 E1588 W1592 K1617 D1649	I1557-T1590 PolarHBondContact O-N 3.35Å; I1557-T1590 VanDerWaalsContact O-N 3.14Å; H1559-T1590 PolarHBondContact N-O 2.79Å; E1588-T1590 WeakPolarHBondContact O-CG2 2.95Å; T1590-W1592 PolarHBondContact OG1-NE1 3.36Å; T1590-K1617 WeakPolarHBondContact CB-O 3.34Å; T1590-D1649 WeakPolarHBondContact CG2-OD1 3.27Å
1591	V	88.5	Confident	78	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	116.1	-175.5	-178.9	0	0	0	0	109.7	L1575 T1578 L1579 K1617 R1619	L1575-V1591 HydrophobicContact CD1-CG1 4.01Å; T1578-V1591 HydrophobicContact CG2-CG1 3.79Å; T1578-V1591 HydrophobicContact CG2-CG2 3.99Å; L1579-V1591 HydrophobicContact CD2-CB 4.4Å; L1579-V1591 HydrophobicContact CD2-CG1 4.19Å; L1579-V1591 HydrophobicContact CD2-CG2 4.39Å; V1591-K1617 PolarHBondContact N-O 2.94Å; V1591-R1619 PolarHBondContact O-N 3.11Å
1592	W	90.4	Very high	78.8	Confident	2 Å²	2	37.5 Å²	37.5	1%	0.008	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	112.3	-173.8	-74.1	76.1	0	0	0	111.4	P1558 H1559 V1560 V1561 T1590 V1594 R1619 I1621 M1646 N1653	P1558-W1592 VanDerWaalsContact CB-CD1 3.47Å; P1558-W1592 HydrophobicContact CB-CG 4.37Å; H1559-W1592 PolarHBondContact O-N 3.18Å; V1560-W1592 WeakPolarHBondContact CA-O 3.27Å; V1560-W1592 HydrophobicContact CG2-CB 4.13Å; V1561-W1592 PolarHBondContact N-O 3.06Å; T1590-W1592 PolarHBondContact OG1-NE1 3.36Å; W1592-V1594 HydrophobicContact CB-CG2 4.18Å; W1592-R1619 WeakPolarHBondContact CA-O 3.38Å; W1592-R1619 HydrophobicContact CD2-CB 3.35Å; W1592-R1619 HydrophobicContact CD2-CG 4.1Å; W1592-R1619 HydrophobicContact CE3-CB 3.67Å; W1592-R1619 HydrophobicContact CG-CB 3.76Å; W1592-R1619 HydrophobicContact CG-CG 4.48Å; W1592-R1619 HydrophobicContact CH2-CB 3.98Å; W1592-R1619 HydrophobicContact CH2-CG 4.34Å; W1592-R1619 HydrophobicContact CZ2-CB 3.72Å; W1592-R1619 HydrophobicContact CZ2-CG 3.73Å; W1592-R1619 HydrophobicContact CZ3-CB 3.97Å; W1592-I1621 HydrophobicContact CE3-CD1 3.7Å; W1592-I1621 HydrophobicContact CE3-CG1 3.88Å; W1592-I1621 HydrophobicContact CZ3-CD1 3.71Å; W1592-I1621 HydrophobicContact CZ3-CG1 3.78Å; W1592-M1646 HydrophobicContact CD2-CE 3.94Å; W1592-M1646 HydrophobicContact CD2-CG 4.24Å; W1592-M1646 HydrophobicContact CE3-CE 4.43Å; W1592-M1646 HydrophobicContact CE3-CG 3.97Å; W1592-M1646 HydrophobicContact CG-CE 4.01Å; W1592-M1646 HydrophobicContact CH2-CB 4.14Å; W1592-M1646 HydrophobicContact CH2-CG 3.92Å; W1592-M1646 HydrophobicContact CZ2-CB 4.09Å; W1592-M1646 HydrophobicContact CZ2-CG 4.14Å; W1592-M1646 HydrophobicContact CZ3-CG 3.81Å; W1592-N1653 WeakPolarHBondContact CZ3-ND2 3.47Å
1593	V	91.6	Very high	79.6	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.006	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	115.3	176.8	-164.3	0	0	0	0	109.8	A1563 L1575 I1602 R1619 S1620 I1621	A1563-V1593 HydrophobicContact CB-CG1 4Å; L1575-V1593 HydrophobicContact CD1-CG2 3.78Å; L1575-V1593 HydrophobicContact CD2-CG1 4.05Å; L1575-V1593 HydrophobicContact CD2-CG2 4.02Å; V1593-I1602 HydrophobicContact CG1-CD1 4.13Å; V1593-I1602 HydrophobicContact CG1-CG1 4.47Å; V1593-R1619 PolarHBondContact N-O 3.5Å; V1593-S1620 VanDerWaalsContact O-CA 3.28Å; V1593-S1620 WeakPolarHBondContact O-CA 3.18Å; V1593-I1621 PolarHBondContact O-N 3.47Å
1594	V	91.6	Very high	80.9	Confident	4 Å²	4	34.4 Å²	34.4	2%	0.024	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	137.2	-161.1	-177.8	0	0	0	0	112.7	V1560 V1561 V1562 A1563 W1592 I1621 L1637	V1560-V1594 HydrophobicContact CG1-CB 4.36Å; V1560-V1594 HydrophobicContact CG1-CG2 3.81Å; V1561-V1594 PolarHBondContact O-N 2.83Å; V1562-V1594 CarbonylContact C-O 3.54Å; V1562-V1594 WeakPolarHBondContact CA-O 3.48Å; A1563-V1594 PolarHBondContact N-O 3.05Å; W1592-V1594 HydrophobicContact CB-CG2 4.18Å; V1594-I1621 CarbonylContact C-O 3.57Å; V1594-I1621 WeakPolarHBondContact CA-O 3.37Å; V1594-I1621 HydrophobicContact CB-CB 4.49Å; V1594-I1621 HydrophobicContact CG1-CB 4.07Å; V1594-I1621 HydrophobicContact CG1-CG2 4.09Å; V1594-I1621 HydrophobicContact CG2-CB 4.18Å; V1594-L1637 HydrophobicContact CG1-CD1 3.61Å; V1594-L1637 HydrophobicContact CG1-CD2 3.48Å; V1594-L1637 VanDerWaalsContact CG1-CD2 3.48Å; V1594-L1637 HydrophobicContact CG1-CG 4.16Å
1595	S	88.7	Confident	82.4	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	120.9	174.5	172	0	0	0	0	112.3	N1564 R1597 N1600 I1621 M1622 D1623	N1564-S1595 WeakPolarHBondContact OD1-CA 3.46Å; N1564-S1595 PolarHBondContact OD1-OG 3.29Å; S1595-R1597 VanDerWaalsContact C-N 3.3Å; S1595-R1597 WeakPolarHBondContact OG-CB 3.4Å; S1595-R1597 PolarHBondContact OG-N 3.11Å; S1595-R1597 VanDerWaalsContact OG-N 3.12Å; S1595-R1597 PolarHBondContact OG-O 2.81Å; S1595-N1600 VanDerWaalsContact CB-ND2 3.3Å; S1595-N1600 WeakPolarHBondContact CB-ND2 3.35Å; S1595-N1600 PolarHBondContact OG-ND2 3.37Å; S1595-I1621 PolarHBondContact N-O 2.99Å; S1595-M1622 WeakPolarHBondContact O-CA 3.19Å; S1595-D1623 PolarHBondContact O-N 3.49Å; S1595-D1623 VanDerWaalsContact O-N 3.1Å
1596	N	85.4	Confident	83.6	Confident	37 Å²	37	25.4 Å²	25.4	20%	0.198	14%	0.142	C	C	.	.			trans	-87.4	-0.9	163.8	68.5	-10.1	0	0	0	112.7	N1564 N1633 L1635 L1637	N1564-N1596 PolarHBondContact ND2-OD1 2.78Å; N1564-N1596 PolarHBondContact OD1-N 2.83Å; N1564-N1596 PolarHBondContact OD1-OD1 2.88Å; N1596-N1633 HydrophobicContact CB-CB 4.33Å; N1596-N1633 PolarHBondContact ND2-ND2 2.79Å; N1596-N1633 WeakPolarHBondContact O-CB 3.45Å; N1596-N1633 PolarHBondContact O-ND2 2.99Å; N1596-N1633 PolarHBondContact O-OD1 3.26Å; N1596-N1633 PolarHBondContact OD1-ND2 2.97Å; N1596-L1635 WeakPolarHBondContact CB-O 3.43Å; N1596-L1637 HydrophobicContact CB-CD1 4.44Å; N1596-L1637 HydrophobicContact CB-CD2 4.4Å; N1596-L1637 HydrophobicContact CB-CG 4.35Å
1597	R	84	Confident	85.1	Confident	87 Å²	87	20.9 Å²	20.9	33%	0.328	10%	0.102	S	C	.	.			trans	-78.5	125.7	170.5	-176.8	-178.5	-172.8	142.7	5.8	111.8	N1564 V1566 S1595 R1599	N1564-R1597 WeakPolarHBondContact O-CD 3.01Å; N1564-R1597 PolarHBondContact O-NH1 2.9Å; N1564-R1597 VanDerWaalsContact O-NH1 3.11Å; N1564-R1597 PolarHBondContact OD1-N 3.14Å; V1566-R1597 VanDerWaalsContact CG2-NH2 3.28Å; S1595-R1597 VanDerWaalsContact C-N 3.3Å; S1595-R1597 WeakPolarHBondContact OG-CB 3.4Å; S1595-R1597 PolarHBondContact OG-N 3.11Å; S1595-R1597 VanDerWaalsContact OG-N 3.12Å; S1595-R1597 PolarHBondContact OG-O 2.81Å; R1597-R1599 PolarHBondContact NE-O 3.39Å; R1597-R1599 PolarHBondContact O-N 2.73Å
1598	V	79.7	Confident	86.4	Confident	27 Å²	27	18.7 Å²	18.7	16%	0.164	9%	0.087	C	C	.	.	S	Bend	trans	-74.2	-19.4	-172.7	-145.2	0	0	0	0	115.7	M1622 D1623 S1625 Y2198	V1598-M1622 WeakPolarHBondContact O-CE 3.26Å; V1598-D1623 WeakPolarHBondContact CA-O 3.19Å; V1598-S1625 WeakPolarHBondContact CG1-O 3.33Å; V1598-Y2198 VanDerWaalsContact CG1-OH 3.3Å; V1598-Y2198 WeakPolarHBondContact CG1-OH 3.39Å
1599	R	83.9	Confident	87.4	Confident	76 Å²	76	14.1 Å²	14.1	29%	0.287	7%	0.065	S	C	.	.	S	Bend	trans	-112.4	99.1	171.5	-69	-175.6	-179.4	-172.8	-2.9	109	R1597 E2150 Y2191 Y2198	R1597-R1599 PolarHBondContact NE-O 3.39Å; R1597-R1599 PolarHBondContact O-N 2.73Å; R1599-E2150 IonicContact CZ-OE1 3.22Å; R1599-E2150 IonicContact NH1-OE1 2.76Å; R1599-E2150 PolarHBondContact NH1-OE1 3.26Å; R1599-Y2191 HydrophobicContact CB-CE2 4.37Å; R1599-Y2191 VanDerWaalsContact O-CE2 3.26Å; R1599-Y2191 WeakPolarHBondContact O-CE2 3.41Å; R1599-Y2198 HydrophobicContact CG-CE2 4.28Å
1600	N	89.4	Confident	87.7	Confident	0 Å²	0	13.7 Å²	13.7	0%	0	6%	0.062	C	C	.	.			trans	-153.3	164.7	-178.9	-152.9	-25.4	0	0	0	109.9	A1563 S1595 M1622 W2187	A1563-N1600 PolarHBondContact O-ND2 2.83Å; S1595-N1600 VanDerWaalsContact CB-ND2 3.3Å; S1595-N1600 WeakPolarHBondContact CB-ND2 3.35Å; S1595-N1600 PolarHBondContact OG-ND2 3.37Å; N1600-M1622 HydrophobicContact CB-CE 3.65Å; N1600-M1622 HydrophobicContact CB-SD 3.97Å; N1600-M1622 WeakPolarHBondContact O-CE 3.49Å; N1600-W2187 PolarHBondContact OD1-NE1 2.69Å
1601	G	90.2	Very high	87.4	Confident	0 Å²	0	14 Å²	14	0%	0	6%	0.063	C	C	.	.			trans	-106.9	12.6	-177.9	0	0	0	0	0	115.4	P1603 G1604 L1605 W2187 S2190	G1601-P1603 VanDerWaalsContact C-CD 3.42Å; G1601-G1604 PolarHBondContact O-N 3.04Å; G1601-L1605 PolarHBondContact O-N 3.15Å; G1601-W2187 VanDerWaalsContact CA-CD1 3.49Å; G1601-W2187 WeakPolarHBondContact CA-O 3.17Å; G1601-W2187 WeakPolarHBondContact O-CA 3.25Å; G1601-S2190 WeakPolarHBondContact O-CB 3.46Å
1602	I	91.6	Very high	86.8	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-51.1	-41.5	-173.1	-70.4	-175.4	0	0	0	114.7	A1563 V1593 G1604 L1605 A1606 M1622	A1563-I1602 HydrophobicContact CB-CD1 4.11Å; V1593-I1602 HydrophobicContact CG1-CD1 4.13Å; V1593-I1602 HydrophobicContact CG1-CG1 4.47Å; I1602-G1604 PolarHBondContact O-N 2.92Å; I1602-L1605 WeakPolarHBondContact O-CB 3.44Å; I1602-L1605 PolarHBondContact O-N 2.81Å; I1602-A1606 WeakPolarHBondContact O-CB 3.46Å; I1602-A1606 PolarHBondContact O-N 2.99Å; I1602-M1622 HydrophobicContact CB-SD 4.49Å
1603	P	88.8	Confident	85.7	Confident	13 Å²	13	15.5 Å²	15.5	8%	0.084	7%	0.07	C	C	.	.	H	α-helix	trans	-58.2	-44.5	-178.1	-26.7	35.8	0	0	0	113.3	G1601 L1605 L1607 M1622 M1654	G1601-P1603 VanDerWaalsContact C-CD 3.42Å; P1603-L1605 VanDerWaalsContact C-N 3.35Å; P1603-L1607 WeakPolarHBondContact O-CG 3.34Å; P1603-L1607 PolarHBondContact O-N 3.39Å; P1603-M1622 HydrophobicContact CG-SD 4.26Å; P1603-M1654 HydrophobicContact CG-CE 3.98Å; P1603-M1654 HydrophobicContact CG-SD 3.76Å
1604	G	89.6	Confident	84	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-70.9	-28	175.9	0	0	0	0	0	113.6	G1601 I1602 C1608 S2190	G1601-G1604 PolarHBondContact O-N 3.04Å; I1602-G1604 PolarHBondContact O-N 2.92Å; G1604-C1608 PolarHBondContact O-N 3.05Å; G1604-C1608 PolarHBondContact O-SG 3.33Å; G1604-S2190 PolarHBondContact N-OG 3.4Å
1605	L	91.6	Very high	82.6	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-69.9	-48	173.5	178.9	63.1	0	0	0	111.7	W1571 L1575 G1601 I1602 P1603 L1607 C1608 L1609 F2130 F2138 T2183 W2187	W1571-L1605 HydrophobicContact CH2-CD2 3.7Å; W1571-L1605 HydrophobicContact CZ3-CD2 3.68Å; L1575-L1605 HydrophobicContact CD2-CD2 4.33Å; G1601-L1605 PolarHBondContact O-N 3.15Å; I1602-L1605 WeakPolarHBondContact O-CB 3.44Å; I1602-L1605 PolarHBondContact O-N 2.81Å; P1603-L1605 VanDerWaalsContact C-N 3.35Å; L1605-L1607 VanDerWaalsContact C-N 3.34Å; L1605-L1607 PolarHBondContact O-N 3.04Å; L1605-C1608 PolarHBondContact O-N 3.07Å; L1605-L1609 HydrophobicContact CD1-CD1 4.2Å; L1605-L1609 HydrophobicContact CD1-CG 4.28Å; L1605-L1609 HydrophobicContact CG-CD1 3.98Å; L1605-L1609 HydrophobicContact CG-CG 4.46Å; L1605-L1609 WeakPolarHBondContact O-CG 3.4Å; L1605-L1609 PolarHBondContact O-N 2.74Å; L1605-F2130 HydrophobicContact CD1-CE2 4.21Å; L1605-F2138 HydrophobicContact CD1-CZ 4.27Å; L1605-T2183 HydrophobicContact CD1-CG2 4.05Å; L1605-W2187 HydrophobicContact CB-CB 4.15Å
1606	A	89	Confident	81.9	Confident	2 Å²	2	22 Å²	22	2%	0.017	11%	0.106	C	C	.	.	H	α-helix	trans	-61.2	-42.3	-177.3	0	0	0	0	0	111.8	I1602 L1609 R1610 I1618	I1602-A1606 WeakPolarHBondContact O-CB 3.46Å; I1602-A1606 PolarHBondContact O-N 2.99Å; A1606-L1609 PolarHBondContact O-N 2.64Å; A1606-R1610 PolarHBondContact O-N 2.93Å; A1606-I1618 HydrophobicContact CB-CG2 4.13Å
1607	L	87.6	Confident	81.7	Confident	18 Å²	18	20.9 Å²	20.9	9%	0.094	10%	0.099	C	C	.	.	H	α-helix	trans	-64.4	-42.8	174.5	-71.7	167.1	0	0	0	112.2	P1603 L1605 L1609 R1610 E1611 A2176	P1603-L1607 WeakPolarHBondContact O-CG 3.34Å; P1603-L1607 PolarHBondContact O-N 3.39Å; L1605-L1607 VanDerWaalsContact C-N 3.34Å; L1605-L1607 PolarHBondContact O-N 3.04Å; L1607-L1609 PolarHBondContact O-N 2.95Å; L1607-R1610 PolarHBondContact O-N 3.25Å; L1607-E1611 PolarHBondContact O-N 2.93Å; L1607-A2176 WeakPolarHBondContact CD1-O 3.45Å
1608	C	87.7	Confident	81.9	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-64.2	-39.4	175.3	-67.3	0	0	0	0	112.5	G1604 L1605 E1611 E1612 S2174 N2179 T2183	G1604-C1608 PolarHBondContact O-N 3.05Å; G1604-C1608 PolarHBondContact O-SG 3.33Å; L1605-C1608 PolarHBondContact O-N 3.07Å; C1608-E1611 PolarHBondContact O-N 2.89Å; C1608-E1612 PolarHBondContact O-N 3.43Å; C1608-E1612 VanDerWaalsContact O-N 3.13Å; C1608-S2174 PolarHBondContact SG-O 3.49Å; C1608-N2179 PolarHBondContact SG-N 2.99Å; C1608-T2183 HydrophobicContact CB-CG2 3.53Å
1609	L	86.2	Confident	82.3	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-64.6	-38.3	175.7	-72.9	171.7	0	0	0	112	L1575 L1579 L1605 A1606 L1607 E1611 E1612 H1613 I1618 F2130 T2183	L1575-L1609 HydrophobicContact CD2-CD1 4.18Å; L1579-L1609 HydrophobicContact CD1-CD1 4.41Å; L1579-L1609 HydrophobicContact CD1-CD2 3.77Å; L1605-L1609 HydrophobicContact CD1-CD1 4.2Å; L1605-L1609 HydrophobicContact CD1-CG 4.28Å; L1605-L1609 HydrophobicContact CG-CD1 3.98Å; L1605-L1609 HydrophobicContact CG-CG 4.46Å; L1605-L1609 WeakPolarHBondContact O-CG 3.4Å; L1605-L1609 PolarHBondContact O-N 2.74Å; A1606-L1609 PolarHBondContact O-N 2.64Å; L1607-L1609 PolarHBondContact O-N 2.95Å; L1609-E1611 VanDerWaalsContact C-N 3.29Å; L1609-E1611 PolarHBondContact O-N 3.19Å; L1609-E1612 PolarHBondContact O-N 3.28Å; L1609-H1613 PolarHBondContact O-CD2 3.39Å; L1609-H1613 PolarHBondContact O-N 3.04Å; L1609-I1618 HydrophobicContact CB-CD1 4.15Å; L1609-I1618 HydrophobicContact CB-CG1 4.01Å; L1609-I1618 HydrophobicContact CB-CG2 4.34Å; L1609-F2130 HydrophobicContact CD2-CB 3.86Å; L1609-F2130 HydrophobicContact CD2-CD1 3.73Å; L1609-F2130 HydrophobicContact CD2-CD2 3.97Å; L1609-F2130 HydrophobicContact CD2-CE1 4.27Å; L1609-F2130 HydrophobicContact CD2-CE2 4.47Å; L1609-F2130 HydrophobicContact CD2-CG 3.56Å; L1609-T2183 HydrophobicContact CD2-CG2 3.86Å; L1609-T2183 HydrophobicContact CG-CG2 4.01Å
1610	R	81.9	Confident	82.7	Confident	15 Å²	15	12.2 Å²	12.2	6%	0.057	6%	0.064	C	C	.	.	H	α-helix	trans	-62.8	-34	174.6	-165.1	-159.7	70	-165.8	2.3	112.3	A1606 L1607 H1613	A1606-R1610 PolarHBondContact O-N 2.93Å; L1607-R1610 PolarHBondContact O-N 3.25Å; R1610-H1613 CarbonylContact O-C 3.58Å; R1610-H1613 VanDerWaalsContact O-O 3.05Å
1611	E	77.9	Confident	82.8	Confident	12 Å²	12	12.3 Å²	12.3	6%	0.056	6%	0.064	C	C	.	.	H	α-helix	trans	-78.1	-27.1	176.8	-66.9	-52	131.3	0	0	113.9	H1378 L1607 C1608 L1609 S2180 K2313	H1378-E1611 IonicContact CD2-OE2 2.83Å; H1378-E1611 IonicContact CE1-OE1 3.23Å; H1378-E1611 PolarHBondContact CE1-OE1 3.07Å; H1378-E1611 IonicContact CE1-OE2 2.82Å; H1378-E1611 VanDerWaalsContact NE2-CD 3.31Å; H1378-E1611 IonicContact NE2-OE1 3.18Å; H1378-E1611 PolarHBondContact NE2-OE1 3.03Å; H1378-E1611 IonicContact NE2-OE2 2.74Å; H1378-E1611 PolarHBondContact NE2-OE2 2.85Å; L1607-E1611 PolarHBondContact O-N 2.93Å; C1608-E1611 PolarHBondContact O-N 2.89Å; L1609-E1611 VanDerWaalsContact C-N 3.29Å; L1609-E1611 PolarHBondContact O-N 3.19Å; E1611-S2180 WeakPolarHBondContact CB-OG 3.28Å; E1611-S2180 PolarHBondContact O-OG 2.84Å; E1611-K2313 IonicContact OE2-NZ 2.73Å
1612	E	76.9	Confident	82.9	Confident	10 Å²	10	12.3 Å²	12.3	5%	0.047	6%	0.064	C	C	.	.	H	α-helix	trans	-75.4	-35	172.8	-70.6	-170.7	-154.8	0	0	112.8	C1608 L1609 L2129 F2130 S2180 G2181	C1608-E1612 PolarHBondContact O-N 3.43Å; C1608-E1612 VanDerWaalsContact O-N 3.13Å; L1609-E1612 PolarHBondContact O-N 3.28Å; E1612-L2129 HydrophobicContact CG-CD2 4.04Å; E1612-L2129 WeakPolarHBondContact OE2-CA 3.19Å; E1612-F2130 WeakPolarHBondContact OE2-CB 3.39Å; E1612-F2130 PolarHBondContact OE2-N 3.46Å; E1612-S2180 PolarHBondContact N-OG 3.21Å; E1612-G2181 WeakPolarHBondContact OE1-CA 3.37Å; E1612-G2181 PolarHBondContact OE1-N 2.64Å
1613	H	66.6	Low	82.7	Confident	23 Å²	23	12.3 Å²	12.3	11%	0.106	6%	0.064	C	C	.	.	S	Bend	trans	-113.1	98.8	-176.7	-54.4	-64.5	0	0	0	110.9	F1584 L1609 R1610 I1615	F1584-H1613 AromaticContact CZ-CE1 3.84Å; F1584-H1613 AromaticContact CZ-ND1 3.51Å; L1609-H1613 PolarHBondContact O-CD2 3.39Å; L1609-H1613 PolarHBondContact O-N 3.04Å; R1610-H1613 CarbonylContact O-C 3.58Å; R1610-H1613 VanDerWaalsContact O-O 3.05Å; H1613-I1615 PolarHBondContact O-N 3.21Å
1614	S	55.8	Low	82.6	Confident	29 Å²	29	11.9 Å²	11.9	20%	0.203	6%	0.061	C	C	.	.	S	Bend	trans	-57.1	-11.1	-173.5	-44.7	0	0	0	0	116.5	S2325	S1614-S2325 WeakPolarHBondContact OG-CA 3.5Å; S1614-S2325 WeakPolarHBondContact OG-CB 3.48Å; S1614-S2325 PolarHBondContact OG-N 3.44Å
1615	I	63.2	Low	82.4	Confident	96 Å²	96	12 Å²	12	49%	0.492	6%	0.062	S	C	.	.	S	Bend	trans	-100.6	115.6	178.1	-50	169	0	0	0	107.3	H1613 K1617	H1613-I1615 PolarHBondContact O-N 3.21Å; I1615-K1617 VanDerWaalsContact C-N 3.27Å; I1615-K1617 HydrophobicContact CG2-CD 4.21Å; I1615-K1617 HydrophobicContact CG2-CG 4.11Å; I1615-K1617 PolarHBondContact O-N 2.85Å
1616	N	73.9	Confident	81.8	Confident	16 Å²	16	14 Å²	14	9%	0.086	7%	0.071	C	C	.	.			trans	-77.3	72	-169.5	-168.2	-12.6	0	0	0	113.3	E1373 N1374 N1375 R1619	E1373-N1616 PolarHBondContact O-ND2 3.19Å; N1374-N1616 VanDerWaalsContact C-ND2 3.35Å; N1374-N1616 WeakPolarHBondContact CA-ND2 3.37Å; N1375-N1616 WeakPolarHBondContact O-CB 3.19Å; N1375-N1616 PolarHBondContact O-ND2 2.96Å; N1616-R1619 PolarHBondContact O-NH1 2.86Å; N1616-R1619 PolarHBondContact O-NH2 2.88Å; N1616-R1619 PolarHBondContact OD1-NH1 3.08Å; N1616-R1619 VanDerWaalsContact OD1-NH1 3.09Å
1617	K	80.9	Confident	80.6	Confident	14 Å²	14	21.2 Å²	21.2	6%	0.061	10%	0.102	C	C	.	.			trans	-99.9	-4.8	177.5	-74.6	178.4	157	-165.4	0	114.4	Y1582 K1585 S1587 D1589 T1590 V1591 I1615	Y1582-K1617 PolarHBondContact O-NZ 2.78Å; K1585-K1617 PolarHBondContact O-NZ 3.41Å; S1587-K1617 WeakPolarHBondContact O-CE 3.44Å; S1587-K1617 PolarHBondContact O-NZ 2.98Å; D1589-K1617 WeakPolarHBondContact O-CD 3.41Å; D1589-K1617 VanDerWaalsContact O-CE 3.23Å; D1589-K1617 WeakPolarHBondContact O-CE 3.2Å; T1590-K1617 WeakPolarHBondContact CB-O 3.34Å; V1591-K1617 PolarHBondContact N-O 2.94Å; I1615-K1617 VanDerWaalsContact C-N 3.27Å; I1615-K1617 HydrophobicContact CG2-CD 4.21Å; I1615-K1617 HydrophobicContact CG2-CG 4.11Å; I1615-K1617 PolarHBondContact O-N 2.85Å
1618	I	86.7	Confident	79	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	127	-178.2	-52.2	-58.9	0	0	0	109.4	L1579 A1606 L1609 H1651	L1579-I1618 HydrophobicContact CD2-CD1 3.46Å; L1579-I1618 VanDerWaalsContact CD2-CD1 3.46Å; A1606-I1618 HydrophobicContact CB-CG2 4.13Å; L1609-I1618 HydrophobicContact CB-CD1 4.15Å; L1609-I1618 HydrophobicContact CB-CG1 4.01Å; L1609-I1618 HydrophobicContact CB-CG2 4.34Å; I1618-H1651 PolarHBondContact O-ND1 3.07Å
1619	R	89.6	Confident	77.1	Confident	7 Å²	7	34.2 Å²	34.2	3%	0.026	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	152.4	175.9	-55.4	-66.7	174.9	-98.9	1.7	108.9	V1591 W1592 V1593 N1616 D1649 L1650 H1651	V1591-R1619 PolarHBondContact O-N 3.11Å; W1592-R1619 WeakPolarHBondContact CA-O 3.38Å; W1592-R1619 HydrophobicContact CD2-CB 3.35Å; W1592-R1619 HydrophobicContact CD2-CG 4.1Å; W1592-R1619 HydrophobicContact CE3-CB 3.67Å; W1592-R1619 HydrophobicContact CG-CB 3.76Å; W1592-R1619 HydrophobicContact CG-CG 4.48Å; W1592-R1619 HydrophobicContact CH2-CB 3.98Å; W1592-R1619 HydrophobicContact CH2-CG 4.34Å; W1592-R1619 HydrophobicContact CZ2-CB 3.72Å; W1592-R1619 HydrophobicContact CZ2-CG 3.73Å; W1592-R1619 HydrophobicContact CZ3-CB 3.97Å; V1593-R1619 PolarHBondContact N-O 3.5Å; N1616-R1619 PolarHBondContact O-NH1 2.86Å; N1616-R1619 PolarHBondContact O-NH2 2.88Å; N1616-R1619 PolarHBondContact OD1-NH1 3.08Å; N1616-R1619 VanDerWaalsContact OD1-NH1 3.09Å; R1619-D1649 IonicContact CZ-OD1 2.82Å; R1619-D1649 IonicContact CZ-OD2 3.43Å; R1619-D1649 VanDerWaalsContact NE-CG 3.26Å; R1619-D1649 PolarHBondContact NE-O 3.29Å; R1619-D1649 VanDerWaalsContact NE-O 3.14Å; R1619-D1649 IonicContact NE-OD1 2.77Å; R1619-D1649 PolarHBondContact NE-OD1 3.35Å; R1619-D1649 IonicContact NE-OD2 2.87Å; R1619-D1649 PolarHBondContact NE-OD2 2.9Å; R1619-D1649 IonicContact NH2-OD1 3.65Å; R1619-D1649 PolarHBondContact NH2-OD1 2.94Å; R1619-D1649 IonicContact NH2-OD2 3.21Å; R1619-D1649 PolarHBondContact NH2-OD2 3.45Å; R1619-L1650 VanDerWaalsContact CD-C 3.41Å; R1619-L1650 VanDerWaalsContact CD-O 3.24Å; R1619-L1650 WeakPolarHBondContact CD-O 3.46Å; R1619-H1651 CarbonylContact C-O 3.44Å
1620	S	91.8	Very high	75	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	146.3	-177.6	60.9	0	0	0	0	113.6	V1593 H1651 S1652 N1653	V1593-S1620 VanDerWaalsContact O-CA 3.28Å; V1593-S1620 WeakPolarHBondContact O-CA 3.18Å; S1620-H1651 PolarHBondContact N-O 2.71Å; S1620-H1651 PolarHBondContact OG-O 3.35Å; S1620-S1652 WeakPolarHBondContact OG-CA 3.49Å; S1620-N1653 WeakPolarHBondContact O-CB 3.4Å; S1620-N1653 PolarHBondContact O-N 3.48Å; S1620-N1653 PolarHBondContact O-ND2 2.81Å; S1620-N1653 VanDerWaalsContact O-ND2 3.08Å
1621	I	92.2	Very high	73.1	Confident	1 Å²	1	49 Å²	49	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	129.6	174.8	-70.9	170.7	0	0	0	109.3	W1592 V1593 V1594 S1595 L1635 L1637 V1642 M1646 N1653 W1660	W1592-I1621 HydrophobicContact CE3-CD1 3.7Å; W1592-I1621 HydrophobicContact CE3-CG1 3.88Å; W1592-I1621 HydrophobicContact CZ3-CD1 3.71Å; W1592-I1621 HydrophobicContact CZ3-CG1 3.78Å; V1593-I1621 PolarHBondContact O-N 3.47Å; V1594-I1621 CarbonylContact C-O 3.57Å; V1594-I1621 WeakPolarHBondContact CA-O 3.37Å; V1594-I1621 HydrophobicContact CB-CB 4.49Å; V1594-I1621 HydrophobicContact CG1-CB 4.07Å; V1594-I1621 HydrophobicContact CG1-CG2 4.09Å; V1594-I1621 HydrophobicContact CG2-CB 4.18Å; S1595-I1621 PolarHBondContact N-O 2.99Å; I1621-L1635 HydrophobicContact CG2-CD2 3.6Å; I1621-L1637 HydrophobicContact CG2-CD2 4.4Å; I1621-V1642 HydrophobicContact CD1-CG1 4.02Å; I1621-M1646 HydrophobicContact CD1-CG 4.01Å; I1621-M1646 HydrophobicContact CD1-SD 4.37Å; I1621-N1653 VanDerWaalsContact CA-O 3.3Å; I1621-N1653 WeakPolarHBondContact CA-O 3.47Å; I1621-N1653 HydrophobicContact CG1-CB 4.15Å; I1621-W1660 HydrophobicContact CG2-CH2 4.03Å; I1621-W1660 HydrophobicContact CG2-CZ3 4.24Å
1622	M	90.8	Very high	71.7	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	134.6	173.5	-179.2	178.3	169.4	0	0	113.2	S1595 V1598 N1600 I1602 P1603 T1624 N1653 M1654 Y1655 R2194	S1595-M1622 WeakPolarHBondContact O-CA 3.19Å; V1598-M1622 WeakPolarHBondContact O-CE 3.26Å; N1600-M1622 HydrophobicContact CB-CE 3.65Å; N1600-M1622 HydrophobicContact CB-SD 3.97Å; N1600-M1622 WeakPolarHBondContact O-CE 3.49Å; I1602-M1622 HydrophobicContact CB-SD 4.49Å; P1603-M1622 HydrophobicContact CG-SD 4.26Å; M1622-T1624 HydrophobicContact CE-CG2 4.12Å; M1622-T1624 HydrophobicContact CG-CG2 4.08Å; M1622-T1624 HydrophobicContact SD-CG2 4.27Å; M1622-N1653 PolarHBondContact N-O 2.73Å; M1622-N1653 VanDerWaalsContact N-O 3.17Å; M1622-M1654 HydrophobicContact CB-CE 4.08Å; M1622-M1654 HydrophobicContact CB-SD 3.86Å; M1622-Y1655 PolarHBondContact O-N 2.89Å; M1622-R2194 HydrophobicContact CE-CG 4.45Å
1623	D	87.7	Confident	70.7	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	132	164.2	-171.5	3.8	0	0	0	110.7	S1595 V1598 S1625 A1634 L1635	S1595-D1623 PolarHBondContact O-N 3.49Å; S1595-D1623 VanDerWaalsContact O-N 3.1Å; V1598-D1623 WeakPolarHBondContact CA-O 3.19Å; D1623-S1625 WeakPolarHBondContact OD1-CB 3.09Å; D1623-S1625 PolarHBondContact OD1-N 3.49Å; D1623-S1625 PolarHBondContact OD1-OG 3.31Å; D1623-A1634 WeakPolarHBondContact OD2-CB 3Å; D1623-A1634 PolarHBondContact OD2-N 3.31Å; D1623-L1635 HydrophobicContact CB-CB 4Å; D1623-L1635 HydrophobicContact CB-CD2 4.5Å
1624	T	87.2	Confident	70.7	Confident	3 Å²	3	55.6 Å²	55.6	2%	0.018	30%	0.296	C	S	.	.			trans	-133.1	22.6	179.5	63.2	0	0	0	0	112.4	M1622 M1654 Y1655 Y1663	M1622-T1624 HydrophobicContact CE-CG2 4.12Å; M1622-T1624 HydrophobicContact CG-CG2 4.08Å; M1622-T1624 HydrophobicContact SD-CG2 4.27Å; T1624-M1654 HydrophobicContact CG2-SD 4.29Å; T1624-Y1655 WeakPolarHBondContact CA-O 3.32Å; T1624-Y1655 PolarHBondContact N-O 3.16Å; T1624-Y1655 PolarHBondContact OG1-O 3.39Å; T1624-Y1663 WeakPolarHBondContact CB-OH 3.46Å; T1624-Y1663 HydrophobicContact CG2-CE2 4.16Å; T1624-Y1663 PolarHBondContact OG1-OH 3.39Å
1625	S	85.5	Confident	71.9	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.021	29%	0.288	C	S	.	.			trans	-74.9	126.5	-173.3	-55.1	0	0	0	0	114.2	V1598 D1623 K1627 N1657 Y2198	V1598-S1625 WeakPolarHBondContact CG1-O 3.33Å; D1623-S1625 WeakPolarHBondContact OD1-CB 3.09Å; D1623-S1625 PolarHBondContact OD1-N 3.49Å; D1623-S1625 PolarHBondContact OD1-OG 3.31Å; S1625-K1627 VanDerWaalsContact C-N 3.33Å; S1625-K1627 PolarHBondContact O-N 2.87Å; S1625-N1657 PolarHBondContact OG-N 3.01Å; S1625-Y2198 PolarHBondContact O-OH 2.9Å; S1625-Y2198 VanDerWaalsContact O-OH 3.05Å
1626	F	78.4	Confident	72.9	Confident	43 Å²	43	54.8 Å²	54.8	19%	0.189	29%	0.29	C	S	.	.			trans	-75.7	-20.2	-180	-54.5	-56.8	0	0	0	113.9	R1628 N1657 E2197 Y2198 M2201	F1626-R1628 PolarHBondContact O-N 3Å; F1626-N1657 PolarHBondContact N-OD1 3.14Å; F1626-E2197 HydrophobicContact CE1-CG 4.21Å; F1626-E2197 HydrophobicContact CZ-CG 3.95Å; F1626-Y2198 HydrophobicContact CB-CE1 4.39Å; F1626-Y2198 HydrophobicContact CD1-CD1 4.01Å; F1626-Y2198 AromaticContact CD1-CE1 3.79Å; F1626-Y2198 HydrophobicContact CD1-CE1 3.79Å; F1626-Y2198 HydrophobicContact CD1-CE2 4.4Å; F1626-Y2198 HydrophobicContact CD1-CG 4.41Å; F1626-Y2198 AromaticContact CD1-CZ 4Å; F1626-M2201 HydrophobicContact CD1-CG 3.94Å; F1626-M2201 HydrophobicContact CD2-CG 3.79Å; F1626-M2201 HydrophobicContact CD2-SD 3.99Å; F1626-M2201 HydrophobicContact CE1-CG 3.78Å; F1626-M2201 HydrophobicContact CE2-CE 4Å; F1626-M2201 HydrophobicContact CE2-CG 3.61Å; F1626-M2201 HydrophobicContact CE2-SD 3.69Å; F1626-M2201 HydrophobicContact CG-CB 4.49Å; F1626-M2201 HydrophobicContact CG-CG 3.96Å; F1626-M2201 HydrophobicContact CZ-CE 4.13Å; F1626-M2201 HydrophobicContact CZ-CG 3.62Å; F1626-M2201 HydrophobicContact CZ-SD 4.17Å
1627	K	64.7	Low	73.3	Confident	153 Å²	153	56.4 Å²	56.4	67%	0.665	30%	0.298	S	S	*	.			trans	-65.1	116.3	179.1	-71.1	-179.8	179.5	172.4	0	110.8	S1625 S1629	S1625-K1627 VanDerWaalsContact C-N 3.33Å; S1625-K1627 PolarHBondContact O-N 2.87Å; K1627-S1629 PolarHBondContact O-N 3.1Å; K1627-S1629 VanDerWaalsContact O-N 3.13Å
1628	R	54	Low	73.3	Confident	235 Å²	235	62.4 Å²	62.4	89%	0.887	33%	0.327	S	S	*	.			trans	-71.8	97.9	162.2	-66	-177.1	-175	176.1	3.2	109.1	F1626	F1626-R1628 PolarHBondContact O-N 3Å
1629	S	46.8	Very low	73.3	Confident	56 Å²	56	63.9 Å²	63.9	39%	0.392	34%	0.337	S	S	.	.			trans	-70.9	144.2	158.3	46.5	0	0	0	0	109.5	K1627 T1631	K1627-S1629 PolarHBondContact O-N 3.1Å; K1627-S1629 VanDerWaalsContact O-N 3.13Å; S1629-T1631 WeakPolarHBondContact CB-O 3.48Å; S1629-T1631 PolarHBondContact O-N 3.31Å; S1629-T1631 PolarHBondContact OG-O 2.89Å
1630	E	43.3	Very low	72.9	Confident	211 Å²	211	68.7 Å²	68.7	99%	0.986	36%	0.363	S	S	*	.	S	Bend	trans	-73.5	-19	176.6	-61.6	-175.5	138.9	0	0	111.9
1631	T	41	Very low	72.7	Confident	114 Å²	114	73.7 Å²	73.7	70%	0.699	39%	0.387	S	S	*	.	S	Bend	trans	-98.3	133	165.6	52.8	0	0	0	0	109.7	S1629	S1629-T1631 WeakPolarHBondContact CB-O 3.48Å; S1629-T1631 PolarHBondContact O-N 3.31Å; S1629-T1631 PolarHBondContact OG-O 2.89Å
1632	G	49.6	Very low	72.4	Confident	72 Å²	72	73.8 Å²	73.8	74%	0.742	39%	0.388	S	S	*	.	S	Bend	trans	-67.8	141.5	-167.7	0	0	0	0	0	115.8
1633	N	55.5	Low	72.2	Confident	70 Å²	70	79.3 Å²	79.3	37%	0.374	41%	0.408	S	S	.	.			trans	64	141.7	177.9	-55	-14	0	0	0	115.1	N1596	N1596-N1633 HydrophobicContact CB-CB 4.33Å; N1596-N1633 PolarHBondContact ND2-ND2 2.79Å; N1596-N1633 WeakPolarHBondContact O-CB 3.45Å; N1596-N1633 PolarHBondContact O-ND2 2.99Å; N1596-N1633 PolarHBondContact O-OD1 3.26Å; N1596-N1633 PolarHBondContact OD1-ND2 2.97Å
1634	A	66.3	Low	72.1	Confident	43 Å²	43	84.9 Å²	84.9	36%	0.355	43%	0.434	S	S	.	.	S	Bend	trans	-96.4	-12.2	-178.3	0	0	0	0	0	113.4	D1623 Y1655	D1623-A1634 WeakPolarHBondContact OD2-CB 3Å; D1623-A1634 PolarHBondContact OD2-N 3.31Å; A1634-Y1655 HydrophobicContact CB-CE1 4.32Å; A1634-Y1655 WeakPolarHBondContact O-CE1 3.22Å
1635	L	80.8	Confident	72.1	Confident	7 Å²	7	85.3 Å²	85.3	4%	0.037	44%	0.437	C	S	.	.			trans	-114	121.6	-178.5	-177.3	65	0	0	0	111.4	N1596 I1621 D1623 L1637 V1642 Y1655 W1660	N1596-L1635 WeakPolarHBondContact CB-O 3.43Å; I1621-L1635 HydrophobicContact CG2-CD2 3.6Å; D1623-L1635 HydrophobicContact CB-CB 4Å; D1623-L1635 HydrophobicContact CB-CD2 4.5Å; L1635-L1637 HydrophobicContact CD2-CD2 4.04Å; L1635-L1637 HydrophobicContact CG-CD2 4.18Å; L1635-V1642 HydrophobicContact CD1-CG2 3.78Å; L1635-V1642 HydrophobicContact CG-CG2 4.44Å; L1635-Y1655 HydrophobicContact CB-CD1 4.08Å; L1635-Y1655 HydrophobicContact CB-CG 4.43Å; L1635-Y1655 HydrophobicContact CD1-CD1 4.2Å; L1635-Y1655 HydrophobicContact CD1-CD2 3.94Å; L1635-Y1655 HydrophobicContact CD1-CE1 4.5Å; L1635-Y1655 HydrophobicContact CD1-CE2 4.23Å; L1635-Y1655 HydrophobicContact CD1-CG 3.89Å; L1635-W1660 HydrophobicContact CD1-CH2 3.91Å; L1635-W1660 HydrophobicContact CD1-CZ2 3.75Å; L1635-W1660 HydrophobicContact CD2-CH2 4.1Å
1636	D	84.2	Confident	72.2	Confident	101 Å²	101	87 Å²	87	54%	0.54	45%	0.445	S	S	.	.			trans	-94.6	126.3	168.4	-177.6	8.6	0	0	0	110.2	E1638 S1639 V1642	D1636-E1638 PolarHBondContact OD1-N 2.67Å; D1636-E1638 VanDerWaalsContact OD1-N 3.12Å; D1636-S1639 WeakPolarHBondContact O-CB 3.16Å; D1636-S1639 PolarHBondContact O-OG 2.81Å; D1636-V1642 VanDerWaalsContact O-CG2 3.31Å; D1636-V1642 WeakPolarHBondContact O-CG2 3.44Å
1637	L	81.7	Confident	72.5	Confident	49 Å²	49	91.1 Å²	91.1	26%	0.257	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-17.6	-174.5	-56.6	-179.6	0	0	0	113.2	V1594 N1596 I1621 L1635 S1639	V1594-L1637 HydrophobicContact CG1-CD1 3.61Å; V1594-L1637 HydrophobicContact CG1-CD2 3.48Å; V1594-L1637 VanDerWaalsContact CG1-CD2 3.48Å; V1594-L1637 HydrophobicContact CG1-CG 4.16Å; N1596-L1637 HydrophobicContact CB-CD1 4.44Å; N1596-L1637 HydrophobicContact CB-CD2 4.4Å; N1596-L1637 HydrophobicContact CB-CG 4.35Å; I1621-L1637 HydrophobicContact CG2-CD2 4.4Å; L1635-L1637 HydrophobicContact CD2-CD2 4.04Å; L1635-L1637 HydrophobicContact CG-CD2 4.18Å; L1637-S1639 VanDerWaalsContact C-N 3.31Å
1638	E	82.1	Confident	73.5	Confident	140 Å²	140	85.1 Å²	85.1	65%	0.654	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-7.4	175.5	-72.4	-73.3	157.5	0	0	112.9	D1636 R1643	D1636-E1638 PolarHBondContact OD1-N 2.67Å; D1636-E1638 VanDerWaalsContact OD1-N 3.12Å; E1638-R1643 PolarHBondContact O-NH1 2.68Å; E1638-R1643 IonicContact OE2-NH2 2.91Å
1639	S	85.6	Confident	75	Confident	33 Å²	33	74.8 Å²	74.8	23%	0.231	40%	0.402	C	S	.	.	S	Bend	trans	-73.5	150.4	-170.3	70	0	0	0	0	114.2	D1636 L1637 E1641 V1642 R1643	D1636-S1639 WeakPolarHBondContact O-CB 3.16Å; D1636-S1639 PolarHBondContact O-OG 2.81Å; L1637-S1639 VanDerWaalsContact C-N 3.31Å; S1639-E1641 VanDerWaalsContact C-N 3.26Å; S1639-E1641 PolarHBondContact O-N 3.33Å; S1639-V1642 WeakPolarHBondContact O-CB 3.36Å; S1639-V1642 PolarHBondContact O-N 3.3Å; S1639-R1643 PolarHBondContact O-N 2.72Å
1640	D	82.5	Confident	77	Confident	107 Å²	107	72.2 Å²	72.2	57%	0.572	38%	0.384	S	S	*	.	H	α-helix	trans	-69.2	-21.9	179.2	-62.8	-35.1	0	0	0	113.1	V1642 R1643 Q1644	D1640-V1642 VanDerWaalsContact C-N 3.29Å; D1640-V1642 PolarHBondContact O-N 3.35Å; D1640-R1643 PolarHBondContact O-N 3.16Å; D1640-R1643 IonicContact OD1-CZ 3.53Å; D1640-R1643 IonicContact OD1-NH1 2.65Å; D1640-R1643 PolarHBondContact OD1-NH1 3.39Å; D1640-Q1644 WeakPolarHBondContact O-CB 3.44Å; D1640-Q1644 WeakPolarHBondContact O-CG 3.16Å; D1640-Q1644 PolarHBondContact O-N 3.02Å
1641	E	85.9	Confident	79.2	Confident	105 Å²	105	62.2 Å²	62.2	49%	0.491	34%	0.337	S	S	.	.	H	α-helix	trans	-62.9	-36.4	167.5	-76	-161.2	156	0	0	111.8	S1639 V1645	S1639-E1641 VanDerWaalsContact C-N 3.26Å; S1639-E1641 PolarHBondContact O-N 3.33Å; E1641-V1645 WeakPolarHBondContact O-CG2 3.18Å; E1641-V1645 PolarHBondContact O-N 3.31Å
1642	V	87.4	Confident	81.5	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.024	31%	0.309	C	S	.	.	H	α-helix	trans	-71.1	-42.9	175.8	167.6	0	0	0	0	110.7	I1621 L1635 D1636 S1639 D1640 Q1644 V1645 M1646 W1660	I1621-V1642 HydrophobicContact CD1-CG1 4.02Å; L1635-V1642 HydrophobicContact CD1-CG2 3.78Å; L1635-V1642 HydrophobicContact CG-CG2 4.44Å; D1636-V1642 VanDerWaalsContact O-CG2 3.31Å; D1636-V1642 WeakPolarHBondContact O-CG2 3.44Å; S1639-V1642 WeakPolarHBondContact O-CB 3.36Å; S1639-V1642 PolarHBondContact O-N 3.3Å; D1640-V1642 VanDerWaalsContact C-N 3.29Å; D1640-V1642 PolarHBondContact O-N 3.35Å; V1642-Q1644 PolarHBondContact O-N 3.12Å; V1642-V1645 PolarHBondContact O-N 3.41Å; V1642-M1646 HydrophobicContact CG1-CG 4.41Å; V1642-M1646 HydrophobicContact CG1-SD 3.95Å; V1642-M1646 WeakPolarHBondContact O-CG 3.37Å; V1642-M1646 PolarHBondContact O-N 2.65Å; V1642-W1660 HydrophobicContact CG2-CH2 4.1Å; V1642-W1660 HydrophobicContact CG2-CZ2 3.86Å
1643	R	85.3	Confident	83.5	Confident	116 Å²	116	54 Å²	54	44%	0.438	27%	0.273	S	S	.	.	H	α-helix	trans	-56.7	-50	173.8	-70.5	-170.7	179	82.9	18.2	112	E1638 S1639 D1640 V1645 M1646 E1647	E1638-R1643 PolarHBondContact O-NH1 2.68Å; E1638-R1643 IonicContact OE2-NH2 2.91Å; S1639-R1643 PolarHBondContact O-N 2.72Å; D1640-R1643 PolarHBondContact O-N 3.16Å; D1640-R1643 IonicContact OD1-CZ 3.53Å; D1640-R1643 IonicContact OD1-NH1 2.65Å; D1640-R1643 PolarHBondContact OD1-NH1 3.39Å; R1643-V1645 PolarHBondContact O-N 3.13Å; R1643-M1646 WeakPolarHBondContact O-CA 3.07Å; R1643-M1646 WeakPolarHBondContact O-CB 3.41Å; R1643-M1646 PolarHBondContact O-N 2.77Å; R1643-E1647 WeakPolarHBondContact O-CG 3.23Å; R1643-E1647 PolarHBondContact O-N 3.37Å
1644	Q	85.4	Confident	85.3	Confident	118 Å²	118	50.7 Å²	50.7	55%	0.551	26%	0.255	S	S	*	.	H	α-helix	trans	-60.7	-28.3	178.5	-74.3	178.9	16.4	0	0	113.7	D1640 V1642 L1648	D1640-Q1644 WeakPolarHBondContact O-CB 3.44Å; D1640-Q1644 WeakPolarHBondContact O-CG 3.16Å; D1640-Q1644 PolarHBondContact O-N 3.02Å; V1642-Q1644 PolarHBondContact O-N 3.12Å; Q1644-L1648 WeakPolarHBondContact O-CG 3.37Å
1645	V	88.1	Confident	86.4	Confident	12 Å²	12	50 Å²	50	7%	0.073	24%	0.244	C	C	.	.	H	α-helix	trans	-80.9	-32.5	174.1	166.3	0	0	0	0	111.9	E1641 V1642 R1643 E1647 L1648 N1653 W1660	E1641-V1645 WeakPolarHBondContact O-CG2 3.18Å; E1641-V1645 PolarHBondContact O-N 3.31Å; V1642-V1645 PolarHBondContact O-N 3.41Å; R1643-V1645 PolarHBondContact O-N 3.13Å; V1645-E1647 VanDerWaalsContact C-N 3.34Å; V1645-L1648 PolarHBondContact O-N 3.38Å; V1645-N1653 HydrophobicContact CG1-CB 3.78Å; V1645-N1653 WeakPolarHBondContact CG1-OD1 3.46Å; V1645-W1660 HydrophobicContact CB-CZ2 4.47Å; V1645-W1660 HydrophobicContact CG1-CD2 4.37Å; V1645-W1660 HydrophobicContact CG1-CE3 4.14Å; V1645-W1660 HydrophobicContact CG1-CH2 4.38Å; V1645-W1660 HydrophobicContact CG1-CZ3 4.15Å; V1645-W1660 HydrophobicContact CG2-CD2 3.81Å; V1645-W1660 HydrophobicContact CG2-CE3 4.41Å; V1645-W1660 HydrophobicContact CG2-CG 3.94Å; V1645-W1660 HydrophobicContact CG2-CZ2 4.25Å
1646	M	88	Confident	86.7	Confident	39 Å²	39	50.7 Å²	50.7	19%	0.192	25%	0.246	C	C	.	.	H	α-helix	trans	-66.1	-36.7	172.4	-68.9	177.9	69.6	0	0	112.1	P1558 V1560 W1592 I1621 V1642 R1643 L1648 D1649	P1558-M1646 HydrophobicContact CB-CE 3.57Å; P1558-M1646 HydrophobicContact CG-CE 3.86Å; V1560-M1646 HydrophobicContact CG2-CE 3.79Å; W1592-M1646 HydrophobicContact CD2-CE 3.94Å; W1592-M1646 HydrophobicContact CD2-CG 4.24Å; W1592-M1646 HydrophobicContact CE3-CE 4.43Å; W1592-M1646 HydrophobicContact CE3-CG 3.97Å; W1592-M1646 HydrophobicContact CG-CE 4.01Å; W1592-M1646 HydrophobicContact CH2-CB 4.14Å; W1592-M1646 HydrophobicContact CH2-CG 3.92Å; W1592-M1646 HydrophobicContact CZ2-CB 4.09Å; W1592-M1646 HydrophobicContact CZ2-CG 4.14Å; W1592-M1646 HydrophobicContact CZ3-CG 3.81Å; I1621-M1646 HydrophobicContact CD1-CG 4.01Å; I1621-M1646 HydrophobicContact CD1-SD 4.37Å; V1642-M1646 HydrophobicContact CG1-CG 4.41Å; V1642-M1646 HydrophobicContact CG1-SD 3.95Å; V1642-M1646 WeakPolarHBondContact O-CG 3.37Å; V1642-M1646 PolarHBondContact O-N 2.65Å; R1643-M1646 WeakPolarHBondContact O-CA 3.07Å; R1643-M1646 WeakPolarHBondContact O-CB 3.41Å; R1643-M1646 PolarHBondContact O-N 2.77Å; M1646-L1648 PolarHBondContact O-N 2.75Å; M1646-L1648 VanDerWaalsContact O-N 3.17Å; M1646-D1649 PolarHBondContact O-N 2.91Å
1647	E	84.1	Confident	86.8	Confident	129 Å²	129	48.6 Å²	48.6	60%	0.603	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-14.2	173.1	-71	165.1	-158.2	0	0	114.5	R1643 V1645	R1643-E1647 WeakPolarHBondContact O-CG 3.23Å; R1643-E1647 PolarHBondContact O-N 3.37Å; V1645-E1647 VanDerWaalsContact C-N 3.34Å
1648	L	86.4	Confident	86.8	Confident	26 Å²	26	48.3 Å²	48.3	14%	0.136	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-15.4	173.3	-55.2	-178.7	0	0	0	113.1	I1534 R1549 Q1644 V1645 M1646 L1650	I1534-L1648 HydrophobicContact CD1-CB 4.15Å; I1534-L1648 HydrophobicContact CD1-CD2 4.14Å; R1549-L1648 PolarHBondContact NH1-O 3.33Å; Q1644-L1648 WeakPolarHBondContact O-CG 3.37Å; V1645-L1648 PolarHBondContact O-N 3.38Å; M1646-L1648 PolarHBondContact O-N 2.75Å; M1646-L1648 VanDerWaalsContact O-N 3.17Å; L1648-L1650 HydrophobicContact CB-CD1 4.02Å; L1648-L1650 HydrophobicContact CB-CG 3.88Å; L1648-L1650 HydrophobicContact CD1-CD1 4.2Å; L1648-L1650 PolarHBondContact O-N 3.46Å
1649	D	86	Confident	87	Confident	19 Å²	19	46 Å²	46	10%	0.102	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	47.3	179.2	-176.3	60.8	0	0	0	114.1	R1549 T1590 R1619 M1646	R1549-D1649 IonicContact CZ-OD2 3.73Å; R1549-D1649 PolarHBondContact NH1-O 3.09Å; R1549-D1649 IonicContact NH1-OD2 2.78Å; R1549-D1649 PolarHBondContact NH1-OD2 2.82Å; R1549-D1649 IonicContact NH2-OD2 2.67Å; R1549-D1649 PolarHBondContact NH2-OD2 3.44Å; T1590-D1649 WeakPolarHBondContact CG2-OD1 3.27Å; R1619-D1649 IonicContact CZ-OD1 2.82Å; R1619-D1649 IonicContact CZ-OD2 3.43Å; R1619-D1649 VanDerWaalsContact NE-CG 3.26Å; R1619-D1649 PolarHBondContact NE-O 3.29Å; R1619-D1649 VanDerWaalsContact NE-O 3.14Å; R1619-D1649 IonicContact NE-OD1 2.77Å; R1619-D1649 PolarHBondContact NE-OD1 3.35Å; R1619-D1649 IonicContact NE-OD2 2.87Å; R1619-D1649 PolarHBondContact NE-OD2 2.9Å; R1619-D1649 IonicContact NH2-OD1 3.65Å; R1619-D1649 PolarHBondContact NH2-OD1 2.94Å; R1619-D1649 IonicContact NH2-OD2 3.21Å; R1619-D1649 PolarHBondContact NH2-OD2 3.45Å; M1646-D1649 PolarHBondContact O-N 2.91Å
1650	L	88.7	Confident	87.4	Confident	1 Å²	1	46 Å²	46	1%	0.005	23%	0.226	C	C	.	.			trans	-97.2	141	-177.7	-56.2	173.3	0	0	0	112.9	Y1246 N1374 I1534 R1619 L1648 S1652 N1653	Y1246-L1650 HydrophobicContact CE2-CD1 3.99Å; N1374-L1650 WeakPolarHBondContact OD1-CA 3.21Å; I1534-L1650 HydrophobicContact CD1-CD2 4.24Å; I1534-L1650 HydrophobicContact CG2-CD1 3.87Å; I1534-L1650 HydrophobicContact CG2-CD2 3.77Å; I1534-L1650 HydrophobicContact CG2-CG 4.45Å; R1619-L1650 VanDerWaalsContact CD-C 3.41Å; R1619-L1650 VanDerWaalsContact CD-O 3.24Å; R1619-L1650 WeakPolarHBondContact CD-O 3.46Å; L1648-L1650 HydrophobicContact CB-CD1 4.02Å; L1648-L1650 HydrophobicContact CB-CG 3.88Å; L1648-L1650 HydrophobicContact CD1-CD1 4.2Å; L1648-L1650 PolarHBondContact O-N 3.46Å; L1650-S1652 PolarHBondContact O-N 3.46Å; L1650-N1653 WeakPolarHBondContact CB-OD1 3.41Å; L1650-N1653 PolarHBondContact O-ND2 3.3Å
1651	H	88.3	Confident	87.8	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.199	C	C	.	.	S	Bend	trans	-55.4	-42	-178.9	-179.4	61.7	0	0	0	115.4	E1373 N1374 I1618 R1619 S1620	E1373-H1651 HydrophobicContact CB-CB 4.45Å; E1373-H1651 VanDerWaalsContact O-CB 3.32Å; E1373-H1651 WeakPolarHBondContact O-CB 3.4Å; E1373-H1651 IonicContact OE2-CD2 3.84Å; N1374-H1651 PolarHBondContact OD1-N 3.34Å; I1618-H1651 PolarHBondContact O-ND1 3.07Å; R1619-H1651 CarbonylContact C-O 3.44Å; S1620-H1651 PolarHBondContact N-O 2.71Å; S1620-H1651 PolarHBondContact OG-O 3.35Å
1652	S	89.5	Confident	88.1	Confident	14 Å²	14	35.9 Å²	35.9	10%	0.098	18%	0.176	C	C	.	.			trans	-138.6	91.1	-166.2	-179.5	0	0	0	0	112.8	Y1246 S1620 L1650	Y1246-S1652 PolarHBondContact OH-O 3.04Å; S1620-S1652 WeakPolarHBondContact OG-CA 3.49Å; L1650-S1652 PolarHBondContact O-N 3.46Å
1653	N	92.3	Very high	88.2	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	108.3	-176.1	-51.6	-83.6	0	0	0	110.9	W1592 S1620 I1621 M1622 V1645 L1650 W1660	W1592-N1653 WeakPolarHBondContact CZ3-ND2 3.47Å; S1620-N1653 WeakPolarHBondContact O-CB 3.4Å; S1620-N1653 PolarHBondContact O-N 3.48Å; S1620-N1653 PolarHBondContact O-ND2 2.81Å; S1620-N1653 VanDerWaalsContact O-ND2 3.08Å; I1621-N1653 VanDerWaalsContact CA-O 3.3Å; I1621-N1653 WeakPolarHBondContact CA-O 3.47Å; I1621-N1653 HydrophobicContact CG1-CB 4.15Å; M1622-N1653 PolarHBondContact N-O 2.73Å; M1622-N1653 VanDerWaalsContact N-O 3.17Å; V1645-N1653 HydrophobicContact CG1-CB 3.78Å; V1645-N1653 WeakPolarHBondContact CG1-OD1 3.46Å; L1650-N1653 WeakPolarHBondContact CB-OD1 3.41Å; L1650-N1653 PolarHBondContact O-ND2 3.3Å; N1653-W1660 HydrophobicContact CB-CE3 4.05Å; N1653-W1660 HydrophobicContact CB-CZ3 3.88Å
1654	M	92.2	Very high	88.4	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	125.6	-176.4	-56	-70.4	121.7	0	0	109.8	F1243 P1603 M1622 T1624 G1661 Y1663	F1243-M1654 HydrophobicContact CE2-CB 3.6Å; F1243-M1654 HydrophobicContact CZ-CB 4.07Å; P1603-M1654 HydrophobicContact CG-CE 3.98Å; P1603-M1654 HydrophobicContact CG-SD 3.76Å; M1622-M1654 HydrophobicContact CB-CE 4.08Å; M1622-M1654 HydrophobicContact CB-SD 3.86Å; T1624-M1654 HydrophobicContact CG2-SD 4.29Å; M1654-G1661 WeakPolarHBondContact CA-O 3.18Å; M1654-G1661 WeakPolarHBondContact CB-O 3.3Å; M1654-G1661 PolarHBondContact N-O 3.45Å; M1654-G1661 PolarHBondContact O-N 3.01Å; M1654-Y1663 HydrophobicContact CB-CE2 4.24Å; M1654-Y1663 HydrophobicContact CG-CD2 3.86Å; M1654-Y1663 HydrophobicContact CG-CE2 3.82Å; M1654-Y1663 HydrophobicContact SD-CD2 4.31Å; M1654-Y1663 HydrophobicContact SD-CE2 4.07Å
1655	Y	90.4	Very high	88.6	Confident	29 Å²	29	26.4 Å²	26.4	11%	0.114	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	130.7	173.2	-167.3	-105.1	0	0	0	109.5	M1622 T1624 A1634 L1635 W1660	M1622-Y1655 PolarHBondContact O-N 2.89Å; T1624-Y1655 WeakPolarHBondContact CA-O 3.32Å; T1624-Y1655 PolarHBondContact N-O 3.16Å; T1624-Y1655 PolarHBondContact OG1-O 3.39Å; A1634-Y1655 HydrophobicContact CB-CE1 4.32Å; A1634-Y1655 WeakPolarHBondContact O-CE1 3.22Å; L1635-Y1655 HydrophobicContact CB-CD1 4.08Å; L1635-Y1655 HydrophobicContact CB-CG 4.43Å; L1635-Y1655 HydrophobicContact CD1-CD1 4.2Å; L1635-Y1655 HydrophobicContact CD1-CD2 3.94Å; L1635-Y1655 HydrophobicContact CD1-CE1 4.5Å; L1635-Y1655 HydrophobicContact CD1-CE2 4.23Å; L1635-Y1655 HydrophobicContact CD1-CG 3.89Å; Y1655-W1660 AromaticContact CD2-CD2 3.88Å; Y1655-W1660 HydrophobicContact CD2-CD2 3.88Å; Y1655-W1660 AromaticContact CD2-CE2 3.59Å; Y1655-W1660 HydrophobicContact CD2-CE3 4.38Å; Y1655-W1660 HydrophobicContact CD2-CG 4.29Å; Y1655-W1660 HydrophobicContact CD2-CH2 4.42Å; Y1655-W1660 AromaticContact CD2-CZ2 3.9Å; Y1655-W1660 HydrophobicContact CD2-CZ2 3.9Å; Y1655-W1660 AromaticContact CD2-NE1 3.77Å; Y1655-W1660 AromaticContact CE2-NE1 3.91Å
1656	R	87	Confident	88.5	Confident	21 Å²	21	26.4 Å²	26.4	8%	0.079	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	105.3	-177	-169.1	174.5	176.4	118.9	-13.8	110.8	F1243 G1658 K1659 Y1663 E2197	F1243-R1656 HydrophobicContact CE1-CB 3.92Å; F1243-R1656 HydrophobicContact CE1-CG 4.49Å; F1243-R1656 HydrophobicContact CE2-CB 3.82Å; F1243-R1656 VanDerWaalsContact CE2-CD 3.49Å; F1243-R1656 HydrophobicContact CE2-CG 4.32Å; F1243-R1656 HydrophobicContact CZ-CB 3.47Å; F1243-R1656 VanDerWaalsContact CZ-CB 3.47Å; F1243-R1656 HydrophobicContact CZ-CG 4.28Å; R1656-G1658 VanDerWaalsContact C-N 3.25Å; R1656-G1658 PolarHBondContact O-N 3.47Å; R1656-K1659 PolarHBondContact N-O 3.2Å; R1656-K1659 PolarHBondContact O-N 3.27Å; R1656-Y1663 PolarHBondContact NH1-OH 2.76Å; R1656-E2197 IonicContact CZ-OE1 3.77Å; R1656-E2197 VanDerWaalsContact CZ-OE1 3.22Å; R1656-E2197 IonicContact NH1-OE1 2.64Å; R1656-E2197 PolarHBondContact NH1-OE1 3.4Å; R1656-E2197 IonicContact NH1-OE2 2.63Å; R1656-E2197 IonicContact NH2-OE1 3.2Å; R1656-E2197 PolarHBondContact NH2-OE1 2.85Å
1657	N	85.1	Confident	88.2	Confident	57 Å²	57	30.1 Å²	30.1	31%	0.305	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	27.5	173.8	-54.9	-50	0	0	0	115.5	S1625 F1626	S1625-N1657 PolarHBondContact OG-N 3.01Å; F1626-N1657 PolarHBondContact N-OD1 3.14Å
1658	G	81.7	Confident	88	Confident	43 Å²	43	25.2 Å²	25.2	44%	0.443	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.7	14.9	-178.1	0	0	0	0	0	115.5	R1656	R1656-G1658 VanDerWaalsContact C-N 3.25Å; R1656-G1658 PolarHBondContact O-N 3.47Å
1659	K	88.4	Confident	87.2	Confident	92 Å²	92	27.6 Å²	27.6	40%	0.4	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	151	169.4	-71	-163.9	172.2	-159.9	0	111.4	Y1245 R1656	Y1245-K1659 HydrophobicContact CD1-CB 3.69Å; Y1245-K1659 HydrophobicContact CD1-CD 3.96Å; Y1245-K1659 HydrophobicContact CD1-CG 4.46Å; Y1245-K1659 HydrophobicContact CE1-CB 3.97Å; Y1245-K1659 HydrophobicContact CE1-CD 4.33Å; Y1245-K1659 HydrophobicContact CG-CD 4.46Å; R1656-K1659 PolarHBondContact N-O 3.2Å; R1656-K1659 PolarHBondContact O-N 3.27Å
1660	W	92.1	Very high	86.1	Confident	32 Å²	32	31 Å²	31	12%	0.121	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	146.2	172.8	-69.4	98.5	0	0	0	112.2	Y1246 I1621 L1635 V1642 V1645 N1653 Y1655	Y1246-W1660 HydrophobicContact CD2-CB 4.03Å; Y1246-W1660 HydrophobicContact CE2-CB 4.45Å; Y1246-W1660 PolarHBondContact N-O 2.83Å; Y1246-W1660 VanDerWaalsContact N-O 3.16Å; I1621-W1660 HydrophobicContact CG2-CH2 4.03Å; I1621-W1660 HydrophobicContact CG2-CZ3 4.24Å; L1635-W1660 HydrophobicContact CD1-CH2 3.91Å; L1635-W1660 HydrophobicContact CD1-CZ2 3.75Å; L1635-W1660 HydrophobicContact CD2-CH2 4.1Å; V1642-W1660 HydrophobicContact CG2-CH2 4.1Å; V1642-W1660 HydrophobicContact CG2-CZ2 3.86Å; V1645-W1660 HydrophobicContact CB-CZ2 4.47Å; V1645-W1660 HydrophobicContact CG1-CD2 4.37Å; V1645-W1660 HydrophobicContact CG1-CE3 4.14Å; V1645-W1660 HydrophobicContact CG1-CH2 4.38Å; V1645-W1660 HydrophobicContact CG1-CZ3 4.15Å; V1645-W1660 HydrophobicContact CG2-CD2 3.81Å; V1645-W1660 HydrophobicContact CG2-CE3 4.41Å; V1645-W1660 HydrophobicContact CG2-CG 3.94Å; V1645-W1660 HydrophobicContact CG2-CZ2 4.25Å; N1653-W1660 HydrophobicContact CB-CE3 4.05Å; N1653-W1660 HydrophobicContact CB-CZ3 3.88Å; Y1655-W1660 AromaticContact CD2-CD2 3.88Å; Y1655-W1660 HydrophobicContact CD2-CD2 3.88Å; Y1655-W1660 AromaticContact CD2-CE2 3.59Å; Y1655-W1660 HydrophobicContact CD2-CE3 4.38Å; Y1655-W1660 HydrophobicContact CD2-CG 4.29Å; Y1655-W1660 HydrophobicContact CD2-CH2 4.42Å; Y1655-W1660 AromaticContact CD2-CZ2 3.9Å; Y1655-W1660 HydrophobicContact CD2-CZ2 3.9Å; Y1655-W1660 AromaticContact CD2-NE1 3.77Å; Y1655-W1660 AromaticContact CE2-NE1 3.91Å
1661	G	92	Very high	84.9	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.8	-161.2	-179.8	0	0	0	0	0	112.7	F1244 M1654	F1244-G1661 CarbonylContact O-C 3.49Å; F1244-G1661 WeakPolarHBondContact O-CA 3.36Å; M1654-G1661 WeakPolarHBondContact CA-O 3.18Å; M1654-G1661 WeakPolarHBondContact CB-O 3.3Å; M1654-G1661 PolarHBondContact N-O 3.45Å; M1654-G1661 PolarHBondContact O-N 3.01Å
1662	C	91.7	Very high	83.8	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	167	-177.8	55.5	0	0	0	0	111.3	F1243 F1244 Y1246 R1664	F1243-C1662 CarbonylContact C-O 3.57Å; F1243-C1662 WeakPolarHBondContact CA-O 3.45Å; F1244-C1662 PolarHBondContact N-O 3.49Å; F1244-C1662 PolarHBondContact O-N 3.01Å; Y1246-C1662 HydrophobicContact CE1-CB 4.17Å; C1662-R1664 VanDerWaalsContact SG-CZ 3.58Å
1663	Y	90.3	Very high	82.7	Confident	24 Å²	24	41.6 Å²	41.6	9%	0.094	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	135.5	170.1	-67.1	-87.1	0	0	0	109.9	V1241 K1242 F1243 T1624 M1654 R1656 R2194	V1241-Y1663 HydrophobicContact CG1-CD1 4.36Å; K1242-Y1663 WeakPolarHBondContact O-CA 3.5Å; F1243-Y1663 HydrophobicContact CB-CE1 4.42Å; F1243-Y1663 HydrophobicContact CD2-CD1 4.23Å; F1243-Y1663 HydrophobicContact CD2-CD2 4.41Å; F1243-Y1663 AromaticContact CD2-CE1 3.84Å; F1243-Y1663 HydrophobicContact CD2-CE1 3.84Å; F1243-Y1663 HydrophobicContact CD2-CE2 4Å; F1243-Y1663 HydrophobicContact CD2-CG 4.49Å; F1243-Y1663 AromaticContact CD2-CZ 3.68Å; F1243-Y1663 HydrophobicContact CE2-CE2 4.19Å; T1624-Y1663 WeakPolarHBondContact CB-OH 3.46Å; T1624-Y1663 HydrophobicContact CG2-CE2 4.16Å; T1624-Y1663 PolarHBondContact OG1-OH 3.39Å; M1654-Y1663 HydrophobicContact CB-CE2 4.24Å; M1654-Y1663 HydrophobicContact CG-CD2 3.86Å; M1654-Y1663 HydrophobicContact CG-CE2 3.82Å; M1654-Y1663 HydrophobicContact SD-CD2 4.31Å; M1654-Y1663 HydrophobicContact SD-CE2 4.07Å; R1656-Y1663 PolarHBondContact NH1-OH 2.76Å; Y1663-R2194 VanDerWaalsContact CE1-NH2 3.28Å
1664	R	89.1	Confident	81.5	Confident	6 Å²	6	47.5 Å²	47.5	2%	0.023	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	144.2	-174.3	-69.1	-67.8	-179.7	-104.5	20.4	111.9	V1241 K1242 F1244 P1366 D1369 E1373 C1662	V1241-R1664 WeakPolarHBondContact CA-O 3.33Å; K1242-R1664 PolarHBondContact N-O 2.71Å; K1242-R1664 PolarHBondContact O-N 2.85Å; F1244-R1664 HydrophobicContact CB-CB 4.44Å; F1244-R1664 HydrophobicContact CB-CG 4.1Å; P1366-R1664 HydrophobicContact CB-CB 4.3Å; P1366-R1664 HydrophobicContact CB-CG 4.01Å; P1366-R1664 HydrophobicContact CG-CB 4.35Å; P1366-R1664 PolarHBondContact O-NE 2.91Å; D1369-R1664 PolarHBondContact O-NH2 2.91Å; D1369-R1664 VanDerWaalsContact O-NH2 3.11Å; E1373-R1664 IonicContact OE1-CZ 3.43Å; E1373-R1664 VanDerWaalsContact OE1-CZ 3.23Å; E1373-R1664 IonicContact OE1-NH1 2.68Å; E1373-R1664 PolarHBondContact OE1-NH1 3.39Å; E1373-R1664 IonicContact OE1-NH2 3.49Å; E1373-R1664 PolarHBondContact OE1-NH2 3.09Å; E1373-R1664 IonicContact OE2-CZ 3.49Å; E1373-R1664 IonicContact OE2-NH1 3.74Å; E1373-R1664 PolarHBondContact OE2-NH1 2.94Å; E1373-R1664 IonicContact OE2-NH2 2.77Å; E1373-R1664 PolarHBondContact OE2-NH2 3.45Å; C1662-R1664 VanDerWaalsContact SG-CZ 3.58Å
1665	H	88.8	Confident	80.4	Confident	9 Å²	9	49.7 Å²	49.7	4%	0.042	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	123.4	179.8	-64.1	69	0	0	0	110.2	E1239 A2176 R2177 Q2210	E1239-H1665 HydrophobicContact CB-CB 4.16Å; E1239-H1665 HydrophobicContact CG-CB 4.44Å; E1239-H1665 IonicContact OE2-CD2 3.21Å; E1239-H1665 PolarHBondContact OE2-CD2 2.79Å; E1239-H1665 VanDerWaalsContact OE2-CD2 3.26Å; E1239-H1665 IonicContact OE2-CG 2.81Å; H1665-A2176 PolarHBondContact CE1-O 3.28Å; H1665-R2177 VanDerWaalsContact CB-NH2 3.33Å; H1665-Q2210 PolarHBondContact NE2-OE1 3.32Å
1666	L	86.2	Confident	79.9	Confident	13 Å²	13	51.3 Å²	51.3	7%	0.068	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	131.8	174.8	-62.6	178.7	0	0	0	109.5	E1239 Q1240 K1242 D1362 K1365 P1366	E1239-L1666 CarbonylContact C-O 3.59Å; E1239-L1666 VanDerWaalsContact CA-O 3.22Å; E1239-L1666 WeakPolarHBondContact CA-O 3.3Å; Q1240-L1666 PolarHBondContact N-O 3.41Å; Q1240-L1666 PolarHBondContact O-N 3.19Å; K1242-L1666 HydrophobicContact CD-CD1 3.72Å; K1242-L1666 HydrophobicContact CG-CD1 4.28Å; D1362-L1666 HydrophobicContact CB-CD1 4.24Å; K1365-L1666 HydrophobicContact CB-CD2 4.21Å; K1365-L1666 HydrophobicContact CG-CD2 4.15Å; P1366-L1666 HydrophobicContact CG-CD2 3.88Å
1667	R	82	Confident	79.7	Confident	117 Å²	117	53.6 Å²	53.6	44%	0.442	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	132.6	-179.4	-169.8	-179.1	-174.9	176	3.4	110.2
1668	L	79.2	Confident	79.7	Confident	26 Å²	26	56.8 Å²	56.8	14%	0.136	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-80.8	131.1	175.9	-73.2	156.1	0	0	0	110.1	L1238 Q1240 Q1672 W2252 F2257	L1238-L1668 HydrophobicContact CB-CB 4.26Å; L1238-L1668 HydrophobicContact CB-CD1 4.08Å; L1238-L1668 PolarHBondContact O-N 3.44Å; Q1240-L1668 HydrophobicContact CB-CD1 4.37Å; Q1240-L1668 HydrophobicContact CB-CD2 4.36Å; Q1240-L1668 HydrophobicContact CB-CG 4.36Å; L1668-Q1672 HydrophobicContact CD2-CB 4.42Å; L1668-W2252 HydrophobicContact CD1-CH2 3.75Å; L1668-W2252 HydrophobicContact CD1-CZ3 3.48Å; L1668-W2252 VanDerWaalsContact CD1-CZ3 3.48Å; L1668-F2257 HydrophobicContact CD1-CD1 4.31Å
1669	K	69.8	Low	80.1	Confident	76 Å²	76	55.2 Å²	55.2	33%	0.33	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-82.1	154	-177.2	-68.8	163.6	170.8	124.1	0	110.9	E1361 D1362 D1671 Q1672 T1673	E1361-K1669 WeakPolarHBondContact OE2-CE 3.2Å; E1361-K1669 IonicContact OE2-NZ 3.92Å; E1361-K1669 PolarHBondContact OE2-NZ 2.59Å; D1362-K1669 IonicContact OD1-NZ 3.11Å; K1669-D1671 WeakPolarHBondContact CB-OD1 3.42Å; K1669-D1671 PolarHBondContact O-N 3.18Å; K1669-Q1672 HydrophobicContact CB-CG 4.24Å; K1669-Q1672 CarbonylContact O-C 3.56Å; K1669-Q1672 WeakPolarHBondContact O-CA 3.46Å; K1669-Q1672 VanDerWaalsContact O-CB 3.29Å; K1669-Q1672 WeakPolarHBondContact O-CB 3.44Å; K1669-Q1672 PolarHBondContact O-N 3.41Å; K1669-T1673 WeakPolarHBondContact O-CG2 3.46Å; K1669-T1673 PolarHBondContact O-N 2.89Å
1670	S	63.1	Low	80.2	Confident	90 Å²	90	54.8 Å²	54.8	63%	0.629	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-22.8	-170.8	48.2	0	0	0	0	115	T1673	S1670-T1673 PolarHBondContact O-OG1 2.66Å; S1670-T1673 VanDerWaalsContact O-OG1 3.05Å
1671	D	63.8	Low	80.2	Confident	119 Å²	119	55.2 Å²	55.2	64%	0.636	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-33.1	167.7	59.1	-34.7	0	0	0	112	K1669	K1669-D1671 WeakPolarHBondContact CB-OD1 3.42Å; K1669-D1671 PolarHBondContact O-N 3.18Å
1672	Q	66	Low	80.3	Confident	95 Å²	95	55.2 Å²	55.2	44%	0.444	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-22.4	175.4	-56.7	173.1	-31.3	0	0	113.1	L1668 K1669 F1674	L1668-Q1672 HydrophobicContact CD2-CB 4.42Å; K1669-Q1672 HydrophobicContact CB-CG 4.24Å; K1669-Q1672 CarbonylContact O-C 3.56Å; K1669-Q1672 WeakPolarHBondContact O-CA 3.46Å; K1669-Q1672 VanDerWaalsContact O-CB 3.29Å; K1669-Q1672 WeakPolarHBondContact O-CB 3.44Å; K1669-Q1672 PolarHBondContact O-N 3.41Å; Q1672-F1674 PolarHBondContact O-N 3.32Å
1673	T	66.4	Low	80.3	Confident	25 Å²	25	55.2 Å²	55.2	15%	0.153	28%	0.277	C	S	.	.	S	Bend	trans	-71.3	-16.8	-176.5	61.2	0	0	0	0	114.4	L1238 K1669 S1670 S2248	L1238-T1673 HydrophobicContact CD1-CG2 3.79Å; K1669-T1673 WeakPolarHBondContact O-CG2 3.46Å; K1669-T1673 PolarHBondContact O-N 2.89Å; S1670-T1673 PolarHBondContact O-OG1 2.66Å; S1670-T1673 VanDerWaalsContact O-OG1 3.05Å; T1673-S2248 PolarHBondContact O-OG 3.17Å
1674	F	65.9	Low	80.4	Confident	123 Å²	123	54.1 Å²	54.1	54%	0.539	27%	0.273	S	S	.	.	S	Bend	trans	-113	106.6	177.5	-68.8	-84	0	0	0	110.3	Q1672 L1687	Q1672-F1674 PolarHBondContact O-N 3.32Å; F1674-L1687 HydrophobicContact CE1-CD1 4.41Å
1675	C	70.2	Confident	80.4	Confident	47 Å²	47	54.4 Å²	54.4	32%	0.318	28%	0.275	S	S	.	.			trans	-86	130.3	173.1	-166.2	0	0	0	0	110	T2027 S2251	C1675-T2027 HydrophobicContact CB-CG2 4.44Å; C1675-T2027 WeakPolarHBondContact O-CB 3.44Å; C1675-T2027 WeakPolarHBondContact O-CG2 3.46Å; C1675-T2027 PolarHBondContact O-N 3.16Å; C1675-T2027 PolarHBondContact O-OG1 2.76Å; C1675-S2251 WeakPolarHBondContact CB-OG 3.46Å
1676	C	78.9	Confident	80.2	Confident	63 Å²	63	54.4 Å²	54.4	43%	0.426	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	137.3	172.7	-62.6	0	0	0	0	109.7	M2024 A2025	C1676-M2024 HydrophobicContact CB-CE 3.58Å; C1676-M2024 WeakPolarHBondContact O-CE 3.34Å; C1676-A2025 CarbonylContact C-O 3.23Å; C1676-A2025 WeakPolarHBondContact CA-O 3.45Å; C1676-A2025 WeakPolarHBondContact CB-O 3.36Å
1677	E	82.7	Confident	79.6	Confident	68 Å²	68	57.6 Å²	57.6	32%	0.318	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	147.7	175.8	74.8	-177.6	171.7	0	0	110.9	T1679 K1703 A2025 T2027	E1677-T1679 HydrophobicContact CG-CG2 4.48Å; E1677-T1679 PolarHBondContact O-N 2.88Å; E1677-K1703 IonicContact OE1-NZ 2.78Å; E1677-K1703 PolarHBondContact OE1-NZ 2.91Å; E1677-K1703 IonicContact OE2-NZ 3.24Å; E1677-A2025 PolarHBondContact N-O 3.21Å; E1677-A2025 PolarHBondContact O-N 2.99Å; E1677-T2027 HydrophobicContact CB-CG2 3.72Å; E1677-T2027 HydrophobicContact CG-CG2 3.73Å
1678	E	86.5	Confident	79.1	Confident	124 Å²	124	54.4 Å²	54.4	58%	0.579	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	110.1	172.5	-142.1	-160.1	-136.7	0	0	108.6	K2022 M2024	E1678-K2022 HydrophobicContact CG-CB 3.78Å; E1678-K2022 HydrophobicContact CG-CD 4.26Å; E1678-K2022 WeakPolarHBondContact OE2-CD 3.29Å; E1678-K2022 IonicContact OE2-NZ 2.72Å; E1678-M2024 HydrophobicContact CB-SD 3.9Å; E1678-M2024 HydrophobicContact CG-SD 3.91Å
1679	T	89.4	Confident	78.5	Confident	11 Å²	11	58.7 Å²	58.7	7%	0.067	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	142.8	-171.6	176.2	0	0	0	0	112.7	E1677 H1681 A1682 K2022 V2023 A2025	E1677-T1679 HydrophobicContact CG-CG2 4.48Å; E1677-T1679 PolarHBondContact O-N 2.88Å; T1679-H1681 VanDerWaalsContact C-N 3.28Å; T1679-H1681 WeakPolarHBondContact CG2-O 3.39Å; T1679-H1681 PolarHBondContact OG1-N 2.73Å; T1679-H1681 PolarHBondContact OG1-O 2.76Å; T1679-A1682 HydrophobicContact CG2-CB 3.97Å; T1679-K2022 WeakPolarHBondContact O-CA 3.46Å; T1679-V2023 PolarHBondContact N-O 2.87Å; T1679-V2023 PolarHBondContact O-N 3.27Å; T1679-A2025 HydrophobicContact CG2-CB 3.66Å
1680	E	90.3	Very high	78.5	Confident	83 Å²	83	57.3 Å²	57.3	39%	0.388	31%	0.307	S	S	.	.	S	Bend	trans	-77.6	-17.6	171.8	-59.4	-174.8	-168.9	0	0	112.3	T1775 L2021 K2022	E1680-T1775 WeakPolarHBondContact O-CB 3.21Å; E1680-T1775 PolarHBondContact O-OG1 2.79Å; E1680-L2021 WeakPolarHBondContact CA-O 3.47Å; E1680-K2022 HydrophobicContact CG-CD 4.39Å; E1680-K2022 HydrophobicContact CG-CG 3.51Å; E1680-K2022 WeakPolarHBondContact OE1-CE 3.42Å
1681	H	92.6	Very high	78.9	Confident	40 Å²	40	55.8 Å²	55.8	19%	0.185	29%	0.292	C	S	.	.	S	Bend	trans	-118.8	104.2	-178.5	-55.5	-67.4	0	0	0	110.3	T1679 S1700 N1702 K1703 T1775 T1776	T1679-H1681 VanDerWaalsContact C-N 3.28Å; T1679-H1681 WeakPolarHBondContact CG2-O 3.39Å; T1679-H1681 PolarHBondContact OG1-N 2.73Å; T1679-H1681 PolarHBondContact OG1-O 2.76Å; H1681-S1700 PolarHBondContact O-N 2.92Å; H1681-N1702 HydrophobicContact CB-CB 4.48Å; H1681-K1703 HydrophobicContact CB-CB 4.22Å; H1681-T1775 WeakPolarHBondContact CA-OG1 3.25Å; H1681-T1776 PolarHBondContact ND1-OG1 2.78Å
1682	A	92.4	Very high	79.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	161.7	174.8	0	0	0	0	0	111.4	T1679 W1697 I1698 A1774 T1775 V2023 A2025	T1679-A1682 HydrophobicContact CG2-CB 3.97Å; A1682-W1697 HydrophobicContact CB-CE3 3.57Å; A1682-W1697 HydrophobicContact CB-CZ3 4.05Å; A1682-I1698 CarbonylContact C-O 3.53Å; A1682-I1698 WeakPolarHBondContact CA-O 3.47Å; A1682-I1698 WeakPolarHBondContact CB-O 3.47Å; A1682-A1774 CarbonylContact O-C 3.55Å; A1682-A1774 VanDerWaalsContact O-CA 3.31Å; A1682-A1774 WeakPolarHBondContact O-CA 3.45Å; A1682-A1774 VanDerWaalsContact O-CB 3.29Å; A1682-A1774 WeakPolarHBondContact O-CB 3.16Å; A1682-T1775 HydrophobicContact CB-CG2 4.39Å; A1682-T1775 PolarHBondContact N-OG1 2.77Å; A1682-T1775 PolarHBondContact O-N 3.11Å; A1682-T1775 PolarHBondContact O-OG1 2.84Å; A1682-V2023 HydrophobicContact CB-CG2 3.64Å; A1682-A2025 HydrophobicContact CB-CB 3.82Å
1683	F	93.5	Very high	80.3	Confident	1 Å²	1	51.7 Å²	51.7	0%	0.004	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	159.3	168.9	60.9	-111.9	0	0	0	111.2	N1685 I1698 D1747 C1748 M1773 A1774 Y2030	F1683-N1685 HydrophobicContact CD2-CB 4.07Å; F1683-N1685 HydrophobicContact CE2-CB 3.89Å; F1683-I1698 HydrophobicContact CD2-CB 4.36Å; F1683-I1698 HydrophobicContact CE2-CB 3.95Å; F1683-I1698 HydrophobicContact CE2-CD1 4.49Å; F1683-I1698 HydrophobicContact CE2-CG2 4.35Å; F1683-I1698 HydrophobicContact CZ-CB 4.47Å; F1683-I1698 HydrophobicContact CZ-CG2 4.43Å; F1683-I1698 PolarHBondContact N-O 2.9Å; F1683-I1698 PolarHBondContact O-N 2.89Å; F1683-D1747 HydrophobicContact CZ-CB 4.47Å; F1683-C1748 HydrophobicContact CD2-CB 3.58Å; F1683-C1748 HydrophobicContact CE2-CB 3.38Å; F1683-C1748 HydrophobicContact CG-CB 4.29Å; F1683-C1748 HydrophobicContact CZ-CB 3.9Å; F1683-M1773 WeakPolarHBondContact CA-O 3.36Å; F1683-A1774 HydrophobicContact CB-CB 3.91Å; F1683-Y2030 WeakPolarHBondContact CZ-OH 3.13Å
1684	I	91.9	Very high	80.9	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	134.4	174.5	-73	162.3	0	0	0	109.8	L1695 T1696 W1697 C1748 M1773 V1987 L2005	I1684-L1695 HydrophobicContact CG2-CD2 3.56Å; I1684-L1695 HydrophobicContact CG2-CG 4.46Å; I1684-T1696 WeakPolarHBondContact CA-O 3.33Å; I1684-W1697 HydrophobicContact CD1-CH2 3.98Å; I1684-W1697 HydrophobicContact CD1-CZ2 3.64Å; I1684-W1697 HydrophobicContact CG1-CD2 3.83Å; I1684-W1697 HydrophobicContact CG1-CE3 3.96Å; I1684-W1697 HydrophobicContact CG1-CG 4.46Å; I1684-W1697 HydrophobicContact CG1-CH2 4.03Å; I1684-W1697 HydrophobicContact CG1-CZ2 3.84Å; I1684-W1697 HydrophobicContact CG1-CZ3 4.07Å; I1684-C1748 PolarHBondContact O-SG 2.95Å; I1684-M1773 HydrophobicContact CB-CB 4.18Å; I1684-M1773 HydrophobicContact CD1-CB 4.26Å; I1684-M1773 PolarHBondContact N-O 2.85Å; I1684-V1987 HydrophobicContact CD1-CG1 4.05Å; I1684-V1987 HydrophobicContact CD1-CG2 3.75Å; I1684-V1987 HydrophobicContact CG1-CG2 4.43Å; I1684-V1987 HydrophobicContact CG2-CG1 3.93Å; I1684-L2005 HydrophobicContact CD1-CD1 3.69Å
1685	N	89.8	Confident	81.9	Confident	12 Å²	12	46.1 Å²	46.1	6%	0.064	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	163	172.8	-158.2	16.9	0	0	0	111.4	F1683 L1695 T1696 I1698 D1747 C1748	F1683-N1685 HydrophobicContact CD2-CB 4.07Å; F1683-N1685 HydrophobicContact CE2-CB 3.89Å; N1685-L1695 WeakPolarHBondContact O-CA 3.29Å; N1685-T1696 PolarHBondContact N-O 2.77Å; N1685-T1696 PolarHBondContact O-N 2.83Å; N1685-I1698 HydrophobicContact CB-CD1 3.84Å; N1685-I1698 HydrophobicContact CB-CG1 4.47Å; N1685-D1747 PolarHBondContact ND2-O 2.74Å; N1685-C1748 HydrophobicContact CB-CB 4.15Å
1686	T	83.3	Confident	82.8	Confident	9 Å²	9	46.5 Å²	46.5	6%	0.055	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	130.1	165.6	51.6	0	0	0	0	110.2	T1688 S1694 L1695 A1730	T1686-T1688 VanDerWaalsContact C-N 3.27Å; T1686-S1694 WeakPolarHBondContact CB-OG 3.34Å; T1686-L1695 HydrophobicContact CG2-CB 4.14Å; T1686-L1695 HydrophobicContact CG2-CD1 4.01Å; T1686-L1695 HydrophobicContact CG2-CG 4.1Å; T1686-A1730 HydrophobicContact CG2-CB 4.1Å
1687	L	74.7	Confident	83.4	Confident	79 Å²	79	44.2 Å²	44.2	41%	0.414	23%	0.232	S	C	.	.	S	Bend	trans	-67.7	-31.1	167.3	-63.4	170.1	0	0	0	111.4	F1674 S1694 T1696 I1698	F1674-L1687 HydrophobicContact CE1-CD1 4.41Å; L1687-S1694 PolarHBondContact N-O 3.48Å; L1687-S1694 PolarHBondContact N-OG 3.05Å; L1687-T1696 HydrophobicContact CD1-CG2 3.89Å; L1687-T1696 HydrophobicContact CD2-CG2 4.44Å; L1687-T1696 HydrophobicContact CG-CG2 3.97Å; L1687-I1698 HydrophobicContact CD2-CD1 3.73Å; L1687-I1698 HydrophobicContact CD2-CG1 4.33Å
1688	T	69.8	Low	83.7	Confident	50 Å²	50	41.1 Å²	41.1	31%	0.307	22%	0.218	S	C	.	.	S	Bend	trans	-129.4	113.1	177.3	-58.9	0	0	0	0	109.4	L1230 T1686 D1691 S1694	L1230-T1688 HydrophobicContact CD1-CG2 3.86Å; L1230-T1688 WeakPolarHBondContact CD1-OG1 3.32Å; T1686-T1688 VanDerWaalsContact C-N 3.27Å; T1688-D1691 HydrophobicContact CG2-CB 4.26Å; T1688-D1691 PolarHBondContact O-N 3.25Å; T1688-S1694 PolarHBondContact N-OG 3.41Å; T1688-S1694 PolarHBondContact O-OG 2.96Å
1689	R	68.6	Low	83.8	Confident	117 Å²	117	35.2 Å²	35.2	44%	0.442	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	142.3	177.2	-73.5	-172.4	-178.5	175.2	2.5	111.6	D1691	R1689-D1691 VanDerWaalsContact C-N 3.26Å
1690	G	68.5	Low	83.8	Confident	46 Å²	46	34.8 Å²	34.8	47%	0.474	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	-24.9	-171.8	0	0	0	0	0	113.1	A1730	G1690-A1730 WeakPolarHBondContact CA-O 3.37Å; G1690-A1730 PolarHBondContact N-O 2.82Å
1691	D	71.1	Confident	83.6	Confident	59 Å²	59	32.8 Å²	32.8	32%	0.316	18%	0.182	S	C	.	.			trans	-105.1	112.4	179.3	177.7	26	0	0	0	112.1	T1688 R1689 N1693 S1694	T1688-D1691 HydrophobicContact CG2-CB 4.26Å; T1688-D1691 PolarHBondContact O-N 3.25Å; R1689-D1691 VanDerWaalsContact C-N 3.26Å; D1691-N1693 VanDerWaalsContact C-N 3.32Å; D1691-N1693 VanDerWaalsContact OD1-CB 3.24Å; D1691-N1693 WeakPolarHBondContact OD1-CB 3.44Å; D1691-N1693 PolarHBondContact OD1-N 3.45Å; D1691-S1694 WeakPolarHBondContact O-CB 3.22Å; D1691-S1694 PolarHBondContact O-N 2.89Å; D1691-S1694 PolarHBondContact O-OG 2.81Å; D1691-S1694 PolarHBondContact OD2-N 3.26Å
1692	L	80.3	Confident	83.4	Confident	21 Å²	21	32.3 Å²	32.3	11%	0.11	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-73.8	-20.2	175.6	-64.2	179.1	0	0	0	113.2	S1694 L1695 A1730 T1731 F1991 R1992	L1692-S1694 PolarHBondContact O-N 2.82Å; L1692-L1695 HydrophobicContact CD2-CD1 3.98Å; L1692-L1695 WeakPolarHBondContact O-CB 3.15Å; L1692-L1695 PolarHBondContact O-N 3.26Å; L1692-A1730 HydrophobicContact CD2-CB 3.76Å; L1692-T1731 HydrophobicContact CD1-CG2 4.14Å; L1692-T1731 HydrophobicContact CD2-CG2 4.24Å; L1692-T1731 HydrophobicContact CG-CG2 4.29Å; L1692-F1991 HydrophobicContact CD2-CD1 4.23Å; L1692-R1992 HydrophobicContact CD1-CG 4.36Å
1693	N	78.9	Confident	83.1	Confident	107 Å²	107	35.4 Å²	35.4	57%	0.572	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-67.4	-23	174.5	-53.8	-0.4	0	0	0	111	D1691 L1695 R1992	D1691-N1693 VanDerWaalsContact C-N 3.32Å; D1691-N1693 VanDerWaalsContact OD1-CB 3.24Å; D1691-N1693 WeakPolarHBondContact OD1-CB 3.44Å; D1691-N1693 PolarHBondContact OD1-N 3.45Å; N1693-L1695 PolarHBondContact O-N 2.95Å; N1693-R1992 PolarHBondContact OD1-NH2 3.25Å
1694	S	79.9	Confident	82.8	Confident	14 Å²	14	38.4 Å²	38.4	10%	0.098	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-81.7	4.3	-179.9	83.9	0	0	0	0	114.3	T1686 L1687 T1688 D1691 L1692 T1696	T1686-S1694 WeakPolarHBondContact CB-OG 3.34Å; L1687-S1694 PolarHBondContact N-O 3.48Å; L1687-S1694 PolarHBondContact N-OG 3.05Å; T1688-S1694 PolarHBondContact N-OG 3.41Å; T1688-S1694 PolarHBondContact O-OG 2.96Å; D1691-S1694 WeakPolarHBondContact O-CB 3.22Å; D1691-S1694 PolarHBondContact O-N 2.89Å; D1691-S1694 PolarHBondContact O-OG 2.81Å; D1691-S1694 PolarHBondContact OD2-N 3.26Å; L1692-S1694 PolarHBondContact O-N 2.82Å; S1694-T1696 PolarHBondContact O-N 3.25Å
1695	L	86.6	Confident	82.6	Confident	17 Å²	17	41.6 Å²	41.6	9%	0.089	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	107.4	-165.8	-163	158.1	0	0	0	111.1	I1684 N1685 T1686 L1692 N1693 A1730 V1987 F1991	I1684-L1695 HydrophobicContact CG2-CD2 3.56Å; I1684-L1695 HydrophobicContact CG2-CG 4.46Å; N1685-L1695 WeakPolarHBondContact O-CA 3.29Å; T1686-L1695 HydrophobicContact CG2-CB 4.14Å; T1686-L1695 HydrophobicContact CG2-CD1 4.01Å; T1686-L1695 HydrophobicContact CG2-CG 4.1Å; L1692-L1695 HydrophobicContact CD2-CD1 3.98Å; L1692-L1695 WeakPolarHBondContact O-CB 3.15Å; L1692-L1695 PolarHBondContact O-N 3.26Å; N1693-L1695 PolarHBondContact O-N 2.95Å; L1695-A1730 HydrophobicContact CD1-CB 4.48Å; L1695-V1987 HydrophobicContact CD2-CB 3.98Å; L1695-V1987 HydrophobicContact CD2-CG1 3.4Å; L1695-F1991 HydrophobicContact CD1-CD1 3.9Å; L1695-F1991 HydrophobicContact CD1-CD2 4.04Å; L1695-F1991 HydrophobicContact CD1-CE1 3.96Å; L1695-F1991 HydrophobicContact CD1-CE2 4.1Å; L1695-F1991 HydrophobicContact CD1-CG 3.93Å; L1695-F1991 HydrophobicContact CD1-CZ 4.05Å; L1695-F1991 HydrophobicContact CD2-CD2 4.44Å; L1695-F1991 HydrophobicContact CD2-CE2 4.36Å
1696	T	89.2	Confident	82.1	Confident	54 Å²	54	46.5 Å²	46.5	33%	0.331	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	175	-169.2	-167	0	0	0	0	112.9	I1684 N1685 L1687 S1694 I1698 A2026	I1684-T1696 WeakPolarHBondContact CA-O 3.33Å; N1685-T1696 PolarHBondContact N-O 2.77Å; N1685-T1696 PolarHBondContact O-N 2.83Å; L1687-T1696 HydrophobicContact CD1-CG2 3.89Å; L1687-T1696 HydrophobicContact CD2-CG2 4.44Å; L1687-T1696 HydrophobicContact CG-CG2 3.97Å; S1694-T1696 PolarHBondContact O-N 3.25Å; T1696-I1698 HydrophobicContact CG2-CG1 4.47Å; T1696-A2026 HydrophobicContact CG2-CB 4.49Å
1697	W	90.8	Very high	82	Confident	16 Å²	16	51.5 Å²	51.5	6%	0.061	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	129.8	170.4	-76.3	100.5	0	0	0	110.8	A1682 I1684 T1775 Y1984 I2007 V2023 A2025 A2026	A1682-W1697 HydrophobicContact CB-CE3 3.57Å; A1682-W1697 HydrophobicContact CB-CZ3 4.05Å; I1684-W1697 HydrophobicContact CD1-CH2 3.98Å; I1684-W1697 HydrophobicContact CD1-CZ2 3.64Å; I1684-W1697 HydrophobicContact CG1-CD2 3.83Å; I1684-W1697 HydrophobicContact CG1-CE3 3.96Å; I1684-W1697 HydrophobicContact CG1-CG 4.46Å; I1684-W1697 HydrophobicContact CG1-CH2 4.03Å; I1684-W1697 HydrophobicContact CG1-CZ2 3.84Å; I1684-W1697 HydrophobicContact CG1-CZ3 4.07Å; W1697-T1775 HydrophobicContact CE3-CG2 4.48Å; W1697-T1775 HydrophobicContact CH2-CG2 3.91Å; W1697-T1775 HydrophobicContact CZ3-CG2 3.77Å; W1697-Y1984 AromaticContact NE1-CD2 3.79Å; W1697-Y1984 PolarHBondContact NE1-O 3.27Å; W1697-I2007 HydrophobicContact CH2-CD1 4.15Å; W1697-I2007 HydrophobicContact CH2-CG2 4.17Å; W1697-I2007 HydrophobicContact CZ2-CD1 4.04Å; W1697-I2007 HydrophobicContact CZ2-CG2 4.5Å; W1697-V2023 HydrophobicContact CD2-CG2 4.12Å; W1697-V2023 HydrophobicContact CE3-CG2 4.13Å; W1697-V2023 HydrophobicContact CG-CG2 4.36Å; W1697-A2025 HydrophobicContact CB-CB 3.92Å; W1697-A2025 CarbonylContact O-C 3.31Å; W1697-A2025 WeakPolarHBondContact O-CA 3.33Å; W1697-A2026 WeakPolarHBondContact O-CB 3.19Å; W1697-A2026 PolarHBondContact O-N 3.35Å
1698	I	89.4	Confident	82	Confident	2 Å²	2	52 Å²	52	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	137.1	174.9	-53.4	-172.5	0	0	0	108.5	A1682 F1683 N1685 L1687 T1696 R2028	A1682-I1698 CarbonylContact C-O 3.53Å; A1682-I1698 WeakPolarHBondContact CA-O 3.47Å; A1682-I1698 WeakPolarHBondContact CB-O 3.47Å; F1683-I1698 HydrophobicContact CD2-CB 4.36Å; F1683-I1698 HydrophobicContact CE2-CB 3.95Å; F1683-I1698 HydrophobicContact CE2-CD1 4.49Å; F1683-I1698 HydrophobicContact CE2-CG2 4.35Å; F1683-I1698 HydrophobicContact CZ-CB 4.47Å; F1683-I1698 HydrophobicContact CZ-CG2 4.43Å; F1683-I1698 PolarHBondContact N-O 2.9Å; F1683-I1698 PolarHBondContact O-N 2.89Å; N1685-I1698 HydrophobicContact CB-CD1 3.84Å; N1685-I1698 HydrophobicContact CB-CG1 4.47Å; L1687-I1698 HydrophobicContact CD2-CD1 3.73Å; L1687-I1698 HydrophobicContact CD2-CG1 4.33Å; T1696-I1698 HydrophobicContact CG2-CG1 4.47Å; I1698-R2028 HydrophobicContact CG2-CB 3.69Å; I1698-R2028 HydrophobicContact CG2-CG 3.95Å
1699	G	88.8	Confident	82.4	Confident	1 Å²	1	51 Å²	51	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	140.2	176.3	0	0	0	0	0	112.1	A2026 Y2030	G1699-A2026 PolarHBondContact N-O 2.95Å; G1699-Y2030 VanDerWaalsContact O-CE2 3.22Å; G1699-Y2030 WeakPolarHBondContact O-CE2 3.3Å
1700	S	89.1	Confident	82.8	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.007	28%	0.284	C	S	.	.			trans	-99.3	143.1	-173.7	175.7	0	0	0	0	112.4	H1681 N1702 K1703	H1681-S1700 PolarHBondContact O-N 2.92Å; S1700-N1702 PolarHBondContact O-N 2.94Å; S1700-N1702 VanDerWaalsContact O-N 3.13Å; S1700-N1702 WeakPolarHBondContact OG-CB 3.5Å; S1700-N1702 VanDerWaalsContact OG-CG 3.23Å; S1700-N1702 PolarHBondContact OG-N 2.98Å; S1700-N1702 PolarHBondContact OG-ND2 3.29Å; S1700-K1703 PolarHBondContact O-N 3.46Å
1701	P	86.5	Confident	83.5	Confident	42 Å²	42	51.2 Å²	51.2	27%	0.273	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-64.7	-11	172.1	27.9	-34.4	0	0	0	113.2	K1703 Y1704 Y2030	P1701-K1703 PolarHBondContact O-N 3.27Å; P1701-Y1704 PolarHBondContact O-N 3.44Å; P1701-Y2030 HydrophobicContact CB-CD1 3.74Å; P1701-Y2030 HydrophobicContact CB-CD2 4.46Å; P1701-Y2030 HydrophobicContact CB-CE1 4Å; P1701-Y2030 HydrophobicContact CB-CG 3.98Å; P1701-Y2030 HydrophobicContact CG-CD1 4.25Å; P1701-Y2030 HydrophobicContact CG-CE1 3.97Å
1702	N	88.9	Confident	84.3	Confident	30 Å²	30	53.7 Å²	53.7	16%	0.16	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-58.2	-18	177.3	-64.4	-8.8	0	0	0	113.1	H1681 S1700 Y1704 W1705 T1776	H1681-N1702 HydrophobicContact CB-CB 4.48Å; S1700-N1702 PolarHBondContact O-N 2.94Å; S1700-N1702 VanDerWaalsContact O-N 3.13Å; S1700-N1702 WeakPolarHBondContact OG-CB 3.5Å; S1700-N1702 VanDerWaalsContact OG-CG 3.23Å; S1700-N1702 PolarHBondContact OG-N 2.98Å; S1700-N1702 PolarHBondContact OG-ND2 3.29Å; N1702-Y1704 PolarHBondContact O-N 3.46Å; N1702-Y1704 VanDerWaalsContact O-N 3.17Å; N1702-W1705 WeakPolarHBondContact O-CB 3.35Å; N1702-W1705 PolarHBondContact O-N 3.13Å; N1702-T1776 PolarHBondContact ND2-O 2.86Å
1703	K	85.9	Confident	84.7	Confident	64 Å²	64	55.2 Å²	55.2	28%	0.278	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-65.1	-8.9	169.7	72.2	-175.6	174.3	-179.9	0	115	E1677 H1681 S1700 P1701	E1677-K1703 IonicContact OE1-NZ 2.78Å; E1677-K1703 PolarHBondContact OE1-NZ 2.91Å; E1677-K1703 IonicContact OE2-NZ 3.24Å; H1681-K1703 HydrophobicContact CB-CB 4.22Å; S1700-K1703 PolarHBondContact O-N 3.46Å; P1701-K1703 PolarHBondContact O-N 3.27Å
1704	Y	87	Confident	85.3	Confident	65 Å²	65	51.9 Å²	51.9	26%	0.255	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-113.1	8.4	170.8	-58.7	-56.1	0	0	0	112.8	P1701 N1702 Y2030 C2032 K2165	P1701-Y1704 PolarHBondContact O-N 3.44Å; N1702-Y1704 PolarHBondContact O-N 3.46Å; N1702-Y1704 VanDerWaalsContact O-N 3.17Å; Y1704-Y2030 WeakPolarHBondContact CE2-O 3.43Å; Y1704-C2032 HydrophobicContact CD1-CB 4.1Å; Y1704-C2032 HydrophobicContact CE1-CB 4.34Å; Y1704-C2032 HydrophobicContact CG-CB 4.32Å; Y1704-K2165 PolarHBondContact OH-NZ 3.32Å
1705	W	86.6	Confident	86	Confident	68 Å²	68	51.2 Å²	51.2	26%	0.258	26%	0.264	S	S	.	.			trans	-72.9	134.2	179	-178.3	79.6	0	0	0	111.4	N1702 K1707 D1708 L1714 V1778	N1702-W1705 WeakPolarHBondContact O-CB 3.35Å; N1702-W1705 PolarHBondContact O-N 3.13Å; W1705-K1707 HydrophobicContact CH2-CB 3.87Å; W1705-K1707 HydrophobicContact CH2-CD 4.48Å; W1705-K1707 HydrophobicContact CH2-CG 4.05Å; W1705-K1707 HydrophobicContact CZ2-CB 4.14Å; W1705-K1707 HydrophobicContact CZ2-CG 4.2Å; W1705-D1708 PolarHBondContact NE1-OD1 2.9Å; W1705-L1714 HydrophobicContact CE3-CB 3.9Å; W1705-L1714 HydrophobicContact CE3-CD2 4.44Å; W1705-L1714 HydrophobicContact CH2-CB 4.14Å; W1705-L1714 HydrophobicContact CZ3-CB 3.6Å; W1705-V1778 HydrophobicContact CB-CG2 4.38Å; W1705-V1778 HydrophobicContact CD2-CG2 4.05Å; W1705-V1778 HydrophobicContact CG-CG2 3.78Å; W1705-V1778 HydrophobicContact CZ2-CG1 4.27Å
1706	T	80.3	Confident	86.4	Confident	114 Å²	114	51.4 Å²	51.4	70%	0.699	27%	0.267	S	S	*	.			trans	-129.3	156.1	166.3	53.8	0	0	0	0	107.5	D1708	T1706-D1708 PolarHBondContact O-N 3.34Å
1707	K	81.5	Confident	86.6	Confident	114 Å²	114	48.8 Å²	48.8	50%	0.496	25%	0.251	S	S	.	.			trans	-68.3	105.8	-170.6	-167.5	163.4	-174.5	163.1	0	111.7	W1705 R1712 E1713	W1705-K1707 HydrophobicContact CH2-CB 3.87Å; W1705-K1707 HydrophobicContact CH2-CD 4.48Å; W1705-K1707 HydrophobicContact CH2-CG 4.05Å; W1705-K1707 HydrophobicContact CZ2-CB 4.14Å; W1705-K1707 HydrophobicContact CZ2-CG 4.2Å; K1707-R1712 WeakPolarHBondContact CE-O 3.41Å; K1707-E1713 IonicContact NZ-OE1 3.48Å; K1707-E1713 PolarHBondContact NZ-OE1 3.03Å; K1707-E1713 IonicContact NZ-OE2 3.38Å; K1707-E1713 PolarHBondContact NZ-OE2 3.03Å
1708	D	75.2	Confident	86.8	Confident	90 Å²	90	48 Å²	48	48%	0.481	25%	0.248	S	C	.	.			trans	-92.7	-30.9	-173	62.7	-41.5	0	0	0	113.4	W1705 T1706 R1712	W1705-D1708 PolarHBondContact NE1-OD1 2.9Å; T1706-D1708 PolarHBondContact O-N 3.34Å; D1708-R1712 WeakPolarHBondContact OD1-CD 3.39Å; D1708-R1712 WeakPolarHBondContact OD2-CD 3.42Å; D1708-R1712 IonicContact OD2-CZ 2.84Å; D1708-R1712 IonicContact OD2-NE 2.94Å; D1708-R1712 IonicContact OD2-NH1 3.76Å; D1708-R1712 PolarHBondContact OD2-NH1 3.12Å
1709	S	77.7	Confident	87.2	Confident	29 Å²	29	48.4 Å²	48.4	20%	0.203	25%	0.249	C	C	.	.			trans	-133.2	145.6	179.5	175.5	0	0	0	0	111.1	T1711 R1712	S1709-T1711 PolarHBondContact O-N 3.15Å; S1709-T1711 PolarHBondContact OG-N 3.46Å; S1709-T1711 PolarHBondContact OG-OG1 2.92Å; S1709-R1712 PolarHBondContact O-N 2.8Å
1710	P	77.7	Confident	87.4	Confident	120 Å²	120	48.3 Å²	48.3	78%	0.779	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-16.4	167.2	29.2	-36.1	0	0	0	113.5
1711	T	82.1	Confident	87.6	Confident	48 Å²	48	48.3 Å²	48.3	29%	0.294	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-11.1	176.6	68	0	0	0	0	113.9	S1709 D1780 T1781	S1709-T1711 PolarHBondContact O-N 3.15Å; S1709-T1711 PolarHBondContact OG-N 3.46Å; S1709-T1711 PolarHBondContact OG-OG1 2.92Å; T1711-D1780 WeakPolarHBondContact CB-OD2 3.48Å; T1711-D1780 CarbonylContact O-C 3.5Å; T1711-D1780 WeakPolarHBondContact O-CA 3.14Å; T1711-D1780 PolarHBondContact OG1-OD2 2.92Å; T1711-T1781 PolarHBondContact O-N 3.29Å; T1711-T1781 PolarHBondContact O-OG1 2.91Å
1712	R	87	Confident	87.9	Confident	111 Å²	111	46.3 Å²	46.3	42%	0.419	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	133.7	-174	-71.2	177.9	174.6	176.5	-4	111.9	K1707 D1708 S1709 V1778 A1779	K1707-R1712 WeakPolarHBondContact CE-O 3.41Å; D1708-R1712 WeakPolarHBondContact OD1-CD 3.39Å; D1708-R1712 WeakPolarHBondContact OD2-CD 3.42Å; D1708-R1712 IonicContact OD2-CZ 2.84Å; D1708-R1712 IonicContact OD2-NE 2.94Å; D1708-R1712 IonicContact OD2-NH1 3.76Å; D1708-R1712 PolarHBondContact OD2-NH1 3.12Å; S1709-R1712 PolarHBondContact O-N 2.8Å; R1712-V1778 HydrophobicContact CB-CG1 4.27Å; R1712-A1779 WeakPolarHBondContact CA-O 3.49Å
1713	E	90.1	Very high	87.9	Confident	52 Å²	52	45.4 Å²	45.4	24%	0.243	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	147.3	174.1	-59.7	-66.7	-179	0	0	110.9	K1707 L1758 V1778 A1779 T1781	K1707-E1713 IonicContact NZ-OE1 3.48Å; K1707-E1713 PolarHBondContact NZ-OE1 3.03Å; K1707-E1713 IonicContact NZ-OE2 3.38Å; K1707-E1713 PolarHBondContact NZ-OE2 3.03Å; E1713-L1758 HydrophobicContact CB-CD2 3.94Å; E1713-L1758 HydrophobicContact CG-CD2 4.5Å; E1713-V1778 WeakPolarHBondContact O-CA 3.42Å; E1713-A1779 PolarHBondContact N-O 3.41Å; E1713-A1779 PolarHBondContact O-N 3.01Å; E1713-T1781 HydrophobicContact CG-CG2 4.26Å
1714	L	91.6	Very high	87.9	Confident	37 Å²	37	48.2 Å²	48.2	19%	0.194	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	133.4	165.1	-174	73	0	0	0	109	W1705 P1759 V1777 V1778	W1705-L1714 HydrophobicContact CE3-CB 3.9Å; W1705-L1714 HydrophobicContact CE3-CD2 4.44Å; W1705-L1714 HydrophobicContact CH2-CB 4.14Å; W1705-L1714 HydrophobicContact CZ3-CB 3.6Å; L1714-P1759 VanDerWaalsContact O-CD 3.28Å; L1714-P1759 WeakPolarHBondContact O-CD 3.26Å; L1714-V1777 CarbonylContact C-O 3.59Å; L1714-V1777 WeakPolarHBondContact CA-O 3.3Å; L1714-V1778 HydrophobicContact CD1-CG2 3.93Å
1715	C	93.3	Very high	87.8	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133.5	179	-175.8	0	0	0	0	110.8	Y1754 R1757 L1758 V1764 T1776 V1777	C1715-Y1754 HydrophobicContact CB-CE2 4.26Å; C1715-R1757 VanDerWaalsContact SG-C 3.57Å; C1715-R1757 PolarHBondContact SG-O 3.15Å; C1715-L1758 HydrophobicContact CB-CD2 4.16Å; C1715-V1764 VanDerWaalsContact SG-CG2 3.57Å; C1715-T1776 CarbonylContact O-C 3.59Å; C1715-T1776 VanDerWaalsContact O-CA 3.29Å; C1715-T1776 WeakPolarHBondContact O-CA 3.48Å; C1715-V1777 HydrophobicContact CB-CG2 3.94Å; C1715-V1777 PolarHBondContact N-O 3.45Å; C1715-V1777 PolarHBondContact O-N 3.08Å
1716	S	94.8	Very high	87.9	Confident	21 Å²	21	43 Å²	43	15%	0.147	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	119	172.3	-74.9	0	0	0	0	109.7	Y1718 G1756 R1757	S1716-Y1718 WeakPolarHBondContact O-CD2 3.43Å; S1716-G1756 CarbonylContact O-C 3.57Å; S1716-G1756 WeakPolarHBondContact O-CA 3.48Å; S1716-R1757 PolarHBondContact N-O 2.97Å; S1716-R1757 PolarHBondContact O-N 3.38Å
1717	V	95.2	Very high	88.2	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	141.1	-177	179.8	0	0	0	0	110.9	A1720 Y1754 A1774 T1775 V1777 I2007 R2008	V1717-A1720 HydrophobicContact CG1-CB 4.24Å; V1717-Y1754 HydrophobicContact CG2-CD2 4.17Å; V1717-Y1754 HydrophobicContact CG2-CG 4.38Å; V1717-A1774 VanDerWaalsContact CB-O 3.25Å; V1717-A1774 WeakPolarHBondContact CB-O 2.97Å; V1717-T1775 PolarHBondContact N-O 3.36Å; V1717-V1777 HydrophobicContact CG2-CB 4.42Å; V1717-V1777 HydrophobicContact CG2-CG1 3.78Å; V1717-V1777 HydrophobicContact CG2-CG2 3.92Å; V1717-I2007 HydrophobicContact CG1-CG1 4.17Å; V1717-R2008 PolarHBondContact O-NH1 3.2Å
1718	Y	95	Very high	88.2	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	-42.7	175.7	-76.6	-113.5	0	0	0	110.9	S1716 A1755 R1757 M1793 I2007 R2008 E2009 E2010 E2011 P2018 S2019	S1716-Y1718 WeakPolarHBondContact O-CD2 3.43Å; Y1718-A1755 PolarHBondContact N-O 3.02Å; Y1718-R1757 HydrophobicContact CD2-CG 4.43Å; Y1718-R1757 HydrophobicContact CE2-CB 4.06Å; Y1718-R1757 HydrophobicContact CE2-CG 3.73Å; Y1718-R1757 WeakPolarHBondContact OH-CD 3.31Å; Y1718-R1757 PolarHBondContact OH-NE 2.66Å; Y1718-M1793 HydrophobicContact CD1-CE 3.53Å; Y1718-M1793 HydrophobicContact CD1-SD 4.41Å; Y1718-M1793 HydrophobicContact CD2-CE 4.03Å; Y1718-M1793 HydrophobicContact CD2-SD 4.06Å; Y1718-M1793 HydrophobicContact CE1-CE 3.84Å; Y1718-M1793 HydrophobicContact CE2-CE 4.31Å; Y1718-M1793 HydrophobicContact CG-CE 3.63Å; Y1718-M1793 HydrophobicContact CG-SD 3.9Å; Y1718-I2007 WeakPolarHBondContact O-CA 3.26Å; Y1718-I2007 WeakPolarHBondContact O-CB 3.17Å; Y1718-I2007 PolarHBondContact O-N 3.19Å; Y1718-R2008 HydrophobicContact CD1-CB 3.53Å; Y1718-R2008 HydrophobicContact CD2-CB 4.44Å; Y1718-R2008 HydrophobicContact CE1-CB 3.82Å; Y1718-R2008 HydrophobicContact CG-CB 3.87Å; Y1718-R2008 PolarHBondContact O-N 2.85Å; Y1718-R2008 VanDerWaalsContact O-N 3.1Å; Y1718-E2009 WeakPolarHBondContact CD1-O 3.3Å; Y1718-E2009 WeakPolarHBondContact CE1-O 3.35Å; Y1718-E2010 HydrophobicContact CD1-CB 4.48Å; Y1718-E2011 WeakPolarHBondContact CE1-OE1 3.43Å; Y1718-E2011 VanDerWaalsContact CE1-OE2 3.27Å; Y1718-E2011 WeakPolarHBondContact CE1-OE2 2.99Å; Y1718-E2011 VanDerWaalsContact OH-CD 3.23Å; Y1718-E2011 PolarHBondContact OH-OE1 3.06Å; Y1718-E2011 PolarHBondContact OH-OE2 2.78Å; Y1718-E2011 VanDerWaalsContact OH-OE2 3.14Å; Y1718-P2018 HydrophobicContact CE2-CB 4.16Å; Y1718-P2018 WeakPolarHBondContact OH-CA 3.31Å; Y1718-P2018 WeakPolarHBondContact OH-CB 3.49Å; Y1718-S2019 PolarHBondContact OH-N 2.79Å
1719	Y	96.1	Very high	88.6	Confident	9 Å²	9	29.9 Å²	29.9	4%	0.035	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	132.4	174.4	-63.3	-90.6	0	0	0	109.2	Y1754 A1755 M1793 H1794 I1981 L2005 K2006	Y1719-Y1754 CarbonylContact O-C 3.51Å; Y1719-Y1754 WeakPolarHBondContact O-CA 3.48Å; Y1719-A1755 PolarHBondContact N-O 3.44Å; Y1719-A1755 VanDerWaalsContact N-O 3.14Å; Y1719-A1755 PolarHBondContact O-N 2.89Å; Y1719-M1793 HydrophobicContact CD2-CB 3.87Å; Y1719-M1793 HydrophobicContact CE2-CB 4.09Å; Y1719-H1794 HydrophobicContact CD1-CB 3.82Å; Y1719-H1794 HydrophobicContact CD2-CB 4.12Å; Y1719-H1794 HydrophobicContact CE1-CB 3.64Å; Y1719-H1794 HydrophobicContact CE2-CB 3.98Å; Y1719-H1794 HydrophobicContact CG-CB 4.05Å; Y1719-I1981 HydrophobicContact CE1-CD1 4.47Å; Y1719-I1981 HydrophobicContact CE1-CG2 4.38Å; Y1719-L2005 WeakPolarHBondContact CA-O 3.19Å; Y1719-K2006 HydrophobicContact CD1-CB 4.04Å; Y1719-K2006 HydrophobicContact CD1-CG 4.24Å; Y1719-K2006 HydrophobicContact CE1-CB 3.66Å; Y1719-K2006 HydrophobicContact CE1-CD 3.95Å; Y1719-K2006 HydrophobicContact CE1-CG 3.53Å
1720	A	94.6	Very high	88.7	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	151.1	169.9	0	0	0	0	0	108.9	V1717 A1772 M1773 L2005 I2007	V1717-A1720 HydrophobicContact CG1-CB 4.24Å; A1720-A1772 WeakPolarHBondContact CB-O 3.48Å; A1720-M1773 HydrophobicContact CB-CB 4.31Å; A1720-M1773 HydrophobicContact CB-CG 3.8Å; A1720-L2005 PolarHBondContact N-O 2.72Å; A1720-L2005 VanDerWaalsContact N-O 3.11Å; A1720-L2005 PolarHBondContact O-N 3.36Å; A1720-I2007 HydrophobicContact CB-CG1 4.45Å
1721	S	93	Very high	88.7	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	146.2	-176.6	84.5	0	0	0	0	112.7	N1723 E1753 K2002	S1721-N1723 PolarHBondContact O-ND2 3.23Å; S1721-E1753 VanDerWaalsContact CB-OE2 3.23Å; S1721-E1753 WeakPolarHBondContact CB-OE2 3.26Å; S1721-E1753 PolarHBondContact N-O 2.83Å; S1721-E1753 VanDerWaalsContact N-O 3.08Å; S1721-E1753 WeakPolarHBondContact OG-CB 3.38Å; S1721-E1753 VanDerWaalsContact OG-CD 3.31Å; S1721-E1753 WeakPolarHBondContact OG-CG 3.35Å; S1721-E1753 PolarHBondContact OG-OE2 3.05Å; S1721-K2002 PolarHBondContact OG-NZ 2.94Å
1722	I	92.4	Very high	88.2	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	141.7	172	-48.5	-179.7	0	0	0	108.6	D1726 I1727 M1773 A1990 F1991 M1994 K2002 V2003 L2005	I1722-D1726 HydrophobicContact CG2-CB 4.48Å; I1722-I1727 HydrophobicContact CG2-CG1 4.35Å; I1722-M1773 HydrophobicContact CG1-SD 4.02Å; I1722-A1990 HydrophobicContact CD1-CB 3.59Å; I1722-F1991 HydrophobicContact CD1-CD2 3.83Å; I1722-F1991 HydrophobicContact CD1-CE2 4.07Å; I1722-F1991 HydrophobicContact CG1-CE2 4.41Å; I1722-F1991 HydrophobicContact CG2-CE2 4.35Å; I1722-F1991 HydrophobicContact CG2-CZ 4.4Å; I1722-M1994 HydrophobicContact CB-SD 3.71Å; I1722-M1994 HydrophobicContact CG2-SD 3.54Å; I1722-M1994 VanDerWaalsContact CG2-SD 3.54Å; I1722-K2002 PolarHBondContact O-NZ 3.48Å; I1722-V2003 HydrophobicContact CD1-CG1 4.02Å; I1722-V2003 PolarHBondContact N-O 2.89Å; I1722-L2005 HydrophobicContact CD1-CD1 4.49Å; I1722-L2005 HydrophobicContact CD1-CD2 4.25Å; I1722-L2005 HydrophobicContact CD1-CG 4.26Å; I1722-L2005 HydrophobicContact CG1-CD1 4.39Å; I1722-L2005 HydrophobicContact CG1-CG 4.27Å
1723	N	89.3	Confident	87.5	Confident	12 Å²	12	28.8 Å²	28.8	6%	0.064	15%	0.145	C	C	.	.			trans	-126.9	158.4	178.2	-53.8	-86.2	0	0	0	110	S1721 R1725 D1726 I1727 K2002	S1721-N1723 PolarHBondContact O-ND2 3.23Å; N1723-R1725 PolarHBondContact O-N 2.81Å; N1723-D1726 WeakPolarHBondContact CA-OD2 3.41Å; N1723-D1726 VanDerWaalsContact CB-OD2 3.24Å; N1723-D1726 WeakPolarHBondContact CB-OD2 3.42Å; N1723-D1726 PolarHBondContact N-OD2 2.84Å; N1723-D1726 PolarHBondContact ND2-OD2 3.39Å; N1723-D1726 WeakPolarHBondContact O-CB 3.48Å; N1723-D1726 PolarHBondContact O-N 3.31Å; N1723-I1727 PolarHBondContact O-N 3.09Å; N1723-K2002 PolarHBondContact OD1-NZ 3.13Å
1724	F	84.4	Confident	86.8	Confident	122 Å²	122	26.8 Å²	26.8	54%	0.535	14%	0.136	S	C	.	.	H	α-helix	trans	-63.1	-29.3	179.6	-153.7	-104.1	0	0	0	112.5	D1726 I1727 M1728	F1724-D1726 VanDerWaalsContact C-N 3.3Å; F1724-D1726 PolarHBondContact O-N 3.36Å; F1724-I1727 HydrophobicContact CD2-CD1 4.23Å; F1724-I1727 PolarHBondContact O-N 2.69Å; F1724-M1728 HydrophobicContact CD1-CG 4.04Å; F1724-M1728 HydrophobicContact CD1-SD 3.79Å; F1724-M1728 HydrophobicContact CE1-CG 4.04Å; F1724-M1728 HydrophobicContact CE1-SD 3.87Å; F1724-M1728 WeakPolarHBondContact O-CG 3.39Å; F1724-M1728 PolarHBondContact O-N 3.26Å
1725	R	86.1	Confident	85.9	Confident	23 Å²	23	26.3 Å²	26.3	9%	0.087	14%	0.136	C	C	.	.	H	α-helix	trans	-55.4	-44	170	-165.1	-169.5	86.1	168.7	3.8	111.9	N1723 I1727 M1728 L1729 I1739 L1749 M1752 P1769 D1948	N1723-R1725 PolarHBondContact O-N 2.81Å; R1725-I1727 VanDerWaalsContact C-N 3.33Å; R1725-I1727 PolarHBondContact O-N 3.16Å; R1725-M1728 PolarHBondContact O-N 2.99Å; R1725-L1729 HydrophobicContact CG-CD1 4.16Å; R1725-L1729 WeakPolarHBondContact O-CB 3.49Å; R1725-L1729 WeakPolarHBondContact O-CG 3.5Å; R1725-L1729 PolarHBondContact O-N 2.97Å; R1725-I1739 HydrophobicContact CG-CD1 4.32Å; R1725-L1749 PolarHBondContact NH2-O 3.36Å; R1725-M1752 VanDerWaalsContact CZ-SD 3.51Å; R1725-M1752 PolarHBondContact NH1-SD 3.22Å; R1725-P1769 PolarHBondContact NH1-O 3.29Å; R1725-P1769 PolarHBondContact NH2-O 3.01Å; R1725-D1948 WeakPolarHBondContact CD-OD1 3.31Å; R1725-D1948 IonicContact CZ-OD1 2.87Å; R1725-D1948 IonicContact NH1-OD1 3.31Å; R1725-D1948 PolarHBondContact NH1-OD1 2.8Å
1726	D	87.9	Confident	84.9	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-66.6	-37.8	-175.7	-53.3	-44.9	0	0	0	110.9	I1722 N1723 F1724 A1730 L1750 G1751 M1773 F1991	I1722-D1726 HydrophobicContact CG2-CB 4.48Å; N1723-D1726 WeakPolarHBondContact CA-OD2 3.41Å; N1723-D1726 VanDerWaalsContact CB-OD2 3.24Å; N1723-D1726 WeakPolarHBondContact CB-OD2 3.42Å; N1723-D1726 PolarHBondContact N-OD2 2.84Å; N1723-D1726 PolarHBondContact ND2-OD2 3.39Å; N1723-D1726 WeakPolarHBondContact O-CB 3.48Å; N1723-D1726 PolarHBondContact O-N 3.31Å; F1724-D1726 VanDerWaalsContact C-N 3.3Å; F1724-D1726 PolarHBondContact O-N 3.36Å; D1726-A1730 VanDerWaalsContact O-CB 3.28Å; D1726-A1730 WeakPolarHBondContact O-CB 3.42Å; D1726-A1730 PolarHBondContact O-N 3.16Å; D1726-L1750 HydrophobicContact CB-CD2 4.39Å; D1726-G1751 PolarHBondContact OD1-N 2.89Å; D1726-M1773 HydrophobicContact CB-CE 4.32Å; D1726-F1991 HydrophobicContact CB-CE1 4.26Å; D1726-F1991 HydrophobicContact CB-CZ 4.26Å
1727	I	86.5	Confident	83.8	Confident	9 Å²	9	30.9 Å²	30.9	5%	0.046	16%	0.158	C	C	.	.	H	α-helix	trans	-67.6	-47.6	174.8	-53.8	172.5	0	0	0	110.7	I1722 N1723 F1724 R1725 L1729 A1730 T1731 F1991 M1994 A1995	I1722-I1727 HydrophobicContact CG2-CG1 4.35Å; N1723-I1727 PolarHBondContact O-N 3.09Å; F1724-I1727 HydrophobicContact CD2-CD1 4.23Å; F1724-I1727 PolarHBondContact O-N 2.69Å; R1725-I1727 VanDerWaalsContact C-N 3.33Å; R1725-I1727 PolarHBondContact O-N 3.16Å; I1727-L1729 VanDerWaalsContact C-N 3.28Å; I1727-L1729 PolarHBondContact O-N 3.31Å; I1727-A1730 PolarHBondContact O-N 3.25Å; I1727-T1731 HydrophobicContact CG2-CG2 4.27Å; I1727-T1731 WeakPolarHBondContact O-CB 3.19Å; I1727-T1731 WeakPolarHBondContact O-CG2 3.26Å; I1727-T1731 PolarHBondContact O-N 3.28Å; I1727-T1731 PolarHBondContact O-OG1 3.42Å; I1727-F1991 HydrophobicContact CG1-CD1 4.33Å; I1727-M1994 HydrophobicContact CD1-CB 3.76Å; I1727-M1994 HydrophobicContact CD1-CG 3.67Å; I1727-M1994 HydrophobicContact CD1-SD 3.96Å; I1727-A1995 HydrophobicContact CD1-CB 4.46Å; I1727-A1995 HydrophobicContact CG2-CB 3.96Å
1728	M	82.9	Confident	82.8	Confident	23 Å²	23	32.3 Å²	32.3	11%	0.113	17%	0.168	C	C	.	.	H	α-helix	trans	-63.5	-34.1	-179.9	-67.6	-177.7	78.8	0	0	112.2	F1724 R1725 G1732 R1733 L1734 Y1923	F1724-M1728 HydrophobicContact CD1-CG 4.04Å; F1724-M1728 HydrophobicContact CD1-SD 3.79Å; F1724-M1728 HydrophobicContact CE1-CG 4.04Å; F1724-M1728 HydrophobicContact CE1-SD 3.87Å; F1724-M1728 WeakPolarHBondContact O-CG 3.39Å; F1724-M1728 PolarHBondContact O-N 3.26Å; R1725-M1728 PolarHBondContact O-N 2.99Å; M1728-G1732 CarbonylContact O-C 3.57Å; M1728-G1732 PolarHBondContact O-N 3.18Å; M1728-G1732 VanDerWaalsContact O-N 3.17Å; M1728-R1733 PolarHBondContact O-N 3.29Å; M1728-L1734 HydrophobicContact CB-CB 3.87Å; M1728-L1734 HydrophobicContact CE-CB 4.26Å; M1728-L1734 HydrophobicContact CE-CD1 4.44Å; M1728-L1734 PolarHBondContact O-N 2.82Å; M1728-Y1923 HydrophobicContact CE-CD2 4.39Å
1729	L	82.5	Confident	81.8	Confident	11 Å²	11	32.9 Å²	32.9	6%	0.058	17%	0.171	C	C	.	.	H	α-helix	trans	-70.2	-50.4	172.6	-75.5	171.2	0	0	0	112.5	R1725 I1727 T1731 G1732 I1739 L1749 L1750	R1725-L1729 HydrophobicContact CG-CD1 4.16Å; R1725-L1729 WeakPolarHBondContact O-CB 3.49Å; R1725-L1729 WeakPolarHBondContact O-CG 3.5Å; R1725-L1729 PolarHBondContact O-N 2.97Å; I1727-L1729 VanDerWaalsContact C-N 3.28Å; I1727-L1729 PolarHBondContact O-N 3.31Å; L1729-T1731 VanDerWaalsContact C-N 3.28Å; L1729-T1731 PolarHBondContact O-N 3.02Å; L1729-G1732 PolarHBondContact O-N 3.36Å; L1729-G1732 VanDerWaalsContact O-N 3.11Å; L1729-I1739 HydrophobicContact CD1-CD1 3.76Å; L1729-I1739 HydrophobicContact CD2-CD1 3.8Å; L1729-I1739 HydrophobicContact CG-CD1 4.14Å; L1729-L1749 HydrophobicContact CD1-CB 4.13Å; L1729-L1750 HydrophobicContact CB-CD2 3.85Å; L1729-L1750 HydrophobicContact CD1-CD2 4.32Å
1730	A	80.9	Confident	80.5	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-63	-35.3	-178.5	0	0	0	0	0	112.4	T1686 G1690 L1692 L1695 D1726 I1727 F1991	T1686-A1730 HydrophobicContact CG2-CB 4.1Å; G1690-A1730 WeakPolarHBondContact CA-O 3.37Å; G1690-A1730 PolarHBondContact N-O 2.82Å; L1692-A1730 HydrophobicContact CD2-CB 3.76Å; L1695-A1730 HydrophobicContact CD1-CB 4.48Å; D1726-A1730 VanDerWaalsContact O-CB 3.28Å; D1726-A1730 WeakPolarHBondContact O-CB 3.42Å; D1726-A1730 PolarHBondContact O-N 3.16Å; I1727-A1730 PolarHBondContact O-N 3.25Å; A1730-F1991 HydrophobicContact CB-CD1 4.3Å; A1730-F1991 HydrophobicContact CB-CE1 3.92Å
1731	T	76.5	Confident	79.1	Confident	44 Å²	44	36.5 Å²	36.5	27%	0.27	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-1.7	175.8	59.7	0	0	0	0	114.5	L1692 I1727 L1729 R1733	L1692-T1731 HydrophobicContact CD1-CG2 4.14Å; L1692-T1731 HydrophobicContact CD2-CG2 4.24Å; L1692-T1731 HydrophobicContact CG-CG2 4.29Å; I1727-T1731 HydrophobicContact CG2-CG2 4.27Å; I1727-T1731 WeakPolarHBondContact O-CB 3.19Å; I1727-T1731 WeakPolarHBondContact O-CG2 3.26Å; I1727-T1731 PolarHBondContact O-N 3.28Å; I1727-T1731 PolarHBondContact O-OG1 3.42Å; L1729-T1731 VanDerWaalsContact C-N 3.28Å; L1729-T1731 PolarHBondContact O-N 3.02Å; T1731-R1733 PolarHBondContact O-N 2.97Å
1732	G	71.7	Confident	77.6	Confident	51 Å²	51	44.7 Å²	44.7	53%	0.526	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	9.6	179.8	0	0	0	0	0	116	M1728 L1729 L1734	M1728-G1732 CarbonylContact O-C 3.57Å; M1728-G1732 PolarHBondContact O-N 3.18Å; M1728-G1732 VanDerWaalsContact O-N 3.17Å; L1729-G1732 PolarHBondContact O-N 3.36Å; L1729-G1732 VanDerWaalsContact O-N 3.11Å; G1732-L1734 PolarHBondContact O-N 3.22Å
1733	R	72.6	Confident	76.4	Confident	190 Å²	190	46.7 Å²	46.7	72%	0.717	25%	0.254	S	S	*	.	S	Bend	trans	-74	-6.5	177.4	-73.3	-170.2	174.3	-144.9	-0.6	114.6	M1728 T1731	M1728-R1733 PolarHBondContact O-N 3.29Å; T1731-R1733 PolarHBondContact O-N 2.97Å
1734	L	75.6	Confident	74.8	Confident	10 Å²	10	50.2 Å²	50.2	5%	0.052	27%	0.272	C	S	.	.	S	Bend	trans	-133.6	131.2	172.4	-169.8	72.9	0	0	0	108.4	M1728 G1732 I1739 K1922 A1926	M1728-L1734 HydrophobicContact CB-CB 3.87Å; M1728-L1734 HydrophobicContact CE-CB 4.26Å; M1728-L1734 HydrophobicContact CE-CD1 4.44Å; M1728-L1734 PolarHBondContact O-N 2.82Å; G1732-L1734 PolarHBondContact O-N 3.22Å; L1734-I1739 HydrophobicContact CD2-CG1 4.43Å; L1734-K1922 HydrophobicContact CD1-CB 3.96Å; L1734-K1922 HydrophobicContact CD2-CB 4.38Å; L1734-K1922 HydrophobicContact CD2-CD 3.96Å; L1734-A1926 HydrophobicContact CD1-CB 3.98Å
1735	S	72.3	Confident	73.6	Confident	27 Å²	27	48.7 Å²	48.7	19%	0.189	27%	0.269	C	S	.	.			trans	-71.5	163.7	178	81.3	0	0	0	0	111.8	D1737 S1738	S1735-D1737 VanDerWaalsContact C-N 3.29Å; S1735-D1737 PolarHBondContact OG-N 3.33Å; S1735-D1737 PolarHBondContact OG-OD2 2.84Å; S1735-S1738 PolarHBondContact O-N 3.26Å; S1735-S1738 PolarHBondContact OG-N 3.3Å; S1735-S1738 PolarHBondContact OG-OG 3.43Å
1736	I	73.4	Confident	72.8	Confident	45 Å²	45	51.5 Å²	51.5	23%	0.231	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-63.1	-42.4	170.9	-41.7	176	0	0	0	109.9	T1225 S1738 I1739 L1749	T1225-I1736 HydrophobicContact CG2-CD1 4.12Å; I1736-S1738 PolarHBondContact O-N 2.91Å; I1736-I1739 PolarHBondContact O-N 3.15Å; I1736-L1749 HydrophobicContact CG2-CD1 3.89Å
1737	D	71.3	Confident	72.1	Confident	71 Å²	71	54 Å²	54	38%	0.38	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-62.3	-17.4	-174.9	-27.8	-72.4	0	0	0	112.2	T1225 S1735 I1739	T1225-D1737 WeakPolarHBondContact CB-OD1 3.29Å; T1225-D1737 VanDerWaalsContact CB-OD2 3.31Å; T1225-D1737 WeakPolarHBondContact CB-OD2 3.34Å; T1225-D1737 PolarHBondContact N-OD2 3.23Å; T1225-D1737 PolarHBondContact OG1-OD1 2.6Å; T1225-D1737 PolarHBondContact OG1-OD2 2.76Å; S1735-D1737 VanDerWaalsContact C-N 3.29Å; S1735-D1737 PolarHBondContact OG-N 3.33Å; S1735-D1737 PolarHBondContact OG-OD2 2.84Å; D1737-I1739 VanDerWaalsContact C-N 3.27Å; D1737-I1739 PolarHBondContact O-N 2.8Å
1738	S	73	Confident	71.9	Confident	31 Å²	31	53.6 Å²	53.6	22%	0.217	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-81.3	5.5	175	-53.1	0	0	0	0	114.2	S1735 I1736 A1926	S1735-S1738 PolarHBondContact O-N 3.26Å; S1735-S1738 PolarHBondContact OG-N 3.3Å; S1735-S1738 PolarHBondContact OG-OG 3.43Å; I1736-S1738 PolarHBondContact O-N 2.91Å; S1738-A1926 WeakPolarHBondContact OG-CB 3.13Å
1739	I	75.3	Confident	71.9	Confident	11 Å²	11	53 Å²	53	6%	0.056	29%	0.29	C	S	.	.	S	Bend	trans	-117.4	118.1	178.2	-57.5	-169.4	0	0	0	110.6	R1725 L1729 L1734 I1736 D1737 G1741 F1743 D1948	R1725-I1739 HydrophobicContact CG-CD1 4.32Å; L1729-I1739 HydrophobicContact CD1-CD1 3.76Å; L1729-I1739 HydrophobicContact CD2-CD1 3.8Å; L1729-I1739 HydrophobicContact CG-CD1 4.14Å; L1734-I1739 HydrophobicContact CD2-CG1 4.43Å; I1736-I1739 PolarHBondContact O-N 3.15Å; D1737-I1739 VanDerWaalsContact C-N 3.27Å; D1737-I1739 PolarHBondContact O-N 2.8Å; I1739-G1741 PolarHBondContact O-N 3.22Å; I1739-F1743 HydrophobicContact CG2-CE2 3.82Å; I1739-F1743 HydrophobicContact CG2-CZ 4.45Å; I1739-D1948 HydrophobicContact CG2-CB 4.4Å
1740	P	67.4	Low	72.2	Confident	35 Å²	35	52.7 Å²	52.7	23%	0.227	29%	0.289	C	S	.	.	S	Bend	trans	-58	122.6	174.8	-26	34.3	0	0	0	113.4	F1743 L1946 S1949	P1740-F1743 WeakPolarHBondContact O-CE2 3.39Å; P1740-L1946 HydrophobicContact CG-CD1 4.01Å; P1740-S1949 WeakPolarHBondContact CG-OG 3.22Å
1741	G	65.2	Low	72.7	Confident	50 Å²	50	52.7 Å²	52.7	52%	0.515	29%	0.289	S	S	.	.	S	Bend	trans	134.4	155.9	173.1	0	0	0	0	0	113.9	I1739 F1743	I1739-G1741 PolarHBondContact O-N 3.22Å; G1741-F1743 VanDerWaalsContact O-CD2 3.27Å; G1741-F1743 WeakPolarHBondContact O-CD2 3.42Å; G1741-F1743 PolarHBondContact O-N 3.02Å
1742	M	62.3	Low	73.3	Confident	173 Å²	173	51 Å²	51	85%	0.852	28%	0.278	S	S	*	.			trans	-84.4	109	171.2	-79.1	-170.4	157.3	0	0	110.2
1743	F	67.2	Low	74.4	Confident	41 Å²	41	48.5 Å²	48.5	18%	0.18	25%	0.253	C	S	.	.			trans	-118.8	20.9	-178.6	-59.6	-73	0	0	0	113.7	I1739 P1740 G1741 D1745 K1746 L1749 P1769	I1739-F1743 HydrophobicContact CG2-CE2 3.82Å; I1739-F1743 HydrophobicContact CG2-CZ 4.45Å; P1740-F1743 WeakPolarHBondContact O-CE2 3.39Å; G1741-F1743 VanDerWaalsContact O-CD2 3.27Å; G1741-F1743 WeakPolarHBondContact O-CD2 3.42Å; G1741-F1743 PolarHBondContact O-N 3.02Å; F1743-D1745 PolarHBondContact O-N 2.9Å; F1743-K1746 HydrophobicContact CB-CB 4.26Å; F1743-K1746 HydrophobicContact CD1-CG 4.35Å; F1743-K1746 PolarHBondContact O-N 2.84Å; F1743-L1749 HydrophobicContact CB-CD2 3.83Å; F1743-L1749 HydrophobicContact CD1-CD2 4.26Å; F1743-L1749 HydrophobicContact CG-CD2 4.07Å; F1743-P1769 HydrophobicContact CE1-CB 4.04Å; F1743-P1769 HydrophobicContact CZ-CB 4.23Å
1744	I	55.1	Low	75.4	Confident	87 Å²	87	39.5 Å²	39.5	45%	0.446	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-28.8	-173.3	-59.1	173.5	0	0	0	111.9	M1168 M2085	M1168-I1744 HydrophobicContact CE-CD1 4.27Å; I1744-M2085 HydrophobicContact CG2-CE 4.29Å
1745	D	61	Low	76.4	Confident	89 Å²	89	39 Å²	39	48%	0.476	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	16.2	178.9	67.7	-25.6	0	0	0	114.3	F1743 R2060	F1743-D1745 PolarHBondContact O-N 2.9Å; D1745-R2060 IonicContact OD2-NH2 2.66Å
1746	K	69.1	Low	77.5	Confident	82 Å²	82	37.7 Å²	37.7	36%	0.357	21%	0.207	S	C	.	.			trans	-114.2	96.9	-175.8	-72.9	-79.7	-178.2	161.6	0	113.1	F1743 C1748 L1749	F1743-K1746 HydrophobicContact CB-CB 4.26Å; F1743-K1746 HydrophobicContact CD1-CG 4.35Å; F1743-K1746 PolarHBondContact O-N 2.84Å; K1746-C1748 PolarHBondContact O-N 3.32Å; K1746-L1749 HydrophobicContact CB-CD2 4.1Å
1747	D	72.1	Confident	78.4	Confident	53 Å²	53	35.6 Å²	35.6	28%	0.283	20%	0.196	S	C	.	.	S	Bend	trans	-59.1	-28	-179.6	-161	27.9	0	0	0	114	F1683 N1685 R2028 Y2030	F1683-D1747 HydrophobicContact CZ-CB 4.47Å; N1685-D1747 PolarHBondContact ND2-O 2.74Å; D1747-R2028 VanDerWaalsContact CG-NH2 3.27Å; D1747-R2028 IonicContact OD1-CZ 2.71Å; D1747-R2028 IonicContact OD1-NH2 3.39Å; D1747-R2028 PolarHBondContact OD1-NH2 2.87Å; D1747-R2028 IonicContact OD2-CZ 2.68Å; D1747-R2028 VanDerWaalsContact OD2-CZ 3.31Å; D1747-R2028 IonicContact OD2-NE 2.69Å; D1747-R2028 PolarHBondContact OD2-NE 2.7Å; D1747-R2028 IonicContact OD2-NH2 3.84Å; D1747-R2028 PolarHBondContact OD2-NH2 3.26Å; D1747-Y2030 PolarHBondContact OD2-OH 3.17Å
1748	C	83.2	Confident	79.4	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.007	18%	0.183	C	C	.	.			trans	-125	133	175	174.4	0	0	0	0	112.4	F1683 I1684 N1685 K1746 L1750 Q1771	F1683-C1748 HydrophobicContact CD2-CB 3.58Å; F1683-C1748 HydrophobicContact CE2-CB 3.38Å; F1683-C1748 HydrophobicContact CG-CB 4.29Å; F1683-C1748 HydrophobicContact CZ-CB 3.9Å; I1684-C1748 PolarHBondContact O-SG 2.95Å; N1685-C1748 HydrophobicContact CB-CB 4.15Å; K1746-C1748 PolarHBondContact O-N 3.32Å; C1748-L1750 PolarHBondContact SG-N 3.43Å; C1748-L1750 VanDerWaalsContact SG-N 3.37Å; C1748-Q1771 HydrophobicContact CB-CG 4.15Å; C1748-Q1771 VanDerWaalsContact O-CG 3.23Å; C1748-Q1771 WeakPolarHBondContact O-CG 3.42Å
1749	L	83.3	Confident	80.1	Confident	10 Å²	10	35.9 Å²	35.9	5%	0.052	20%	0.2	C	C	.	.			trans	-111.9	2.7	179.3	-57	-179.2	0	0	0	113.3	R1725 L1729 I1736 F1743 K1746	R1725-L1749 PolarHBondContact NH2-O 3.36Å; L1729-L1749 HydrophobicContact CD1-CB 4.13Å; I1736-L1749 HydrophobicContact CG2-CD1 3.89Å; F1743-L1749 HydrophobicContact CB-CD2 3.83Å; F1743-L1749 HydrophobicContact CD1-CD2 4.26Å; F1743-L1749 HydrophobicContact CG-CD2 4.07Å; K1746-L1749 HydrophobicContact CB-CD2 4.1Å
1750	L	88.8	Confident	80.7	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.026	23%	0.227	C	C	.	.			trans	-89.5	142.4	-173.5	-51.6	-176.8	0	0	0	112.2	D1726 L1729 C1748 Q1771 M1773 F1991	D1726-L1750 HydrophobicContact CB-CD2 4.39Å; L1729-L1750 HydrophobicContact CB-CD2 3.85Å; L1729-L1750 HydrophobicContact CD1-CD2 4.32Å; C1748-L1750 PolarHBondContact SG-N 3.43Å; C1748-L1750 VanDerWaalsContact SG-N 3.37Å; L1750-Q1771 VanDerWaalsContact O-CA 3.31Å; L1750-Q1771 WeakPolarHBondContact O-CA 3.38Å; L1750-Q1771 PolarHBondContact O-N 2.95Å; L1750-M1773 HydrophobicContact CB-CE 3.58Å; L1750-F1991 HydrophobicContact CD1-CZ 4.29Å
1751	G	89.8	Confident	81.7	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.216	C	C	.	.			trans	84.5	125.1	172.8	0	0	0	0	0	113.1	D1726 C1770 Q1771 A1772	D1726-G1751 PolarHBondContact OD1-N 2.89Å; G1751-C1770 CarbonylContact O-C 3.59Å; G1751-C1770 VanDerWaalsContact O-CA 3.32Å; G1751-C1770 WeakPolarHBondContact O-CA 3.41Å; G1751-Q1771 PolarHBondContact O-N 3.23Å; G1751-A1772 VanDerWaalsContact C-CB 3.41Å; G1751-A1772 WeakPolarHBondContact O-CB 3.43Å; G1751-A1772 PolarHBondContact O-N 3.06Å
1752	M	90.8	Very high	83	Confident	8 Å²	8	39.2 Å²	39.2	4%	0.039	21%	0.206	C	C	.	.			trans	-117.8	-13.9	-178.8	-61.6	179.6	75.5	0	0	114.9	R1725 L1767 L1768 V1801 L1947 F1951	R1725-M1752 VanDerWaalsContact CZ-SD 3.51Å; R1725-M1752 PolarHBondContact NH1-SD 3.22Å; M1752-L1767 CarbonylContact O-C 3.48Å; M1752-L1767 WeakPolarHBondContact O-CA 3.36Å; M1752-L1768 WeakPolarHBondContact CA-O 3.5Å; M1752-L1768 PolarHBondContact O-N 3.34Å; M1752-V1801 HydrophobicContact CB-CG2 3.87Å; M1752-L1947 HydrophobicContact CE-CD2 4.23Å; M1752-F1951 HydrophobicContact CE-CE2 3.96Å
1753	E	93.3	Very high	84.6	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	136.6	-169	154.5	-175.3	-101.8	0	0	111.5	S1721 L1767 A1772 P1800 V1801 K2002	S1721-E1753 VanDerWaalsContact CB-OE2 3.23Å; S1721-E1753 WeakPolarHBondContact CB-OE2 3.26Å; S1721-E1753 PolarHBondContact N-O 2.83Å; S1721-E1753 VanDerWaalsContact N-O 3.08Å; S1721-E1753 WeakPolarHBondContact OG-CB 3.38Å; S1721-E1753 VanDerWaalsContact OG-CD 3.31Å; S1721-E1753 WeakPolarHBondContact OG-CG 3.35Å; S1721-E1753 PolarHBondContact OG-OE2 3.05Å; E1753-L1767 HydrophobicContact CB-CD2 4.32Å; E1753-A1772 VanDerWaalsContact N-CB 3.35Å; E1753-P1800 HydrophobicContact CG-CB 4.11Å; E1753-P1800 HydrophobicContact CG-CG 4.24Å; E1753-P1800 WeakPolarHBondContact OE1-CA 3.43Å; E1753-P1800 WeakPolarHBondContact OE1-CB 3.4Å; E1753-P1800 WeakPolarHBondContact OE1-CD 3.49Å; E1753-V1801 HydrophobicContact CB-CB 4.41Å; E1753-V1801 HydrophobicContact CB-CG2 3.72Å; E1753-V1801 PolarHBondContact OE1-N 2.82Å; E1753-K2002 WeakPolarHBondContact OE2-CE 3.37Å; E1753-K2002 IonicContact OE2-NZ 2.74Å; E1753-K2002 PolarHBondContact OE2-NZ 3.34Å
1754	Y	95.2	Very high	85.9	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	158.2	-177.3	73.5	-82.8	0	0	0	111.7	C1715 V1717 Y1719 M1765 G1766 L1768 A1772 V1777 A1779	C1715-Y1754 HydrophobicContact CB-CE2 4.26Å; V1717-Y1754 HydrophobicContact CG2-CD2 4.17Å; V1717-Y1754 HydrophobicContact CG2-CG 4.38Å; Y1719-Y1754 CarbonylContact O-C 3.51Å; Y1719-Y1754 WeakPolarHBondContact O-CA 3.48Å; Y1754-M1765 WeakPolarHBondContact O-CA 3.49Å; Y1754-G1766 WeakPolarHBondContact CD1-O 3.25Å; Y1754-G1766 PolarHBondContact N-O 2.98Å; Y1754-G1766 PolarHBondContact O-N 2.65Å; Y1754-L1768 HydrophobicContact CD1-CD1 3.88Å; Y1754-L1768 HydrophobicContact CD1-CG 4.27Å; Y1754-L1768 HydrophobicContact CE1-CD1 3.91Å; Y1754-L1768 HydrophobicContact CE1-CG 4Å; Y1754-A1772 HydrophobicContact CD1-CB 4.47Å; Y1754-V1777 HydrophobicContact CD1-CG2 4.3Å; Y1754-V1777 HydrophobicContact CD2-CG2 4.18Å; Y1754-V1777 HydrophobicContact CE1-CG2 4.12Å; Y1754-V1777 HydrophobicContact CE2-CG2 4.01Å; Y1754-V1777 HydrophobicContact CG-CG2 4.34Å; Y1754-A1779 HydrophobicContact CE1-CB 4.36Å; Y1754-A1779 VanDerWaalsContact OH-CB 3.23Å; Y1754-A1779 WeakPolarHBondContact OH-CB 3.33Å
1755	A	95.8	Very high	87.8	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	144.5	161.1	0	0	0	0	0	110	Y1718 Y1719 V1764 M1765 M1793 A1796 A1797	Y1718-A1755 PolarHBondContact N-O 3.02Å; Y1719-A1755 PolarHBondContact N-O 3.44Å; Y1719-A1755 VanDerWaalsContact N-O 3.14Å; Y1719-A1755 PolarHBondContact O-N 2.89Å; A1755-V1764 CarbonylContact C-O 3.55Å; A1755-V1764 WeakPolarHBondContact CA-O 3.29Å; A1755-M1765 HydrophobicContact CB-CB 4.32Å; A1755-M1793 HydrophobicContact CB-CB 4.28Å; A1755-M1793 HydrophobicContact CB-CG 4.41Å; A1755-M1793 VanDerWaalsContact CB-O 3.26Å; A1755-M1793 WeakPolarHBondContact CB-O 3.03Å; A1755-A1796 HydrophobicContact CB-CB 4.16Å; A1755-A1797 HydrophobicContact CB-CB 3.91Å
1756	G	94.5	Very high	89.4	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.2	-157.8	-175.2	0	0	0	0	0	114.9	S1716 R1763 V1764 M1793	S1716-G1756 CarbonylContact O-C 3.57Å; S1716-G1756 WeakPolarHBondContact O-CA 3.48Å; G1756-R1763 WeakPolarHBondContact O-CA 3.33Å; G1756-V1764 PolarHBondContact N-O 2.68Å; G1756-V1764 PolarHBondContact O-N 2.94Å; G1756-M1793 VanDerWaalsContact CA-SD 3.55Å
1757	R	93.7	Very high	90.5	Very high	1 Å²	1	17.9 Å²	17.9	0%	0.004	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	141.5	-179.2	-62.7	-177.5	-174.2	-88.3	5	113.3	C1715 S1716 Y1718 G1761 E1762 R1763 M1793 E2011 A2013 K2014 C2016 P2018	C1715-R1757 VanDerWaalsContact SG-C 3.57Å; C1715-R1757 PolarHBondContact SG-O 3.15Å; S1716-R1757 PolarHBondContact N-O 2.97Å; S1716-R1757 PolarHBondContact O-N 3.38Å; Y1718-R1757 HydrophobicContact CD2-CG 4.43Å; Y1718-R1757 HydrophobicContact CE2-CB 4.06Å; Y1718-R1757 HydrophobicContact CE2-CG 3.73Å; Y1718-R1757 WeakPolarHBondContact OH-CD 3.31Å; Y1718-R1757 PolarHBondContact OH-NE 2.66Å; R1757-G1761 PolarHBondContact NH1-O 3.18Å; R1757-E1762 VanDerWaalsContact CA-O 3.28Å; R1757-E1762 WeakPolarHBondContact CA-O 3.37Å; R1757-R1763 HydrophobicContact CG-CG 4.41Å; R1757-M1793 HydrophobicContact CG-CE 4.19Å; R1757-M1793 HydrophobicContact CG-SD 4.34Å; R1757-E2011 IonicContact CZ-OE2 2.71Å; R1757-E2011 IonicContact NE-OE2 3.07Å; R1757-E2011 PolarHBondContact NE-OE2 3.39Å; R1757-E2011 IonicContact NH2-OE2 2.78Å; R1757-E2011 PolarHBondContact NH2-OE2 2.95Å; R1757-A2013 PolarHBondContact NH2-O 2.86Å; R1757-K2014 PolarHBondContact NH1-O 3.2Å; R1757-C2016 WeakPolarHBondContact CD-O 3.34Å; R1757-C2016 VanDerWaalsContact CZ-SG 3.51Å; R1757-C2016 PolarHBondContact NH2-SG 3.41Å; R1757-P2018 HydrophobicContact CB-CB 4.21Å
1758	L	92.2	Very high	91.3	Very high	20 Å²	20	16 Å²	16	11%	0.105	9%	0.091	C	C	.	.			trans	-74	164.5	164.5	-63.6	-179.4	0	0	0	111.2	E1713 C1715 T1760 G1761 E1762 V1764 M1784	E1713-L1758 HydrophobicContact CB-CD2 3.94Å; E1713-L1758 HydrophobicContact CG-CD2 4.5Å; C1715-L1758 HydrophobicContact CB-CD2 4.16Å; L1758-T1760 WeakPolarHBondContact CB-OG1 3.33Å; L1758-T1760 PolarHBondContact O-N 2.83Å; L1758-T1760 VanDerWaalsContact O-N 3.17Å; L1758-G1761 WeakPolarHBondContact O-CA 3.39Å; L1758-G1761 PolarHBondContact O-N 2.88Å; L1758-E1762 PolarHBondContact N-O 3.27Å; L1758-V1764 HydrophobicContact CD1-CG1 4.06Å; L1758-V1764 HydrophobicContact CD2-CG2 4.29Å; L1758-V1764 HydrophobicContact CG-CG1 4.03Å; L1758-V1764 HydrophobicContact CG-CG2 4.1Å; L1758-M1784 HydrophobicContact CD1-SD 4.31Å; L1758-M1784 HydrophobicContact CD2-CE 4.21Å; L1758-M1784 HydrophobicContact CD2-SD 4.06Å
1759	P	87	Confident	91.3	Very high	87 Å²	87	17.9 Å²	17.9	57%	0.565	10%	0.103	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-21	175.9	-23.8	35.7	0	0	0	113.7	L1714 G1761	L1714-P1759 VanDerWaalsContact O-CD 3.28Å; L1714-P1759 WeakPolarHBondContact O-CD 3.26Å; P1759-G1761 PolarHBondContact O-N 3.27Å
1760	T	88.2	Confident	91.5	Very high	104 Å²	104	17.6 Å²	17.6	64%	0.638	10%	0.102	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-8.6	169.9	55.3	0	0	0	0	113.6	L1758 E1762	L1758-T1760 WeakPolarHBondContact CB-OG1 3.33Å; L1758-T1760 PolarHBondContact O-N 2.83Å; L1758-T1760 VanDerWaalsContact O-N 3.17Å; T1760-E1762 VanDerWaalsContact C-N 3.33Å
1761	G	88.7	Confident	91.5	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.107	C	C	.	.			trans	85.3	-2.4	-177.1	0	0	0	0	0	115.4	R1757 L1758 P1759 C2016	R1757-G1761 PolarHBondContact NH1-O 3.18Å; L1758-G1761 WeakPolarHBondContact O-CA 3.39Å; L1758-G1761 PolarHBondContact O-N 2.88Å; P1759-G1761 PolarHBondContact O-N 3.27Å; G1761-C2016 WeakPolarHBondContact CA-O 3.35Å
1762	E	92.1	Very high	91.5	Very high	63 Å²	63	18.7 Å²	18.7	29%	0.294	11%	0.107	S	C	.	.			trans	-68.9	133.1	-180	-178.1	160.4	-135.2	0	0	112.1	R1757 L1758 T1760 V1764 K1786 L2015	R1757-E1762 VanDerWaalsContact CA-O 3.28Å; R1757-E1762 WeakPolarHBondContact CA-O 3.37Å; L1758-E1762 PolarHBondContact N-O 3.27Å; T1760-E1762 VanDerWaalsContact C-N 3.33Å; E1762-V1764 HydrophobicContact CG-CG1 4.35Å; E1762-K1786 WeakPolarHBondContact OE1-CD 3.27Å; E1762-K1786 WeakPolarHBondContact OE1-CE 3.12Å; E1762-K1786 IonicContact OE1-NZ 3.04Å; E1762-K1786 PolarHBondContact OE1-NZ 2.88Å; E1762-L2015 HydrophobicContact CB-CD1 4.49Å
1763	R	94.7	Very high	91.6	Very high	16 Å²	16	18.4 Å²	18.4	6%	0.06	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	121.9	179.9	-65.1	167.4	70.2	-116.5	6.6	110.5	G1756 R1757 V1787 P1788 W1791 M1793 E2010 K2014	G1756-R1763 WeakPolarHBondContact O-CA 3.33Å; R1757-R1763 HydrophobicContact CG-CG 4.41Å; R1763-V1787 HydrophobicContact CB-CB 4.02Å; R1763-V1787 HydrophobicContact CB-CG2 4.27Å; R1763-V1787 PolarHBondContact O-N 3.01Å; R1763-P1788 PolarHBondContact NH1-O 2.94Å; R1763-W1791 PolarHBondContact NH1-O 3.09Å; R1763-W1791 PolarHBondContact NH2-O 3.27Å; R1763-M1793 HydrophobicContact CG-CE 4.45Å; R1763-M1793 HydrophobicContact CG-SD 4.41Å; R1763-E2010 IonicContact CZ-OE1 3.9Å; R1763-E2010 IonicContact NE-OE1 2.73Å; R1763-E2010 PolarHBondContact NE-OE1 3.42Å; R1763-E2010 IonicContact NH2-OE1 2.66Å; R1763-E2010 PolarHBondContact NH2-OE1 3.15Å; R1763-E2010 IonicContact NH2-OE2 3.58Å; R1763-K2014 WeakPolarHBondContact CD-O 3.28Å; R1763-K2014 WeakPolarHBondContact CG-O 3.32Å
1764	V	95.1	Very high	91.7	Very high	5 Å²	5	18.5 Å²	18.5	3%	0.03	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	152.9	-175.4	-64.6	0	0	0	0	112.1	C1715 A1755 G1756 L1758 E1762 M1784 W1785	C1715-V1764 VanDerWaalsContact SG-CG2 3.57Å; A1755-V1764 CarbonylContact C-O 3.55Å; A1755-V1764 WeakPolarHBondContact CA-O 3.29Å; G1756-V1764 PolarHBondContact N-O 2.68Å; G1756-V1764 PolarHBondContact O-N 2.94Å; L1758-V1764 HydrophobicContact CD1-CG1 4.06Å; L1758-V1764 HydrophobicContact CD2-CG2 4.29Å; L1758-V1764 HydrophobicContact CG-CG1 4.03Å; L1758-V1764 HydrophobicContact CG-CG2 4.1Å; E1762-V1764 HydrophobicContact CG-CG1 4.35Å; V1764-M1784 HydrophobicContact CB-CG 3.97Å; V1764-M1784 HydrophobicContact CB-SD 3.94Å; V1764-M1784 HydrophobicContact CG1-CG 4.3Å; V1764-M1784 HydrophobicContact CG1-SD 3.85Å; V1764-M1784 HydrophobicContact CG2-CG 4.43Å; V1764-M1784 HydrophobicContact CG2-SD 4.05Å; V1764-W1785 CarbonylContact C-O 3.49Å; V1764-W1785 VanDerWaalsContact CA-O 3.23Å; V1764-W1785 WeakPolarHBondContact CA-O 3.23Å; V1764-W1785 WeakPolarHBondContact CB-O 3.33Å
1765	M	95.6	Very high	91.6	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	151.5	167.2	62.2	-178.7	-179.4	0	0	108.7	Y1754 A1755 W1785 V1787 W1791 A1796 P1800 I1969	Y1754-M1765 WeakPolarHBondContact O-CA 3.49Å; A1755-M1765 HydrophobicContact CB-CB 4.32Å; M1765-W1785 HydrophobicContact CE-CB 3.93Å; M1765-W1785 HydrophobicContact CE-CG 4.48Å; M1765-W1785 HydrophobicContact CG-CB 4.09Å; M1765-W1785 PolarHBondContact N-O 2.87Å; M1765-W1785 PolarHBondContact O-N 3.15Å; M1765-V1787 HydrophobicContact CB-CG2 4.16Å; M1765-V1787 HydrophobicContact CG-CG2 4.36Å; M1765-W1791 HydrophobicContact CE-CZ3 4.16Å; M1765-W1791 HydrophobicContact SD-CZ3 4.26Å; M1765-A1796 HydrophobicContact CB-CB 4.17Å; M1765-A1796 HydrophobicContact SD-CB 3.85Å; M1765-P1800 HydrophobicContact CB-CG 4.1Å; M1765-P1800 HydrophobicContact CG-CG 4.13Å; M1765-P1800 HydrophobicContact SD-CG 4.12Å; M1765-I1969 HydrophobicContact CE-CD1 3.63Å
1766	G	93.5	Very high	91.5	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	168.1	-173.5	0	0	0	0	0	115.6	Y1754 F1783	Y1754-G1766 WeakPolarHBondContact CD1-O 3.25Å; Y1754-G1766 PolarHBondContact N-O 2.98Å; Y1754-G1766 PolarHBondContact O-N 2.65Å; G1766-F1783 CarbonylContact C-O 3.57Å; G1766-F1783 VanDerWaalsContact CA-O 3.26Å; G1766-F1783 WeakPolarHBondContact CA-O 3.21Å
1767	L	92.9	Very high	91.4	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.01	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	145.7	173.4	-74.3	-176.8	0	0	0	111.5	M1752 E1753 F1783 W1785 P1800 V1801 T1804 F1951 W1958	M1752-L1767 CarbonylContact O-C 3.48Å; M1752-L1767 WeakPolarHBondContact O-CA 3.36Å; E1753-L1767 HydrophobicContact CB-CD2 4.32Å; L1767-F1783 HydrophobicContact CB-CB 4.26Å; L1767-F1783 PolarHBondContact N-O 3.3Å; L1767-F1783 WeakPolarHBondContact O-CB 3.12Å; L1767-W1785 HydrophobicContact CD1-CH2 4.12Å; L1767-W1785 HydrophobicContact CD1-CZ3 4.48Å; L1767-W1785 HydrophobicContact CG-CH2 4.21Å; L1767-W1785 HydrophobicContact CG-CZ3 4.07Å; L1767-P1800 HydrophobicContact CD2-CB 3.71Å; L1767-P1800 HydrophobicContact CG-CB 3.96Å; L1767-V1801 HydrophobicContact CD2-CB 4.29Å; L1767-V1801 HydrophobicContact CD2-CG2 3.48Å; L1767-V1801 VanDerWaalsContact CD2-CG2 3.48Å; L1767-T1804 HydrophobicContact CD1-CG2 4.1Å; L1767-F1951 HydrophobicContact CB-CE1 4.05Å; L1767-F1951 HydrophobicContact CB-CZ 4Å; L1767-W1958 HydrophobicContact CD1-CH2 3.95Å; L1767-W1958 HydrophobicContact CD1-CZ3 3.97Å
1768	L	89.6	Confident	91.3	Very high	14 Å²	14	20.6 Å²	20.6	7%	0.073	12%	0.119	C	C	.	.			trans	-137.4	149.8	171.7	-68.2	166.4	0	0	0	109.4	M1752 Y1754 C1770 A1772 V1777 A1779 F1951	M1752-L1768 WeakPolarHBondContact CA-O 3.5Å; M1752-L1768 PolarHBondContact O-N 3.34Å; Y1754-L1768 HydrophobicContact CD1-CD1 3.88Å; Y1754-L1768 HydrophobicContact CD1-CG 4.27Å; Y1754-L1768 HydrophobicContact CE1-CD1 3.91Å; Y1754-L1768 HydrophobicContact CE1-CG 4Å; L1768-C1770 WeakPolarHBondContact CB-O 3.43Å; L1768-C1770 PolarHBondContact O-N 2.87Å; L1768-A1772 HydrophobicContact CB-CB 4.47Å; L1768-A1772 HydrophobicContact CD1-CB 3.99Å; L1768-V1777 HydrophobicContact CD1-CB 3.7Å; L1768-V1777 HydrophobicContact CD1-CG1 3.73Å; L1768-V1777 HydrophobicContact CD1-CG2 4.05Å; L1768-A1779 HydrophobicContact CD2-CB 4.03Å; L1768-F1951 WeakPolarHBondContact O-CZ 3.38Å
1769	P	83.7	Confident	91.1	Very high	40 Å²	40	19.7 Å²	19.7	26%	0.26	11%	0.114	S	C	.	.	S	Bend	trans	-67.9	-26	173.3	28.5	-35	0	0	0	112.1	R1725 F1743 F1951	R1725-P1769 PolarHBondContact NH1-O 3.29Å; R1725-P1769 PolarHBondContact NH2-O 3.01Å; F1743-P1769 HydrophobicContact CE1-CB 4.04Å; F1743-P1769 HydrophobicContact CZ-CB 4.23Å; P1769-F1951 HydrophobicContact CB-CB 4.49Å; P1769-F1951 HydrophobicContact CB-CD1 4.43Å; P1769-F1951 HydrophobicContact CB-CD2 3.89Å; P1769-F1951 HydrophobicContact CB-CE2 4.18Å; P1769-F1951 HydrophobicContact CB-CG 4.04Å
1770	C	86.7	Confident	91.2	Very high	5 Å²	5	17.4 Å²	17.4	3%	0.034	10%	0.097	C	C	.	.	S	Bend	trans	-164.4	174.4	175.5	59.8	0	0	0	0	111.8	G1751 L1768 A1772	G1751-C1770 CarbonylContact O-C 3.59Å; G1751-C1770 VanDerWaalsContact O-CA 3.32Å; G1751-C1770 WeakPolarHBondContact O-CA 3.41Å; L1768-C1770 WeakPolarHBondContact CB-O 3.43Å; L1768-C1770 PolarHBondContact O-N 2.87Å; C1770-A1772 VanDerWaalsContact C-N 3.34Å; C1770-A1772 PolarHBondContact O-N 3.27Å
1771	Q	88.7	Confident	91.1	Very high	28 Å²	28	15.4 Å²	15.4	13%	0.131	9%	0.085	C	C	.	.			trans	68.6	18.1	172.3	-53.3	-179.8	-71.4	0	0	115.7	C1748 L1750 G1751 M1773 A1774 V1777	C1748-Q1771 HydrophobicContact CB-CG 4.15Å; C1748-Q1771 VanDerWaalsContact O-CG 3.23Å; C1748-Q1771 WeakPolarHBondContact O-CG 3.42Å; L1750-Q1771 VanDerWaalsContact O-CA 3.31Å; L1750-Q1771 WeakPolarHBondContact O-CA 3.38Å; L1750-Q1771 PolarHBondContact O-N 2.95Å; G1751-Q1771 PolarHBondContact O-N 3.23Å; Q1771-M1773 VanDerWaalsContact C-N 3.31Å; Q1771-M1773 PolarHBondContact O-N 3.09Å; Q1771-A1774 WeakPolarHBondContact O-CB 3.37Å; Q1771-V1777 WeakPolarHBondContact O-CG1 3.23Å
1772	A	90.6	Very high	91.1	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.102	C	C	.	.			trans	-70.3	-24.2	178.3	0	0	0	0	0	114.1	A1720 G1751 E1753 Y1754 L1768 C1770 A1774	A1720-A1772 WeakPolarHBondContact CB-O 3.48Å; G1751-A1772 VanDerWaalsContact C-CB 3.41Å; G1751-A1772 WeakPolarHBondContact O-CB 3.43Å; G1751-A1772 PolarHBondContact O-N 3.06Å; E1753-A1772 VanDerWaalsContact N-CB 3.35Å; Y1754-A1772 HydrophobicContact CD1-CB 4.47Å; L1768-A1772 HydrophobicContact CB-CB 4.47Å; L1768-A1772 HydrophobicContact CD1-CB 3.99Å; C1770-A1772 VanDerWaalsContact C-N 3.34Å; C1770-A1772 PolarHBondContact O-N 3.27Å; A1772-A1774 VanDerWaalsContact C-N 3.26Å; A1772-A1774 PolarHBondContact O-N 2.96Å
1773	M	93	Very high	91	Very high	1 Å²	1	17 Å²	17	1%	0.005	10%	0.095	C	C	.	.	S	Bend	trans	-80.9	74.6	173.3	-71	-174.9	-61.4	0	0	110.1	F1683 I1684 A1720 I1722 D1726 L1750 Q1771 F1991 L2005	F1683-M1773 WeakPolarHBondContact CA-O 3.36Å; I1684-M1773 HydrophobicContact CB-CB 4.18Å; I1684-M1773 HydrophobicContact CD1-CB 4.26Å; I1684-M1773 PolarHBondContact N-O 2.85Å; A1720-M1773 HydrophobicContact CB-CB 4.31Å; A1720-M1773 HydrophobicContact CB-CG 3.8Å; I1722-M1773 HydrophobicContact CG1-SD 4.02Å; D1726-M1773 HydrophobicContact CB-CE 4.32Å; L1750-M1773 HydrophobicContact CB-CE 3.58Å; Q1771-M1773 VanDerWaalsContact C-N 3.31Å; Q1771-M1773 PolarHBondContact O-N 3.09Å; M1773-F1991 HydrophobicContact CE-CE2 4.06Å; M1773-F1991 HydrophobicContact CE-CZ 3.75Å; M1773-F1991 HydrophobicContact SD-CE2 4.17Å; M1773-F1991 HydrophobicContact SD-CZ 4.42Å; M1773-L2005 HydrophobicContact CG-CD1 4.21Å; M1773-L2005 HydrophobicContact SD-CD1 3.71Å
1774	A	93.8	Very high	90.9	Very high	2 Å²	2	17.1 Å²	17.1	2%	0.017	10%	0.096	C	C	.	.	B	Isolated β-bridge	trans	-142.9	166.6	-173.8	0	0	0	0	0	112.2	A1682 F1683 V1717 Q1771 A1772 V1777	A1682-A1774 CarbonylContact O-C 3.55Å; A1682-A1774 VanDerWaalsContact O-CA 3.31Å; A1682-A1774 WeakPolarHBondContact O-CA 3.45Å; A1682-A1774 VanDerWaalsContact O-CB 3.29Å; A1682-A1774 WeakPolarHBondContact O-CB 3.16Å; F1683-A1774 HydrophobicContact CB-CB 3.91Å; V1717-A1774 VanDerWaalsContact CB-O 3.25Å; V1717-A1774 WeakPolarHBondContact CB-O 2.97Å; Q1771-A1774 WeakPolarHBondContact O-CB 3.37Å; A1772-A1774 VanDerWaalsContact C-N 3.26Å; A1772-A1774 PolarHBondContact O-N 2.96Å; A1774-V1777 HydrophobicContact CB-CG1 3.93Å
1775	T	93.9	Very high	90.8	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	-76.5	-32.3	168.3	58.9	0	0	0	0	111.8	E1680 H1681 A1682 W1697 V1717 I2007 R2008 L2021 V2023	E1680-T1775 WeakPolarHBondContact O-CB 3.21Å; E1680-T1775 PolarHBondContact O-OG1 2.79Å; H1681-T1775 WeakPolarHBondContact CA-OG1 3.25Å; A1682-T1775 HydrophobicContact CB-CG2 4.39Å; A1682-T1775 PolarHBondContact N-OG1 2.77Å; A1682-T1775 PolarHBondContact O-N 3.11Å; A1682-T1775 PolarHBondContact O-OG1 2.84Å; W1697-T1775 HydrophobicContact CE3-CG2 4.48Å; W1697-T1775 HydrophobicContact CH2-CG2 3.91Å; W1697-T1775 HydrophobicContact CZ3-CG2 3.77Å; V1717-T1775 PolarHBondContact N-O 3.36Å; T1775-I2007 HydrophobicContact CG2-CG2 4.3Å; T1775-R2008 PolarHBondContact O-NH1 3.11Å; T1775-L2021 HydrophobicContact CG2-CD2 4.07Å; T1775-V2023 HydrophobicContact CG2-CG1 4.02Å; T1775-V2023 HydrophobicContact CG2-CG2 3.8Å
1776	T	94.2	Very high	90.7	Very high	4 Å²	4	24 Å²	24	3%	0.025	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	136.3	179.3	58.2	0	0	0	0	110.3	H1681 N1702 C1715	H1681-T1776 PolarHBondContact ND1-OG1 2.78Å; N1702-T1776 PolarHBondContact ND2-O 2.86Å; C1715-T1776 CarbonylContact O-C 3.59Å; C1715-T1776 VanDerWaalsContact O-CA 3.29Å; C1715-T1776 WeakPolarHBondContact O-CA 3.48Å
1777	V	92.8	Very high	90.7	Very high	3 Å²	3	24.3 Å²	24.3	2%	0.018	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	151.1	179.6	-64	0	0	0	0	111.1	L1714 C1715 V1717 Y1754 L1768 Q1771 A1774	L1714-V1777 CarbonylContact C-O 3.59Å; L1714-V1777 WeakPolarHBondContact CA-O 3.3Å; C1715-V1777 HydrophobicContact CB-CG2 3.94Å; C1715-V1777 PolarHBondContact N-O 3.45Å; C1715-V1777 PolarHBondContact O-N 3.08Å; V1717-V1777 HydrophobicContact CG2-CB 4.42Å; V1717-V1777 HydrophobicContact CG2-CG1 3.78Å; V1717-V1777 HydrophobicContact CG2-CG2 3.92Å; Y1754-V1777 HydrophobicContact CD1-CG2 4.3Å; Y1754-V1777 HydrophobicContact CD2-CG2 4.18Å; Y1754-V1777 HydrophobicContact CE1-CG2 4.12Å; Y1754-V1777 HydrophobicContact CE2-CG2 4.01Å; Y1754-V1777 HydrophobicContact CG-CG2 4.34Å; L1768-V1777 HydrophobicContact CD1-CB 3.7Å; L1768-V1777 HydrophobicContact CD1-CG1 3.73Å; L1768-V1777 HydrophobicContact CD1-CG2 4.05Å; Q1771-V1777 WeakPolarHBondContact O-CG1 3.23Å; A1774-V1777 HydrophobicContact CB-CG1 3.93Å
1778	V	90.3	Very high	90.6	Very high	38 Å²	38	25.3 Å²	25.3	23%	0.23	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	115.3	166.9	179.8	0	0	0	0	106.9	W1705 R1712 E1713 L1714	W1705-V1778 HydrophobicContact CB-CG2 4.38Å; W1705-V1778 HydrophobicContact CD2-CG2 4.05Å; W1705-V1778 HydrophobicContact CG-CG2 3.78Å; W1705-V1778 HydrophobicContact CZ2-CG1 4.27Å; R1712-V1778 HydrophobicContact CB-CG1 4.27Å; E1713-V1778 WeakPolarHBondContact O-CA 3.42Å; L1714-V1778 HydrophobicContact CD1-CG2 3.93Å
1779	A	88.3	Confident	90.4	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.008	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	143.5	-172.1	0	0	0	0	0	111.4	R1712 E1713 Y1754 L1768 M1784	R1712-A1779 WeakPolarHBondContact CA-O 3.49Å; E1713-A1779 PolarHBondContact N-O 3.41Å; E1713-A1779 PolarHBondContact O-N 3.01Å; Y1754-A1779 HydrophobicContact CE1-CB 4.36Å; Y1754-A1779 VanDerWaalsContact OH-CB 3.23Å; Y1754-A1779 WeakPolarHBondContact OH-CB 3.33Å; L1768-A1779 HydrophobicContact CD2-CB 4.03Å; A1779-M1784 HydrophobicContact CB-CE 3.81Å
1780	D	88.1	Confident	90.7	Very high	39 Å²	39	35 Å²	35	21%	0.209	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	133.3	172.8	-169.6	-76.4	0	0	0	110.2	T1711 N1782 F1783	T1711-D1780 WeakPolarHBondContact CB-OD2 3.48Å; T1711-D1780 CarbonylContact O-C 3.5Å; T1711-D1780 WeakPolarHBondContact O-CA 3.14Å; T1711-D1780 PolarHBondContact OG1-OD2 2.92Å; D1780-N1782 PolarHBondContact O-N 3.14Å; D1780-N1782 VanDerWaalsContact O-N 3.14Å; D1780-N1782 WeakPolarHBondContact OD1-CB 3.42Å; D1780-N1782 PolarHBondContact OD1-N 2.93Å; D1780-N1782 PolarHBondContact OD1-ND2 2.94Å; D1780-F1783 HydrophobicContact CB-CD2 4.36Å; D1780-F1783 PolarHBondContact O-N 3.19Å
1781	T	87.7	Confident	91	Very high	63 Å²	63	35.6 Å²	35.6	39%	0.387	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-62	-22.2	-174.2	51.5	0	0	0	0	113.7	T1711 E1713 F1783 M1784	T1711-T1781 PolarHBondContact O-N 3.29Å; T1711-T1781 PolarHBondContact O-OG1 2.91Å; E1713-T1781 HydrophobicContact CG-CG2 4.26Å; T1781-F1783 PolarHBondContact O-N 2.84Å; T1781-M1784 HydrophobicContact CG2-CE 4.36Å; T1781-M1784 PolarHBondContact O-N 3.38Å
1782	N	87.7	Confident	91.1	Very high	65 Å²	65	39.6 Å²	39.6	35%	0.348	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-61.5	-34	173	-70.5	-79.7	0	0	0	112.4	D1780 W1958 K1962	D1780-N1782 PolarHBondContact O-N 3.14Å; D1780-N1782 VanDerWaalsContact O-N 3.14Å; D1780-N1782 WeakPolarHBondContact OD1-CB 3.42Å; D1780-N1782 PolarHBondContact OD1-N 2.93Å; D1780-N1782 PolarHBondContact OD1-ND2 2.94Å; N1782-W1958 WeakPolarHBondContact O-CZ2 3.46Å; N1782-K1962 WeakPolarHBondContact O-CE 3.48Å; N1782-K1962 PolarHBondContact O-NZ 2.84Å
1783	F	91.2	Very high	91.2	Very high	32 Å²	32	39.6 Å²	39.6	14%	0.14	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-96.5	15.4	-177.7	-63.7	-86	0	0	0	113.2	G1766 L1767 D1780 T1781 F1951 W1958	G1766-F1783 CarbonylContact C-O 3.57Å; G1766-F1783 VanDerWaalsContact CA-O 3.26Å; G1766-F1783 WeakPolarHBondContact CA-O 3.21Å; L1767-F1783 HydrophobicContact CB-CB 4.26Å; L1767-F1783 PolarHBondContact N-O 3.3Å; L1767-F1783 WeakPolarHBondContact O-CB 3.12Å; D1780-F1783 HydrophobicContact CB-CD2 4.36Å; D1780-F1783 PolarHBondContact O-N 3.19Å; T1781-F1783 PolarHBondContact O-N 2.84Å; F1783-F1951 AromaticContact CD1-CD1 3.65Å; F1783-F1951 HydrophobicContact CD1-CD1 3.65Å; F1783-F1951 AromaticContact CD1-CE1 3.53Å; F1783-F1951 HydrophobicContact CD1-CE1 3.53Å; F1783-F1951 HydrophobicContact CD2-CD1 4.43Å; F1783-F1951 AromaticContact CE1-CD1 3.45Å; F1783-F1951 HydrophobicContact CE1-CD1 3.45Å; F1783-F1951 VanDerWaalsContact CE1-CD1 3.45Å; F1783-F1951 AromaticContact CE1-CE1 3.79Å; F1783-F1951 HydrophobicContact CE1-CE1 3.79Å; F1783-F1951 HydrophobicContact CE1-CG 4.3Å; F1783-F1951 HydrophobicContact CE2-CD1 4.26Å; F1783-F1951 HydrophobicContact CG-CD1 4.16Å; F1783-F1951 HydrophobicContact CG-CE1 4.05Å; F1783-F1951 AromaticContact CZ-CD1 3.79Å; F1783-F1951 HydrophobicContact CZ-CD1 3.79Å; F1783-W1958 HydrophobicContact CB-CZ2 4.45Å; F1783-W1958 HydrophobicContact CD1-CD2 4.04Å; F1783-W1958 AromaticContact CD1-CE2 3.57Å; F1783-W1958 HydrophobicContact CD1-CE3 4.27Å; F1783-W1958 AromaticContact CD1-CH2 3.67Å; F1783-W1958 HydrophobicContact CD1-CH2 3.67Å; F1783-W1958 AromaticContact CD1-CZ2 3.41Å; F1783-W1958 HydrophobicContact CD1-CZ2 3.41Å; F1783-W1958 VanDerWaalsContact CD1-CZ2 3.41Å; F1783-W1958 HydrophobicContact CD1-CZ3 4.1Å; F1783-W1958 AromaticContact CE1-CD2 3.51Å; F1783-W1958 HydrophobicContact CE1-CD2 3.51Å; F1783-W1958 AromaticContact CE1-CE2 3.44Å; F1783-W1958 VanDerWaalsContact CE1-CE2 3.44Å; F1783-W1958 AromaticContact CE1-CE3 3.89Å; F1783-W1958 HydrophobicContact CE1-CE3 3.89Å; F1783-W1958 HydrophobicContact CE1-CG 4Å; F1783-W1958 HydrophobicContact CE1-CH2 4.13Å; F1783-W1958 AromaticContact CE1-CZ2 3.81Å; F1783-W1958 HydrophobicContact CE1-CZ2 3.81Å; F1783-W1958 HydrophobicContact CE1-CZ3 4.17Å; F1783-W1958 AromaticContact CE1-NE1 3.77Å; F1783-W1958 HydrophobicContact CG-CZ2 4.1Å; F1783-W1958 HydrophobicContact CZ-CD2 4.24Å; F1783-W1958 HydrophobicContact CZ-CG 4.28Å; F1783-W1958 AromaticContact CZ-NE1 3.99Å
1784	M	92.2	Very high	91.1	Very high	17 Å²	17	41.9 Å²	41.9	8%	0.084	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	152.9	-175.3	-159.6	-174	-58.6	0	0	111.8	L1758 V1764 A1779 T1781 K1962	L1758-M1784 HydrophobicContact CD1-SD 4.31Å; L1758-M1784 HydrophobicContact CD2-CE 4.21Å; L1758-M1784 HydrophobicContact CD2-SD 4.06Å; V1764-M1784 HydrophobicContact CB-CG 3.97Å; V1764-M1784 HydrophobicContact CB-SD 3.94Å; V1764-M1784 HydrophobicContact CG1-CG 4.3Å; V1764-M1784 HydrophobicContact CG1-SD 3.85Å; V1764-M1784 HydrophobicContact CG2-CG 4.43Å; V1764-M1784 HydrophobicContact CG2-SD 4.05Å; A1779-M1784 HydrophobicContact CB-CE 3.81Å; T1781-M1784 HydrophobicContact CG2-CE 4.36Å; T1781-M1784 PolarHBondContact O-N 3.38Å; M1784-K1962 PolarHBondContact O-NZ 2.74Å
1785	W	93.5	Very high	91.1	Very high	17 Å²	17	44.4 Å²	44.4	6%	0.064	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	153.8	174.1	-59.8	-90.9	0	0	0	111.1	V1764 M1765 L1767 P1800 T1804 W1958 K1962 L1965 D1966	V1764-W1785 CarbonylContact C-O 3.49Å; V1764-W1785 VanDerWaalsContact CA-O 3.23Å; V1764-W1785 WeakPolarHBondContact CA-O 3.23Å; V1764-W1785 WeakPolarHBondContact CB-O 3.33Å; M1765-W1785 HydrophobicContact CE-CB 3.93Å; M1765-W1785 HydrophobicContact CE-CG 4.48Å; M1765-W1785 HydrophobicContact CG-CB 4.09Å; M1765-W1785 PolarHBondContact N-O 2.87Å; M1765-W1785 PolarHBondContact O-N 3.15Å; L1767-W1785 HydrophobicContact CD1-CH2 4.12Å; L1767-W1785 HydrophobicContact CD1-CZ3 4.48Å; L1767-W1785 HydrophobicContact CG-CH2 4.21Å; L1767-W1785 HydrophobicContact CG-CZ3 4.07Å; W1785-P1800 HydrophobicContact CZ3-CB 4.02Å; W1785-P1800 HydrophobicContact CZ3-CG 4.4Å; W1785-T1804 HydrophobicContact CH2-CG2 3.98Å; W1785-T1804 HydrophobicContact CZ2-CG2 4.34Å; W1785-W1958 AromaticContact CH2-CH2 3.62Å; W1785-W1958 HydrophobicContact CH2-CH2 3.62Å; W1785-W1958 HydrophobicContact CH2-CZ2 4.3Å; W1785-W1958 AromaticContact CZ2-CH2 3.79Å; W1785-W1958 HydrophobicContact CZ2-CH2 3.79Å; W1785-W1958 HydrophobicContact CZ2-CZ2 4.19Å; W1785-K1962 HydrophobicContact CZ2-CG 4.16Å; W1785-L1965 HydrophobicContact CD2-CD2 4.08Å; W1785-L1965 HydrophobicContact CE3-CD2 4.42Å; W1785-L1965 HydrophobicContact CH2-CD2 3.74Å; W1785-L1965 HydrophobicContact CZ2-CD2 3.39Å; W1785-L1965 HydrophobicContact CZ3-CD2 4.27Å; W1785-D1966 PolarHBondContact NE1-OD1 3.37Å
1786	K	92.4	Very high	91.1	Very high	134 Å²	134	44.4 Å²	44.4	58%	0.583	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	137.8	170.9	-172.8	168.7	-174.6	149.7	0	110.3	E1762	E1762-K1786 WeakPolarHBondContact OE1-CD 3.27Å; E1762-K1786 WeakPolarHBondContact OE1-CE 3.12Å; E1762-K1786 IonicContact OE1-NZ 3.04Å; E1762-K1786 PolarHBondContact OE1-NZ 2.88Å
1787	V	92.9	Very high	91.1	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.03	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-75	126.7	173.5	179.6	0	0	0	0	109.3	R1763 M1765 W1791 A1796	R1763-V1787 HydrophobicContact CB-CB 4.02Å; R1763-V1787 HydrophobicContact CB-CG2 4.27Å; R1763-V1787 PolarHBondContact O-N 3.01Å; M1765-V1787 HydrophobicContact CB-CG2 4.16Å; M1765-V1787 HydrophobicContact CG-CG2 4.36Å; V1787-W1791 HydrophobicContact CG1-CB 4.14Å; V1787-A1796 HydrophobicContact CB-CB 4.38Å; V1787-A1796 HydrophobicContact CG1-CB 3.76Å; V1787-A1796 HydrophobicContact CG2-CB 3.73Å
1788	P	91.4	Very high	91.2	Very high	23 Å²	23	44 Å²	44	15%	0.149	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-54.7	141.2	174.7	-27.2	35.9	0	0	0	112.5	R1763 H1790 W1791 I1969	R1763-P1788 PolarHBondContact NH1-O 2.94Å; P1788-H1790 PolarHBondContact O-N 3.37Å; P1788-W1791 HydrophobicContact CB-CD2 4.17Å; P1788-W1791 HydrophobicContact CB-CG 4.13Å; P1788-W1791 HydrophobicContact CG-CD2 3.82Å; P1788-W1791 HydrophobicContact CG-CE3 3.94Å; P1788-W1791 HydrophobicContact CG-CG 4.3Å; P1788-W1791 HydrophobicContact CG-CH2 4.39Å; P1788-W1791 HydrophobicContact CG-CZ2 4.27Å; P1788-W1791 HydrophobicContact CG-CZ3 4.23Å; P1788-W1791 PolarHBondContact O-N 3.16Å; P1788-I1969 HydrophobicContact CG-CG2 3.81Å
1789	D	86.5	Confident	91.4	Very high	106 Å²	106	42.2 Å²	42.2	57%	0.567	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-19.4	-177	-100.6	-43.1	0	0	0	114.2	K2014	D1789-K2014 PolarHBondContact O-NZ 2.95Å; D1789-K2014 WeakPolarHBondContact OD1-CD 3.49Å; D1789-K2014 IonicContact OD1-NZ 2.85Å; D1789-K2014 PolarHBondContact OD1-NZ 3.06Å
1790	H	89.3	Confident	91.6	Very high	151 Å²	151	42.2 Å²	42.2	70%	0.699	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-1.6	179.7	68.1	-86.8	0	0	0	113.7	P1788	P1788-H1790 PolarHBondContact O-N 3.37Å
1791	W	92.5	Very high	91.9	Very high	19 Å²	19	40.9 Å²	40.9	7%	0.072	20%	0.198	C	C	.	.	S	Bend	trans	-101.4	148.7	171.8	-62.6	-0.4	0	0	0	110.6	R1763 M1765 V1787 P1788 E1795 A1796 V1799 I1969 V1974 P1976	R1763-W1791 PolarHBondContact NH1-O 3.09Å; R1763-W1791 PolarHBondContact NH2-O 3.27Å; M1765-W1791 HydrophobicContact CE-CZ3 4.16Å; M1765-W1791 HydrophobicContact SD-CZ3 4.26Å; V1787-W1791 HydrophobicContact CG1-CB 4.14Å; P1788-W1791 HydrophobicContact CB-CD2 4.17Å; P1788-W1791 HydrophobicContact CB-CG 4.13Å; P1788-W1791 HydrophobicContact CG-CD2 3.82Å; P1788-W1791 HydrophobicContact CG-CE3 3.94Å; P1788-W1791 HydrophobicContact CG-CG 4.3Å; P1788-W1791 HydrophobicContact CG-CH2 4.39Å; P1788-W1791 HydrophobicContact CG-CZ2 4.27Å; P1788-W1791 HydrophobicContact CG-CZ3 4.23Å; P1788-W1791 PolarHBondContact O-N 3.16Å; W1791-E1795 WeakPolarHBondContact CA-OE2 3.43Å; W1791-E1795 HydrophobicContact CB-CB 4.3Å; W1791-A1796 HydrophobicContact CE3-CB 4.28Å; W1791-V1799 HydrophobicContact CH2-CG2 4.12Å; W1791-V1799 HydrophobicContact CZ3-CB 4.37Å; W1791-V1799 HydrophobicContact CZ3-CG1 4.41Å; W1791-V1799 HydrophobicContact CZ3-CG2 3.92Å; W1791-I1969 HydrophobicContact CH2-CG1 4.08Å; W1791-I1969 HydrophobicContact CH2-CG2 4.24Å; W1791-I1969 HydrophobicContact CZ2-CG2 4.34Å; W1791-V1974 HydrophobicContact CH2-CG1 4.21Å; W1791-P1976 HydrophobicContact CD2-CG 3.74Å; W1791-P1976 HydrophobicContact CE3-CG 4.14Å; W1791-P1976 HydrophobicContact CG-CG 4.03Å; W1791-P1976 HydrophobicContact CZ2-CG 4.27Å
1792	K	91.5	Very high	92.1	Very high	111 Å²	111	38 Å²	38	48%	0.483	18%	0.18	S	C	.	.			trans	-80	160.4	164	-67.3	-68.8	-174.1	169.5	0	111.3	H1794 E1795 A1796 E2010	K1792-H1794 VanDerWaalsContact C-N 3.3Å; K1792-H1794 PolarHBondContact O-N 3.48Å; K1792-E1795 PolarHBondContact N-OE2 2.89Å; K1792-E1795 WeakPolarHBondContact O-CB 3.3Å; K1792-E1795 PolarHBondContact O-N 2.9Å; K1792-E1795 VanDerWaalsContact O-N 3.14Å; K1792-A1796 PolarHBondContact O-N 2.86Å; K1792-A1796 VanDerWaalsContact O-N 3.12Å; K1792-E2010 WeakPolarHBondContact CA-OE2 3.47Å; K1792-E2010 WeakPolarHBondContact CD-OE2 3.37Å
1793	M	91.7	Very high	92.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-66.8	-29.9	178.8	-87.3	-170.7	-75.8	0	0	112.6	Y1718 Y1719 A1755 G1756 R1757 R1763 E1795 A1796 A1797 E2010	Y1718-M1793 HydrophobicContact CD1-CE 3.53Å; Y1718-M1793 HydrophobicContact CD1-SD 4.41Å; Y1718-M1793 HydrophobicContact CD2-CE 4.03Å; Y1718-M1793 HydrophobicContact CD2-SD 4.06Å; Y1718-M1793 HydrophobicContact CE1-CE 3.84Å; Y1718-M1793 HydrophobicContact CE2-CE 4.31Å; Y1718-M1793 HydrophobicContact CG-CE 3.63Å; Y1718-M1793 HydrophobicContact CG-SD 3.9Å; Y1719-M1793 HydrophobicContact CD2-CB 3.87Å; Y1719-M1793 HydrophobicContact CE2-CB 4.09Å; A1755-M1793 HydrophobicContact CB-CB 4.28Å; A1755-M1793 HydrophobicContact CB-CG 4.41Å; A1755-M1793 VanDerWaalsContact CB-O 3.26Å; A1755-M1793 WeakPolarHBondContact CB-O 3.03Å; G1756-M1793 VanDerWaalsContact CA-SD 3.55Å; R1757-M1793 HydrophobicContact CG-CE 4.19Å; R1757-M1793 HydrophobicContact CG-SD 4.34Å; R1763-M1793 HydrophobicContact CG-CE 4.45Å; R1763-M1793 HydrophobicContact CG-SD 4.41Å; M1793-E1795 VanDerWaalsContact C-N 3.3Å; M1793-E1795 PolarHBondContact O-N 2.79Å; M1793-A1796 PolarHBondContact O-N 3.19Å; M1793-A1797 PolarHBondContact O-N 3.04Å; M1793-A1797 VanDerWaalsContact O-N 3.13Å; M1793-E2010 HydrophobicContact CE-CB 4.05Å; M1793-E2010 HydrophobicContact CE-CG 3.65Å; M1793-E2010 VanDerWaalsContact CE-OE1 3.29Å; M1793-E2010 WeakPolarHBondContact CE-OE1 3.24Å; M1793-E2010 VanDerWaalsContact CG-OE1 3.29Å; M1793-E2010 WeakPolarHBondContact CG-OE1 3.45Å; M1793-E2010 PolarHBondContact N-OE1 3.38Å; M1793-E2010 PolarHBondContact N-OE2 3.37Å
1794	H	92.2	Very high	92.6	Very high	49 Å²	49	33.4 Å²	33.4	23%	0.227	16%	0.157	C	C	.	.	H	α-helix	trans	-66.1	-31.9	172.3	60.5	43.5	0	0	0	112.9	Y1719 K1792 M1979 I1981 L2004	Y1719-H1794 HydrophobicContact CD1-CB 3.82Å; Y1719-H1794 HydrophobicContact CD2-CB 4.12Å; Y1719-H1794 HydrophobicContact CE1-CB 3.64Å; Y1719-H1794 HydrophobicContact CE2-CB 3.98Å; Y1719-H1794 HydrophobicContact CG-CB 4.05Å; K1792-H1794 VanDerWaalsContact C-N 3.3Å; K1792-H1794 PolarHBondContact O-N 3.48Å; H1794-M1979 HydrophobicContact CB-SD 4.08Å; H1794-I1981 HydrophobicContact CB-CD1 3.96Å; H1794-L2004 HydrophobicContact CB-CD1 4.28Å; H1794-L2004 VanDerWaalsContact O-CD1 3.22Å; H1794-L2004 WeakPolarHBondContact O-CD1 3.35Å
1795	E	93.9	Very high	92.6	Very high	55 Å²	55	33.3 Å²	33.3	26%	0.257	16%	0.157	S	C	.	.	H	α-helix	trans	-71.2	-46.1	177.6	-86.1	159.5	-178.3	0	0	110.6	W1791 K1792 M1793 A1797 T1798 P1976 M1979	W1791-E1795 WeakPolarHBondContact CA-OE2 3.43Å; W1791-E1795 HydrophobicContact CB-CB 4.3Å; K1792-E1795 PolarHBondContact N-OE2 2.89Å; K1792-E1795 WeakPolarHBondContact O-CB 3.3Å; K1792-E1795 PolarHBondContact O-N 2.9Å; K1792-E1795 VanDerWaalsContact O-N 3.14Å; M1793-E1795 VanDerWaalsContact C-N 3.3Å; M1793-E1795 PolarHBondContact O-N 2.79Å; E1795-A1797 VanDerWaalsContact C-N 3.28Å; E1795-A1797 PolarHBondContact O-N 3.31Å; E1795-T1798 PolarHBondContact O-N 2.98Å; E1795-T1798 VanDerWaalsContact O-N 3.14Å; E1795-T1798 PolarHBondContact O-OG1 3.36Å; E1795-P1976 HydrophobicContact CB-CB 3.58Å; E1795-P1976 HydrophobicContact CB-CG 3.62Å; E1795-P1976 HydrophobicContact CG-CB 3.69Å; E1795-P1976 HydrophobicContact CG-CG 3.98Å; E1795-M1979 HydrophobicContact CG-CE 3.92Å
1796	A	93.5	Very high	92.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.7	-37.1	176.1	0	0	0	0	0	112.9	A1755 M1765 V1787 W1791 K1792 M1793 T1798 V1799 P1800	A1755-A1796 HydrophobicContact CB-CB 4.16Å; M1765-A1796 HydrophobicContact CB-CB 4.17Å; M1765-A1796 HydrophobicContact SD-CB 3.85Å; V1787-A1796 HydrophobicContact CB-CB 4.38Å; V1787-A1796 HydrophobicContact CG1-CB 3.76Å; V1787-A1796 HydrophobicContact CG2-CB 3.73Å; W1791-A1796 HydrophobicContact CE3-CB 4.28Å; K1792-A1796 PolarHBondContact O-N 2.86Å; K1792-A1796 VanDerWaalsContact O-N 3.12Å; M1793-A1796 PolarHBondContact O-N 3.19Å; A1796-T1798 PolarHBondContact O-N 3.03Å; A1796-V1799 PolarHBondContact O-N 2.82Å; A1796-P1800 WeakPolarHBondContact O-CD 3.46Å
1797	A	93.8	Very high	92.7	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-0.5	177.8	0	0	0	0	0	115	A1755 M1793 E1795 L2004	A1755-A1797 HydrophobicContact CB-CB 3.91Å; M1793-A1797 PolarHBondContact O-N 3.04Å; M1793-A1797 VanDerWaalsContact O-N 3.13Å; E1795-A1797 VanDerWaalsContact C-N 3.28Å; E1795-A1797 PolarHBondContact O-N 3.31Å; A1797-L2004 HydrophobicContact CB-CD1 4.43Å; A1797-L2004 HydrophobicContact CB-CD2 3.86Å; A1797-L2004 WeakPolarHBondContact O-CD2 3.39Å
1798	T	94.5	Very high	92.8	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-5.4	176.4	68.9	0	0	0	0	114.5	E1795 A1796 V1802 L1977 M1979 K2002 L2004	E1795-T1798 PolarHBondContact O-N 2.98Å; E1795-T1798 VanDerWaalsContact O-N 3.14Å; E1795-T1798 PolarHBondContact O-OG1 3.36Å; A1796-T1798 PolarHBondContact O-N 3.03Å; T1798-V1802 WeakPolarHBondContact O-CG2 3.49Å; T1798-L1977 PolarHBondContact OG1-N 3.33Å; T1798-M1979 HydrophobicContact CG2-CB 4.02Å; T1798-M1979 HydrophobicContact CG2-SD 4.26Å; T1798-K2002 HydrophobicContact CG2-CB 3.98Å; T1798-K2002 HydrophobicContact CG2-CG 4.47Å; T1798-L2004 HydrophobicContact CG2-CD1 3.96Å; T1798-L2004 HydrophobicContact CG2-CD2 4.37Å; T1798-L2004 HydrophobicContact CG2-CG 4.47Å
1799	V	94.8	Very high	92.9	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.12	C	C	.	.	S	Bend	trans	-102.9	-53.7	-165	167.8	0	0	0	0	114.9	W1791 A1796 V1802 F1803 L1965 V1974	W1791-V1799 HydrophobicContact CH2-CG2 4.12Å; W1791-V1799 HydrophobicContact CZ3-CB 4.37Å; W1791-V1799 HydrophobicContact CZ3-CG1 4.41Å; W1791-V1799 HydrophobicContact CZ3-CG2 3.92Å; A1796-V1799 PolarHBondContact O-N 2.82Å; V1799-V1802 PolarHBondContact O-N 2.65Å; V1799-V1802 VanDerWaalsContact O-N 3.15Å; V1799-F1803 HydrophobicContact CB-CD2 4.34Å; V1799-F1803 HydrophobicContact CG1-CD2 3.96Å; V1799-F1803 HydrophobicContact CG2-CD2 4.31Å; V1799-F1803 HydrophobicContact CG2-CE2 4.3Å; V1799-F1803 PolarHBondContact O-N 2.75Å; V1799-L1965 HydrophobicContact CG1-CD1 4.14Å; V1799-V1974 HydrophobicContact CG1-CG1 3.42Å; V1799-V1974 VanDerWaalsContact CG1-CG1 3.42Å; V1799-V1974 HydrophobicContact CG2-CG1 4.3Å
1800	P	93.3	Very high	93.3	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-45.5	-65.8	-170.7	-32.9	36	0	0	0	117.4	E1753 M1765 L1767 W1785 A1796 V1802 T1804	E1753-P1800 HydrophobicContact CG-CB 4.11Å; E1753-P1800 HydrophobicContact CG-CG 4.24Å; E1753-P1800 WeakPolarHBondContact OE1-CA 3.43Å; E1753-P1800 WeakPolarHBondContact OE1-CB 3.4Å; E1753-P1800 WeakPolarHBondContact OE1-CD 3.49Å; M1765-P1800 HydrophobicContact CB-CG 4.1Å; M1765-P1800 HydrophobicContact CG-CG 4.13Å; M1765-P1800 HydrophobicContact SD-CG 4.12Å; L1767-P1800 HydrophobicContact CD2-CB 3.71Å; L1767-P1800 HydrophobicContact CG-CB 3.96Å; W1785-P1800 HydrophobicContact CZ3-CB 4.02Å; W1785-P1800 HydrophobicContact CZ3-CG 4.4Å; A1796-P1800 WeakPolarHBondContact O-CD 3.46Å; P1800-V1802 PolarHBondContact O-N 3.23Å; P1800-T1804 VanDerWaalsContact O-CB 3.31Å; P1800-T1804 WeakPolarHBondContact O-CB 3.45Å; P1800-T1804 WeakPolarHBondContact O-CG2 3.41Å; P1800-T1804 PolarHBondContact O-N 3.02Å; P1800-T1804 PolarHBondContact O-OG1 3.31Å
1801	V	92.9	Very high	93.5	Very high	12 Å²	12	14.4 Å²	14.4	7%	0.073	7%	0.068	C	C	.	.	H	α-helix	trans	-60.6	-39.4	-179.4	160.8	0	0	0	0	109.9	M1752 E1753 L1767 T1804 T1805 L1947	M1752-V1801 HydrophobicContact CB-CG2 3.87Å; E1753-V1801 HydrophobicContact CB-CB 4.41Å; E1753-V1801 HydrophobicContact CB-CG2 3.72Å; E1753-V1801 PolarHBondContact OE1-N 2.82Å; L1767-V1801 HydrophobicContact CD2-CB 4.29Å; L1767-V1801 HydrophobicContact CD2-CG2 3.48Å; L1767-V1801 VanDerWaalsContact CD2-CG2 3.48Å; V1801-T1804 PolarHBondContact O-OG1 3.46Å; V1801-T1805 VanDerWaalsContact O-CB 3.24Å; V1801-T1805 WeakPolarHBondContact O-CB 3.46Å; V1801-T1805 PolarHBondContact O-N 2.67Å; V1801-T1805 PolarHBondContact O-OG1 2.85Å; V1801-L1947 HydrophobicContact CG1-CD2 4.4Å; V1801-L1947 HydrophobicContact CG2-CD2 4.43Å
1802	V	93.4	Very high	93.5	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.006	7%	0.069	C	C	.	.	H	α-helix	trans	-75.7	-47	-161.4	-164.3	0	0	0	0	111.4	T1798 V1799 P1800 A1806 G1830 V1831 A1834 L1977 K2002	T1798-V1802 WeakPolarHBondContact O-CG2 3.49Å; V1799-V1802 PolarHBondContact O-N 2.65Å; V1799-V1802 VanDerWaalsContact O-N 3.15Å; P1800-V1802 PolarHBondContact O-N 3.23Å; V1802-A1806 WeakPolarHBondContact O-CB 3.36Å; V1802-A1806 PolarHBondContact O-N 3.16Å; V1802-G1830 WeakPolarHBondContact CG1-O 3.45Å; V1802-V1831 HydrophobicContact CG1-CB 4.41Å; V1802-V1831 HydrophobicContact CG1-CG2 4.03Å; V1802-V1831 VanDerWaalsContact CG1-N 3.29Å; V1802-A1834 HydrophobicContact CG1-CB 3.94Å; V1802-L1977 HydrophobicContact CB-CD1 4.11Å; V1802-L1977 HydrophobicContact CG1-CD1 3.56Å; V1802-L1977 HydrophobicContact CG2-CD1 4.42Å; V1802-K2002 HydrophobicContact CG2-CD 4.44Å; V1802-K2002 VanDerWaalsContact CG2-CE 3.42Å; V1802-K2002 HydrophobicContact CG2-CG 4.19Å
1803	F	94.2	Very high	93.5	Very high	1 Å²	1	13 Å²	13	0%	0.004	6%	0.061	C	C	.	.	H	α-helix	trans	-80	-33.5	176.4	-78.1	-91.8	0	0	0	112.7	V1799 T1805 A1806 F1807 A1834 I1838 L1965 V1974 K1975 L1977	V1799-F1803 HydrophobicContact CB-CD2 4.34Å; V1799-F1803 HydrophobicContact CG1-CD2 3.96Å; V1799-F1803 HydrophobicContact CG2-CD2 4.31Å; V1799-F1803 HydrophobicContact CG2-CE2 4.3Å; V1799-F1803 PolarHBondContact O-N 2.75Å; F1803-T1805 PolarHBondContact O-N 2.76Å; F1803-A1806 PolarHBondContact O-N 2.89Å; F1803-F1807 HydrophobicContact CB-CD2 4.28Å; F1803-F1807 HydrophobicContact CB-CE2 4.25Å; F1803-F1807 HydrophobicContact CD1-CE2 4.3Å; F1803-F1807 WeakPolarHBondContact O-CB 3.45Å; F1803-F1807 WeakPolarHBondContact O-CD2 3.41Å; F1803-F1807 PolarHBondContact O-N 3.45Å; F1803-A1834 HydrophobicContact CD1-CB 3.82Å; F1803-A1834 HydrophobicContact CD2-CB 4.03Å; F1803-A1834 HydrophobicContact CE1-CB 3.79Å; F1803-A1834 HydrophobicContact CE2-CB 4.01Å; F1803-A1834 HydrophobicContact CG-CB 3.95Å; F1803-A1834 HydrophobicContact CZ-CB 3.89Å; F1803-I1838 HydrophobicContact CD1-CD1 4.24Å; F1803-L1965 HydrophobicContact CB-CD1 3.38Å; F1803-L1965 HydrophobicContact CG-CD1 4.33Å; F1803-V1974 HydrophobicContact CB-CG1 4.45Å; F1803-V1974 HydrophobicContact CD1-CB 4.26Å; F1803-V1974 HydrophobicContact CD1-CG1 4.06Å; F1803-V1974 HydrophobicContact CD1-CG2 3.75Å; F1803-V1974 HydrophobicContact CD2-CG1 3.87Å; F1803-V1974 HydrophobicContact CE1-CB 4.27Å; F1803-V1974 HydrophobicContact CE1-CG1 4.23Å; F1803-V1974 HydrophobicContact CE1-CG2 4.12Å; F1803-V1974 HydrophobicContact CE2-CG1 4.04Å; F1803-V1974 HydrophobicContact CG-CG1 3.87Å; F1803-V1974 HydrophobicContact CG-CG2 4.2Å; F1803-V1974 HydrophobicContact CZ-CG1 4.22Å; F1803-K1975 WeakPolarHBondContact CE2-O 3.47Å; F1803-L1977 HydrophobicContact CE2-CD1 4.31Å; F1803-L1977 HydrophobicContact CE2-CD2 3.99Å; F1803-L1977 HydrophobicContact CE2-CG 4.14Å; F1803-L1977 HydrophobicContact CZ-CD2 4.18Å
1804	T	93.9	Very high	93.5	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-63.1	-42.6	173.9	55.3	0	0	0	0	111.7	L1767 W1785 P1800 V1801 A1806 Y1808 W1958 V1961 L1965	L1767-T1804 HydrophobicContact CD1-CG2 4.1Å; W1785-T1804 HydrophobicContact CH2-CG2 3.98Å; W1785-T1804 HydrophobicContact CZ2-CG2 4.34Å; P1800-T1804 VanDerWaalsContact O-CB 3.31Å; P1800-T1804 WeakPolarHBondContact O-CB 3.45Å; P1800-T1804 WeakPolarHBondContact O-CG2 3.41Å; P1800-T1804 PolarHBondContact O-N 3.02Å; P1800-T1804 PolarHBondContact O-OG1 3.31Å; V1801-T1804 PolarHBondContact O-OG1 3.46Å; T1804-A1806 PolarHBondContact O-N 3.17Å; T1804-Y1808 WeakPolarHBondContact O-CB 3.37Å; T1804-Y1808 PolarHBondContact O-N 3.11Å; T1804-W1958 HydrophobicContact CG2-CZ3 4.31Å; T1804-V1961 HydrophobicContact CG2-CG1 3.79Å; T1804-L1965 HydrophobicContact CG2-CD2 4.14Å
1805	T	92.8	Very high	93.6	Very high	15 Å²	15	19.6 Å²	19.6	9%	0.092	8%	0.084	C	C	.	.	H	α-helix	trans	-59.3	-46.9	172.8	-56.9	0	0	0	0	111.4	V1801 F1803 Y1808 A1809 V1831 I1920	V1801-T1805 VanDerWaalsContact O-CB 3.24Å; V1801-T1805 WeakPolarHBondContact O-CB 3.46Å; V1801-T1805 PolarHBondContact O-N 2.67Å; V1801-T1805 PolarHBondContact O-OG1 2.85Å; F1803-T1805 PolarHBondContact O-N 2.76Å; T1805-Y1808 PolarHBondContact O-N 2.97Å; T1805-A1809 VanDerWaalsContact O-CB 3.23Å; T1805-A1809 WeakPolarHBondContact O-CB 3.33Å; T1805-A1809 PolarHBondContact O-N 2.91Å; T1805-V1831 HydrophobicContact CG2-CG1 3.97Å; T1805-V1831 HydrophobicContact CG2-CG2 4.49Å; T1805-I1920 HydrophobicContact CG2-CG2 4.04Å
1806	A	93.7	Very high	93.6	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-68.8	-39.8	-177.5	0	0	0	0	0	113.2	V1802 F1803 T1804 L1810 A1834 A1835 I1838	V1802-A1806 WeakPolarHBondContact O-CB 3.36Å; V1802-A1806 PolarHBondContact O-N 3.16Å; F1803-A1806 PolarHBondContact O-N 2.89Å; T1804-A1806 PolarHBondContact O-N 3.17Å; A1806-L1810 WeakPolarHBondContact O-CB 3.14Å; A1806-L1810 PolarHBondContact O-N 3.46Å; A1806-A1834 HydrophobicContact CB-CB 3.96Å; A1806-A1835 HydrophobicContact CB-CB 4.29Å; A1806-I1838 HydrophobicContact CB-CD1 3.68Å
1807	F	95	Very high	93.5	Very high	5 Å²	5	25.4 Å²	25.4	2%	0.022	11%	0.105	C	C	.	.	H	α-helix	trans	-66.7	-43	173.1	-78.2	-56.9	0	0	0	112.2	F1803 V1811 V1812 I1838 L1964 L1965 L1973 V1974	F1803-F1807 HydrophobicContact CB-CD2 4.28Å; F1803-F1807 HydrophobicContact CB-CE2 4.25Å; F1803-F1807 HydrophobicContact CD1-CE2 4.3Å; F1803-F1807 WeakPolarHBondContact O-CB 3.45Å; F1803-F1807 WeakPolarHBondContact O-CD2 3.41Å; F1803-F1807 PolarHBondContact O-N 3.45Å; F1807-V1811 HydrophobicContact CD1-CG2 4.01Å; F1807-V1811 WeakPolarHBondContact O-CA 3.44Å; F1807-V1811 WeakPolarHBondContact O-CB 3.31Å; F1807-V1811 PolarHBondContact O-N 3.18Å; F1807-V1812 PolarHBondContact O-N 3.49Å; F1807-V1812 VanDerWaalsContact O-N 3.11Å; F1807-I1838 HydrophobicContact CD1-CD1 3.64Å; F1807-I1838 HydrophobicContact CD1-CG1 4.23Å; F1807-I1838 HydrophobicContact CD2-CD1 4.21Å; F1807-I1838 HydrophobicContact CE1-CD1 3.66Å; F1807-I1838 HydrophobicContact CE1-CG1 3.82Å; F1807-I1838 HydrophobicContact CE1-CG2 4.49Å; F1807-I1838 HydrophobicContact CE2-CD1 4.23Å; F1807-I1838 HydrophobicContact CG-CD1 3.91Å; F1807-I1838 HydrophobicContact CZ-CD1 3.97Å; F1807-I1838 HydrophobicContact CZ-CG1 4.16Å; F1807-L1964 HydrophobicContact CB-CB 4.23Å; F1807-L1964 HydrophobicContact CB-CD1 4.27Å; F1807-L1964 HydrophobicContact CD1-CB 4.02Å; F1807-L1964 HydrophobicContact CD1-CD1 4.48Å; F1807-L1964 HydrophobicContact CD1-CD2 4.48Å; F1807-L1964 HydrophobicContact CD2-CB 4.23Å; F1807-L1964 HydrophobicContact CE1-CB 4.42Å; F1807-L1964 HydrophobicContact CG-CB 3.93Å; F1807-L1965 HydrophobicContact CD2-CD1 4.34Å; F1807-L1965 HydrophobicContact CE2-CD1 4.09Å; F1807-L1973 HydrophobicContact CE1-CD2 4.21Å; F1807-L1973 HydrophobicContact CZ-CD2 4.1Å; F1807-V1974 HydrophobicContact CE2-CG2 3.76Å; F1807-V1974 HydrophobicContact CZ-CG2 4Å
1808	Y	94.5	Very high	93.3	Very high	7 Å²	7	33.9 Å²	33.9	3%	0.027	14%	0.142	C	C	.	.	I	π-helix	trans	-62.3	-47.5	177	-177.2	-132.4	0	0	0	111.2	T1804 T1805 V1812 R1813 I1945 L1950 E1957 V1961	T1804-Y1808 WeakPolarHBondContact O-CB 3.37Å; T1804-Y1808 PolarHBondContact O-N 3.11Å; T1805-Y1808 PolarHBondContact O-N 2.97Å; Y1808-V1812 HydrophobicContact CD2-CB 4.05Å; Y1808-V1812 HydrophobicContact CD2-CG1 4.16Å; Y1808-V1812 HydrophobicContact CE2-CG1 4.36Å; Y1808-R1813 HydrophobicContact CD2-CG 3.89Å; Y1808-R1813 HydrophobicContact CE1-CG 4.44Å; Y1808-R1813 HydrophobicContact CE2-CG 3.54Å; Y1808-R1813 HydrophobicContact CG-CG 4.44Å; Y1808-R1813 WeakPolarHBondContact O-CB 3.36Å; Y1808-R1813 WeakPolarHBondContact O-CG 3.39Å; Y1808-R1813 PolarHBondContact O-N 2.96Å; Y1808-R1813 PolarHBondContact OH-NE 3.37Å; Y1808-I1945 HydrophobicContact CD1-CG2 3.62Å; Y1808-I1945 HydrophobicContact CE1-CG2 3.93Å; Y1808-L1950 HydrophobicContact CD1-CD1 4.16Å; Y1808-L1950 HydrophobicContact CD2-CD1 4.15Å; Y1808-L1950 HydrophobicContact CE1-CD1 4.38Å; Y1808-L1950 HydrophobicContact CE1-CD2 4.48Å; Y1808-L1950 HydrophobicContact CE1-CG 4.47Å; Y1808-L1950 HydrophobicContact CE2-CD1 4.39Å; Y1808-L1950 HydrophobicContact CE2-CD2 4.03Å; Y1808-L1950 HydrophobicContact CG-CD1 4.05Å; Y1808-E1957 HydrophobicContact CE2-CB 4.28Å; Y1808-E1957 PolarHBondContact OH-OE2 2.89Å; Y1808-V1961 HydrophobicContact CD2-CG2 3.96Å; Y1808-V1961 HydrophobicContact CG-CG2 4.25Å
1809	A	93.8	Very high	93	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.17	C	C	.	.	I	π-helix	trans	-62.9	-61.3	177.3	0	0	0	0	0	112.5	T1805 G1814 L1896 L1918 I1945	T1805-A1809 VanDerWaalsContact O-CB 3.23Å; T1805-A1809 WeakPolarHBondContact O-CB 3.33Å; T1805-A1809 PolarHBondContact O-N 2.91Å; A1809-G1814 WeakPolarHBondContact O-CA 3.34Å; A1809-G1814 PolarHBondContact O-N 3.32Å; A1809-L1896 HydrophobicContact CB-CD1 3.87Å; A1809-L1918 HydrophobicContact CB-CD1 4.38Å; A1809-L1918 WeakPolarHBondContact O-CD1 3.19Å; A1809-I1945 HydrophobicContact CB-CG1 4.34Å; A1809-I1945 HydrophobicContact CB-CG2 4.11Å
1810	L	94.4	Very high	92.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	17%	0.174	C	C	.	.	I	π-helix	trans	-77.6	-44.3	-170	-63.9	178.4	0	0	0	113.2	A1806 G1814 R1815 I1816 A1835 I1838 L1918	A1806-L1810 WeakPolarHBondContact O-CB 3.14Å; A1806-L1810 PolarHBondContact O-N 3.46Å; L1810-G1814 CarbonylContact O-C 3.16Å; L1810-R1815 PolarHBondContact O-N 3.11Å; L1810-I1816 HydrophobicContact CB-CB 4.46Å; L1810-I1816 HydrophobicContact CB-CD1 4.4Å; L1810-I1816 HydrophobicContact CB-CG2 4.21Å; L1810-I1816 HydrophobicContact CD1-CD1 4.38Å; L1810-I1816 HydrophobicContact CD2-CD1 4.45Å; L1810-I1816 WeakPolarHBondContact O-CB 3.39Å; L1810-I1816 WeakPolarHBondContact O-CG2 3.4Å; L1810-I1816 PolarHBondContact O-N 2.94Å; L1810-A1835 HydrophobicContact CD1-CB 3.91Å; L1810-I1838 HydrophobicContact CB-CG2 4.44Å; L1810-I1838 HydrophobicContact CD1-CB 4.1Å; L1810-I1838 HydrophobicContact CD1-CG2 3.89Å; L1810-L1918 HydrophobicContact CD2-CD1 3.86Å
1811	V	93.4	Very high	93	Very high	27 Å²	27	39.7 Å²	39.7	16%	0.164	18%	0.183	C	C	.	.	I	π-helix	trans	-93.2	-50.5	-169.3	-175.4	0	0	0	0	111.6	F1807 R1815 I1816 I1838 Y1842 L1964	F1807-V1811 HydrophobicContact CD1-CG2 4.01Å; F1807-V1811 WeakPolarHBondContact O-CA 3.44Å; F1807-V1811 WeakPolarHBondContact O-CB 3.31Å; F1807-V1811 PolarHBondContact O-N 3.18Å; V1811-R1815 WeakPolarHBondContact O-CA 3.47Å; V1811-R1815 PolarHBondContact O-N 2.91Å; V1811-I1816 HydrophobicContact CG2-CG2 4.02Å; V1811-I1838 HydrophobicContact CG2-CG2 4.06Å; V1811-Y1842 HydrophobicContact CG2-CE2 4.31Å; V1811-L1964 HydrophobicContact CB-CD1 4.14Å; V1811-L1964 HydrophobicContact CG1-CD1 3.9Å; V1811-L1964 HydrophobicContact CG1-CD2 4.18Å
1812	V	92.8	Very high	93.2	Very high	15 Å²	15	39.1 Å²	39.1	9%	0.091	18%	0.18	C	C	.	.	I	π-helix	trans	-75.6	-54.5	-175.3	-177.3	0	0	0	0	111.5	F1807 Y1808 E1957 M1960 V1961 L1964	F1807-V1812 PolarHBondContact O-N 3.49Å; F1807-V1812 VanDerWaalsContact O-N 3.11Å; Y1808-V1812 HydrophobicContact CD2-CB 4.05Å; Y1808-V1812 HydrophobicContact CD2-CG1 4.16Å; Y1808-V1812 HydrophobicContact CE2-CG1 4.36Å; V1812-E1957 HydrophobicContact CG1-CG 4.39Å; V1812-M1960 HydrophobicContact CG1-CE 4.44Å; V1812-M1960 HydrophobicContact CG2-CB 4.46Å; V1812-V1961 HydrophobicContact CG2-CG2 3.91Å; V1812-L1964 HydrophobicContact CG2-CD1 3.85Å
1813	R	92	Very high	93.3	Very high	85 Å²	85	39.1 Å²	39.1	32%	0.321	18%	0.18	S	C	.	.	I	π-helix	trans	-87	-49.7	-175.3	-55.8	-68.9	-92.9	-154.7	-10.1	111.8	Y1808 I1945 E1957	Y1808-R1813 HydrophobicContact CD2-CG 3.89Å; Y1808-R1813 HydrophobicContact CE1-CG 4.44Å; Y1808-R1813 HydrophobicContact CE2-CG 3.54Å; Y1808-R1813 HydrophobicContact CG-CG 4.44Å; Y1808-R1813 WeakPolarHBondContact O-CB 3.36Å; Y1808-R1813 WeakPolarHBondContact O-CG 3.39Å; Y1808-R1813 PolarHBondContact O-N 2.96Å; Y1808-R1813 PolarHBondContact OH-NE 3.37Å; R1813-I1945 HydrophobicContact CB-CD1 3.73Å; R1813-I1945 HydrophobicContact CG-CD1 3.89Å; R1813-E1957 WeakPolarHBondContact CD-OE1 3.12Å; R1813-E1957 IonicContact CZ-OE1 3.82Å; R1813-E1957 IonicContact CZ-OE2 2.73Å; R1813-E1957 IonicContact NE-OE1 2.73Å; R1813-E1957 IonicContact NH1-OE1 2.63Å; R1813-E1957 PolarHBondContact NH1-OE1 3.31Å; R1813-E1957 IonicContact NH1-OE2 2.68Å; R1813-E1957 PolarHBondContact NH1-OE2 3.17Å
1814	G	91.2	Very high	93.4	Very high	1 Å²	1	39 Å²	39	1%	0.01	18%	0.179	C	C	.	.	S	Bend	trans	-76.7	-19.9	-179	0	0	0	0	0	115.8	A1809 L1810 I1816 R1916	A1809-G1814 WeakPolarHBondContact O-CA 3.34Å; A1809-G1814 PolarHBondContact O-N 3.32Å; L1810-G1814 CarbonylContact O-C 3.16Å; G1814-I1816 VanDerWaalsContact C-N 3.29Å; G1814-I1816 PolarHBondContact O-N 3.46Å; G1814-R1916 VanDerWaalsContact O-CD 3.3Å; G1814-R1916 WeakPolarHBondContact O-CD 3.48Å
1815	R	93.1	Very high	93.4	Very high	187 Å²	187	39.3 Å²	39.3	71%	0.706	18%	0.181	S	C	*	.			trans	50.9	45.9	177	-57.5	177.6	179.2	180	-1.4	113.2	L1810 V1811 R1817	L1810-R1815 PolarHBondContact O-N 3.11Å; V1811-R1815 WeakPolarHBondContact O-CA 3.47Å; V1811-R1815 PolarHBondContact O-N 2.91Å; R1815-R1817 WeakPolarHBondContact O-CG 3.23Å
1816	I	94.3	Very high	93.2	Very high	10 Å²	10	40.2 Å²	40.2	5%	0.051	19%	0.188	C	C	.	.			trans	-49.7	140.5	-179.9	-168.1	170.3	0	0	0	112.8	L1810 V1811 G1814 V1822 A1839 Y1842 L1894	L1810-I1816 HydrophobicContact CB-CB 4.46Å; L1810-I1816 HydrophobicContact CB-CD1 4.4Å; L1810-I1816 HydrophobicContact CB-CG2 4.21Å; L1810-I1816 HydrophobicContact CD1-CD1 4.38Å; L1810-I1816 HydrophobicContact CD2-CD1 4.45Å; L1810-I1816 WeakPolarHBondContact O-CB 3.39Å; L1810-I1816 WeakPolarHBondContact O-CG2 3.4Å; L1810-I1816 PolarHBondContact O-N 2.94Å; V1811-I1816 HydrophobicContact CG2-CG2 4.02Å; G1814-I1816 VanDerWaalsContact C-N 3.29Å; G1814-I1816 PolarHBondContact O-N 3.46Å; I1816-V1822 HydrophobicContact CD1-CG2 4.11Å; I1816-A1839 HydrophobicContact CD1-CB 4.04Å; I1816-Y1842 HydrophobicContact CG2-CD1 3.93Å; I1816-Y1842 HydrophobicContact CG2-CE1 3.97Å; I1816-Y1842 HydrophobicContact CG2-CG 4.22Å; I1816-L1894 HydrophobicContact CB-CD2 4.38Å; I1816-L1894 HydrophobicContact CG1-CD1 4.39Å
1817	R	91.6	Very high	93	Very high	167 Å²	167	40.2 Å²	40.2	63%	0.63	19%	0.188	S	C	*	.			trans	-127.6	154.8	-177	-50.9	175.8	175.6	175.7	-3.2	111.7	R1815 G1819 E1820 C1844	R1815-R1817 WeakPolarHBondContact O-CG 3.23Å; R1817-G1819 PolarHBondContact O-N 3.35Å; R1817-E1820 HydrophobicContact CB-CG 3.99Å; R1817-E1820 WeakPolarHBondContact CB-OE2 3.36Å; R1817-E1820 PolarHBondContact N-OE2 3.27Å; R1817-E1820 WeakPolarHBondContact O-CB 3.2Å; R1817-E1820 WeakPolarHBondContact O-CG 3.29Å; R1817-E1820 PolarHBondContact O-N 2.85Å; R1817-C1844 PolarHBondContact O-SG 3.21Å
1818	K	89.8	Confident	92.7	Very high	179 Å²	179	40.2 Å²	40.2	78%	0.778	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	128.6	177.5	179.1	155.4	-174	168	0	111.9	Y1842	K1818-Y1842 WeakPolarHBondContact CA-O 3.4Å; K1818-Y1842 VanDerWaalsContact CB-O 3.24Å; K1818-Y1842 WeakPolarHBondContact CB-O 3.31Å; K1818-Y1842 WeakPolarHBondContact CG-O 3.33Å
1819	G	87.3	Confident	92.3	Very high	57 Å²	57	40.6 Å²	40.6	59%	0.588	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.2	3.8	179.6	0	0	0	0	0	116	R1817 G1843	R1817-G1819 PolarHBondContact O-N 3.35Å; G1819-G1843 WeakPolarHBondContact CA-O 3.43Å; G1819-G1843 PolarHBondContact N-O 3.36Å; G1819-G1843 VanDerWaalsContact N-O 3.07Å
1820	E	94.2	Very high	92	Very high	19 Å²	19	41 Å²	41	9%	0.089	20%	0.199	C	C	.	.			trans	-73.3	150.2	174.4	-70.3	-171.8	133.7	0	0	112.2	R1817 C1844 E1845 D1893 L1894 R1916	R1817-E1820 HydrophobicContact CB-CG 3.99Å; R1817-E1820 WeakPolarHBondContact CB-OE2 3.36Å; R1817-E1820 PolarHBondContact N-OE2 3.27Å; R1817-E1820 WeakPolarHBondContact O-CB 3.2Å; R1817-E1820 WeakPolarHBondContact O-CG 3.29Å; R1817-E1820 PolarHBondContact O-N 2.85Å; E1820-C1844 CarbonylContact O-C 3.55Å; E1820-C1844 VanDerWaalsContact O-CA 3.26Å; E1820-C1844 WeakPolarHBondContact O-CA 3.24Å; E1820-C1844 WeakPolarHBondContact O-CB 3.21Å; E1820-E1845 PolarHBondContact O-N 3.31Å; E1820-D1893 HydrophobicContact CB-CB 3.91Å; E1820-D1893 HydrophobicContact CG-CB 4.17Å; E1820-L1894 HydrophobicContact CB-CD1 4.19Å; E1820-L1894 VanDerWaalsContact OE2-CD1 3.26Å; E1820-L1894 WeakPolarHBondContact OE2-CD1 3.22Å; E1820-R1916 VanDerWaalsContact CD-NH1 3.31Å; E1820-R1916 IonicContact OE1-CZ 3.2Å; E1820-R1916 VanDerWaalsContact OE1-CZ 3.23Å; E1820-R1916 IonicContact OE1-NH1 3.38Å; E1820-R1916 PolarHBondContact OE1-NH1 2.76Å; E1820-R1916 IonicContact OE1-NH2 2.7Å; E1820-R1916 PolarHBondContact OE1-NH2 2.87Å; E1820-R1916 IonicContact OE2-CZ 2.73Å; E1820-R1916 IonicContact OE2-NH1 2.72Å; E1820-R1916 PolarHBondContact OE2-NH1 3.48Å
1821	K	95.5	Very high	91.9	Very high	46 Å²	46	42.7 Å²	42.7	20%	0.2	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	129.9	170.2	-63.5	-176.2	-177.8	-74.6	0	110	E1845 F1847 T1887 V1892 D1893 L1894	K1821-E1845 CarbonylContact C-O 3.59Å; K1821-E1845 WeakPolarHBondContact CA-O 3.36Å; K1821-E1845 HydrophobicContact CG-CB 4.22Å; K1821-E1845 IonicContact NZ-OE1 3.82Å; K1821-E1845 PolarHBondContact NZ-OE1 3.24Å; K1821-E1845 IonicContact NZ-OE2 2.74Å; K1821-E1845 PolarHBondContact NZ-OE2 2.68Å; K1821-F1847 HydrophobicContact CD-CE2 4.46Å; K1821-T1887 HydrophobicContact CD-CG2 4.03Å; K1821-V1892 HydrophobicContact CB-CB 4.3Å; K1821-V1892 HydrophobicContact CB-CG1 4.15Å; K1821-D1893 PolarHBondContact N-OD2 3.19Å; K1821-D1893 WeakPolarHBondContact O-CA 3.42Å; K1821-D1893 WeakPolarHBondContact O-CB 3.27Å; K1821-D1893 PolarHBondContact O-N 3.44Å; K1821-L1894 PolarHBondContact O-N 2.81Å; K1821-L1894 VanDerWaalsContact O-N 3.14Å
1822	V	95.9	Very high	91.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	130.2	-175.8	-173.6	0	0	0	0	110.7	I1816 I1824 C1844 E1845 F1847 L1894	I1816-V1822 HydrophobicContact CD1-CG2 4.11Å; V1822-I1824 HydrophobicContact CG1-CD1 4.31Å; V1822-I1824 HydrophobicContact CG1-CG1 3.84Å; V1822-C1844 HydrophobicContact CG2-CB 4Å; V1822-E1845 PolarHBondContact N-O 3.31Å; V1822-F1847 PolarHBondContact O-N 3.41Å; V1822-L1894 WeakPolarHBondContact CA-O 3.4Å; V1822-L1894 HydrophobicContact CG1-CB 4.16Å; V1822-L1894 HydrophobicContact CG2-CB 4.3Å; V1822-L1894 HydrophobicContact CG2-CD1 4.18Å
1823	L	95.9	Very high	91.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	120	168.9	176.7	57.4	0	0	0	110	H1825 F1847 T1849 F1879 I1883 V1892 L1894 V1895 L1896 C1910	L1823-H1825 WeakPolarHBondContact CD2-NE2 3.17Å; L1823-F1847 WeakPolarHBondContact CA-O 3.36Å; L1823-F1847 HydrophobicContact CD1-CB 4.01Å; L1823-T1849 HydrophobicContact CD1-CG2 4.46Å; L1823-F1879 HydrophobicContact CD2-CD2 4.49Å; L1823-I1883 HydrophobicContact CD1-CD1 3.89Å; L1823-I1883 HydrophobicContact CD1-CG1 4.21Å; L1823-I1883 HydrophobicContact CD2-CG1 4.22Å; L1823-V1892 HydrophobicContact CB-CG1 4.35Å; L1823-V1892 HydrophobicContact CB-CG2 3.81Å; L1823-L1894 PolarHBondContact N-O 2.86Å; L1823-V1895 HydrophobicContact CB-CG1 4.3Å; L1823-V1895 HydrophobicContact CB-CG2 4.28Å; L1823-V1895 HydrophobicContact CD2-CG1 4.19Å; L1823-V1895 HydrophobicContact CD2-CG2 4.46Å; L1823-V1895 HydrophobicContact CG-CG1 4.27Å; L1823-V1895 CarbonylContact O-C 3.59Å; L1823-V1895 WeakPolarHBondContact O-CA 3.32Å; L1823-L1896 PolarHBondContact O-N 3.44Å; L1823-C1910 HydrophobicContact CD2-CB 4.17Å
1824	I	95.9	Very high	91.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	111	178.8	-59.7	178.2	0	0	0	108.6	V1822 A1835 I1836 A1839 V1846 F1847 T1848 T1849 L1896	V1822-I1824 HydrophobicContact CG1-CD1 4.31Å; V1822-I1824 HydrophobicContact CG1-CG1 3.84Å; I1824-A1835 HydrophobicContact CD1-CB 3.85Å; I1824-A1835 HydrophobicContact CG2-CB 4.15Å; I1824-I1836 HydrophobicContact CD1-CB 4.43Å; I1824-I1836 HydrophobicContact CD1-CG1 3.8Å; I1824-I1836 HydrophobicContact CG2-CG1 4.39Å; I1824-A1839 HydrophobicContact CD1-CB 4.27Å; I1824-V1846 HydrophobicContact CD1-CG1 3.84Å; I1824-V1846 HydrophobicContact CG1-CG1 4.33Å; I1824-F1847 PolarHBondContact N-O 3.15Å; I1824-T1848 VanDerWaalsContact O-CA 3.22Å; I1824-T1848 WeakPolarHBondContact O-CA 3.42Å; I1824-T1848 PolarHBondContact O-OG1 2.98Å; I1824-T1849 PolarHBondContact O-N 3.23Å; I1824-L1896 HydrophobicContact CG2-CD2 4.48Å
1825	H	93.8	Very high	92	Very high	6 Å²	6	37 Å²	37	3%	0.028	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	148.1	177.3	-74.1	-60.1	0	0	0	112.2	L1823 G1827 T1849 F1879 L1896 N1897 L1899 S1907	L1823-H1825 WeakPolarHBondContact CD2-NE2 3.17Å; H1825-G1827 VanDerWaalsContact C-N 3.34Å; H1825-G1827 PolarHBondContact O-N 2.93Å; H1825-T1849 WeakPolarHBondContact CA-OG1 3.13Å; H1825-T1849 VanDerWaalsContact ND1-CG2 3.29Å; H1825-T1849 WeakPolarHBondContact ND1-CG2 3.33Å; H1825-T1849 PolarHBondContact ND1-OG1 2.74Å; H1825-F1879 AromaticContact CE1-CD2 3.7Å; H1825-F1879 AromaticContact CE1-CE2 3.45Å; H1825-F1879 VanDerWaalsContact CE1-CE2 3.45Å; H1825-F1879 WeakPolarHBondContact CE1-CE2 3.44Å; H1825-F1879 AromaticContact CE1-CZ 3.68Å; H1825-F1879 AromaticContact NE2-CE2 3.84Å; H1825-L1896 PolarHBondContact N-O 3.34Å; H1825-N1897 PolarHBondContact CD2-OD1 3.23Å; H1825-L1899 HydrophobicContact CB-CD1 4.12Å; H1825-L1899 HydrophobicContact CB-CG 4.03Å; H1825-S1907 PolarHBondContact CD2-OG 3.43Å; H1825-S1907 PolarHBondContact CE1-OG 2.94Å; H1825-S1907 PolarHBondContact NE2-OG 3.39Å
1826	S	88.9	Confident	92	Very high	34 Å²	34	28.1 Å²	28.1	24%	0.238	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	33.8	175.3	-48.9	0	0	0	0	115.2	S1828 G1829 T1849 S1898	S1826-S1828 PolarHBondContact O-N 3.34Å; S1826-G1829 PolarHBondContact O-N 2.68Å; S1826-T1849 WeakPolarHBondContact CA-O 3.37Å; S1826-T1849 PolarHBondContact N-O 3.04Å; S1826-T1849 PolarHBondContact N-OG1 3.45Å; S1826-S1898 PolarHBondContact OG-OG 2.67Å
1827	G	88.6	Confident	91.9	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.2	-24.5	-168.7	0	0	0	0	0	117.3	H1825 G1829 G1832 M1833 T1848 T1849	H1825-G1827 VanDerWaalsContact C-N 3.34Å; H1825-G1827 PolarHBondContact O-N 2.93Å; G1827-G1829 VanDerWaalsContact C-N 3.34Å; G1827-G1829 PolarHBondContact O-N 3.44Å; G1827-G1832 CarbonylContact O-C 3.54Å; G1827-M1833 WeakPolarHBondContact O-CG 3.43Å; G1827-M1833 PolarHBondContact O-N 3.42Å; G1827-T1848 WeakPolarHBondContact CA-OG1 3.46Å; G1827-T1848 PolarHBondContact N-OG1 3.47Å; G1827-T1849 PolarHBondContact N-O 3.43Å; G1827-T1849 VanDerWaalsContact N-O 3.13Å
1828	S	88.7	Confident	92	Very high	5 Å²	5	21 Å²	21	4%	0.035	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-16.3	177.3	67.2	0	0	0	0	115.5	S1826 K1855 G2001	S1826-S1828 PolarHBondContact O-N 3.34Å; S1828-K1855 WeakPolarHBondContact OG-CD 3.47Å; S1828-K1855 PolarHBondContact OG-NZ 3.04Å; S1828-K1855 VanDerWaalsContact OG-NZ 3.14Å; S1828-G2001 PolarHBondContact O-N 3.42Å
1829	G	86.5	Confident	92.2	Very high	15 Å²	15	12.5 Å²	12.5	16%	0.155	9%	0.091	C	C	.	.	B	Isolated β-bridge	trans	-87.1	158	173.8	0	0	0	0	0	110.9	S1826 G1827 V1831 G1832 M1833	S1826-G1829 PolarHBondContact O-N 2.68Å; G1827-G1829 VanDerWaalsContact C-N 3.34Å; G1827-G1829 PolarHBondContact O-N 3.44Å; G1829-V1831 PolarHBondContact O-N 3.31Å; G1829-G1832 WeakPolarHBondContact O-CA 3.42Å; G1829-G1832 PolarHBondContact O-N 3.41Å; G1829-M1833 PolarHBondContact O-N 3.02Å
1830	G	88.6	Confident	92.4	Very high	9 Å²	9	11.7 Å²	11.7	9%	0.093	7%	0.073	C	C	.	.	H	α-helix	trans	-46.3	-54.3	-170.5	0	0	0	0	0	115.4	V1802 G1832 M1833 A1834 G2001	V1802-G1830 WeakPolarHBondContact CG1-O 3.45Å; G1830-G1832 VanDerWaalsContact C-N 3.25Å; G1830-G1832 PolarHBondContact O-N 3.47Å; G1830-M1833 PolarHBondContact O-N 3.03Å; G1830-M1833 VanDerWaalsContact O-N 3.09Å; G1830-A1834 PolarHBondContact O-N 2.88Å; G1830-G2001 PolarHBondContact N-O 3.24Å
1831	V	91.5	Very high	92.2	Very high	34 Å²	34	14 Å²	14	21%	0.206	9%	0.091	C	C	.	.	H	α-helix	trans	-64.2	-34.5	-176.7	-177.4	0	0	0	0	111.2	V1802 T1805 G1829 A1835 I1920	V1802-V1831 HydrophobicContact CG1-CB 4.41Å; V1802-V1831 HydrophobicContact CG1-CG2 4.03Å; V1802-V1831 VanDerWaalsContact CG1-N 3.29Å; T1805-V1831 HydrophobicContact CG2-CG1 3.97Å; T1805-V1831 HydrophobicContact CG2-CG2 4.49Å; G1829-V1831 PolarHBondContact O-N 3.31Å; V1831-A1835 WeakPolarHBondContact O-CB 3.45Å; V1831-A1835 PolarHBondContact O-N 2.88Å; V1831-I1920 HydrophobicContact CB-CD1 4.5Å; V1831-I1920 HydrophobicContact CG1-CD1 4.01Å
1832	G	91.7	Very high	91.9	Very high	7 Å²	7	15.5 Å²	15.5	7%	0.072	10%	0.096	C	C	.	.	H	α-helix	trans	-60.4	-47.5	172	0	0	0	0	0	112.1	G1827 G1829 G1830 A1835 I1836	G1827-G1832 CarbonylContact O-C 3.54Å; G1829-G1832 WeakPolarHBondContact O-CA 3.42Å; G1829-G1832 PolarHBondContact O-N 3.41Å; G1830-G1832 VanDerWaalsContact C-N 3.25Å; G1830-G1832 PolarHBondContact O-N 3.47Å; G1832-A1835 PolarHBondContact O-N 3.34Å; G1832-I1836 WeakPolarHBondContact O-CB 3.27Å; G1832-I1836 WeakPolarHBondContact O-CD1 3.14Å; G1832-I1836 WeakPolarHBondContact O-CG1 3.48Å; G1832-I1836 PolarHBondContact O-N 3.32Å
1833	M	93	Very high	91.6	Very high	3 Å²	3	17.4 Å²	17.4	2%	0.015	12%	0.115	C	C	.	.	H	α-helix	trans	-64.2	-42.8	178.3	-61.4	-174.6	71.4	0	0	112.6	G1827 G1829 G1830 I1836 S1837 F1858 L1859 V1862 F1863 L1977 P1978	G1827-M1833 WeakPolarHBondContact O-CG 3.43Å; G1827-M1833 PolarHBondContact O-N 3.42Å; G1829-M1833 PolarHBondContact O-N 3.02Å; G1830-M1833 PolarHBondContact O-N 3.03Å; G1830-M1833 VanDerWaalsContact O-N 3.09Å; M1833-I1836 PolarHBondContact O-N 2.98Å; M1833-S1837 PolarHBondContact O-N 3.22Å; M1833-F1858 HydrophobicContact CE-CE1 3.93Å; M1833-F1858 HydrophobicContact CE-CZ 3.91Å; M1833-F1858 HydrophobicContact SD-CE1 3.92Å; M1833-F1858 HydrophobicContact SD-CZ 4.17Å; M1833-L1859 HydrophobicContact CG-CD2 4.23Å; M1833-V1862 HydrophobicContact CE-CB 4.37Å; M1833-V1862 HydrophobicContact CE-CG1 3.83Å; M1833-V1862 HydrophobicContact CE-CG2 4.19Å; M1833-F1863 HydrophobicContact CB-CE2 4.37Å; M1833-F1863 HydrophobicContact CB-CZ 4.39Å; M1833-F1863 HydrophobicContact CE-CE2 4.33Å; M1833-F1863 WeakPolarHBondContact O-CZ 3.31Å; M1833-L1977 HydrophobicContact CB-CD2 4.15Å; M1833-P1978 HydrophobicContact CE-CG 4.13Å
1834	A	92.8	Very high	91.5	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.6	-42.2	175.7	0	0	0	0	0	111.9	V1802 F1803 A1806 G1830 S1837 I1838	V1802-A1834 HydrophobicContact CG1-CB 3.94Å; F1803-A1834 HydrophobicContact CD1-CB 3.82Å; F1803-A1834 HydrophobicContact CD2-CB 4.03Å; F1803-A1834 HydrophobicContact CE1-CB 3.79Å; F1803-A1834 HydrophobicContact CE2-CB 4.01Å; F1803-A1834 HydrophobicContact CG-CB 3.95Å; F1803-A1834 HydrophobicContact CZ-CB 3.89Å; A1806-A1834 HydrophobicContact CB-CB 3.96Å; G1830-A1834 PolarHBondContact O-N 2.88Å; A1834-S1837 PolarHBondContact O-N 3.35Å; A1834-I1838 WeakPolarHBondContact O-CG1 3.5Å; A1834-I1838 PolarHBondContact O-N 3.09Å
1835	A	94	Very high	91.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65	-38.5	176	0	0	0	0	0	112.5	A1806 L1810 I1824 V1831 G1832 I1838 A1839 L1896	A1806-A1835 HydrophobicContact CB-CB 4.29Å; L1810-A1835 HydrophobicContact CD1-CB 3.91Å; I1824-A1835 HydrophobicContact CD1-CB 3.85Å; I1824-A1835 HydrophobicContact CG2-CB 4.15Å; V1831-A1835 WeakPolarHBondContact O-CB 3.45Å; V1831-A1835 PolarHBondContact O-N 2.88Å; G1832-A1835 PolarHBondContact O-N 3.34Å; A1835-I1838 PolarHBondContact O-N 2.98Å; A1835-A1839 VanDerWaalsContact O-CB 3.29Å; A1835-A1839 WeakPolarHBondContact O-CB 3.48Å; A1835-A1839 PolarHBondContact O-N 3.03Å; A1835-L1896 HydrophobicContact CB-CD2 3.52Å
1836	I	93.8	Very high	91.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.2	-47.6	173.5	-69	161.2	0	0	0	110	I1824 G1832 M1833 I1838 A1839 L1840 V1846 L1859 F1863 L1866	I1824-I1836 HydrophobicContact CD1-CB 4.43Å; I1824-I1836 HydrophobicContact CD1-CG1 3.8Å; I1824-I1836 HydrophobicContact CG2-CG1 4.39Å; G1832-I1836 WeakPolarHBondContact O-CB 3.27Å; G1832-I1836 WeakPolarHBondContact O-CD1 3.14Å; G1832-I1836 WeakPolarHBondContact O-CG1 3.48Å; G1832-I1836 PolarHBondContact O-N 3.32Å; M1833-I1836 PolarHBondContact O-N 2.98Å; I1836-I1838 PolarHBondContact O-N 3.15Å; I1836-A1839 PolarHBondContact O-N 2.9Å; I1836-L1840 HydrophobicContact CG2-CD1 3.68Å; I1836-L1840 HydrophobicContact CG2-CG 4.22Å; I1836-L1840 WeakPolarHBondContact O-CB 3.46Å; I1836-L1840 VanDerWaalsContact O-CG 3.3Å; I1836-L1840 WeakPolarHBondContact O-CG 3.36Å; I1836-L1840 PolarHBondContact O-N 3.04Å; I1836-V1846 HydrophobicContact CG1-CG1 4.09Å; I1836-L1859 HydrophobicContact CD1-CD2 4.17Å; I1836-F1863 HydrophobicContact CB-CD2 4.43Å; I1836-F1863 HydrophobicContact CB-CE1 4.46Å; I1836-F1863 HydrophobicContact CB-CE2 4.05Å; I1836-F1863 HydrophobicContact CB-CZ 4.06Å; I1836-F1863 HydrophobicContact CD1-CE2 4.29Å; I1836-F1863 HydrophobicContact CG2-CB 4.38Å; I1836-F1863 HydrophobicContact CG2-CD1 3.79Å; I1836-F1863 HydrophobicContact CG2-CD2 3.65Å; I1836-F1863 HydrophobicContact CG2-CE1 3.87Å; I1836-F1863 HydrophobicContact CG2-CE2 3.73Å; I1836-F1863 HydrophobicContact CG2-CG 3.67Å; I1836-F1863 HydrophobicContact CG2-CZ 3.84Å; I1836-L1866 HydrophobicContact CD1-CD1 4.49Å; I1836-L1866 HydrophobicContact CG2-CD1 4.29Å
1837	S	92.4	Very high	91.8	Very high	28 Å²	28	19.6 Å²	19.6	20%	0.196	12%	0.123	C	C	.	.	H	α-helix	trans	-57	-46.5	177.1	-168.4	0	0	0	0	112.4	M1833 A1834 S1841 L1973	M1833-S1837 PolarHBondContact O-N 3.22Å; A1834-S1837 PolarHBondContact O-N 3.35Å; S1837-S1841 PolarHBondContact O-N 3.41Å; S1837-L1973 PolarHBondContact OG-O 3.37Å
1838	I	93.4	Very high	92.1	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-67.1	-43	178.2	-68.2	163.6	0	0	0	111.7	F1803 A1806 F1807 L1810 V1811 A1834 A1835 I1836 S1841 Y1842 L1973	F1803-I1838 HydrophobicContact CD1-CD1 4.24Å; A1806-I1838 HydrophobicContact CB-CD1 3.68Å; F1807-I1838 HydrophobicContact CD1-CD1 3.64Å; F1807-I1838 HydrophobicContact CD1-CG1 4.23Å; F1807-I1838 HydrophobicContact CD2-CD1 4.21Å; F1807-I1838 HydrophobicContact CE1-CD1 3.66Å; F1807-I1838 HydrophobicContact CE1-CG1 3.82Å; F1807-I1838 HydrophobicContact CE1-CG2 4.49Å; F1807-I1838 HydrophobicContact CE2-CD1 4.23Å; F1807-I1838 HydrophobicContact CG-CD1 3.91Å; F1807-I1838 HydrophobicContact CZ-CD1 3.97Å; F1807-I1838 HydrophobicContact CZ-CG1 4.16Å; L1810-I1838 HydrophobicContact CB-CG2 4.44Å; L1810-I1838 HydrophobicContact CD1-CB 4.1Å; L1810-I1838 HydrophobicContact CD1-CG2 3.89Å; V1811-I1838 HydrophobicContact CG2-CG2 4.06Å; A1834-I1838 WeakPolarHBondContact O-CG1 3.5Å; A1834-I1838 PolarHBondContact O-N 3.09Å; A1835-I1838 PolarHBondContact O-N 2.98Å; I1836-I1838 PolarHBondContact O-N 3.15Å; I1838-S1841 PolarHBondContact O-N 2.86Å; I1838-S1841 PolarHBondContact O-OG 2.86Å; I1838-Y1842 HydrophobicContact CG2-CD2 4.43Å; I1838-Y1842 HydrophobicContact CG2-CE2 4.43Å; I1838-Y1842 VanDerWaalsContact O-CD2 3.31Å; I1838-Y1842 WeakPolarHBondContact O-CD2 3.16Å; I1838-Y1842 PolarHBondContact O-N 3.05Å; I1838-L1973 HydrophobicContact CG1-CD2 4.46Å
1839	A	93.5	Very high	92.3	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66.4	-40.1	178.5	0	0	0	0	0	112	I1816 I1824 A1835 I1836 Y1842 G1843 C1844 V1846	I1816-A1839 HydrophobicContact CD1-CB 4.04Å; I1824-A1839 HydrophobicContact CD1-CB 4.27Å; A1835-A1839 VanDerWaalsContact O-CB 3.29Å; A1835-A1839 WeakPolarHBondContact O-CB 3.48Å; A1835-A1839 PolarHBondContact O-N 3.03Å; I1836-A1839 PolarHBondContact O-N 2.9Å; A1839-Y1842 PolarHBondContact O-N 3.19Å; A1839-G1843 PolarHBondContact O-N 3.04Å; A1839-C1844 HydrophobicContact CB-CB 4.2Å; A1839-C1844 VanDerWaalsContact O-CB 3.22Å; A1839-C1844 WeakPolarHBondContact O-CB 3.11Å; A1839-C1844 PolarHBondContact O-N 3.21Å; A1839-C1844 PolarHBondContact O-SG 3.04Å; A1839-V1846 HydrophobicContact CB-CG2 3.59Å
1840	L	91.6	Very high	92.4	Very high	40 Å²	40	19.2 Å²	19.2	21%	0.209	12%	0.117	C	C	.	.	H	α-helix	trans	-66.7	-36.9	176.1	-70.4	174.6	0	0	0	112.3	I1836 Y1842 G1843 V1846 F1863 E1865	I1836-L1840 HydrophobicContact CG2-CD1 3.68Å; I1836-L1840 HydrophobicContact CG2-CG 4.22Å; I1836-L1840 WeakPolarHBondContact O-CB 3.46Å; I1836-L1840 VanDerWaalsContact O-CG 3.3Å; I1836-L1840 WeakPolarHBondContact O-CG 3.36Å; I1836-L1840 PolarHBondContact O-N 3.04Å; L1840-Y1842 VanDerWaalsContact C-N 3.32Å; L1840-Y1842 PolarHBondContact O-N 3.5Å; L1840-G1843 WeakPolarHBondContact O-CA 3.24Å; L1840-G1843 PolarHBondContact O-N 2.89Å; L1840-V1846 HydrophobicContact CD2-CG2 4.02Å; L1840-V1846 HydrophobicContact CG-CG2 4.2Å; L1840-F1863 HydrophobicContact CD1-CB 4.14Å; L1840-F1863 HydrophobicContact CD1-CD1 3.8Å; L1840-F1863 HydrophobicContact CD1-CG 4.22Å; L1840-E1865 HydrophobicContact CD1-CB 4.31Å; L1840-E1865 HydrophobicContact CD1-CG 4.42Å; L1840-E1865 HydrophobicContact CD2-CB 3.96Å; L1840-E1865 HydrophobicContact CD2-CG 4.27Å
1841	S	90.2	Very high	92.2	Very high	66 Å²	66	19.8 Å²	19.8	46%	0.462	12%	0.123	S	C	.	.	H	α-helix	trans	-69.2	-28.7	177.9	73.9	0	0	0	0	113.6	S1837 I1838 G1843 L1973	S1837-S1841 PolarHBondContact O-N 3.41Å; I1838-S1841 PolarHBondContact O-N 2.86Å; I1838-S1841 PolarHBondContact O-OG 2.86Å; S1841-G1843 PolarHBondContact O-N 3.34Å; S1841-L1973 VanDerWaalsContact CB-CD1 3.48Å; S1841-L1973 WeakPolarHBondContact OG-CD1 3.09Å
1842	Y	89.8	Confident	91.9	Very high	79 Å²	79	20.4 Å²	20.4	31%	0.31	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-12.6	167.7	-82.7	-112.8	0	0	0	112.6	V1811 I1816 K1818 I1838 A1839 L1840	V1811-Y1842 HydrophobicContact CG2-CE2 4.31Å; I1816-Y1842 HydrophobicContact CG2-CD1 3.93Å; I1816-Y1842 HydrophobicContact CG2-CE1 3.97Å; I1816-Y1842 HydrophobicContact CG2-CG 4.22Å; K1818-Y1842 WeakPolarHBondContact CA-O 3.4Å; K1818-Y1842 VanDerWaalsContact CB-O 3.24Å; K1818-Y1842 WeakPolarHBondContact CB-O 3.31Å; K1818-Y1842 WeakPolarHBondContact CG-O 3.33Å; I1838-Y1842 HydrophobicContact CG2-CD2 4.43Å; I1838-Y1842 HydrophobicContact CG2-CE2 4.43Å; I1838-Y1842 VanDerWaalsContact O-CD2 3.31Å; I1838-Y1842 WeakPolarHBondContact O-CD2 3.16Å; I1838-Y1842 PolarHBondContact O-N 3.05Å; A1839-Y1842 PolarHBondContact O-N 3.19Å; L1840-Y1842 VanDerWaalsContact C-N 3.32Å; L1840-Y1842 PolarHBondContact O-N 3.5Å
1843	G	90	Very high	91.6	Very high	39 Å²	39	25.6 Å²	25.6	40%	0.402	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	40.6	-176.5	0	0	0	0	0	112.7	G1819 A1839 L1840 S1841	G1819-G1843 WeakPolarHBondContact CA-O 3.43Å; G1819-G1843 PolarHBondContact N-O 3.36Å; G1819-G1843 VanDerWaalsContact N-O 3.07Å; A1839-G1843 PolarHBondContact O-N 3.04Å; L1840-G1843 WeakPolarHBondContact O-CA 3.24Å; L1840-G1843 PolarHBondContact O-N 2.89Å; S1841-G1843 PolarHBondContact O-N 3.34Å
1844	C	92.9	Very high	91.3	Very high	9 Å²	9	31.4 Å²	31.4	6%	0.061	18%	0.182	C	C	.	.			trans	-87.8	154.9	174.5	-58.5	0	0	0	0	111.7	R1817 E1820 V1822 A1839	R1817-C1844 PolarHBondContact O-SG 3.21Å; E1820-C1844 CarbonylContact O-C 3.55Å; E1820-C1844 VanDerWaalsContact O-CA 3.26Å; E1820-C1844 WeakPolarHBondContact O-CA 3.24Å; E1820-C1844 WeakPolarHBondContact O-CB 3.21Å; V1822-C1844 HydrophobicContact CG2-CB 4Å; A1839-C1844 HydrophobicContact CB-CB 4.2Å; A1839-C1844 VanDerWaalsContact O-CB 3.22Å; A1839-C1844 WeakPolarHBondContact O-CB 3.11Å; A1839-C1844 PolarHBondContact O-N 3.21Å; A1839-C1844 PolarHBondContact O-SG 3.04Å
1845	E	93.8	Very high	91	Very high	75 Å²	75	32.1 Å²	32.1	35%	0.35	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	111.9	171.1	-174.8	-174.1	137.6	0	0	109.1	E1820 K1821 V1822 F1847	E1820-E1845 PolarHBondContact O-N 3.31Å; K1821-E1845 CarbonylContact C-O 3.59Å; K1821-E1845 WeakPolarHBondContact CA-O 3.36Å; K1821-E1845 HydrophobicContact CG-CB 4.22Å; K1821-E1845 IonicContact NZ-OE1 3.82Å; K1821-E1845 PolarHBondContact NZ-OE1 3.24Å; K1821-E1845 IonicContact NZ-OE2 2.74Å; K1821-E1845 PolarHBondContact NZ-OE2 2.68Å; V1822-E1845 PolarHBondContact N-O 3.31Å; E1845-F1847 HydrophobicContact CG-CE2 4.23Å; E1845-F1847 WeakPolarHBondContact OE1-CE2 3.33Å; E1845-F1847 WeakPolarHBondContact OE1-CZ 3.37Å
1846	V	94.5	Very high	90.8	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	120	-169.4	-178.7	0	0	0	0	111.5	I1824 I1836 A1839 L1840 L1866 H1870	I1824-V1846 HydrophobicContact CD1-CG1 3.84Å; I1824-V1846 HydrophobicContact CG1-CG1 4.33Å; I1836-V1846 HydrophobicContact CG1-CG1 4.09Å; A1839-V1846 HydrophobicContact CB-CG2 3.59Å; L1840-V1846 HydrophobicContact CD2-CG2 4.02Å; L1840-V1846 HydrophobicContact CG-CG2 4.2Å; V1846-L1866 HydrophobicContact CB-CD2 4.19Å; V1846-L1866 HydrophobicContact CG1-CD2 4.4Å; V1846-H1870 WeakPolarHBondContact O-CB 3.23Å; V1846-H1870 PolarHBondContact O-ND1 2.9Å
1847	F	95.7	Very high	90.6	Very high	1 Å²	1	38.1 Å²	38.1	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	146.9	163.5	-66	-89.2	0	0	0	110	K1821 V1822 L1823 I1824 E1845 H1870 I1883 R1886 T1887 V1892	K1821-F1847 HydrophobicContact CD-CE2 4.46Å; V1822-F1847 PolarHBondContact O-N 3.41Å; L1823-F1847 WeakPolarHBondContact CA-O 3.36Å; L1823-F1847 HydrophobicContact CD1-CB 4.01Å; I1824-F1847 PolarHBondContact N-O 3.15Å; E1845-F1847 HydrophobicContact CG-CE2 4.23Å; E1845-F1847 WeakPolarHBondContact OE1-CE2 3.33Å; E1845-F1847 WeakPolarHBondContact OE1-CZ 3.37Å; F1847-H1870 CarbonylContact C-O 3.45Å; F1847-H1870 WeakPolarHBondContact CA-O 3.05Å; F1847-I1883 HydrophobicContact CB-CD1 3.44Å; F1847-I1883 VanDerWaalsContact CB-CD1 3.44Å; F1847-I1883 HydrophobicContact CD1-CD1 3.5Å; F1847-I1883 HydrophobicContact CD2-CD1 4.39Å; F1847-I1883 HydrophobicContact CE1-CD1 4.38Å; F1847-I1883 HydrophobicContact CG-CD1 3.51Å; F1847-R1886 HydrophobicContact CE1-CB 3.72Å; F1847-R1886 HydrophobicContact CE1-CG 4.3Å; F1847-R1886 HydrophobicContact CZ-CB 4.05Å; F1847-T1887 HydrophobicContact CE2-CG2 4.31Å; F1847-T1887 HydrophobicContact CZ-CG2 4.46Å; F1847-V1892 HydrophobicContact CD2-CG1 4.19Å
1848	T	94.9	Very high	90.4	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.006	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	147.4	-179.2	176.4	0	0	0	0	112.9	I1824 G1827 L1859 L1866 H1870 F1871 S1872	I1824-T1848 VanDerWaalsContact O-CA 3.22Å; I1824-T1848 WeakPolarHBondContact O-CA 3.42Å; I1824-T1848 PolarHBondContact O-OG1 2.98Å; G1827-T1848 WeakPolarHBondContact CA-OG1 3.46Å; G1827-T1848 PolarHBondContact N-OG1 3.47Å; T1848-L1859 HydrophobicContact CG2-CD1 4.47Å; T1848-L1866 HydrophobicContact CG2-CD1 4.33Å; T1848-H1870 PolarHBondContact N-O 3.15Å; T1848-F1871 HydrophobicContact CG2-CD1 3.57Å; T1848-F1871 HydrophobicContact CG2-CE1 3.54Å; T1848-F1871 HydrophobicContact CG2-CG 4.36Å; T1848-F1871 HydrophobicContact CG2-CZ 4.33Å; T1848-F1871 WeakPolarHBondContact O-CA 3.28Å; T1848-S1872 PolarHBondContact O-N 3.48Å
1849	T	92.9	Very high	90.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	146.2	168.8	67.9	0	0	0	0	112.8	L1823 I1824 H1825 S1826 G1827 S1872 N1873 S1874 F1879	L1823-T1849 HydrophobicContact CD1-CG2 4.46Å; I1824-T1849 PolarHBondContact O-N 3.23Å; H1825-T1849 WeakPolarHBondContact CA-OG1 3.13Å; H1825-T1849 VanDerWaalsContact ND1-CG2 3.29Å; H1825-T1849 WeakPolarHBondContact ND1-CG2 3.33Å; H1825-T1849 PolarHBondContact ND1-OG1 2.74Å; S1826-T1849 WeakPolarHBondContact CA-O 3.37Å; S1826-T1849 PolarHBondContact N-O 3.04Å; S1826-T1849 PolarHBondContact N-OG1 3.45Å; G1827-T1849 PolarHBondContact N-O 3.43Å; G1827-T1849 VanDerWaalsContact N-O 3.13Å; T1849-S1872 CarbonylContact C-O 3.59Å; T1849-S1872 VanDerWaalsContact CA-O 3.26Å; T1849-S1872 WeakPolarHBondContact CA-O 3.11Å; T1849-N1873 WeakPolarHBondContact CB-O 3.42Å; T1849-N1873 WeakPolarHBondContact CG2-O 3.44Å; T1849-S1874 WeakPolarHBondContact OG1-CB 3.35Å; T1849-F1879 HydrophobicContact CG2-CB 3.8Å; T1849-F1879 HydrophobicContact CG2-CD1 4.17Å; T1849-F1879 HydrophobicContact CG2-CG 3.93Å
1850	V	89.3	Confident	90.1	Very high	10 Å²	10	40.7 Å²	40.7	6%	0.061	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	154.2	178.9	-71.8	0	0	0	0	111.4	K1855 K1856 L1859 F1871 S1872 N1873 S1874	V1850-K1855 HydrophobicContact CB-CB 4.36Å; V1850-K1855 HydrophobicContact CG1-CB 4.4Å; V1850-K1856 HydrophobicContact CG2-CB 4.09Å; V1850-L1859 HydrophobicContact CG1-CD1 3.63Å; V1850-F1871 HydrophobicContact CG1-CD1 4.26Å; V1850-F1871 HydrophobicContact CG2-CD1 4.2Å; V1850-S1872 PolarHBondContact N-O 3.17Å; V1850-N1873 CarbonylContact O-C 3.49Å; V1850-N1873 WeakPolarHBondContact O-CA 3.46Å; V1850-S1874 PolarHBondContact O-N 3.25Å
1851	G	85.1	Confident	90	Very high	21 Å²	21	43.1 Å²	43.1	22%	0.216	24%	0.241	C	C	.	.	S	Bend	trans	-98.1	-0.4	-177.4	0	0	0	0	0	116	S1874	G1851-S1874 PolarHBondContact N-OG 2.78Å
1852	S	85.3	Confident	89.8	Confident	47 Å²	47	42.8 Å²	42.8	33%	0.329	24%	0.236	S	C	.	.	S	Bend	trans	-164.9	154.7	176.1	61.5	0	0	0	0	111.6	E1854 K1855 K1856	S1852-E1854 VanDerWaalsContact C-N 3.27Å; S1852-E1854 PolarHBondContact O-N 2.78Å; S1852-K1855 WeakPolarHBondContact O-CB 3.18Å; S1852-K1855 PolarHBondContact O-N 3.14Å; S1852-K1856 PolarHBondContact O-N 3.37Å; S1852-K1856 VanDerWaalsContact O-N 3.15Å
1853	D	85.3	Confident	89.8	Confident	116 Å²	116	40 Å²	40	62%	0.62	23%	0.225	S	C	*	.	H	α-helix	trans	-64.3	-30.7	175.7	-62.4	-73	0	0	0	113	K1855 K1856 E1857	D1853-K1855 PolarHBondContact O-N 2.73Å; D1853-K1856 WeakPolarHBondContact O-CA 3.45Å; D1853-K1856 VanDerWaalsContact O-CB 3.27Å; D1853-K1856 WeakPolarHBondContact O-CB 3.36Å; D1853-K1856 PolarHBondContact O-N 3.06Å; D1853-E1857 PolarHBondContact O-N 2.95Å
1854	E	86.1	Confident	89.7	Confident	125 Å²	125	42.8 Å²	42.8	58%	0.584	24%	0.236	S	C	*	.	H	α-helix	trans	-58.8	-29.6	172.3	-162.3	-143.9	153.2	0	0	112.7	S1852 F1858 K2000	S1852-E1854 VanDerWaalsContact C-N 3.27Å; S1852-E1854 PolarHBondContact O-N 2.78Å; E1854-F1858 WeakPolarHBondContact O-CB 3.47Å; E1854-K2000 WeakPolarHBondContact OE1-CE 3.41Å; E1854-K2000 IonicContact OE1-NZ 3.48Å; E1854-K2000 PolarHBondContact OE1-NZ 3.46Å
1855	K	87.1	Confident	89.5	Confident	15 Å²	15	47.5 Å²	47.5	7%	0.065	26%	0.257	C	S	.	.	H	α-helix	trans	-85.9	-27.8	174.5	-76.8	177.4	156.6	-143.5	0	112.6	S1828 V1850 S1852 D1853 L1859 G1997 K1998 H1999 K2000	S1828-K1855 WeakPolarHBondContact OG-CD 3.47Å; S1828-K1855 PolarHBondContact OG-NZ 3.04Å; S1828-K1855 VanDerWaalsContact OG-NZ 3.14Å; V1850-K1855 HydrophobicContact CB-CB 4.36Å; V1850-K1855 HydrophobicContact CG1-CB 4.4Å; S1852-K1855 WeakPolarHBondContact O-CB 3.18Å; S1852-K1855 PolarHBondContact O-N 3.14Å; D1853-K1855 PolarHBondContact O-N 2.73Å; K1855-L1859 WeakPolarHBondContact O-CG 3.48Å; K1855-L1859 PolarHBondContact O-N 3.37Å; K1855-G1997 PolarHBondContact NZ-O 2.86Å; K1855-K1998 WeakPolarHBondContact CE-O 3.39Å; K1855-H1999 WeakPolarHBondContact CE-O 3.22Å; K1855-H1999 PolarHBondContact NZ-O 3.42Å; K1855-K2000 HydrophobicContact CG-CG 4.44Å
1856	K	89	Confident	89.3	Confident	38 Å²	38	44.2 Å²	44.2	17%	0.165	24%	0.242	C	C	.	.	H	α-helix	trans	-65.7	-54.7	173	-172.5	-170.4	166.4	-142.4	0	111.4	V1850 S1852 D1853 F1858 L1859 K1860 D1868 F1871	V1850-K1856 HydrophobicContact CG2-CB 4.09Å; S1852-K1856 PolarHBondContact O-N 3.37Å; S1852-K1856 VanDerWaalsContact O-N 3.15Å; D1853-K1856 WeakPolarHBondContact O-CA 3.45Å; D1853-K1856 VanDerWaalsContact O-CB 3.27Å; D1853-K1856 WeakPolarHBondContact O-CB 3.36Å; D1853-K1856 PolarHBondContact O-N 3.06Å; K1856-F1858 VanDerWaalsContact C-N 3.31Å; K1856-F1858 PolarHBondContact O-N 3.32Å; K1856-L1859 PolarHBondContact O-N 3.31Å; K1856-L1859 VanDerWaalsContact O-N 3.12Å; K1856-K1860 HydrophobicContact CG-CD 4.3Å; K1856-K1860 WeakPolarHBondContact O-CG 3.29Å; K1856-K1860 PolarHBondContact O-N 3.18Å; K1856-D1868 WeakPolarHBondContact CE-OD1 3.45Å; K1856-D1868 IonicContact NZ-OD1 3.73Å; K1856-D1868 PolarHBondContact NZ-OD1 3.35Å; K1856-F1871 HydrophobicContact CB-CD1 4.44Å; K1856-F1871 HydrophobicContact CD-CB 4.36Å; K1856-F1871 HydrophobicContact CD-CG 4.41Å; K1856-F1871 HydrophobicContact CG-CB 4.08Å; K1856-F1871 HydrophobicContact CG-CD1 3.77Å; K1856-F1871 HydrophobicContact CG-CD2 3.98Å; K1856-F1871 HydrophobicContact CG-CE1 4.18Å; K1856-F1871 HydrophobicContact CG-CE2 4.37Å; K1856-F1871 HydrophobicContact CG-CG 3.67Å; K1856-F1871 HydrophobicContact CG-CZ 4.46Å
1857	E	89.4	Confident	89.1	Confident	88 Å²	88	50.2 Å²	50.2	41%	0.411	27%	0.268	S	S	.	.	H	α-helix	trans	-67.2	-32.6	-179	-60.7	-51.6	129.7	0	0	112.2	D1853 K1860 S1861	D1853-E1857 PolarHBondContact O-N 2.95Å; E1857-K1860 PolarHBondContact O-N 2.85Å; E1857-K1860 WeakPolarHBondContact OE1-CD 3.46Å; E1857-K1860 IonicContact OE1-NZ 2.67Å; E1857-K1860 PolarHBondContact OE1-NZ 3.2Å; E1857-K1860 WeakPolarHBondContact OE2-CD 3.25Å; E1857-K1860 WeakPolarHBondContact OE2-CE 3.31Å; E1857-K1860 IonicContact OE2-NZ 2.71Å; E1857-K1860 PolarHBondContact OE2-NZ 2.77Å; E1857-S1861 PolarHBondContact O-N 2.95Å
1858	F	89.4	Confident	88.7	Confident	35 Å²	35	54.1 Å²	54.1	15%	0.154	29%	0.289	C	S	.	.	H	α-helix	trans	-60.9	-42.3	169.4	167.2	-101.5	0	0	0	113	M1833 E1854 K1856 S1861 V1862 P1978 K2000	M1833-F1858 HydrophobicContact CE-CE1 3.93Å; M1833-F1858 HydrophobicContact CE-CZ 3.91Å; M1833-F1858 HydrophobicContact SD-CE1 3.92Å; M1833-F1858 HydrophobicContact SD-CZ 4.17Å; E1854-F1858 WeakPolarHBondContact O-CB 3.47Å; K1856-F1858 VanDerWaalsContact C-N 3.31Å; K1856-F1858 PolarHBondContact O-N 3.32Å; F1858-S1861 PolarHBondContact O-N 3.23Å; F1858-S1861 PolarHBondContact O-OG 3.19Å; F1858-V1862 HydrophobicContact CD2-CG2 4.47Å; F1858-V1862 HydrophobicContact CE2-CG2 4.14Å; F1858-V1862 HydrophobicContact CZ-CG2 4.25Å; F1858-V1862 WeakPolarHBondContact O-CG2 3.28Å; F1858-V1862 PolarHBondContact O-N 2.65Å; F1858-P1978 HydrophobicContact CE2-CB 4.29Å; F1858-P1978 HydrophobicContact CE2-CG 4.2Å; F1858-P1978 HydrophobicContact CZ-CB 3.96Å; F1858-P1978 HydrophobicContact CZ-CG 3.86Å; F1858-K2000 HydrophobicContact CB-CD 4.32Å; F1858-K2000 HydrophobicContact CD1-CB 4.37Å; F1858-K2000 HydrophobicContact CD1-CD 4.04Å; F1858-K2000 HydrophobicContact CD1-CG 4.35Å; F1858-K2000 HydrophobicContact CD2-CD 3.94Å; F1858-K2000 HydrophobicContact CE1-CB 3.87Å; F1858-K2000 HydrophobicContact CE1-CD 4.31Å; F1858-K2000 HydrophobicContact CE1-CG 4.35Å; F1858-K2000 HydrophobicContact CE2-CB 4.45Å; F1858-K2000 HydrophobicContact CE2-CD 4.21Å; F1858-K2000 HydrophobicContact CG-CD 3.84Å; F1858-K2000 HydrophobicContact CZ-CB 3.9Å; F1858-K2000 HydrophobicContact CZ-CD 4.37Å
1859	L	89.6	Confident	88.5	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-69.6	-34.7	175.8	-77.2	172.8	0	0	0	112.3	M1833 I1836 T1848 V1850 K1855 K1856 S1861 V1862 F1863 L1866 F1871	M1833-L1859 HydrophobicContact CG-CD2 4.23Å; I1836-L1859 HydrophobicContact CD1-CD2 4.17Å; T1848-L1859 HydrophobicContact CG2-CD1 4.47Å; V1850-L1859 HydrophobicContact CG1-CD1 3.63Å; K1855-L1859 WeakPolarHBondContact O-CG 3.48Å; K1855-L1859 PolarHBondContact O-N 3.37Å; K1856-L1859 PolarHBondContact O-N 3.31Å; K1856-L1859 VanDerWaalsContact O-N 3.12Å; L1859-S1861 VanDerWaalsContact C-N 3.28Å; L1859-S1861 PolarHBondContact O-N 3.44Å; L1859-V1862 PolarHBondContact O-N 3.46Å; L1859-F1863 HydrophobicContact CD2-CD2 4Å; L1859-F1863 HydrophobicContact CD2-CE2 3.98Å; L1859-F1863 PolarHBondContact O-N 3.07Å; L1859-L1866 HydrophobicContact CB-CD1 4.39Å; L1859-F1871 HydrophobicContact CB-CE1 3.75Å; L1859-F1871 HydrophobicContact CB-CZ 3.92Å; L1859-F1871 HydrophobicContact CD1-CE1 3.87Å; L1859-F1871 HydrophobicContact CG-CE1 4.5Å
1860	K	90.2	Very high	88.5	Confident	48 Å²	48	59 Å²	59	21%	0.209	31%	0.311	C	S	.	.	H	α-helix	trans	-63.7	-30.6	174	-69.3	165.8	57.6	-177.2	0	112.6	K1856 E1857 D1868 F1871	K1856-K1860 HydrophobicContact CG-CD 4.3Å; K1856-K1860 WeakPolarHBondContact O-CG 3.29Å; K1856-K1860 PolarHBondContact O-N 3.18Å; E1857-K1860 PolarHBondContact O-N 2.85Å; E1857-K1860 WeakPolarHBondContact OE1-CD 3.46Å; E1857-K1860 IonicContact OE1-NZ 2.67Å; E1857-K1860 PolarHBondContact OE1-NZ 3.2Å; E1857-K1860 WeakPolarHBondContact OE2-CD 3.25Å; E1857-K1860 WeakPolarHBondContact OE2-CE 3.31Å; E1857-K1860 IonicContact OE2-NZ 2.71Å; E1857-K1860 PolarHBondContact OE2-NZ 2.77Å; K1860-D1868 IonicContact NZ-OD1 3.26Å; K1860-D1868 PolarHBondContact NZ-OD1 3.31Å; K1860-D1868 IonicContact NZ-OD2 3.72Å; K1860-D1868 PolarHBondContact NZ-OD2 3.12Å; K1860-F1871 HydrophobicContact CD-CE2 3.93Å; K1860-F1871 HydrophobicContact CD-CZ 4.41Å; K1860-F1871 HydrophobicContact CG-CE2 3.5Å; K1860-F1871 HydrophobicContact CG-CZ 3.68Å
1861	S	88.5	Confident	88.7	Confident	90 Å²	90	59 Å²	59	63%	0.629	31%	0.31	S	S	*	.	H	α-helix	trans	-82	-25.8	175.4	67.9	0	0	0	0	114.2	E1857 F1858 L1859	E1857-S1861 PolarHBondContact O-N 2.95Å; F1858-S1861 PolarHBondContact O-N 3.23Å; F1858-S1861 PolarHBondContact O-OG 3.19Å; L1859-S1861 VanDerWaalsContact C-N 3.28Å; L1859-S1861 PolarHBondContact O-N 3.44Å
1862	V	86.5	Confident	88.9	Confident	59 Å²	59	59 Å²	59	36%	0.358	31%	0.307	S	S	.	.	H	α-helix	trans	-85	-35.3	175.6	177.8	0	0	0	0	112.3	M1833 F1858 L1859	M1833-V1862 HydrophobicContact CE-CB 4.37Å; M1833-V1862 HydrophobicContact CE-CG1 3.83Å; M1833-V1862 HydrophobicContact CE-CG2 4.19Å; F1858-V1862 HydrophobicContact CD2-CG2 4.47Å; F1858-V1862 HydrophobicContact CE2-CG2 4.14Å; F1858-V1862 HydrophobicContact CZ-CG2 4.25Å; F1858-V1862 WeakPolarHBondContact O-CG2 3.28Å; F1858-V1862 PolarHBondContact O-N 2.65Å; L1859-V1862 PolarHBondContact O-N 3.46Å
1863	F	90.6	Very high	89.1	Confident	22 Å²	22	59.1 Å²	59.1	10%	0.096	30%	0.304	C	S	.	.			trans	-127.3	86.1	-178.9	-56.4	-72.4	0	0	0	109.9	M1833 I1836 L1840 L1859 E1865 L1866	M1833-F1863 HydrophobicContact CB-CE2 4.37Å; M1833-F1863 HydrophobicContact CB-CZ 4.39Å; M1833-F1863 HydrophobicContact CE-CE2 4.33Å; M1833-F1863 WeakPolarHBondContact O-CZ 3.31Å; I1836-F1863 HydrophobicContact CB-CD2 4.43Å; I1836-F1863 HydrophobicContact CB-CE1 4.46Å; I1836-F1863 HydrophobicContact CB-CE2 4.05Å; I1836-F1863 HydrophobicContact CB-CZ 4.06Å; I1836-F1863 HydrophobicContact CD1-CE2 4.29Å; I1836-F1863 HydrophobicContact CG2-CB 4.38Å; I1836-F1863 HydrophobicContact CG2-CD1 3.79Å; I1836-F1863 HydrophobicContact CG2-CD2 3.65Å; I1836-F1863 HydrophobicContact CG2-CE1 3.87Å; I1836-F1863 HydrophobicContact CG2-CE2 3.73Å; I1836-F1863 HydrophobicContact CG2-CG 3.67Å; I1836-F1863 HydrophobicContact CG2-CZ 3.84Å; L1840-F1863 HydrophobicContact CD1-CB 4.14Å; L1840-F1863 HydrophobicContact CD1-CD1 3.8Å; L1840-F1863 HydrophobicContact CD1-CG 4.22Å; L1859-F1863 HydrophobicContact CD2-CD2 4Å; L1859-F1863 HydrophobicContact CD2-CE2 3.98Å; L1859-F1863 PolarHBondContact O-N 3.07Å; F1863-E1865 VanDerWaalsContact C-OE2 3.27Å; F1863-E1865 WeakPolarHBondContact CA-OE2 3.4Å; F1863-E1865 PolarHBondContact O-N 2.81Å; F1863-L1866 HydrophobicContact CB-CD1 3.89Å; F1863-L1866 HydrophobicContact CB-CG 3.87Å; F1863-L1866 HydrophobicContact CD2-CD1 4.28Å; F1863-L1866 HydrophobicContact CG-CD1 4.44Å; F1863-L1866 WeakPolarHBondContact O-CB 3.41Å; F1863-L1866 PolarHBondContact O-N 3.4Å
1864	P	87.2	Confident	89.1	Confident	97 Å²	97	54.7 Å²	54.7	63%	0.63	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-14.6	-177.7	-24.4	35.7	0	0	0	114.9	L1866	P1864-L1866 PolarHBondContact O-N 2.74Å
1865	E	88.8	Confident	88.9	Confident	107 Å²	107	56.9 Å²	56.9	50%	0.5	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-24	171.4	-57.2	79	-173.6	0	0	112.4	L1840 F1863 H1870	L1840-E1865 HydrophobicContact CD1-CB 4.31Å; L1840-E1865 HydrophobicContact CD1-CG 4.42Å; L1840-E1865 HydrophobicContact CD2-CB 3.96Å; L1840-E1865 HydrophobicContact CD2-CG 4.27Å; F1863-E1865 VanDerWaalsContact C-OE2 3.27Å; F1863-E1865 WeakPolarHBondContact CA-OE2 3.4Å; F1863-E1865 PolarHBondContact O-N 2.81Å; E1865-H1870 PolarHBondContact O-CE1 2.92Å
1866	L	90.9	Very high	88.8	Confident	6 Å²	6	58.3 Å²	58.3	3%	0.031	30%	0.296	C	S	.	.			trans	-83	116.5	-177.8	-60.1	-175.9	0	0	0	112.1	I1836 V1846 T1848 L1859 F1863 P1864 H1870 F1871	I1836-L1866 HydrophobicContact CD1-CD1 4.49Å; I1836-L1866 HydrophobicContact CG2-CD1 4.29Å; V1846-L1866 HydrophobicContact CB-CD2 4.19Å; V1846-L1866 HydrophobicContact CG1-CD2 4.4Å; T1848-L1866 HydrophobicContact CG2-CD1 4.33Å; L1859-L1866 HydrophobicContact CB-CD1 4.39Å; F1863-L1866 HydrophobicContact CB-CD1 3.89Å; F1863-L1866 HydrophobicContact CB-CG 3.87Å; F1863-L1866 HydrophobicContact CD2-CD1 4.28Å; F1863-L1866 HydrophobicContact CG-CD1 4.44Å; F1863-L1866 WeakPolarHBondContact O-CB 3.41Å; F1863-L1866 PolarHBondContact O-N 3.4Å; P1864-L1866 PolarHBondContact O-N 2.74Å; L1866-H1870 HydrophobicContact CD2-CB 4.42Å; L1866-F1871 HydrophobicContact CB-CE2 3.79Å; L1866-F1871 HydrophobicContact CB-CZ 3.71Å; L1866-F1871 HydrophobicContact CD1-CE1 4.38Å; L1866-F1871 HydrophobicContact CD1-CZ 3.89Å; L1866-F1871 HydrophobicContact CG-CZ 4.44Å
1867	K	90.1	Very high	88.7	Confident	128 Å²	128	58.5 Å²	58.5	56%	0.557	30%	0.301	S	S	*	.			trans	-103.7	161.7	178.1	-64.6	174	-175.4	172.5	0	110.6	H1869 H1870 F1871	K1867-H1869 PolarHBondContact O-N 2.94Å; K1867-H1870 PolarHBondContact N-ND1 3.02Å; K1867-H1870 WeakPolarHBondContact O-CB 3.4Å; K1867-H1870 PolarHBondContact O-N 3.22Å; K1867-F1871 VanDerWaalsContact O-CD2 3.29Å; K1867-F1871 WeakPolarHBondContact O-CD2 3.39Å
1868	D	86.6	Confident	88.6	Confident	83 Å²	83	59.5 Å²	59.5	44%	0.444	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-52.5	-30.7	-174.5	-69.8	-65.8	0	0	0	115	K1856 K1860 H1870 F1871	K1856-D1868 WeakPolarHBondContact CE-OD1 3.45Å; K1856-D1868 IonicContact NZ-OD1 3.73Å; K1856-D1868 PolarHBondContact NZ-OD1 3.35Å; K1860-D1868 IonicContact NZ-OD1 3.26Å; K1860-D1868 PolarHBondContact NZ-OD1 3.31Å; K1860-D1868 IonicContact NZ-OD2 3.72Å; K1860-D1868 PolarHBondContact NZ-OD2 3.12Å; D1868-H1870 VanDerWaalsContact C-N 3.33Å; D1868-H1870 PolarHBondContact O-N 3.43Å; D1868-F1871 PolarHBondContact O-N 3.08Å
1869	H	90.1	Very high	88.8	Confident	82 Å²	82	57.8 Å²	57.8	38%	0.38	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-78.1	-10	177.9	61.2	-94.2	0	0	0	114.9	K1867 F1871 H1882	K1867-H1869 PolarHBondContact O-N 2.94Å; H1869-F1871 VanDerWaalsContact C-N 3.31Å; H1869-H1882 PolarHBondContact O-CE1 3.13Å; H1869-H1882 PolarHBondContact O-NE2 3.29Å
1870	H	93.3	Very high	88.9	Confident	22 Å²	22	59.2 Å²	59.2	10%	0.102	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-78	-16.9	171.2	-61.8	177.6	0	0	0	112.4	V1846 F1847 T1848 E1865 L1866 K1867 D1868	V1846-H1870 WeakPolarHBondContact O-CB 3.23Å; V1846-H1870 PolarHBondContact O-ND1 2.9Å; F1847-H1870 CarbonylContact C-O 3.45Å; F1847-H1870 WeakPolarHBondContact CA-O 3.05Å; T1848-H1870 PolarHBondContact N-O 3.15Å; E1865-H1870 PolarHBondContact O-CE1 2.92Å; L1866-H1870 HydrophobicContact CD2-CB 4.42Å; K1867-H1870 PolarHBondContact N-ND1 3.02Å; K1867-H1870 WeakPolarHBondContact O-CB 3.4Å; K1867-H1870 PolarHBondContact O-N 3.22Å; D1868-H1870 VanDerWaalsContact C-N 3.33Å; D1868-H1870 PolarHBondContact O-N 3.43Å
1871	F	92.8	Very high	88.9	Confident	9 Å²	9	64.5 Å²	64.5	4%	0.039	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	144.7	-174.2	-65.3	-87.2	0	0	0	112.9	T1848 V1850 K1856 L1859 K1860 L1866 K1867 D1868 H1869 H1882	T1848-F1871 HydrophobicContact CG2-CD1 3.57Å; T1848-F1871 HydrophobicContact CG2-CE1 3.54Å; T1848-F1871 HydrophobicContact CG2-CG 4.36Å; T1848-F1871 HydrophobicContact CG2-CZ 4.33Å; T1848-F1871 WeakPolarHBondContact O-CA 3.28Å; V1850-F1871 HydrophobicContact CG1-CD1 4.26Å; V1850-F1871 HydrophobicContact CG2-CD1 4.2Å; K1856-F1871 HydrophobicContact CB-CD1 4.44Å; K1856-F1871 HydrophobicContact CD-CB 4.36Å; K1856-F1871 HydrophobicContact CD-CG 4.41Å; K1856-F1871 HydrophobicContact CG-CB 4.08Å; K1856-F1871 HydrophobicContact CG-CD1 3.77Å; K1856-F1871 HydrophobicContact CG-CD2 3.98Å; K1856-F1871 HydrophobicContact CG-CE1 4.18Å; K1856-F1871 HydrophobicContact CG-CE2 4.37Å; K1856-F1871 HydrophobicContact CG-CG 3.67Å; K1856-F1871 HydrophobicContact CG-CZ 4.46Å; L1859-F1871 HydrophobicContact CB-CE1 3.75Å; L1859-F1871 HydrophobicContact CB-CZ 3.92Å; L1859-F1871 HydrophobicContact CD1-CE1 3.87Å; L1859-F1871 HydrophobicContact CG-CE1 4.5Å; K1860-F1871 HydrophobicContact CD-CE2 3.93Å; K1860-F1871 HydrophobicContact CD-CZ 4.41Å; K1860-F1871 HydrophobicContact CG-CE2 3.5Å; K1860-F1871 HydrophobicContact CG-CZ 3.68Å; L1866-F1871 HydrophobicContact CB-CE2 3.79Å; L1866-F1871 HydrophobicContact CB-CZ 3.71Å; L1866-F1871 HydrophobicContact CD1-CE1 4.38Å; L1866-F1871 HydrophobicContact CD1-CZ 3.89Å; L1866-F1871 HydrophobicContact CG-CZ 4.44Å; K1867-F1871 VanDerWaalsContact O-CD2 3.29Å; K1867-F1871 WeakPolarHBondContact O-CD2 3.39Å; D1868-F1871 PolarHBondContact O-N 3.08Å; H1869-F1871 VanDerWaalsContact C-N 3.31Å; F1871-H1882 PolarHBondContact O-CE1 3.42Å; F1871-H1882 PolarHBondContact O-NE2 2.96Å; F1871-H1882 VanDerWaalsContact O-NE2 3.12Å
1872	S	90.9	Very high	89	Confident	21 Å²	21	62.2 Å²	62.2	15%	0.147	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	178.5	166.2	-157.2	0	0	0	0	112.1	T1848 T1849 V1850 F1879	T1848-S1872 PolarHBondContact O-N 3.48Å; T1849-S1872 CarbonylContact C-O 3.59Å; T1849-S1872 VanDerWaalsContact CA-O 3.26Å; T1849-S1872 WeakPolarHBondContact CA-O 3.11Å; V1850-S1872 PolarHBondContact N-O 3.17Å; S1872-F1879 WeakPolarHBondContact OG-CA 3.29Å
1873	N	88.3	Confident	89.3	Confident	51 Å²	51	59.5 Å²	59.5	27%	0.273	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	145.4	-176.8	-162.9	-19	0	0	0	111.5	T1849 V1850 R1875 T1876 E1878 F1879	T1849-N1873 WeakPolarHBondContact CB-O 3.42Å; T1849-N1873 WeakPolarHBondContact CG2-O 3.44Å; V1850-N1873 CarbonylContact O-C 3.49Å; V1850-N1873 WeakPolarHBondContact O-CA 3.46Å; N1873-R1875 PolarHBondContact OD1-N 3.47Å; N1873-T1876 WeakPolarHBondContact CB-OG1 3.5Å; N1873-T1876 VanDerWaalsContact CG-OG1 3.26Å; N1873-T1876 PolarHBondContact ND2-OG1 2.93Å; N1873-T1876 VanDerWaalsContact ND2-OG1 3.1Å; N1873-E1878 PolarHBondContact ND2-OE2 3.19Å; N1873-F1879 WeakPolarHBondContact O-CD1 3.29Å
1874	S	84.9	Confident	89.4	Confident	22 Å²	22	60.7 Å²	60.7	15%	0.154	30%	0.298	C	S	.	.	S	Bend	trans	-108.5	-2.4	174.8	79	0	0	0	0	114.3	T1849 V1850 G1851	T1849-S1874 WeakPolarHBondContact OG1-CB 3.35Å; V1850-S1874 PolarHBondContact O-N 3.25Å; G1851-S1874 PolarHBondContact N-OG 2.78Å
1875	R	82.5	Confident	89.5	Confident	171 Å²	171	62.5 Å²	62.5	65%	0.645	30%	0.298	S	S	*	.	S	Bend	trans	-100.4	-21	-178.1	-69.4	-179.3	166.5	-175.3	-4.8	113.4	N1873 K1903	N1873-R1875 PolarHBondContact OD1-N 3.47Å; R1875-K1903 WeakPolarHBondContact O-CE 3.39Å; R1875-K1903 PolarHBondContact O-NZ 3.17Å; R1875-K1903 VanDerWaalsContact O-NZ 3.15Å
1876	T	85	Confident	89.5	Confident	46 Å²	46	63.2 Å²	63.2	28%	0.282	30%	0.295	S	S	.	.	S	Bend	trans	-118	169	179.1	56.2	0	0	0	0	110.1	N1873 E1878 F1879	N1873-T1876 WeakPolarHBondContact CB-OG1 3.5Å; N1873-T1876 VanDerWaalsContact CG-OG1 3.26Å; N1873-T1876 PolarHBondContact ND2-OG1 2.93Å; N1873-T1876 VanDerWaalsContact ND2-OG1 3.1Å; T1876-E1878 VanDerWaalsContact C-N 3.3Å; T1876-E1878 WeakPolarHBondContact CB-OE2 3.06Å; T1876-E1878 WeakPolarHBondContact OG1-CG 3.27Å; T1876-E1878 PolarHBondContact OG1-OE2 3.12Å; T1876-F1879 VanDerWaalsContact O-CD1 3.27Å; T1876-F1879 WeakPolarHBondContact O-CD1 3.43Å; T1876-F1879 WeakPolarHBondContact O-CE1 3.48Å
1877	S	87.6	Confident	89.5	Confident	41 Å²	41	63.6 Å²	63.6	29%	0.287	30%	0.298	S	S	.	.	S	Bend	trans	-83.6	0.4	173.6	47.1	0	0	0	0	114	F1879 E1880	S1877-F1879 PolarHBondContact O-N 3.49Å; S1877-E1880 PolarHBondContact O-N 3.3Å
1878	E	87.3	Confident	89.3	Confident	109 Å²	109	61 Å²	61	51%	0.509	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-24.7	-176.9	-63.6	169.8	120.7	0	0	114	N1873 T1876 E1880 F1881 H1882	N1873-E1878 PolarHBondContact ND2-OE2 3.19Å; T1876-E1878 VanDerWaalsContact C-N 3.3Å; T1876-E1878 WeakPolarHBondContact CB-OE2 3.06Å; T1876-E1878 WeakPolarHBondContact OG1-CG 3.27Å; T1876-E1878 PolarHBondContact OG1-OE2 3.12Å; E1878-E1880 PolarHBondContact O-N 3.35Å; E1878-F1881 PolarHBondContact O-N 3.18Å; E1878-H1882 PolarHBondContact O-N 3.1Å
1879	F	92.8	Very high	89.2	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.2	-26.9	177	67.2	-100.3	0	0	0	112.8	L1823 H1825 T1849 S1872 N1873 T1876 S1877 H1882 I1883 L1899 K1903 A1906 S1907	L1823-F1879 HydrophobicContact CD2-CD2 4.49Å; H1825-F1879 AromaticContact CE1-CD2 3.7Å; H1825-F1879 AromaticContact CE1-CE2 3.45Å; H1825-F1879 VanDerWaalsContact CE1-CE2 3.45Å; H1825-F1879 WeakPolarHBondContact CE1-CE2 3.44Å; H1825-F1879 AromaticContact CE1-CZ 3.68Å; H1825-F1879 AromaticContact NE2-CE2 3.84Å; T1849-F1879 HydrophobicContact CG2-CB 3.8Å; T1849-F1879 HydrophobicContact CG2-CD1 4.17Å; T1849-F1879 HydrophobicContact CG2-CG 3.93Å; S1872-F1879 WeakPolarHBondContact OG-CA 3.29Å; N1873-F1879 WeakPolarHBondContact O-CD1 3.29Å; T1876-F1879 VanDerWaalsContact O-CD1 3.27Å; T1876-F1879 WeakPolarHBondContact O-CD1 3.43Å; T1876-F1879 WeakPolarHBondContact O-CE1 3.48Å; S1877-F1879 PolarHBondContact O-N 3.49Å; F1879-H1882 PolarHBondContact O-N 3.49Å; F1879-I1883 WeakPolarHBondContact O-CB 3.23Å; F1879-I1883 WeakPolarHBondContact O-CG1 3.48Å; F1879-I1883 PolarHBondContact O-N 3.48Å; F1879-L1899 HydrophobicContact CE1-CD1 4.08Å; F1879-L1899 HydrophobicContact CZ-CD1 4.39Å; F1879-K1903 HydrophobicContact CE1-CB 4.31Å; F1879-K1903 HydrophobicContact CE1-CG 4.19Å; F1879-K1903 HydrophobicContact CZ-CB 4.38Å; F1879-A1906 HydrophobicContact CE2-CB 3.99Å; F1879-A1906 HydrophobicContact CZ-CB 3.73Å; F1879-S1907 WeakPolarHBondContact CE2-OG 3.36Å; F1879-S1907 WeakPolarHBondContact CZ-OG 3.43Å
1880	E	92.7	Very high	89.3	Confident	30 Å²	30	61.7 Å²	61.7	14%	0.14	32%	0.318	C	S	.	.	H	α-helix	trans	-59.7	-50.2	176.4	-178.2	175.1	175.8	0	0	111.2	S1877 E1878 H1882 I1883 M1884 A1906 R1909	S1877-E1880 PolarHBondContact O-N 3.3Å; E1878-E1880 PolarHBondContact O-N 3.35Å; E1880-H1882 PolarHBondContact O-N 2.94Å; E1880-I1883 PolarHBondContact O-N 3.23Å; E1880-M1884 WeakPolarHBondContact O-CB 3.4Å; E1880-M1884 VanDerWaalsContact O-CG 3.24Å; E1880-M1884 WeakPolarHBondContact O-CG 2.98Å; E1880-M1884 PolarHBondContact O-N 3.31Å; E1880-A1906 HydrophobicContact CB-CB 4.22Å; E1880-A1906 WeakPolarHBondContact OE2-CA 3.19Å; E1880-A1906 WeakPolarHBondContact OE2-CB 3.37Å; E1880-R1909 WeakPolarHBondContact OE1-CB 3.4Å; E1880-R1909 VanDerWaalsContact OE1-CD 3.27Å; E1880-R1909 WeakPolarHBondContact OE1-CD 3.38Å; E1880-R1909 IonicContact OE1-CZ 3.15Å; E1880-R1909 IonicContact OE1-NE 3.65Å; E1880-R1909 PolarHBondContact OE1-NE 3.05Å; E1880-R1909 IonicContact OE1-NH2 3.81Å; E1880-R1909 IonicContact OE2-CZ 3.73Å; E1880-R1909 VanDerWaalsContact OE2-CZ 3.23Å; E1880-R1909 IonicContact OE2-NE 3.41Å; E1880-R1909 PolarHBondContact OE2-NE 2.97Å; E1880-R1909 IonicContact OE2-NH2 2.72Å; E1880-R1909 PolarHBondContact OE2-NH2 2.95Å
1881	F	89.7	Confident	89.2	Confident	159 Å²	159	60.7 Å²	60.7	70%	0.697	31%	0.313	S	S	*	.	H	α-helix	trans	-64.3	-40.1	177.8	-64.2	-80.1	0	0	0	111.9	E1878 H1885	E1878-F1881 PolarHBondContact O-N 3.18Å; F1881-H1885 WeakPolarHBondContact O-CB 3.47Å; F1881-H1885 PolarHBondContact O-N 3.1Å
1882	H	91.6	Very high	89.3	Confident	41 Å²	41	60.2 Å²	60.2	19%	0.19	31%	0.311	C	S	.	.	H	α-helix	trans	-62.9	-48.6	176.5	178.7	93.4	0	0	0	112.2	H1869 F1871 E1878 F1879 E1880 H1885 R1886	H1869-H1882 PolarHBondContact O-CE1 3.13Å; H1869-H1882 PolarHBondContact O-NE2 3.29Å; F1871-H1882 PolarHBondContact O-CE1 3.42Å; F1871-H1882 PolarHBondContact O-NE2 2.96Å; F1871-H1882 VanDerWaalsContact O-NE2 3.12Å; E1878-H1882 PolarHBondContact O-N 3.1Å; F1879-H1882 PolarHBondContact O-N 3.49Å; E1880-H1882 PolarHBondContact O-N 2.94Å; H1882-H1885 PolarHBondContact O-N 3.43Å; H1882-R1886 WeakPolarHBondContact O-CB 3.31Å; H1882-R1886 VanDerWaalsContact O-CG 3.31Å; H1882-R1886 WeakPolarHBondContact O-CG 3.44Å; H1882-R1886 PolarHBondContact O-N 3.18Å
1883	I	92.5	Very high	89.6	Confident	2 Å²	2	60 Å²	60	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-66.8	-44.7	-179.8	-64.5	-65.3	0	0	0	110.6	L1823 F1847 F1879 E1880 H1885 R1886 T1887 V1892 C1910	L1823-I1883 HydrophobicContact CD1-CD1 3.89Å; L1823-I1883 HydrophobicContact CD1-CG1 4.21Å; L1823-I1883 HydrophobicContact CD2-CG1 4.22Å; F1847-I1883 HydrophobicContact CB-CD1 3.44Å; F1847-I1883 VanDerWaalsContact CB-CD1 3.44Å; F1847-I1883 HydrophobicContact CD1-CD1 3.5Å; F1847-I1883 HydrophobicContact CD2-CD1 4.39Å; F1847-I1883 HydrophobicContact CE1-CD1 4.38Å; F1847-I1883 HydrophobicContact CG-CD1 3.51Å; F1879-I1883 WeakPolarHBondContact O-CB 3.23Å; F1879-I1883 WeakPolarHBondContact O-CG1 3.48Å; F1879-I1883 PolarHBondContact O-N 3.48Å; E1880-I1883 PolarHBondContact O-N 3.23Å; I1883-H1885 VanDerWaalsContact C-N 3.34Å; I1883-H1885 PolarHBondContact O-N 3.39Å; I1883-R1886 PolarHBondContact O-N 3.47Å; I1883-T1887 HydrophobicContact CG2-CG2 4.26Å; I1883-T1887 WeakPolarHBondContact O-CB 3.33Å; I1883-T1887 VanDerWaalsContact O-CG2 3.28Å; I1883-T1887 WeakPolarHBondContact O-CG2 3.39Å; I1883-T1887 PolarHBondContact O-N 2.94Å; I1883-T1887 PolarHBondContact O-OG1 3.21Å; I1883-V1892 HydrophobicContact CG2-CG1 3.87Å; I1883-C1910 HydrophobicContact CG2-CB 4.26Å
1884	M	91.2	Very high	89.9	Confident	48 Å²	48	57.5 Å²	57.5	24%	0.236	30%	0.295	C	S	.	.	H	α-helix	trans	-59.9	-43.9	174.9	-71.8	-61.5	-166.4	0	0	111.7	E1880 T1887 G1888 G1889 R1909	E1880-M1884 WeakPolarHBondContact O-CB 3.4Å; E1880-M1884 VanDerWaalsContact O-CG 3.24Å; E1880-M1884 WeakPolarHBondContact O-CG 2.98Å; E1880-M1884 PolarHBondContact O-N 3.31Å; M1884-T1887 PolarHBondContact O-N 2.96Å; M1884-T1887 PolarHBondContact O-OG1 2.84Å; M1884-G1888 PolarHBondContact O-N 3.02Å; M1884-G1888 VanDerWaalsContact O-N 3.16Å; M1884-G1889 PolarHBondContact O-N 3.1Å; M1884-R1909 WeakPolarHBondContact CE-O 3.38Å
1885	H	90.2	Very high	90.4	Very high	135 Å²	135	56.5 Å²	56.5	63%	0.625	29%	0.288	S	S	*	.	H	α-helix	trans	-63.2	-46.9	176.8	179.9	76.2	0	0	0	112.3	F1881 H1882 I1883 T1887 G1888	F1881-H1885 WeakPolarHBondContact O-CB 3.47Å; F1881-H1885 PolarHBondContact O-N 3.1Å; H1882-H1885 PolarHBondContact O-N 3.43Å; I1883-H1885 VanDerWaalsContact C-N 3.34Å; I1883-H1885 PolarHBondContact O-N 3.39Å; H1885-T1887 VanDerWaalsContact C-N 3.3Å; H1885-T1887 PolarHBondContact O-N 3.45Å; H1885-G1888 PolarHBondContact O-N 2.91Å
1886	R	89.5	Confident	91.1	Very high	121 Å²	121	48.6 Å²	48.6	46%	0.457	26%	0.258	S	S	.	.	H	α-helix	trans	-71.7	-20.6	-179.8	-64.3	-61.8	175.1	-154.4	-2.9	114.2	F1847 H1882 I1883	F1847-R1886 HydrophobicContact CE1-CB 3.72Å; F1847-R1886 HydrophobicContact CE1-CG 4.3Å; F1847-R1886 HydrophobicContact CZ-CB 4.05Å; H1882-R1886 WeakPolarHBondContact O-CB 3.31Å; H1882-R1886 VanDerWaalsContact O-CG 3.31Å; H1882-R1886 WeakPolarHBondContact O-CG 3.44Å; H1882-R1886 PolarHBondContact O-N 3.18Å; I1883-R1886 PolarHBondContact O-N 3.47Å
1887	T	89.6	Confident	91.5	Very high	15 Å²	15	46.4 Å²	46.4	9%	0.092	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	5.8	175.7	60.2	0	0	0	0	113.7	K1821 F1847 I1883 M1884 H1885 G1889 R1890 G1891 V1892	K1821-T1887 HydrophobicContact CD-CG2 4.03Å; F1847-T1887 HydrophobicContact CE2-CG2 4.31Å; F1847-T1887 HydrophobicContact CZ-CG2 4.46Å; I1883-T1887 HydrophobicContact CG2-CG2 4.26Å; I1883-T1887 WeakPolarHBondContact O-CB 3.33Å; I1883-T1887 VanDerWaalsContact O-CG2 3.28Å; I1883-T1887 WeakPolarHBondContact O-CG2 3.39Å; I1883-T1887 PolarHBondContact O-N 2.94Å; I1883-T1887 PolarHBondContact O-OG1 3.21Å; M1884-T1887 PolarHBondContact O-N 2.96Å; M1884-T1887 PolarHBondContact O-OG1 2.84Å; H1885-T1887 VanDerWaalsContact C-N 3.3Å; H1885-T1887 PolarHBondContact O-N 3.45Å; T1887-G1889 VanDerWaalsContact C-N 3.28Å; T1887-G1889 PolarHBondContact O-N 3.01Å; T1887-R1890 WeakPolarHBondContact O-CB 3.48Å; T1887-R1890 PolarHBondContact O-N 3.04Å; T1887-G1891 WeakPolarHBondContact CB-O 3.5Å; T1887-G1891 WeakPolarHBondContact CG2-O 3.32Å; T1887-G1891 WeakPolarHBondContact OG1-CA 3.48Å; T1887-G1891 PolarHBondContact OG1-N 3.11Å; T1887-V1892 HydrophobicContact CG2-CG1 4.13Å
1888	G	86.1	Confident	91.5	Very high	73 Å²	73	46.7 Å²	46.7	75%	0.753	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.4	31	-179.7	0	0	0	0	0	113.6	M1884 H1885 R1890	M1884-G1888 PolarHBondContact O-N 3.02Å; M1884-G1888 VanDerWaalsContact O-N 3.16Å; H1885-G1888 PolarHBondContact O-N 2.91Å; G1888-R1890 VanDerWaalsContact C-N 3.27Å; G1888-R1890 PolarHBondContact O-N 3.18Å
1889	G	85.5	Confident	91.5	Very high	55 Å²	55	42.5 Å²	42.5	57%	0.567	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.5	-2.1	-175	0	0	0	0	0	115.1	M1884 T1887	M1884-G1889 PolarHBondContact O-N 3.1Å; T1887-G1889 VanDerWaalsContact C-N 3.28Å; T1887-G1889 PolarHBondContact O-N 3.01Å
1890	R	90.9	Very high	91	Very high	125 Å²	125	44.5 Å²	44.5	47%	0.472	24%	0.242	S	C	.	.			trans	-71.9	-34.4	179.3	-176.8	176.4	178.2	-101.3	-8.7	113.1	T1887 G1888 D1893 A1912	T1887-R1890 WeakPolarHBondContact O-CB 3.48Å; T1887-R1890 PolarHBondContact O-N 3.04Å; G1888-R1890 VanDerWaalsContact C-N 3.27Å; G1888-R1890 PolarHBondContact O-N 3.18Å; R1890-D1893 IonicContact CZ-OD1 3.31Å; R1890-D1893 VanDerWaalsContact CZ-OD1 3.27Å; R1890-D1893 IonicContact CZ-OD2 3.01Å; R1890-D1893 IonicContact NH1-OD1 3.73Å; R1890-D1893 PolarHBondContact NH1-OD1 3.13Å; R1890-D1893 IonicContact NH1-OD2 2.6Å; R1890-D1893 PolarHBondContact NH1-OD2 2.56Å; R1890-D1893 IonicContact NH2-OD1 3.01Å; R1890-D1893 PolarHBondContact NH2-OD1 3.18Å; R1890-A1912 HydrophobicContact CG-CB 4.18Å; R1890-A1912 WeakPolarHBondContact O-CA 3.3Å; R1890-A1912 VanDerWaalsContact O-CB 3.3Å; R1890-A1912 WeakPolarHBondContact O-CB 3.38Å
1891	G	92.4	Very high	90.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.257	C	S	.	.			trans	78.6	-168.8	-165	0	0	0	0	0	113.2	T1887 C1910	T1887-G1891 WeakPolarHBondContact CB-O 3.5Å; T1887-G1891 WeakPolarHBondContact CG2-O 3.32Å; T1887-G1891 WeakPolarHBondContact OG1-CA 3.48Å; T1887-G1891 PolarHBondContact OG1-N 3.11Å; G1891-C1910 CarbonylContact C-O 3.44Å; G1891-C1910 WeakPolarHBondContact CA-O 3.14Å
1892	V	95.1	Very high	90.2	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	153	-177.1	-65.5	0	0	0	0	112.9	K1821 L1823 F1847 I1883 T1887 L1894 V1895 C1910 A1912	K1821-V1892 HydrophobicContact CB-CB 4.3Å; K1821-V1892 HydrophobicContact CB-CG1 4.15Å; L1823-V1892 HydrophobicContact CB-CG1 4.35Å; L1823-V1892 HydrophobicContact CB-CG2 3.81Å; F1847-V1892 HydrophobicContact CD2-CG1 4.19Å; I1883-V1892 HydrophobicContact CG2-CG1 3.87Å; T1887-V1892 HydrophobicContact CG2-CG1 4.13Å; V1892-L1894 WeakPolarHBondContact CG2-O 3.27Å; V1892-V1895 HydrophobicContact CG2-CG2 3.52Å; V1892-C1910 PolarHBondContact N-O 3.3Å; V1892-A1912 VanDerWaalsContact O-CB 3.29Å; V1892-A1912 WeakPolarHBondContact O-CB 3.39Å; V1892-A1912 PolarHBondContact O-N 3.09Å
1893	D	95.4	Very high	90.1	Very high	15 Å²	15	44.8 Å²	44.8	8%	0.08	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-27.9	-176.4	-60.3	-74.7	0	0	0	112.8	E1820 K1821 R1890 G1915 R1916	E1820-D1893 HydrophobicContact CB-CB 3.91Å; E1820-D1893 HydrophobicContact CG-CB 4.17Å; K1821-D1893 PolarHBondContact N-OD2 3.19Å; K1821-D1893 WeakPolarHBondContact O-CA 3.42Å; K1821-D1893 WeakPolarHBondContact O-CB 3.27Å; K1821-D1893 PolarHBondContact O-N 3.44Å; R1890-D1893 IonicContact CZ-OD1 3.31Å; R1890-D1893 VanDerWaalsContact CZ-OD1 3.27Å; R1890-D1893 IonicContact CZ-OD2 3.01Å; R1890-D1893 IonicContact NH1-OD1 3.73Å; R1890-D1893 PolarHBondContact NH1-OD1 3.13Å; R1890-D1893 IonicContact NH1-OD2 2.6Å; R1890-D1893 PolarHBondContact NH1-OD2 2.56Å; R1890-D1893 IonicContact NH2-OD1 3.01Å; R1890-D1893 PolarHBondContact NH2-OD1 3.18Å; D1893-G1915 CarbonylContact O-C 3.57Å; D1893-G1915 VanDerWaalsContact O-CA 3.25Å; D1893-G1915 WeakPolarHBondContact O-CA 3.4Å; D1893-R1916 PolarHBondContact O-N 3.41Å; D1893-R1916 PolarHBondContact O-NE 2.94Å; D1893-R1916 PolarHBondContact O-NH2 3.09Å
1894	L	96	Very high	89.9	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	150.1	166.9	-64.7	92	0	0	0	111.7	I1816 E1820 K1821 V1822 L1823 V1892 R1916 L1918	I1816-L1894 HydrophobicContact CB-CD2 4.38Å; I1816-L1894 HydrophobicContact CG1-CD1 4.39Å; E1820-L1894 HydrophobicContact CB-CD1 4.19Å; E1820-L1894 VanDerWaalsContact OE2-CD1 3.26Å; E1820-L1894 WeakPolarHBondContact OE2-CD1 3.22Å; K1821-L1894 PolarHBondContact O-N 2.81Å; K1821-L1894 VanDerWaalsContact O-N 3.14Å; V1822-L1894 WeakPolarHBondContact CA-O 3.4Å; V1822-L1894 HydrophobicContact CG1-CB 4.16Å; V1822-L1894 HydrophobicContact CG2-CB 4.3Å; V1822-L1894 HydrophobicContact CG2-CD1 4.18Å; L1823-L1894 PolarHBondContact N-O 2.86Å; V1892-L1894 WeakPolarHBondContact CG2-O 3.27Å; L1894-R1916 VanDerWaalsContact CA-O 3.31Å; L1894-R1916 WeakPolarHBondContact CA-O 3.47Å; L1894-R1916 HydrophobicContact CD2-CB 4.45Å; L1894-R1916 HydrophobicContact CG-CB 4.27Å; L1894-L1918 HydrophobicContact CD2-CD1 4.06Å
1895	V	95.7	Very high	89.7	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	127.4	166.4	-174.8	0	0	0	0	109.2	L1823 V1892 N1897 L1911 R1916 F1917 L1918	L1823-V1895 HydrophobicContact CB-CG1 4.3Å; L1823-V1895 HydrophobicContact CB-CG2 4.28Å; L1823-V1895 HydrophobicContact CD2-CG1 4.19Å; L1823-V1895 HydrophobicContact CD2-CG2 4.46Å; L1823-V1895 HydrophobicContact CG-CG1 4.27Å; L1823-V1895 CarbonylContact O-C 3.59Å; L1823-V1895 WeakPolarHBondContact O-CA 3.32Å; V1892-V1895 HydrophobicContact CG2-CG2 3.52Å; V1895-N1897 HydrophobicContact CG1-CB 4.49Å; V1895-L1911 HydrophobicContact CB-CD2 4.48Å; V1895-L1911 HydrophobicContact CG2-CD2 3.84Å; V1895-L1911 HydrophobicContact CG2-CG 4.24Å; V1895-R1916 PolarHBondContact N-O 2.85Å; V1895-F1917 HydrophobicContact CB-CD2 3.69Å; V1895-F1917 HydrophobicContact CB-CE2 3.8Å; V1895-F1917 HydrophobicContact CG1-CD2 4.08Å; V1895-F1917 HydrophobicContact CG1-CE2 3.65Å; V1895-F1917 HydrophobicContact CG1-CZ 4.47Å; V1895-F1917 HydrophobicContact CG2-CD2 4.16Å; V1895-F1917 HydrophobicContact CG2-CE2 4.31Å; V1895-L1918 WeakPolarHBondContact O-CB 3.19Å; V1895-L1918 PolarHBondContact O-N 3.11Å
1896	L	95.6	Very high	89.7	Confident	5 Å²	5	39.6 Å²	39.6	3%	0.026	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	102.7	166.4	-178.5	60.7	0	0	0	108.4	A1809 L1823 I1824 H1825 A1835 L1918 I1920	A1809-L1896 HydrophobicContact CB-CD1 3.87Å; L1823-L1896 PolarHBondContact O-N 3.44Å; I1824-L1896 HydrophobicContact CG2-CD2 4.48Å; H1825-L1896 PolarHBondContact N-O 3.34Å; A1835-L1896 HydrophobicContact CB-CD2 3.52Å; L1896-L1918 HydrophobicContact CD1-CB 3.87Å; L1896-I1920 HydrophobicContact CD1-CG1 4.37Å; L1896-I1920 HydrophobicContact CD1-CG2 4Å
1897	N	93.2	Very high	89.8	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	142	-175.9	-171.1	36.6	0	0	0	112.9	H1825 V1895 L1899 F1917 L1918 E1919 I1920	H1825-N1897 PolarHBondContact CD2-OD1 3.23Å; V1895-N1897 HydrophobicContact CG1-CB 4.49Å; N1897-L1899 PolarHBondContact ND2-O 2.79Å; N1897-L1899 PolarHBondContact OD1-N 3.21Å; N1897-F1917 HydrophobicContact CB-CE1 3.78Å; N1897-F1917 HydrophobicContact CB-CE2 4.24Å; N1897-F1917 HydrophobicContact CB-CZ 3.48Å; N1897-F1917 VanDerWaalsContact CB-CZ 3.48Å; N1897-L1918 PolarHBondContact N-O 3.18Å; N1897-E1919 PolarHBondContact ND2-OE1 3.09Å; N1897-E1919 PolarHBondContact ND2-OE2 3.23Å; N1897-I1920 WeakPolarHBondContact O-CG1 2.94Å; N1897-I1920 PolarHBondContact O-N 3.09Å; N1897-I1920 VanDerWaalsContact O-N 3.14Å
1898	S	88.5	Confident	89.9	Confident	47 Å²	47	33.5 Å²	33.5	33%	0.329	20%	0.197	S	C	.	.			trans	-140.2	16.5	173.6	87.9	0	0	0	0	111.9	S1826	S1826-S1898 PolarHBondContact OG-OG 2.67Å
1899	L	87.3	Confident	90.1	Very high	22 Å²	22	35.3 Å²	35.3	12%	0.115	18%	0.181	C	C	.	.			trans	-117	143.7	-174.2	-52.1	177.7	0	0	0	109.5	H1825 F1879 N1897 K1903	H1825-L1899 HydrophobicContact CB-CD1 4.12Å; H1825-L1899 HydrophobicContact CB-CG 4.03Å; F1879-L1899 HydrophobicContact CE1-CD1 4.08Å; F1879-L1899 HydrophobicContact CZ-CD1 4.39Å; N1897-L1899 PolarHBondContact ND2-O 2.79Å; N1897-L1899 PolarHBondContact OD1-N 3.21Å; L1899-K1903 HydrophobicContact CB-CB 3.59Å; L1899-K1903 HydrophobicContact CB-CG 4.46Å; L1899-K1903 HydrophobicContact CD1-CB 4.01Å; L1899-K1903 HydrophobicContact CD1-CG 4.37Å; L1899-K1903 HydrophobicContact CG-CB 4.44Å
1900	S	83.3	Confident	90.4	Very high	41 Å²	41	32.7 Å²	32.7	29%	0.287	15%	0.154	S	C	.	.			trans	-96	171.2	-175	53.9	0	0	0	0	114.1	E1902 K1903 L1904 D1924	S1900-E1902 PolarHBondContact O-N 3.35Å; S1900-K1903 WeakPolarHBondContact O-CB 3.48Å; S1900-K1903 PolarHBondContact O-N 3.46Å; S1900-K1903 VanDerWaalsContact O-N 3.11Å; S1900-L1904 PolarHBondContact O-N 2.91Å; S1900-D1924 WeakPolarHBondContact CA-OD2 3.49Å; S1900-D1924 WeakPolarHBondContact CB-OD2 3.34Å
1901	E	82.4	Confident	90.5	Very high	99 Å²	99	26.9 Å²	26.9	46%	0.463	13%	0.132	S	C	.	.	H	α-helix	trans	55.9	-129.2	163.5	-57.8	160.8	179.6	0	0	113.2	K1903 L1904 H1905 Y1923 D1924	E1901-K1903 PolarHBondContact O-N 3.24Å; E1901-L1904 WeakPolarHBondContact O-CB 3.33Å; E1901-L1904 PolarHBondContact O-N 3.43Å; E1901-L1904 VanDerWaalsContact O-N 3.1Å; E1901-H1905 PolarHBondContact O-CD2 3.03Å; E1901-H1905 VanDerWaalsContact O-CD2 3.24Å; E1901-H1905 PolarHBondContact O-N 2.86Å; E1901-Y1923 HydrophobicContact CG-CE1 4.37Å; E1901-D1924 PolarHBondContact N-OD1 2.62Å; E1901-D1924 VanDerWaalsContact N-OD1 3.09Å; E1901-D1924 PolarHBondContact N-OD2 2.78Å
1902	E	82.9	Confident	90.5	Very high	99 Å²	99	26.9 Å²	26.9	46%	0.463	13%	0.132	S	C	.	.	H	α-helix	trans	-51.8	-31.3	179.2	68.9	172.6	176.2	0	0	113.4	S1900 A1906	S1900-E1902 PolarHBondContact O-N 3.35Å; E1902-A1906 PolarHBondContact O-N 2.81Å
1903	K	88.1	Confident	90.3	Very high	39 Å²	39	32.9 Å²	32.9	17%	0.17	16%	0.16	C	C	.	.	H	α-helix	trans	-77.4	-40.1	-176.9	-70.6	107.6	178.7	158.5	0	110.4	R1875 F1879 L1899 S1900 E1901 H1905 A1906 S1907	R1875-K1903 WeakPolarHBondContact O-CE 3.39Å; R1875-K1903 PolarHBondContact O-NZ 3.17Å; R1875-K1903 VanDerWaalsContact O-NZ 3.15Å; F1879-K1903 HydrophobicContact CE1-CB 4.31Å; F1879-K1903 HydrophobicContact CE1-CG 4.19Å; F1879-K1903 HydrophobicContact CZ-CB 4.38Å; L1899-K1903 HydrophobicContact CB-CB 3.59Å; L1899-K1903 HydrophobicContact CB-CG 4.46Å; L1899-K1903 HydrophobicContact CD1-CB 4.01Å; L1899-K1903 HydrophobicContact CD1-CG 4.37Å; L1899-K1903 HydrophobicContact CG-CB 4.44Å; S1900-K1903 WeakPolarHBondContact O-CB 3.48Å; S1900-K1903 PolarHBondContact O-N 3.46Å; S1900-K1903 VanDerWaalsContact O-N 3.11Å; E1901-K1903 PolarHBondContact O-N 3.24Å; K1903-H1905 VanDerWaalsContact C-N 3.26Å; K1903-H1905 PolarHBondContact O-N 3.4Å; K1903-A1906 PolarHBondContact O-N 2.99Å; K1903-A1906 VanDerWaalsContact O-N 3.14Å; K1903-S1907 WeakPolarHBondContact O-CB 3.46Å; K1903-S1907 PolarHBondContact O-N 2.66Å; K1903-S1907 PolarHBondContact O-OG 3.37Å
1904	L	88.4	Confident	90.1	Very high	11 Å²	11	37 Å²	37	6%	0.058	18%	0.179	C	C	.	.	H	α-helix	trans	-54.4	-47.3	171.4	-173.2	157.4	0	0	0	110	S1900 E1901 A1906 S1907 V1908 E1919 D1924	S1900-L1904 PolarHBondContact O-N 2.91Å; E1901-L1904 WeakPolarHBondContact O-CB 3.33Å; E1901-L1904 PolarHBondContact O-N 3.43Å; E1901-L1904 VanDerWaalsContact O-N 3.1Å; L1904-A1906 PolarHBondContact O-N 3.19Å; L1904-S1907 WeakPolarHBondContact O-CB 3.35Å; L1904-S1907 PolarHBondContact O-N 3.25Å; L1904-V1908 HydrophobicContact CD2-CG2 3.97Å; L1904-V1908 WeakPolarHBondContact O-CG2 3.24Å; L1904-V1908 PolarHBondContact O-N 3.1Å; L1904-E1919 VanDerWaalsContact CD1-OE2 3.29Å; L1904-E1919 WeakPolarHBondContact CD1-OE2 3.46Å; L1904-D1924 HydrophobicContact CD1-CB 3.66Å
1905	H	87.3	Confident	89.9	Confident	64 Å²	64	37 Å²	37	30%	0.296	18%	0.179	S	C	.	.	H	α-helix	trans	-61.8	-41.5	176.8	-67.4	-68.5	0	0	0	113.5	E1901 K1903 V1908 R1909 K1930	E1901-H1905 PolarHBondContact O-CD2 3.03Å; E1901-H1905 VanDerWaalsContact O-CD2 3.24Å; E1901-H1905 PolarHBondContact O-N 2.86Å; K1903-H1905 VanDerWaalsContact C-N 3.26Å; K1903-H1905 PolarHBondContact O-N 3.4Å; H1905-V1908 PolarHBondContact O-N 3.3Å; H1905-R1909 WeakPolarHBondContact O-CG 3.31Å; H1905-R1909 PolarHBondContact O-N 3.19Å; H1905-K1930 PolarHBondContact CE1-O 3.43Å
1906	A	90.1	Very high	89.9	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.8	-42.9	175.2	0	0	0	0	0	112.1	F1879 E1880 E1902 K1903 L1904 V1908 R1909 C1910	F1879-A1906 HydrophobicContact CE2-CB 3.99Å; F1879-A1906 HydrophobicContact CZ-CB 3.73Å; E1880-A1906 HydrophobicContact CB-CB 4.22Å; E1880-A1906 WeakPolarHBondContact OE2-CA 3.19Å; E1880-A1906 WeakPolarHBondContact OE2-CB 3.37Å; E1902-A1906 PolarHBondContact O-N 2.81Å; K1903-A1906 PolarHBondContact O-N 2.99Å; K1903-A1906 VanDerWaalsContact O-N 3.14Å; L1904-A1906 PolarHBondContact O-N 3.19Å; A1906-V1908 PolarHBondContact O-N 3.46Å; A1906-R1909 PolarHBondContact O-N 3.06Å; A1906-C1910 PolarHBondContact O-N 3.45Å; A1906-C1910 PolarHBondContact O-SG 3.08Å
1907	S	92.4	Very high	89.8	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.4	-41.5	174	-59.9	0	0	0	0	112	H1825 F1879 K1903 L1904 C1910 F1917	H1825-S1907 PolarHBondContact CD2-OG 3.43Å; H1825-S1907 PolarHBondContact CE1-OG 2.94Å; H1825-S1907 PolarHBondContact NE2-OG 3.39Å; F1879-S1907 WeakPolarHBondContact CE2-OG 3.36Å; F1879-S1907 WeakPolarHBondContact CZ-OG 3.43Å; K1903-S1907 WeakPolarHBondContact O-CB 3.46Å; K1903-S1907 PolarHBondContact O-N 2.66Å; K1903-S1907 PolarHBondContact O-OG 3.37Å; L1904-S1907 WeakPolarHBondContact O-CB 3.35Å; L1904-S1907 PolarHBondContact O-N 3.25Å; S1907-C1910 WeakPolarHBondContact O-CB 3.38Å; S1907-C1910 PolarHBondContact O-N 3.47Å; S1907-F1917 VanDerWaalsContact C-CE2 3.46Å
1908	V	90.5	Very high	89.9	Confident	9 Å²	9	38.4 Å²	38.4	6%	0.055	18%	0.184	C	C	.	.	H	α-helix	trans	-64.3	-39.7	175.2	169	0	0	0	0	111.2	L1904 H1905 A1906 C1910 L1911 F1917 L1931 I1935 F1942	L1904-V1908 HydrophobicContact CD2-CG2 3.97Å; L1904-V1908 WeakPolarHBondContact O-CG2 3.24Å; L1904-V1908 PolarHBondContact O-N 3.1Å; H1905-V1908 PolarHBondContact O-N 3.3Å; A1906-V1908 PolarHBondContact O-N 3.46Å; V1908-C1910 VanDerWaalsContact C-N 3.28Å; V1908-C1910 PolarHBondContact O-N 3.31Å; V1908-L1911 HydrophobicContact CG1-CD1 4.36Å; V1908-L1911 WeakPolarHBondContact O-CB 3.16Å; V1908-L1911 WeakPolarHBondContact O-CD1 3.38Å; V1908-L1911 WeakPolarHBondContact O-CG 3.48Å; V1908-L1911 PolarHBondContact O-N 3.17Å; V1908-F1917 HydrophobicContact CB-CE2 4.34Å; V1908-F1917 HydrophobicContact CG2-CD1 4.2Å; V1908-F1917 HydrophobicContact CG2-CD2 4.01Å; V1908-F1917 HydrophobicContact CG2-CE1 3.82Å; V1908-F1917 HydrophobicContact CG2-CE2 3.67Å; V1908-F1917 HydrophobicContact CG2-CG 4.27Å; V1908-F1917 HydrophobicContact CG2-CZ 3.54Å; V1908-L1931 HydrophobicContact CG1-CD1 4.23Å; V1908-L1931 HydrophobicContact CG2-CD1 4.12Å; V1908-I1935 HydrophobicContact CG1-CB 4.2Å; V1908-I1935 HydrophobicContact CG1-CD1 4.2Å; V1908-I1935 HydrophobicContact CG1-CG1 3.79Å; V1908-I1935 HydrophobicContact CG1-CG2 4.2Å; V1908-F1942 HydrophobicContact CG2-CE2 4.17Å
1909	R	90.8	Very high	90.1	Very high	111 Å²	111	36.3 Å²	36.3	42%	0.419	17%	0.169	S	C	.	.	H	α-helix	trans	-63.5	-33.1	176.9	-72.4	-174.8	-61.1	-98.3	1.1	112.5	E1880 M1884 H1905 A1906 L1911 K1938	E1880-R1909 WeakPolarHBondContact OE1-CB 3.4Å; E1880-R1909 VanDerWaalsContact OE1-CD 3.27Å; E1880-R1909 WeakPolarHBondContact OE1-CD 3.38Å; E1880-R1909 IonicContact OE1-CZ 3.15Å; E1880-R1909 IonicContact OE1-NE 3.65Å; E1880-R1909 PolarHBondContact OE1-NE 3.05Å; E1880-R1909 IonicContact OE1-NH2 3.81Å; E1880-R1909 IonicContact OE2-CZ 3.73Å; E1880-R1909 VanDerWaalsContact OE2-CZ 3.23Å; E1880-R1909 IonicContact OE2-NE 3.41Å; E1880-R1909 PolarHBondContact OE2-NE 2.97Å; E1880-R1909 IonicContact OE2-NH2 2.72Å; E1880-R1909 PolarHBondContact OE2-NH2 2.95Å; M1884-R1909 WeakPolarHBondContact CE-O 3.38Å; H1905-R1909 WeakPolarHBondContact O-CG 3.31Å; H1905-R1909 PolarHBondContact O-N 3.19Å; A1906-R1909 PolarHBondContact O-N 3.06Å; R1909-L1911 PolarHBondContact O-N 2.94Å; R1909-L1911 VanDerWaalsContact O-N 3.13Å; R1909-K1938 PolarHBondContact O-NZ 2.71Å
1910	C	93.3	Very high	90.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-10.6	175.7	-65.1	0	0	0	0	115.6	L1823 I1883 G1891 V1892 A1906 S1907 V1908	L1823-C1910 HydrophobicContact CD2-CB 4.17Å; I1883-C1910 HydrophobicContact CG2-CB 4.26Å; G1891-C1910 CarbonylContact C-O 3.44Å; G1891-C1910 WeakPolarHBondContact CA-O 3.14Å; V1892-C1910 PolarHBondContact N-O 3.3Å; A1906-C1910 PolarHBondContact O-N 3.45Å; A1906-C1910 PolarHBondContact O-SG 3.08Å; S1907-C1910 WeakPolarHBondContact O-CB 3.38Å; S1907-C1910 PolarHBondContact O-N 3.47Å; V1908-C1910 VanDerWaalsContact C-N 3.28Å; V1908-C1910 PolarHBondContact O-N 3.31Å
1911	L	92.9	Very high	90.2	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.016	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	134.4	178.6	-71.6	163.1	0	0	0	112.7	V1895 V1908 R1909 F1917 I1935 K1938 A1940	V1895-L1911 HydrophobicContact CB-CD2 4.48Å; V1895-L1911 HydrophobicContact CG2-CD2 3.84Å; V1895-L1911 HydrophobicContact CG2-CG 4.24Å; V1908-L1911 HydrophobicContact CG1-CD1 4.36Å; V1908-L1911 WeakPolarHBondContact O-CB 3.16Å; V1908-L1911 WeakPolarHBondContact O-CD1 3.38Å; V1908-L1911 WeakPolarHBondContact O-CG 3.48Å; V1908-L1911 PolarHBondContact O-N 3.17Å; R1909-L1911 PolarHBondContact O-N 2.94Å; R1909-L1911 VanDerWaalsContact O-N 3.13Å; L1911-F1917 HydrophobicContact CD1-CB 4.01Å; L1911-F1917 HydrophobicContact CD1-CD2 3.88Å; L1911-F1917 HydrophobicContact CD1-CG 4.31Å; L1911-F1917 HydrophobicContact CD2-CB 4.3Å; L1911-F1917 HydrophobicContact CD2-CD2 4.15Å; L1911-F1917 HydrophobicContact CG-CD2 4.1Å; L1911-I1935 HydrophobicContact CD1-CG1 4.24Å; L1911-K1938 WeakPolarHBondContact O-CD 3.31Å; L1911-K1938 PolarHBondContact O-NZ 3Å; L1911-A1940 HydrophobicContact CD1-CB 4.36Å
1912	A	92.6	Very high	90	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	173.8	166.8	0	0	0	0	0	112.5	R1890 V1892 H1914 G1915	R1890-A1912 HydrophobicContact CG-CB 4.18Å; R1890-A1912 WeakPolarHBondContact O-CA 3.3Å; R1890-A1912 VanDerWaalsContact O-CB 3.3Å; R1890-A1912 WeakPolarHBondContact O-CB 3.38Å; V1892-A1912 VanDerWaalsContact O-CB 3.29Å; V1892-A1912 WeakPolarHBondContact O-CB 3.39Å; V1892-A1912 PolarHBondContact O-N 3.09Å; A1912-H1914 PolarHBondContact O-N 3.15Å; A1912-G1915 WeakPolarHBondContact O-CA 3.47Å; A1912-G1915 PolarHBondContact O-N 3Å
1913	Q	89	Confident	89.7	Confident	126 Å²	126	33.1 Å²	33.1	59%	0.589	15%	0.151	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-62.2	131.8	166.2	-160.6	176.4	1.3	0	0	109.7	G1915 K1938	Q1913-G1915 PolarHBondContact O-N 3.33Å; Q1913-K1938 WeakPolarHBondContact CA-O 3.34Å; Q1913-K1938 VanDerWaalsContact CG-O 3.24Å; Q1913-K1938 WeakPolarHBondContact CG-O 3.2Å
1914	H	91.4	Very high	89.1	Confident	102 Å²	102	31.9 Å²	31.9	47%	0.472	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	62	20.7	-167.3	-43.4	-69.5	0	0	0	115.1	A1912 R1916 K1938 N1939	A1912-H1914 PolarHBondContact O-N 3.15Å; H1914-R1916 PolarHBondContact O-NE 2.79Å; H1914-R1916 PolarHBondContact O-NH2 3.16Å; H1914-K1938 PolarHBondContact N-O 3.16Å; H1914-N1939 WeakPolarHBondContact CA-O 3.44Å; H1914-N1939 PolarHBondContact CE1-ND2 3.37Å; H1914-N1939 PolarHBondContact ND1-ND2 3.32Å
1915	G	92.1	Very high	88.6	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	146.2	174.5	0	0	0	0	0	112.8	D1893 A1912 Q1913 A1940 T1941	D1893-G1915 CarbonylContact O-C 3.57Å; D1893-G1915 VanDerWaalsContact O-CA 3.25Å; D1893-G1915 WeakPolarHBondContact O-CA 3.4Å; A1912-G1915 WeakPolarHBondContact O-CA 3.47Å; A1912-G1915 PolarHBondContact O-N 3Å; Q1913-G1915 PolarHBondContact O-N 3.33Å; G1915-A1940 CarbonylContact O-C 3.52Å; G1915-A1940 WeakPolarHBondContact O-CA 3.26Å; G1915-A1940 VanDerWaalsContact O-CB 3.28Å; G1915-A1940 WeakPolarHBondContact O-CB 2.96Å; G1915-T1941 PolarHBondContact O-N 2.87Å
1916	R	95.5	Very high	87.8	Confident	33 Å²	33	33.7 Å²	33.7	13%	0.125	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	125.7	172.9	-67.8	125	-79.8	165.3	-3.7	111.3	G1814 E1820 D1893 L1894 V1895 H1914 T1941	G1814-R1916 VanDerWaalsContact O-CD 3.3Å; G1814-R1916 WeakPolarHBondContact O-CD 3.48Å; E1820-R1916 VanDerWaalsContact CD-NH1 3.31Å; E1820-R1916 IonicContact OE1-CZ 3.2Å; E1820-R1916 VanDerWaalsContact OE1-CZ 3.23Å; E1820-R1916 IonicContact OE1-NH1 3.38Å; E1820-R1916 PolarHBondContact OE1-NH1 2.76Å; E1820-R1916 IonicContact OE1-NH2 2.7Å; E1820-R1916 PolarHBondContact OE1-NH2 2.87Å; E1820-R1916 IonicContact OE2-CZ 2.73Å; E1820-R1916 IonicContact OE2-NH1 2.72Å; E1820-R1916 PolarHBondContact OE2-NH1 3.48Å; D1893-R1916 PolarHBondContact O-N 3.41Å; D1893-R1916 PolarHBondContact O-NE 2.94Å; D1893-R1916 PolarHBondContact O-NH2 3.09Å; L1894-R1916 VanDerWaalsContact CA-O 3.31Å; L1894-R1916 WeakPolarHBondContact CA-O 3.47Å; L1894-R1916 HydrophobicContact CD2-CB 4.45Å; L1894-R1916 HydrophobicContact CG-CB 4.27Å; V1895-R1916 PolarHBondContact N-O 2.85Å; H1914-R1916 PolarHBondContact O-NE 2.79Å; H1914-R1916 PolarHBondContact O-NH2 3.16Å; R1916-T1941 WeakPolarHBondContact CG-OG1 3.25Å
1917	F	94.6	Very high	86.8	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	129.8	172.8	-153.2	-103.3	0	0	0	110.3	V1895 N1897 S1907 V1908 L1911 E1919 T1941 F1942 H1943	V1895-F1917 HydrophobicContact CB-CD2 3.69Å; V1895-F1917 HydrophobicContact CB-CE2 3.8Å; V1895-F1917 HydrophobicContact CG1-CD2 4.08Å; V1895-F1917 HydrophobicContact CG1-CE2 3.65Å; V1895-F1917 HydrophobicContact CG1-CZ 4.47Å; V1895-F1917 HydrophobicContact CG2-CD2 4.16Å; V1895-F1917 HydrophobicContact CG2-CE2 4.31Å; N1897-F1917 HydrophobicContact CB-CE1 3.78Å; N1897-F1917 HydrophobicContact CB-CE2 4.24Å; N1897-F1917 HydrophobicContact CB-CZ 3.48Å; N1897-F1917 VanDerWaalsContact CB-CZ 3.48Å; S1907-F1917 VanDerWaalsContact C-CE2 3.46Å; V1908-F1917 HydrophobicContact CB-CE2 4.34Å; V1908-F1917 HydrophobicContact CG2-CD1 4.2Å; V1908-F1917 HydrophobicContact CG2-CD2 4.01Å; V1908-F1917 HydrophobicContact CG2-CE1 3.82Å; V1908-F1917 HydrophobicContact CG2-CE2 3.67Å; V1908-F1917 HydrophobicContact CG2-CG 4.27Å; V1908-F1917 HydrophobicContact CG2-CZ 3.54Å; L1911-F1917 HydrophobicContact CD1-CB 4.01Å; L1911-F1917 HydrophobicContact CD1-CD2 3.88Å; L1911-F1917 HydrophobicContact CD1-CG 4.31Å; L1911-F1917 HydrophobicContact CD2-CB 4.3Å; L1911-F1917 HydrophobicContact CD2-CD2 4.15Å; L1911-F1917 HydrophobicContact CG-CD2 4.1Å; F1917-E1919 HydrophobicContact CD1-CB 4.43Å; F1917-E1919 HydrophobicContact CE1-CB 4.42Å; F1917-E1919 WeakPolarHBondContact CE1-OE2 3.48Å; F1917-T1941 PolarHBondContact N-O 3.33Å; F1917-F1942 HydrophobicContact CB-CD2 3.89Å; F1917-F1942 HydrophobicContact CB-CE2 4.44Å; F1917-F1942 HydrophobicContact CB-CG 4.35Å; F1917-F1942 AromaticContact CD1-CD2 3.55Å; F1917-F1942 HydrophobicContact CD1-CD2 3.55Å; F1917-F1942 AromaticContact CD1-CE2 3.2Å; F1917-F1942 HydrophobicContact CD1-CE2 3.2Å; F1917-F1942 HydrophobicContact CD1-CG 4.36Å; F1917-F1942 AromaticContact CD1-CZ 3.75Å; F1917-F1942 HydrophobicContact CD1-CZ 3.75Å; F1917-F1942 HydrophobicContact CE1-CD2 4.37Å; F1917-F1942 AromaticContact CE1-CE2 3.61Å; F1917-F1942 HydrophobicContact CE1-CE2 3.61Å; F1917-F1942 HydrophobicContact CE1-CZ 4.02Å; F1917-F1942 AromaticContact CG-CD2 3.98Å; F1917-F1942 HydrophobicContact CG-CD2 3.98Å; F1917-F1942 HydrophobicContact CG-CE2 4.04Å; F1917-H1943 PolarHBondContact O-N 3.3Å
1918	L	94.7	Very high	85.9	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	102.8	-178.5	-51.5	173.5	0	0	0	107.9	A1809 L1810 L1894 V1895 L1896 N1897 H1943 I1945	A1809-L1918 HydrophobicContact CB-CD1 4.38Å; A1809-L1918 WeakPolarHBondContact O-CD1 3.19Å; L1810-L1918 HydrophobicContact CD2-CD1 3.86Å; L1894-L1918 HydrophobicContact CD2-CD1 4.06Å; V1895-L1918 WeakPolarHBondContact O-CB 3.19Å; V1895-L1918 PolarHBondContact O-N 3.11Å; L1896-L1918 HydrophobicContact CD1-CB 3.87Å; N1897-L1918 PolarHBondContact N-O 3.18Å; L1918-H1943 HydrophobicContact CD2-CB 4.14Å; L1918-I1945 HydrophobicContact CB-CG1 4.25Å; L1918-I1945 HydrophobicContact CD2-CD1 4.34Å
1919	E	91.8	Very high	85.2	Confident	3 Å²	3	41.5 Å²	41.5	1%	0.014	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	111.5	-176.2	-174.2	56.4	-95.1	0	0	110.5	N1897 L1904 F1917 G1921 L1925 F1942 H1943 I1945	N1897-E1919 PolarHBondContact ND2-OE1 3.09Å; N1897-E1919 PolarHBondContact ND2-OE2 3.23Å; L1904-E1919 VanDerWaalsContact CD1-OE2 3.29Å; L1904-E1919 WeakPolarHBondContact CD1-OE2 3.46Å; F1917-E1919 HydrophobicContact CD1-CB 4.43Å; F1917-E1919 HydrophobicContact CE1-CB 4.42Å; F1917-E1919 WeakPolarHBondContact CE1-OE2 3.48Å; E1919-G1921 VanDerWaalsContact OE1-CA 3.31Å; E1919-G1921 WeakPolarHBondContact OE1-CA 3.37Å; E1919-G1921 PolarHBondContact OE1-N 3Å; E1919-L1925 HydrophobicContact CG-CD1 4.16Å; E1919-L1925 HydrophobicContact CG-CG 4.45Å; E1919-F1942 HydrophobicContact CB-CE1 4.09Å; E1919-F1942 HydrophobicContact CB-CZ 4.07Å; E1919-F1942 HydrophobicContact CG-CZ 4.42Å; E1919-H1943 PolarHBondContact N-O 2.81Å; E1919-I1945 WeakPolarHBondContact O-CB 3.39Å; E1919-I1945 PolarHBondContact O-N 3.09Å
1920	I	90.1	Very high	84.5	Confident	44 Å²	44	44.5 Å²	44.5	23%	0.226	23%	0.23	C	C	.	.			trans	-100.9	-7.8	170.1	58.7	158.6	0	0	0	112.5	T1805 V1831 L1896 N1897 I1945	T1805-I1920 HydrophobicContact CG2-CG2 4.04Å; V1831-I1920 HydrophobicContact CB-CD1 4.5Å; V1831-I1920 HydrophobicContact CG1-CD1 4.01Å; L1896-I1920 HydrophobicContact CD1-CG1 4.37Å; L1896-I1920 HydrophobicContact CD1-CG2 4Å; N1897-I1920 WeakPolarHBondContact O-CG1 2.94Å; N1897-I1920 PolarHBondContact O-N 3.09Å; N1897-I1920 VanDerWaalsContact O-N 3.14Å; I1920-I1945 HydrophobicContact CG2-CB 3.73Å; I1920-I1945 HydrophobicContact CG2-CG1 4.3Å; I1920-I1945 HydrophobicContact CG2-CG2 3.83Å
1921	G	82.7	Confident	84	Confident	21 Å²	21	46.9 Å²	46.9	22%	0.216	24%	0.242	C	C	.	.			trans	-73.6	126.1	172.9	0	0	0	0	0	111.9	E1919	E1919-G1921 VanDerWaalsContact OE1-CA 3.31Å; E1919-G1921 WeakPolarHBondContact OE1-CA 3.37Å; E1919-G1921 PolarHBondContact OE1-N 3Å
1922	K	79.2	Confident	83.3	Confident	31 Å²	31	48.7 Å²	48.7	14%	0.135	26%	0.261	C	S	.	.			trans	-92.6	-11.3	-178.5	-63	-166.2	178.7	-165.4	0	115.1	L1734 A1926 L1946 D1948	L1734-K1922 HydrophobicContact CD1-CB 3.96Å; L1734-K1922 HydrophobicContact CD2-CB 4.38Å; L1734-K1922 HydrophobicContact CD2-CD 3.96Å; K1922-A1926 WeakPolarHBondContact O-CB 3.48Å; K1922-A1926 PolarHBondContact O-N 3.37Å; K1922-L1946 HydrophobicContact CD-CD2 4.24Å; K1922-L1946 HydrophobicContact CG-CD2 4.23Å; K1922-D1948 IonicContact NZ-OD1 3.56Å; K1922-D1948 IonicContact NZ-OD2 3.42Å; K1922-D1948 PolarHBondContact NZ-OD2 2.98Å
1923	Y	76	Confident	83	Confident	99 Å²	99	55 Å²	55	39%	0.388	29%	0.293	S	S	.	.	H	α-helix	trans	-68.2	-60.9	-171.9	-176	-109.2	0	0	0	112	M1728 E1901 L1925 A1926 A1927	M1728-Y1923 HydrophobicContact CE-CD2 4.39Å; E1901-Y1923 HydrophobicContact CG-CE1 4.37Å; Y1923-L1925 PolarHBondContact O-N 2.78Å; Y1923-A1926 PolarHBondContact O-N 2.96Å; Y1923-A1927 WeakPolarHBondContact O-CB 3.28Å; Y1923-A1927 PolarHBondContact O-N 2.95Å
1924	D	76.5	Confident	82.7	Confident	12 Å²	12	53.4 Å²	53.4	6%	0.064	30%	0.295	C	S	.	.	H	α-helix	trans	-61.7	-29.3	178.2	-66.4	-99.5	0	0	0	113.5	S1900 E1901 L1904 D1928 S1929	S1900-D1924 WeakPolarHBondContact CA-OD2 3.49Å; S1900-D1924 WeakPolarHBondContact CB-OD2 3.34Å; E1901-D1924 PolarHBondContact N-OD1 2.62Å; E1901-D1924 VanDerWaalsContact N-OD1 3.09Å; E1901-D1924 PolarHBondContact N-OD2 2.78Å; L1904-D1924 HydrophobicContact CD1-CB 3.66Å; D1924-D1928 WeakPolarHBondContact O-CA 3.39Å; D1924-D1928 PolarHBondContact O-N 3.28Å; D1924-S1929 WeakPolarHBondContact CB-OG 3.3Å; D1924-S1929 PolarHBondContact O-N 3.18Å; D1924-S1929 VanDerWaalsContact O-N 3.07Å; D1924-S1929 WeakPolarHBondContact OD1-CB 3.35Å; D1924-S1929 PolarHBondContact OD1-OG 2.91Å
1925	L	76.3	Confident	82.3	Confident	83 Å²	83	49.4 Å²	49.4	44%	0.435	28%	0.277	S	S	.	.	H	α-helix	trans	-69.4	-33.8	172.2	-72.3	174.5	0	0	0	112.9	E1919 Y1923	E1919-L1925 HydrophobicContact CG-CD1 4.16Å; E1919-L1925 HydrophobicContact CG-CG 4.45Å; Y1923-L1925 PolarHBondContact O-N 2.78Å
1926	A	71	Confident	82.1	Confident	30 Å²	30	53 Å²	53	25%	0.248	29%	0.293	C	S	.	.	H	α-helix	trans	-82.6	-26.7	175.9	0	0	0	0	0	112.9	L1734 S1738 K1922 Y1923	L1734-A1926 HydrophobicContact CD1-CB 3.98Å; S1738-A1926 WeakPolarHBondContact OG-CB 3.13Å; K1922-A1926 WeakPolarHBondContact O-CB 3.48Å; K1922-A1926 PolarHBondContact O-N 3.37Å; Y1923-A1926 PolarHBondContact O-N 2.96Å
1927	A	69	Low	81.7	Confident	48 Å²	48	58.9 Å²	58.9	40%	0.397	33%	0.326	S	S	.	.	H	α-helix	trans	-84.5	-18.7	175.5	0	0	0	0	0	113.8	Y1923	Y1923-A1927 WeakPolarHBondContact O-CB 3.28Å; Y1923-A1927 PolarHBondContact O-N 2.95Å
1928	D	74.2	Confident	81.3	Confident	79 Å²	79	62.1 Å²	62.1	42%	0.422	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	53.8	-171.5	-153.4	1	0	0	0	113.4	R1176 D1924 K1930	R1176-D1928 IonicContact CZ-OD2 2.75Å; R1176-D1928 VanDerWaalsContact NH1-CB 3.27Å; R1176-D1928 IonicContact NH1-OD2 2.82Å; R1176-D1928 PolarHBondContact NH1-OD2 2.82Å; R1176-D1928 IonicContact NH2-OD2 2.71Å; R1176-D1928 PolarHBondContact NH2-OD2 3.33Å; D1924-D1928 WeakPolarHBondContact O-CA 3.39Å; D1924-D1928 PolarHBondContact O-N 3.28Å; D1928-K1930 PolarHBondContact O-N 2.72Å
1929	S	74.7	Confident	81	Confident	46 Å²	46	67 Å²	67	32%	0.322	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-61.5	120.8	175.8	-62.7	0	0	0	0	111.3	D1924 L1931	D1924-S1929 WeakPolarHBondContact CB-OG 3.3Å; D1924-S1929 PolarHBondContact O-N 3.18Å; D1924-S1929 VanDerWaalsContact O-N 3.07Å; D1924-S1929 WeakPolarHBondContact OD1-CB 3.35Å; D1924-S1929 PolarHBondContact OD1-OG 2.91Å; S1929-L1931 PolarHBondContact O-N 3.43Å
1930	K	76.1	Confident	80.8	Confident	174 Å²	174	67.2 Å²	67.2	76%	0.757	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-55.7	120.3	-176.7	-67.8	-179.6	177.9	176.3	0	112.8	H1905 D1928	H1905-K1930 PolarHBondContact CE1-O 3.43Å; D1928-K1930 PolarHBondContact O-N 2.72Å
1931	L	82.4	Confident	80.9	Confident	51 Å²	51	67.8 Å²	67.8	27%	0.267	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-89.3	137.3	176.6	-171.9	63.7	0	0	0	112.6	V1908 S1929 M1933 F1936 F1942	V1908-L1931 HydrophobicContact CG1-CD1 4.23Å; V1908-L1931 HydrophobicContact CG2-CD1 4.12Å; S1929-L1931 PolarHBondContact O-N 3.43Å; L1931-M1933 PolarHBondContact O-N 2.95Å; L1931-F1936 HydrophobicContact CD2-CE2 3.94Å; L1931-F1936 HydrophobicContact CD2-CZ 3.8Å; L1931-F1942 HydrophobicContact CD1-CE2 4.19Å; L1931-F1942 HydrophobicContact CD2-CD2 3.77Å; L1931-F1942 HydrophobicContact CD2-CE2 4.03Å; L1931-F1942 HydrophobicContact CD2-CG 4.22Å
1932	G	80.2	Confident	81.3	Confident	40 Å²	40	69.6 Å²	69.6	41%	0.412	38%	0.376	S	S	.	.			trans	-72.9	90.7	177.5	0	0	0	0	0	112.9	S1934 I1935	G1932-S1934 PolarHBondContact O-N 3.14Å; G1932-I1935 WeakPolarHBondContact O-CG2 3.44Å; G1932-I1935 PolarHBondContact O-N 2.96Å
1933	M	84.5	Confident	81.8	Confident	134 Å²	134	70.7 Å²	70.7	66%	0.66	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-54.5	-21.5	-173.7	-66.5	-59.9	-67.9	0	0	115.6	L1931 I1935 F1936	L1931-M1933 PolarHBondContact O-N 2.95Å; M1933-I1935 PolarHBondContact O-N 3.49Å; M1933-I1935 VanDerWaalsContact O-N 3.17Å; M1933-F1936 HydrophobicContact CE-CD2 3.77Å; M1933-F1936 HydrophobicContact CE-CE2 3.91Å; M1933-F1936 WeakPolarHBondContact O-CD2 3.48Å; M1933-F1936 PolarHBondContact O-N 3.01Å; M1933-F1936 VanDerWaalsContact O-N 3.16Å; M1933-F1936 HydrophobicContact SD-CD2 3.93Å; M1933-F1936 HydrophobicContact SD-CE2 3.65Å
1934	S	83.7	Confident	82.4	Confident	91 Å²	91	67.4 Å²	67.4	64%	0.636	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-60.9	-20.1	174.2	54.4	0	0	0	0	113.7	G1932 F1936 L1937	G1932-S1934 PolarHBondContact O-N 3.14Å; S1934-F1936 PolarHBondContact O-N 3.2Å; S1934-L1937 WeakPolarHBondContact O-CB 3.26Å; S1934-L1937 WeakPolarHBondContact O-CG 3.38Å; S1934-L1937 PolarHBondContact O-N 2.97Å
1935	I	83.4	Confident	83	Confident	19 Å²	19	67.1 Å²	67.1	10%	0.097	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-61.5	-30.9	174.9	-162.4	69.7	0	0	0	112.4	V1908 L1911 G1932 M1933 L1937 K1938	V1908-I1935 HydrophobicContact CG1-CB 4.2Å; V1908-I1935 HydrophobicContact CG1-CD1 4.2Å; V1908-I1935 HydrophobicContact CG1-CG1 3.79Å; V1908-I1935 HydrophobicContact CG1-CG2 4.2Å; L1911-I1935 HydrophobicContact CD1-CG1 4.24Å; G1932-I1935 WeakPolarHBondContact O-CG2 3.44Å; G1932-I1935 PolarHBondContact O-N 2.96Å; M1933-I1935 PolarHBondContact O-N 3.49Å; M1933-I1935 VanDerWaalsContact O-N 3.17Å; I1935-L1937 PolarHBondContact O-N 3.31Å; I1935-K1938 HydrophobicContact CD1-CD 3.82Å; I1935-K1938 VanDerWaalsContact O-CB 3.29Å; I1935-K1938 WeakPolarHBondContact O-CB 3.4Å; I1935-K1938 PolarHBondContact O-N 3.15Å
1936	F	87.4	Confident	83.4	Confident	75 Å²	75	65.5 Å²	65.5	33%	0.329	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-68.3	-14.3	-179.8	-63.3	-68.7	0	0	0	113	L1931 M1933 S1934 K1938 N1939 A1940 F1942	L1931-F1936 HydrophobicContact CD2-CE2 3.94Å; L1931-F1936 HydrophobicContact CD2-CZ 3.8Å; M1933-F1936 HydrophobicContact CE-CD2 3.77Å; M1933-F1936 HydrophobicContact CE-CE2 3.91Å; M1933-F1936 WeakPolarHBondContact O-CD2 3.48Å; M1933-F1936 PolarHBondContact O-N 3.01Å; M1933-F1936 VanDerWaalsContact O-N 3.16Å; M1933-F1936 HydrophobicContact SD-CD2 3.93Å; M1933-F1936 HydrophobicContact SD-CE2 3.65Å; S1934-F1936 PolarHBondContact O-N 3.2Å; F1936-K1938 PolarHBondContact O-N 2.75Å; F1936-N1939 WeakPolarHBondContact O-CA 3.48Å; F1936-N1939 PolarHBondContact O-N 2.86Å; F1936-A1940 WeakPolarHBondContact CD1-O 3.44Å; F1936-F1942 HydrophobicContact CE1-CB 4.1Å; F1936-F1942 HydrophobicContact CZ-CB 4.1Å
1937	L	86.4	Confident	84.1	Confident	156 Å²	156	64.8 Å²	64.8	82%	0.817	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-65.1	-20.5	168.8	-59.3	175.9	0	0	0	112.8	S1934 I1935 N1939	S1934-L1937 WeakPolarHBondContact O-CB 3.26Å; S1934-L1937 WeakPolarHBondContact O-CG 3.38Å; S1934-L1937 PolarHBondContact O-N 2.97Å; I1935-L1937 PolarHBondContact O-N 3.31Å; L1937-N1939 PolarHBondContact O-N 3.31Å
1938	K	85.9	Confident	84.7	Confident	69 Å²	69	63 Å²	63	30%	0.3	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-71.5	1.1	167.2	-66.4	-173.7	178.6	176	0	112.9	R1909 L1911 Q1913 H1914 I1935 F1936 A1940	R1909-K1938 PolarHBondContact O-NZ 2.71Å; L1911-K1938 WeakPolarHBondContact O-CD 3.31Å; L1911-K1938 PolarHBondContact O-NZ 3Å; Q1913-K1938 WeakPolarHBondContact CA-O 3.34Å; Q1913-K1938 VanDerWaalsContact CG-O 3.24Å; Q1913-K1938 WeakPolarHBondContact CG-O 3.2Å; H1914-K1938 PolarHBondContact N-O 3.16Å; I1935-K1938 HydrophobicContact CD1-CD 3.82Å; I1935-K1938 VanDerWaalsContact O-CB 3.29Å; I1935-K1938 WeakPolarHBondContact O-CB 3.4Å; I1935-K1938 PolarHBondContact O-N 3.15Å; F1936-K1938 PolarHBondContact O-N 2.75Å; K1938-A1940 HydrophobicContact CB-CB 4.28Å; K1938-A1940 PolarHBondContact O-N 3.43Å
1939	N	88.7	Confident	85	Confident	103 Å²	103	60.7 Å²	60.7	55%	0.551	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	39	-165.7	-167.5	16.8	0	0	0	111.9	H1914 F1936 L1937	H1914-N1939 WeakPolarHBondContact CA-O 3.44Å; H1914-N1939 PolarHBondContact CE1-ND2 3.37Å; H1914-N1939 PolarHBondContact ND1-ND2 3.32Å; F1936-N1939 WeakPolarHBondContact O-CA 3.48Å; F1936-N1939 PolarHBondContact O-N 2.86Å; L1937-N1939 PolarHBondContact O-N 3.31Å
1940	A	89.2	Confident	85.6	Confident	7 Å²	7	58.7 Å²	58.7	6%	0.058	32%	0.319	C	S	.	.			trans	-82.6	157.3	175.1	0	0	0	0	0	110.3	L1911 G1915 F1936 K1938	L1911-A1940 HydrophobicContact CD1-CB 4.36Å; G1915-A1940 CarbonylContact O-C 3.52Å; G1915-A1940 WeakPolarHBondContact O-CA 3.26Å; G1915-A1940 VanDerWaalsContact O-CB 3.28Å; G1915-A1940 WeakPolarHBondContact O-CB 2.96Å; F1936-A1940 WeakPolarHBondContact CD1-O 3.44Å; K1938-A1940 HydrophobicContact CB-CB 4.28Å; K1938-A1940 PolarHBondContact O-N 3.43Å
1941	T	91.2	Very high	85.8	Confident	55 Å²	55	52.3 Å²	52.3	34%	0.337	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	150.2	174.4	63.4	0	0	0	0	111.2	G1915 R1916 F1917 H1943	G1915-T1941 PolarHBondContact O-N 2.87Å; R1916-T1941 WeakPolarHBondContact CG-OG1 3.25Å; F1917-T1941 PolarHBondContact N-O 3.33Å; T1941-H1943 WeakPolarHBondContact CB-NE2 3.48Å; T1941-H1943 PolarHBondContact OG1-NE2 2.97Å
1942	F	90.9	Very high	85.5	Confident	60 Å²	60	55.1 Å²	55.1	26%	0.263	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	127.6	178.2	-167.6	-74.8	0	0	0	108.9	V1908 F1917 E1919 L1931 F1936	V1908-F1942 HydrophobicContact CG2-CE2 4.17Å; F1917-F1942 HydrophobicContact CB-CD2 3.89Å; F1917-F1942 HydrophobicContact CB-CE2 4.44Å; F1917-F1942 HydrophobicContact CB-CG 4.35Å; F1917-F1942 AromaticContact CD1-CD2 3.55Å; F1917-F1942 HydrophobicContact CD1-CD2 3.55Å; F1917-F1942 AromaticContact CD1-CE2 3.2Å; F1917-F1942 HydrophobicContact CD1-CE2 3.2Å; F1917-F1942 HydrophobicContact CD1-CG 4.36Å; F1917-F1942 AromaticContact CD1-CZ 3.75Å; F1917-F1942 HydrophobicContact CD1-CZ 3.75Å; F1917-F1942 HydrophobicContact CE1-CD2 4.37Å; F1917-F1942 AromaticContact CE1-CE2 3.61Å; F1917-F1942 HydrophobicContact CE1-CE2 3.61Å; F1917-F1942 HydrophobicContact CE1-CZ 4.02Å; F1917-F1942 AromaticContact CG-CD2 3.98Å; F1917-F1942 HydrophobicContact CG-CD2 3.98Å; F1917-F1942 HydrophobicContact CG-CE2 4.04Å; E1919-F1942 HydrophobicContact CB-CE1 4.09Å; E1919-F1942 HydrophobicContact CB-CZ 4.07Å; E1919-F1942 HydrophobicContact CG-CZ 4.42Å; L1931-F1942 HydrophobicContact CD1-CE2 4.19Å; L1931-F1942 HydrophobicContact CD2-CD2 3.77Å; L1931-F1942 HydrophobicContact CD2-CE2 4.03Å; L1931-F1942 HydrophobicContact CD2-CG 4.22Å; F1936-F1942 HydrophobicContact CE1-CB 4.1Å; F1936-F1942 HydrophobicContact CZ-CB 4.1Å
1943	H	90.5	Very high	85.1	Confident	53 Å²	53	58.9 Å²	58.9	25%	0.245	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	114.8	-176.9	-56.1	-84.6	0	0	0	110.5	F1917 L1918 E1919 T1941 I1945	F1917-H1943 PolarHBondContact O-N 3.3Å; L1918-H1943 HydrophobicContact CD2-CB 4.14Å; E1919-H1943 PolarHBondContact N-O 2.81Å; T1941-H1943 WeakPolarHBondContact CB-NE2 3.48Å; T1941-H1943 PolarHBondContact OG1-NE2 2.97Å; H1943-I1945 HydrophobicContact CB-CD1 3.99Å
1944	G	87.6	Confident	84.6	Confident	31 Å²	31	59.9 Å²	59.9	32%	0.32	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	131.7	163.6	0	0	0	0	0	110.6
1945	I	89	Confident	84.6	Confident	6 Å²	6	57.1 Å²	57.1	3%	0.031	31%	0.307	C	S	.	.			trans	-116.1	93.6	-174.6	-51.2	-59.2	0	0	0	109.5	Y1808 A1809 R1813 L1918 E1919 I1920 H1943	Y1808-I1945 HydrophobicContact CD1-CG2 3.62Å; Y1808-I1945 HydrophobicContact CE1-CG2 3.93Å; A1809-I1945 HydrophobicContact CB-CG1 4.34Å; A1809-I1945 HydrophobicContact CB-CG2 4.11Å; R1813-I1945 HydrophobicContact CB-CD1 3.73Å; R1813-I1945 HydrophobicContact CG-CD1 3.89Å; L1918-I1945 HydrophobicContact CB-CG1 4.25Å; L1918-I1945 HydrophobicContact CD2-CD1 4.34Å; E1919-I1945 WeakPolarHBondContact O-CB 3.39Å; E1919-I1945 PolarHBondContact O-N 3.09Å; I1920-I1945 HydrophobicContact CG2-CB 3.73Å; I1920-I1945 HydrophobicContact CG2-CG1 4.3Å; I1920-I1945 HydrophobicContact CG2-CG2 3.83Å; H1943-I1945 HydrophobicContact CB-CD1 3.99Å
1946	L	85.3	Confident	84.7	Confident	49 Å²	49	63.8 Å²	63.8	26%	0.257	34%	0.337	S	S	.	.			trans	-104.9	110.1	175.7	-58.3	178	0	0	0	109.5	P1740 K1922 D1948	P1740-L1946 HydrophobicContact CG-CD1 4.01Å; K1922-L1946 HydrophobicContact CD-CD2 4.24Å; K1922-L1946 HydrophobicContact CG-CD2 4.23Å; L1946-D1948 PolarHBondContact O-N 3.48Å
1947	L	85	Confident	84.7	Confident	15 Å²	15	62.7 Å²	62.7	8%	0.079	33%	0.333	C	S	.	.	S	Bend	trans	-65.6	-31.8	176	-170.6	74.1	0	0	0	111.3	M1752 V1801 S1949 L1950	M1752-L1947 HydrophobicContact CE-CD2 4.23Å; V1801-L1947 HydrophobicContact CG1-CD2 4.4Å; V1801-L1947 HydrophobicContact CG2-CD2 4.43Å; L1947-S1949 VanDerWaalsContact C-N 3.28Å; L1947-S1949 PolarHBondContact O-N 3.38Å; L1947-L1950 HydrophobicContact CD1-CD1 4.07Å; L1947-L1950 WeakPolarHBondContact O-CB 3.44Å; L1947-L1950 PolarHBondContact O-N 2.97Å
1948	D	81.4	Confident	84.9	Confident	11 Å²	11	55.6 Å²	55.6	6%	0.059	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-63	-32.7	-174.2	-39.2	-113.8	0	0	0	112.2	R1725 I1739 K1922 L1946 L1950 F1951	R1725-D1948 WeakPolarHBondContact CD-OD1 3.31Å; R1725-D1948 IonicContact CZ-OD1 2.87Å; R1725-D1948 IonicContact NH1-OD1 3.31Å; R1725-D1948 PolarHBondContact NH1-OD1 2.8Å; I1739-D1948 HydrophobicContact CG2-CB 4.4Å; K1922-D1948 IonicContact NZ-OD1 3.56Å; K1922-D1948 IonicContact NZ-OD2 3.42Å; K1922-D1948 PolarHBondContact NZ-OD2 2.98Å; L1946-D1948 PolarHBondContact O-N 3.48Å; D1948-L1950 PolarHBondContact O-N 2.96Å; D1948-F1951 WeakPolarHBondContact O-CD2 3.38Å; D1948-F1951 PolarHBondContact O-N 3.29Å
1949	S	82.1	Confident	84.9	Confident	30 Å²	30	56.1 Å²	56.1	21%	0.21	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-65.7	-12.6	174.5	-59	0	0	0	0	114.1	P1740 L1947 F1951 N1955	P1740-S1949 WeakPolarHBondContact CG-OG 3.22Å; L1947-S1949 VanDerWaalsContact C-N 3.28Å; L1947-S1949 PolarHBondContact O-N 3.38Å; S1949-F1951 VanDerWaalsContact C-N 3.29Å; S1949-N1955 PolarHBondContact O-ND2 2.73Å
1950	L	86	Confident	85	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.016	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-80	-9.1	175	-57.8	-172.8	0	0	0	113.3	Y1808 L1947 D1948 E1952 E1957 W1958 V1961	Y1808-L1950 HydrophobicContact CD1-CD1 4.16Å; Y1808-L1950 HydrophobicContact CD2-CD1 4.15Å; Y1808-L1950 HydrophobicContact CE1-CD1 4.38Å; Y1808-L1950 HydrophobicContact CE1-CD2 4.48Å; Y1808-L1950 HydrophobicContact CE1-CG 4.47Å; Y1808-L1950 HydrophobicContact CE2-CD1 4.39Å; Y1808-L1950 HydrophobicContact CE2-CD2 4.03Å; Y1808-L1950 HydrophobicContact CG-CD1 4.05Å; L1947-L1950 HydrophobicContact CD1-CD1 4.07Å; L1947-L1950 WeakPolarHBondContact O-CB 3.44Å; L1947-L1950 PolarHBondContact O-N 2.97Å; D1948-L1950 PolarHBondContact O-N 2.96Å; L1950-E1952 VanDerWaalsContact C-N 3.3Å; L1950-E1957 HydrophobicContact CD2-CB 4Å; L1950-W1958 HydrophobicContact CB-CB 4.29Å; L1950-W1958 HydrophobicContact CB-CE3 4.15Å; L1950-W1958 HydrophobicContact CD1-CE3 4.27Å; L1950-V1961 HydrophobicContact CD1-CG2 4.21Å
1951	F	82.1	Confident	85.1	Confident	41 Å²	41	56 Å²	56	18%	0.18	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-82.4	-3.2	173.2	-65.8	-73.1	0	0	0	113.7	M1752 L1767 L1768 P1769 F1783 D1948 S1949	M1752-F1951 HydrophobicContact CE-CE2 3.96Å; L1767-F1951 HydrophobicContact CB-CE1 4.05Å; L1767-F1951 HydrophobicContact CB-CZ 4Å; L1768-F1951 WeakPolarHBondContact O-CZ 3.38Å; P1769-F1951 HydrophobicContact CB-CB 4.49Å; P1769-F1951 HydrophobicContact CB-CD1 4.43Å; P1769-F1951 HydrophobicContact CB-CD2 3.89Å; P1769-F1951 HydrophobicContact CB-CE2 4.18Å; P1769-F1951 HydrophobicContact CB-CG 4.04Å; F1783-F1951 AromaticContact CD1-CD1 3.65Å; F1783-F1951 HydrophobicContact CD1-CD1 3.65Å; F1783-F1951 AromaticContact CD1-CE1 3.53Å; F1783-F1951 HydrophobicContact CD1-CE1 3.53Å; F1783-F1951 HydrophobicContact CD2-CD1 4.43Å; F1783-F1951 AromaticContact CE1-CD1 3.45Å; F1783-F1951 HydrophobicContact CE1-CD1 3.45Å; F1783-F1951 VanDerWaalsContact CE1-CD1 3.45Å; F1783-F1951 AromaticContact CE1-CE1 3.79Å; F1783-F1951 HydrophobicContact CE1-CE1 3.79Å; F1783-F1951 HydrophobicContact CE1-CG 4.3Å; F1783-F1951 HydrophobicContact CE2-CD1 4.26Å; F1783-F1951 HydrophobicContact CG-CD1 4.16Å; F1783-F1951 HydrophobicContact CG-CE1 4.05Å; F1783-F1951 AromaticContact CZ-CD1 3.79Å; F1783-F1951 HydrophobicContact CZ-CD1 3.79Å; D1948-F1951 WeakPolarHBondContact O-CD2 3.38Å; D1948-F1951 PolarHBondContact O-N 3.29Å; S1949-F1951 VanDerWaalsContact C-N 3.29Å
1952	E	75	Confident	85.1	Confident	110 Å²	110	54.9 Å²	54.9	51%	0.514	29%	0.285	S	S	.	.	S	Bend	trans	-65.9	139.9	176.6	-70.6	-179.8	-170.1	0	0	111.8	L1950 N1954 N1955	L1950-E1952 VanDerWaalsContact C-N 3.3Å; E1952-N1954 PolarHBondContact O-N 3.46Å; E1952-N1955 WeakPolarHBondContact O-CB 3.47Å; E1952-N1955 PolarHBondContact O-N 2.67Å
1953	P	71.5	Confident	85.2	Confident	118 Å²	118	56.1 Å²	56.1	77%	0.766	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	136.3	179.3	-26.2	34.9	0	0	0	112.7	N1955	P1953-N1955 VanDerWaalsContact C-N 3.28Å; P1953-N1955 PolarHBondContact O-N 2.91Å
1954	N	74.9	Confident	85.3	Confident	155 Å²	155	54.8 Å²	54.8	83%	0.829	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	19.5	178.7	-50.4	-43	0	0	0	115.9	E1952 H1956	E1952-N1954 PolarHBondContact O-N 3.46Å; N1954-H1956 PolarHBondContact O-N 3.37Å
1955	N	82.3	Confident	85.5	Confident	34 Å²	34	53.3 Å²	53.3	18%	0.182	27%	0.274	C	S	.	.			trans	-62.7	119.9	175.9	-171.4	-43.3	0	0	0	112.1	S1949 E1952 P1953 E1957 W1958	S1949-N1955 PolarHBondContact O-ND2 2.73Å; E1952-N1955 WeakPolarHBondContact O-CB 3.47Å; E1952-N1955 PolarHBondContact O-N 2.67Å; P1953-N1955 VanDerWaalsContact C-N 3.28Å; P1953-N1955 PolarHBondContact O-N 2.91Å; N1955-E1957 WeakPolarHBondContact OD1-CA 3.17Å; N1955-E1957 WeakPolarHBondContact OD1-CB 3.36Å; N1955-E1957 PolarHBondContact OD1-N 2.95Å; N1955-W1958 HydrophobicContact CB-CB 4.29Å; N1955-W1958 PolarHBondContact OD1-N 2.71Å
1956	H	85.3	Confident	85.6	Confident	158 Å²	158	55.1 Å²	55.1	73%	0.731	28%	0.284	S	S	*	.	H	α-helix	trans	-76.4	-30.7	179.6	-74.7	-72.7	0	0	0	114.2	N1954 W1958 Q1959 M1960	N1954-H1956 PolarHBondContact O-N 3.37Å; H1956-W1958 VanDerWaalsContact C-N 3.28Å; H1956-W1958 PolarHBondContact O-N 3.09Å; H1956-Q1959 PolarHBondContact O-N 3.21Å; H1956-M1960 PolarHBondContact O-N 3.32Å
1957	E	88.4	Confident	85.8	Confident	52 Å²	52	59.1 Å²	59.1	24%	0.243	30%	0.295	C	S	.	.	H	α-helix	trans	-66.4	-34.1	176.7	-67.1	-170.6	127.9	0	0	110.8	Y1808 V1812 R1813 L1950 N1955 Q1959 M1960 V1961	Y1808-E1957 HydrophobicContact CE2-CB 4.28Å; Y1808-E1957 PolarHBondContact OH-OE2 2.89Å; V1812-E1957 HydrophobicContact CG1-CG 4.39Å; R1813-E1957 WeakPolarHBondContact CD-OE1 3.12Å; R1813-E1957 IonicContact CZ-OE1 3.82Å; R1813-E1957 IonicContact CZ-OE2 2.73Å; R1813-E1957 IonicContact NE-OE1 2.73Å; R1813-E1957 IonicContact NH1-OE1 2.63Å; R1813-E1957 PolarHBondContact NH1-OE1 3.31Å; R1813-E1957 IonicContact NH1-OE2 2.68Å; R1813-E1957 PolarHBondContact NH1-OE2 3.17Å; L1950-E1957 HydrophobicContact CD2-CB 4Å; N1955-E1957 WeakPolarHBondContact OD1-CA 3.17Å; N1955-E1957 WeakPolarHBondContact OD1-CB 3.36Å; N1955-E1957 PolarHBondContact OD1-N 2.95Å; E1957-Q1959 VanDerWaalsContact C-N 3.34Å; E1957-Q1959 PolarHBondContact O-N 2.79Å; E1957-M1960 WeakPolarHBondContact O-CB 3.31Å; E1957-M1960 PolarHBondContact O-N 3.13Å; E1957-M1960 VanDerWaalsContact O-N 3.15Å; E1957-V1961 WeakPolarHBondContact O-CG2 3.34Å; E1957-V1961 PolarHBondContact O-N 3.18Å
1958	W	89.8	Confident	86.1	Confident	8 Å²	8	58.5 Å²	58.5	3%	0.03	29%	0.293	C	S	.	.	H	α-helix	trans	-54.7	-47.7	172.5	170.7	-113.4	0	0	0	112.4	L1767 N1782 F1783 W1785 T1804 L1950 N1955 H1956 M1960 V1961 K1962	L1767-W1958 HydrophobicContact CD1-CH2 3.95Å; L1767-W1958 HydrophobicContact CD1-CZ3 3.97Å; N1782-W1958 WeakPolarHBondContact O-CZ2 3.46Å; F1783-W1958 HydrophobicContact CB-CZ2 4.45Å; F1783-W1958 HydrophobicContact CD1-CD2 4.04Å; F1783-W1958 AromaticContact CD1-CE2 3.57Å; F1783-W1958 HydrophobicContact CD1-CE3 4.27Å; F1783-W1958 AromaticContact CD1-CH2 3.67Å; F1783-W1958 HydrophobicContact CD1-CH2 3.67Å; F1783-W1958 AromaticContact CD1-CZ2 3.41Å; F1783-W1958 HydrophobicContact CD1-CZ2 3.41Å; F1783-W1958 VanDerWaalsContact CD1-CZ2 3.41Å; F1783-W1958 HydrophobicContact CD1-CZ3 4.1Å; F1783-W1958 AromaticContact CE1-CD2 3.51Å; F1783-W1958 HydrophobicContact CE1-CD2 3.51Å; F1783-W1958 AromaticContact CE1-CE2 3.44Å; F1783-W1958 VanDerWaalsContact CE1-CE2 3.44Å; F1783-W1958 AromaticContact CE1-CE3 3.89Å; F1783-W1958 HydrophobicContact CE1-CE3 3.89Å; F1783-W1958 HydrophobicContact CE1-CG 4Å; F1783-W1958 HydrophobicContact CE1-CH2 4.13Å; F1783-W1958 AromaticContact CE1-CZ2 3.81Å; F1783-W1958 HydrophobicContact CE1-CZ2 3.81Å; F1783-W1958 HydrophobicContact CE1-CZ3 4.17Å; F1783-W1958 AromaticContact CE1-NE1 3.77Å; F1783-W1958 HydrophobicContact CG-CZ2 4.1Å; F1783-W1958 HydrophobicContact CZ-CD2 4.24Å; F1783-W1958 HydrophobicContact CZ-CG 4.28Å; F1783-W1958 AromaticContact CZ-NE1 3.99Å; W1785-W1958 AromaticContact CH2-CH2 3.62Å; W1785-W1958 HydrophobicContact CH2-CH2 3.62Å; W1785-W1958 HydrophobicContact CH2-CZ2 4.3Å; W1785-W1958 AromaticContact CZ2-CH2 3.79Å; W1785-W1958 HydrophobicContact CZ2-CH2 3.79Å; W1785-W1958 HydrophobicContact CZ2-CZ2 4.19Å; T1804-W1958 HydrophobicContact CG2-CZ3 4.31Å; L1950-W1958 HydrophobicContact CB-CB 4.29Å; L1950-W1958 HydrophobicContact CB-CE3 4.15Å; L1950-W1958 HydrophobicContact CD1-CE3 4.27Å; N1955-W1958 HydrophobicContact CB-CB 4.29Å; N1955-W1958 PolarHBondContact OD1-N 2.71Å; H1956-W1958 VanDerWaalsContact C-N 3.28Å; H1956-W1958 PolarHBondContact O-N 3.09Å; W1958-M1960 VanDerWaalsContact C-N 3.27Å; W1958-M1960 PolarHBondContact O-N 3.12Å; W1958-V1961 HydrophobicContact CZ3-CG1 4.48Å; W1958-V1961 PolarHBondContact O-N 3.06Å; W1958-V1961 VanDerWaalsContact O-N 3.09Å; W1958-K1962 HydrophobicContact CZ2-CB 4.25Å; W1958-K1962 HydrophobicContact CZ2-CG 4.36Å; W1958-K1962 PolarHBondContact O-N 2.99Å
1959	Q	86.5	Confident	86.5	Confident	80 Å²	80	59.6 Å²	59.6	37%	0.374	30%	0.299	S	S	.	.	H	α-helix	trans	-63.9	-32.8	179.7	-63.8	-65.6	-15	0	0	111.9	H1956 E1957 N1963	H1956-Q1959 PolarHBondContact O-N 3.21Å; E1957-Q1959 VanDerWaalsContact C-N 3.34Å; E1957-Q1959 PolarHBondContact O-N 2.79Å; Q1959-N1963 WeakPolarHBondContact O-CB 3.45Å; Q1959-N1963 PolarHBondContact O-N 3.15Å; Q1959-N1963 VanDerWaalsContact O-N 3.16Å; Q1959-N1963 PolarHBondContact O-ND2 2.86Å
1960	M	90.8	Very high	86.8	Confident	108 Å²	108	65.8 Å²	65.8	53%	0.532	32%	0.324	S	S	.	.	H	α-helix	trans	-67	-41.8	172.1	-64.2	178	61.4	0	0	112	V1812 H1956 E1957 W1958 L1964	V1812-M1960 HydrophobicContact CG1-CE 4.44Å; V1812-M1960 HydrophobicContact CG2-CB 4.46Å; H1956-M1960 PolarHBondContact O-N 3.32Å; E1957-M1960 WeakPolarHBondContact O-CB 3.31Å; E1957-M1960 PolarHBondContact O-N 3.13Å; E1957-M1960 VanDerWaalsContact O-N 3.15Å; W1958-M1960 VanDerWaalsContact C-N 3.27Å; W1958-M1960 PolarHBondContact O-N 3.12Å; M1960-L1964 VanDerWaalsContact O-CG 3.31Å; M1960-L1964 WeakPolarHBondContact O-CG 3.14Å; M1960-L1964 PolarHBondContact O-N 2.93Å; M1960-L1964 VanDerWaalsContact O-N 3.09Å
1961	V	92.5	Very high	86.8	Confident	0 Å²	0	72 Å²	72	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-67.6	-41.2	178.7	174.2	0	0	0	0	111.5	T1804 Y1808 V1812 L1950 E1957 W1958 L1964 L1965	T1804-V1961 HydrophobicContact CG2-CG1 3.79Å; Y1808-V1961 HydrophobicContact CD2-CG2 3.96Å; Y1808-V1961 HydrophobicContact CG-CG2 4.25Å; V1812-V1961 HydrophobicContact CG2-CG2 3.91Å; L1950-V1961 HydrophobicContact CD1-CG2 4.21Å; E1957-V1961 WeakPolarHBondContact O-CG2 3.34Å; E1957-V1961 PolarHBondContact O-N 3.18Å; W1958-V1961 HydrophobicContact CZ3-CG1 4.48Å; W1958-V1961 PolarHBondContact O-N 3.06Å; W1958-V1961 VanDerWaalsContact O-N 3.09Å; V1961-L1964 PolarHBondContact O-N 3.49Å; V1961-L1965 PolarHBondContact O-N 3.45Å
1962	K	91.3	Very high	86.9	Confident	31 Å²	31	71.7 Å²	71.7	14%	0.135	37%	0.365	C	S	.	.	H	α-helix	trans	-58.8	-53.4	174.3	-164.9	-173.4	178.5	70	0	111	N1782 M1784 W1785 W1958 L1964 L1965 D1966	N1782-K1962 WeakPolarHBondContact O-CE 3.48Å; N1782-K1962 PolarHBondContact O-NZ 2.84Å; M1784-K1962 PolarHBondContact O-NZ 2.74Å; W1785-K1962 HydrophobicContact CZ2-CG 4.16Å; W1958-K1962 HydrophobicContact CZ2-CB 4.25Å; W1958-K1962 HydrophobicContact CZ2-CG 4.36Å; W1958-K1962 PolarHBondContact O-N 2.99Å; K1962-L1964 PolarHBondContact O-N 3.11Å; K1962-L1964 VanDerWaalsContact O-N 3.09Å; K1962-L1965 PolarHBondContact O-N 2.98Å; K1962-D1966 PolarHBondContact O-N 2.68Å
1963	N	91.7	Very high	87.7	Confident	85 Å²	85	68.2 Å²	68.2	46%	0.455	35%	0.35	S	S	.	.	H	α-helix	trans	-64.5	-11.6	176.7	-72.8	-51.3	0	0	0	114.7	Q1959 R1967	Q1959-N1963 WeakPolarHBondContact O-CB 3.45Å; Q1959-N1963 PolarHBondContact O-N 3.15Å; Q1959-N1963 VanDerWaalsContact O-N 3.16Å; Q1959-N1963 PolarHBondContact O-ND2 2.86Å; N1963-R1967 PolarHBondContact O-NE 2.86Å; N1963-R1967 PolarHBondContact O-NH2 3.45Å; N1963-R1967 VanDerWaalsContact O-NH2 3.11Å
1964	L	93.1	Very high	88.6	Confident	26 Å²	26	62.7 Å²	62.7	14%	0.136	31%	0.314	C	S	.	.	H	α-helix	trans	-88.6	-38.9	169.4	-79.1	165.7	0	0	0	111.5	F1807 V1811 V1812 M1960 V1961 K1962 G1968	F1807-L1964 HydrophobicContact CB-CB 4.23Å; F1807-L1964 HydrophobicContact CB-CD1 4.27Å; F1807-L1964 HydrophobicContact CD1-CB 4.02Å; F1807-L1964 HydrophobicContact CD1-CD1 4.48Å; F1807-L1964 HydrophobicContact CD1-CD2 4.48Å; F1807-L1964 HydrophobicContact CD2-CB 4.23Å; F1807-L1964 HydrophobicContact CE1-CB 4.42Å; F1807-L1964 HydrophobicContact CG-CB 3.93Å; V1811-L1964 HydrophobicContact CB-CD1 4.14Å; V1811-L1964 HydrophobicContact CG1-CD1 3.9Å; V1811-L1964 HydrophobicContact CG1-CD2 4.18Å; V1812-L1964 HydrophobicContact CG2-CD1 3.85Å; M1960-L1964 VanDerWaalsContact O-CG 3.31Å; M1960-L1964 WeakPolarHBondContact O-CG 3.14Å; M1960-L1964 PolarHBondContact O-N 2.93Å; M1960-L1964 VanDerWaalsContact O-N 3.09Å; V1961-L1964 PolarHBondContact O-N 3.49Å; K1962-L1964 PolarHBondContact O-N 3.11Å; K1962-L1964 VanDerWaalsContact O-N 3.09Å; L1964-G1968 WeakPolarHBondContact O-CA 3.4Å; L1964-G1968 PolarHBondContact O-N 3.25Å
1965	L	92.4	Very high	89.3	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-67.7	-44.6	175.1	-168	72.9	0	0	0	111.5	W1785 V1799 F1803 T1804 F1807 V1961 K1962 G1968 I1969 V1974	W1785-L1965 HydrophobicContact CD2-CD2 4.08Å; W1785-L1965 HydrophobicContact CE3-CD2 4.42Å; W1785-L1965 HydrophobicContact CH2-CD2 3.74Å; W1785-L1965 HydrophobicContact CZ2-CD2 3.39Å; W1785-L1965 HydrophobicContact CZ3-CD2 4.27Å; V1799-L1965 HydrophobicContact CG1-CD1 4.14Å; F1803-L1965 HydrophobicContact CB-CD1 3.38Å; F1803-L1965 HydrophobicContact CG-CD1 4.33Å; T1804-L1965 HydrophobicContact CG2-CD2 4.14Å; F1807-L1965 HydrophobicContact CD2-CD1 4.34Å; F1807-L1965 HydrophobicContact CE2-CD1 4.09Å; V1961-L1965 PolarHBondContact O-N 3.45Å; K1962-L1965 PolarHBondContact O-N 2.98Å; L1965-G1968 CarbonylContact O-C 3.59Å; L1965-G1968 WeakPolarHBondContact O-CA 3.49Å; L1965-G1968 PolarHBondContact O-N 3.46Å; L1965-G1968 VanDerWaalsContact O-N 3.13Å; L1965-I1969 HydrophobicContact CD2-CD1 4.45Å; L1965-I1969 HydrophobicContact CG-CD1 4.02Å; L1965-I1969 WeakPolarHBondContact O-CG1 3.27Å; L1965-I1969 PolarHBondContact O-N 3.39Å; L1965-V1974 HydrophobicContact CD1-CG1 4.09Å; L1965-V1974 HydrophobicContact CD1-CG2 4.04Å
1966	D	90.9	Very high	89.8	Confident	44 Å²	44	61.9 Å²	61.9	24%	0.235	31%	0.305	C	S	.	.	H	α-helix	trans	-56.7	-58.2	-178	-61.5	-24	0	0	0	110.7	W1785 K1962 G1968 I1969 E1970	W1785-D1966 PolarHBondContact NE1-OD1 3.37Å; K1962-D1966 PolarHBondContact O-N 2.68Å; D1966-G1968 VanDerWaalsContact C-N 3.29Å; D1966-G1968 PolarHBondContact O-N 3.33Å; D1966-I1969 WeakPolarHBondContact O-CB 3.47Å; D1966-I1969 PolarHBondContact O-N 3.47Å; D1966-I1969 VanDerWaalsContact O-N 3.12Å; D1966-E1970 PolarHBondContact O-N 3.19Å; D1966-E1970 VanDerWaalsContact O-N 3.1Å
1967	R	89.9	Confident	90	Very high	132 Å²	132	55 Å²	55	50%	0.498	27%	0.274	S	S	.	.	H	α-helix	trans	-61.4	-36.1	173.9	-71.7	-179.3	-65.8	145.9	3.3	112.7	N1963 I1969 E1970 D1971	N1963-R1967 PolarHBondContact O-NE 2.86Å; N1963-R1967 PolarHBondContact O-NH2 3.45Å; N1963-R1967 VanDerWaalsContact O-NH2 3.11Å; R1967-I1969 PolarHBondContact O-N 2.73Å; R1967-E1970 PolarHBondContact O-N 3.19Å; R1967-D1971 VanDerWaalsContact O-CB 3.3Å; R1967-D1971 WeakPolarHBondContact O-CB 3.37Å; R1967-D1971 PolarHBondContact O-N 3.29Å
1968	G	90.9	Very high	90.1	Very high	3 Å²	3	54.9 Å²	54.9	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-60.8	-32.3	176.2	0	0	0	0	0	113.3	L1964 L1965 D1966 G1972 L1973 V1974	L1964-G1968 WeakPolarHBondContact O-CA 3.4Å; L1964-G1968 PolarHBondContact O-N 3.25Å; L1965-G1968 CarbonylContact O-C 3.59Å; L1965-G1968 WeakPolarHBondContact O-CA 3.49Å; L1965-G1968 PolarHBondContact O-N 3.46Å; L1965-G1968 VanDerWaalsContact O-N 3.13Å; D1966-G1968 VanDerWaalsContact C-N 3.29Å; D1966-G1968 PolarHBondContact O-N 3.33Å; G1968-G1972 PolarHBondContact O-N 3.04Å; G1968-L1973 PolarHBondContact O-N 3.44Å; G1968-V1974 WeakPolarHBondContact O-CB 3.4Å; G1968-V1974 PolarHBondContact O-N 2.84Å
1969	I	89.9	Confident	90.3	Very high	34 Å²	34	57.2 Å²	57.2	17%	0.174	29%	0.29	C	S	.	.	H	α-helix	trans	-75.9	-42.9	173.6	-65.6	163.7	0	0	0	110.4	M1765 P1788 W1791 L1965 D1966 R1967 G1972 V1974	M1765-I1969 HydrophobicContact CE-CD1 3.63Å; P1788-I1969 HydrophobicContact CG-CG2 3.81Å; W1791-I1969 HydrophobicContact CH2-CG1 4.08Å; W1791-I1969 HydrophobicContact CH2-CG2 4.24Å; W1791-I1969 HydrophobicContact CZ2-CG2 4.34Å; L1965-I1969 HydrophobicContact CD2-CD1 4.45Å; L1965-I1969 HydrophobicContact CG-CD1 4.02Å; L1965-I1969 WeakPolarHBondContact O-CG1 3.27Å; L1965-I1969 PolarHBondContact O-N 3.39Å; D1966-I1969 WeakPolarHBondContact O-CB 3.47Å; D1966-I1969 PolarHBondContact O-N 3.47Å; D1966-I1969 VanDerWaalsContact O-N 3.12Å; R1967-I1969 PolarHBondContact O-N 2.73Å; I1969-G1972 PolarHBondContact O-N 3.14Å; I1969-V1974 HydrophobicContact CG1-CB 3.85Å; I1969-V1974 HydrophobicContact CG1-CG1 3.78Å; I1969-V1974 HydrophobicContact CG1-CG2 4.38Å
1970	E	87.3	Confident	90.6	Very high	159 Å²	159	55.6 Å²	55.6	74%	0.743	29%	0.285	S	S	*	.	H	α-helix	trans	-63.4	-45.3	177.6	-66.6	177	152.3	0	0	112.8	D1966 R1967 G1972	D1966-E1970 PolarHBondContact O-N 3.19Å; D1966-E1970 VanDerWaalsContact O-N 3.1Å; R1967-E1970 PolarHBondContact O-N 3.19Å; E1970-G1972 PolarHBondContact O-N 2.87Å
1971	D	86.7	Confident	90.8	Very high	135 Å²	135	53.7 Å²	53.7	72%	0.722	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-7.1	177.3	-69.4	-33.4	0	0	0	112.9	R1967 L1973	R1967-D1971 VanDerWaalsContact O-CB 3.3Å; R1967-D1971 WeakPolarHBondContact O-CB 3.37Å; R1967-D1971 PolarHBondContact O-N 3.29Å; D1971-L1973 VanDerWaalsContact C-N 3.25Å; D1971-L1973 PolarHBondContact O-N 2.69Å
1972	G	85	Confident	90.9	Very high	33 Å²	33	55 Å²	55	34%	0.34	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	15.7	-178.3	0	0	0	0	0	115.2	G1968 I1969 E1970 K1975	G1968-G1972 PolarHBondContact O-N 3.04Å; I1969-G1972 PolarHBondContact O-N 3.14Å; E1970-G1972 PolarHBondContact O-N 2.87Å; G1972-K1975 WeakPolarHBondContact O-CE 3.48Å
1973	L	90	Very high	90.9	Very high	37 Å²	37	55.8 Å²	55.8	19%	0.194	29%	0.291	C	S	.	.			trans	-70.3	-39.7	172	171.8	59.7	0	0	0	111.7	F1807 S1837 I1838 S1841 G1968 D1971	F1807-L1973 HydrophobicContact CE1-CD2 4.21Å; F1807-L1973 HydrophobicContact CZ-CD2 4.1Å; S1837-L1973 PolarHBondContact OG-O 3.37Å; I1838-L1973 HydrophobicContact CG1-CD2 4.46Å; S1841-L1973 VanDerWaalsContact CB-CD1 3.48Å; S1841-L1973 WeakPolarHBondContact OG-CD1 3.09Å; G1968-L1973 PolarHBondContact O-N 3.44Å; D1971-L1973 VanDerWaalsContact C-N 3.25Å; D1971-L1973 PolarHBondContact O-N 2.69Å
1974	V	91.2	Very high	90.7	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.012	29%	0.285	C	S	.	.	S	Bend	trans	-85.6	118.5	176.8	178.8	0	0	0	0	107.7	W1791 V1799 F1803 F1807 L1965 G1968 I1969	W1791-V1974 HydrophobicContact CH2-CG1 4.21Å; V1799-V1974 HydrophobicContact CG1-CG1 3.42Å; V1799-V1974 VanDerWaalsContact CG1-CG1 3.42Å; V1799-V1974 HydrophobicContact CG2-CG1 4.3Å; F1803-V1974 HydrophobicContact CB-CG1 4.45Å; F1803-V1974 HydrophobicContact CD1-CB 4.26Å; F1803-V1974 HydrophobicContact CD1-CG1 4.06Å; F1803-V1974 HydrophobicContact CD1-CG2 3.75Å; F1803-V1974 HydrophobicContact CD2-CG1 3.87Å; F1803-V1974 HydrophobicContact CE1-CB 4.27Å; F1803-V1974 HydrophobicContact CE1-CG1 4.23Å; F1803-V1974 HydrophobicContact CE1-CG2 4.12Å; F1803-V1974 HydrophobicContact CE2-CG1 4.04Å; F1803-V1974 HydrophobicContact CG-CG1 3.87Å; F1803-V1974 HydrophobicContact CG-CG2 4.2Å; F1803-V1974 HydrophobicContact CZ-CG1 4.22Å; F1807-V1974 HydrophobicContact CE2-CG2 3.76Å; F1807-V1974 HydrophobicContact CZ-CG2 4Å; L1965-V1974 HydrophobicContact CD1-CG1 4.09Å; L1965-V1974 HydrophobicContact CD1-CG2 4.04Å; G1968-V1974 WeakPolarHBondContact O-CB 3.4Å; G1968-V1974 PolarHBondContact O-N 2.84Å; I1969-V1974 HydrophobicContact CG1-CB 3.85Å; I1969-V1974 HydrophobicContact CG1-CG1 3.78Å; I1969-V1974 HydrophobicContact CG1-CG2 4.38Å
1975	K	90.2	Very high	90.3	Very high	137 Å²	137	60 Å²	60	60%	0.596	31%	0.307	S	S	*	.			trans	-130.6	149.6	179.4	-64.6	-178.9	-174.1	175.7	0	109.7	F1803 G1972	F1803-K1975 WeakPolarHBondContact CE2-O 3.47Å; G1972-K1975 WeakPolarHBondContact O-CE 3.48Å
1976	P	91.4	Very high	90.2	Very high	36 Å²	36	65.8 Å²	65.8	23%	0.234	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-54.1	141	170.7	-25.9	36.1	0	0	0	111.7	W1791 E1795	W1791-P1976 HydrophobicContact CD2-CG 3.74Å; W1791-P1976 HydrophobicContact CE3-CG 4.14Å; W1791-P1976 HydrophobicContact CG-CG 4.03Å; W1791-P1976 HydrophobicContact CZ2-CG 4.27Å; E1795-P1976 HydrophobicContact CB-CB 3.58Å; E1795-P1976 HydrophobicContact CB-CG 3.62Å; E1795-P1976 HydrophobicContact CG-CB 3.69Å; E1795-P1976 HydrophobicContact CG-CG 3.98Å
1977	L	91.3	Very high	90.1	Very high	13 Å²	13	64 Å²	64	7%	0.068	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-95.6	150.5	-178.2	-56	178.1	0	0	0	110.5	T1798 V1802 F1803 M1833 M1979	T1798-L1977 PolarHBondContact OG1-N 3.33Å; V1802-L1977 HydrophobicContact CB-CD1 4.11Å; V1802-L1977 HydrophobicContact CG1-CD1 3.56Å; V1802-L1977 HydrophobicContact CG2-CD1 4.42Å; F1803-L1977 HydrophobicContact CE2-CD1 4.31Å; F1803-L1977 HydrophobicContact CE2-CD2 3.99Å; F1803-L1977 HydrophobicContact CE2-CG 4.14Å; F1803-L1977 HydrophobicContact CZ-CD2 4.18Å; M1833-L1977 HydrophobicContact CB-CD2 4.15Å; L1977-M1979 PolarHBondContact O-N 2.98Å
1978	P	90.1	Very high	90	Very high	50 Å²	50	61 Å²	61	33%	0.325	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-52.6	141	170	-29.7	39.4	0	0	0	111.8	M1833 F1858 G2001 K2002	M1833-P1978 HydrophobicContact CE-CG 4.13Å; F1858-P1978 HydrophobicContact CE2-CB 4.29Å; F1858-P1978 HydrophobicContact CE2-CG 4.2Å; F1858-P1978 HydrophobicContact CZ-CB 3.96Å; F1858-P1978 HydrophobicContact CZ-CG 3.86Å; P1978-G2001 CarbonylContact O-C 3.57Å; P1978-G2001 VanDerWaalsContact O-CA 3.3Å; P1978-G2001 WeakPolarHBondContact O-CA 3.4Å; P1978-K2002 PolarHBondContact O-N 3.44Å
1979	M	92.7	Very high	89.9	Confident	57 Å²	57	65.5 Å²	65.5	28%	0.281	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	149	-165.4	70.4	-157	91.8	0	0	112.5	H1794 E1795 T1798 L1977 I1981 K2002 L2004	H1794-M1979 HydrophobicContact CB-SD 4.08Å; E1795-M1979 HydrophobicContact CG-CE 3.92Å; T1798-M1979 HydrophobicContact CG2-CB 4.02Å; T1798-M1979 HydrophobicContact CG2-SD 4.26Å; L1977-M1979 PolarHBondContact O-N 2.98Å; M1979-I1981 HydrophobicContact CG-CD1 4.31Å; M1979-I1981 HydrophobicContact CG-CG1 4.04Å; M1979-I1981 HydrophobicContact SD-CD1 4.19Å; M1979-I1981 HydrophobicContact SD-CG1 4.43Å; M1979-K2002 CarbonylContact C-O 3.52Å; M1979-K2002 VanDerWaalsContact CA-O 3.28Å; M1979-K2002 WeakPolarHBondContact CA-O 3.5Å; M1979-L2004 HydrophobicContact CB-CD1 3.93Å; M1979-L2004 HydrophobicContact CB-CG 4.36Å; M1979-L2004 HydrophobicContact CG-CD1 4.11Å; M1979-L2004 HydrophobicContact SD-CD1 3.72Å
1980	T	93.6	Very high	89.9	Confident	46 Å²	46	63.9 Å²	63.9	28%	0.282	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	118.9	165.2	-49.4	0	0	0	0	108.3	F1982 F1993 K2002 V2003 L2004	T1980-F1982 HydrophobicContact CG2-CD2 4.24Å; T1980-F1982 HydrophobicContact CG2-CE2 3.64Å; T1980-F1982 HydrophobicContact CG2-CZ 4.35Å; T1980-F1993 HydrophobicContact CG2-CE1 3.9Å; T1980-F1993 HydrophobicContact CG2-CZ 4.36Å; T1980-K2002 PolarHBondContact N-O 3.49Å; T1980-V2003 WeakPolarHBondContact O-CA 3.4Å; T1980-L2004 PolarHBondContact O-N 3.23Å
1981	I	94.1	Very high	90.1	Very high	67 Å²	67	56.3 Å²	56.3	34%	0.344	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	123.2	-177.6	-56	175.9	0	0	0	108.8	Y1719 H1794 M1979 L2004 K2006	Y1719-I1981 HydrophobicContact CE1-CD1 4.47Å; Y1719-I1981 HydrophobicContact CE1-CG2 4.38Å; H1794-I1981 HydrophobicContact CB-CD1 3.96Å; M1979-I1981 HydrophobicContact CG-CD1 4.31Å; M1979-I1981 HydrophobicContact CG-CG1 4.04Å; M1979-I1981 HydrophobicContact SD-CD1 4.19Å; M1979-I1981 HydrophobicContact SD-CG1 4.43Å; I1981-L2004 HydrophobicContact CG1-CB 4.3Å; I1981-L2004 HydrophobicContact CG1-CD1 4.24Å; I1981-K2006 HydrophobicContact CG2-CB 3.79Å
1982	F	94.5	Very high	90.1	Very high	27 Å²	27	55.2 Å²	55.2	12%	0.118	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	144.2	166.9	-71.4	-101.8	0	0	0	109.4	T1980 R1986 E1989 A1990 F1993 V2003 L2004 L2005 K2006	T1980-F1982 HydrophobicContact CG2-CD2 4.24Å; T1980-F1982 HydrophobicContact CG2-CE2 3.64Å; T1980-F1982 HydrophobicContact CG2-CZ 4.35Å; F1982-R1986 HydrophobicContact CD1-CB 4.43Å; F1982-E1989 HydrophobicContact CD1-CB 4.21Å; F1982-E1989 HydrophobicContact CE1-CB 3.95Å; F1982-A1990 HydrophobicContact CB-CB 3.85Å; F1982-A1990 HydrophobicContact CD1-CB 4.04Å; F1982-A1990 HydrophobicContact CD2-CB 3.68Å; F1982-A1990 HydrophobicContact CE2-CB 4.22Å; F1982-A1990 HydrophobicContact CG-CB 3.59Å; F1982-F1993 HydrophobicContact CE2-CB 4.36Å; F1982-F1993 AromaticContact CE2-CD1 3.69Å; F1982-F1993 HydrophobicContact CE2-CD1 3.69Å; F1982-F1993 HydrophobicContact CE2-CE1 4.26Å; F1982-F1993 HydrophobicContact CE2-CG 4.18Å; F1982-F1993 HydrophobicContact CZ-CB 3.88Å; F1982-F1993 AromaticContact CZ-CD1 3.85Å; F1982-F1993 HydrophobicContact CZ-CD1 3.85Å; F1982-F1993 AromaticContact CZ-CG 3.85Å; F1982-F1993 HydrophobicContact CZ-CG 3.85Å; F1982-V2003 HydrophobicContact CD2-CG1 3.94Å; F1982-V2003 HydrophobicContact CE2-CG1 4.08Å; F1982-L2004 PolarHBondContact N-O 3.09Å; F1982-L2005 HydrophobicContact CB-CD2 4.23Å; F1982-L2005 CarbonylContact O-C 3.5Å; F1982-L2005 WeakPolarHBondContact O-CA 3.31Å; F1982-K2006 PolarHBondContact O-N 3.37Å
1983	P	92	Very high	90.3	Very high	49 Å²	49	56.7 Å²	56.7	32%	0.318	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	158.7	168.6	30.8	-33.8	0	0	0	111.5	D1985 R1986	P1983-D1985 WeakPolarHBondContact CB-OD1 3.35Å; P1983-D1985 WeakPolarHBondContact CG-OD1 3.39Å; P1983-D1985 PolarHBondContact O-N 3.03Å; P1983-D1985 VanDerWaalsContact O-N 3.15Å; P1983-R1986 HydrophobicContact CG-CB 4.47Å; P1983-R1986 HydrophobicContact CG-CG 4.15Å; P1983-R1986 PolarHBondContact O-N 3.38Å; P1983-R1986 VanDerWaalsContact O-N 3.12Å
1984	Y	87.5	Confident	90.1	Very high	86 Å²	86	55.6 Å²	55.6	34%	0.337	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-6.8	-170.4	69	-100.4	0	0	0	116.2	W1697 V1987 K2006 V2023	W1697-Y1984 AromaticContact NE1-CD2 3.79Å; W1697-Y1984 PolarHBondContact NE1-O 3.27Å; Y1984-V1987 WeakPolarHBondContact O-CG2 3.13Å; Y1984-K2006 WeakPolarHBondContact CB-O 3.31Å; Y1984-K2006 WeakPolarHBondContact CD1-O 3.45Å; Y1984-K2006 PolarHBondContact N-O 3.16Å; Y1984-V2023 HydrophobicContact CD2-CG1 4.29Å; Y1984-V2023 HydrophobicContact CE2-CG1 4Å
1985	D	84.6	Confident	89.6	Confident	112 Å²	112	58 Å²	58	60%	0.599	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-27.3	173.2	59.5	-31.1	0	0	0	111.9	P1983 V1987	P1983-D1985 WeakPolarHBondContact CB-OD1 3.35Å; P1983-D1985 WeakPolarHBondContact CG-OD1 3.39Å; P1983-D1985 PolarHBondContact O-N 3.03Å; P1983-D1985 VanDerWaalsContact O-N 3.15Å; D1985-V1987 PolarHBondContact O-N 2.88Å
1986	R	90.5	Very high	89.1	Confident	123 Å²	123	54.7 Å²	54.7	46%	0.464	28%	0.276	S	S	.	.			trans	-101.1	41	-176.4	-55	-161.3	-157.2	-170.4	2.1	114.1	F1982 P1983 E1988 E1989 A1990	F1982-R1986 HydrophobicContact CD1-CB 4.43Å; P1983-R1986 HydrophobicContact CG-CB 4.47Å; P1983-R1986 HydrophobicContact CG-CG 4.15Å; P1983-R1986 PolarHBondContact O-N 3.38Å; P1983-R1986 VanDerWaalsContact O-N 3.12Å; R1986-E1988 PolarHBondContact O-N 3.01Å; R1986-E1989 HydrophobicContact CB-CB 4.28Å; R1986-E1989 HydrophobicContact CB-CG 4.35Å; R1986-E1989 WeakPolarHBondContact CD-OE2 3.42Å; R1986-E1989 IonicContact NH1-OE1 3.04Å; R1986-E1989 IonicContact NH1-OE2 3.63Å; R1986-E1989 PolarHBondContact O-N 2.93Å; R1986-A1990 PolarHBondContact O-N 2.92Å; R1986-A1990 VanDerWaalsContact O-N 3.13Å
1987	V	89	Confident	88.3	Confident	7 Å²	7	54.7 Å²	54.7	4%	0.042	28%	0.283	C	S	.	.	H	α-helix	trans	-65.1	-39.2	-175.4	-169.5	0	0	0	0	112	I1684 L1695 Y1984 D1985 A1990 F1991 L2005	I1684-V1987 HydrophobicContact CD1-CG1 4.05Å; I1684-V1987 HydrophobicContact CD1-CG2 3.75Å; I1684-V1987 HydrophobicContact CG1-CG2 4.43Å; I1684-V1987 HydrophobicContact CG2-CG1 3.93Å; L1695-V1987 HydrophobicContact CD2-CB 3.98Å; L1695-V1987 HydrophobicContact CD2-CG1 3.4Å; Y1984-V1987 WeakPolarHBondContact O-CG2 3.13Å; D1985-V1987 PolarHBondContact O-N 2.88Å; V1987-A1990 WeakPolarHBondContact O-CB 3.06Å; V1987-A1990 PolarHBondContact O-N 3.27Å; V1987-F1991 HydrophobicContact CG1-CD2 3.86Å; V1987-F1991 HydrophobicContact CG1-CE2 3.89Å; V1987-F1991 WeakPolarHBondContact O-CD2 3.42Å; V1987-F1991 PolarHBondContact O-N 2.76Å; V1987-L2005 HydrophobicContact CG1-CD1 3.94Å; V1987-L2005 HydrophobicContact CG1-CD2 4.33Å; V1987-L2005 HydrophobicContact CG2-CD1 4.42Å; V1987-L2005 HydrophobicContact CG2-CD2 4.34Å
1988	E	88.2	Confident	87.7	Confident	69 Å²	69	61 Å²	61	32%	0.322	31%	0.31	S	S	.	.	H	α-helix	trans	-61.8	-45.6	177.2	-167.2	-163.1	139.1	0	0	111.6	R1986 A1990 F1991 R1992	R1986-E1988 PolarHBondContact O-N 3.01Å; E1988-A1990 VanDerWaalsContact C-N 3.28Å; E1988-A1990 PolarHBondContact O-N 3.32Å; E1988-F1991 PolarHBondContact O-N 2.8Å; E1988-R1992 WeakPolarHBondContact O-CG 3.45Å; E1988-R1992 PolarHBondContact O-N 2.89Å; E1988-R1992 IonicContact OE1-CZ 3.76Å; E1988-R1992 IonicContact OE1-NE 3.38Å; E1988-R1992 PolarHBondContact OE1-NE 3.32Å; E1988-R1992 IonicContact OE1-NH2 2.75Å; E1988-R1992 PolarHBondContact OE1-NH2 3.08Å
1989	E	88.5	Confident	87.5	Confident	96 Å²	96	59.6 Å²	59.6	45%	0.449	30%	0.299	S	S	.	.	H	α-helix	trans	-56.3	-44.1	173.8	-66.3	-176.8	-170.5	0	0	111	F1982 R1986 R1992 F1993	F1982-E1989 HydrophobicContact CD1-CB 4.21Å; F1982-E1989 HydrophobicContact CE1-CB 3.95Å; R1986-E1989 HydrophobicContact CB-CB 4.28Å; R1986-E1989 HydrophobicContact CB-CG 4.35Å; R1986-E1989 WeakPolarHBondContact CD-OE2 3.42Å; R1986-E1989 IonicContact NH1-OE1 3.04Å; R1986-E1989 IonicContact NH1-OE2 3.63Å; R1986-E1989 PolarHBondContact O-N 2.93Å; E1989-R1992 PolarHBondContact O-N 2.99Å; E1989-F1993 WeakPolarHBondContact O-CB 3.28Å; E1989-F1993 PolarHBondContact O-N 3.44Å
1990	A	90.6	Very high	87.2	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.3	-43.1	179.9	0	0	0	0	0	112.6	I1722 F1982 R1986 V1987 E1988 M1994 V2003 L2005	I1722-A1990 HydrophobicContact CD1-CB 3.59Å; F1982-A1990 HydrophobicContact CB-CB 3.85Å; F1982-A1990 HydrophobicContact CD1-CB 4.04Å; F1982-A1990 HydrophobicContact CD2-CB 3.68Å; F1982-A1990 HydrophobicContact CE2-CB 4.22Å; F1982-A1990 HydrophobicContact CG-CB 3.59Å; R1986-A1990 PolarHBondContact O-N 2.92Å; R1986-A1990 VanDerWaalsContact O-N 3.13Å; V1987-A1990 WeakPolarHBondContact O-CB 3.06Å; V1987-A1990 PolarHBondContact O-N 3.27Å; E1988-A1990 VanDerWaalsContact C-N 3.28Å; E1988-A1990 PolarHBondContact O-N 3.32Å; A1990-M1994 WeakPolarHBondContact O-CB 3.38Å; A1990-M1994 PolarHBondContact O-N 2.85Å; A1990-V2003 HydrophobicContact CB-CG1 4.32Å; A1990-L2005 HydrophobicContact CB-CD2 3.83Å
1991	F	90.3	Very high	87	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.7	-49.2	174.7	-94.3	-106.4	0	0	0	111.6	L1692 L1695 I1722 D1726 I1727 A1730 L1750 M1773 V1987 E1988 M1994 A1995	L1692-F1991 HydrophobicContact CD2-CD1 4.23Å; L1695-F1991 HydrophobicContact CD1-CD1 3.9Å; L1695-F1991 HydrophobicContact CD1-CD2 4.04Å; L1695-F1991 HydrophobicContact CD1-CE1 3.96Å; L1695-F1991 HydrophobicContact CD1-CE2 4.1Å; L1695-F1991 HydrophobicContact CD1-CG 3.93Å; L1695-F1991 HydrophobicContact CD1-CZ 4.05Å; L1695-F1991 HydrophobicContact CD2-CD2 4.44Å; L1695-F1991 HydrophobicContact CD2-CE2 4.36Å; I1722-F1991 HydrophobicContact CD1-CD2 3.83Å; I1722-F1991 HydrophobicContact CD1-CE2 4.07Å; I1722-F1991 HydrophobicContact CG1-CE2 4.41Å; I1722-F1991 HydrophobicContact CG2-CE2 4.35Å; I1722-F1991 HydrophobicContact CG2-CZ 4.4Å; D1726-F1991 HydrophobicContact CB-CE1 4.26Å; D1726-F1991 HydrophobicContact CB-CZ 4.26Å; I1727-F1991 HydrophobicContact CG1-CD1 4.33Å; A1730-F1991 HydrophobicContact CB-CD1 4.3Å; A1730-F1991 HydrophobicContact CB-CE1 3.92Å; L1750-F1991 HydrophobicContact CD1-CZ 4.29Å; M1773-F1991 HydrophobicContact CE-CE2 4.06Å; M1773-F1991 HydrophobicContact CE-CZ 3.75Å; M1773-F1991 HydrophobicContact SD-CE2 4.17Å; M1773-F1991 HydrophobicContact SD-CZ 4.42Å; V1987-F1991 HydrophobicContact CG1-CD2 3.86Å; V1987-F1991 HydrophobicContact CG1-CE2 3.89Å; V1987-F1991 WeakPolarHBondContact O-CD2 3.42Å; V1987-F1991 PolarHBondContact O-N 2.76Å; E1988-F1991 PolarHBondContact O-N 2.8Å; F1991-M1994 PolarHBondContact O-N 2.81Å; F1991-A1995 WeakPolarHBondContact O-CB 3.43Å; F1991-A1995 PolarHBondContact O-N 3.42Å
1992	R	86.7	Confident	86.9	Confident	113 Å²	113	54.6 Å²	54.6	43%	0.426	27%	0.27	S	S	.	.	H	α-helix	trans	-60.9	-45.9	176.8	-70.6	-172.3	-169.9	-88.8	1.3	111.4	L1692 N1693 E1988 E1989 M1994 A1995 T1996	L1692-R1992 HydrophobicContact CD1-CG 4.36Å; N1693-R1992 PolarHBondContact OD1-NH2 3.25Å; E1988-R1992 WeakPolarHBondContact O-CG 3.45Å; E1988-R1992 PolarHBondContact O-N 2.89Å; E1988-R1992 IonicContact OE1-CZ 3.76Å; E1988-R1992 IonicContact OE1-NE 3.38Å; E1988-R1992 PolarHBondContact OE1-NE 3.32Å; E1988-R1992 IonicContact OE1-NH2 2.75Å; E1988-R1992 PolarHBondContact OE1-NH2 3.08Å; E1989-R1992 PolarHBondContact O-N 2.99Å; R1992-M1994 PolarHBondContact O-N 2.75Å; R1992-A1995 PolarHBondContact O-N 3Å; R1992-T1996 WeakPolarHBondContact O-CG2 3.31Å; R1992-T1996 PolarHBondContact O-N 2.85Å; R1992-T1996 VanDerWaalsContact O-N 3.15Å
1993	F	88.8	Confident	86.9	Confident	64 Å²	64	53.3 Å²	53.3	28%	0.281	26%	0.264	S	S	.	.	H	α-helix	trans	-57.8	-47.9	177.8	175.9	-106.6	0	0	0	111.5	T1980 F1982 E1989 A1995 T1996 K1998 H1999 V2003	T1980-F1993 HydrophobicContact CG2-CE1 3.9Å; T1980-F1993 HydrophobicContact CG2-CZ 4.36Å; F1982-F1993 HydrophobicContact CE2-CB 4.36Å; F1982-F1993 AromaticContact CE2-CD1 3.69Å; F1982-F1993 HydrophobicContact CE2-CD1 3.69Å; F1982-F1993 HydrophobicContact CE2-CE1 4.26Å; F1982-F1993 HydrophobicContact CE2-CG 4.18Å; F1982-F1993 HydrophobicContact CZ-CB 3.88Å; F1982-F1993 AromaticContact CZ-CD1 3.85Å; F1982-F1993 HydrophobicContact CZ-CD1 3.85Å; F1982-F1993 AromaticContact CZ-CG 3.85Å; F1982-F1993 HydrophobicContact CZ-CG 3.85Å; E1989-F1993 WeakPolarHBondContact O-CB 3.28Å; E1989-F1993 PolarHBondContact O-N 3.44Å; F1993-A1995 VanDerWaalsContact C-N 3.35Å; F1993-A1995 PolarHBondContact O-N 2.98Å; F1993-T1996 PolarHBondContact O-N 3.33Å; F1993-T1996 PolarHBondContact O-OG1 3.21Å; F1993-K1998 HydrophobicContact CE2-CB 4.42Å; F1993-H1999 HydrophobicContact CD1-CB 4.35Å; F1993-H1999 HydrophobicContact CE1-CB 3.67Å; F1993-H1999 HydrophobicContact CZ-CB 4.2Å; F1993-V2003 HydrophobicContact CD1-CG2 4.19Å; F1993-V2003 HydrophobicContact CE1-CG2 4.27Å
1994	M	86.7	Confident	87	Confident	14 Å²	14	51 Å²	51	7%	0.069	25%	0.249	C	C	.	.	H	α-helix	trans	-64.3	-40.1	178.5	-164.3	176	175.8	0	0	111.7	I1722 I1727 A1990 F1991 R1992 T1996 G1997 H1999 V2003	I1722-M1994 HydrophobicContact CB-SD 3.71Å; I1722-M1994 HydrophobicContact CG2-SD 3.54Å; I1722-M1994 VanDerWaalsContact CG2-SD 3.54Å; I1727-M1994 HydrophobicContact CD1-CB 3.76Å; I1727-M1994 HydrophobicContact CD1-CG 3.67Å; I1727-M1994 HydrophobicContact CD1-SD 3.96Å; A1990-M1994 WeakPolarHBondContact O-CB 3.38Å; A1990-M1994 PolarHBondContact O-N 2.85Å; F1991-M1994 PolarHBondContact O-N 2.81Å; R1992-M1994 PolarHBondContact O-N 2.75Å; M1994-T1996 VanDerWaalsContact C-N 3.29Å; M1994-T1996 PolarHBondContact O-N 2.67Å; M1994-G1997 PolarHBondContact O-N 3.23Å; M1994-H1999 PolarHBondContact O-CE1 3Å; M1994-H1999 PolarHBondContact O-ND1 3.06Å; M1994-V2003 HydrophobicContact CB-CG2 4.06Å; M1994-V2003 HydrophobicContact CG-CB 4.49Å; M1994-V2003 HydrophobicContact CG-CG2 3.95Å; M1994-V2003 HydrophobicContact SD-CB 4.14Å; M1994-V2003 HydrophobicContact SD-CG2 4.17Å
1995	A	80.6	Confident	87.3	Confident	51 Å²	51	46.9 Å²	46.9	42%	0.421	23%	0.233	S	C	.	.	H	α-helix	trans	-61.5	-29.3	177.7	0	0	0	0	0	113.9	I1727 F1991 R1992 F1993 G1997	I1727-A1995 HydrophobicContact CD1-CB 4.46Å; I1727-A1995 HydrophobicContact CG2-CB 3.96Å; F1991-A1995 WeakPolarHBondContact O-CB 3.43Å; F1991-A1995 PolarHBondContact O-N 3.42Å; R1992-A1995 PolarHBondContact O-N 3Å; F1993-A1995 VanDerWaalsContact C-N 3.35Å; F1993-A1995 PolarHBondContact O-N 2.98Å; A1995-G1997 PolarHBondContact O-N 3.24Å
1996	T	79.7	Confident	87.8	Confident	69 Å²	69	44.1 Å²	44.1	42%	0.423	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-10.6	173.8	68.3	0	0	0	0	114.5	R1992 F1993 M1994 K1998	R1992-T1996 WeakPolarHBondContact O-CG2 3.31Å; R1992-T1996 PolarHBondContact O-N 2.85Å; R1992-T1996 VanDerWaalsContact O-N 3.15Å; F1993-T1996 PolarHBondContact O-N 3.33Å; F1993-T1996 PolarHBondContact O-OG1 3.21Å; M1994-T1996 VanDerWaalsContact C-N 3.29Å; M1994-T1996 PolarHBondContact O-N 2.67Å; T1996-K1998 PolarHBondContact O-N 2.91Å; T1996-K1998 VanDerWaalsContact O-N 3.15Å; T1996-K1998 WeakPolarHBondContact OG1-CB 3.44Å; T1996-K1998 WeakPolarHBondContact OG1-CG 3.38Å; T1996-K1998 PolarHBondContact OG1-N 2.82Å
1997	G	75.3	Confident	88	Confident	36 Å²	36	38.4 Å²	38.4	37%	0.371	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	8.5	-176.6	0	0	0	0	0	115.1	K1855 M1994 A1995	K1855-G1997 PolarHBondContact NZ-O 2.86Å; M1994-G1997 PolarHBondContact O-N 3.23Å; A1995-G1997 PolarHBondContact O-N 3.24Å
1998	K	78.5	Confident	88.2	Confident	144 Å²	144	38.6 Å²	38.6	63%	0.626	19%	0.194	S	C	*	.			trans	-72.3	-28.7	-179.7	-70.5	179	179.2	-178.7	0	113.6	K1855 F1993 T1996	K1855-K1998 WeakPolarHBondContact CE-O 3.39Å; F1993-K1998 HydrophobicContact CE2-CB 4.42Å; T1996-K1998 PolarHBondContact O-N 2.91Å; T1996-K1998 VanDerWaalsContact O-N 3.15Å; T1996-K1998 WeakPolarHBondContact OG1-CB 3.44Å; T1996-K1998 WeakPolarHBondContact OG1-CG 3.38Å; T1996-K1998 PolarHBondContact OG1-N 2.82Å
1999	H	85.7	Confident	88.2	Confident	22 Å²	22	41 Å²	41	10%	0.102	21%	0.205	C	C	.	.			trans	-53.3	150.7	-178.2	63.3	-92.3	0	0	0	114.1	K1855 F1993 M1994 V2003	K1855-H1999 WeakPolarHBondContact CE-O 3.22Å; K1855-H1999 PolarHBondContact NZ-O 3.42Å; F1993-H1999 HydrophobicContact CD1-CB 4.35Å; F1993-H1999 HydrophobicContact CE1-CB 3.67Å; F1993-H1999 HydrophobicContact CZ-CB 4.2Å; M1994-H1999 PolarHBondContact O-CE1 3Å; M1994-H1999 PolarHBondContact O-ND1 3.06Å; H1999-V2003 HydrophobicContact CB-CG2 3.81Å
2000	K	86.8	Confident	88.3	Confident	52 Å²	52	38 Å²	38	23%	0.226	19%	0.192	C	C	.	.			trans	-115.6	130.4	172.7	-59.6	177	-171	177.3	0	108	E1854 K1855 F1858 K2002	E1854-K2000 WeakPolarHBondContact OE1-CE 3.41Å; E1854-K2000 IonicContact OE1-NZ 3.48Å; E1854-K2000 PolarHBondContact OE1-NZ 3.46Å; K1855-K2000 HydrophobicContact CG-CG 4.44Å; F1858-K2000 HydrophobicContact CB-CD 4.32Å; F1858-K2000 HydrophobicContact CD1-CB 4.37Å; F1858-K2000 HydrophobicContact CD1-CD 4.04Å; F1858-K2000 HydrophobicContact CD1-CG 4.35Å; F1858-K2000 HydrophobicContact CD2-CD 3.94Å; F1858-K2000 HydrophobicContact CE1-CB 3.87Å; F1858-K2000 HydrophobicContact CE1-CD 4.31Å; F1858-K2000 HydrophobicContact CE1-CG 4.35Å; F1858-K2000 HydrophobicContact CE2-CB 4.45Å; F1858-K2000 HydrophobicContact CE2-CD 4.21Å; F1858-K2000 HydrophobicContact CG-CD 3.84Å; F1858-K2000 HydrophobicContact CZ-CB 3.9Å; F1858-K2000 HydrophobicContact CZ-CD 4.37Å; K2000-K2002 PolarHBondContact O-N 2.86Å
2001	G	89.1	Confident	88.3	Confident	3 Å²	3	40.3 Å²	40.3	3%	0.031	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	66	-115	-174.1	0	0	0	0	0	113.1	S1828 G1830 P1978	S1828-G2001 PolarHBondContact O-N 3.42Å; G1830-G2001 PolarHBondContact N-O 3.24Å; P1978-G2001 CarbonylContact O-C 3.57Å; P1978-G2001 VanDerWaalsContact O-CA 3.3Å; P1978-G2001 WeakPolarHBondContact O-CA 3.4Å
2002	K	91.8	Very high	87.9	Confident	9 Å²	9	49.6 Å²	49.6	4%	0.039	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	153.7	-171.2	-103.9	-80.1	178	173.4	0	113.9	S1721 I1722 N1723 E1753 T1798 V1802 P1978 M1979 T1980 K2000	S1721-K2002 PolarHBondContact OG-NZ 2.94Å; I1722-K2002 PolarHBondContact O-NZ 3.48Å; N1723-K2002 PolarHBondContact OD1-NZ 3.13Å; E1753-K2002 WeakPolarHBondContact OE2-CE 3.37Å; E1753-K2002 IonicContact OE2-NZ 2.74Å; E1753-K2002 PolarHBondContact OE2-NZ 3.34Å; T1798-K2002 HydrophobicContact CG2-CB 3.98Å; T1798-K2002 HydrophobicContact CG2-CG 4.47Å; V1802-K2002 HydrophobicContact CG2-CD 4.44Å; V1802-K2002 VanDerWaalsContact CG2-CE 3.42Å; V1802-K2002 HydrophobicContact CG2-CG 4.19Å; P1978-K2002 PolarHBondContact O-N 3.44Å; M1979-K2002 CarbonylContact C-O 3.52Å; M1979-K2002 VanDerWaalsContact CA-O 3.28Å; M1979-K2002 WeakPolarHBondContact CA-O 3.5Å; T1980-K2002 PolarHBondContact N-O 3.49Å; K2000-K2002 PolarHBondContact O-N 2.86Å
2003	V	93.6	Very high	87.7	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130	168.9	-175.5	0	0	0	0	108.8	I1722 T1980 F1982 A1990 F1993 M1994 H1999	I1722-V2003 HydrophobicContact CD1-CG1 4.02Å; I1722-V2003 PolarHBondContact N-O 2.89Å; T1980-V2003 WeakPolarHBondContact O-CA 3.4Å; F1982-V2003 HydrophobicContact CD2-CG1 3.94Å; F1982-V2003 HydrophobicContact CE2-CG1 4.08Å; A1990-V2003 HydrophobicContact CB-CG1 4.32Å; F1993-V2003 HydrophobicContact CD1-CG2 4.19Å; F1993-V2003 HydrophobicContact CE1-CG2 4.27Å; M1994-V2003 HydrophobicContact CB-CG2 4.06Å; M1994-V2003 HydrophobicContact CG-CB 4.49Å; M1994-V2003 HydrophobicContact CG-CG2 3.95Å; M1994-V2003 HydrophobicContact SD-CB 4.14Å; M1994-V2003 HydrophobicContact SD-CG2 4.17Å; H1999-V2003 HydrophobicContact CB-CG2 3.81Å
2004	L	94.8	Very high	87.4	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	146.7	-174	-61	178.8	0	0	0	111.2	H1794 A1797 T1798 M1979 T1980 I1981 F1982	H1794-L2004 HydrophobicContact CB-CD1 4.28Å; H1794-L2004 VanDerWaalsContact O-CD1 3.22Å; H1794-L2004 WeakPolarHBondContact O-CD1 3.35Å; A1797-L2004 HydrophobicContact CB-CD1 4.43Å; A1797-L2004 HydrophobicContact CB-CD2 3.86Å; A1797-L2004 WeakPolarHBondContact O-CD2 3.39Å; T1798-L2004 HydrophobicContact CG2-CD1 3.96Å; T1798-L2004 HydrophobicContact CG2-CD2 4.37Å; T1798-L2004 HydrophobicContact CG2-CG 4.47Å; M1979-L2004 HydrophobicContact CB-CD1 3.93Å; M1979-L2004 HydrophobicContact CB-CG 4.36Å; M1979-L2004 HydrophobicContact CG-CD1 4.11Å; M1979-L2004 HydrophobicContact SD-CD1 3.72Å; T1980-L2004 PolarHBondContact O-N 3.23Å; I1981-L2004 HydrophobicContact CG1-CB 4.3Å; I1981-L2004 HydrophobicContact CG1-CD1 4.24Å; F1982-L2004 PolarHBondContact N-O 3.09Å
2005	L	94	Very high	87.4	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	120.8	167.6	-61.4	174.7	0	0	0	108.7	I1684 Y1719 A1720 I1722 M1773 F1982 V1987 A1990 I2007	I1684-L2005 HydrophobicContact CD1-CD1 3.69Å; Y1719-L2005 WeakPolarHBondContact CA-O 3.19Å; A1720-L2005 PolarHBondContact N-O 2.72Å; A1720-L2005 VanDerWaalsContact N-O 3.11Å; A1720-L2005 PolarHBondContact O-N 3.36Å; I1722-L2005 HydrophobicContact CD1-CD1 4.49Å; I1722-L2005 HydrophobicContact CD1-CD2 4.25Å; I1722-L2005 HydrophobicContact CD1-CG 4.26Å; I1722-L2005 HydrophobicContact CG1-CD1 4.39Å; I1722-L2005 HydrophobicContact CG1-CG 4.27Å; M1773-L2005 HydrophobicContact CG-CD1 4.21Å; M1773-L2005 HydrophobicContact SD-CD1 3.71Å; F1982-L2005 HydrophobicContact CB-CD2 4.23Å; F1982-L2005 CarbonylContact O-C 3.5Å; F1982-L2005 WeakPolarHBondContact O-CA 3.31Å; V1987-L2005 HydrophobicContact CG1-CD1 3.94Å; V1987-L2005 HydrophobicContact CG1-CD2 4.33Å; V1987-L2005 HydrophobicContact CG2-CD1 4.42Å; V1987-L2005 HydrophobicContact CG2-CD2 4.34Å; A1990-L2005 HydrophobicContact CB-CD2 3.83Å; L2005-I2007 HydrophobicContact CB-CD1 3.82Å; L2005-I2007 PolarHBondContact O-N 3.06Å
2006	K	95.4	Very high	87.8	Confident	54 Å²	54	53.3 Å²	53.3	24%	0.235	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	109.8	171.5	-176.7	173.9	70.1	164.6	0	109.3	Y1719 I1981 F1982 Y1984 E2009	Y1719-K2006 HydrophobicContact CD1-CB 4.04Å; Y1719-K2006 HydrophobicContact CD1-CG 4.24Å; Y1719-K2006 HydrophobicContact CE1-CB 3.66Å; Y1719-K2006 HydrophobicContact CE1-CD 3.95Å; Y1719-K2006 HydrophobicContact CE1-CG 3.53Å; I1981-K2006 HydrophobicContact CG2-CB 3.79Å; F1982-K2006 PolarHBondContact O-N 3.37Å; Y1984-K2006 WeakPolarHBondContact CB-O 3.31Å; Y1984-K2006 WeakPolarHBondContact CD1-O 3.45Å; Y1984-K2006 PolarHBondContact N-O 3.16Å; K2006-E2009 WeakPolarHBondContact CD-OE2 3.49Å; K2006-E2009 WeakPolarHBondContact CE-OE2 3.5Å; K2006-E2009 IonicContact NZ-OE1 3.27Å; K2006-E2009 PolarHBondContact NZ-OE1 2.86Å; K2006-E2009 IonicContact NZ-OE2 3.96Å; K2006-E2009 PolarHBondContact NZ-OE2 2.93Å
2007	I	93.9	Very high	88.1	Confident	3 Å²	3	54.7 Å²	54.7	2%	0.015	28%	0.283	C	S	.	.			trans	-94	-42.4	-178.4	-44.9	-55.1	0	0	0	110.9	W1697 V1717 Y1718 A1720 T1775 L2005 L2021	W1697-I2007 HydrophobicContact CH2-CD1 4.15Å; W1697-I2007 HydrophobicContact CH2-CG2 4.17Å; W1697-I2007 HydrophobicContact CZ2-CD1 4.04Å; W1697-I2007 HydrophobicContact CZ2-CG2 4.5Å; V1717-I2007 HydrophobicContact CG1-CG1 4.17Å; Y1718-I2007 WeakPolarHBondContact O-CA 3.26Å; Y1718-I2007 WeakPolarHBondContact O-CB 3.17Å; Y1718-I2007 PolarHBondContact O-N 3.19Å; A1720-I2007 HydrophobicContact CB-CG1 4.45Å; T1775-I2007 HydrophobicContact CG2-CG2 4.3Å; L2005-I2007 HydrophobicContact CB-CD1 3.82Å; L2005-I2007 PolarHBondContact O-N 3.06Å; I2007-L2021 HydrophobicContact CG2-CD2 3.82Å; I2007-L2021 VanDerWaalsContact O-CD2 3.23Å; I2007-L2021 WeakPolarHBondContact O-CD2 3.24Å
2008	R	92.8	Very high	88.7	Confident	12 Å²	12	54.4 Å²	54.4	5%	0.045	28%	0.275	C	S	.	.	S	Bend	trans	-130.2	155.5	172.7	-68.6	-179.3	171.8	80.5	-1.6	110.5	V1717 Y1718 T1775 S2019 L2021	V1717-R2008 PolarHBondContact O-NH1 3.2Å; Y1718-R2008 HydrophobicContact CD1-CB 3.53Å; Y1718-R2008 HydrophobicContact CD2-CB 4.44Å; Y1718-R2008 HydrophobicContact CE1-CB 3.82Å; Y1718-R2008 HydrophobicContact CG-CB 3.87Å; Y1718-R2008 PolarHBondContact O-N 2.85Å; Y1718-R2008 VanDerWaalsContact O-N 3.1Å; T1775-R2008 PolarHBondContact O-NH1 3.11Å; R2008-S2019 PolarHBondContact NE-O 3.39Å; R2008-L2021 HydrophobicContact CG-CB 4.04Å; R2008-L2021 HydrophobicContact CG-CD2 3.82Å; R2008-L2021 HydrophobicContact CG-CG 4.44Å
2009	E	89.5	Confident	89	Confident	118 Å²	118	49.5 Å²	49.5	55%	0.551	26%	0.258	S	S	*	.	P	Polyproline II helix	trans	-75.7	137.6	166.1	-138.5	65.8	-149.3	0	0	110.2	Y1718 K2006	Y1718-E2009 WeakPolarHBondContact CD1-O 3.3Å; Y1718-E2009 WeakPolarHBondContact CE1-O 3.35Å; K2006-E2009 WeakPolarHBondContact CD-OE2 3.49Å; K2006-E2009 WeakPolarHBondContact CE-OE2 3.5Å; K2006-E2009 IonicContact NZ-OE1 3.27Å; K2006-E2009 PolarHBondContact NZ-OE1 2.86Å; K2006-E2009 IonicContact NZ-OE2 3.96Å; K2006-E2009 PolarHBondContact NZ-OE2 2.93Å
2010	E	89.8	Confident	88.9	Confident	35 Å²	35	53.9 Å²	53.9	16%	0.164	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-78.2	126	176.8	172.6	164.3	-133.6	0	0	110.8	Y1718 R1763 K1792 M1793	Y1718-E2010 HydrophobicContact CD1-CB 4.48Å; R1763-E2010 IonicContact CZ-OE1 3.9Å; R1763-E2010 IonicContact NE-OE1 2.73Å; R1763-E2010 PolarHBondContact NE-OE1 3.42Å; R1763-E2010 IonicContact NH2-OE1 2.66Å; R1763-E2010 PolarHBondContact NH2-OE1 3.15Å; R1763-E2010 IonicContact NH2-OE2 3.58Å; K1792-E2010 WeakPolarHBondContact CA-OE2 3.47Å; K1792-E2010 WeakPolarHBondContact CD-OE2 3.37Å; M1793-E2010 HydrophobicContact CE-CB 4.05Å; M1793-E2010 HydrophobicContact CE-CG 3.65Å; M1793-E2010 VanDerWaalsContact CE-OE1 3.29Å; M1793-E2010 WeakPolarHBondContact CE-OE1 3.24Å; M1793-E2010 VanDerWaalsContact CG-OE1 3.29Å; M1793-E2010 WeakPolarHBondContact CG-OE1 3.45Å; M1793-E2010 PolarHBondContact N-OE1 3.38Å; M1793-E2010 PolarHBondContact N-OE2 3.37Å
2011	E	89.7	Confident	89.1	Confident	47 Å²	47	52.7 Å²	52.7	22%	0.22	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-69.7	147.8	176.8	-50.8	80.7	-177.3	0	0	111.7	Y1718 R1757 A2013 S2019	Y1718-E2011 WeakPolarHBondContact CE1-OE1 3.43Å; Y1718-E2011 VanDerWaalsContact CE1-OE2 3.27Å; Y1718-E2011 WeakPolarHBondContact CE1-OE2 2.99Å; Y1718-E2011 VanDerWaalsContact OH-CD 3.23Å; Y1718-E2011 PolarHBondContact OH-OE1 3.06Å; Y1718-E2011 PolarHBondContact OH-OE2 2.78Å; Y1718-E2011 VanDerWaalsContact OH-OE2 3.14Å; R1757-E2011 IonicContact CZ-OE2 2.71Å; R1757-E2011 IonicContact NE-OE2 3.07Å; R1757-E2011 PolarHBondContact NE-OE2 3.39Å; R1757-E2011 IonicContact NH2-OE2 2.78Å; R1757-E2011 PolarHBondContact NH2-OE2 2.95Å; E2011-A2013 PolarHBondContact O-N 2.84Å; E2011-S2019 VanDerWaalsContact OE1-CB 3.27Å; E2011-S2019 WeakPolarHBondContact OE1-CB 3.15Å; E2011-S2019 PolarHBondContact OE1-N 3.33Å; E2011-S2019 PolarHBondContact OE1-OG 3.47Å
2012	E	82.6	Confident	89	Confident	196 Å²	196	57.3 Å²	57.3	92%	0.916	30%	0.304	S	S	*	.	S	Bend	trans	-60.9	-30.9	176.7	-60.4	-167.9	146.7	0	0	113	K2014	E2012-K2014 PolarHBondContact O-N 3.35Å
2013	A	83	Confident	88.9	Confident	51 Å²	51	57 Å²	57	42%	0.421	30%	0.303	S	S	.	.			trans	-75.2	120.5	178.1	0	0	0	0	0	111.2	R1757 E2011 L2015 C2016	R1757-A2013 PolarHBondContact NH2-O 2.86Å; E2011-A2013 PolarHBondContact O-N 2.84Å; A2013-L2015 VanDerWaalsContact C-N 3.35Å; A2013-L2015 PolarHBondContact O-N 2.88Å; A2013-C2016 HydrophobicContact CB-CB 4.04Å; A2013-C2016 PolarHBondContact O-SG 2.86Å
2014	K	81.3	Confident	88.7	Confident	110 Å²	110	62.4 Å²	62.4	48%	0.478	33%	0.33	S	S	.	.	S	Bend	trans	-68.3	-32.3	-178.4	-57.7	-165.9	-165.9	178.8	0	113.6	R1757 R1763 D1789 E2012	R1757-K2014 PolarHBondContact NH1-O 3.2Å; R1763-K2014 WeakPolarHBondContact CD-O 3.28Å; R1763-K2014 WeakPolarHBondContact CG-O 3.32Å; D1789-K2014 PolarHBondContact O-NZ 2.95Å; D1789-K2014 WeakPolarHBondContact OD1-CD 3.49Å; D1789-K2014 IonicContact OD1-NZ 2.85Å; D1789-K2014 PolarHBondContact OD1-NZ 3.06Å; E2012-K2014 PolarHBondContact O-N 3.35Å
2015	L	86.9	Confident	88.4	Confident	133 Å²	133	62.4 Å²	62.4	70%	0.696	33%	0.33	S	S	*	.	S	Bend	trans	-121.2	98.8	175.4	-172.3	75.3	0	0	0	109.3	E1762 A2013	E1762-L2015 HydrophobicContact CB-CD1 4.49Å; A2013-L2015 VanDerWaalsContact C-N 3.35Å; A2013-L2015 PolarHBondContact O-N 2.88Å
2016	C	89.5	Confident	88	Confident	25 Å²	25	62.9 Å²	62.9	17%	0.169	33%	0.334	C	S	.	.			trans	-151.6	151.3	174.3	64.6	0	0	0	0	109.2	R1757 G1761 A2013	R1757-C2016 WeakPolarHBondContact CD-O 3.34Å; R1757-C2016 VanDerWaalsContact CZ-SG 3.51Å; R1757-C2016 PolarHBondContact NH2-SG 3.41Å; G1761-C2016 WeakPolarHBondContact CA-O 3.35Å; A2013-C2016 HydrophobicContact CB-CB 4.04Å; A2013-C2016 PolarHBondContact O-SG 2.86Å
2017	P	85.3	Confident	87.3	Confident	98 Å²	98	61.8 Å²	61.8	64%	0.636	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-57.7	149.2	171.5	27.1	-35.1	0	0	0	110.3
2018	P	88.5	Confident	86.9	Confident	31 Å²	31	64.7 Å²	64.7	20%	0.201	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-66.4	144.4	-175.8	24.6	-32.9	0	0	0	112.9	Y1718 R1757	Y1718-P2018 HydrophobicContact CE2-CB 4.16Å; Y1718-P2018 WeakPolarHBondContact OH-CA 3.31Å; Y1718-P2018 WeakPolarHBondContact OH-CB 3.49Å; R1757-P2018 HydrophobicContact CB-CB 4.21Å
2019	S	85.8	Confident	86.6	Confident	40 Å²	40	64.4 Å²	64.4	28%	0.28	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-60.7	135	172.2	40.5	0	0	0	0	111.8	Y1718 R2008 E2011 L2021	Y1718-S2019 PolarHBondContact OH-N 2.79Å; R2008-S2019 PolarHBondContact NE-O 3.39Å; E2011-S2019 VanDerWaalsContact OE1-CB 3.27Å; E2011-S2019 WeakPolarHBondContact OE1-CB 3.15Å; E2011-S2019 PolarHBondContact OE1-N 3.33Å; E2011-S2019 PolarHBondContact OE1-OG 3.47Å; S2019-L2021 PolarHBondContact O-N 3.45Å
2020	P	84	Confident	86.6	Confident	114 Å²	114	59.3 Å²	59.3	74%	0.74	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-65.9	131.3	173	28.1	-33.2	0	0	0	109.1
2021	L	89.2	Confident	86.6	Confident	27 Å²	27	57.9 Å²	57.9	14%	0.141	31%	0.312	C	S	.	.			trans	-131.9	127.8	175.2	173.5	76.5	0	0	0	106.7	E1680 T1775 I2007 R2008 S2019 V2023	E1680-L2021 WeakPolarHBondContact CA-O 3.47Å; T1775-L2021 HydrophobicContact CG2-CD2 4.07Å; I2007-L2021 HydrophobicContact CG2-CD2 3.82Å; I2007-L2021 VanDerWaalsContact O-CD2 3.23Å; I2007-L2021 WeakPolarHBondContact O-CD2 3.24Å; R2008-L2021 HydrophobicContact CG-CB 4.04Å; R2008-L2021 HydrophobicContact CG-CD2 3.82Å; R2008-L2021 HydrophobicContact CG-CG 4.44Å; S2019-L2021 PolarHBondContact O-N 3.45Å; L2021-V2023 HydrophobicContact CD2-CG1 4.1Å; L2021-V2023 HydrophobicContact CG-CG1 4.21Å
2022	K	88.5	Confident	86.7	Confident	100 Å²	100	56.5 Å²	56.5	44%	0.435	31%	0.307	S	S	.	.			trans	-111.3	145.4	162.1	-62.3	175	-179.8	178.5	0	109.1	E1678 T1679 E1680	E1678-K2022 HydrophobicContact CG-CB 3.78Å; E1678-K2022 HydrophobicContact CG-CD 4.26Å; E1678-K2022 WeakPolarHBondContact OE2-CD 3.29Å; E1678-K2022 IonicContact OE2-NZ 2.72Å; T1679-K2022 WeakPolarHBondContact O-CA 3.46Å; E1680-K2022 HydrophobicContact CG-CD 4.39Å; E1680-K2022 HydrophobicContact CG-CG 3.51Å; E1680-K2022 WeakPolarHBondContact OE1-CE 3.42Å
2023	V	89.8	Confident	87	Confident	4 Å²	4	50.2 Å²	50.2	2%	0.024	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	146.5	171.4	-63.1	0	0	0	0	108.9	T1679 A1682 W1697 T1775 Y1984 L2021 A2025	T1679-V2023 PolarHBondContact N-O 2.87Å; T1679-V2023 PolarHBondContact O-N 3.27Å; A1682-V2023 HydrophobicContact CB-CG2 3.64Å; W1697-V2023 HydrophobicContact CD2-CG2 4.12Å; W1697-V2023 HydrophobicContact CE3-CG2 4.13Å; W1697-V2023 HydrophobicContact CG-CG2 4.36Å; T1775-V2023 HydrophobicContact CG2-CG1 4.02Å; T1775-V2023 HydrophobicContact CG2-CG2 3.8Å; Y1984-V2023 HydrophobicContact CD2-CG1 4.29Å; Y1984-V2023 HydrophobicContact CE2-CG1 4Å; L2021-V2023 HydrophobicContact CD2-CG1 4.1Å; L2021-V2023 HydrophobicContact CG-CG1 4.21Å; V2023-A2025 HydrophobicContact CG2-CB 4.47Å; V2023-A2025 PolarHBondContact O-N 2.77Å
2024	M	88.7	Confident	87.3	Confident	112 Å²	112	50.4 Å²	50.4	55%	0.552	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.9	110.2	165.6	-72.4	-56.8	-56.8	0	0	108.2	C1676 E1678	C1676-M2024 HydrophobicContact CB-CE 3.58Å; C1676-M2024 WeakPolarHBondContact O-CE 3.34Å; E1678-M2024 HydrophobicContact CB-SD 3.9Å; E1678-M2024 HydrophobicContact CG-SD 3.91Å
2025	A	88	Confident	87.9	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	143.1	178.8	0	0	0	0	0	110.5	C1676 E1677 T1679 A1682 W1697 V2023 T2027	C1676-A2025 CarbonylContact C-O 3.23Å; C1676-A2025 WeakPolarHBondContact CA-O 3.45Å; C1676-A2025 WeakPolarHBondContact CB-O 3.36Å; E1677-A2025 PolarHBondContact N-O 3.21Å; E1677-A2025 PolarHBondContact O-N 2.99Å; T1679-A2025 HydrophobicContact CG2-CB 3.66Å; A1682-A2025 HydrophobicContact CB-CB 3.82Å; W1697-A2025 HydrophobicContact CB-CB 3.92Å; W1697-A2025 CarbonylContact O-C 3.31Å; W1697-A2025 WeakPolarHBondContact O-CA 3.33Å; V2023-A2025 HydrophobicContact CG2-CB 4.47Å; V2023-A2025 PolarHBondContact O-N 2.77Å; A2025-T2027 PolarHBondContact O-N 3.48Å
2026	A	84.9	Confident	88.4	Confident	11 Å²	11	40.5 Å²	40.5	9%	0.091	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.2	125.7	167.7	0	0	0	0	0	109.4	T1696 W1697 G1699	T1696-A2026 HydrophobicContact CG2-CB 4.49Å; W1697-A2026 WeakPolarHBondContact O-CB 3.19Å; W1697-A2026 PolarHBondContact O-N 3.35Å; G1699-A2026 PolarHBondContact N-O 2.95Å
2027	T	82.1	Confident	88.8	Confident	30 Å²	30	39.5 Å²	39.5	18%	0.184	23%	0.229	C	C	.	.			trans	-66	144.9	177.4	54.7	0	0	0	0	110.2	C1675 E1677 A2025 S2251	C1675-T2027 HydrophobicContact CB-CG2 4.44Å; C1675-T2027 WeakPolarHBondContact O-CB 3.44Å; C1675-T2027 WeakPolarHBondContact O-CG2 3.46Å; C1675-T2027 PolarHBondContact O-N 3.16Å; C1675-T2027 PolarHBondContact O-OG1 2.76Å; E1677-T2027 HydrophobicContact CB-CG2 3.72Å; E1677-T2027 HydrophobicContact CG-CG2 3.73Å; A2025-T2027 PolarHBondContact O-N 3.48Å; T2027-S2251 WeakPolarHBondContact OG1-CB 3.44Å; T2027-S2251 PolarHBondContact OG1-OG 2.8Å
2028	R	84.1	Confident	89.3	Confident	64 Å²	64	34.8 Å²	34.8	24%	0.242	20%	0.199	C	C	.	.			trans	-145	121.7	-179.1	-167.2	77.5	156.4	176.3	-6.3	106.1	I1698 D1747 Y2030 D2247	I1698-R2028 HydrophobicContact CG2-CB 3.69Å; I1698-R2028 HydrophobicContact CG2-CG 3.95Å; D1747-R2028 VanDerWaalsContact CG-NH2 3.27Å; D1747-R2028 IonicContact OD1-CZ 2.71Å; D1747-R2028 IonicContact OD1-NH2 3.39Å; D1747-R2028 PolarHBondContact OD1-NH2 2.87Å; D1747-R2028 IonicContact OD2-CZ 2.68Å; D1747-R2028 VanDerWaalsContact OD2-CZ 3.31Å; D1747-R2028 IonicContact OD2-NE 2.69Å; D1747-R2028 PolarHBondContact OD2-NE 2.7Å; D1747-R2028 IonicContact OD2-NH2 3.84Å; D1747-R2028 PolarHBondContact OD2-NH2 3.26Å; R2028-Y2030 HydrophobicContact CB-CD2 4.1Å; R2028-Y2030 HydrophobicContact CB-CE2 3.65Å; R2028-Y2030 HydrophobicContact CG-CD2 4.14Å; R2028-Y2030 HydrophobicContact CG-CE2 3.45Å; R2028-Y2030 VanDerWaalsContact CG-CE2 3.45Å; R2028-Y2030 WeakPolarHBondContact O-CD2 3.45Å; R2028-Y2030 PolarHBondContact O-N 3.2Å; R2028-Y2030 VanDerWaalsContact O-N 3.15Å; R2028-D2247 IonicContact NH1-OD2 2.75Å
2029	S	87.6	Confident	89.7	Confident	6 Å²	6	33.3 Å²	33.3	4%	0.042	19%	0.189	C	C	.	.			trans	-73.4	109.9	-178.8	60	0	0	0	0	110.2	W2053 R2057 D2247	S2029-W2053 WeakPolarHBondContact OG-CH2 3.46Å; S2029-R2057 WeakPolarHBondContact O-CD 3.3Å; S2029-R2057 WeakPolarHBondContact O-CG 3.42Å; S2029-R2057 PolarHBondContact O-NH1 3.2Å; S2029-R2057 PolarHBondContact OG-NH1 3.01Å; S2029-D2247 VanDerWaalsContact CB-OD1 3.31Å; S2029-D2247 WeakPolarHBondContact CB-OD1 3.26Å; S2029-D2247 PolarHBondContact N-OD1 2.71Å; S2029-D2247 PolarHBondContact OG-OD1 3.27Å
2030	Y	88.9	Confident	90.2	Very high	12 Å²	12	31.4 Å²	31.4	5%	0.047	18%	0.176	C	C	.	.			trans	-111.1	145.1	172.1	-73.7	-79.3	0	0	0	110.7	F1683 G1699 P1701 Y1704 D1747 R2028 W2166	F1683-Y2030 WeakPolarHBondContact CZ-OH 3.13Å; G1699-Y2030 VanDerWaalsContact O-CE2 3.22Å; G1699-Y2030 WeakPolarHBondContact O-CE2 3.3Å; P1701-Y2030 HydrophobicContact CB-CD1 3.74Å; P1701-Y2030 HydrophobicContact CB-CD2 4.46Å; P1701-Y2030 HydrophobicContact CB-CE1 4Å; P1701-Y2030 HydrophobicContact CB-CG 3.98Å; P1701-Y2030 HydrophobicContact CG-CD1 4.25Å; P1701-Y2030 HydrophobicContact CG-CE1 3.97Å; Y1704-Y2030 WeakPolarHBondContact CE2-O 3.43Å; D1747-Y2030 PolarHBondContact OD2-OH 3.17Å; R2028-Y2030 HydrophobicContact CB-CD2 4.1Å; R2028-Y2030 HydrophobicContact CB-CE2 3.65Å; R2028-Y2030 HydrophobicContact CG-CD2 4.14Å; R2028-Y2030 HydrophobicContact CG-CE2 3.45Å; R2028-Y2030 VanDerWaalsContact CG-CE2 3.45Å; R2028-Y2030 WeakPolarHBondContact O-CD2 3.45Å; R2028-Y2030 PolarHBondContact O-N 3.2Å; R2028-Y2030 VanDerWaalsContact O-N 3.15Å; Y2030-W2166 WeakPolarHBondContact O-CH2 3.43Å
2031	C	90.5	Very high	90.5	Very high	5 Å²	5	27 Å²	27	3%	0.034	15%	0.151	C	C	.	.			trans	-89.6	149	177.3	-65.7	0	0	0	0	111.4	Y2037 L2054 R2057 A2059	C2031-Y2037 WeakPolarHBondContact CA-OH 3.45Å; C2031-Y2037 HydrophobicContact CB-CE2 3.67Å; C2031-L2054 VanDerWaalsContact SG-CD2 3.57Å; C2031-R2057 PolarHBondContact N-O 2.94Å; C2031-A2059 HydrophobicContact CB-CB 4Å
2032	C	90.7	Very high	90.5	Very high	17 Å²	17	25.7 Å²	25.7	12%	0.115	14%	0.144	C	C	.	.			trans	-83.1	121.9	169.3	177.6	0	0	0	0	108.6	Y1704 A2034 H2035 Y2037	Y1704-C2032 HydrophobicContact CD1-CB 4.1Å; Y1704-C2032 HydrophobicContact CE1-CB 4.34Å; Y1704-C2032 HydrophobicContact CG-CB 4.32Å; C2032-A2034 PolarHBondContact O-N 3.46Å; C2032-A2034 VanDerWaalsContact O-N 3.14Å; C2032-H2035 HydrophobicContact CB-CB 4.12Å; C2032-H2035 PolarHBondContact O-N 3.31Å; C2032-H2035 VanDerWaalsContact O-N 3.08Å; C2032-H2035 PolarHBondContact SG-CD2 2.89Å; C2032-Y2037 PolarHBondContact N-OH 3.26Å
2033	P	89.2	Confident	90.7	Very high	64 Å²	64	21.1 Å²	21.1	42%	0.416	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-23.9	-177.1	-25.6	35.3	0	0	0	114.6	R2060	P2033-R2060 HydrophobicContact CB-CG 4.33Å
2034	A	89.9	Confident	90.5	Very high	55 Å²	55	22.9 Å²	22.9	46%	0.455	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-24.7	177.9	0	0	0	0	0	113.5	C2032 K2061	C2032-A2034 PolarHBondContact O-N 3.46Å; C2032-A2034 VanDerWaalsContact O-N 3.14Å; A2034-K2061 WeakPolarHBondContact O-CD 3.3Å; A2034-K2061 WeakPolarHBondContact O-CE 3.35Å; A2034-K2061 PolarHBondContact O-NZ 3.3Å
2035	H	94.8	Very high	90.3	Very high	36 Å²	36	18 Å²	18	17%	0.167	12%	0.122	C	C	.	.	S	Bend	trans	-82.2	151.8	-175.8	-68.2	-162.4	0	0	0	111.6	C2032 Y2037 P2114 G2116	C2032-H2035 HydrophobicContact CB-CB 4.12Å; C2032-H2035 PolarHBondContact O-N 3.31Å; C2032-H2035 VanDerWaalsContact O-N 3.08Å; C2032-H2035 PolarHBondContact SG-CD2 2.89Å; H2035-Y2037 HydrophobicContact CB-CE2 4.07Å; H2035-P2114 CarbonylContact C-O 3.56Å; H2035-P2114 VanDerWaalsContact CA-O 3.32Å; H2035-P2114 WeakPolarHBondContact CA-O 3.47Å; H2035-G2116 VanDerWaalsContact ND1-CA 3.27Å; H2035-G2116 WeakPolarHBondContact ND1-CA 3.46Å
2036	V	96.3	Very high	90.3	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	139.5	170.1	-171.8	0	0	0	0	109.2	K2061 V2063 T2109 I2112 P2114 G2116	V2036-K2061 HydrophobicContact CB-CB 4.44Å; V2036-K2061 HydrophobicContact CG2-CB 4.06Å; V2036-K2061 HydrophobicContact CG2-CD 3.97Å; V2036-V2063 HydrophobicContact CG1-CG2 3.76Å; V2036-T2109 HydrophobicContact CB-CG2 4.21Å; V2036-T2109 HydrophobicContact CG1-CG2 3.63Å; V2036-I2112 HydrophobicContact CG2-CB 3.89Å; V2036-I2112 HydrophobicContact CG2-CG2 3.87Å; V2036-P2114 PolarHBondContact N-O 3.32Å; V2036-G2116 PolarHBondContact O-N 3.44Å
2037	Y	97.5	Very high	90.6	Very high	3 Å²	3	19.1 Å²	19.1	1%	0.012	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	120.8	172	-62.6	-86.4	0	0	0	109.5	C2031 C2032 H2035 A2059 K2061 V2063 F2119 W2166	C2031-Y2037 WeakPolarHBondContact CA-OH 3.45Å; C2031-Y2037 HydrophobicContact CB-CE2 3.67Å; C2032-Y2037 PolarHBondContact N-OH 3.26Å; H2035-Y2037 HydrophobicContact CB-CE2 4.07Å; Y2037-A2059 HydrophobicContact CD2-CB 3.84Å; Y2037-A2059 HydrophobicContact CE2-CB 4.14Å; Y2037-K2061 PolarHBondContact N-O 2.79Å; Y2037-V2063 PolarHBondContact O-N 3.12Å; Y2037-F2119 HydrophobicContact CD1-CE2 4.1Å; Y2037-W2166 AromaticContact CE1-CE3 3.92Å; Y2037-W2166 HydrophobicContact CE1-CE3 3.92Å; Y2037-W2166 AromaticContact CE1-CZ3 3.86Å; Y2037-W2166 HydrophobicContact CE1-CZ3 3.86Å
2038	L	97.2	Very high	91.1	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	117.7	-177.7	175.6	61.3	0	0	0	109.4	T2040 V2063 T2065 L2105 T2109 G2117 I2118 F2119	L2038-T2040 HydrophobicContact CG-CG2 4.47Å; L2038-V2063 HydrophobicContact CD1-CB 3.86Å; L2038-V2063 HydrophobicContact CD1-CG1 3.64Å; L2038-T2065 HydrophobicContact CD1-CG2 4.01Å; L2038-L2105 HydrophobicContact CD1-CD1 4.11Å; L2038-L2105 HydrophobicContact CD1-CD2 4.26Å; L2038-L2105 HydrophobicContact CD1-CG 4.31Å; L2038-L2105 HydrophobicContact CD2-CD2 4.31Å; L2038-L2105 HydrophobicContact CD2-CG 4.48Å; L2038-T2109 HydrophobicContact CB-CG2 4.48Å; L2038-G2117 PolarHBondContact N-O 2.76Å; L2038-I2118 HydrophobicContact CB-CG1 4.45Å; L2038-I2118 WeakPolarHBondContact O-CA 3.41Å; L2038-F2119 PolarHBondContact O-N 3.33Å
2039	I	97	Very high	91.4	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	102.6	-178.6	-46.2	-179	0	0	0	108.8	G2042 L2050 A2051 L2054 L2062 V2063 L2064 T2065 F2119 L2121	I2039-G2042 PolarHBondContact O-N 3.4Å; I2039-L2050 HydrophobicContact CD1-CG 4.42Å; I2039-L2050 HydrophobicContact CG2-CD2 4.3Å; I2039-A2051 HydrophobicContact CD1-CB 3.96Å; I2039-L2054 HydrophobicContact CD1-CD1 3.74Å; I2039-L2054 HydrophobicContact CG1-CD1 4.42Å; I2039-L2062 HydrophobicContact CD1-CD2 4.41Å; I2039-V2063 PolarHBondContact N-O 2.92Å; I2039-L2064 HydrophobicContact CB-CD2 3.89Å; I2039-L2064 HydrophobicContact CD1-CD2 3.77Å; I2039-L2064 HydrophobicContact CG1-CD2 4.05Å; I2039-T2065 PolarHBondContact O-N 3.1Å; I2039-F2119 WeakPolarHBondContact CA-O 3.39Å; I2039-F2119 HydrophobicContact CG1-CB 4.47Å; I2039-F2119 HydrophobicContact CG2-CB 4.34Å; I2039-L2121 HydrophobicContact CG2-CD1 4.1Å
2040	T	95.3	Very high	91.6	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	127.4	178.8	72.3	0	0	0	0	109.9	L2038 G2042 T2065 I2096 F2119 H2120 L2121 A2122 L2152	L2038-T2040 HydrophobicContact CG-CG2 4.47Å; T2040-G2042 VanDerWaalsContact C-N 3.32Å; T2040-T2065 VanDerWaalsContact CA-OG1 3.26Å; T2040-T2065 WeakPolarHBondContact CA-OG1 3.42Å; T2040-T2065 HydrophobicContact CG2-CG2 4.33Å; T2040-I2096 HydrophobicContact CG2-CD1 4.18Å; T2040-I2096 HydrophobicContact CG2-CG2 4.1Å; T2040-F2119 PolarHBondContact N-O 3.26Å; T2040-H2120 WeakPolarHBondContact OG1-CA 3.43Å; T2040-H2120 PolarHBondContact OG1-ND1 3.23Å; T2040-L2121 CarbonylContact O-C 3.51Å; T2040-L2121 PolarHBondContact O-N 2.87Å; T2040-L2121 VanDerWaalsContact O-N 3.11Å; T2040-A2122 PolarHBondContact O-N 3.4Å; T2040-L2152 HydrophobicContact CG2-CD1 4.37Å; T2040-L2152 HydrophobicContact CG2-CD2 4.34Å
2041	G	90.1	Very high	91.8	Very high	21 Å²	21	14.7 Å²	14.7	22%	0.216	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.6	13.5	-165.3	0	0	0	0	0	113.4	L2043 G2044 T2065	G2041-L2043 PolarHBondContact O-N 2.97Å; G2041-G2044 PolarHBondContact O-N 2.83Å; G2041-T2065 CarbonylContact C-O 3.33Å; G2041-T2065 VanDerWaalsContact CA-O 3.25Å; G2041-T2065 WeakPolarHBondContact CA-O 3.28Å; G2041-T2065 PolarHBondContact N-O 2.51Å; G2041-T2065 PolarHBondContact N-OG1 2.92Å
2042	G	90.2	Very high	91.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	0.5	-171.7	0	0	0	0	0	117.5	I2039 T2040 G2047 T2065	I2039-G2042 PolarHBondContact O-N 3.4Å; T2040-G2042 VanDerWaalsContact C-N 3.32Å; G2042-G2047 CarbonylContact O-C 3.59Å; G2042-T2065 PolarHBondContact N-O 2.74Å
2043	L	91	Very high	91.7	Very high	3 Å²	3	15.5 Å²	15.5	2%	0.016	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-3	169.3	-60.6	-176.5	0	0	0	113.7	G2041 L2048 L2064 G2069 V2070 Q2075 I2091	G2041-L2043 PolarHBondContact O-N 2.97Å; L2043-L2048 HydrophobicContact CD2-CD2 3.84Å; L2043-L2064 HydrophobicContact CD2-CB 4.33Å; L2043-L2064 HydrophobicContact CD2-CD1 3.83Å; L2043-G2069 VanDerWaalsContact CD1-O 3.27Å; L2043-G2069 WeakPolarHBondContact CD1-O 3.23Å; L2043-V2070 HydrophobicContact CD1-CG2 4.05Å; L2043-Q2075 PolarHBondContact O-NE2 2.98Å; L2043-I2091 HydrophobicContact CD1-CD1 4.33Å; L2043-I2091 HydrophobicContact CD1-CG2 3.91Å
2044	G	85.9	Confident	91.8	Very high	41 Å²	41	12.5 Å²	12.5	42%	0.423	9%	0.088	S	C	.	.	S	Bend	trans	-69.9	156.3	163.4	0	0	0	0	0	110.5	G2041 L2046 G2047 L2048	G2041-G2044 PolarHBondContact O-N 2.83Å; G2044-L2046 PolarHBondContact O-N 3.21Å; G2044-G2047 CarbonylContact O-C 3.56Å; G2044-G2047 VanDerWaalsContact O-CA 3.3Å; G2044-G2047 WeakPolarHBondContact O-CA 3.31Å; G2044-G2047 PolarHBondContact O-N 2.81Å; G2044-L2048 PolarHBondContact O-N 2.84Å
2045	G	84.5	Confident	91.9	Very high	11 Å²	11	10.1 Å²	10.1	11%	0.113	7%	0.068	C	C	.	.	H	α-helix	trans	-46.9	-59.4	-172.3	0	0	0	0	0	114.5	G2047 L2048 E2049 V2217	G2045-G2047 PolarHBondContact O-N 2.89Å; G2045-L2048 WeakPolarHBondContact O-CB 3.42Å; G2045-L2048 PolarHBondContact O-N 2.97Å; G2045-E2049 PolarHBondContact O-N 2.87Å; G2045-E2049 VanDerWaalsContact O-N 3.1Å; G2045-V2217 VanDerWaalsContact C-CG2 3.48Å
2046	L	88.6	Confident	91.3	Very high	32 Å²	32	10.8 Å²	10.8	17%	0.168	7%	0.074	C	C	.	.	H	α-helix	trans	-58.5	-29.4	176.7	-179.9	63.7	0	0	0	113.4	G2044 L2050 L2121 F2170 I2214 I2239	G2044-L2046 PolarHBondContact O-N 3.21Å; L2046-L2050 WeakPolarHBondContact O-CB 3.42Å; L2046-L2050 PolarHBondContact O-N 2.83Å; L2046-L2121 HydrophobicContact CB-CD2 4.28Å; L2046-L2121 HydrophobicContact CD2-CD2 4.04Å; L2046-L2121 HydrophobicContact CG-CD2 3.81Å; L2046-F2170 HydrophobicContact CD2-CD2 3.91Å; L2046-F2170 HydrophobicContact CD2-CE2 3.84Å; L2046-F2170 HydrophobicContact CG-CE2 4.49Å; L2046-I2214 HydrophobicContact CD2-CD1 3.67Å; L2046-I2239 HydrophobicContact CD1-CD1 3.48Å; L2046-I2239 VanDerWaalsContact CD1-CD1 3.48Å
2047	G	91.4	Very high	90.8	Very high	1 Å²	1	11.8 Å²	11.8	1%	0.01	8%	0.078	C	C	.	.	H	α-helix	trans	-71.7	-34.6	175.3	0	0	0	0	0	113.5	G2042 G2044 G2045 A2051	G2042-G2047 CarbonylContact O-C 3.59Å; G2044-G2047 CarbonylContact O-C 3.56Å; G2044-G2047 VanDerWaalsContact O-CA 3.3Å; G2044-G2047 WeakPolarHBondContact O-CA 3.31Å; G2044-G2047 PolarHBondContact O-N 2.81Å; G2045-G2047 PolarHBondContact O-N 2.89Å; G2047-A2051 VanDerWaalsContact O-CB 3.3Å; G2047-A2051 WeakPolarHBondContact O-CB 3.28Å; G2047-A2051 PolarHBondContact O-N 2.73Å
2048	L	91.6	Very high	90.4	Very high	3 Å²	3	12.5 Å²	12.5	2%	0.016	9%	0.086	C	C	.	.	H	α-helix	trans	-70	-42.3	173.1	-62.3	169.5	0	0	0	111.1	L2043 G2044 G2045 A2051 N2052 Y2074 Q2075 W2082	L2043-L2048 HydrophobicContact CD2-CD2 3.84Å; G2044-L2048 PolarHBondContact O-N 2.84Å; G2045-L2048 WeakPolarHBondContact O-CB 3.42Å; G2045-L2048 PolarHBondContact O-N 2.97Å; L2048-A2051 WeakPolarHBondContact O-CB 3.45Å; L2048-A2051 PolarHBondContact O-N 2.85Å; L2048-N2052 WeakPolarHBondContact O-CB 3.27Å; L2048-N2052 PolarHBondContact O-N 3.18Å; L2048-Y2074 HydrophobicContact CB-CE1 4.45Å; L2048-Y2074 HydrophobicContact CD1-CD1 3.64Å; L2048-Y2074 HydrophobicContact CD1-CE1 3.73Å; L2048-Q2075 HydrophobicContact CD1-CG 3.77Å; L2048-W2082 HydrophobicContact CB-CH2 4.21Å; L2048-W2082 HydrophobicContact CD2-CH2 3.78Å; L2048-W2082 HydrophobicContact CD2-CZ3 4.21Å; L2048-W2082 WeakPolarHBondContact O-CZ2 3.35Å
2049	E	90.8	Very high	90.1	Very high	16 Å²	16	12.5 Å²	12.5	8%	0.075	9%	0.086	C	C	.	.	H	α-helix	trans	-70.4	-37.6	179.1	-58.8	-44.2	117.3	0	0	112	L1121 G2045 A2051 N2052 W2053 Y2074 V2217 I2239	L1121-E2049 HydrophobicContact CD1-CG 4.31Å; L1121-E2049 HydrophobicContact CD2-CG 4.03Å; G2045-E2049 PolarHBondContact O-N 2.87Å; G2045-E2049 VanDerWaalsContact O-N 3.1Å; E2049-A2051 VanDerWaalsContact C-N 3.34Å; E2049-N2052 PolarHBondContact O-N 2.88Å; E2049-W2053 VanDerWaalsContact O-CB 3.28Å; E2049-W2053 WeakPolarHBondContact O-CB 3.5Å; E2049-W2053 PolarHBondContact O-N 3.21Å; E2049-Y2074 PolarHBondContact OE1-OH 3.31Å; E2049-V2217 HydrophobicContact CG-CG1 4.47Å; E2049-V2217 HydrophobicContact CG-CG2 4.17Å; E2049-I2239 HydrophobicContact CB-CD1 4.49Å; E2049-I2239 HydrophobicContact CB-CG2 3.85Å; E2049-I2239 HydrophobicContact CG-CG2 4.1Å
2050	L	92.8	Very high	89.9	Confident	1 Å²	1	16 Å²	16	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-62.1	-40.1	168.7	179.2	60.9	0	0	0	111.9	I2039 L2046 W2053 L2054 F2119 L2121 F2170 L2243 L2246	I2039-L2050 HydrophobicContact CD1-CG 4.42Å; I2039-L2050 HydrophobicContact CG2-CD2 4.3Å; L2046-L2050 WeakPolarHBondContact O-CB 3.42Å; L2046-L2050 PolarHBondContact O-N 2.83Å; L2050-W2053 HydrophobicContact CD1-CE3 4.1Å; L2050-W2053 HydrophobicContact CD1-CZ3 4.47Å; L2050-W2053 PolarHBondContact O-N 2.96Å; L2050-L2054 HydrophobicContact CD1-CD1 4.12Å; L2050-L2054 HydrophobicContact CD1-CG 4.16Å; L2050-L2054 HydrophobicContact CG-CD1 3.98Å; L2050-L2054 HydrophobicContact CG-CG 4.46Å; L2050-L2054 WeakPolarHBondContact O-CB 3.5Å; L2050-L2054 VanDerWaalsContact O-CG 3.23Å; L2050-L2054 WeakPolarHBondContact O-CG 3.26Å; L2050-L2054 PolarHBondContact O-N 2.9Å; L2050-F2119 HydrophobicContact CD1-CE1 4.47Å; L2050-F2119 HydrophobicContact CD2-CB 3.86Å; L2050-F2119 HydrophobicContact CD2-CD1 3.84Å; L2050-F2119 HydrophobicContact CD2-CG 3.9Å; L2050-L2121 HydrophobicContact CD2-CD1 3.78Å; L2050-L2121 HydrophobicContact CD2-CD2 4.16Å; L2050-F2170 HydrophobicContact CD2-CZ 4.3Å; L2050-L2243 HydrophobicContact CD1-CD2 4.38Å; L2050-L2246 HydrophobicContact CD1-CD2 3.57Å
2051	A	93.1	Very high	89.9	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.8	-45.1	174.6	0	0	0	0	0	112.1	I2039 G2047 L2048 E2049 W2053 L2054 I2055 L2062 L2064 W2082	I2039-A2051 HydrophobicContact CD1-CB 3.96Å; G2047-A2051 VanDerWaalsContact O-CB 3.3Å; G2047-A2051 WeakPolarHBondContact O-CB 3.28Å; G2047-A2051 PolarHBondContact O-N 2.73Å; L2048-A2051 WeakPolarHBondContact O-CB 3.45Å; L2048-A2051 PolarHBondContact O-N 2.85Å; E2049-A2051 VanDerWaalsContact C-N 3.34Å; A2051-W2053 PolarHBondContact O-N 3.03Å; A2051-L2054 PolarHBondContact O-N 3Å; A2051-I2055 WeakPolarHBondContact O-CD1 3.39Å; A2051-I2055 VanDerWaalsContact O-CG1 3.28Å; A2051-I2055 WeakPolarHBondContact O-CG1 3.44Å; A2051-I2055 PolarHBondContact O-N 2.78Å; A2051-L2062 HydrophobicContact CB-CD1 3.92Å; A2051-L2064 HydrophobicContact CB-CD2 4.18Å; A2051-W2082 HydrophobicContact CB-CH2 3.68Å; A2051-W2082 HydrophobicContact CB-CZ2 4.06Å; A2051-W2082 HydrophobicContact CB-CZ3 4.21Å
2052	N	89.6	Confident	90.2	Very high	15 Å²	15	17.5 Å²	17.5	8%	0.08	10%	0.1	C	C	.	.	H	α-helix	trans	-59.3	-46.5	175.8	-161	74.3	0	0	0	110.9	K1167 D1169 L2048 E2049 I2055 T2056 W2082	K1167-N2052 PolarHBondContact NZ-OD1 2.7Å; D1169-N2052 PolarHBondContact OD2-ND2 3.02Å; L2048-N2052 WeakPolarHBondContact O-CB 3.27Å; L2048-N2052 PolarHBondContact O-N 3.18Å; E2049-N2052 PolarHBondContact O-N 2.88Å; N2052-I2055 WeakPolarHBondContact O-CB 3.36Å; N2052-I2055 PolarHBondContact O-N 3.28Å; N2052-T2056 PolarHBondContact O-N 2.88Å; N2052-T2056 VanDerWaalsContact O-N 3.09Å; N2052-W2082 HydrophobicContact CB-CZ2 3.95Å; N2052-W2082 PolarHBondContact OD1-NE1 2.87Å
2053	W	89.3	Confident	90.6	Very high	24 Å²	24	17.7 Å²	17.7	9%	0.091	10%	0.101	C	C	.	.	H	α-helix	trans	-64.9	-42.4	177.5	-175.7	89.2	0	0	0	112.9	S2029 E2049 L2050 A2051 I2055 T2056 R2057 L2243 L2246 D2247 L2250	S2029-W2053 WeakPolarHBondContact OG-CH2 3.46Å; E2049-W2053 VanDerWaalsContact O-CB 3.28Å; E2049-W2053 WeakPolarHBondContact O-CB 3.5Å; E2049-W2053 PolarHBondContact O-N 3.21Å; L2050-W2053 HydrophobicContact CD1-CE3 4.1Å; L2050-W2053 HydrophobicContact CD1-CZ3 4.47Å; L2050-W2053 PolarHBondContact O-N 2.96Å; A2051-W2053 PolarHBondContact O-N 3.03Å; W2053-I2055 VanDerWaalsContact C-N 3.25Å; W2053-I2055 PolarHBondContact O-N 3.22Å; W2053-T2056 PolarHBondContact O-N 2.97Å; W2053-T2056 PolarHBondContact O-OG1 3.27Å; W2053-R2057 HydrophobicContact CD2-CG 4.04Å; W2053-R2057 HydrophobicContact CE3-CG 4.17Å; W2053-R2057 HydrophobicContact CH2-CG 4.35Å; W2053-R2057 HydrophobicContact CZ2-CG 4.2Å; W2053-R2057 HydrophobicContact CZ3-CG 4.32Å; W2053-R2057 WeakPolarHBondContact O-CG 3.45Å; W2053-R2057 PolarHBondContact O-N 2.9Å; W2053-L2243 HydrophobicContact CB-CD1 3.95Å; W2053-L2243 HydrophobicContact CB-CD2 3.95Å; W2053-L2243 HydrophobicContact CD2-CD2 4.13Å; W2053-L2243 HydrophobicContact CG-CB 4.3Å; W2053-L2243 HydrophobicContact CG-CD1 4.05Å; W2053-L2243 HydrophobicContact CG-CD2 3.87Å; W2053-L2243 HydrophobicContact CG-CG 4.3Å; W2053-L2246 HydrophobicContact CZ3-CD2 4.36Å; W2053-D2247 HydrophobicContact CZ2-CB 4.02Å; W2053-L2250 HydrophobicContact CH2-CD1 3.82Å; W2053-L2250 HydrophobicContact CZ3-CD1 3.96Å
2054	L	91.8	Very high	90.8	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-61.7	-35.1	174.5	-73	166.9	0	0	0	111.6	C2031 I2039 L2050 A2051 R2057 G2058 A2059 F2119	C2031-L2054 VanDerWaalsContact SG-CD2 3.57Å; I2039-L2054 HydrophobicContact CD1-CD1 3.74Å; I2039-L2054 HydrophobicContact CG1-CD1 4.42Å; L2050-L2054 HydrophobicContact CD1-CD1 4.12Å; L2050-L2054 HydrophobicContact CD1-CG 4.16Å; L2050-L2054 HydrophobicContact CG-CD1 3.98Å; L2050-L2054 HydrophobicContact CG-CG 4.46Å; L2050-L2054 WeakPolarHBondContact O-CB 3.5Å; L2050-L2054 VanDerWaalsContact O-CG 3.23Å; L2050-L2054 WeakPolarHBondContact O-CG 3.26Å; L2050-L2054 PolarHBondContact O-N 2.9Å; A2051-L2054 PolarHBondContact O-N 3Å; L2054-R2057 CarbonylContact O-C 3.58Å; L2054-R2057 PolarHBondContact O-N 3.09Å; L2054-G2058 PolarHBondContact O-N 3.04Å; L2054-A2059 HydrophobicContact CB-CB 4.09Å; L2054-A2059 WeakPolarHBondContact O-CB 3.5Å; L2054-A2059 PolarHBondContact O-N 3.18Å; L2054-F2119 HydrophobicContact CD1-CD2 4.07Å; L2054-F2119 HydrophobicContact CD1-CE2 3.76Å; L2054-F2119 HydrophobicContact CD1-CZ 4.27Å; L2054-F2119 HydrophobicContact CD2-CE2 4.03Å; L2054-F2119 HydrophobicContact CD2-CZ 3.96Å
2055	I	90.3	Very high	91.2	Very high	6 Å²	6	16 Å²	16	3%	0.031	8%	0.083	C	C	.	.	H	α-helix	trans	-64.7	-44.6	174.3	-68.6	161	0	0	0	111.5	A2051 N2052 W2053 R2057 G2058 R2060 L2062 W2082 V2087	A2051-I2055 WeakPolarHBondContact O-CD1 3.39Å; A2051-I2055 VanDerWaalsContact O-CG1 3.28Å; A2051-I2055 WeakPolarHBondContact O-CG1 3.44Å; A2051-I2055 PolarHBondContact O-N 2.78Å; N2052-I2055 WeakPolarHBondContact O-CB 3.36Å; N2052-I2055 PolarHBondContact O-N 3.28Å; W2053-I2055 VanDerWaalsContact C-N 3.25Å; W2053-I2055 PolarHBondContact O-N 3.22Å; I2055-R2057 VanDerWaalsContact C-N 3.27Å; I2055-R2057 PolarHBondContact O-N 3.23Å; I2055-G2058 PolarHBondContact O-N 2.93Å; I2055-R2060 PolarHBondContact O-NH1 3.14Å; I2055-L2062 HydrophobicContact CD1-CD1 3.78Å; I2055-L2062 HydrophobicContact CG1-CD1 3.96Å; I2055-W2082 HydrophobicContact CD1-CB 4.06Å; I2055-W2082 VanDerWaalsContact CD1-CD1 3.46Å; I2055-W2082 HydrophobicContact CD1-CD2 3.78Å; I2055-W2082 HydrophobicContact CD1-CG 3.51Å; I2055-V2087 HydrophobicContact CD1-CB 4.4Å; I2055-V2087 HydrophobicContact CD1-CG1 3.98Å; I2055-V2087 HydrophobicContact CD1-CG2 4.03Å; I2055-V2087 HydrophobicContact CG1-CG1 3.99Å; I2055-V2087 HydrophobicContact CG1-CG2 3.98Å; I2055-V2087 HydrophobicContact CG2-CG2 3.74Å
2056	T	83.3	Confident	91.5	Very high	50 Å²	50	16.5 Å²	16.5	31%	0.307	8%	0.084	S	C	.	.	H	α-helix	trans	-68.1	-28	175.4	63.7	0	0	0	0	112.1	N2052 W2053 G2058	N2052-T2056 PolarHBondContact O-N 2.88Å; N2052-T2056 VanDerWaalsContact O-N 3.09Å; W2053-T2056 PolarHBondContact O-N 2.97Å; W2053-T2056 PolarHBondContact O-OG1 3.27Å; T2056-G2058 PolarHBondContact O-N 3.5Å
2057	R	86.4	Confident	91.3	Very high	20 Å²	20	22.8 Å²	22.8	8%	0.075	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	6.2	167.7	-61.4	-47.2	-178	90.5	-6.7	114.9	S2029 C2031 W2053 L2054 I2055 D2247	S2029-R2057 WeakPolarHBondContact O-CD 3.3Å; S2029-R2057 WeakPolarHBondContact O-CG 3.42Å; S2029-R2057 PolarHBondContact O-NH1 3.2Å; S2029-R2057 PolarHBondContact OG-NH1 3.01Å; C2031-R2057 PolarHBondContact N-O 2.94Å; W2053-R2057 HydrophobicContact CD2-CG 4.04Å; W2053-R2057 HydrophobicContact CE3-CG 4.17Å; W2053-R2057 HydrophobicContact CH2-CG 4.35Å; W2053-R2057 HydrophobicContact CZ2-CG 4.2Å; W2053-R2057 HydrophobicContact CZ3-CG 4.32Å; W2053-R2057 WeakPolarHBondContact O-CG 3.45Å; W2053-R2057 PolarHBondContact O-N 2.9Å; L2054-R2057 CarbonylContact O-C 3.58Å; L2054-R2057 PolarHBondContact O-N 3.09Å; I2055-R2057 VanDerWaalsContact C-N 3.27Å; I2055-R2057 PolarHBondContact O-N 3.23Å; R2057-D2247 IonicContact CZ-OD1 3.23Å; R2057-D2247 IonicContact CZ-OD2 2.78Å; R2057-D2247 VanDerWaalsContact CZ-OD2 3.32Å; R2057-D2247 IonicContact NH1-OD1 3.3Å; R2057-D2247 PolarHBondContact NH1-OD1 3.41Å; R2057-D2247 IonicContact NH1-OD2 3.82Å; R2057-D2247 PolarHBondContact NH1-OD2 3.36Å; R2057-D2247 IonicContact NH2-OD1 3.15Å; R2057-D2247 IonicContact NH2-OD2 3.66Å; R2057-D2247 PolarHBondContact NH2-OD2 3.13Å
2058	G	87.7	Confident	91	Very high	18 Å²	18	25.5 Å²	25.5	19%	0.186	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	102.1	4.5	169.9	0	0	0	0	0	116	L2054 I2055 T2056	L2054-G2058 PolarHBondContact O-N 3.04Å; I2055-G2058 PolarHBondContact O-N 2.93Å; T2056-G2058 PolarHBondContact O-N 3.5Å
2059	A	91.6	Very high	90.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.13	C	C	.	.			trans	-65	138.7	173.5	0	0	0	0	0	110.7	C2031 Y2037 L2054 L2062	C2031-A2059 HydrophobicContact CB-CB 4Å; Y2037-A2059 HydrophobicContact CD2-CB 3.84Å; Y2037-A2059 HydrophobicContact CE2-CB 4.14Å; L2054-A2059 HydrophobicContact CB-CB 4.09Å; L2054-A2059 WeakPolarHBondContact O-CB 3.5Å; L2054-A2059 PolarHBondContact O-N 3.18Å; A2059-L2062 HydrophobicContact CB-CD2 4.4Å
2060	R	92.7	Very high	90.6	Very high	74 Å²	74	28 Å²	28	28%	0.279	14%	0.144	S	C	.	.			trans	-126.5	-2.6	176.1	-62.3	-64.9	177.7	-97.7	7.5	113.4	D1745 P2033 I2055 T2088	D1745-R2060 IonicContact OD2-NH2 2.66Å; P2033-R2060 HydrophobicContact CB-CG 4.33Å; I2055-R2060 PolarHBondContact O-NH1 3.14Å; R2060-T2088 PolarHBondContact O-N 3.37Å
2061	K	96.1	Very high	90.2	Very high	53 Å²	53	36.9 Å²	36.9	23%	0.23	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	120.1	178.2	-58.7	171.3	176.3	-171.4	0	110.3	A2034 V2036 Y2037 T2088 I2112	A2034-K2061 WeakPolarHBondContact O-CD 3.3Å; A2034-K2061 WeakPolarHBondContact O-CE 3.35Å; A2034-K2061 PolarHBondContact O-NZ 3.3Å; V2036-K2061 HydrophobicContact CB-CB 4.44Å; V2036-K2061 HydrophobicContact CG2-CB 4.06Å; V2036-K2061 HydrophobicContact CG2-CD 3.97Å; Y2037-K2061 PolarHBondContact N-O 2.79Å; K2061-T2088 CarbonylContact C-O 3.58Å; K2061-T2088 WeakPolarHBondContact CA-O 3.47Å; K2061-I2112 HydrophobicContact CB-CG2 4.22Å; K2061-I2112 HydrophobicContact CD-CG2 4.2Å; K2061-I2112 WeakPolarHBondContact CE-O 3.18Å; K2061-I2112 HydrophobicContact CG-CG2 4.3Å; K2061-I2112 PolarHBondContact NZ-O 3.13Å
2062	L	96.5	Very high	89.8	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	140.6	-179.5	-65.1	178.4	0	0	0	111.2	I2039 A2051 I2055 A2059 L2064 V2087 T2088 V2089 S2090	I2039-L2062 HydrophobicContact CD1-CD2 4.41Å; A2051-L2062 HydrophobicContact CB-CD1 3.92Å; I2055-L2062 HydrophobicContact CD1-CD1 3.78Å; I2055-L2062 HydrophobicContact CG1-CD1 3.96Å; A2059-L2062 HydrophobicContact CB-CD2 4.4Å; L2062-L2064 HydrophobicContact CB-CD2 4.34Å; L2062-V2087 HydrophobicContact CD1-CG1 4.35Å; L2062-V2087 HydrophobicContact CG-CG1 4.44Å; L2062-T2088 PolarHBondContact N-O 2.87Å; L2062-V2089 HydrophobicContact CB-CG1 4.31Å; L2062-V2089 HydrophobicContact CB-CG2 4.39Å; L2062-V2089 HydrophobicContact CD1-CG2 4.29Å; L2062-S2090 PolarHBondContact O-N 3.12Å
2063	V	96.9	Very high	89.4	Confident	3 Å²	3	39.3 Å²	39.3	2%	0.018	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	115.6	164.5	178.7	0	0	0	0	108.2	V2036 Y2037 L2038 I2039 S2090 L2105 T2109 I2112	V2036-V2063 HydrophobicContact CG1-CG2 3.76Å; Y2037-V2063 PolarHBondContact O-N 3.12Å; L2038-V2063 HydrophobicContact CD1-CB 3.86Å; L2038-V2063 HydrophobicContact CD1-CG1 3.64Å; I2039-V2063 PolarHBondContact N-O 2.92Å; V2063-S2090 WeakPolarHBondContact CA-O 3.5Å; V2063-L2105 HydrophobicContact CG1-CD1 4.11Å; V2063-T2109 HydrophobicContact CB-CG2 4.46Å; V2063-T2109 HydrophobicContact CG2-CG2 3.98Å; V2063-I2112 HydrophobicContact CG2-CD1 3.64Å
2064	L	96.2	Very high	89.3	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	122.4	-178.6	-51.1	-179	0	0	0	108.9	I2039 L2043 A2051 L2062 W2082 V2089 S2090 I2091 S2092	I2039-L2064 HydrophobicContact CB-CD2 3.89Å; I2039-L2064 HydrophobicContact CD1-CD2 3.77Å; I2039-L2064 HydrophobicContact CG1-CD2 4.05Å; L2043-L2064 HydrophobicContact CD2-CB 4.33Å; L2043-L2064 HydrophobicContact CD2-CD1 3.83Å; A2051-L2064 HydrophobicContact CB-CD2 4.18Å; L2062-L2064 HydrophobicContact CB-CD2 4.34Å; L2064-W2082 HydrophobicContact CD1-CZ3 4.02Å; L2064-V2089 HydrophobicContact CD1-CG1 3.72Å; L2064-V2089 HydrophobicContact CG-CG1 4.05Å; L2064-S2090 PolarHBondContact N-O 3.23Å; L2064-I2091 WeakPolarHBondContact O-CA 3.41Å; L2064-S2092 PolarHBondContact O-N 2.83Å
2065	T	94.4	Very high	89.1	Confident	9 Å²	9	39.6 Å²	39.6	6%	0.055	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	137.8	177.1	88.1	0	0	0	0	113	L2038 I2039 T2040 G2041 G2042 S2092 L2105	L2038-T2065 HydrophobicContact CD1-CG2 4.01Å; I2039-T2065 PolarHBondContact O-N 3.1Å; T2040-T2065 VanDerWaalsContact CA-OG1 3.26Å; T2040-T2065 WeakPolarHBondContact CA-OG1 3.42Å; T2040-T2065 HydrophobicContact CG2-CG2 4.33Å; G2041-T2065 CarbonylContact C-O 3.33Å; G2041-T2065 VanDerWaalsContact CA-O 3.25Å; G2041-T2065 WeakPolarHBondContact CA-O 3.28Å; G2041-T2065 PolarHBondContact N-O 2.51Å; G2041-T2065 PolarHBondContact N-OG1 2.92Å; G2042-T2065 PolarHBondContact N-O 2.74Å; T2065-S2092 VanDerWaalsContact CA-O 3.28Å; T2065-S2092 WeakPolarHBondContact CA-O 3.45Å; T2065-L2105 HydrophobicContact CG2-CD1 3.87Å; T2065-L2105 HydrophobicContact CG2-CD2 3.83Å
2066	S	90.2	Very high	88.8	Confident	21 Å²	21	39.9 Å²	39.9	15%	0.147	20%	0.199	C	C	.	.			trans	-154.4	122.4	176.9	171.5	0	0	0	0	110.1	S2068 G2069 S2092 T2093	S2066-S2068 PolarHBondContact O-N 3.08Å; S2066-S2068 PolarHBondContact OG-N 2.9Å; S2066-G2069 PolarHBondContact O-N 3.49Å; S2066-G2069 PolarHBondContact OG-N 3.38Å; S2066-G2069 PolarHBondContact OG-O 2.8Å; S2066-S2092 PolarHBondContact N-O 3.34Å; S2066-T2093 WeakPolarHBondContact O-CA 3.5Å
2067	R	85.3	Confident	88.9	Confident	164 Å²	164	37.5 Å²	37.5	62%	0.619	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	-9.6	177.6	-65.9	-179.6	-65.2	172.7	0.1	114.8
2068	S	84.4	Confident	88.9	Confident	58 Å²	58	36.6 Å²	36.6	41%	0.406	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-137.9	11.3	-177	-47.1	0	0	0	0	113.8	S2066 R2071	S2066-S2068 PolarHBondContact O-N 3.08Å; S2066-S2068 PolarHBondContact OG-N 2.9Å; S2068-R2071 VanDerWaalsContact CB-CZ 3.46Å; S2068-R2071 PolarHBondContact OG-NH1 2.98Å
2069	G	87.3	Confident	88.9	Confident	12 Å²	12	36.1 Å²	36.1	12%	0.124	17%	0.174	C	C	.	.			trans	61.4	-145.5	-174.8	0	0	0	0	0	113.4	L2043 S2066	L2043-G2069 VanDerWaalsContact CD1-O 3.27Å; L2043-G2069 WeakPolarHBondContact CD1-O 3.23Å; S2066-G2069 PolarHBondContact O-N 3.49Å; S2066-G2069 PolarHBondContact OG-N 3.38Å; S2066-G2069 PolarHBondContact OG-O 2.8Å
2070	V	86.7	Confident	88.4	Confident	60 Å²	60	38 Å²	38	36%	0.364	18%	0.182	S	C	.	.			trans	-85.2	134	178.8	-178.3	0	0	0	0	110	L2043 Q2075 A2076 L2079 I2091	L2043-V2070 HydrophobicContact CD1-CG2 4.05Å; V2070-Q2075 HydrophobicContact CG1-CB 3.89Å; V2070-A2076 HydrophobicContact CG1-CB 4.33Å; V2070-L2079 HydrophobicContact CG2-CD1 3.48Å; V2070-L2079 VanDerWaalsContact CG2-CD1 3.48Å; V2070-I2091 HydrophobicContact CG2-CD1 3.62Å
2071	R	85	Confident	87.9	Confident	188 Å²	188	36.1 Å²	36.1	71%	0.709	18%	0.175	S	C	*	.			trans	-140.2	-14.1	-177.8	-66.3	-166.9	-69.1	-175.7	-3	115.7	S2068	S2068-R2071 VanDerWaalsContact CB-CZ 3.46Å; S2068-R2071 PolarHBondContact OG-NH1 2.98Å
2072	T	83.6	Confident	87.4	Confident	60 Å²	60	33.6 Å²	33.6	37%	0.368	16%	0.164	S	C	.	.	S	Bend	trans	-118.2	156.6	178.3	73.1	0	0	0	0	112.7	Y2074 Q2075 A2076	T2072-Y2074 VanDerWaalsContact C-N 3.29Å; T2072-Y2074 PolarHBondContact O-N 3.41Å; T2072-Q2075 PolarHBondContact O-N 2.86Å; T2072-Q2075 WeakPolarHBondContact OG1-CG 3.39Å; T2072-Q2075 PolarHBondContact OG1-N 2.89Å; T2072-A2076 PolarHBondContact O-N 3.34Å
2073	G	81.9	Confident	86.9	Confident	6 Å²	6	40 Å²	40	6%	0.062	19%	0.189	C	C	.	.	H	α-helix	trans	-60	-39.7	174.4	0	0	0	0	0	112.1	E1109 Q2075 A2076 R2077	E1109-G2073 WeakPolarHBondContact O-CA 3.28Å; G2073-Q2075 PolarHBondContact O-N 3.45Å; G2073-A2076 PolarHBondContact O-N 3.3Å; G2073-R2077 WeakPolarHBondContact O-CB 3.38Å; G2073-R2077 PolarHBondContact O-N 2.83Å
2074	Y	86.2	Confident	86.1	Confident	7 Å²	7	46.8 Å²	46.8	3%	0.027	21%	0.214	C	C	.	.	H	α-helix	trans	-58.5	-45	176.1	-172.1	-98.1	0	0	0	112.8	D1114 E1118 L1121 L2048 E2049 T2072 A2076 R2077 C2078	D1114-Y2074 VanDerWaalsContact OD1-CB 3.25Å; D1114-Y2074 WeakPolarHBondContact OD1-CB 3.2Å; D1114-Y2074 PolarHBondContact OD1-N 2.94Å; E1118-Y2074 HydrophobicContact CB-CD2 4.41Å; E1118-Y2074 HydrophobicContact CB-CE2 4.08Å; E1118-Y2074 VanDerWaalsContact OE2-CE2 3.28Å; E1118-Y2074 WeakPolarHBondContact OE2-CE2 3.45Å; L1121-Y2074 HydrophobicContact CD1-CE2 4.33Å; L1121-Y2074 WeakPolarHBondContact CD1-OH 3.28Å; L2048-Y2074 HydrophobicContact CB-CE1 4.45Å; L2048-Y2074 HydrophobicContact CD1-CD1 3.64Å; L2048-Y2074 HydrophobicContact CD1-CE1 3.73Å; E2049-Y2074 PolarHBondContact OE1-OH 3.31Å; T2072-Y2074 VanDerWaalsContact C-N 3.29Å; T2072-Y2074 PolarHBondContact O-N 3.41Å; Y2074-A2076 PolarHBondContact O-N 3.27Å; Y2074-R2077 PolarHBondContact O-N 3.23Å; Y2074-C2078 PolarHBondContact O-N 2.87Å
2075	Q	88.2	Confident	85.2	Confident	23 Å²	23	51 Å²	51	11%	0.107	24%	0.235	C	C	.	.	H	α-helix	trans	-60.9	-45.1	176.4	-72.8	162.9	-6.7	0	0	111.7	L2043 L2048 V2070 T2072 G2073 C2078 L2079	L2043-Q2075 PolarHBondContact O-NE2 2.98Å; L2048-Q2075 HydrophobicContact CD1-CG 3.77Å; V2070-Q2075 HydrophobicContact CG1-CB 3.89Å; T2072-Q2075 PolarHBondContact O-N 2.86Å; T2072-Q2075 WeakPolarHBondContact OG1-CG 3.39Å; T2072-Q2075 PolarHBondContact OG1-N 2.89Å; G2073-Q2075 PolarHBondContact O-N 3.45Å; Q2075-C2078 PolarHBondContact O-N 3.45Å; Q2075-L2079 WeakPolarHBondContact O-CD1 3.5Å; Q2075-L2079 VanDerWaalsContact O-CG 3.31Å; Q2075-L2079 WeakPolarHBondContact O-CG 3.26Å; Q2075-L2079 PolarHBondContact O-N 3.2Å
2076	A	84	Confident	84.8	Confident	12 Å²	12	53.4 Å²	53.4	10%	0.099	26%	0.261	C	S	.	.	H	α-helix	trans	-63.2	-42.7	177.7	0	0	0	0	0	112.2	I1108 V2070 T2072 G2073 Y2074 L2079 Y2080	I1108-A2076 HydrophobicContact CB-CB 4.21Å; I1108-A2076 HydrophobicContact CD1-CB 3.64Å; I1108-A2076 HydrophobicContact CG2-CB 4.1Å; V2070-A2076 HydrophobicContact CG1-CB 4.33Å; T2072-A2076 PolarHBondContact O-N 3.34Å; G2073-A2076 PolarHBondContact O-N 3.3Å; Y2074-A2076 PolarHBondContact O-N 3.27Å; A2076-L2079 PolarHBondContact O-N 3.42Å; A2076-Y2080 WeakPolarHBondContact O-CB 3.31Å; A2076-Y2080 PolarHBondContact O-N 2.61Å
2077	R	86	Confident	84.7	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.5	-48.4	176	178.4	174.6	169	101.9	-9.2	111.9	L1110 E1118 N1138 L1164 E1166 G2073 Y2074 L2079 Y2080 F2081	L1110-R2077 HydrophobicContact CD2-CB 4.34Å; E1118-R2077 VanDerWaalsContact CD-NE 3.26Å; E1118-R2077 IonicContact OE1-CZ 3.53Å; E1118-R2077 VanDerWaalsContact OE1-CZ 3.27Å; E1118-R2077 IonicContact OE1-NE 2.98Å; E1118-R2077 PolarHBondContact OE1-NE 2.94Å; E1118-R2077 IonicContact OE1-NH2 2.71Å; E1118-R2077 PolarHBondContact OE1-NH2 3.14Å; E1118-R2077 IonicContact OE2-NE 2.99Å; N1138-R2077 HydrophobicContact CB-CB 4.25Å; N1138-R2077 PolarHBondContact O-NH1 3.33Å; L1164-R2077 VanDerWaalsContact O-CZ 3.3Å; L1164-R2077 PolarHBondContact O-NH1 3.01Å; L1164-R2077 PolarHBondContact O-NH2 2.91Å; E1166-R2077 PolarHBondContact O-NH2 3.06Å; G2073-R2077 WeakPolarHBondContact O-CB 3.38Å; G2073-R2077 PolarHBondContact O-N 2.83Å; Y2074-R2077 PolarHBondContact O-N 3.23Å; R2077-L2079 PolarHBondContact O-N 2.68Å; R2077-Y2080 PolarHBondContact O-N 2.96Å; R2077-F2081 HydrophobicContact CG-CD2 3.92Å; R2077-F2081 HydrophobicContact CG-CE2 3.94Å; R2077-F2081 WeakPolarHBondContact O-CD2 3.33Å; R2077-F2081 PolarHBondContact O-N 2.95Å; R2077-F2081 VanDerWaalsContact O-N 3.13Å
2078	C	86.5	Confident	85.2	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-59.2	-45.6	178.1	-83	0	0	0	0	112.3	Y2074 Q2075 Y2080 F2081 W2082	Y2074-C2078 PolarHBondContact O-N 2.87Å; Q2075-C2078 PolarHBondContact O-N 3.45Å; C2078-Y2080 PolarHBondContact O-N 3.14Å; C2078-F2081 PolarHBondContact O-N 3.5Å; C2078-W2082 HydrophobicContact CB-CD2 4.44Å; C2078-W2082 HydrophobicContact CB-CE3 4.44Å; C2078-W2082 HydrophobicContact CB-CH2 3.81Å; C2078-W2082 HydrophobicContact CB-CZ2 3.79Å; C2078-W2082 HydrophobicContact CB-CZ3 4.14Å; C2078-W2082 PolarHBondContact O-N 2.87Å
2079	L	86.7	Confident	85.6	Confident	8 Å²	8	46.7 Å²	46.7	4%	0.042	24%	0.235	C	C	.	.	H	α-helix	trans	-62.7	-40.9	177.2	-68.2	163.8	0	0	0	113	V2070 Q2075 A2076 R2077 W2082 R2083 V2089 I2091	V2070-L2079 HydrophobicContact CG2-CD1 3.48Å; V2070-L2079 VanDerWaalsContact CG2-CD1 3.48Å; Q2075-L2079 WeakPolarHBondContact O-CD1 3.5Å; Q2075-L2079 VanDerWaalsContact O-CG 3.31Å; Q2075-L2079 WeakPolarHBondContact O-CG 3.26Å; Q2075-L2079 PolarHBondContact O-N 3.2Å; A2076-L2079 PolarHBondContact O-N 3.42Å; R2077-L2079 PolarHBondContact O-N 2.68Å; L2079-W2082 HydrophobicContact CD2-CE3 4.1Å; L2079-W2082 HydrophobicContact CD2-CZ3 4.15Å; L2079-R2083 WeakPolarHBondContact O-CB 3.35Å; L2079-R2083 WeakPolarHBondContact O-CD 3.47Å; L2079-R2083 VanDerWaalsContact O-CG 3.25Å; L2079-R2083 WeakPolarHBondContact O-CG 3.32Å; L2079-R2083 PolarHBondContact O-N 3.45Å; L2079-R2083 VanDerWaalsContact O-N 3.1Å; L2079-V2089 HydrophobicContact CD2-CB 4.37Å; L2079-V2089 HydrophobicContact CD2-CG1 3.73Å; L2079-I2091 HydrophobicContact CD1-CD1 3.61Å; L2079-I2091 HydrophobicContact CD2-CD1 3.98Å; L2079-I2091 HydrophobicContact CG-CD1 4.47Å
2080	Y	82	Confident	85.9	Confident	40 Å²	40	48.5 Å²	48.5	16%	0.157	25%	0.246	C	C	.	.	H	α-helix	trans	-59.2	-49.8	176.7	167.5	-104.4	0	0	0	111.7	C1105 A2076 R2077 C2078 R2083 R2084	C1105-Y2080 HydrophobicContact CB-CE2 4.41Å; A2076-Y2080 WeakPolarHBondContact O-CB 3.31Å; A2076-Y2080 PolarHBondContact O-N 2.61Å; R2077-Y2080 PolarHBondContact O-N 2.96Å; C2078-Y2080 PolarHBondContact O-N 3.14Å; Y2080-R2083 PolarHBondContact O-N 2.91Å; Y2080-R2084 PolarHBondContact O-N 2.73Å; Y2080-R2084 PolarHBondContact OH-NH1 3.3Å
2081	F	80.9	Confident	86.2	Confident	34 Å²	34	48 Å²	48	15%	0.149	24%	0.241	C	C	.	.	H	α-helix	trans	-68.4	-43.2	179.8	-80.2	-76.7	0	0	0	112.8	K1167 R2077 C2078 R2083 R2084 M2085	K1167-F2081 HydrophobicContact CB-CB 4.41Å; K1167-F2081 HydrophobicContact CB-CD1 3.61Å; K1167-F2081 HydrophobicContact CB-CD2 3.8Å; K1167-F2081 HydrophobicContact CB-CE1 3.68Å; K1167-F2081 HydrophobicContact CB-CE2 3.88Å; K1167-F2081 HydrophobicContact CB-CG 3.67Å; K1167-F2081 HydrophobicContact CB-CZ 3.82Å; K1167-F2081 HydrophobicContact CD-CB 3.74Å; K1167-F2081 HydrophobicContact CD-CD2 3.96Å; K1167-F2081 HydrophobicContact CD-CG 3.85Å; K1167-F2081 HydrophobicContact CG-CD2 4.31Å; K1167-F2081 HydrophobicContact CG-CG 4.3Å; R2077-F2081 HydrophobicContact CG-CD2 3.92Å; R2077-F2081 HydrophobicContact CG-CE2 3.94Å; R2077-F2081 WeakPolarHBondContact O-CD2 3.33Å; R2077-F2081 PolarHBondContact O-N 2.95Å; R2077-F2081 VanDerWaalsContact O-N 3.13Å; C2078-F2081 PolarHBondContact O-N 3.5Å; F2081-R2083 VanDerWaalsContact C-N 3.28Å; F2081-R2083 PolarHBondContact O-N 3.13Å; F2081-R2084 PolarHBondContact O-N 2.6Å; F2081-R2084 VanDerWaalsContact O-N 3.1Å; F2081-M2085 WeakPolarHBondContact O-CG 3.37Å; F2081-M2085 PolarHBondContact O-N 2.99Å
2082	W	86.7	Confident	86.6	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.8	-36.5	177.6	-61.6	-29.3	0	0	0	112.8	L2048 A2051 N2052 I2055 L2064 C2078 L2079 M2085 G2086 V2087 V2089	L2048-W2082 HydrophobicContact CB-CH2 4.21Å; L2048-W2082 HydrophobicContact CD2-CH2 3.78Å; L2048-W2082 HydrophobicContact CD2-CZ3 4.21Å; L2048-W2082 WeakPolarHBondContact O-CZ2 3.35Å; A2051-W2082 HydrophobicContact CB-CH2 3.68Å; A2051-W2082 HydrophobicContact CB-CZ2 4.06Å; A2051-W2082 HydrophobicContact CB-CZ3 4.21Å; N2052-W2082 HydrophobicContact CB-CZ2 3.95Å; N2052-W2082 PolarHBondContact OD1-NE1 2.87Å; I2055-W2082 HydrophobicContact CD1-CB 4.06Å; I2055-W2082 VanDerWaalsContact CD1-CD1 3.46Å; I2055-W2082 HydrophobicContact CD1-CD2 3.78Å; I2055-W2082 HydrophobicContact CD1-CG 3.51Å; L2064-W2082 HydrophobicContact CD1-CZ3 4.02Å; C2078-W2082 HydrophobicContact CB-CD2 4.44Å; C2078-W2082 HydrophobicContact CB-CE3 4.44Å; C2078-W2082 HydrophobicContact CB-CH2 3.81Å; C2078-W2082 HydrophobicContact CB-CZ2 3.79Å; C2078-W2082 HydrophobicContact CB-CZ3 4.14Å; C2078-W2082 PolarHBondContact O-N 2.87Å; L2079-W2082 HydrophobicContact CD2-CE3 4.1Å; L2079-W2082 HydrophobicContact CD2-CZ3 4.15Å; W2082-M2085 CarbonylContact O-C 3.49Å; W2082-M2085 PolarHBondContact O-N 2.95Å; W2082-G2086 PolarHBondContact O-N 2.99Å; W2082-V2087 HydrophobicContact CB-CB 4.34Å; W2082-V2087 WeakPolarHBondContact O-CB 3.43Å; W2082-V2087 PolarHBondContact O-N 3.36Å; W2082-V2087 VanDerWaalsContact O-N 3.08Å; W2082-V2089 HydrophobicContact CB-CG2 4.36Å; W2082-V2089 HydrophobicContact CE3-CG2 4.34Å
2083	R	86.3	Confident	87.1	Confident	134 Å²	134	41 Å²	41	51%	0.506	22%	0.219	S	C	.	.	H	α-helix	trans	-65.3	-41.8	173.5	-73.2	169.9	177.4	173.1	-1.1	112	L2079 Y2080 F2081 M2085 G2086	L2079-R2083 WeakPolarHBondContact O-CB 3.35Å; L2079-R2083 WeakPolarHBondContact O-CD 3.47Å; L2079-R2083 VanDerWaalsContact O-CG 3.25Å; L2079-R2083 WeakPolarHBondContact O-CG 3.32Å; L2079-R2083 PolarHBondContact O-N 3.45Å; L2079-R2083 VanDerWaalsContact O-N 3.1Å; Y2080-R2083 PolarHBondContact O-N 2.91Å; F2081-R2083 VanDerWaalsContact C-N 3.28Å; F2081-R2083 PolarHBondContact O-N 3.13Å; R2083-M2085 PolarHBondContact O-N 3.36Å; R2083-G2086 PolarHBondContact O-N 3.36Å
2084	R	78.7	Confident	87.6	Confident	146 Å²	146	41.8 Å²	41.8	55%	0.551	22%	0.222	S	C	*	.	H	α-helix	trans	-63.9	-25.1	172.5	-71.2	-173.2	79	116.1	8.5	113	E1104 Y2080 F2081 G2086	E1104-R2084 IonicContact OE2-CZ 3.35Å; E1104-R2084 IonicContact OE2-NH1 3.31Å; E1104-R2084 PolarHBondContact OE2-NH1 3.13Å; E1104-R2084 IonicContact OE2-NH2 3.46Å; E1104-R2084 PolarHBondContact OE2-NH2 3.14Å; Y2080-R2084 PolarHBondContact O-N 2.73Å; Y2080-R2084 PolarHBondContact OH-NH1 3.3Å; F2081-R2084 PolarHBondContact O-N 2.6Å; F2081-R2084 VanDerWaalsContact O-N 3.1Å; R2084-G2086 VanDerWaalsContact C-N 3.25Å; R2084-G2086 PolarHBondContact O-N 2.86Å
2085	M	79	Confident	87.8	Confident	90 Å²	90	44 Å²	44	44%	0.443	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	6.3	172.1	-61.3	173.5	94	0	0	113.8	I1744 F2081 W2082 R2083 V2087	I1744-M2085 HydrophobicContact CG2-CE 4.29Å; F2081-M2085 WeakPolarHBondContact O-CG 3.37Å; F2081-M2085 PolarHBondContact O-N 2.99Å; W2082-M2085 CarbonylContact O-C 3.49Å; W2082-M2085 PolarHBondContact O-N 2.95Å; R2083-M2085 PolarHBondContact O-N 3.36Å; M2085-V2087 HydrophobicContact CB-CG2 4.39Å
2086	G	84.5	Confident	88	Confident	58 Å²	58	43.1 Å²	43.1	60%	0.598	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.5	17.2	178.3	0	0	0	0	0	115	W2082 R2083 R2084	W2082-G2086 PolarHBondContact O-N 2.99Å; R2083-G2086 PolarHBondContact O-N 3.36Å; R2084-G2086 VanDerWaalsContact C-N 3.25Å; R2084-G2086 PolarHBondContact O-N 2.86Å
2087	V	89.7	Confident	88.3	Confident	6 Å²	6	43.4 Å²	43.4	4%	0.036	24%	0.235	C	C	.	.			trans	-84.5	127.6	178.8	-174.3	0	0	0	0	110.4	I2055 L2062 W2082 M2085 V2089	I2055-V2087 HydrophobicContact CD1-CB 4.4Å; I2055-V2087 HydrophobicContact CD1-CG1 3.98Å; I2055-V2087 HydrophobicContact CD1-CG2 4.03Å; I2055-V2087 HydrophobicContact CG1-CG1 3.99Å; I2055-V2087 HydrophobicContact CG1-CG2 3.98Å; I2055-V2087 HydrophobicContact CG2-CG2 3.74Å; L2062-V2087 HydrophobicContact CD1-CG1 4.35Å; L2062-V2087 HydrophobicContact CG-CG1 4.44Å; W2082-V2087 HydrophobicContact CB-CB 4.34Å; W2082-V2087 WeakPolarHBondContact O-CB 3.43Å; W2082-V2087 PolarHBondContact O-N 3.36Å; W2082-V2087 VanDerWaalsContact O-N 3.08Å; M2085-V2087 HydrophobicContact CB-CG2 4.39Å; V2087-V2089 HydrophobicContact CB-CG2 4.27Å; V2087-V2089 HydrophobicContact CG1-CG2 3.73Å; V2087-V2089 PolarHBondContact O-N 3.06Å
2088	T	93.9	Very high	88.6	Confident	81 Å²	81	46.5 Å²	46.5	50%	0.497	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	109.2	171.3	-59.5	0	0	0	0	109.3	R2060 K2061 L2062 I2112	R2060-T2088 PolarHBondContact O-N 3.37Å; K2061-T2088 CarbonylContact C-O 3.58Å; K2061-T2088 WeakPolarHBondContact CA-O 3.47Å; L2062-T2088 PolarHBondContact N-O 2.87Å; T2088-I2112 HydrophobicContact CG2-CG2 4.44Å
2089	V	93	Very high	88.9	Confident	16 Å²	16	50.2 Å²	50.2	10%	0.097	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	115.1	178.7	-171.5	0	0	0	0	110.1	L2062 L2064 L2079 W2082 V2087	L2062-V2089 HydrophobicContact CB-CG1 4.31Å; L2062-V2089 HydrophobicContact CB-CG2 4.39Å; L2062-V2089 HydrophobicContact CD1-CG2 4.29Å; L2064-V2089 HydrophobicContact CD1-CG1 3.72Å; L2064-V2089 HydrophobicContact CG-CG1 4.05Å; L2079-V2089 HydrophobicContact CD2-CB 4.37Å; L2079-V2089 HydrophobicContact CD2-CG1 3.73Å; W2082-V2089 HydrophobicContact CB-CG2 4.36Å; W2082-V2089 HydrophobicContact CE3-CG2 4.34Å; V2087-V2089 HydrophobicContact CB-CG2 4.27Å; V2087-V2089 HydrophobicContact CG1-CG2 3.73Å; V2087-V2089 PolarHBondContact O-N 3.06Å
2090	S	93.6	Very high	89.3	Confident	50 Å²	50	57.7 Å²	57.7	35%	0.35	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	145.3	170.5	-173	0	0	0	0	110.6	L2062 V2063 L2064	L2062-S2090 PolarHBondContact O-N 3.12Å; V2063-S2090 WeakPolarHBondContact CA-O 3.5Å; L2064-S2090 PolarHBondContact N-O 3.23Å
2091	I	93.8	Very high	89.9	Confident	50 Å²	50	59.1 Å²	59.1	26%	0.256	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	121.6	178.6	-58.9	173.9	0	0	0	107.8	L2043 L2064 V2070 L2079	L2043-I2091 HydrophobicContact CD1-CD1 4.33Å; L2043-I2091 HydrophobicContact CD1-CG2 3.91Å; L2064-I2091 WeakPolarHBondContact O-CA 3.41Å; V2070-I2091 HydrophobicContact CG2-CD1 3.62Å; L2079-I2091 HydrophobicContact CD1-CD1 3.61Å; L2079-I2091 HydrophobicContact CD2-CD1 3.98Å; L2079-I2091 HydrophobicContact CG-CD1 4.47Å
2092	S	93.3	Very high	90.6	Very high	10 Å²	10	57.5 Å²	57.5	7%	0.07	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	136.4	178.3	-173.5	0	0	0	0	111.2	L2064 T2065 S2066 L2094	L2064-S2092 PolarHBondContact O-N 2.83Å; T2065-S2092 VanDerWaalsContact CA-O 3.28Å; T2065-S2092 WeakPolarHBondContact CA-O 3.45Å; S2066-S2092 PolarHBondContact N-O 3.34Å; S2092-L2094 WeakPolarHBondContact OG-CG 3.43Å; S2092-L2094 PolarHBondContact OG-N 2.93Å
2093	T	93.5	Very high	91.1	Very high	91 Å²	91	59.7 Å²	59.7	56%	0.558	31%	0.314	S	S	*	.			trans	-97.7	8.6	175.5	61	0	0	0	0	113.2	S2066	S2066-T2093 WeakPolarHBondContact O-CA 3.5Å
2094	L	92.6	Very high	91.5	Very high	22 Å²	22	60 Å²	60	12%	0.115	32%	0.315	C	S	.	.			trans	-67.8	134.3	178.1	-65.6	173.7	0	0	0	111.2	S2092 Q2101 R2104 L2105 E2108	S2092-L2094 WeakPolarHBondContact OG-CG 3.43Å; S2092-L2094 PolarHBondContact OG-N 2.93Å; L2094-Q2101 HydrophobicContact CB-CB 4.27Å; L2094-Q2101 HydrophobicContact CD2-CB 4.14Å; L2094-Q2101 HydrophobicContact CD2-CG 4.14Å; L2094-R2104 HydrophobicContact CD1-CB 4.11Å; L2094-R2104 HydrophobicContact CD1-CG 3.86Å; L2094-L2105 HydrophobicContact CB-CB 4.47Å; L2094-L2105 HydrophobicContact CD1-CB 3.93Å; L2094-E2108 WeakPolarHBondContact CD1-OE2 3.32Å
2095	D	90.1	Very high	92.3	Very high	53 Å²	53	53.1 Å²	53.1	28%	0.283	29%	0.289	S	S	.	.			trans	-88.5	122.1	179.4	-162.6	-19.8	0	0	0	111.5	G2097 N2098 Q2101	D2095-G2097 VanDerWaalsContact C-N 3.25Å; D2095-G2097 PolarHBondContact O-N 2.95Å; D2095-G2097 PolarHBondContact OD1-N 3.22Å; D2095-N2098 PolarHBondContact O-N 2.87Å; D2095-Q2101 WeakPolarHBondContact O-CB 3.31Å
2096	I	93.7	Very high	93.1	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.021	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-16.9	177.9	61.5	170.6	0	0	0	113.2	T2040 N2098 T2102 L2105 A2122 G2148 H2151 L2152	T2040-I2096 HydrophobicContact CG2-CD1 4.18Å; T2040-I2096 HydrophobicContact CG2-CG2 4.1Å; I2096-N2098 PolarHBondContact O-N 2.99Å; I2096-T2102 WeakPolarHBondContact CA-OG1 3.46Å; I2096-T2102 PolarHBondContact O-OG1 3.38Å; I2096-T2102 VanDerWaalsContact O-OG1 3.09Å; I2096-L2105 HydrophobicContact CG2-CD2 3.81Å; I2096-A2122 HydrophobicContact CD1-CB 3.96Å; I2096-G2148 WeakPolarHBondContact O-CA 3.33Å; I2096-H2151 PolarHBondContact O-ND1 2.79Å; I2096-L2152 HydrophobicContact CD1-CD1 4.26Å
2097	G	89.6	Confident	93.6	Very high	19 Å²	19	50.1 Å²	50.1	20%	0.196	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-14.2	169.7	0	0	0	0	0	113	D2095 H2151	D2095-G2097 VanDerWaalsContact C-N 3.25Å; D2095-G2097 PolarHBondContact O-N 2.95Å; D2095-G2097 PolarHBondContact OD1-N 3.22Å; G2097-H2151 PolarHBondContact O-CE1 3.04Å
2098	N	93	Very high	93.7	Very high	64 Å²	64	52.8 Å²	52.8	34%	0.342	27%	0.27	S	S	.	.	S	Bend	trans	-108.5	125.3	177.1	-178.7	-74.7	0	0	0	111.2	D2095 I2096 Q2100 Q2101 T2102	D2095-N2098 PolarHBondContact O-N 2.87Å; I2096-N2098 PolarHBondContact O-N 2.99Å; N2098-Q2100 PolarHBondContact O-N 3.18Å; N2098-Q2100 PolarHBondContact OD1-N 3.19Å; N2098-Q2100 VanDerWaalsContact OD1-N 3.09Å; N2098-Q2101 HydrophobicContact CB-CB 4.11Å; N2098-Q2101 HydrophobicContact CB-CG 4.19Å; N2098-Q2101 PolarHBondContact O-N 2.95Å; N2098-Q2101 PolarHBondContact OD1-N 3.12Å; N2098-T2102 PolarHBondContact O-N 2.93Å; N2098-T2102 PolarHBondContact O-OG1 3.32Å
2099	E	93	Very high	93.8	Very high	78 Å²	78	49 Å²	49	36%	0.364	25%	0.246	S	C	.	.	H	α-helix	trans	-59.4	-45.7	-175.8	-169.2	-176.4	176.4	0	0	112.8	T2102 E2103 H2151 K2154 F2155	E2099-T2102 WeakPolarHBondContact O-CB 3.32Å; E2099-T2102 PolarHBondContact O-N 2.9Å; E2099-E2103 PolarHBondContact O-N 3.44Å; E2099-H2151 PolarHBondContact N-CE1 3.32Å; E2099-K2154 VanDerWaalsContact OE1-CE 3.31Å; E2099-K2154 WeakPolarHBondContact OE1-CE 3.41Å; E2099-K2154 IonicContact OE1-NZ 2.81Å; E2099-K2154 PolarHBondContact OE1-NZ 3.11Å; E2099-K2154 IonicContact OE2-NZ 3.34Å; E2099-F2155 HydrophobicContact CG-CE2 3.61Å; E2099-F2155 HydrophobicContact CG-CZ 3.64Å; E2099-F2155 WeakPolarHBondContact O-CE2 3.45Å
2100	Q	94.1	Very high	93.7	Very high	166 Å²	166	54.8 Å²	54.8	78%	0.776	27%	0.266	S	S	*	.	H	α-helix	trans	-69.2	-38.7	-174.9	-61.6	178.9	0	0	0	111.7	N2098 T2102 E2103 R2104	N2098-Q2100 PolarHBondContact O-N 3.18Å; N2098-Q2100 PolarHBondContact OD1-N 3.19Å; N2098-Q2100 VanDerWaalsContact OD1-N 3.09Å; Q2100-T2102 VanDerWaalsContact C-N 3.33Å; Q2100-E2103 PolarHBondContact O-N 3.4Å; Q2100-R2104 WeakPolarHBondContact O-CB 3.47Å; Q2100-R2104 PolarHBondContact O-N 2.73Å; Q2100-R2104 VanDerWaalsContact O-N 3.08Å
2101	Q	95.5	Very high	93.7	Very high	70 Å²	70	60.2 Å²	60.2	33%	0.327	29%	0.286	S	S	.	.	H	α-helix	trans	-67.2	-34.7	172.5	-67.8	-171.1	50.1	0	0	111.7	L2094 D2095 N2098 R2104 L2105	L2094-Q2101 HydrophobicContact CB-CB 4.27Å; L2094-Q2101 HydrophobicContact CD2-CB 4.14Å; L2094-Q2101 HydrophobicContact CD2-CG 4.14Å; D2095-Q2101 WeakPolarHBondContact O-CB 3.31Å; N2098-Q2101 HydrophobicContact CB-CB 4.11Å; N2098-Q2101 HydrophobicContact CB-CG 4.19Å; N2098-Q2101 PolarHBondContact O-N 2.95Å; N2098-Q2101 PolarHBondContact OD1-N 3.12Å; Q2101-R2104 PolarHBondContact O-N 3.19Å; Q2101-L2105 WeakPolarHBondContact O-CB 3.45Å; Q2101-L2105 PolarHBondContact O-N 3.42Å
2102	T	95	Very high	93.6	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-67.2	-44.1	174.5	-48.9	0	0	0	0	111.5	I2096 N2098 E2099 Q2100 R2104 L2105 F2106 H2151 F2155	I2096-T2102 WeakPolarHBondContact CA-OG1 3.46Å; I2096-T2102 PolarHBondContact O-OG1 3.38Å; I2096-T2102 VanDerWaalsContact O-OG1 3.09Å; N2098-T2102 PolarHBondContact O-N 2.93Å; N2098-T2102 PolarHBondContact O-OG1 3.32Å; E2099-T2102 WeakPolarHBondContact O-CB 3.32Å; E2099-T2102 PolarHBondContact O-N 2.9Å; Q2100-T2102 VanDerWaalsContact C-N 3.33Å; T2102-R2104 VanDerWaalsContact C-N 3.26Å; T2102-R2104 PolarHBondContact O-N 3.37Å; T2102-L2105 WeakPolarHBondContact O-CB 3Å; T2102-L2105 PolarHBondContact O-N 3.03Å; T2102-F2106 HydrophobicContact CG2-CD2 4.05Å; T2102-F2106 HydrophobicContact CG2-CE2 3.99Å; T2102-F2106 WeakPolarHBondContact O-CD2 3.23Å; T2102-F2106 PolarHBondContact O-N 2.74Å; T2102-H2151 HydrophobicContact CG2-CB 3.74Å; T2102-F2155 HydrophobicContact CG2-CD2 3.84Å; T2102-F2155 HydrophobicContact CG2-CE2 4.46Å
2103	E	96.2	Very high	93.5	Very high	45 Å²	45	60.2 Å²	60.2	21%	0.21	29%	0.288	C	S	.	.	H	α-helix	trans	-61.6	-37.8	175.6	-159.1	-174.3	-124.1	0	0	111.6	E2099 Q2100 F2106 K2107 F2155 K2158 Y2159	E2099-E2103 PolarHBondContact O-N 3.44Å; Q2100-E2103 PolarHBondContact O-N 3.4Å; E2103-F2106 PolarHBondContact O-N 2.75Å; E2103-K2107 WeakPolarHBondContact O-CG 3.49Å; E2103-K2107 PolarHBondContact O-N 3.02Å; E2103-K2107 VanDerWaalsContact O-N 3.13Å; E2103-K2107 WeakPolarHBondContact OE2-CE 3.36Å; E2103-K2107 IonicContact OE2-NZ 3.33Å; E2103-K2107 PolarHBondContact OE2-NZ 2.9Å; E2103-F2155 HydrophobicContact CB-CD1 4.23Å; E2103-F2155 HydrophobicContact CB-CD2 4.44Å; E2103-F2155 HydrophobicContact CB-CE1 3.76Å; E2103-F2155 HydrophobicContact CB-CE2 4Å; E2103-F2155 HydrophobicContact CB-CZ 3.64Å; E2103-F2155 HydrophobicContact CG-CD1 3.84Å; E2103-F2155 HydrophobicContact CG-CE1 3.53Å; E2103-F2155 HydrophobicContact CG-CZ 3.98Å; E2103-F2155 WeakPolarHBondContact OE1-CE1 3.35Å; E2103-K2158 IonicContact OE1-NZ 2.7Å; E2103-K2158 PolarHBondContact OE1-NZ 2.87Å; E2103-Y2159 HydrophobicContact CG-CE2 3.81Å; E2103-Y2159 PolarHBondContact OE1-OH 2.66Å
2104	R	94.7	Very high	93.5	Very high	141 Å²	141	58.3 Å²	58.3	53%	0.532	28%	0.278	S	S	.	.	H	α-helix	trans	-63	-45.9	174.1	-176.9	178.1	168.6	156.6	4.6	111.9	L2094 Q2100 Q2101 T2102 F2106 K2107 E2108	L2094-R2104 HydrophobicContact CD1-CB 4.11Å; L2094-R2104 HydrophobicContact CD1-CG 3.86Å; Q2100-R2104 WeakPolarHBondContact O-CB 3.47Å; Q2100-R2104 PolarHBondContact O-N 2.73Å; Q2100-R2104 VanDerWaalsContact O-N 3.08Å; Q2101-R2104 PolarHBondContact O-N 3.19Å; T2102-R2104 VanDerWaalsContact C-N 3.26Å; T2102-R2104 PolarHBondContact O-N 3.37Å; R2104-F2106 VanDerWaalsContact C-N 3.31Å; R2104-F2106 PolarHBondContact O-N 3Å; R2104-K2107 WeakPolarHBondContact O-CB 3.34Å; R2104-K2107 PolarHBondContact O-N 2.73Å; R2104-K2107 VanDerWaalsContact O-N 3.1Å; R2104-E2108 HydrophobicContact CG-CG 4.41Å; R2104-E2108 IonicContact CZ-OE1 2.71Å; R2104-E2108 IonicContact NE-OE1 3.48Å; R2104-E2108 PolarHBondContact NE-OE1 3.07Å; R2104-E2108 IonicContact NH2-OE1 3.77Å; R2104-E2108 PolarHBondContact NH2-OE1 3.13Å; R2104-E2108 PolarHBondContact O-N 3.36Å
2105	L	95.8	Very high	93.7	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-56.9	-42.6	175.6	175.1	66.4	0	0	0	111.8	L2038 V2063 T2065 L2094 I2096 Q2101 T2102 T2109	L2038-L2105 HydrophobicContact CD1-CD1 4.11Å; L2038-L2105 HydrophobicContact CD1-CD2 4.26Å; L2038-L2105 HydrophobicContact CD1-CG 4.31Å; L2038-L2105 HydrophobicContact CD2-CD2 4.31Å; L2038-L2105 HydrophobicContact CD2-CG 4.48Å; V2063-L2105 HydrophobicContact CG1-CD1 4.11Å; T2065-L2105 HydrophobicContact CG2-CD1 3.87Å; T2065-L2105 HydrophobicContact CG2-CD2 3.83Å; L2094-L2105 HydrophobicContact CB-CB 4.47Å; L2094-L2105 HydrophobicContact CD1-CB 3.93Å; I2096-L2105 HydrophobicContact CG2-CD2 3.81Å; Q2101-L2105 WeakPolarHBondContact O-CB 3.45Å; Q2101-L2105 PolarHBondContact O-N 3.42Å; T2102-L2105 WeakPolarHBondContact O-CB 3Å; T2102-L2105 PolarHBondContact O-N 3.03Å; L2105-T2109 VanDerWaalsContact O-CB 3.27Å; L2105-T2109 WeakPolarHBondContact O-CB 3.38Å; L2105-T2109 PolarHBondContact O-N 3.17Å; L2105-T2109 PolarHBondContact O-OG1 2.9Å
2106	F	96.2	Very high	93.9	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.2	-38.9	175.3	-89.7	-88.5	0	0	0	112.8	T2102 E2103 R2104 R2110 I2115 I2118 L2152 F2155 Y2159	T2102-F2106 HydrophobicContact CG2-CD2 4.05Å; T2102-F2106 HydrophobicContact CG2-CE2 3.99Å; T2102-F2106 WeakPolarHBondContact O-CD2 3.23Å; T2102-F2106 PolarHBondContact O-N 2.74Å; E2103-F2106 PolarHBondContact O-N 2.75Å; R2104-F2106 VanDerWaalsContact C-N 3.31Å; R2104-F2106 PolarHBondContact O-N 3Å; F2106-R2110 WeakPolarHBondContact O-CB 3.49Å; F2106-R2110 PolarHBondContact O-N 2.92Å; F2106-R2110 VanDerWaalsContact O-N 3.07Å; F2106-I2115 HydrophobicContact CD1-CD1 3.6Å; F2106-I2115 HydrophobicContact CE1-CD1 3.96Å; F2106-I2118 HydrophobicContact CE1-CD1 3.92Å; F2106-I2118 HydrophobicContact CZ-CD1 3.84Å; F2106-L2152 HydrophobicContact CE2-CD2 3.92Å; F2106-L2152 HydrophobicContact CZ-CD2 4.16Å; F2106-F2155 HydrophobicContact CD1-CB 4.35Å; F2106-F2155 HydrophobicContact CD2-CB 3.38Å; F2106-F2155 HydrophobicContact CD2-CG 4.26Å; F2106-F2155 HydrophobicContact CE1-CB 4.42Å; F2106-F2155 HydrophobicContact CE2-CB 3.46Å; F2106-F2155 VanDerWaalsContact CE2-CB 3.46Å; F2106-F2155 HydrophobicContact CG-CB 3.86Å; F2106-F2155 HydrophobicContact CZ-CB 4Å; F2106-Y2159 HydrophobicContact CB-CD2 3.81Å; F2106-Y2159 HydrophobicContact CB-CE2 4.33Å; F2106-Y2159 HydrophobicContact CB-CG 4.25Å; F2106-Y2159 HydrophobicContact CD1-CD2 4.36Å; F2106-Y2159 HydrophobicContact CG-CD2 4.21Å
2107	K	94.3	Very high	94	Very high	86 Å²	86	54.7 Å²	54.7	37%	0.374	26%	0.258	S	S	.	.	H	α-helix	trans	-63.8	-53.8	175.9	-68.6	163.8	-173.3	162.1	0	111.1	E2103 R2104 T2109 R2110 E2111 Y2159	E2103-K2107 WeakPolarHBondContact O-CG 3.49Å; E2103-K2107 PolarHBondContact O-N 3.02Å; E2103-K2107 VanDerWaalsContact O-N 3.13Å; E2103-K2107 WeakPolarHBondContact OE2-CE 3.36Å; E2103-K2107 IonicContact OE2-NZ 3.33Å; E2103-K2107 PolarHBondContact OE2-NZ 2.9Å; R2104-K2107 WeakPolarHBondContact O-CB 3.34Å; R2104-K2107 PolarHBondContact O-N 2.73Å; R2104-K2107 VanDerWaalsContact O-N 3.1Å; K2107-T2109 VanDerWaalsContact C-N 3.29Å; K2107-T2109 PolarHBondContact O-N 3.49Å; K2107-R2110 PolarHBondContact O-N 2.94Å; K2107-E2111 PolarHBondContact O-N 2.78Å; K2107-Y2159 WeakPolarHBondContact CE-OH 3.3Å
2108	E	93.6	Very high	94.3	Very high	62 Å²	62	53.8 Å²	53.8	29%	0.29	25%	0.249	S	C	.	.	H	α-helix	trans	-59.7	-37.7	178.8	-68.4	176.4	172.9	0	0	112	L2094 R2104	L2094-E2108 WeakPolarHBondContact CD1-OE2 3.32Å; R2104-E2108 HydrophobicContact CG-CG 4.41Å; R2104-E2108 IonicContact CZ-OE1 2.71Å; R2104-E2108 IonicContact NE-OE1 3.48Å; R2104-E2108 PolarHBondContact NE-OE1 3.07Å; R2104-E2108 IonicContact NH2-OE1 3.77Å; R2104-E2108 PolarHBondContact NH2-OE1 3.13Å; R2104-E2108 PolarHBondContact O-N 3.36Å
2109	T	94.9	Very high	94.5	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-65.4	-40.2	175	-56.1	0	0	0	0	111.6	V2036 L2038 V2063 L2105 K2107 E2111 I2112 G2113 I2115	V2036-T2109 HydrophobicContact CB-CG2 4.21Å; V2036-T2109 HydrophobicContact CG1-CG2 3.63Å; L2038-T2109 HydrophobicContact CB-CG2 4.48Å; V2063-T2109 HydrophobicContact CB-CG2 4.46Å; V2063-T2109 HydrophobicContact CG2-CG2 3.98Å; L2105-T2109 VanDerWaalsContact O-CB 3.27Å; L2105-T2109 WeakPolarHBondContact O-CB 3.38Å; L2105-T2109 PolarHBondContact O-N 3.17Å; L2105-T2109 PolarHBondContact O-OG1 2.9Å; K2107-T2109 VanDerWaalsContact C-N 3.29Å; K2107-T2109 PolarHBondContact O-N 3.49Å; T2109-E2111 VanDerWaalsContact C-N 3.31Å; T2109-E2111 PolarHBondContact O-N 3.49Å; T2109-I2112 PolarHBondContact O-N 3.26Å; T2109-G2113 PolarHBondContact O-N 3.21Å; T2109-I2115 HydrophobicContact CG2-CD1 3.69Å; T2109-I2115 HydrophobicContact CG2-CG1 3.73Å
2110	R	91.9	Very high	94.6	Very high	137 Å²	137	47 Å²	47	52%	0.517	22%	0.215	S	C	.	.	H	α-helix	trans	-70.9	-24.4	-176.7	-153.7	-178.1	-153.9	-136.5	6.1	113.3	F2106 K2107 I2112 G2113 Y2159	F2106-R2110 WeakPolarHBondContact O-CB 3.49Å; F2106-R2110 PolarHBondContact O-N 2.92Å; F2106-R2110 VanDerWaalsContact O-N 3.07Å; K2107-R2110 PolarHBondContact O-N 2.94Å; R2110-I2112 VanDerWaalsContact C-N 3.28Å; R2110-G2113 WeakPolarHBondContact CA-O 3.47Å; R2110-G2113 PolarHBondContact O-N 3.43Å; R2110-Y2159 VanDerWaalsContact CZ-O 3.24Å; R2110-Y2159 PolarHBondContact NE-O 3.38Å; R2110-Y2159 PolarHBondContact NH2-O 3.39Å
2111	E	91.9	Very high	94.7	Very high	165 Å²	165	40.2 Å²	40.2	77%	0.771	18%	0.184	S	C	*	.	H	α-helix	trans	-67.5	-27.7	172.8	-70.6	171.6	-171.9	0	0	112.3	K2107 T2109	K2107-E2111 PolarHBondContact O-N 2.78Å; T2109-E2111 VanDerWaalsContact C-N 3.31Å; T2109-E2111 PolarHBondContact O-N 3.49Å
2112	I	92.6	Very high	94.4	Very high	47 Å²	47	37.6 Å²	37.6	24%	0.241	18%	0.175	C	C	.	.	H	α-helix	trans	-80.4	-27.5	175.3	-54	168	0	0	0	110.7	V2036 K2061 V2063 T2088 T2109 R2110	V2036-I2112 HydrophobicContact CG2-CB 3.89Å; V2036-I2112 HydrophobicContact CG2-CG2 3.87Å; K2061-I2112 HydrophobicContact CB-CG2 4.22Å; K2061-I2112 HydrophobicContact CD-CG2 4.2Å; K2061-I2112 WeakPolarHBondContact CE-O 3.18Å; K2061-I2112 HydrophobicContact CG-CG2 4.3Å; K2061-I2112 PolarHBondContact NZ-O 3.13Å; V2063-I2112 HydrophobicContact CG2-CD1 3.64Å; T2088-I2112 HydrophobicContact CG2-CG2 4.44Å; T2109-I2112 PolarHBondContact O-N 3.26Å; R2110-I2112 VanDerWaalsContact C-N 3.28Å
2113	G	91.7	Very high	94.2	Very high	12 Å²	12	40.9 Å²	40.9	12%	0.124	19%	0.191	C	C	.	.			trans	153.5	-176.4	174	0	0	0	0	0	113.8	T2109 R2110	T2109-G2113 PolarHBondContact O-N 3.21Å; R2110-G2113 WeakPolarHBondContact CA-O 3.47Å; R2110-G2113 PolarHBondContact O-N 3.43Å
2114	P	93.8	Very high	93.7	Very high	52 Å²	52	39.6 Å²	39.6	34%	0.338	19%	0.186	S	C	.	.			trans	-65.9	142.8	179.7	-17.8	31.1	0	0	0	112.4	H2035 V2036 G2116 E2163	H2035-P2114 CarbonylContact C-O 3.56Å; H2035-P2114 VanDerWaalsContact CA-O 3.32Å; H2035-P2114 WeakPolarHBondContact CA-O 3.47Å; V2036-P2114 PolarHBondContact N-O 3.32Å; P2114-G2116 PolarHBondContact O-N 2.75Å; P2114-E2163 WeakPolarHBondContact CB-OE2 3.15Å; P2114-E2163 WeakPolarHBondContact CG-OE2 3.4Å
2115	I	96.3	Very high	93.2	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.01	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	97.7	-174.2	-54.4	179.4	0	0	0	109.7	F2106 T2109 I2118 L2164	F2106-I2115 HydrophobicContact CD1-CD1 3.6Å; F2106-I2115 HydrophobicContact CE1-CD1 3.96Å; T2109-I2115 HydrophobicContact CG2-CD1 3.69Å; T2109-I2115 HydrophobicContact CG2-CG1 3.73Å; I2115-I2118 HydrophobicContact CG2-CD1 4.28Å; I2115-I2118 HydrophobicContact CG2-CG1 3.8Å; I2115-L2164 HydrophobicContact CG2-CD1 4.36Å
2116	G	93.8	Very high	92.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-23.8	-177.4	0	0	0	0	0	114.6	H2035 V2036 P2114 K2165 W2166	H2035-G2116 VanDerWaalsContact ND1-CA 3.27Å; H2035-G2116 WeakPolarHBondContact ND1-CA 3.46Å; V2036-G2116 PolarHBondContact O-N 3.44Å; P2114-G2116 PolarHBondContact O-N 2.75Å; G2116-K2165 PolarHBondContact O-N 3.19Å; G2116-W2166 PolarHBondContact O-N 3.46Å
2117	G	95	Very high	91.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	145.3	177.5	0	0	0	0	0	113	L2038 W2166	L2038-G2117 PolarHBondContact N-O 2.76Å; G2117-W2166 VanDerWaalsContact CA-O 3.3Å; G2117-W2166 WeakPolarHBondContact CA-O 3.49Å
2118	I	97.2	Very high	91.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	124.4	175.1	-63.1	167	0	0	0	107.6	L2038 F2106 I2115 L2152 L2164 W2166 F2167 V2168	L2038-I2118 HydrophobicContact CB-CG1 4.45Å; L2038-I2118 WeakPolarHBondContact O-CA 3.41Å; F2106-I2118 HydrophobicContact CE1-CD1 3.92Å; F2106-I2118 HydrophobicContact CZ-CD1 3.84Å; I2115-I2118 HydrophobicContact CG2-CD1 4.28Å; I2115-I2118 HydrophobicContact CG2-CG1 3.8Å; I2118-L2152 HydrophobicContact CG2-CD2 4.18Å; I2118-L2164 HydrophobicContact CD1-CD1 3.95Å; I2118-L2164 HydrophobicContact CD1-CD2 4.4Å; I2118-L2164 HydrophobicContact CG1-CD1 3.94Å; I2118-W2166 PolarHBondContact N-O 2.85Å; I2118-F2167 HydrophobicContact CB-CD2 4.19Å; I2118-F2167 HydrophobicContact CD1-CD2 4.09Å; I2118-F2167 HydrophobicContact CD1-CE2 4.34Å; I2118-F2167 HydrophobicContact CG2-CD2 4.33Å; I2118-F2167 HydrophobicContact CG2-CE2 4.35Å; I2118-F2167 WeakPolarHBondContact O-CA 3.23Å; I2118-V2168 PolarHBondContact O-N 3.35Å
2119	F	96.8	Very high	90.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	114.5	178.1	-64.6	-90.8	0	0	0	109.3	Y2037 L2038 I2039 T2040 L2050 L2054 L2121 W2166 V2168 L2250	Y2037-F2119 HydrophobicContact CD1-CE2 4.1Å; L2038-F2119 PolarHBondContact O-N 3.33Å; I2039-F2119 WeakPolarHBondContact CA-O 3.39Å; I2039-F2119 HydrophobicContact CG1-CB 4.47Å; I2039-F2119 HydrophobicContact CG2-CB 4.34Å; T2040-F2119 PolarHBondContact N-O 3.26Å; L2050-F2119 HydrophobicContact CD1-CE1 4.47Å; L2050-F2119 HydrophobicContact CD2-CB 3.86Å; L2050-F2119 HydrophobicContact CD2-CD1 3.84Å; L2050-F2119 HydrophobicContact CD2-CG 3.9Å; L2054-F2119 HydrophobicContact CD1-CD2 4.07Å; L2054-F2119 HydrophobicContact CD1-CE2 3.76Å; L2054-F2119 HydrophobicContact CD1-CZ 4.27Å; L2054-F2119 HydrophobicContact CD2-CE2 4.03Å; L2054-F2119 HydrophobicContact CD2-CZ 3.96Å; F2119-L2121 HydrophobicContact CB-CD1 3.81Å; F2119-W2166 HydrophobicContact CZ-CE3 4.39Å; F2119-V2168 HydrophobicContact CD1-CB 3.79Å; F2119-V2168 HydrophobicContact CD1-CG1 4.38Å; F2119-V2168 HydrophobicContact CD1-CG2 3.83Å; F2119-V2168 HydrophobicContact CE1-CB 4.19Å; F2119-V2168 HydrophobicContact CE1-CG2 3.71Å; F2119-L2250 HydrophobicContact CE1-CD1 4.42Å; F2119-L2250 HydrophobicContact CE1-CD2 4.19Å; F2119-L2250 HydrophobicContact CZ-CD2 4.49Å
2120	H	96.2	Very high	89.9	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	97.5	-174.6	179.3	51.8	0	0	0	111.4	T2040 P2144 T2149 L2152 V2168 F2170	T2040-H2120 WeakPolarHBondContact OG1-CA 3.43Å; T2040-H2120 PolarHBondContact OG1-ND1 3.23Å; H2120-P2144 PolarHBondContact CE1-O 3.03Å; H2120-P2144 PolarHBondContact NE2-O 2.81Å; H2120-T2149 PolarHBondContact CD2-OG1 3.17Å; H2120-T2149 PolarHBondContact NE2-OG1 3.31Å; H2120-L2152 HydrophobicContact CB-CD1 4.11Å; H2120-V2168 PolarHBondContact N-O 3.19Å; H2120-F2170 WeakPolarHBondContact O-CD1 3.13Å; H2120-F2170 PolarHBondContact O-N 2.85Å
2121	L	94.2	Very high	89.3	Confident	22 Å²	22	33.8 Å²	33.8	12%	0.115	17%	0.172	C	C	.	.			trans	-112.3	2.6	179.1	-67.7	73.7	0	0	0	112.4	I2039 T2040 L2046 L2050 F2119 M2123 F2170	I2039-L2121 HydrophobicContact CG2-CD1 4.1Å; T2040-L2121 CarbonylContact O-C 3.51Å; T2040-L2121 PolarHBondContact O-N 2.87Å; T2040-L2121 VanDerWaalsContact O-N 3.11Å; L2046-L2121 HydrophobicContact CB-CD2 4.28Å; L2046-L2121 HydrophobicContact CD2-CD2 4.04Å; L2046-L2121 HydrophobicContact CG-CD2 3.81Å; L2050-L2121 HydrophobicContact CD2-CD1 3.78Å; L2050-L2121 HydrophobicContact CD2-CD2 4.16Å; F2119-L2121 HydrophobicContact CB-CD1 3.81Å; L2121-M2123 PolarHBondContact O-N 3.33Å; L2121-F2170 HydrophobicContact CD1-CD1 3.65Å; L2121-F2170 HydrophobicContact CD1-CE1 3.5Å; L2121-F2170 VanDerWaalsContact CD1-CE1 3.5Å; L2121-F2170 HydrophobicContact CD1-CG 4.3Å; L2121-F2170 HydrophobicContact CD1-CZ 4.03Å; L2121-F2170 HydrophobicContact CD2-CD2 4.49Å; L2121-F2170 HydrophobicContact CD2-CE2 4.31Å; L2121-F2170 HydrophobicContact CD2-CZ 4.36Å; L2121-F2170 HydrophobicContact CG-CD1 3.73Å; L2121-F2170 HydrophobicContact CG-CD2 4.06Å; L2121-F2170 HydrophobicContact CG-CE1 3.88Å; L2121-F2170 HydrophobicContact CG-CE2 4.2Å; L2121-F2170 HydrophobicContact CG-CG 3.85Å; L2121-F2170 HydrophobicContact CG-CZ 4.12Å
2122	A	90.4	Very high	88.9	Confident	16 Å²	16	30.1 Å²	30.1	13%	0.132	16%	0.158	C	C	.	.			trans	-72.4	126.4	-175.8	0	0	0	0	0	110.7	T2040 I2096 P2144 K2145	T2040-A2122 PolarHBondContact O-N 3.4Å; I2096-A2122 HydrophobicContact CD1-CB 3.96Å; A2122-P2144 HydrophobicContact CB-CB 4.49Å; A2122-K2145 WeakPolarHBondContact O-CE 3.32Å
2123	M	90	Very high	88.6	Confident	69 Å²	69	28.2 Å²	28.2	34%	0.34	15%	0.148	S	C	.	.			trans	-146.4	156.3	-178.8	61.2	-170.9	-90.4	0	0	111.3	L2121 L2125 Y2185 I2219	L2121-M2123 PolarHBondContact O-N 3.33Å; M2123-L2125 HydrophobicContact CE-CD1 3.83Å; M2123-L2125 HydrophobicContact CE-CD2 3.76Å; M2123-L2125 HydrophobicContact CE-CG 3.63Å; M2123-Y2185 HydrophobicContact CB-CE2 4.25Å; M2123-I2219 HydrophobicContact CE-CD1 3.77Å
2124	V	87.1	Confident	88.5	Confident	17 Å²	17	30.4 Å²	30.4	10%	0.103	16%	0.159	C	C	.	.			trans	-133.4	124.2	167.9	173.9	0	0	0	0	106.8	R2126 Q2140 S2141 P2144	V2124-R2126 HydrophobicContact CG1-CG 4.34Å; V2124-Q2140 WeakPolarHBondContact CB-O 3.45Å; V2124-Q2140 HydrophobicContact CG1-CB 4.45Å; V2124-S2141 WeakPolarHBondContact O-CA 3.34Å; V2124-S2141 WeakPolarHBondContact O-CB 3.39Å; V2124-S2141 PolarHBondContact O-OG 2.83Å; V2124-P2144 HydrophobicContact CB-CG 4.35Å; V2124-P2144 HydrophobicContact CG2-CG 4.18Å
2125	L	83.5	Confident	88.2	Confident	40 Å²	40	30.7 Å²	30.7	21%	0.209	16%	0.159	C	C	.	.			trans	-93.3	136.5	174.1	-70.8	-171	0	0	0	110.2	M2123 D2127 Y2185 I2219	M2123-L2125 HydrophobicContact CE-CD1 3.83Å; M2123-L2125 HydrophobicContact CE-CD2 3.76Å; M2123-L2125 HydrophobicContact CE-CG 3.63Å; L2125-D2127 VanDerWaalsContact CB-OD1 3.26Å; L2125-D2127 WeakPolarHBondContact CB-OD1 3.37Å; L2125-D2127 WeakPolarHBondContact CD2-OD1 3.2Å; L2125-Y2185 HydrophobicContact CD2-CD1 3.88Å; L2125-Y2185 HydrophobicContact CD2-CD2 3.86Å; L2125-Y2185 HydrophobicContact CD2-CE1 4.06Å; L2125-Y2185 HydrophobicContact CD2-CE2 4.05Å; L2125-Y2185 HydrophobicContact CD2-CG 3.78Å; L2125-I2219 HydrophobicContact CD1-CD1 3.86Å; L2125-I2219 HydrophobicContact CD1-CG2 4.36Å; L2125-I2219 HydrophobicContact CG-CD1 4.46Å
2126	R	84.2	Confident	87.9	Confident	109 Å²	109	36.4 Å²	36.4	41%	0.411	19%	0.186	S	C	.	.			trans	-139	57.1	176.5	-72.7	-63.2	-179	-143	6.9	107.6	V2124 C2128 Q2133 N2137 Q2140 N2184	V2124-R2126 HydrophobicContact CG1-CG 4.34Å; R2126-C2128 PolarHBondContact O-N 2.94Å; R2126-Q2133 PolarHBondContact O-NE2 3.26Å; R2126-N2137 HydrophobicContact CB-CB 3.86Å; R2126-N2137 HydrophobicContact CG-CB 4.31Å; R2126-Q2140 HydrophobicContact CG-CB 4.29Å; R2126-Q2140 VanDerWaalsContact CZ-OE1 3.26Å; R2126-N2184 WeakPolarHBondContact CB-ND2 3.49Å; R2126-N2184 PolarHBondContact O-ND2 3.33Å
2127	D	79.7	Confident	87.6	Confident	33 Å²	33	37.9 Å²	37.9	18%	0.176	19%	0.194	C	C	.	.			trans	-76.8	120	-167.1	-60.9	12.3	0	0	0	108.9	L2125 G2181 Q2182 L2307	L2125-D2127 VanDerWaalsContact CB-OD1 3.26Å; L2125-D2127 WeakPolarHBondContact CB-OD1 3.37Å; L2125-D2127 WeakPolarHBondContact CD2-OD1 3.2Å; D2127-G2181 CarbonylContact C-O 3.47Å; D2127-G2181 VanDerWaalsContact CA-O 3.28Å; D2127-G2181 WeakPolarHBondContact CA-O 3.41Å; D2127-Q2182 HydrophobicContact CB-CG 4.33Å; D2127-Q2182 PolarHBondContact OD2-NE2 3.13Å; D2127-L2307 HydrophobicContact CB-CD1 3.96Å
2128	C	77.3	Confident	87.4	Confident	22 Å²	22	37.9 Å²	37.9	15%	0.149	19%	0.194	C	C	.	.			trans	-172.9	133.1	-162.7	166.7	0	0	0	0	107.8	R2126 N2132 Q2133 G2181	R2126-C2128 PolarHBondContact O-N 2.94Å; C2128-N2132 WeakPolarHBondContact SG-CB 3.14Å; C2128-N2132 PolarHBondContact SG-O 2.87Å; C2128-N2132 VanDerWaalsContact SG-O 3.38Å; C2128-Q2133 PolarHBondContact O-NE2 3.11Å; C2128-G2181 CarbonylContact C-O 3.52Å; C2128-G2181 PolarHBondContact N-O 2.96Å; C2128-G2181 CarbonylContact O-C 3.51Å; C2128-G2181 WeakPolarHBondContact O-CA 3.29Å; C2128-G2181 VanDerWaalsContact O-O 3.07Å
2129	L	78	Confident	87	Confident	7 Å²	7	40.7 Å²	40.7	4%	0.037	21%	0.211	C	C	.	.			trans	-55.2	147.1	175.1	-64.6	171.8	0	0	0	111.3	E1612 E2131 N2132 Q2133 M2326	E1612-L2129 HydrophobicContact CG-CD2 4.04Å; E1612-L2129 WeakPolarHBondContact OE2-CA 3.19Å; L2129-E2131 VanDerWaalsContact C-N 3.28Å; L2129-E2131 HydrophobicContact CB-CG 3.81Å; L2129-E2131 PolarHBondContact O-N 3.01Å; L2129-N2132 CarbonylContact O-C 3.58Å; L2129-N2132 PolarHBondContact O-N 3.33Å; L2129-Q2133 PolarHBondContact O-N 3.32Å; L2129-M2326 HydrophobicContact CD1-CB 4.24Å; L2129-M2326 HydrophobicContact CD2-CB 3.98Å; L2129-M2326 HydrophobicContact CD2-CE 4.19Å; L2129-M2326 HydrophobicContact CD2-CG 3.94Å
2130	F	87.2	Confident	86.6	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.009	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-59.5	-35.6	-172.6	-168.7	-102.9	0	0	0	113.2	L1572 L1575 Q1576 L1579 L1605 L1609 E1612 N2132 Q2133 F2138 T2183	L1572-F2130 HydrophobicContact CD1-CD2 4.46Å; L1572-F2130 HydrophobicContact CD1-CE2 3.48Å; L1572-F2130 VanDerWaalsContact CD1-CE2 3.48Å; L1572-F2130 HydrophobicContact CD1-CZ 3.66Å; L1575-F2130 HydrophobicContact CB-CE1 4.27Å; L1575-F2130 HydrophobicContact CB-CZ 4.2Å; L1575-F2130 HydrophobicContact CD2-CE1 4.25Å; L1575-F2130 HydrophobicContact CD2-CZ 3.81Å; L1575-F2130 HydrophobicContact CG-CE1 3.9Å; L1575-F2130 HydrophobicContact CG-CZ 3.93Å; Q1576-F2130 HydrophobicContact CB-CE1 4.35Å; Q1576-F2130 HydrophobicContact CG-CD1 3.85Å; Q1576-F2130 HydrophobicContact CG-CE1 3.48Å; Q1576-F2130 VanDerWaalsContact CG-CE1 3.48Å; Q1576-F2130 HydrophobicContact CG-CZ 4.1Å; Q1576-F2130 PolarHBondContact NE2-O 3.19Å; L1579-F2130 HydrophobicContact CD1-CD1 3.55Å; L1579-F2130 HydrophobicContact CD1-CE1 3.58Å; L1605-F2130 HydrophobicContact CD1-CE2 4.21Å; L1609-F2130 HydrophobicContact CD2-CB 3.86Å; L1609-F2130 HydrophobicContact CD2-CD1 3.73Å; L1609-F2130 HydrophobicContact CD2-CD2 3.97Å; L1609-F2130 HydrophobicContact CD2-CE1 4.27Å; L1609-F2130 HydrophobicContact CD2-CE2 4.47Å; L1609-F2130 HydrophobicContact CD2-CG 3.56Å; E1612-F2130 WeakPolarHBondContact OE2-CB 3.39Å; E1612-F2130 PolarHBondContact OE2-N 3.46Å; F2130-N2132 PolarHBondContact O-N 2.98Å; F2130-N2132 VanDerWaalsContact O-N 3.16Å; F2130-Q2133 PolarHBondContact O-N 2.78Å; F2130-Q2133 VanDerWaalsContact O-N 3.12Å; F2130-F2138 HydrophobicContact CD2-CE2 4.49Å; F2130-F2138 HydrophobicContact CE2-CE2 4.19Å; F2130-F2138 HydrophobicContact CE2-CZ 4.08Å; F2130-T2183 HydrophobicContact CB-CG2 4.16Å; F2130-T2183 HydrophobicContact CD2-CG2 3.96Å; F2130-T2183 HydrophobicContact CG-CG2 4.39Å
2131	E	78.5	Confident	86.3	Confident	94 Å²	94	44.3 Å²	44.3	44%	0.439	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-52.2	-31.3	170.3	42.9	161	-129.4	0	0	113.6	L2129 R2330	L2129-E2131 VanDerWaalsContact C-N 3.28Å; L2129-E2131 HydrophobicContact CB-CG 3.81Å; L2129-E2131 PolarHBondContact O-N 3.01Å; E2131-R2330 IonicContact OE1-NH1 2.94Å
2132	N	82.4	Confident	86	Confident	88 Å²	88	43.8 Å²	43.8	47%	0.471	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-107.1	3.1	-178.3	-61.6	-82	0	0	0	113	C2128 L2129 F2130	C2128-N2132 WeakPolarHBondContact SG-CB 3.14Å; C2128-N2132 PolarHBondContact SG-O 2.87Å; C2128-N2132 VanDerWaalsContact SG-O 3.38Å; L2129-N2132 CarbonylContact O-C 3.58Å; L2129-N2132 PolarHBondContact O-N 3.33Å; F2130-N2132 PolarHBondContact O-N 2.98Å; F2130-N2132 VanDerWaalsContact O-N 3.16Å
2133	Q	87.3	Confident	86	Confident	7 Å²	7	44.8 Å²	44.8	3%	0.033	23%	0.232	C	C	.	.			trans	-71.4	149.6	-178.8	-78.4	-67.9	0.3	0	0	112.6	Q1576 R2126 C2128 L2129 F2130 N2137 F2138 N2184	Q1576-Q2133 PolarHBondContact NE2-O 2.7Å; R2126-Q2133 PolarHBondContact O-NE2 3.26Å; C2128-Q2133 PolarHBondContact O-NE2 3.11Å; L2129-Q2133 PolarHBondContact O-N 3.32Å; F2130-Q2133 PolarHBondContact O-N 2.78Å; F2130-Q2133 VanDerWaalsContact O-N 3.12Å; Q2133-N2137 PolarHBondContact OE1-ND2 2.81Å; Q2133-F2138 HydrophobicContact CB-CD2 4.36Å; Q2133-F2138 HydrophobicContact CB-CE2 4.03Å; Q2133-F2138 HydrophobicContact CG-CE2 4.17Å; Q2133-N2184 PolarHBondContact NE2-ND2 2.98Å; Q2133-N2184 VanDerWaalsContact NE2-ND2 3.12Å; Q2133-N2184 PolarHBondContact OE1-ND2 3.28Å
2134	T	88.9	Confident	86.1	Confident	58 Å²	58	42.1 Å²	42.1	36%	0.356	22%	0.22	S	C	.	.			trans	-125.1	161	-179.2	64.4	0	0	0	0	111.6	E2136 N2137 F2138	T2134-E2136 VanDerWaalsContact C-N 3.32Å; T2134-E2136 PolarHBondContact O-N 2.85Å; T2134-N2137 PolarHBondContact O-N 3.24Å; T2134-N2137 VanDerWaalsContact O-N 3.14Å; T2134-N2137 VanDerWaalsContact OG1-CG 3.29Å; T2134-N2137 PolarHBondContact OG1-N 2.77Å; T2134-N2137 VanDerWaalsContact OG1-N 3.13Å; T2134-F2138 PolarHBondContact O-N 2.82Å
2135	V	89.1	Confident	86.3	Confident	57 Å²	57	41.4 Å²	41.4	35%	0.345	22%	0.215	S	C	.	.	H	α-helix	trans	-58.7	-44.1	172.2	175.3	0	0	0	0	110.4	S1568 L1572 N2137 F2138 V2139	S1568-V2135 VanDerWaalsContact O-CG1 3.23Å; S1568-V2135 WeakPolarHBondContact O-CG1 3.38Å; L1572-V2135 HydrophobicContact CD2-CG2 4.3Å; V2135-N2137 VanDerWaalsContact C-N 3.3Å; V2135-N2137 PolarHBondContact O-N 3.44Å; V2135-F2138 PolarHBondContact O-N 2.63Å; V2135-V2139 HydrophobicContact CG1-CG2 4.1Å; V2135-V2139 WeakPolarHBondContact O-CB 3.43Å; V2135-V2139 VanDerWaalsContact O-CG2 3.29Å; V2135-V2139 WeakPolarHBondContact O-CG2 3.43Å; V2135-V2139 PolarHBondContact O-N 2.71Å
2136	E	88.3	Confident	86.7	Confident	123 Å²	123	40 Å²	40	58%	0.575	21%	0.208	S	C	*	.	H	α-helix	trans	-54.2	-41.6	172.8	-83.6	71.6	-165.9	0	0	113.4	T2134 Q2140	T2134-E2136 VanDerWaalsContact C-N 3.32Å; T2134-E2136 PolarHBondContact O-N 2.85Å; E2136-Q2140 VanDerWaalsContact O-CB 3.27Å; E2136-Q2140 WeakPolarHBondContact O-CB 3.28Å; E2136-Q2140 WeakPolarHBondContact O-CG 3.44Å; E2136-Q2140 PolarHBondContact O-N 3Å
2137	N	88.6	Confident	86.9	Confident	31 Å²	31	36.2 Å²	36.2	17%	0.166	20%	0.201	C	C	.	.	H	α-helix	trans	-67.9	-45.5	179.1	-76.6	-11.1	0	0	0	111.5	R2126 Q2133 T2134 V2135 Q2140 S2141	R2126-N2137 HydrophobicContact CB-CB 3.86Å; R2126-N2137 HydrophobicContact CG-CB 4.31Å; Q2133-N2137 PolarHBondContact OE1-ND2 2.81Å; T2134-N2137 PolarHBondContact O-N 3.24Å; T2134-N2137 VanDerWaalsContact O-N 3.14Å; T2134-N2137 VanDerWaalsContact OG1-CG 3.29Å; T2134-N2137 PolarHBondContact OG1-N 2.77Å; T2134-N2137 VanDerWaalsContact OG1-N 3.13Å; V2135-N2137 VanDerWaalsContact C-N 3.3Å; V2135-N2137 PolarHBondContact O-N 3.44Å; N2137-Q2140 PolarHBondContact O-N 3.09Å; N2137-S2141 PolarHBondContact O-N 3.02Å
2138	F	90.4	Very high	87.5	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.6	-44.4	174.9	-96.2	-97.3	0	0	0	111.6	F1569 W1571 L1572 L1605 F2130 Q2133 T2134 V2135 S2142 N2184 W2187	F1569-F2138 HydrophobicContact CD1-CB 3.97Å; F1569-F2138 AromaticContact CD1-CD1 3.72Å; F1569-F2138 HydrophobicContact CD1-CD1 3.72Å; F1569-F2138 HydrophobicContact CD1-CG 4.14Å; F1569-F2138 HydrophobicContact CD2-CB 4.21Å; F1569-F2138 HydrophobicContact CE1-CB 4.14Å; F1569-F2138 AromaticContact CE1-CD1 3.72Å; F1569-F2138 HydrophobicContact CE1-CD1 3.72Å; F1569-F2138 HydrophobicContact CE1-CG 4.37Å; F1569-F2138 HydrophobicContact CE2-CB 4.37Å; F1569-F2138 HydrophobicContact CG-CB 4.02Å; F1569-F2138 HydrophobicContact CZ-CB 4.33Å; W1571-F2138 HydrophobicContact CH2-CD1 4.43Å; W1571-F2138 AromaticContact CH2-CE1 3.87Å; W1571-F2138 HydrophobicContact CH2-CE1 3.87Å; W1571-F2138 HydrophobicContact CH2-CZ 4.37Å; L1572-F2138 HydrophobicContact CD1-CD2 3.74Å; L1572-F2138 HydrophobicContact CD1-CE2 3.4Å; L1572-F2138 VanDerWaalsContact CD1-CE2 3.4Å; L1572-F2138 HydrophobicContact CD1-CG 4.49Å; L1572-F2138 HydrophobicContact CD1-CZ 3.91Å; L1572-F2138 HydrophobicContact CD2-CD2 4.22Å; L1605-F2138 HydrophobicContact CD1-CZ 4.27Å; F2130-F2138 HydrophobicContact CD2-CE2 4.49Å; F2130-F2138 HydrophobicContact CE2-CE2 4.19Å; F2130-F2138 HydrophobicContact CE2-CZ 4.08Å; Q2133-F2138 HydrophobicContact CB-CD2 4.36Å; Q2133-F2138 HydrophobicContact CB-CE2 4.03Å; Q2133-F2138 HydrophobicContact CG-CE2 4.17Å; T2134-F2138 PolarHBondContact O-N 2.82Å; V2135-F2138 PolarHBondContact O-N 2.63Å; F2138-S2142 WeakPolarHBondContact O-CB 3.31Å; F2138-S2142 PolarHBondContact O-N 2.79Å; F2138-S2142 PolarHBondContact O-OG 2.77Å; F2138-N2184 HydrophobicContact CD1-CB 3.97Å; F2138-N2184 HydrophobicContact CD2-CB 3.75Å; F2138-N2184 HydrophobicContact CE1-CB 3.94Å; F2138-N2184 HydrophobicContact CE2-CB 3.7Å; F2138-N2184 HydrophobicContact CG-CB 3.89Å; F2138-N2184 HydrophobicContact CZ-CB 3.8Å; F2138-W2187 HydrophobicContact CE1-CB 4.19Å; F2138-W2187 HydrophobicContact CE1-CG 4.36Å
2139	V	89.1	Confident	88.3	Confident	59 Å²	59	33.7 Å²	33.7	36%	0.358	19%	0.186	S	C	.	.	H	α-helix	trans	-63.2	-44.1	175.8	170.9	0	0	0	0	111.6	F1569 V2135 S2142 S2143	F1569-V2139 HydrophobicContact CD2-CG2 3.85Å; F1569-V2139 HydrophobicContact CE2-CG2 3.82Å; V2135-V2139 HydrophobicContact CG1-CG2 4.1Å; V2135-V2139 WeakPolarHBondContact O-CB 3.43Å; V2135-V2139 VanDerWaalsContact O-CG2 3.29Å; V2135-V2139 WeakPolarHBondContact O-CG2 3.43Å; V2135-V2139 PolarHBondContact O-N 2.71Å; V2139-S2142 WeakPolarHBondContact CA-OG 3.28Å; V2139-S2142 PolarHBondContact O-OG 2.87Å; V2139-S2143 WeakPolarHBondContact O-CB 3.45Å; V2139-S2143 PolarHBondContact O-N 3.02Å
2140	Q	88.3	Confident	89	Confident	77 Å²	77	36.4 Å²	36.4	36%	0.36	20%	0.198	S	C	.	.	H	α-helix	trans	-69.1	-36.8	-178.7	-75.9	178.9	39	0	0	113.4	V2124 R2126 E2136 N2137 P2144	V2124-Q2140 WeakPolarHBondContact CB-O 3.45Å; V2124-Q2140 HydrophobicContact CG1-CB 4.45Å; R2126-Q2140 HydrophobicContact CG-CB 4.29Å; R2126-Q2140 VanDerWaalsContact CZ-OE1 3.26Å; E2136-Q2140 VanDerWaalsContact O-CB 3.27Å; E2136-Q2140 WeakPolarHBondContact O-CB 3.28Å; E2136-Q2140 WeakPolarHBondContact O-CG 3.44Å; E2136-Q2140 PolarHBondContact O-N 3Å; N2137-Q2140 PolarHBondContact O-N 3.09Å; Q2140-P2144 VanDerWaalsContact O-CD 3.27Å; Q2140-P2144 WeakPolarHBondContact O-CD 3.11Å
2141	S	89.1	Confident	89.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-79.3	-33.4	175.9	-75.4	0	0	0	0	113.2	V2124 N2137	V2124-S2141 WeakPolarHBondContact O-CA 3.34Å; V2124-S2141 WeakPolarHBondContact O-CB 3.39Å; V2124-S2141 PolarHBondContact O-OG 2.83Å; N2137-S2141 PolarHBondContact O-N 3.02Å
2142	S	88.8	Confident	90.2	Very high	10 Å²	10	33.1 Å²	33.1	7%	0.07	18%	0.183	C	C	.	.	H	α-helix	trans	-78.1	-37.2	178.2	63.1	0	0	0	0	113.8	F2138 V2139 K2145 C2146	F2138-S2142 WeakPolarHBondContact O-CB 3.31Å; F2138-S2142 PolarHBondContact O-N 2.79Å; F2138-S2142 PolarHBondContact O-OG 2.77Å; V2139-S2142 WeakPolarHBondContact CA-OG 3.28Å; V2139-S2142 PolarHBondContact O-OG 2.87Å; S2142-K2145 PolarHBondContact O-N 3.24Å; S2142-C2146 WeakPolarHBondContact O-CB 2.99Å; S2142-C2146 PolarHBondContact O-N 2.82Å
2143	S	90.6	Very high	90.8	Very high	38 Å²	38	29.4 Å²	29.4	27%	0.266	16%	0.163	S	C	.	.	I	π-helix	trans	-47.3	-52	-178.1	177.4	0	0	0	0	114.7	V2139 K2145 G2148	V2139-S2143 WeakPolarHBondContact O-CB 3.45Å; V2139-S2143 PolarHBondContact O-N 3.02Å; S2143-K2145 PolarHBondContact O-N 3.17Å; S2143-G2148 PolarHBondContact O-N 2.89Å
2144	P	90.9	Very high	91.2	Very high	12 Å²	12	34.4 Å²	34.4	8%	0.078	19%	0.185	C	C	.	.	I	π-helix	trans	-69.4	-32.8	179.1	27.9	-36	0	0	0	113.5	H2120 A2122 V2124 Q2140 G2148	H2120-P2144 PolarHBondContact CE1-O 3.03Å; H2120-P2144 PolarHBondContact NE2-O 2.81Å; A2122-P2144 HydrophobicContact CB-CB 4.49Å; V2124-P2144 HydrophobicContact CB-CG 4.35Å; V2124-P2144 HydrophobicContact CG2-CG 4.18Å; Q2140-P2144 VanDerWaalsContact O-CD 3.27Å; Q2140-P2144 WeakPolarHBondContact O-CD 3.11Å; P2144-G2148 WeakPolarHBondContact O-CA 3.38Å
2145	K	92.1	Very high	91.5	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.009	17%	0.169	C	C	.	.	I	π-helix	trans	-88.5	-51.1	-172.8	-72.4	-78.1	-179.4	125.6	0	112.7	A2122 S2142 S2143 T2149 F2170 Y2185 A2188 N2189 M2192	A2122-K2145 WeakPolarHBondContact O-CE 3.32Å; S2142-K2145 PolarHBondContact O-N 3.24Å; S2143-K2145 PolarHBondContact O-N 3.17Å; K2145-T2149 WeakPolarHBondContact O-CB 3.27Å; K2145-T2149 PolarHBondContact O-N 3.31Å; K2145-T2149 PolarHBondContact O-OG1 2.83Å; K2145-F2170 PolarHBondContact NZ-O 2.88Å; K2145-Y2185 PolarHBondContact NZ-OH 3.48Å; K2145-A2188 HydrophobicContact CB-CB 4.14Å; K2145-N2189 PolarHBondContact NZ-OD1 3.45Å; K2145-M2192 HydrophobicContact CD-CE 4.19Å; K2145-M2192 HydrophobicContact CD-SD 3.61Å
2146	C	91.2	Very high	91.8	Very high	10 Å²	10	29.3 Å²	29.3	7%	0.068	15%	0.153	C	C	.	.	I	π-helix	trans	-79.7	-68.1	-176.5	-52.6	0	0	0	0	110.9	S2142 G2148 T2149 E2150 Y2191	S2142-C2146 WeakPolarHBondContact O-CB 2.99Å; S2142-C2146 PolarHBondContact O-N 2.82Å; C2146-G2148 PolarHBondContact O-N 3.47Å; C2146-T2149 PolarHBondContact O-N 3.02Å; C2146-E2150 PolarHBondContact O-N 2.57Å; C2146-Y2191 HydrophobicContact CB-CD1 3.79Å; C2146-Y2191 HydrophobicContact CB-CE1 4.22Å; C2146-Y2191 HydrophobicContact CB-CG 4.21Å
2147	A	89.6	Confident	92	Very high	31 Å²	31	28.2 Å²	28.2	26%	0.256	14%	0.144	S	C	.	.	I	π-helix	trans	-64	-42.1	-179	0	0	0	0	0	111.2	T2149 E2150 H2151	A2147-T2149 PolarHBondContact O-N 3.08Å; A2147-E2150 PolarHBondContact O-N 3.32Å; A2147-H2151 PolarHBondContact O-N 3.43Å; A2147-H2151 PolarHBondContact O-ND1 3.17Å; A2147-H2151 VanDerWaalsContact O-ND1 3.13Å
2148	G	92.3	Very high	92.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-54.3	-46.3	171.6	0	0	0	0	0	113.4	I2096 S2143 P2144 C2146 H2151 L2152	I2096-G2148 WeakPolarHBondContact O-CA 3.33Å; S2143-G2148 PolarHBondContact O-N 2.89Å; P2144-G2148 WeakPolarHBondContact O-CA 3.38Å; C2146-G2148 PolarHBondContact O-N 3.47Å; G2148-H2151 PolarHBondContact O-N 3.24Å; G2148-L2152 WeakPolarHBondContact O-CB 3.38Å; G2148-L2152 WeakPolarHBondContact O-CD1 3.43Å; G2148-L2152 WeakPolarHBondContact O-CG 3.46Å; G2148-L2152 PolarHBondContact O-N 2.88Å
2149	T	94.4	Very high	92.3	Very high	1 Å²	1	34 Å²	34	1%	0.006	17%	0.167	C	C	.	.	H	α-helix	trans	-70.6	-36.4	177.2	-60.7	0	0	0	0	112.7	H2120 K2145 C2146 A2147 L2152 D2153 F2167 M2192 I2195 V2196	H2120-T2149 PolarHBondContact CD2-OG1 3.17Å; H2120-T2149 PolarHBondContact NE2-OG1 3.31Å; K2145-T2149 WeakPolarHBondContact O-CB 3.27Å; K2145-T2149 PolarHBondContact O-N 3.31Å; K2145-T2149 PolarHBondContact O-OG1 2.83Å; C2146-T2149 PolarHBondContact O-N 3.02Å; A2147-T2149 PolarHBondContact O-N 3.08Å; T2149-L2152 PolarHBondContact O-N 3.27Å; T2149-D2153 WeakPolarHBondContact O-CB 3.36Å; T2149-D2153 PolarHBondContact O-N 3.16Å; T2149-F2167 HydrophobicContact CG2-CE1 4.28Å; T2149-F2167 HydrophobicContact CG2-CZ 4.34Å; T2149-M2192 HydrophobicContact CG2-CG 4.13Å; T2149-I2195 HydrophobicContact CG2-CB 4.09Å; T2149-I2195 HydrophobicContact CG2-CD1 3.82Å; T2149-I2195 HydrophobicContact CG2-CG2 3.94Å; T2149-V2196 HydrophobicContact CG2-CG2 4.45Å
2150	E	92.8	Very high	92.4	Very high	64 Å²	64	31.7 Å²	31.7	30%	0.299	15%	0.153	S	C	.	.	H	α-helix	trans	-64.3	-40.8	173.8	-72	-151	130.5	0	0	112.1	R1599 C2146 A2147 D2153 K2154 I2195	R1599-E2150 IonicContact CZ-OE1 3.22Å; R1599-E2150 IonicContact NH1-OE1 2.76Å; R1599-E2150 PolarHBondContact NH1-OE1 3.26Å; C2146-E2150 PolarHBondContact O-N 2.57Å; A2147-E2150 PolarHBondContact O-N 3.32Å; E2150-D2153 PolarHBondContact O-N 2.86Å; E2150-K2154 WeakPolarHBondContact O-CB 3.44Å; E2150-K2154 PolarHBondContact O-N 2.73Å; E2150-I2195 HydrophobicContact CG-CD1 3.5Å; E2150-I2195 HydrophobicContact CG-CG1 4.14Å
2151	H	95.4	Very high	92	Very high	28 Å²	28	30.3 Å²	30.3	13%	0.13	16%	0.159	C	C	.	.	H	α-helix	trans	-66.4	-43.5	174.2	-56.9	147.9	0	0	0	111.7	I2096 G2097 E2099 T2102 A2147 G2148 D2153 K2154 F2155	I2096-H2151 PolarHBondContact O-ND1 2.79Å; G2097-H2151 PolarHBondContact O-CE1 3.04Å; E2099-H2151 PolarHBondContact N-CE1 3.32Å; T2102-H2151 HydrophobicContact CG2-CB 3.74Å; A2147-H2151 PolarHBondContact O-N 3.43Å; A2147-H2151 PolarHBondContact O-ND1 3.17Å; A2147-H2151 VanDerWaalsContact O-ND1 3.13Å; G2148-H2151 PolarHBondContact O-N 3.24Å; H2151-D2153 PolarHBondContact O-N 2.97Å; H2151-K2154 PolarHBondContact O-N 3.35Å; H2151-F2155 HydrophobicContact CB-CD2 4.28Å; H2151-F2155 HydrophobicContact CB-CE2 4.37Å; H2151-F2155 WeakPolarHBondContact O-CB 3.35Å; H2151-F2155 WeakPolarHBondContact O-CD2 3.28Å; H2151-F2155 PolarHBondContact O-N 2.73Å
2152	L	95.8	Very high	91.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62.7	-39.1	175.6	-71.3	168.5	0	0	0	111.8	T2040 I2096 F2106 I2118 H2120 G2148 T2149 S2156 F2167	T2040-L2152 HydrophobicContact CG2-CD1 4.37Å; T2040-L2152 HydrophobicContact CG2-CD2 4.34Å; I2096-L2152 HydrophobicContact CD1-CD1 4.26Å; F2106-L2152 HydrophobicContact CE2-CD2 3.92Å; F2106-L2152 HydrophobicContact CZ-CD2 4.16Å; I2118-L2152 HydrophobicContact CG2-CD2 4.18Å; H2120-L2152 HydrophobicContact CB-CD1 4.11Å; G2148-L2152 WeakPolarHBondContact O-CB 3.38Å; G2148-L2152 WeakPolarHBondContact O-CD1 3.43Å; G2148-L2152 WeakPolarHBondContact O-CG 3.46Å; G2148-L2152 PolarHBondContact O-N 2.88Å; T2149-L2152 PolarHBondContact O-N 3.27Å; L2152-S2156 WeakPolarHBondContact O-CB 3.27Å; L2152-S2156 PolarHBondContact O-N 3.14Å; L2152-S2156 PolarHBondContact O-OG 3.14Å; L2152-F2167 HydrophobicContact CB-CE2 3.94Å; L2152-F2167 HydrophobicContact CB-CZ 3.89Å
2153	D	94.4	Very high	91.7	Very high	9 Å²	9	40.7 Å²	40.7	5%	0.048	22%	0.218	C	C	.	.	H	α-helix	trans	-63.3	-56.9	173.1	-176.7	37.5	0	0	0	110.8	T2149 E2150 H2151 F2155 S2156 R2157 I2195 R2199	T2149-D2153 WeakPolarHBondContact O-CB 3.36Å; T2149-D2153 PolarHBondContact O-N 3.16Å; E2150-D2153 PolarHBondContact O-N 2.86Å; H2151-D2153 PolarHBondContact O-N 2.97Å; D2153-F2155 VanDerWaalsContact C-N 3.33Å; D2153-F2155 PolarHBondContact O-N 2.81Å; D2153-S2156 PolarHBondContact O-N 3.27Å; D2153-S2156 PolarHBondContact O-OG 2.89Å; D2153-R2157 VanDerWaalsContact CG-NE 3.27Å; D2153-R2157 WeakPolarHBondContact O-CG 3.21Å; D2153-R2157 PolarHBondContact O-N 3.18Å; D2153-R2157 IonicContact OD1-CZ 2.78Å; D2153-R2157 IonicContact OD1-NE 2.74Å; D2153-R2157 PolarHBondContact OD1-NE 3.15Å; D2153-R2157 IonicContact OD1-NH2 3.66Å; D2153-R2157 PolarHBondContact OD1-NH2 2.95Å; D2153-R2157 IonicContact OD2-CZ 3.75Å; D2153-R2157 IonicContact OD2-NE 2.63Å; D2153-R2157 PolarHBondContact OD2-NE 2.78Å; D2153-R2157 VanDerWaalsContact OD2-NE 3.11Å; D2153-R2157 IonicContact OD2-NH2 2.77Å; D2153-R2157 PolarHBondContact OD2-NH2 2.83Å; D2153-I2195 HydrophobicContact CB-CG2 4.17Å; D2153-R2199 WeakPolarHBondContact OD1-CD 3.42Å; D2153-R2199 VanDerWaalsContact OD1-CG 3.27Å; D2153-R2199 WeakPolarHBondContact OD1-CG 3.27Å; D2153-R2199 IonicContact OD1-CZ 3.48Å; D2153-R2199 IonicContact OD1-NE 3.82Å; D2153-R2199 IonicContact OD1-NH1 3.28Å; D2153-R2199 PolarHBondContact OD1-NH1 3.39Å
2154	K	94.3	Very high	91.8	Very high	112 Å²	112	39.5 Å²	39.5	49%	0.487	21%	0.209	S	C	.	.	H	α-helix	trans	-52.8	-46.9	-179.1	-174.3	178.3	-170.5	176.7	0	112.5	E2099 E2150 H2151 K2158	E2099-K2154 VanDerWaalsContact OE1-CE 3.31Å; E2099-K2154 WeakPolarHBondContact OE1-CE 3.41Å; E2099-K2154 IonicContact OE1-NZ 2.81Å; E2099-K2154 PolarHBondContact OE1-NZ 3.11Å; E2099-K2154 IonicContact OE2-NZ 3.34Å; E2150-K2154 WeakPolarHBondContact O-CB 3.44Å; E2150-K2154 PolarHBondContact O-N 2.73Å; H2151-K2154 PolarHBondContact O-N 3.35Å; K2154-K2158 PolarHBondContact O-N 2.63Å
2155	F	95.8	Very high	91.8	Very high	6 Å²	6	42.8 Å²	42.8	3%	0.026	22%	0.222	C	C	.	.	H	α-helix	trans	-85.1	-28	-177.1	-65.8	-54.8	0	0	0	113.9	E2099 T2102 E2103 F2106 H2151 D2153 K2158 Y2159	E2099-F2155 HydrophobicContact CG-CE2 3.61Å; E2099-F2155 HydrophobicContact CG-CZ 3.64Å; E2099-F2155 WeakPolarHBondContact O-CE2 3.45Å; T2102-F2155 HydrophobicContact CG2-CD2 3.84Å; T2102-F2155 HydrophobicContact CG2-CE2 4.46Å; E2103-F2155 HydrophobicContact CB-CD1 4.23Å; E2103-F2155 HydrophobicContact CB-CD2 4.44Å; E2103-F2155 HydrophobicContact CB-CE1 3.76Å; E2103-F2155 HydrophobicContact CB-CE2 4Å; E2103-F2155 HydrophobicContact CB-CZ 3.64Å; E2103-F2155 HydrophobicContact CG-CD1 3.84Å; E2103-F2155 HydrophobicContact CG-CE1 3.53Å; E2103-F2155 HydrophobicContact CG-CZ 3.98Å; E2103-F2155 WeakPolarHBondContact OE1-CE1 3.35Å; F2106-F2155 HydrophobicContact CD1-CB 4.35Å; F2106-F2155 HydrophobicContact CD2-CB 3.38Å; F2106-F2155 HydrophobicContact CD2-CG 4.26Å; F2106-F2155 HydrophobicContact CE1-CB 4.42Å; F2106-F2155 HydrophobicContact CE2-CB 3.46Å; F2106-F2155 VanDerWaalsContact CE2-CB 3.46Å; F2106-F2155 HydrophobicContact CG-CB 3.86Å; F2106-F2155 HydrophobicContact CZ-CB 4Å; H2151-F2155 HydrophobicContact CB-CD2 4.28Å; H2151-F2155 HydrophobicContact CB-CE2 4.37Å; H2151-F2155 WeakPolarHBondContact O-CB 3.35Å; H2151-F2155 WeakPolarHBondContact O-CD2 3.28Å; H2151-F2155 PolarHBondContact O-N 2.73Å; D2153-F2155 VanDerWaalsContact C-N 3.33Å; D2153-F2155 PolarHBondContact O-N 2.81Å; F2155-K2158 HydrophobicContact CD1-CD 4.19Å; F2155-K2158 PolarHBondContact O-N 3.34Å; F2155-K2158 VanDerWaalsContact O-N 3.16Å; F2155-Y2159 HydrophobicContact CB-CD2 4.16Å; F2155-Y2159 HydrophobicContact CD1-CD2 4.33Å; F2155-Y2159 AromaticContact CD1-CE2 3.93Å; F2155-Y2159 HydrophobicContact CD1-CE2 3.93Å; F2155-Y2159 WeakPolarHBondContact O-CB 3.5Å; F2155-Y2159 WeakPolarHBondContact O-CD2 3.28Å; F2155-Y2159 PolarHBondContact O-N 3Å
2156	S	94.9	Very high	91.9	Very high	2 Å²	2	43 Å²	43	1%	0.014	22%	0.223	C	C	.	.	H	α-helix	trans	-65.5	-40.6	171.5	63.9	0	0	0	0	112.1	L2152 D2153 K2158 Y2159 C2160 R2199	L2152-S2156 WeakPolarHBondContact O-CB 3.27Å; L2152-S2156 PolarHBondContact O-N 3.14Å; L2152-S2156 PolarHBondContact O-OG 3.14Å; D2153-S2156 PolarHBondContact O-N 3.27Å; D2153-S2156 PolarHBondContact O-OG 2.89Å; S2156-K2158 PolarHBondContact O-N 2.91Å; S2156-Y2159 PolarHBondContact O-N 3.06Å; S2156-C2160 WeakPolarHBondContact O-CB 3.36Å; S2156-C2160 PolarHBondContact O-N 2.82Å; S2156-R2199 PolarHBondContact OG-NH1 2.65Å
2157	R	93	Very high	92.1	Very high	100 Å²	100	42.6 Å²	42.6	38%	0.377	22%	0.22	S	C	.	.	H	α-helix	trans	-58.8	-33.9	171	-68.3	175.9	-168	-119.1	11.5	112.6	D2153 D2202 L2204	D2153-R2157 VanDerWaalsContact CG-NE 3.27Å; D2153-R2157 WeakPolarHBondContact O-CG 3.21Å; D2153-R2157 PolarHBondContact O-N 3.18Å; D2153-R2157 IonicContact OD1-CZ 2.78Å; D2153-R2157 IonicContact OD1-NE 2.74Å; D2153-R2157 PolarHBondContact OD1-NE 3.15Å; D2153-R2157 IonicContact OD1-NH2 3.66Å; D2153-R2157 PolarHBondContact OD1-NH2 2.95Å; D2153-R2157 IonicContact OD2-CZ 3.75Å; D2153-R2157 IonicContact OD2-NE 2.63Å; D2153-R2157 PolarHBondContact OD2-NE 2.78Å; D2153-R2157 VanDerWaalsContact OD2-NE 3.11Å; D2153-R2157 IonicContact OD2-NH2 2.77Å; D2153-R2157 PolarHBondContact OD2-NH2 2.83Å; R2157-D2202 IonicContact CZ-OD2 2.7Å; R2157-D2202 IonicContact NH1-OD2 2.7Å; R2157-D2202 PolarHBondContact NH1-OD2 2.97Å; R2157-D2202 IonicContact NH2-OD2 3.78Å; R2157-D2202 PolarHBondContact NH2-OD2 3.41Å; R2157-L2204 HydrophobicContact CG-CD1 3.94Å
2158	K	93.1	Very high	92.4	Very high	119 Å²	119	41.1 Å²	41.1	52%	0.517	21%	0.208	S	C	.	.	H	α-helix	trans	-82.1	-36.8	-179	-175.5	176.4	175.9	-177.7	0	114	E2103 K2154 F2155 S2156	E2103-K2158 IonicContact OE1-NZ 2.7Å; E2103-K2158 PolarHBondContact OE1-NZ 2.87Å; K2154-K2158 PolarHBondContact O-N 2.63Å; F2155-K2158 HydrophobicContact CD1-CD 4.19Å; F2155-K2158 PolarHBondContact O-N 3.34Å; F2155-K2158 VanDerWaalsContact O-N 3.16Å; S2156-K2158 PolarHBondContact O-N 2.91Å
2159	Y	92.3	Very high	92.6	Very high	35 Å²	35	41.1 Å²	41.1	14%	0.137	21%	0.208	C	C	.	.	H	α-helix	trans	-113.9	-23.6	-167.4	-71.4	-70.9	0	0	0	115.8	E2103 F2106 K2107 R2110 F2155 S2156	E2103-Y2159 HydrophobicContact CG-CE2 3.81Å; E2103-Y2159 PolarHBondContact OE1-OH 2.66Å; F2106-Y2159 HydrophobicContact CB-CD2 3.81Å; F2106-Y2159 HydrophobicContact CB-CE2 4.33Å; F2106-Y2159 HydrophobicContact CB-CG 4.25Å; F2106-Y2159 HydrophobicContact CD1-CD2 4.36Å; F2106-Y2159 HydrophobicContact CG-CD2 4.21Å; K2107-Y2159 WeakPolarHBondContact CE-OH 3.3Å; R2110-Y2159 VanDerWaalsContact CZ-O 3.24Å; R2110-Y2159 PolarHBondContact NE-O 3.38Å; R2110-Y2159 PolarHBondContact NH2-O 3.39Å; F2155-Y2159 HydrophobicContact CB-CD2 4.16Å; F2155-Y2159 HydrophobicContact CD1-CD2 4.33Å; F2155-Y2159 AromaticContact CD1-CE2 3.93Å; F2155-Y2159 HydrophobicContact CD1-CE2 3.93Å; F2155-Y2159 WeakPolarHBondContact O-CB 3.5Å; F2155-Y2159 WeakPolarHBondContact O-CD2 3.28Å; F2155-Y2159 PolarHBondContact O-N 3Å; S2156-Y2159 PolarHBondContact O-N 3.06Å
2160	C	90.8	Very high	92.6	Very high	10 Å²	10	41.8 Å²	41.8	7%	0.068	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-33.8	-175	-48.5	0	0	0	0	113.6	S2156 L2164	S2156-C2160 WeakPolarHBondContact O-CB 3.36Å; S2156-C2160 PolarHBondContact O-N 2.82Å; C2160-L2164 HydrophobicContact CB-CB 3.73Å; C2160-L2164 HydrophobicContact CB-CD1 4.46Å; C2160-L2164 HydrophobicContact CB-CD2 4.44Å; C2160-L2164 HydrophobicContact CB-CG 4.44Å
2161	G	80.8	Confident	92.6	Very high	47 Å²	47	38.9 Å²	38.9	49%	0.485	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	58.3	-146.2	-175.8	0	0	0	0	0	112.4	E2163	G2161-E2163 VanDerWaalsContact C-N 3.26Å; G2161-E2163 PolarHBondContact O-N 3.44Å
2162	P	83.5	Confident	92.4	Very high	135 Å²	135	38.6 Å²	38.6	88%	0.877	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-75.8	-5.7	-176.8	32.8	-36.6	0	0	0	114.5	L2164	P2162-L2164 VanDerWaalsContact C-N 3.33Å
2163	E	87.5	Confident	92	Very high	94 Å²	94	39.3 Å²	39.3	44%	0.439	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-80.7	-14	-179.4	-67	-177.2	-134.8	0	0	113.4	P2114 G2161 K2165	P2114-E2163 WeakPolarHBondContact CB-OE2 3.15Å; P2114-E2163 WeakPolarHBondContact CG-OE2 3.4Å; G2161-E2163 VanDerWaalsContact C-N 3.26Å; G2161-E2163 PolarHBondContact O-N 3.44Å; E2163-K2165 PolarHBondContact O-N 2.95Å; E2163-K2165 VanDerWaalsContact O-N 3.15Å
2164	L	93.4	Very high	91.6	Very high	12 Å²	12	39.1 Å²	39.1	6%	0.063	20%	0.201	C	C	.	.			trans	-70	108.4	171.9	-172.6	68.9	0	0	0	109.6	I2115 I2118 C2160 P2162 W2166 F2167 P2205	I2115-L2164 HydrophobicContact CG2-CD1 4.36Å; I2118-L2164 HydrophobicContact CD1-CD1 3.95Å; I2118-L2164 HydrophobicContact CD1-CD2 4.4Å; I2118-L2164 HydrophobicContact CG1-CD1 3.94Å; C2160-L2164 HydrophobicContact CB-CB 3.73Å; C2160-L2164 HydrophobicContact CB-CD1 4.46Å; C2160-L2164 HydrophobicContact CB-CD2 4.44Å; C2160-L2164 HydrophobicContact CB-CG 4.44Å; P2162-L2164 VanDerWaalsContact C-N 3.33Å; L2164-W2166 WeakPolarHBondContact CD1-O 3.25Å; L2164-F2167 HydrophobicContact CD2-CB 4.38Å; L2164-F2167 HydrophobicContact CD2-CD2 4.37Å; L2164-P2205 VanDerWaalsContact O-CG 3.29Å; L2164-P2205 WeakPolarHBondContact O-CG 3.38Å
2165	K	90.8	Very high	91.4	Very high	81 Å²	81	34.1 Å²	34.1	35%	0.352	18%	0.18	S	C	.	.			trans	-86.8	-33.2	177.2	-168.8	-176.2	177	-166.8	0	112.3	Y1704 G2116 E2163	Y1704-K2165 PolarHBondContact OH-NZ 3.32Å; G2116-K2165 PolarHBondContact O-N 3.19Å; E2163-K2165 PolarHBondContact O-N 2.95Å; E2163-K2165 VanDerWaalsContact O-N 3.15Å
2166	W	94.2	Very high	90.9	Very high	8 Å²	8	34 Å²	34	3%	0.03	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	132.2	-172.3	-60.7	-54.5	0	0	0	112.3	Y2030 Y2037 G2116 G2117 I2118 F2119 L2164 V2168 L2250	Y2030-W2166 WeakPolarHBondContact O-CH2 3.43Å; Y2037-W2166 AromaticContact CE1-CE3 3.92Å; Y2037-W2166 HydrophobicContact CE1-CE3 3.92Å; Y2037-W2166 AromaticContact CE1-CZ3 3.86Å; Y2037-W2166 HydrophobicContact CE1-CZ3 3.86Å; G2116-W2166 PolarHBondContact O-N 3.46Å; G2117-W2166 VanDerWaalsContact CA-O 3.3Å; G2117-W2166 WeakPolarHBondContact CA-O 3.49Å; I2118-W2166 PolarHBondContact N-O 2.85Å; F2119-W2166 HydrophobicContact CZ-CE3 4.39Å; L2164-W2166 WeakPolarHBondContact CD1-O 3.25Å; W2166-V2168 HydrophobicContact CB-CG2 4.28Å; W2166-L2250 HydrophobicContact CB-CD2 4.24Å; W2166-L2250 HydrophobicContact CD2-CD2 4.02Å; W2166-L2250 HydrophobicContact CG-CD2 3.72Å; W2166-L2250 HydrophobicContact CZ2-CB 4.5Å; W2166-L2250 PolarHBondContact NE1-O 2.95Å; W2166-L2250 VanDerWaalsContact NE1-O 3.17Å
2167	F	95.8	Very high	90.4	Very high	1 Å²	1	34.3 Å²	34.3	0%	0.004	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	104.3	166.6	-173.1	-79.2	0	0	0	106.1	I2118 T2149 L2152 L2164 V2196 P2205 I2207	I2118-F2167 HydrophobicContact CB-CD2 4.19Å; I2118-F2167 HydrophobicContact CD1-CD2 4.09Å; I2118-F2167 HydrophobicContact CD1-CE2 4.34Å; I2118-F2167 HydrophobicContact CG2-CD2 4.33Å; I2118-F2167 HydrophobicContact CG2-CE2 4.35Å; I2118-F2167 WeakPolarHBondContact O-CA 3.23Å; T2149-F2167 HydrophobicContact CG2-CE1 4.28Å; T2149-F2167 HydrophobicContact CG2-CZ 4.34Å; L2152-F2167 HydrophobicContact CB-CE2 3.94Å; L2152-F2167 HydrophobicContact CB-CZ 3.89Å; L2164-F2167 HydrophobicContact CD2-CB 4.38Å; L2164-F2167 HydrophobicContact CD2-CD2 4.37Å; F2167-V2196 HydrophobicContact CD1-CG2 4.46Å; F2167-V2196 HydrophobicContact CE1-CG2 4.15Å; F2167-P2205 HydrophobicContact CB-CB 4.44Å; F2167-P2205 WeakPolarHBondContact CB-O 3.4Å; F2167-I2207 PolarHBondContact O-N 2.98Å
2168	V	95.7	Very high	89.9	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.3	-171.3	-171.4	0	0	0	0	109.4	I2118 F2119 H2120 W2166 F2170 I2207 I2209 L2246 L2250	I2118-V2168 PolarHBondContact O-N 3.35Å; F2119-V2168 HydrophobicContact CD1-CB 3.79Å; F2119-V2168 HydrophobicContact CD1-CG1 4.38Å; F2119-V2168 HydrophobicContact CD1-CG2 3.83Å; F2119-V2168 HydrophobicContact CE1-CB 4.19Å; F2119-V2168 HydrophobicContact CE1-CG2 3.71Å; H2120-V2168 PolarHBondContact N-O 3.19Å; W2166-V2168 HydrophobicContact CB-CG2 4.28Å; V2168-F2170 HydrophobicContact CB-CE1 4.5Å; V2168-F2170 HydrophobicContact CG1-CD1 4.2Å; V2168-F2170 HydrophobicContact CG1-CE1 3.75Å; V2168-I2207 WeakPolarHBondContact CA-O 3.19Å; V2168-I2207 HydrophobicContact CG1-CG2 4.3Å; V2168-I2207 HydrophobicContact CG2-CB 4.41Å; V2168-I2209 HydrophobicContact CG1-CD1 4.26Å; V2168-L2246 HydrophobicContact CG1-CD1 4.43Å; V2168-L2250 HydrophobicContact CG2-CD2 3.7Å
2169	A	94.9	Very high	89.4	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	133.9	175	0	0	0	0	0	110.9	M2192 V2196 I2207 V2208 I2209	A2169-M2192 HydrophobicContact CB-CE 4.14Å; A2169-M2192 HydrophobicContact CB-CG 4.11Å; A2169-M2192 HydrophobicContact CB-SD 3.78Å; A2169-V2196 HydrophobicContact CB-CG2 4.32Å; A2169-I2207 PolarHBondContact N-O 3.47Å; A2169-V2208 HydrophobicContact CB-CG2 4.38Å; A2169-V2208 WeakPolarHBondContact O-CA 3.47Å; A2169-I2209 PolarHBondContact O-N 2.79Å
2170	F	94.5	Very high	88.8	Confident	14 Å²	14	23.8 Å²	23.8	6%	0.061	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	102.5	-176.9	-75.6	60.5	0	0	0	109	L2046 L2050 H2120 L2121 K2145 V2168 W2211	L2046-F2170 HydrophobicContact CD2-CD2 3.91Å; L2046-F2170 HydrophobicContact CD2-CE2 3.84Å; L2046-F2170 HydrophobicContact CG-CE2 4.49Å; L2050-F2170 HydrophobicContact CD2-CZ 4.3Å; H2120-F2170 WeakPolarHBondContact O-CD1 3.13Å; H2120-F2170 PolarHBondContact O-N 2.85Å; L2121-F2170 HydrophobicContact CD1-CD1 3.65Å; L2121-F2170 HydrophobicContact CD1-CE1 3.5Å; L2121-F2170 VanDerWaalsContact CD1-CE1 3.5Å; L2121-F2170 HydrophobicContact CD1-CG 4.3Å; L2121-F2170 HydrophobicContact CD1-CZ 4.03Å; L2121-F2170 HydrophobicContact CD2-CD2 4.49Å; L2121-F2170 HydrophobicContact CD2-CE2 4.31Å; L2121-F2170 HydrophobicContact CD2-CZ 4.36Å; L2121-F2170 HydrophobicContact CG-CD1 3.73Å; L2121-F2170 HydrophobicContact CG-CD2 4.06Å; L2121-F2170 HydrophobicContact CG-CE1 3.88Å; L2121-F2170 HydrophobicContact CG-CE2 4.2Å; L2121-F2170 HydrophobicContact CG-CG 3.85Å; L2121-F2170 HydrophobicContact CG-CZ 4.12Å; K2145-F2170 PolarHBondContact NZ-O 2.88Å; V2168-F2170 HydrophobicContact CB-CE1 4.5Å; V2168-F2170 HydrophobicContact CG1-CD1 4.2Å; V2168-F2170 HydrophobicContact CG1-CE1 3.75Å; F2170-W2211 AromaticContact CD2-CD1 3.53Å; F2170-W2211 AromaticContact CD2-NE1 3.07Å; F2170-W2211 AromaticContact CE2-CE2 3.94Å; F2170-W2211 HydrophobicContact CE2-CZ2 4.22Å; F2170-W2211 AromaticContact CE2-NE1 3.31Å; F2170-W2211 VanDerWaalsContact CE2-NE1 3.31Å; F2170-W2211 AromaticContact CG-NE1 3.87Å
2171	S	94.1	Very high	88.3	Confident	4 Å²	4	23.3 Å²	23.3	3%	0.028	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-169.5	170.5	-172.1	0	0	0	0	109.8	N2189 E2193 V2208 I2209 W2211	S2171-N2189 WeakPolarHBondContact OG-CB 3.43Å; S2171-E2193 VanDerWaalsContact CB-OE1 3.31Å; S2171-E2193 WeakPolarHBondContact CB-OE1 3.33Å; S2171-E2193 PolarHBondContact OG-OE1 3.36Å; S2171-V2208 VanDerWaalsContact CB-CG1 3.44Å; S2171-I2209 CarbonylContact C-O 3.55Å; S2171-I2209 WeakPolarHBondContact CA-O 3.48Å; S2171-I2209 PolarHBondContact N-O 2.91Å; S2171-W2211 PolarHBondContact O-N 2.84Å
2172	S	91.1	Very high	88.7	Confident	21 Å²	21	21.9 Å²	21.9	15%	0.147	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	156.6	179.1	-171	0	0	0	0	112.6	S2174 C2175 W2211	S2172-S2174 PolarHBondContact O-N 2.87Å; S2172-S2174 VanDerWaalsContact O-N 3.11Å; S2172-S2174 PolarHBondContact OG-OG 3.02Å; S2172-C2175 WeakPolarHBondContact O-CB 3.23Å; S2172-C2175 PolarHBondContact O-N 2.81Å; S2172-W2211 CarbonylContact C-O 3.58Å; S2172-W2211 VanDerWaalsContact CA-O 3.26Å; S2172-W2211 WeakPolarHBondContact CA-O 3.3Å; S2172-W2211 PolarHBondContact OG-O 2.65Å
2173	Q	87.5	Confident	89	Confident	15 Å²	15	15.5 Å²	15.5	7%	0.07	8%	0.079	C	C	.	.	H	α-helix	trans	-52.4	-26.6	171.5	-87.4	-74.5	6.2	0	0	113.3	C2175 A2176 R2177 W2211 S2258	Q2173-C2175 PolarHBondContact O-N 2.78Å; Q2173-C2175 VanDerWaalsContact O-N 3.13Å; Q2173-A2176 WeakPolarHBondContact O-CB 3.03Å; Q2173-A2176 PolarHBondContact O-N 3.43Å; Q2173-R2177 PolarHBondContact O-N 3Å; Q2173-W2211 PolarHBondContact N-O 2.9Å; Q2173-S2258 PolarHBondContact NE2-OG 2.87Å
2174	S	85.7	Confident	89.3	Confident	6 Å²	6	11 Å²	11	4%	0.042	6%	0.058	C	C	.	.	H	α-helix	trans	-54.5	-31	171.5	-31.6	0	0	0	0	113.3	C1608 S2172 G2178 Q2182	C1608-S2174 PolarHBondContact SG-O 3.49Å; S2172-S2174 PolarHBondContact O-N 2.87Å; S2172-S2174 VanDerWaalsContact O-N 3.11Å; S2172-S2174 PolarHBondContact OG-OG 3.02Å; S2174-G2178 CarbonylContact O-C 3.53Å; S2174-G2178 VanDerWaalsContact O-CA 3.25Å; S2174-G2178 WeakPolarHBondContact O-CA 3.36Å; S2174-G2178 PolarHBondContact O-N 3.04Å; S2174-Q2182 PolarHBondContact OG-OE1 3.11Å
2175	C	89.3	Confident	89.2	Confident	6 Å²	6	11 Å²	11	4%	0.041	6%	0.057	C	C	.	.	H	α-helix	trans	-83.6	-27.3	173.9	-176.1	0	0	0	0	113.2	S2172 Q2173 N2189 S2190	S2172-C2175 WeakPolarHBondContact O-CB 3.23Å; S2172-C2175 PolarHBondContact O-N 2.81Å; Q2173-C2175 PolarHBondContact O-N 2.78Å; Q2173-C2175 VanDerWaalsContact O-N 3.13Å; C2175-N2189 HydrophobicContact CB-CB 3.64Å; C2175-S2190 WeakPolarHBondContact SG-CA 3.38Å; C2175-S2190 WeakPolarHBondContact SG-CB 3.36Å; C2175-S2190 PolarHBondContact SG-N 2.84Å
2176	A	85.7	Confident	89.2	Confident	4 Å²	4	7.2 Å²	7.2	3%	0.033	4%	0.041	C	C	.	.	H	α-helix	trans	-85.6	-44.6	-166.9	0	0	0	0	0	112.6	L1607 H1665 Q2173 Q2210	L1607-A2176 WeakPolarHBondContact CD1-O 3.45Å; H1665-A2176 PolarHBondContact CE1-O 3.28Å; Q2173-A2176 WeakPolarHBondContact O-CB 3.03Å; Q2173-A2176 PolarHBondContact O-N 3.43Å; A2176-Q2210 HydrophobicContact CB-CB 4.25Å; A2176-Q2210 HydrophobicContact CB-CG 4.25Å
2177	R	84.5	Confident	89.2	Confident	9 Å²	9	6.9 Å²	6.9	3%	0.034	4%	0.039	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.9	-2.2	-179.1	-54	-58.7	-169.4	164.2	5.6	113.1	E1239 D1369 H1403 H1665 Q2173	E1239-R2177 IonicContact OE1-NH2 3.21Å; E1239-R2177 PolarHBondContact OE1-NH2 3.02Å; E1239-R2177 IonicContact OE2-NH2 2.71Å; D1369-R2177 IonicContact OD2-CZ 3.24Å; D1369-R2177 IonicContact OD2-NH1 2.73Å; D1369-R2177 PolarHBondContact OD2-NH1 3.05Å; D1369-R2177 IonicContact OD2-NH2 3.41Å; H1403-R2177 VanDerWaalsContact CD2-CD 3.42Å; H1403-R2177 WeakPolarHBondContact CD2-CD 3.24Å; H1403-R2177 WeakPolarHBondContact NE2-CD 3.31Å; H1665-R2177 VanDerWaalsContact CB-NH2 3.33Å; Q2173-R2177 PolarHBondContact O-N 3Å
2178	G	82.2	Confident	89.2	Confident	10 Å²	10	6.8 Å²	6.8	10%	0.103	4%	0.039	C	C	.	.			trans	93.7	153.8	-174.6	0	0	0	0	0	112.5	S2174	S2174-G2178 CarbonylContact O-C 3.53Å; S2174-G2178 VanDerWaalsContact O-CA 3.25Å; S2174-G2178 WeakPolarHBondContact O-CA 3.36Å; S2174-G2178 PolarHBondContact O-N 3.04Å
2179	N	82.4	Confident	89.1	Confident	18 Å²	18	6.8 Å²	6.8	10%	0.096	4%	0.039	C	C	.	.			trans	-151.6	133.3	161.4	-169	38.1	0	0	0	110	C1608 Q2182 V2310 Q2314	C1608-N2179 PolarHBondContact SG-N 2.99Å; N2179-Q2182 HydrophobicContact CB-CB 4.38Å; N2179-Q2182 PolarHBondContact ND2-OE1 3.22Å; N2179-Q2182 PolarHBondContact O-N 2.89Å; N2179-V2310 WeakPolarHBondContact OD1-CG1 3.48Å; N2179-Q2314 PolarHBondContact OD1-NE2 3.02Å
2180	S	79.4	Confident	89	Confident	4 Å²	4	6.9 Å²	6.9	3%	0.028	4%	0.04	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	143.8	-177.4	-56.4	0	0	0	0	111.8	E1611 E1612 Q2182	E1611-S2180 WeakPolarHBondContact CB-OG 3.28Å; E1611-S2180 PolarHBondContact O-OG 2.84Å; E1612-S2180 PolarHBondContact N-OG 3.21Å; S2180-Q2182 PolarHBondContact O-N 3.25Å
2181	G	81.1	Confident	89	Confident	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.038	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	-1	-174.9	0	0	0	0	0	114.5	E1612 D2127 C2128	E1612-G2181 WeakPolarHBondContact OE1-CA 3.37Å; E1612-G2181 PolarHBondContact OE1-N 2.64Å; D2127-G2181 CarbonylContact C-O 3.47Å; D2127-G2181 VanDerWaalsContact CA-O 3.28Å; D2127-G2181 WeakPolarHBondContact CA-O 3.41Å; C2128-G2181 CarbonylContact C-O 3.52Å; C2128-G2181 PolarHBondContact N-O 2.96Å; C2128-G2181 CarbonylContact O-C 3.51Å; C2128-G2181 WeakPolarHBondContact O-CA 3.29Å; C2128-G2181 VanDerWaalsContact O-O 3.07Å
2182	Q	89.3	Confident	89	Confident	18 Å²	18	6.4 Å²	6.4	8%	0.084	4%	0.037	C	C	.	.			trans	-118.7	23	-176.5	-74.6	-175.3	-13.7	0	0	113.3	D2127 S2174 N2179 S2180 N2184 Y2185 G2186	D2127-Q2182 HydrophobicContact CB-CG 4.33Å; D2127-Q2182 PolarHBondContact OD2-NE2 3.13Å; S2174-Q2182 PolarHBondContact OG-OE1 3.11Å; N2179-Q2182 HydrophobicContact CB-CB 4.38Å; N2179-Q2182 PolarHBondContact ND2-OE1 3.22Å; N2179-Q2182 PolarHBondContact O-N 2.89Å; S2180-Q2182 PolarHBondContact O-N 3.25Å; Q2182-N2184 VanDerWaalsContact C-N 3.26Å; Q2182-N2184 PolarHBondContact O-N 3.11Å; Q2182-Y2185 CarbonylContact O-C 3.58Å; Q2182-Y2185 PolarHBondContact O-N 3.3Å; Q2182-G2186 PolarHBondContact O-N 2.96Å
2183	T	90.9	Very high	89.1	Confident	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-48.1	-41.7	175.5	38.9	0	0	0	0	114.2	L1605 C1608 L1609 F2130 W2187	L1605-T2183 HydrophobicContact CD1-CG2 4.05Å; C1608-T2183 HydrophobicContact CB-CG2 3.53Å; L1609-T2183 HydrophobicContact CD2-CG2 3.86Å; L1609-T2183 HydrophobicContact CG-CG2 4.01Å; F2130-T2183 HydrophobicContact CB-CG2 4.16Å; F2130-T2183 HydrophobicContact CD2-CG2 3.96Å; F2130-T2183 HydrophobicContact CG-CG2 4.39Å; T2183-W2187 WeakPolarHBondContact O-CB 3.14Å; T2183-W2187 PolarHBondContact O-N 2.84Å
2184	N	92.1	Very high	89.3	Confident	1 Å²	1	5.4 Å²	5.4	1%	0.005	3%	0.03	C	C	.	.	H	α-helix	trans	-67.8	-39.2	175.1	58.4	4.5	0	0	0	113.6	R2126 Q2133 F2138 Q2182 A2188	R2126-N2184 WeakPolarHBondContact CB-ND2 3.49Å; R2126-N2184 PolarHBondContact O-ND2 3.33Å; Q2133-N2184 PolarHBondContact NE2-ND2 2.98Å; Q2133-N2184 VanDerWaalsContact NE2-ND2 3.12Å; Q2133-N2184 PolarHBondContact OE1-ND2 3.28Å; F2138-N2184 HydrophobicContact CD1-CB 3.97Å; F2138-N2184 HydrophobicContact CD2-CB 3.75Å; F2138-N2184 HydrophobicContact CE1-CB 3.94Å; F2138-N2184 HydrophobicContact CE2-CB 3.7Å; F2138-N2184 HydrophobicContact CG-CB 3.89Å; F2138-N2184 HydrophobicContact CZ-CB 3.8Å; Q2182-N2184 VanDerWaalsContact C-N 3.26Å; Q2182-N2184 PolarHBondContact O-N 3.11Å; N2184-A2188 VanDerWaalsContact O-CB 3.3Å; N2184-A2188 WeakPolarHBondContact O-CB 3.23Å; N2184-A2188 PolarHBondContact O-N 3.06Å
2185	Y	92.5	Very high	89.5	Confident	12 Å²	12	5.1 Å²	5.1	5%	0.047	3%	0.028	C	C	.	.	H	α-helix	trans	-76	-39.6	179.6	-171.1	-124.7	0	0	0	111.7	M2123 L2125 K2145 Q2182 A2188 N2189	M2123-Y2185 HydrophobicContact CB-CE2 4.25Å; L2125-Y2185 HydrophobicContact CD2-CD1 3.88Å; L2125-Y2185 HydrophobicContact CD2-CD2 3.86Å; L2125-Y2185 HydrophobicContact CD2-CE1 4.06Å; L2125-Y2185 HydrophobicContact CD2-CE2 4.05Å; L2125-Y2185 HydrophobicContact CD2-CG 3.78Å; K2145-Y2185 PolarHBondContact NZ-OH 3.48Å; Q2182-Y2185 CarbonylContact O-C 3.58Å; Q2182-Y2185 PolarHBondContact O-N 3.3Å; Y2185-A2188 PolarHBondContact O-N 3.09Å; Y2185-N2189 WeakPolarHBondContact CD1-ND2 3.46Å; Y2185-N2189 WeakPolarHBondContact CE1-ND2 3.46Å; Y2185-N2189 VanDerWaalsContact O-CB 3.28Å; Y2185-N2189 WeakPolarHBondContact O-CB 3.37Å; Y2185-N2189 PolarHBondContact O-N 2.81Å; Y2185-N2189 PolarHBondContact O-ND2 3.48Å
2186	G	91.3	Very high	89.6	Confident	0 Å²	0	4.9 Å²	4.9	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-58.2	-49.3	171	0	0	0	0	0	111.6	Q2182 A2188 N2189 S2190	Q2182-G2186 PolarHBondContact O-N 2.96Å; G2186-A2188 PolarHBondContact O-N 2.83Å; G2186-N2189 PolarHBondContact O-N 3.34Å; G2186-S2190 WeakPolarHBondContact O-CB 3.35Å; G2186-S2190 PolarHBondContact O-N 3.47Å
2187	W	94.4	Very high	89.8	Confident	1 Å²	1	5.4 Å²	5.4	0%	0.004	3%	0.028	C	C	.	.	H	α-helix	trans	-58.3	-49.1	173.9	-175.7	93.6	0	0	0	112.2	V1566 F1569 W1571 N1600 G1601 L1605 F2138 T2183 N2189 S2190 Y2191	V1566-W2187 HydrophobicContact CB-CH2 3.88Å; V1566-W2187 HydrophobicContact CB-CZ2 3.87Å; V1566-W2187 HydrophobicContact CG1-CH2 4.49Å; V1566-W2187 HydrophobicContact CG1-CZ2 4Å; F1569-W2187 HydrophobicContact CE1-CD2 4.34Å; F1569-W2187 AromaticContact CE1-CE3 3.98Å; F1569-W2187 HydrophobicContact CE1-CE3 3.98Å; F1569-W2187 AromaticContact CE1-CH2 3.56Å; F1569-W2187 HydrophobicContact CE1-CH2 3.56Å; F1569-W2187 AromaticContact CE1-CZ2 3.92Å; F1569-W2187 HydrophobicContact CE1-CZ2 3.92Å; F1569-W2187 AromaticContact CE1-CZ3 3.59Å; F1569-W2187 HydrophobicContact CE1-CZ3 3.59Å; F1569-W2187 HydrophobicContact CZ-CE3 4.42Å; F1569-W2187 AromaticContact CZ-CH2 3.77Å; F1569-W2187 HydrophobicContact CZ-CH2 3.77Å; F1569-W2187 AromaticContact CZ-CZ3 3.7Å; F1569-W2187 HydrophobicContact CZ-CZ3 3.7Å; W1571-W2187 AromaticContact CZ2-NE1 3.99Å; N1600-W2187 PolarHBondContact OD1-NE1 2.69Å; G1601-W2187 VanDerWaalsContact CA-CD1 3.49Å; G1601-W2187 WeakPolarHBondContact CA-O 3.17Å; G1601-W2187 WeakPolarHBondContact O-CA 3.25Å; L1605-W2187 HydrophobicContact CB-CB 4.15Å; F2138-W2187 HydrophobicContact CE1-CB 4.19Å; F2138-W2187 HydrophobicContact CE1-CG 4.36Å; T2183-W2187 WeakPolarHBondContact O-CB 3.14Å; T2183-W2187 PolarHBondContact O-N 2.84Å; W2187-N2189 PolarHBondContact O-N 3.13Å; W2187-S2190 PolarHBondContact O-N 2.82Å; W2187-Y2191 AromaticContact CH2-CD2 3.63Å; W2187-Y2191 HydrophobicContact CH2-CD2 3.63Å; W2187-Y2191 HydrophobicContact CH2-CE2 4.12Å; W2187-Y2191 HydrophobicContact CH2-CG 4.36Å; W2187-Y2191 AromaticContact CZ2-CD2 3.74Å; W2187-Y2191 HydrophobicContact CZ2-CD2 3.74Å; W2187-Y2191 HydrophobicContact CZ2-CE2 4.27Å; W2187-Y2191 HydrophobicContact CZ3-CD2 4.28Å; W2187-Y2191 PolarHBondContact O-N 3.28Å
2188	A	94.1	Very high	90	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-65.3	-37.8	-176.9	0	0	0	0	0	113.2	K2145 N2184 Y2185 G2186 M2192	K2145-A2188 HydrophobicContact CB-CB 4.14Å; N2184-A2188 VanDerWaalsContact O-CB 3.3Å; N2184-A2188 WeakPolarHBondContact O-CB 3.23Å; N2184-A2188 PolarHBondContact O-N 3.06Å; Y2185-A2188 PolarHBondContact O-N 3.09Å; G2186-A2188 PolarHBondContact O-N 2.83Å; A2188-M2192 WeakPolarHBondContact O-CB 3.33Å; A2188-M2192 PolarHBondContact O-N 2.82Å; A2188-M2192 VanDerWaalsContact O-N 3.17Å
2189	N	94.7	Very high	90.4	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-66.4	-42.8	172.9	-75.9	-37.6	0	0	0	111.8	K2145 S2171 C2175 Y2185 G2186 W2187 Y2191 M2192 E2193	K2145-N2189 PolarHBondContact NZ-OD1 3.45Å; S2171-N2189 WeakPolarHBondContact OG-CB 3.43Å; C2175-N2189 HydrophobicContact CB-CB 3.64Å; Y2185-N2189 WeakPolarHBondContact CD1-ND2 3.46Å; Y2185-N2189 WeakPolarHBondContact CE1-ND2 3.46Å; Y2185-N2189 VanDerWaalsContact O-CB 3.28Å; Y2185-N2189 WeakPolarHBondContact O-CB 3.37Å; Y2185-N2189 PolarHBondContact O-N 2.81Å; Y2185-N2189 PolarHBondContact O-ND2 3.48Å; G2186-N2189 PolarHBondContact O-N 3.34Å; W2187-N2189 PolarHBondContact O-N 3.13Å; N2189-Y2191 VanDerWaalsContact C-N 3.34Å; N2189-Y2191 PolarHBondContact O-N 3.22Å; N2189-M2192 WeakPolarHBondContact O-CB 3.42Å; N2189-M2192 PolarHBondContact O-N 3.31Å; N2189-E2193 PolarHBondContact O-N 3.12Å
2190	S	93.1	Very high	90.7	Very high	1 Å²	1	7 Å²	7	1%	0.007	3%	0.031	C	C	.	.	H	α-helix	trans	-65.6	-38.1	179.5	-159.1	0	0	0	0	111.9	G1601 G1604 C2175 G2186 W2187 E2193 R2194	G1601-S2190 WeakPolarHBondContact O-CB 3.46Å; G1604-S2190 PolarHBondContact N-OG 3.4Å; C2175-S2190 WeakPolarHBondContact SG-CA 3.38Å; C2175-S2190 WeakPolarHBondContact SG-CB 3.36Å; C2175-S2190 PolarHBondContact SG-N 2.84Å; G2186-S2190 WeakPolarHBondContact O-CB 3.35Å; G2186-S2190 PolarHBondContact O-N 3.47Å; W2187-S2190 PolarHBondContact O-N 2.82Å; S2190-E2193 WeakPolarHBondContact O-CB 3.37Å; S2190-E2193 PolarHBondContact O-N 2.89Å; S2190-R2194 WeakPolarHBondContact O-CG 3.17Å; S2190-R2194 PolarHBondContact O-N 2.73Å; S2190-R2194 VanDerWaalsContact O-N 3.17Å
2191	Y	93.3	Very high	91	Very high	9 Å²	9	11.3 Å²	11.3	4%	0.035	5%	0.052	C	C	.	.	H	α-helix	trans	-59.9	-47.6	172.2	-164.6	-72.9	0	0	0	111.6	V1566 R1599 C2146 W2187 N2189 E2193 R2194 I2195	V1566-Y2191 HydrophobicContact CB-CE2 3.9Å; V1566-Y2191 HydrophobicContact CG1-CE2 4.01Å; V1566-Y2191 HydrophobicContact CG2-CE2 3.96Å; R1599-Y2191 HydrophobicContact CB-CE2 4.37Å; R1599-Y2191 VanDerWaalsContact O-CE2 3.26Å; R1599-Y2191 WeakPolarHBondContact O-CE2 3.41Å; C2146-Y2191 HydrophobicContact CB-CD1 3.79Å; C2146-Y2191 HydrophobicContact CB-CE1 4.22Å; C2146-Y2191 HydrophobicContact CB-CG 4.21Å; W2187-Y2191 AromaticContact CH2-CD2 3.63Å; W2187-Y2191 HydrophobicContact CH2-CD2 3.63Å; W2187-Y2191 HydrophobicContact CH2-CE2 4.12Å; W2187-Y2191 HydrophobicContact CH2-CG 4.36Å; W2187-Y2191 AromaticContact CZ2-CD2 3.74Å; W2187-Y2191 HydrophobicContact CZ2-CD2 3.74Å; W2187-Y2191 HydrophobicContact CZ2-CE2 4.27Å; W2187-Y2191 HydrophobicContact CZ3-CD2 4.28Å; W2187-Y2191 PolarHBondContact O-N 3.28Å; N2189-Y2191 VanDerWaalsContact C-N 3.34Å; N2189-Y2191 PolarHBondContact O-N 3.22Å; Y2191-E2193 VanDerWaalsContact C-N 3.33Å; Y2191-E2193 PolarHBondContact O-N 3.12Å; Y2191-R2194 PolarHBondContact O-N 3.15Å; Y2191-I2195 HydrophobicContact CD1-CD1 3.86Å; Y2191-I2195 HydrophobicContact CD1-CG1 4.19Å; Y2191-I2195 HydrophobicContact CE1-CD1 3.91Å; Y2191-I2195 HydrophobicContact CE1-CG1 4.15Å; Y2191-I2195 PolarHBondContact O-N 2.71Å
2192	M	94.6	Very high	91.3	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-60.8	-40.2	177.3	175.8	-174.4	74.5	0	0	112.2	K2145 T2149 A2169 A2188 N2189 R2194 I2195 V2196 V2208	K2145-M2192 HydrophobicContact CD-CE 4.19Å; K2145-M2192 HydrophobicContact CD-SD 3.61Å; T2149-M2192 HydrophobicContact CG2-CG 4.13Å; A2169-M2192 HydrophobicContact CB-CE 4.14Å; A2169-M2192 HydrophobicContact CB-CG 4.11Å; A2169-M2192 HydrophobicContact CB-SD 3.78Å; A2188-M2192 WeakPolarHBondContact O-CB 3.33Å; A2188-M2192 PolarHBondContact O-N 2.82Å; A2188-M2192 VanDerWaalsContact O-N 3.17Å; N2189-M2192 WeakPolarHBondContact O-CB 3.42Å; N2189-M2192 PolarHBondContact O-N 3.31Å; M2192-R2194 PolarHBondContact O-N 3.12Å; M2192-I2195 PolarHBondContact O-N 3.04Å; M2192-V2196 PolarHBondContact O-N 3.04Å; M2192-V2208 HydrophobicContact CE-CG1 4.35Å
2193	E	93.8	Very high	91.1	Very high	5 Å²	5	20.7 Å²	20.7	2%	0.023	10%	0.103	C	C	.	.	H	α-helix	trans	-58.5	-43.5	173.7	-80	169.7	-159.4	0	0	112.6	S2171 N2189 S2190 Y2191 I2195 V2196 E2197 V2208 Q2210 I2256	S2171-E2193 VanDerWaalsContact CB-OE1 3.31Å; S2171-E2193 WeakPolarHBondContact CB-OE1 3.33Å; S2171-E2193 PolarHBondContact OG-OE1 3.36Å; N2189-E2193 PolarHBondContact O-N 3.12Å; S2190-E2193 WeakPolarHBondContact O-CB 3.37Å; S2190-E2193 PolarHBondContact O-N 2.89Å; Y2191-E2193 VanDerWaalsContact C-N 3.33Å; Y2191-E2193 PolarHBondContact O-N 3.12Å; E2193-I2195 PolarHBondContact O-N 2.74Å; E2193-V2196 PolarHBondContact O-N 3.14Å; E2193-E2197 WeakPolarHBondContact O-CB 3.42Å; E2193-E2197 PolarHBondContact O-N 2.72Å; E2193-V2208 HydrophobicContact CG-CB 4.29Å; E2193-V2208 HydrophobicContact CG-CG1 3.69Å; E2193-V2208 HydrophobicContact CG-CG2 4.37Å; E2193-Q2210 WeakPolarHBondContact OE1-CG 3.19Å; E2193-Q2210 PolarHBondContact OE1-NE2 3.35Å; E2193-Q2210 PolarHBondContact OE2-NE2 3.28Å; E2193-I2256 HydrophobicContact CB-CD1 4.19Å; E2193-I2256 HydrophobicContact CG-CD1 4.48Å; E2193-I2256 HydrophobicContact CG-CG2 4.39Å
2194	R	90.3	Very high	91.1	Very high	10 Å²	10	23.2 Å²	23.2	4%	0.038	12%	0.116	C	C	.	.	H	α-helix	trans	-64.5	-36.4	176.6	-62.1	-70.2	83.4	78.5	-5.8	112.5	M1622 Y1663 S2190 Y2191 M2192 E2197 Y2198	M1622-R2194 HydrophobicContact CE-CG 4.45Å; Y1663-R2194 VanDerWaalsContact CE1-NH2 3.28Å; S2190-R2194 WeakPolarHBondContact O-CG 3.17Å; S2190-R2194 PolarHBondContact O-N 2.73Å; S2190-R2194 VanDerWaalsContact O-N 3.17Å; Y2191-R2194 PolarHBondContact O-N 3.15Å; M2192-R2194 PolarHBondContact O-N 3.12Å; R2194-E2197 IonicContact CZ-OE2 2.8Å; R2194-E2197 IonicContact NE-OE2 3.55Å; R2194-E2197 PolarHBondContact NE-OE2 3.46Å; R2194-E2197 IonicContact NH2-OE2 3.75Å; R2194-E2197 PolarHBondContact NH2-OE2 3.14Å; R2194-E2197 PolarHBondContact O-N 2.76Å; R2194-Y2198 WeakPolarHBondContact O-CD2 3.34Å; R2194-Y2198 PolarHBondContact O-N 2.89Å; R2194-Y2198 VanDerWaalsContact O-N 3.07Å
2195	I	90.5	Very high	91.1	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.9	-45.8	174.7	-57.3	163.6	0	0	0	110.6	T2149 E2150 D2153 Y2191 M2192 E2193 Y2198 R2199	T2149-I2195 HydrophobicContact CG2-CB 4.09Å; T2149-I2195 HydrophobicContact CG2-CD1 3.82Å; T2149-I2195 HydrophobicContact CG2-CG2 3.94Å; E2150-I2195 HydrophobicContact CG-CD1 3.5Å; E2150-I2195 HydrophobicContact CG-CG1 4.14Å; D2153-I2195 HydrophobicContact CB-CG2 4.17Å; Y2191-I2195 HydrophobicContact CD1-CD1 3.86Å; Y2191-I2195 HydrophobicContact CD1-CG1 4.19Å; Y2191-I2195 HydrophobicContact CE1-CD1 3.91Å; Y2191-I2195 HydrophobicContact CE1-CG1 4.15Å; Y2191-I2195 PolarHBondContact O-N 2.71Å; M2192-I2195 PolarHBondContact O-N 3.04Å; E2193-I2195 PolarHBondContact O-N 2.74Å; I2195-Y2198 PolarHBondContact O-N 3.34Å; I2195-R2199 PolarHBondContact O-N 3.49Å; I2195-R2199 VanDerWaalsContact O-N 3.16Å
2196	V	91.9	Very high	91.1	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-71.9	-33	-179	-176.5	0	0	0	0	111.4	T2149 F2167 A2169 M2192 E2193 Y2198 R2199 I2200 G2206 V2208	T2149-V2196 HydrophobicContact CG2-CG2 4.45Å; F2167-V2196 HydrophobicContact CD1-CG2 4.46Å; F2167-V2196 HydrophobicContact CE1-CG2 4.15Å; A2169-V2196 HydrophobicContact CB-CG2 4.32Å; M2192-V2196 PolarHBondContact O-N 3.04Å; E2193-V2196 PolarHBondContact O-N 3.14Å; V2196-Y2198 VanDerWaalsContact C-N 3.35Å; V2196-Y2198 PolarHBondContact O-N 2.99Å; V2196-R2199 WeakPolarHBondContact O-CA 3.31Å; V2196-R2199 WeakPolarHBondContact O-CB 3.41Å; V2196-R2199 PolarHBondContact O-N 2.93Å; V2196-R2199 VanDerWaalsContact O-N 3.08Å; V2196-I2200 HydrophobicContact CG1-CD1 4.4Å; V2196-I2200 WeakPolarHBondContact O-CG1 3.43Å; V2196-I2200 PolarHBondContact O-N 3.28Å; V2196-G2206 VanDerWaalsContact CG1-CA 3.45Å; V2196-V2208 HydrophobicContact CB-CG2 3.49Å; V2196-V2208 VanDerWaalsContact CB-CG2 3.49Å; V2196-V2208 HydrophobicContact CG1-CG2 3.63Å; V2196-V2208 HydrophobicContact CG2-CG2 3.71Å
2197	E	89.2	Confident	91.3	Very high	16 Å²	16	24.1 Å²	24.1	8%	0.075	12%	0.123	C	C	.	.	H	α-helix	trans	-62.1	-40.3	172	-162.7	174.7	179.8	0	0	112.1	F1626 R1656 E2193 R2194 R2199 I2200 M2201 I2256	F1626-E2197 HydrophobicContact CE1-CG 4.21Å; F1626-E2197 HydrophobicContact CZ-CG 3.95Å; R1656-E2197 IonicContact CZ-OE1 3.77Å; R1656-E2197 VanDerWaalsContact CZ-OE1 3.22Å; R1656-E2197 IonicContact NH1-OE1 2.64Å; R1656-E2197 PolarHBondContact NH1-OE1 3.4Å; R1656-E2197 IonicContact NH1-OE2 2.63Å; R1656-E2197 IonicContact NH2-OE1 3.2Å; R1656-E2197 PolarHBondContact NH2-OE1 2.85Å; E2193-E2197 WeakPolarHBondContact O-CB 3.42Å; E2193-E2197 PolarHBondContact O-N 2.72Å; R2194-E2197 IonicContact CZ-OE2 2.8Å; R2194-E2197 IonicContact NE-OE2 3.55Å; R2194-E2197 PolarHBondContact NE-OE2 3.46Å; R2194-E2197 IonicContact NH2-OE2 3.75Å; R2194-E2197 PolarHBondContact NH2-OE2 3.14Å; R2194-E2197 PolarHBondContact O-N 2.76Å; E2197-R2199 VanDerWaalsContact C-N 3.33Å; E2197-R2199 PolarHBondContact O-N 2.87Å; E2197-I2200 WeakPolarHBondContact O-CB 3.34Å; E2197-I2200 PolarHBondContact O-N 2.69Å; E2197-M2201 WeakPolarHBondContact O-CG 3.22Å; E2197-M2201 PolarHBondContact O-N 3.24Å; E2197-I2256 HydrophobicContact CB-CD1 4.31Å
2198	Y	88.3	Confident	91.4	Very high	38 Å²	38	24 Å²	24	15%	0.149	12%	0.123	C	C	.	.	H	α-helix	trans	-60.5	-38.9	169.9	-92.7	-77.5	0	0	0	112.5	V1598 R1599 S1625 F1626 R2194 I2195 V2196 I2200 M2201 D2202	V1598-Y2198 VanDerWaalsContact CG1-OH 3.3Å; V1598-Y2198 WeakPolarHBondContact CG1-OH 3.39Å; R1599-Y2198 HydrophobicContact CG-CE2 4.28Å; S1625-Y2198 PolarHBondContact O-OH 2.9Å; S1625-Y2198 VanDerWaalsContact O-OH 3.05Å; F1626-Y2198 HydrophobicContact CB-CE1 4.39Å; F1626-Y2198 HydrophobicContact CD1-CD1 4.01Å; F1626-Y2198 AromaticContact CD1-CE1 3.79Å; F1626-Y2198 HydrophobicContact CD1-CE1 3.79Å; F1626-Y2198 HydrophobicContact CD1-CE2 4.4Å; F1626-Y2198 HydrophobicContact CD1-CG 4.41Å; F1626-Y2198 AromaticContact CD1-CZ 4Å; R2194-Y2198 WeakPolarHBondContact O-CD2 3.34Å; R2194-Y2198 PolarHBondContact O-N 2.89Å; R2194-Y2198 VanDerWaalsContact O-N 3.07Å; I2195-Y2198 PolarHBondContact O-N 3.34Å; V2196-Y2198 VanDerWaalsContact C-N 3.35Å; V2196-Y2198 PolarHBondContact O-N 2.99Å; Y2198-I2200 VanDerWaalsContact C-N 3.35Å; Y2198-I2200 PolarHBondContact O-N 3.39Å; Y2198-M2201 PolarHBondContact O-N 3.28Å; Y2198-D2202 WeakPolarHBondContact O-CB 3.47Å; Y2198-D2202 VanDerWaalsContact O-CG 3.28Å; Y2198-D2202 PolarHBondContact O-N 3.21Å
2199	R	90.8	Very high	91.4	Very high	3 Å²	3	24 Å²	24	1%	0.011	12%	0.123	C	C	.	.	H	α-helix	trans	-62.4	-40.8	174.5	-71.5	178.3	60.1	98.4	-5.3	112.3	D2153 S2156 I2195 V2196 E2197 D2202 N2203 L2204 P2205	D2153-R2199 WeakPolarHBondContact OD1-CD 3.42Å; D2153-R2199 VanDerWaalsContact OD1-CG 3.27Å; D2153-R2199 WeakPolarHBondContact OD1-CG 3.27Å; D2153-R2199 IonicContact OD1-CZ 3.48Å; D2153-R2199 IonicContact OD1-NE 3.82Å; D2153-R2199 IonicContact OD1-NH1 3.28Å; D2153-R2199 PolarHBondContact OD1-NH1 3.39Å; S2156-R2199 PolarHBondContact OG-NH1 2.65Å; I2195-R2199 PolarHBondContact O-N 3.49Å; I2195-R2199 VanDerWaalsContact O-N 3.16Å; V2196-R2199 WeakPolarHBondContact O-CA 3.31Å; V2196-R2199 WeakPolarHBondContact O-CB 3.41Å; V2196-R2199 PolarHBondContact O-N 2.93Å; V2196-R2199 VanDerWaalsContact O-N 3.08Å; E2197-R2199 VanDerWaalsContact C-N 3.33Å; E2197-R2199 PolarHBondContact O-N 2.87Å; R2199-D2202 CarbonylContact O-C 3.57Å; R2199-D2202 WeakPolarHBondContact O-CB 3.08Å; R2199-D2202 PolarHBondContact O-N 3.29Å; R2199-N2203 PolarHBondContact O-N 2.95Å; R2199-L2204 HydrophobicContact CB-CB 4.24Å; R2199-L2204 WeakPolarHBondContact O-CA 3.42Å; R2199-L2204 WeakPolarHBondContact O-CB 3.48Å; R2199-L2204 PolarHBondContact O-N 3.18Å; R2199-P2205 PolarHBondContact NE-O 3.21Å; R2199-P2205 PolarHBondContact NH2-O 3.43Å
2200	I	89.7	Confident	91.4	Very high	30 Å²	30	24.2 Å²	24.2	15%	0.154	12%	0.124	C	C	.	.	H	α-helix	trans	-62.1	-44.7	176.3	-66.8	168.3	0	0	0	110.1	V2196 E2197 Y2198 D2202 N2203 G2206 Q2254	V2196-I2200 HydrophobicContact CG1-CD1 4.4Å; V2196-I2200 WeakPolarHBondContact O-CG1 3.43Å; V2196-I2200 PolarHBondContact O-N 3.28Å; E2197-I2200 WeakPolarHBondContact O-CB 3.34Å; E2197-I2200 PolarHBondContact O-N 2.69Å; Y2198-I2200 VanDerWaalsContact C-N 3.35Å; Y2198-I2200 PolarHBondContact O-N 3.39Å; I2200-D2202 VanDerWaalsContact C-N 3.31Å; I2200-D2202 PolarHBondContact O-N 2.85Å; I2200-N2203 WeakPolarHBondContact O-CA 3.49Å; I2200-N2203 PolarHBondContact O-N 3.22Å; I2200-G2206 WeakPolarHBondContact CD1-O 3.39Å; I2200-Q2254 HydrophobicContact CG1-CB 4.12Å; I2200-Q2254 HydrophobicContact CG1-CG 4.45Å; I2200-Q2254 HydrophobicContact CG2-CB 4.36Å
2201	M	85	Confident	91.3	Very high	93 Å²	93	24.5 Å²	24.5	46%	0.458	13%	0.125	S	C	.	.	H	α-helix	trans	-66.5	-30.4	175.5	-62	-62.8	141	0	0	113.1	F1626 E2197 Y2198 N2203	F1626-M2201 HydrophobicContact CD1-CG 3.94Å; F1626-M2201 HydrophobicContact CD2-CG 3.79Å; F1626-M2201 HydrophobicContact CD2-SD 3.99Å; F1626-M2201 HydrophobicContact CE1-CG 3.78Å; F1626-M2201 HydrophobicContact CE2-CE 4Å; F1626-M2201 HydrophobicContact CE2-CG 3.61Å; F1626-M2201 HydrophobicContact CE2-SD 3.69Å; F1626-M2201 HydrophobicContact CG-CB 4.49Å; F1626-M2201 HydrophobicContact CG-CG 3.96Å; F1626-M2201 HydrophobicContact CZ-CE 4.13Å; F1626-M2201 HydrophobicContact CZ-CG 3.62Å; F1626-M2201 HydrophobicContact CZ-SD 4.17Å; E2197-M2201 WeakPolarHBondContact O-CG 3.22Å; E2197-M2201 PolarHBondContact O-N 3.24Å; Y2198-M2201 PolarHBondContact O-N 3.28Å; M2201-N2203 PolarHBondContact O-N 3.32Å
2202	D	86.9	Confident	91	Very high	77 Å²	77	24.6 Å²	24.6	41%	0.412	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	5.6	169.5	-69.5	-33.1	0	0	0	113.3	R2157 Y2198 R2199 I2200 L2204	R2157-D2202 IonicContact CZ-OD2 2.7Å; R2157-D2202 IonicContact NH1-OD2 2.7Å; R2157-D2202 PolarHBondContact NH1-OD2 2.97Å; R2157-D2202 IonicContact NH2-OD2 3.78Å; R2157-D2202 PolarHBondContact NH2-OD2 3.41Å; Y2198-D2202 WeakPolarHBondContact O-CB 3.47Å; Y2198-D2202 VanDerWaalsContact O-CG 3.28Å; Y2198-D2202 PolarHBondContact O-N 3.21Å; R2199-D2202 CarbonylContact O-C 3.57Å; R2199-D2202 WeakPolarHBondContact O-CB 3.08Å; R2199-D2202 PolarHBondContact O-N 3.29Å; I2200-D2202 VanDerWaalsContact C-N 3.31Å; I2200-D2202 PolarHBondContact O-N 2.85Å; D2202-L2204 HydrophobicContact CB-CD1 4.14Å; D2202-L2204 HydrophobicContact CB-CG 4.18Å; D2202-L2204 PolarHBondContact O-N 2.82Å
2203	N	86.9	Confident	90.4	Very high	139 Å²	139	25 Å²	25	74%	0.743	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.3	17.2	-173.5	-101.1	-51.1	0	0	0	115.2	R2199 I2200 M2201 Q2254	R2199-N2203 PolarHBondContact O-N 2.95Å; I2200-N2203 WeakPolarHBondContact O-CA 3.49Å; I2200-N2203 PolarHBondContact O-N 3.22Å; M2201-N2203 PolarHBondContact O-N 3.32Å; N2203-Q2254 PolarHBondContact O-NE2 2.74Å
2204	L	90.8	Very high	90	Very high	53 Å²	53	26.1 Å²	26.1	28%	0.277	14%	0.138	S	C	.	.			trans	-87.7	153.7	178	-65.2	173	0	0	0	111.8	R2157 R2199 D2202 G2206 Q2254	R2157-L2204 HydrophobicContact CG-CD1 3.94Å; R2199-L2204 HydrophobicContact CB-CB 4.24Å; R2199-L2204 WeakPolarHBondContact O-CA 3.42Å; R2199-L2204 WeakPolarHBondContact O-CB 3.48Å; R2199-L2204 PolarHBondContact O-N 3.18Å; D2202-L2204 HydrophobicContact CB-CD1 4.14Å; D2202-L2204 HydrophobicContact CB-CG 4.18Å; D2202-L2204 PolarHBondContact O-N 2.82Å; L2204-G2206 PolarHBondContact O-N 3.49Å; L2204-Q2254 PolarHBondContact O-NE2 3.14Å
2205	P	91.7	Very high	89.6	Confident	30 Å²	30	25.7 Å²	25.7	20%	0.195	14%	0.136	C	C	.	.			trans	-54.3	131.7	172.6	-21.2	29.3	0	0	0	111.3	L2164 F2167 R2199	L2164-P2205 VanDerWaalsContact O-CG 3.29Å; L2164-P2205 WeakPolarHBondContact O-CG 3.38Å; F2167-P2205 HydrophobicContact CB-CB 4.44Å; F2167-P2205 WeakPolarHBondContact CB-O 3.4Å; R2199-P2205 PolarHBondContact NE-O 3.21Å; R2199-P2205 PolarHBondContact NH2-O 3.43Å
2206	G	92.7	Very high	89	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.1	112.8	-178.4	0	0	0	0	0	110.9	V2196 I2200 L2204 Q2254 G2255	V2196-G2206 VanDerWaalsContact CG1-CA 3.45Å; I2200-G2206 WeakPolarHBondContact CD1-O 3.39Å; L2204-G2206 PolarHBondContact O-N 3.49Å; G2206-Q2254 VanDerWaalsContact O-CA 3.3Å; G2206-Q2254 WeakPolarHBondContact O-CA 3.23Å; G2206-G2255 PolarHBondContact O-N 3.41Å; G2206-G2255 VanDerWaalsContact O-N 3.07Å
2207	I	95.2	Very high	88.5	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	130.4	174.5	-65.9	166.8	0	0	0	107.7	F2167 V2168 A2169 I2209 F2249 L2250 G2255 F2257	F2167-I2207 PolarHBondContact O-N 2.98Å; V2168-I2207 WeakPolarHBondContact CA-O 3.19Å; V2168-I2207 HydrophobicContact CG1-CG2 4.3Å; V2168-I2207 HydrophobicContact CG2-CB 4.41Å; A2169-I2207 PolarHBondContact N-O 3.47Å; I2207-I2209 HydrophobicContact CG2-CD1 4.35Å; I2207-I2209 HydrophobicContact CG2-CG1 4.01Å; I2207-F2249 WeakPolarHBondContact CD1-O 3.22Å; I2207-F2249 HydrophobicContact CG2-CB 4.44Å; I2207-L2250 HydrophobicContact CD1-CD2 4.23Å; I2207-G2255 WeakPolarHBondContact CA-O 3.39Å; I2207-F2257 HydrophobicContact CG2-CD2 4.3Å; I2207-F2257 HydrophobicContact CG2-CE2 4.4Å
2208	V	95.4	Very high	87.6	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.6	165.6	-170.2	0	0	0	0	109.6	A2169 S2171 M2192 E2193 V2196 G2255 I2256 F2257	A2169-V2208 HydrophobicContact CB-CG2 4.38Å; A2169-V2208 WeakPolarHBondContact O-CA 3.47Å; S2171-V2208 VanDerWaalsContact CB-CG1 3.44Å; M2192-V2208 HydrophobicContact CE-CG1 4.35Å; E2193-V2208 HydrophobicContact CG-CB 4.29Å; E2193-V2208 HydrophobicContact CG-CG1 3.69Å; E2193-V2208 HydrophobicContact CG-CG2 4.37Å; V2196-V2208 HydrophobicContact CB-CG2 3.49Å; V2196-V2208 VanDerWaalsContact CB-CG2 3.49Å; V2196-V2208 HydrophobicContact CG1-CG2 3.63Å; V2196-V2208 HydrophobicContact CG2-CG2 3.71Å; V2208-G2255 PolarHBondContact N-O 3.24Å; V2208-I2256 HydrophobicContact CB-CG1 4.22Å; V2208-I2256 HydrophobicContact CB-CG2 4.31Å; V2208-I2256 HydrophobicContact CG2-CG1 4.33Å; V2208-F2257 PolarHBondContact O-N 2.83Å
2209	I	94.7	Very high	86.9	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	115.6	175.9	-51.9	160.3	0	0	0	108.4	V2168 A2169 S2171 I2207 W2211 L2246 F2249 F2257 C2259	V2168-I2209 HydrophobicContact CG1-CD1 4.26Å; A2169-I2209 PolarHBondContact O-N 2.79Å; S2171-I2209 CarbonylContact C-O 3.55Å; S2171-I2209 WeakPolarHBondContact CA-O 3.48Å; S2171-I2209 PolarHBondContact N-O 2.91Å; I2207-I2209 HydrophobicContact CG2-CD1 4.35Å; I2207-I2209 HydrophobicContact CG2-CG1 4.01Å; I2209-W2211 HydrophobicContact CB-CZ2 4.31Å; I2209-W2211 HydrophobicContact CD1-CZ2 3.77Å; I2209-W2211 HydrophobicContact CG2-CD2 3.73Å; I2209-W2211 VanDerWaalsContact CG2-CE2 3.42Å; I2209-W2211 HydrophobicContact CG2-CE3 4.29Å; I2209-W2211 HydrophobicContact CG2-CG 4.06Å; I2209-W2211 HydrophobicContact CG2-CH2 4.3Å; I2209-W2211 HydrophobicContact CG2-CZ2 3.77Å; I2209-W2211 PolarHBondContact O-N 3.42Å; I2209-L2246 HydrophobicContact CD1-CD1 3.59Å; I2209-F2249 HydrophobicContact CD1-CB 4.18Å; I2209-F2249 HydrophobicContact CD1-CD2 3.5Å; I2209-F2249 VanDerWaalsContact CD1-CD2 3.5Å; I2209-F2249 HydrophobicContact CD1-CE2 4.19Å; I2209-F2249 HydrophobicContact CD1-CG 4.12Å; I2209-F2249 HydrophobicContact CG1-CB 4.48Å; I2209-F2249 HydrophobicContact CG1-CD2 3.76Å; I2209-F2249 HydrophobicContact CG1-CE2 4.19Å; I2209-F2249 HydrophobicContact CG1-CG 4.18Å; I2209-F2249 HydrophobicContact CG2-CD2 4.16Å; I2209-F2249 HydrophobicContact CG2-CE2 3.72Å; I2209-F2249 HydrophobicContact CG2-CZ 4.33Å; I2209-F2257 CarbonylContact C-O 3.5Å; I2209-F2257 WeakPolarHBondContact CA-O 3.22Å; I2209-C2259 HydrophobicContact CG2-CB 3.99Å
2210	Q	94	Very high	85.9	Confident	3 Å²	3	27.7 Å²	27.7	1%	0.014	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	91.5	169.1	-67.6	169.6	-16.7	0	0	108.1	H1665 A2176 E2193 F2257 S2258 C2259	H1665-Q2210 PolarHBondContact NE2-OE1 3.32Å; A2176-Q2210 HydrophobicContact CB-CB 4.25Å; A2176-Q2210 HydrophobicContact CB-CG 4.25Å; E2193-Q2210 WeakPolarHBondContact OE1-CG 3.19Å; E2193-Q2210 PolarHBondContact OE1-NE2 3.35Å; E2193-Q2210 PolarHBondContact OE2-NE2 3.28Å; Q2210-F2257 PolarHBondContact N-O 3.49Å; Q2210-S2258 WeakPolarHBondContact O-CA 3.42Å; Q2210-S2258 PolarHBondContact O-OG 3.02Å; Q2210-C2259 PolarHBondContact O-N 2.92Å
2211	W	91.6	Very high	84.9	Confident	7 Å²	7	28.1 Å²	28.1	3%	0.027	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	137.1	178.4	-66.1	100.2	0	0	0	111.7	F2170 S2171 S2172 Q2173 I2209 I2214 C2242 F2249 C2259	F2170-W2211 AromaticContact CD2-CD1 3.53Å; F2170-W2211 AromaticContact CD2-NE1 3.07Å; F2170-W2211 AromaticContact CE2-CE2 3.94Å; F2170-W2211 HydrophobicContact CE2-CZ2 4.22Å; F2170-W2211 AromaticContact CE2-NE1 3.31Å; F2170-W2211 VanDerWaalsContact CE2-NE1 3.31Å; F2170-W2211 AromaticContact CG-NE1 3.87Å; S2171-W2211 PolarHBondContact O-N 2.84Å; S2172-W2211 CarbonylContact C-O 3.58Å; S2172-W2211 VanDerWaalsContact CA-O 3.26Å; S2172-W2211 WeakPolarHBondContact CA-O 3.3Å; S2172-W2211 PolarHBondContact OG-O 2.65Å; Q2173-W2211 PolarHBondContact N-O 2.9Å; I2209-W2211 HydrophobicContact CB-CZ2 4.31Å; I2209-W2211 HydrophobicContact CD1-CZ2 3.77Å; I2209-W2211 HydrophobicContact CG2-CD2 3.73Å; I2209-W2211 VanDerWaalsContact CG2-CE2 3.42Å; I2209-W2211 HydrophobicContact CG2-CE3 4.29Å; I2209-W2211 HydrophobicContact CG2-CG 4.06Å; I2209-W2211 HydrophobicContact CG2-CH2 4.3Å; I2209-W2211 HydrophobicContact CG2-CZ2 3.77Å; I2209-W2211 PolarHBondContact O-N 3.42Å; W2211-I2214 HydrophobicContact CB-CD1 3.88Å; W2211-I2214 HydrophobicContact CB-CG1 4.22Å; W2211-I2214 HydrophobicContact CD2-CD1 4.16Å; W2211-I2214 HydrophobicContact CG-CD1 3.88Å; W2211-C2242 HydrophobicContact CH2-CB 3.95Å; W2211-C2242 WeakPolarHBondContact CH2-O 3.29Å; W2211-C2242 HydrophobicContact CZ3-CB 3.81Å; W2211-F2249 HydrophobicContact CH2-CE2 4.4Å; W2211-C2259 WeakPolarHBondContact CA-O 3.27Å; W2211-C2259 HydrophobicContact CE3-CB 3.77Å; W2211-C2259 HydrophobicContact CH2-CB 4.43Å; W2211-C2259 HydrophobicContact CZ3-CB 3.71Å; W2211-C2259 VanDerWaalsContact CZ3-SG 3.54Å
2212	G	87.4	Confident	84.1	Confident	12 Å²	12	28.5 Å²	28.5	12%	0.124	16%	0.158	C	C	.	.			trans	-72	-153.5	161	0	0	0	0	0	112	I2214 C2259	G2212-I2214 PolarHBondContact O-N 3.27Å; G2212-C2259 PolarHBondContact N-O 3.23Å
2213	A	82.7	Confident	83.1	Confident	7 Å²	7	32.9 Å²	32.9	6%	0.058	17%	0.173	C	C	.	.			trans	-57.7	132.8	172.4	0	0	0	0	0	111.3	I2220 V2231 T2234 A2236 Q2237	A2213-I2220 HydrophobicContact CB-CD1 3.43Å; A2213-I2220 VanDerWaalsContact CB-CD1 3.43Å; A2213-V2231 HydrophobicContact CB-CB 4.28Å; A2213-T2234 WeakPolarHBondContact CB-OG1 3.22Å; A2213-T2234 PolarHBondContact N-OG1 3.45Å; A2213-T2234 VanDerWaalsContact N-OG1 3.08Å; A2213-A2236 HydrophobicContact CB-CB 4.4Å; A2213-Q2237 WeakPolarHBondContact O-CB 3.45Å; A2213-Q2237 PolarHBondContact O-N 3.32Å
2214	I	85.4	Confident	81.8	Confident	30 Å²	30	28.1 Å²	28.1	15%	0.154	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	-114.3	126.4	174.9	-59.6	-179.7	0	0	0	108.6	L2046 W2211 G2212 I2239	L2046-I2214 HydrophobicContact CD2-CD1 3.67Å; W2211-I2214 HydrophobicContact CB-CD1 3.88Å; W2211-I2214 HydrophobicContact CB-CG1 4.22Å; W2211-I2214 HydrophobicContact CD2-CD1 4.16Å; W2211-I2214 HydrophobicContact CG-CD1 3.88Å; G2212-I2214 PolarHBondContact O-N 3.27Å; I2214-I2239 HydrophobicContact CG2-CD1 4.03Å
2215	G	80.5	Confident	80.5	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.153	C	C	.	.			trans	-97.7	-173.3	-178.5	0	0	0	0	0	114.2	V2217 N2227 Q2237 I2239	G2215-V2217 PolarHBondContact O-N 3.33Å; G2215-N2227 VanDerWaalsContact CA-OD1 3.27Å; G2215-N2227 WeakPolarHBondContact CA-OD1 3.41Å; G2215-Q2237 PolarHBondContact N-O 3.35Å; G2215-I2239 WeakPolarHBondContact O-CG1 3.34Å
2216	D	78.9	Confident	79.3	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.005	16%	0.163	C	C	.	.	S	Bend	trans	59.5	-39.3	-175.7	-53.8	-55.9	0	0	0	115.9	L1120 L1121 N2227 R2238 I2239	L1120-D2216 HydrophobicContact CG-CB 4.49Å; L1121-D2216 HydrophobicContact CD2-CB 3.78Å; L1121-D2216 HydrophobicContact CG-CB 4.35Å; D2216-N2227 PolarHBondContact N-OD1 3.34Å; D2216-N2227 PolarHBondContact OD1-ND2 3.01Å; D2216-R2238 VanDerWaalsContact CG-NE 3.34Å; D2216-R2238 IonicContact OD1-CZ 3.98Å; D2216-R2238 IonicContact OD1-NE 3.53Å; D2216-R2238 PolarHBondContact OD1-NE 2.88Å; D2216-R2238 IonicContact OD1-NH2 2.8Å; D2216-R2238 PolarHBondContact OD1-NH2 2.87Å; D2216-R2238 VanDerWaalsContact OD2-CA 3.23Å; D2216-R2238 WeakPolarHBondContact OD2-CA 3.4Å; D2216-R2238 WeakPolarHBondContact OD2-CB 3.45Å; D2216-R2238 IonicContact OD2-NE 2.94Å; D2216-R2238 PolarHBondContact OD2-NE 3.06Å; D2216-I2239 HydrophobicContact CB-CB 4.39Å; D2216-I2239 HydrophobicContact CB-CG1 3.98Å; D2216-I2239 PolarHBondContact OD2-N 3.29Å
2217	V	80.4	Confident	78.1	Confident	3 Å²	3	30.8 Å²	30.8	2%	0.018	17%	0.169	C	C	.	.	S	Bend	trans	-146.7	157.4	-177.5	-61.4	0	0	0	0	112.8	K1117 L1121 G2045 E2049 G2215 I2239	K1117-V2217 HydrophobicContact CD-CG1 4.01Å; K1117-V2217 HydrophobicContact CG-CG1 3.96Å; L1121-V2217 HydrophobicContact CD1-CG1 3.81Å; L1121-V2217 HydrophobicContact CD2-CG1 4.03Å; L1121-V2217 HydrophobicContact CG-CG1 4.12Å; G2045-V2217 VanDerWaalsContact C-CG2 3.48Å; E2049-V2217 HydrophobicContact CG-CG1 4.47Å; E2049-V2217 HydrophobicContact CG-CG2 4.17Å; G2215-V2217 PolarHBondContact O-N 3.33Å; V2217-I2239 HydrophobicContact CG2-CD1 3.65Å; V2217-I2239 HydrophobicContact CG2-CG1 3.76Å
2218	G	71.5	Confident	76.6	Confident	15 Å²	15	35.6 Å²	35.6	16%	0.155	20%	0.199	C	C	.	.	S	Bend	trans	84.6	-160.7	-179.2	0	0	0	0	0	112.6	I2220 V2221 E2222	G2218-I2220 PolarHBondContact O-N 3.05Å; G2218-V2221 PolarHBondContact O-N 2.88Å; G2218-E2222 VanDerWaalsContact O-CB 3.28Å; G2218-E2222 WeakPolarHBondContact O-CB 3.5Å; G2218-E2222 VanDerWaalsContact O-CG 3.31Å; G2218-E2222 WeakPolarHBondContact O-CG 3.37Å; G2218-E2222 PolarHBondContact O-N 2.82Å
2219	I	73.1	Confident	75.1	Confident	66 Å²	66	36.7 Å²	36.7	34%	0.338	21%	0.205	S	C	.	.	H	α-helix	trans	-63.5	-30.1	-156.4	-82.3	154.9	0	0	0	115.1	M2123 L2125 K2223	M2123-I2219 HydrophobicContact CE-CD1 3.77Å; L2125-I2219 HydrophobicContact CD1-CD1 3.86Å; L2125-I2219 HydrophobicContact CD1-CG2 4.36Å; L2125-I2219 HydrophobicContact CG-CD1 4.46Å; I2219-K2223 HydrophobicContact CG2-CD 4.45Å; I2219-K2223 VanDerWaalsContact O-CB 3.31Å; I2219-K2223 WeakPolarHBondContact O-CB 3.26Å; I2219-K2223 PolarHBondContact O-N 2.95Å
2220	I	69.9	Low	73.8	Confident	15 Å²	15	38.1 Å²	38.1	8%	0.077	21%	0.213	C	C	.	.	I	π-helix	trans	-67.6	-55.1	178.9	-59.5	-174.6	0	0	0	110.3	A2213 G2218 E2222 K2223 L2224 G2225 T2229 V2231	A2213-I2220 HydrophobicContact CB-CD1 3.43Å; A2213-I2220 VanDerWaalsContact CB-CD1 3.43Å; G2218-I2220 PolarHBondContact O-N 3.05Å; I2220-E2222 PolarHBondContact O-N 2.87Å; I2220-K2223 PolarHBondContact O-N 2.95Å; I2220-L2224 HydrophobicContact CG1-CD1 4.1Å; I2220-L2224 HydrophobicContact CG2-CB 4.25Å; I2220-L2224 PolarHBondContact O-N 3.06Å; I2220-G2225 PolarHBondContact O-N 3.27Å; I2220-T2229 HydrophobicContact CG2-CG2 4.39Å; I2220-V2231 HydrophobicContact CD1-CG2 4.08Å
2221	V	68	Low	72.5	Confident	39 Å²	39	39.4 Å²	39.4	24%	0.236	22%	0.221	C	C	.	.	I	π-helix	trans	-71.6	-16.8	179.6	-170.7	0	0	0	0	112.7	L1120 G2218	L1120-V2221 HydrophobicContact CD2-CG1 4.46Å; G2218-V2221 PolarHBondContact O-N 2.88Å
2222	E	69.1	Low	71.4	Confident	101 Å²	101	40 Å²	40	47%	0.472	23%	0.228	S	C	.	.	I	π-helix	trans	-99	-8.5	178.4	-68.8	172.6	-171.9	0	0	114.6	K1117 G2218 I2220	K1117-E2222 IonicContact NZ-OE1 2.69Å; K1117-E2222 PolarHBondContact NZ-OE1 3.03Å; G2218-E2222 VanDerWaalsContact O-CB 3.28Å; G2218-E2222 WeakPolarHBondContact O-CB 3.5Å; G2218-E2222 VanDerWaalsContact O-CG 3.31Å; G2218-E2222 WeakPolarHBondContact O-CG 3.37Å; G2218-E2222 PolarHBondContact O-N 2.82Å; I2220-E2222 PolarHBondContact O-N 2.87Å
2223	K	66.1	Low	70.6	Confident	168 Å²	168	39.5 Å²	39.5	73%	0.73	22%	0.224	S	C	*	.	I	π-helix	trans	-145.6	-34.2	-178.4	-68.1	-169.2	161.6	-156	0	117.1	I2219 I2220	I2219-K2223 HydrophobicContact CG2-CD 4.45Å; I2219-K2223 VanDerWaalsContact O-CB 3.31Å; I2219-K2223 WeakPolarHBondContact O-CB 3.26Å; I2219-K2223 PolarHBondContact O-N 2.95Å; I2220-K2223 PolarHBondContact O-N 2.95Å
2224	L	58.5	Low	70.3	Confident	39 Å²	39	39.3 Å²	39.3	20%	0.204	22%	0.222	C	C	.	.	I	π-helix	trans	-98	-42.7	-171	-79.7	158	0	0	0	112.6	I2220 T2229 V2231 L2307	I2220-L2224 HydrophobicContact CG1-CD1 4.1Å; I2220-L2224 HydrophobicContact CG2-CB 4.25Å; I2220-L2224 PolarHBondContact O-N 3.06Å; L2224-T2229 HydrophobicContact CB-CG2 4.36Å; L2224-V2231 HydrophobicContact CD1-CG2 4.21Å; L2224-L2307 HydrophobicContact CD1-CD2 3.97Å; L2224-L2307 HydrophobicContact CD2-CB 4.2Å; L2224-L2307 HydrophobicContact CD2-CD2 3.94Å; L2224-L2307 HydrophobicContact CG-CD2 4.25Å
2225	G	63.4	Low	69.9	Low	38 Å²	38	40.7 Å²	40.7	39%	0.392	23%	0.228	S	C	.	.			trans	171.5	-120.3	-175.8	0	0	0	0	0	112.6	I2220	I2220-G2225 PolarHBondContact O-N 3.27Å
2226	D	66.3	Low	69.8	Low	76 Å²	76	40.8 Å²	40.8	41%	0.406	23%	0.229	S	C	.	.			trans	-132.5	-157	-179.8	69.6	30.2	0	0	0	112.2	T2228 T2229	D2226-T2228 VanDerWaalsContact C-N 3.3Å; D2226-T2228 WeakPolarHBondContact OD1-CB 3.46Å; D2226-T2228 PolarHBondContact OD1-N 3.05Å; D2226-T2228 PolarHBondContact OD1-OG1 2.75Å; D2226-T2229 PolarHBondContact N-OG1 3Å; D2226-T2229 VanDerWaalsContact N-OG1 3.13Å; D2226-T2229 PolarHBondContact O-OG1 2.86Å
2227	N	67.9	Low	70.1	Confident	26 Å²	26	40.8 Å²	40.8	14%	0.139	23%	0.228	C	C	.	.	S	Bend	trans	-78.8	-10.1	-178.3	-73.8	-27.9	0	0	0	114.2	G2215 D2216 R2238	G2215-N2227 VanDerWaalsContact CA-OD1 3.27Å; G2215-N2227 WeakPolarHBondContact CA-OD1 3.41Å; D2216-N2227 PolarHBondContact N-OD1 3.34Å; D2216-N2227 PolarHBondContact OD1-ND2 3.01Å; N2227-R2238 VanDerWaalsContact ND2-CZ 3.29Å; N2227-R2238 PolarHBondContact ND2-NE 3.03Å; N2227-R2238 PolarHBondContact ND2-NH2 2.94Å
2228	T	64.8	Low	70.2	Confident	102 Å²	102	42.7 Å²	42.7	63%	0.626	24%	0.235	S	C	*	.	S	Bend	trans	-86.4	-25.6	176.3	67.9	0	0	0	0	112.2	D2226 I2230	D2226-T2228 VanDerWaalsContact C-N 3.3Å; D2226-T2228 WeakPolarHBondContact OD1-CB 3.46Å; D2226-T2228 PolarHBondContact OD1-N 3.05Å; D2226-T2228 PolarHBondContact OD1-OG1 2.75Å; T2228-I2230 PolarHBondContact O-N 3.18Å
2229	T	63.6	Low	70.9	Confident	22 Å²	22	42.1 Å²	42.1	14%	0.135	23%	0.229	C	C	.	.			trans	-49.6	127.5	177.7	-55.1	0	0	0	0	111.9	I2220 L2224 D2226 V2231 E2311	I2220-T2229 HydrophobicContact CG2-CG2 4.39Å; L2224-T2229 HydrophobicContact CB-CG2 4.36Å; D2226-T2229 PolarHBondContact N-OG1 3Å; D2226-T2229 VanDerWaalsContact N-OG1 3.13Å; D2226-T2229 PolarHBondContact O-OG1 2.86Å; T2229-V2231 HydrophobicContact CG2-CG2 3.96Å; T2229-E2311 WeakPolarHBondContact CG2-OE1 3.41Å
2230	I	65.9	Low	71.2	Confident	30 Å²	30	41.8 Å²	41.8	15%	0.154	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	116.4	-177.7	-62.6	165.6	0	0	0	109.1	T2228 T2234 H2235 A2263	T2228-I2230 PolarHBondContact O-N 3.18Å; I2230-T2234 CarbonylContact C-O 3.51Å; I2230-T2234 WeakPolarHBondContact CA-O 3.41Å; I2230-H2235 WeakPolarHBondContact CG1-ND1 3.29Å; I2230-A2263 HydrophobicContact CD1-CB 4.11Å; I2230-A2263 HydrophobicContact CG1-CB 4.37Å; I2230-A2263 HydrophobicContact CG2-CB 3.8Å
2231	V	68.2	Low	71.8	Confident	31 Å²	31	42.2 Å²	42.2	19%	0.188	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	129.5	-176.9	-170.4	0	0	0	0	109.7	A2213 I2220 L2224 T2229 G2233 T2234	A2213-V2231 HydrophobicContact CB-CB 4.28Å; I2220-V2231 HydrophobicContact CD1-CG2 4.08Å; L2224-V2231 HydrophobicContact CD1-CG2 4.21Å; T2229-V2231 HydrophobicContact CG2-CG2 3.96Å; V2231-G2233 VanDerWaalsContact C-N 3.27Å; V2231-G2233 PolarHBondContact O-N 3.48Å; V2231-T2234 PolarHBondContact N-O 2.8Å; V2231-T2234 WeakPolarHBondContact O-CA 3.31Å; V2231-T2234 WeakPolarHBondContact O-CB 3.35Å; V2231-T2234 PolarHBondContact O-N 3.35Å; V2231-T2234 VanDerWaalsContact O-O 3.13Å; V2231-T2234 PolarHBondContact O-OG1 3.17Å
2232	G	67.5	Low	72.7	Confident	18 Å²	18	40.5 Å²	40.5	19%	0.186	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.4	23.6	-176.3	0	0	0	0	0	114.2	T2234	G2232-T2234 PolarHBondContact O-N 3.04Å
2233	G	69.9	Low	73.6	Confident	3 Å²	3	36.5 Å²	36.5	3%	0.031	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	15.1	-167.1	0	0	0	0	0	113.7	V2231 A2263	V2231-G2233 VanDerWaalsContact C-N 3.27Å; V2231-G2233 PolarHBondContact O-N 3.48Å; G2233-A2263 WeakPolarHBondContact O-CB 3.49Å; G2233-A2263 PolarHBondContact O-N 3.15Å
2234	T	78.1	Confident	74.4	Confident	2 Å²	2	33.7 Å²	33.7	1%	0.012	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	138.2	-177.4	74.3	0	0	0	0	112	P1404 A2213 I2230 V2231 G2232 F2260 I2261	P1404-T2234 HydrophobicContact CB-CG2 3.78Å; P1404-T2234 HydrophobicContact CG-CG2 4.25Å; A2213-T2234 WeakPolarHBondContact CB-OG1 3.22Å; A2213-T2234 PolarHBondContact N-OG1 3.45Å; A2213-T2234 VanDerWaalsContact N-OG1 3.08Å; I2230-T2234 CarbonylContact C-O 3.51Å; I2230-T2234 WeakPolarHBondContact CA-O 3.41Å; V2231-T2234 PolarHBondContact N-O 2.8Å; V2231-T2234 WeakPolarHBondContact O-CA 3.31Å; V2231-T2234 WeakPolarHBondContact O-CB 3.35Å; V2231-T2234 PolarHBondContact O-N 3.35Å; V2231-T2234 VanDerWaalsContact O-O 3.13Å; V2231-T2234 PolarHBondContact O-OG1 3.17Å; G2232-T2234 PolarHBondContact O-N 3.04Å; T2234-F2260 HydrophobicContact CG2-CB 3.86Å; T2234-F2260 HydrophobicContact CG2-CD2 3.68Å; T2234-F2260 HydrophobicContact CG2-CG 4.11Å; T2234-I2261 CarbonylContact C-O 3.55Å; T2234-I2261 WeakPolarHBondContact CA-O 3.48Å; T2234-I2261 WeakPolarHBondContact CB-O 3.21Å
2235	H	76.5	Confident	75.7	Confident	59 Å²	59	32.2 Å²	32.2	27%	0.273	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	149.7	168.9	-74.8	-72.9	0	0	0	110.4	I2230 Q2237 I2261	I2230-H2235 WeakPolarHBondContact CG1-ND1 3.29Å; H2235-Q2237 PolarHBondContact O-N 3.43Å; H2235-I2261 HydrophobicContact CB-CB 4.24Å; H2235-I2261 HydrophobicContact CB-CG2 3.89Å; H2235-I2261 PolarHBondContact N-O 3.21Å
2236	A	79.1	Confident	77	Confident	3 Å²	3	30.6 Å²	30.6	3%	0.025	17%	0.172	C	C	.	.			trans	-59	106.9	175.6	0	0	0	0	0	112.1	A2213 R2238	A2213-A2236 HydrophobicContact CB-CB 4.4Å; A2236-R2238 PolarHBondContact O-N 2.97Å; A2236-R2238 VanDerWaalsContact O-N 3.15Å
2237	Q	84.9	Confident	78	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-67.9	113.5	178.8	-170.4	179.1	8.3	0	0	110.2	A2213 G2215 H2235 S2241 C2242 C2259 I2261	A2213-Q2237 WeakPolarHBondContact O-CB 3.45Å; A2213-Q2237 PolarHBondContact O-N 3.32Å; G2215-Q2237 PolarHBondContact N-O 3.35Å; H2235-Q2237 PolarHBondContact O-N 3.43Å; Q2237-S2241 PolarHBondContact NE2-OG 2.89Å; Q2237-C2242 VanDerWaalsContact CD-SG 3.56Å; Q2237-C2242 WeakPolarHBondContact CG-SG 3.45Å; Q2237-C2242 PolarHBondContact O-SG 3.49Å; Q2237-C2242 VanDerWaalsContact O-SG 3.4Å; Q2237-C2259 PolarHBondContact OE1-SG 3.5Å; Q2237-I2261 HydrophobicContact CB-CD1 3.89Å; Q2237-I2261 HydrophobicContact CB-CG1 4.2Å; Q2237-I2261 HydrophobicContact CG-CD1 3.89Å; Q2237-I2261 HydrophobicContact CG-CG1 4.14Å
2238	R	82.7	Confident	78.7	Confident	43 Å²	43	27.7 Å²	27.7	16%	0.162	16%	0.158	C	C	.	.			trans	-56.2	140.7	178.8	-52	-60.6	-64.4	-88.4	2.3	110.5	E1125 D2216 N2227 A2236 P2240 S2241 C2242	E1125-R2238 IonicContact OE1-CZ 3.64Å; E1125-R2238 IonicContact OE1-NH1 2.76Å; E1125-R2238 PolarHBondContact OE1-NH1 3.44Å; E1125-R2238 IonicContact OE1-NH2 3.52Å; E1125-R2238 PolarHBondContact OE1-NH2 3.2Å; E1125-R2238 IonicContact OE2-NH1 3.24Å; D2216-R2238 VanDerWaalsContact CG-NE 3.34Å; D2216-R2238 IonicContact OD1-CZ 3.98Å; D2216-R2238 IonicContact OD1-NE 3.53Å; D2216-R2238 PolarHBondContact OD1-NE 2.88Å; D2216-R2238 IonicContact OD1-NH2 2.8Å; D2216-R2238 PolarHBondContact OD1-NH2 2.87Å; D2216-R2238 VanDerWaalsContact OD2-CA 3.23Å; D2216-R2238 WeakPolarHBondContact OD2-CA 3.4Å; D2216-R2238 WeakPolarHBondContact OD2-CB 3.45Å; D2216-R2238 IonicContact OD2-NE 2.94Å; D2216-R2238 PolarHBondContact OD2-NE 3.06Å; N2227-R2238 VanDerWaalsContact ND2-CZ 3.29Å; N2227-R2238 PolarHBondContact ND2-NE 3.03Å; N2227-R2238 PolarHBondContact ND2-NH2 2.94Å; A2236-R2238 PolarHBondContact O-N 2.97Å; A2236-R2238 VanDerWaalsContact O-N 3.15Å; R2238-P2240 VanDerWaalsContact C-CD 3.5Å; R2238-S2241 WeakPolarHBondContact O-CA 3.47Å; R2238-S2241 VanDerWaalsContact O-CB 3.27Å; R2238-S2241 WeakPolarHBondContact O-CB 3.29Å; R2238-S2241 PolarHBondContact O-N 2.93Å; R2238-C2242 PolarHBondContact O-N 3.28Å; R2238-C2242 VanDerWaalsContact O-N 3.1Å
2239	I	85.7	Confident	79.8	Confident	4 Å²	4	22.8 Å²	22.8	2%	0.021	13%	0.128	C	C	.	.	H	α-helix	trans	-52.7	-43	-175	-77.3	-70.8	0	0	0	113.8	L1121 L2046 E2049 I2214 G2215 D2216 V2217 S2241 C2242 L2243	L1121-I2239 HydrophobicContact CD2-CB 4.05Å; L1121-I2239 HydrophobicContact CD2-CG1 4.14Å; L1121-I2239 HydrophobicContact CD2-CG2 4.12Å; L2046-I2239 HydrophobicContact CD1-CD1 3.48Å; L2046-I2239 VanDerWaalsContact CD1-CD1 3.48Å; E2049-I2239 HydrophobicContact CB-CD1 4.49Å; E2049-I2239 HydrophobicContact CB-CG2 3.85Å; E2049-I2239 HydrophobicContact CG-CG2 4.1Å; I2214-I2239 HydrophobicContact CG2-CD1 4.03Å; G2215-I2239 WeakPolarHBondContact O-CG1 3.34Å; D2216-I2239 HydrophobicContact CB-CB 4.39Å; D2216-I2239 HydrophobicContact CB-CG1 3.98Å; D2216-I2239 PolarHBondContact OD2-N 3.29Å; V2217-I2239 HydrophobicContact CG2-CD1 3.65Å; V2217-I2239 HydrophobicContact CG2-CG1 3.76Å; I2239-S2241 PolarHBondContact O-N 2.56Å; I2239-C2242 PolarHBondContact O-N 3.14Å; I2239-L2243 HydrophobicContact CG2-CD1 3.6Å; I2239-L2243 HydrophobicContact CG2-CG 4.19Å; I2239-L2243 WeakPolarHBondContact O-CB 3.33Å; I2239-L2243 WeakPolarHBondContact O-CG 3.01Å; I2239-L2243 PolarHBondContact O-N 3.08Å
2240	P	79.2	Confident	81	Confident	59 Å²	59	22.1 Å²	22.1	38%	0.383	12%	0.124	S	C	.	.	H	α-helix	trans	-57.7	-34.2	175	-26.7	36.1	0	0	0	113.5	R2238 Q2244	R2238-P2240 VanDerWaalsContact C-CD 3.5Å; P2240-Q2244 VanDerWaalsContact O-CB 3.31Å; P2240-Q2244 WeakPolarHBondContact O-CB 2.84Å; P2240-Q2244 PolarHBondContact O-N 2.99Å
2241	S	82.9	Confident	81.7	Confident	24 Å²	24	21.7 Å²	21.7	17%	0.168	12%	0.123	C	C	.	.	H	α-helix	trans	-72.2	-45.3	175.3	-175.4	0	0	0	0	111.5	Q2237 R2238 I2239 L2243 Q2244 S2245	Q2237-S2241 PolarHBondContact NE2-OG 2.89Å; R2238-S2241 WeakPolarHBondContact O-CA 3.47Å; R2238-S2241 VanDerWaalsContact O-CB 3.27Å; R2238-S2241 WeakPolarHBondContact O-CB 3.29Å; R2238-S2241 PolarHBondContact O-N 2.93Å; I2239-S2241 PolarHBondContact O-N 2.56Å; S2241-L2243 VanDerWaalsContact C-N 3.34Å; S2241-L2243 PolarHBondContact O-N 2.85Å; S2241-Q2244 PolarHBondContact O-N 2.98Å; S2241-S2245 PolarHBondContact O-N 3.3Å; S2241-S2245 PolarHBondContact O-OG 2.86Å
2242	C	87.5	Confident	82.2	Confident	3 Å²	3	22.4 Å²	22.4	2%	0.02	12%	0.123	C	C	.	.	H	α-helix	trans	-57.6	-46.2	174.8	-65.1	0	0	0	0	111.8	W2211 Q2237 R2238 I2239 Q2244 S2245 L2246	W2211-C2242 HydrophobicContact CH2-CB 3.95Å; W2211-C2242 WeakPolarHBondContact CH2-O 3.29Å; W2211-C2242 HydrophobicContact CZ3-CB 3.81Å; Q2237-C2242 VanDerWaalsContact CD-SG 3.56Å; Q2237-C2242 WeakPolarHBondContact CG-SG 3.45Å; Q2237-C2242 PolarHBondContact O-SG 3.49Å; Q2237-C2242 VanDerWaalsContact O-SG 3.4Å; R2238-C2242 PolarHBondContact O-N 3.28Å; R2238-C2242 VanDerWaalsContact O-N 3.1Å; I2239-C2242 PolarHBondContact O-N 3.14Å; C2242-Q2244 VanDerWaalsContact C-N 3.32Å; C2242-Q2244 PolarHBondContact O-N 2.92Å; C2242-S2245 PolarHBondContact O-N 3.22Å; C2242-L2246 WeakPolarHBondContact O-CB 3.46Å; C2242-L2246 PolarHBondContact O-N 2.59Å
2243	L	87.7	Confident	82.3	Confident	17 Å²	17	29.5 Å²	29.5	9%	0.089	15%	0.149	C	C	.	.	H	α-helix	trans	-67.7	-31.1	179.2	-67.4	171.4	0	0	0	112.5	L2050 W2053 I2239 S2241 L2246 D2247	L2050-L2243 HydrophobicContact CD1-CD2 4.38Å; W2053-L2243 HydrophobicContact CB-CD1 3.95Å; W2053-L2243 HydrophobicContact CB-CD2 3.95Å; W2053-L2243 HydrophobicContact CD2-CD2 4.13Å; W2053-L2243 HydrophobicContact CG-CB 4.3Å; W2053-L2243 HydrophobicContact CG-CD1 4.05Å; W2053-L2243 HydrophobicContact CG-CD2 3.87Å; W2053-L2243 HydrophobicContact CG-CG 4.3Å; I2239-L2243 HydrophobicContact CG2-CD1 3.6Å; I2239-L2243 HydrophobicContact CG2-CG 4.19Å; I2239-L2243 WeakPolarHBondContact O-CB 3.33Å; I2239-L2243 WeakPolarHBondContact O-CG 3.01Å; I2239-L2243 PolarHBondContact O-N 3.08Å; S2241-L2243 VanDerWaalsContact C-N 3.34Å; S2241-L2243 PolarHBondContact O-N 2.85Å; L2243-L2246 HydrophobicContact CD2-CD2 4.45Å; L2243-D2247 PolarHBondContact O-N 2.92Å; L2243-D2247 VanDerWaalsContact O-N 3.17Å
2244	Q	82.1	Confident	82.8	Confident	108 Å²	108	32 Å²	32	51%	0.505	16%	0.159	S	C	.	.	H	α-helix	trans	-70.4	-43.3	172.3	-173.6	173.8	7.1	0	0	112	P2240 S2241 C2242 L2246 D2247 S2248	P2240-Q2244 VanDerWaalsContact O-CB 3.31Å; P2240-Q2244 WeakPolarHBondContact O-CB 2.84Å; P2240-Q2244 PolarHBondContact O-N 2.99Å; S2241-Q2244 PolarHBondContact O-N 2.98Å; C2242-Q2244 VanDerWaalsContact C-N 3.32Å; C2242-Q2244 PolarHBondContact O-N 2.92Å; Q2244-L2246 VanDerWaalsContact C-N 3.33Å; Q2244-D2247 VanDerWaalsContact O-CB 3.31Å; Q2244-D2247 WeakPolarHBondContact O-CB 3.28Å; Q2244-D2247 PolarHBondContact O-N 3.34Å; Q2244-S2248 PolarHBondContact O-N 3.34Å
2245	S	86.4	Confident	83.2	Confident	9 Å²	9	32.3 Å²	32.3	6%	0.063	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-37.4	173.8	-64.3	0	0	0	0	112.2	S2241 C2242 D2247 S2248 F2249 C2259	S2241-S2245 PolarHBondContact O-N 3.3Å; S2241-S2245 PolarHBondContact O-OG 2.86Å; C2242-S2245 PolarHBondContact O-N 3.22Å; S2245-D2247 VanDerWaalsContact C-N 3.31Å; S2245-D2247 PolarHBondContact O-N 3.41Å; S2245-S2248 WeakPolarHBondContact O-CB 3.28Å; S2245-S2248 PolarHBondContact O-N 3.27Å; S2245-F2249 WeakPolarHBondContact O-CD2 3.33Å; S2245-F2249 WeakPolarHBondContact O-CG 3.35Å; S2245-F2249 PolarHBondContact O-N 2.85Å; S2245-C2259 WeakPolarHBondContact CB-SG 3.41Å; S2245-C2259 PolarHBondContact OG-SG 2.88Å
2246	L	89.4	Confident	84	Confident	4 Å²	4	30 Å²	30	2%	0.021	15%	0.152	C	C	.	.	H	α-helix	trans	-61.5	-36.9	173.8	-178	62.5	0	0	0	112.3	L2050 W2053 V2168 I2209 C2242 L2243 Q2244 S2248 F2249 L2250	L2050-L2246 HydrophobicContact CD1-CD2 3.57Å; W2053-L2246 HydrophobicContact CZ3-CD2 4.36Å; V2168-L2246 HydrophobicContact CG1-CD1 4.43Å; I2209-L2246 HydrophobicContact CD1-CD1 3.59Å; C2242-L2246 WeakPolarHBondContact O-CB 3.46Å; C2242-L2246 PolarHBondContact O-N 2.59Å; L2243-L2246 HydrophobicContact CD2-CD2 4.45Å; Q2244-L2246 VanDerWaalsContact C-N 3.33Å; L2246-S2248 VanDerWaalsContact C-N 3.34Å; L2246-S2248 PolarHBondContact O-N 3.32Å; L2246-F2249 PolarHBondContact O-N 2.9Å; L2246-L2250 HydrophobicContact CD1-CD1 4.2Å; L2246-L2250 HydrophobicContact CD1-CG 4.01Å; L2246-L2250 HydrophobicContact CG-CD1 3.89Å; L2246-L2250 HydrophobicContact CG-CG 4.18Å; L2246-L2250 WeakPolarHBondContact O-CB 3.35Å; L2246-L2250 VanDerWaalsContact O-CG 3.22Å; L2246-L2250 WeakPolarHBondContact O-CG 3.45Å; L2246-L2250 PolarHBondContact O-N 3.14Å
2247	D	87.1	Confident	84.6	Confident	14 Å²	14	30 Å²	30	8%	0.075	15%	0.152	C	C	.	.	H	α-helix	trans	-58.3	-45.4	174.5	-155.6	14.2	0	0	0	111.6	R2028 S2029 W2053 R2057 L2243 Q2244 S2245 S2251	R2028-D2247 IonicContact NH1-OD2 2.75Å; S2029-D2247 VanDerWaalsContact CB-OD1 3.31Å; S2029-D2247 WeakPolarHBondContact CB-OD1 3.26Å; S2029-D2247 PolarHBondContact N-OD1 2.71Å; S2029-D2247 PolarHBondContact OG-OD1 3.27Å; W2053-D2247 HydrophobicContact CZ2-CB 4.02Å; R2057-D2247 IonicContact CZ-OD1 3.23Å; R2057-D2247 IonicContact CZ-OD2 2.78Å; R2057-D2247 VanDerWaalsContact CZ-OD2 3.32Å; R2057-D2247 IonicContact NH1-OD1 3.3Å; R2057-D2247 PolarHBondContact NH1-OD1 3.41Å; R2057-D2247 IonicContact NH1-OD2 3.82Å; R2057-D2247 PolarHBondContact NH1-OD2 3.36Å; R2057-D2247 IonicContact NH2-OD1 3.15Å; R2057-D2247 IonicContact NH2-OD2 3.66Å; R2057-D2247 PolarHBondContact NH2-OD2 3.13Å; L2243-D2247 PolarHBondContact O-N 2.92Å; L2243-D2247 VanDerWaalsContact O-N 3.17Å; Q2244-D2247 VanDerWaalsContact O-CB 3.31Å; Q2244-D2247 WeakPolarHBondContact O-CB 3.28Å; Q2244-D2247 PolarHBondContact O-N 3.34Å; S2245-D2247 VanDerWaalsContact C-N 3.31Å; S2245-D2247 PolarHBondContact O-N 3.41Å; D2247-S2251 PolarHBondContact O-N 3.02Å
2248	S	83.8	Confident	85	Confident	26 Å²	26	30 Å²	30	18%	0.182	15%	0.152	C	C	.	.	H	α-helix	trans	-61.4	-51.3	173.4	-72.4	0	0	0	0	111.6	T1673 Q2244 S2245 L2246 L2250 S2251 W2252	T1673-S2248 PolarHBondContact O-OG 3.17Å; Q2244-S2248 PolarHBondContact O-N 3.34Å; S2245-S2248 WeakPolarHBondContact O-CB 3.28Å; S2245-S2248 PolarHBondContact O-N 3.27Å; L2246-S2248 VanDerWaalsContact C-N 3.34Å; L2246-S2248 PolarHBondContact O-N 3.32Å; S2248-L2250 VanDerWaalsContact C-N 3.32Å; S2248-L2250 PolarHBondContact O-N 2.91Å; S2248-S2251 WeakPolarHBondContact O-CB 3.39Å; S2248-S2251 PolarHBondContact O-N 2.96Å; S2248-S2251 PolarHBondContact O-OG 3Å; S2248-W2252 PolarHBondContact O-N 3.42Å
2249	F	87.8	Confident	85.4	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.9	-39.5	179.9	-61	-49.3	0	0	0	112.8	L1238 I2207 I2209 W2211 S2245 L2246 S2251 W2252 F2257 C2259	L1238-F2249 HydrophobicContact CD2-CE1 4.46Å; L1238-F2249 HydrophobicContact CD2-CZ 3.79Å; I2207-F2249 WeakPolarHBondContact CD1-O 3.22Å; I2207-F2249 HydrophobicContact CG2-CB 4.44Å; I2209-F2249 HydrophobicContact CD1-CB 4.18Å; I2209-F2249 HydrophobicContact CD1-CD2 3.5Å; I2209-F2249 VanDerWaalsContact CD1-CD2 3.5Å; I2209-F2249 HydrophobicContact CD1-CE2 4.19Å; I2209-F2249 HydrophobicContact CD1-CG 4.12Å; I2209-F2249 HydrophobicContact CG1-CB 4.48Å; I2209-F2249 HydrophobicContact CG1-CD2 3.76Å; I2209-F2249 HydrophobicContact CG1-CE2 4.19Å; I2209-F2249 HydrophobicContact CG1-CG 4.18Å; I2209-F2249 HydrophobicContact CG2-CD2 4.16Å; I2209-F2249 HydrophobicContact CG2-CE2 3.72Å; I2209-F2249 HydrophobicContact CG2-CZ 4.33Å; W2211-F2249 HydrophobicContact CH2-CE2 4.4Å; S2245-F2249 WeakPolarHBondContact O-CD2 3.33Å; S2245-F2249 WeakPolarHBondContact O-CG 3.35Å; S2245-F2249 PolarHBondContact O-N 2.85Å; L2246-F2249 PolarHBondContact O-N 2.9Å; F2249-S2251 PolarHBondContact O-N 2.88Å; F2249-W2252 AromaticContact CD1-CE3 3.73Å; F2249-W2252 HydrophobicContact CD1-CE3 3.73Å; F2249-W2252 HydrophobicContact CD1-CH2 4.1Å; F2249-W2252 AromaticContact CD1-CZ3 3.38Å; F2249-W2252 HydrophobicContact CD1-CZ3 3.38Å; F2249-W2252 HydrophobicContact CE1-CE3 4.3Å; F2249-W2252 HydrophobicContact CE1-CH2 4.07Å; F2249-W2252 AromaticContact CE1-CZ3 3.51Å; F2249-W2252 HydrophobicContact CE1-CZ3 3.51Å; F2249-W2252 PolarHBondContact O-N 3.31Å; F2249-F2257 HydrophobicContact CD1-CB 3.8Å; F2249-F2257 HydrophobicContact CD1-CD1 4.23Å; F2249-F2257 AromaticContact CD1-CD2 3.7Å; F2249-F2257 HydrophobicContact CD1-CD2 3.7Å; F2249-F2257 HydrophobicContact CD1-CE2 4.35Å; F2249-F2257 AromaticContact CD1-CG 3.63Å; F2249-F2257 HydrophobicContact CD1-CG 3.63Å; F2249-F2257 HydrophobicContact CE1-CB 3.42Å; F2249-F2257 VanDerWaalsContact CE1-CB 3.42Å; F2249-F2257 HydrophobicContact CE1-CD1 4.2Å; F2249-F2257 HydrophobicContact CE1-CD2 4.23Å; F2249-F2257 AromaticContact CE1-CG 3.7Å; F2249-F2257 HydrophobicContact CE1-CG 3.7Å; F2249-F2257 HydrophobicContact CG-CD2 4.33Å; F2249-F2257 HydrophobicContact CZ-CB 3.99Å; F2249-C2259 HydrophobicContact CE2-CB 3.75Å; F2249-C2259 HydrophobicContact CZ-CB 3.77Å
2250	L	88.1	Confident	85.5	Confident	8 Å²	8	27.8 Å²	27.8	4%	0.042	14%	0.143	C	C	.	.	H	α-helix	trans	-67.5	-14.9	176.6	-72.1	174.6	0	0	0	114	W2053 F2119 W2166 V2168 I2207 L2246 S2248	W2053-L2250 HydrophobicContact CH2-CD1 3.82Å; W2053-L2250 HydrophobicContact CZ3-CD1 3.96Å; F2119-L2250 HydrophobicContact CE1-CD1 4.42Å; F2119-L2250 HydrophobicContact CE1-CD2 4.19Å; F2119-L2250 HydrophobicContact CZ-CD2 4.49Å; W2166-L2250 HydrophobicContact CB-CD2 4.24Å; W2166-L2250 HydrophobicContact CD2-CD2 4.02Å; W2166-L2250 HydrophobicContact CG-CD2 3.72Å; W2166-L2250 HydrophobicContact CZ2-CB 4.5Å; W2166-L2250 PolarHBondContact NE1-O 2.95Å; W2166-L2250 VanDerWaalsContact NE1-O 3.17Å; V2168-L2250 HydrophobicContact CG2-CD2 3.7Å; I2207-L2250 HydrophobicContact CD1-CD2 4.23Å; L2246-L2250 HydrophobicContact CD1-CD1 4.2Å; L2246-L2250 HydrophobicContact CD1-CG 4.01Å; L2246-L2250 HydrophobicContact CG-CD1 3.89Å; L2246-L2250 HydrophobicContact CG-CG 4.18Å; L2246-L2250 WeakPolarHBondContact O-CB 3.35Å; L2246-L2250 VanDerWaalsContact O-CG 3.22Å; L2246-L2250 WeakPolarHBondContact O-CG 3.45Å; L2246-L2250 PolarHBondContact O-N 3.14Å; S2248-L2250 VanDerWaalsContact C-N 3.32Å; S2248-L2250 PolarHBondContact O-N 2.91Å
2251	S	81.9	Confident	85.7	Confident	21 Å²	21	25.4 Å²	25.4	15%	0.147	13%	0.127	C	C	.	.	H	α-helix	trans	-85.7	-32.8	173.7	78.5	0	0	0	0	113.3	C1675 T2027 D2247 S2248 F2249 K2253	C1675-S2251 WeakPolarHBondContact CB-OG 3.46Å; T2027-S2251 WeakPolarHBondContact OG1-CB 3.44Å; T2027-S2251 PolarHBondContact OG1-OG 2.8Å; D2247-S2251 PolarHBondContact O-N 3.02Å; S2248-S2251 WeakPolarHBondContact O-CB 3.39Å; S2248-S2251 PolarHBondContact O-N 2.96Å; S2248-S2251 PolarHBondContact O-OG 3Å; F2249-S2251 PolarHBondContact O-N 2.88Å; S2251-K2253 PolarHBondContact O-N 2.87Å
2252	W	79.1	Confident	85.4	Confident	45 Å²	45	27.9 Å²	27.9	17%	0.17	13%	0.133	C	C	.	.	S	Bend	trans	-76.6	8.1	-173.9	-54.9	-20.5	0	0	0	114.5	L1238 L1668 S2248 F2249 Q2254 F2257	L1238-W2252 HydrophobicContact CD1-CH2 4.47Å; L1668-W2252 HydrophobicContact CD1-CH2 3.75Å; L1668-W2252 HydrophobicContact CD1-CZ3 3.48Å; L1668-W2252 VanDerWaalsContact CD1-CZ3 3.48Å; S2248-W2252 PolarHBondContact O-N 3.42Å; F2249-W2252 AromaticContact CD1-CE3 3.73Å; F2249-W2252 HydrophobicContact CD1-CE3 3.73Å; F2249-W2252 HydrophobicContact CD1-CH2 4.1Å; F2249-W2252 AromaticContact CD1-CZ3 3.38Å; F2249-W2252 HydrophobicContact CD1-CZ3 3.38Å; F2249-W2252 HydrophobicContact CE1-CE3 4.3Å; F2249-W2252 HydrophobicContact CE1-CH2 4.07Å; F2249-W2252 AromaticContact CE1-CZ3 3.51Å; F2249-W2252 HydrophobicContact CE1-CZ3 3.51Å; F2249-W2252 PolarHBondContact O-N 3.31Å; W2252-Q2254 PolarHBondContact O-N 3.38Å; W2252-F2257 HydrophobicContact CB-CZ 4.33Å; W2252-F2257 AromaticContact CE3-CD1 3.98Å; W2252-F2257 HydrophobicContact CE3-CD1 3.98Å; W2252-F2257 AromaticContact CE3-CE1 3.55Å; W2252-F2257 HydrophobicContact CE3-CE1 3.55Å; W2252-F2257 HydrophobicContact CE3-CE2 4.31Å; W2252-F2257 AromaticContact CE3-CZ 3.74Å; W2252-F2257 HydrophobicContact CE3-CZ 3.74Å; W2252-F2257 AromaticContact CZ3-CD1 3.96Å; W2252-F2257 HydrophobicContact CZ3-CD1 3.96Å; W2252-F2257 AromaticContact CZ3-CE1 3.97Å; W2252-F2257 HydrophobicContact CZ3-CE1 3.97Å
2253	K	68.1	Low	84.5	Confident	168 Å²	168	27.9 Å²	27.9	73%	0.73	13%	0.133	S	C	*	.			trans	65.2	-55.3	177.8	-56.5	178	-177.8	173.5	0	115.6	S2251	S2251-K2253 PolarHBondContact O-N 2.87Å
2254	Q	81	Confident	83.1	Confident	55 Å²	55	34.1 Å²	34.1	26%	0.257	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	145	-169.6	-70.6	179	17.5	0	0	111.6	I2200 N2203 L2204 G2206 W2252	I2200-Q2254 HydrophobicContact CG1-CB 4.12Å; I2200-Q2254 HydrophobicContact CG1-CG 4.45Å; I2200-Q2254 HydrophobicContact CG2-CB 4.36Å; N2203-Q2254 PolarHBondContact O-NE2 2.74Å; L2204-Q2254 PolarHBondContact O-NE2 3.14Å; G2206-Q2254 VanDerWaalsContact O-CA 3.3Å; G2206-Q2254 WeakPolarHBondContact O-CA 3.23Å; W2252-Q2254 PolarHBondContact O-N 3.38Å
2255	G	87.1	Confident	81.6	Confident	8 Å²	8	30.6 Å²	30.6	8%	0.082	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	153.5	172.7	172.5	0	0	0	0	0	115.3	G2206 I2207 V2208	G2206-G2255 PolarHBondContact O-N 3.41Å; G2206-G2255 VanDerWaalsContact O-N 3.07Å; I2207-G2255 WeakPolarHBondContact CA-O 3.39Å; V2208-G2255 PolarHBondContact N-O 3.24Å
2256	I	92.6	Very high	79.4	Confident	11 Å²	11	35.6 Å²	35.6	6%	0.056	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	125.6	166.5	-58	170.3	0	0	0	107.1	V1241 E2193 E2197 V2208	V1241-I2256 HydrophobicContact CB-CB 4.14Å; V1241-I2256 HydrophobicContact CB-CG2 3.9Å; V1241-I2256 HydrophobicContact CG2-CB 4.47Å; V1241-I2256 HydrophobicContact CG2-CG2 3.77Å; V1241-I2256 PolarHBondContact N-O 3.36Å; E2193-I2256 HydrophobicContact CB-CD1 4.19Å; E2193-I2256 HydrophobicContact CG-CD1 4.48Å; E2193-I2256 HydrophobicContact CG-CG2 4.39Å; E2197-I2256 HydrophobicContact CB-CD1 4.31Å; V2208-I2256 HydrophobicContact CB-CG1 4.22Å; V2208-I2256 HydrophobicContact CB-CG2 4.31Å; V2208-I2256 HydrophobicContact CG2-CG1 4.33Å
2257	F	92.6	Very high	76.8	Confident	3 Å²	3	43.7 Å²	43.7	1%	0.013	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	158.6	-175	-53.1	-74.3	0	0	0	111	E1239 Q1240 L1668 I2207 V2208 I2209 Q2210 F2249 W2252	E1239-F2257 CarbonylContact O-C 3.52Å; E1239-F2257 VanDerWaalsContact O-CA 3.23Å; E1239-F2257 WeakPolarHBondContact O-CA 3.06Å; Q1240-F2257 HydrophobicContact CB-CD1 4.14Å; Q1240-F2257 HydrophobicContact CB-CE1 4.33Å; Q1240-F2257 HydrophobicContact CG-CD1 4.14Å; Q1240-F2257 HydrophobicContact CG-CE1 3.99Å; L1668-F2257 HydrophobicContact CD1-CD1 4.31Å; I2207-F2257 HydrophobicContact CG2-CD2 4.3Å; I2207-F2257 HydrophobicContact CG2-CE2 4.4Å; V2208-F2257 PolarHBondContact O-N 2.83Å; I2209-F2257 CarbonylContact C-O 3.5Å; I2209-F2257 WeakPolarHBondContact CA-O 3.22Å; Q2210-F2257 PolarHBondContact N-O 3.49Å; F2249-F2257 HydrophobicContact CD1-CB 3.8Å; F2249-F2257 HydrophobicContact CD1-CD1 4.23Å; F2249-F2257 AromaticContact CD1-CD2 3.7Å; F2249-F2257 HydrophobicContact CD1-CD2 3.7Å; F2249-F2257 HydrophobicContact CD1-CE2 4.35Å; F2249-F2257 AromaticContact CD1-CG 3.63Å; F2249-F2257 HydrophobicContact CD1-CG 3.63Å; F2249-F2257 HydrophobicContact CE1-CB 3.42Å; F2249-F2257 VanDerWaalsContact CE1-CB 3.42Å; F2249-F2257 HydrophobicContact CE1-CD1 4.2Å; F2249-F2257 HydrophobicContact CE1-CD2 4.23Å; F2249-F2257 AromaticContact CE1-CG 3.7Å; F2249-F2257 HydrophobicContact CE1-CG 3.7Å; F2249-F2257 HydrophobicContact CG-CD2 4.33Å; F2249-F2257 HydrophobicContact CZ-CB 3.99Å; W2252-F2257 HydrophobicContact CB-CZ 4.33Å; W2252-F2257 AromaticContact CE3-CD1 3.98Å; W2252-F2257 HydrophobicContact CE3-CD1 3.98Å; W2252-F2257 AromaticContact CE3-CE1 3.55Å; W2252-F2257 HydrophobicContact CE3-CE1 3.55Å; W2252-F2257 HydrophobicContact CE3-CE2 4.31Å; W2252-F2257 AromaticContact CE3-CZ 3.74Å; W2252-F2257 HydrophobicContact CE3-CZ 3.74Å; W2252-F2257 AromaticContact CZ3-CD1 3.96Å; W2252-F2257 HydrophobicContact CZ3-CD1 3.96Å; W2252-F2257 AromaticContact CZ3-CE1 3.97Å; W2252-F2257 HydrophobicContact CZ3-CE1 3.97Å
2258	S	91.3	Very high	74.1	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	145.1	167.7	-172.5	0	0	0	0	110.8	L1238 E1239 Q2173 Q2210	L1238-S2258 WeakPolarHBondContact CA-O 3.45Å; E1239-S2258 PolarHBondContact N-O 2.96Å; E1239-S2258 VanDerWaalsContact N-O 3.08Å; E1239-S2258 PolarHBondContact O-N 3.27Å; Q2173-S2258 PolarHBondContact NE2-OG 2.87Å; Q2210-S2258 WeakPolarHBondContact O-CA 3.42Å; Q2210-S2258 PolarHBondContact O-OG 3.02Å
2259	C	91.4	Very high	71.4	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	119	-178.5	-165.3	0	0	0	0	111.1	L1238 I2209 Q2210 W2211 G2212 Q2237 S2245 F2249	L1238-C2259 HydrophobicContact CD2-CB 4.21Å; L1238-C2259 WeakPolarHBondContact CD2-SG 3.22Å; I2209-C2259 HydrophobicContact CG2-CB 3.99Å; Q2210-C2259 PolarHBondContact O-N 2.92Å; W2211-C2259 WeakPolarHBondContact CA-O 3.27Å; W2211-C2259 HydrophobicContact CE3-CB 3.77Å; W2211-C2259 HydrophobicContact CH2-CB 4.43Å; W2211-C2259 HydrophobicContact CZ3-CB 3.71Å; W2211-C2259 VanDerWaalsContact CZ3-SG 3.54Å; G2212-C2259 PolarHBondContact N-O 3.23Å; Q2237-C2259 PolarHBondContact OE1-SG 3.5Å; S2245-C2259 WeakPolarHBondContact CB-SG 3.41Å; S2245-C2259 PolarHBondContact OG-SG 2.88Å; F2249-C2259 HydrophobicContact CE2-CB 3.75Å; F2249-C2259 HydrophobicContact CZ-CB 3.77Å
2260	F	88.3	Confident	68.4	Low	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	161.8	-176.8	59.5	-77	0	0	0	111.3	P1236 T1237 E1239 S1402 P1404 T2234	P1236-F2260 CarbonylContact C-O 3.56Å; P1236-F2260 WeakPolarHBondContact CA-O 3.36Å; T1237-F2260 HydrophobicContact CG2-CE1 3.75Å; T1237-F2260 HydrophobicContact CG2-CE2 4.14Å; T1237-F2260 HydrophobicContact CG2-CZ 3.51Å; T1237-F2260 PolarHBondContact N-O 2.9Å; T1237-F2260 PolarHBondContact O-N 3.13Å; E1239-F2260 HydrophobicContact CG-CE1 4.23Å; E1239-F2260 WeakPolarHBondContact OE2-CE1 3.38Å; S1402-F2260 WeakPolarHBondContact O-CZ 3.2Å; P1404-F2260 HydrophobicContact CB-CD2 4.29Å; P1404-F2260 HydrophobicContact CB-CE2 3.96Å; P1404-F2260 HydrophobicContact CG-CE2 4.25Å; T2234-F2260 HydrophobicContact CG2-CB 3.86Å; T2234-F2260 HydrophobicContact CG2-CD2 3.68Å; T2234-F2260 HydrophobicContact CG2-CG 4.11Å
2261	I	83.8	Confident	65.5	Low	10 Å²	10	63 Å²	63	5%	0.051	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	124.8	166.9	-64.6	167.8	0	0	0	107.4	V1234 P1236 T2234 H2235 Q2237	V1234-I2261 HydrophobicContact CG1-CB 4.44Å; V1234-I2261 HydrophobicContact CG1-CD1 3.76Å; V1234-I2261 HydrophobicContact CG1-CG1 4.24Å; V1234-I2261 HydrophobicContact CG1-CG2 3.39Å; P1236-I2261 HydrophobicContact CB-CG1 4.37Å; T2234-I2261 CarbonylContact C-O 3.55Å; T2234-I2261 WeakPolarHBondContact CA-O 3.48Å; T2234-I2261 WeakPolarHBondContact CB-O 3.21Å; H2235-I2261 HydrophobicContact CB-CB 4.24Å; H2235-I2261 HydrophobicContact CB-CG2 3.89Å; H2235-I2261 PolarHBondContact N-O 3.21Å; Q2237-I2261 HydrophobicContact CB-CD1 3.89Å; Q2237-I2261 HydrophobicContact CB-CG1 4.2Å; Q2237-I2261 HydrophobicContact CG-CD1 3.89Å; Q2237-I2261 HydrophobicContact CG-CG1 4.14Å
2262	R	76.8	Confident	62.9	Low	75 Å²	75	64.8 Å²	64.8	28%	0.283	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	141.2	174.2	-146.7	-167.3	70.6	-154.9	-1.2	110.5	V1401 P1404	V1401-R2262 VanDerWaalsContact CG1-NH1 3.31Å; V1401-R2262 WeakPolarHBondContact O-CD 3.45Å; V1401-R2262 PolarHBondContact O-NH1 3.02Å; P1404-R2262 HydrophobicContact CB-CG 4.19Å
2263	A	68.7	Low	60.8	Low	3 Å²	3	72.4 Å²	72.4	3%	0.025	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-72.6	159.6	160.9	0	0	0	0	0	110.9	I2230 G2233	I2230-A2263 HydrophobicContact CD1-CB 4.11Å; I2230-A2263 HydrophobicContact CG1-CB 4.37Å; I2230-A2263 HydrophobicContact CG2-CB 3.8Å; G2233-A2263 WeakPolarHBondContact O-CB 3.49Å; G2233-A2263 PolarHBondContact O-N 3.15Å
2264	E	58.5	Low	59.3	Low	148 Å²	148	71.8 Å²	71.8	69%	0.692	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-89.9	120.2	167.6	-64.1	-157.5	137.3	0	0	110.2	N2266	E2264-N2266 PolarHBondContact O-N 3.25Å
2265	T	50.5	Low	57.4	Low	35 Å²	35	72.4 Å²	72.4	22%	0.215	42%	0.422	C	S	.	.			trans	-73.9	106.2	164.2	32.5	0	0	0	0	107.9	K1407 R2267 R2318	K1407-T2265 HydrophobicContact CG-CG2 4.16Å; T2265-R2267 PolarHBondContact O-N 3.01Å; T2265-R2318 HydrophobicContact CG2-CG 3.77Å
2266	N	39.3	Very low	56.1	Low	113 Å²	113	75.4 Å²	75.4	60%	0.604	44%	0.436	S	S	*	.			trans	-56.3	126.2	-179.2	-84.3	-50	0	0	0	111	E2264	E2264-N2266 PolarHBondContact O-N 3.25Å
2267	R	35.1	Very low	54.8	Low	175 Å²	175	75 Å²	75	66%	0.66	43%	0.434	S	S	*	.			trans	-66.8	132.4	168.1	-72.6	-171.8	179.4	-165.8	2	108.6	T2265 G2269	T2265-R2267 PolarHBondContact O-N 3.01Å; R2267-G2269 VanDerWaalsContact C-N 3.3Å; R2267-G2269 PolarHBondContact O-N 3.27Å
2268	P	31.1	Very low	53.6	Low	143 Å²	143	75.4 Å²	75.4	93%	0.929	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	83.2	176.6	29.4	-34.8	0	0	0	110.8
2269	G	26.8	Very low	52.1	Low	78 Å²	78	81.1 Å²	81.1	80%	0.804	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-172.8	-17.7	-177.6	0	0	0	0	0	118.8	R2267	R2267-G2269 VanDerWaalsContact C-N 3.3Å; R2267-G2269 PolarHBondContact O-N 3.27Å
2270	G	23.8	Very low	50.6	Low	64 Å²	64	83.3 Å²	83.3	66%	0.66	48%	0.476	S	S	*	.	S	Bend	trans	-120.4	107.8	-176.3	0	0	0	0	0	114.2	G2272	G2270-G2272 PolarHBondContact O-N 3.32Å
2271	D	27.1	Very low	49.6	Very low	167 Å²	167	83.3 Å²	83.3	89%	0.893	48%	0.476	S	S	*	.	S	Bend	trans	44.6	-8.9	163.2	-64.1	-12.8	0	0	0	121.8	K2273	D2271-K2273 PolarHBondContact O-N 3.39Å
2272	G	29	Very low	48.6	Very low	59 Å²	59	82.9 Å²	82.9	61%	0.608	47%	0.474	S	S	*	.			trans	-75.2	20.7	-174.3	0	0	0	0	0	117.1	G2270 N2274 A2275	G2270-G2272 PolarHBondContact O-N 3.32Å; G2272-N2274 PolarHBondContact O-N 2.64Å; G2272-A2275 PolarHBondContact O-N 2.95Å
2273	K	33.4	Very low	47.7	Very low	205 Å²	205	86.7 Å²	86.7	89%	0.891	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-3.1	-169.6	-80.6	-166.8	174.3	-174.3	0	116.6	D2271	D2271-K2273 PolarHBondContact O-N 3.39Å
2274	N	37.6	Very low	47.2	Very low	156 Å²	156	87.6 Å²	87.6	83%	0.834	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	5.5	-175.5	-70.8	-4.7	0	0	0	114.7	G2272 N2276	G2272-N2274 PolarHBondContact O-N 2.64Å; N2274-N2276 PolarHBondContact O-N 2.9Å
2275	A	40.6	Very low	47.2	Very low	68 Å²	68	81.3 Å²	81.3	56%	0.562	47%	0.47	S	S	*	.			trans	-76.7	90.4	173.1	0	0	0	0	0	110.7	G2272 I2277 Y2320	G2272-A2275 PolarHBondContact O-N 2.95Å; A2275-I2277 PolarHBondContact O-N 2.9Å; A2275-Y2320 PolarHBondContact O-OH 3.1Å; A2275-Y2320 VanDerWaalsContact O-OH 3.11Å
2276	N	59	Low	47	Very low	70 Å²	70	82.6 Å²	82.6	37%	0.374	49%	0.49	S	S	.	.			trans	-67.6	115.7	-179.6	-175.3	-6.3	0	0	0	110.9	N2274 M2278 Q2279 T2280	N2274-N2276 PolarHBondContact O-N 2.9Å; N2276-M2278 PolarHBondContact O-N 2.82Å; N2276-M2278 VanDerWaalsContact O-N 3.08Å; N2276-M2278 WeakPolarHBondContact OD1-CB 3.12Å; N2276-M2278 VanDerWaalsContact OD1-CG 3.28Å; N2276-M2278 WeakPolarHBondContact OD1-CG 3.16Å; N2276-M2278 PolarHBondContact OD1-N 2.83Å; N2276-M2278 VanDerWaalsContact OD1-N 3.07Å; N2276-Q2279 HydrophobicContact CB-CG 4.34Å; N2276-Q2279 PolarHBondContact O-N 2.71Å; N2276-T2280 PolarHBondContact O-N 3.11Å
2277	I	66.7	Low	48	Very low	3 Å²	3	78.6 Å²	78.6	2%	0.015	47%	0.469	C	S	.	.	H	α-helix	trans	-52.4	-34.3	179.4	-170.3	168.7	0	0	0	112.4	A2275 Q2279 T2280 I2281 L2316 Y2320 L2337 V2341	A2275-I2277 PolarHBondContact O-N 2.9Å; I2277-Q2279 VanDerWaalsContact C-N 3.32Å; I2277-Q2279 PolarHBondContact O-N 3.39Å; I2277-T2280 PolarHBondContact O-N 3.43Å; I2277-I2281 HydrophobicContact CD1-CD1 4.16Å; I2277-I2281 HydrophobicContact CG1-CD1 3.82Å; I2277-I2281 HydrophobicContact CG1-CG1 4.41Å; I2277-I2281 WeakPolarHBondContact O-CB 3.25Å; I2277-I2281 PolarHBondContact O-N 2.74Å; I2277-L2316 HydrophobicContact CD1-CD2 3.73Å; I2277-Y2320 WeakPolarHBondContact CA-OH 3.45Å; I2277-Y2320 HydrophobicContact CB-CE1 4.31Å; I2277-Y2320 HydrophobicContact CB-CE2 3.97Å; I2277-Y2320 HydrophobicContact CD1-CD2 3.64Å; I2277-Y2320 HydrophobicContact CD1-CE2 3.59Å; I2277-Y2320 HydrophobicContact CD1-CG 4.16Å; I2277-Y2320 HydrophobicContact CG1-CD2 4.22Å; I2277-Y2320 HydrophobicContact CG1-CE2 3.64Å; I2277-L2337 HydrophobicContact CD1-CB 4.21Å; I2277-L2337 HydrophobicContact CD1-CD2 3.88Å; I2277-L2337 HydrophobicContact CG2-CB 4.2Å; I2277-V2341 HydrophobicContact CB-CG2 4.12Å; I2277-V2341 HydrophobicContact CD1-CG2 3.53Å; I2277-V2341 HydrophobicContact CG1-CG2 4.41Å; I2277-V2341 HydrophobicContact CG2-CB 4.36Å; I2277-V2341 HydrophobicContact CG2-CG2 3.92Å
2278	M	67.3	Low	48.3	Very low	11 Å²	11	75.9 Å²	75.9	5%	0.054	48%	0.476	C	S	.	.	H	α-helix	trans	-57.3	-42.7	174.9	-65	-98.1	-70.8	0	0	112.6	N2276 A2282 L2290 Q2295 L2334 V2338	N2276-M2278 PolarHBondContact O-N 2.82Å; N2276-M2278 VanDerWaalsContact O-N 3.08Å; N2276-M2278 WeakPolarHBondContact OD1-CB 3.12Å; N2276-M2278 VanDerWaalsContact OD1-CG 3.28Å; N2276-M2278 WeakPolarHBondContact OD1-CG 3.16Å; N2276-M2278 PolarHBondContact OD1-N 2.83Å; N2276-M2278 VanDerWaalsContact OD1-N 3.07Å; M2278-A2282 WeakPolarHBondContact O-CB 3.44Å; M2278-A2282 PolarHBondContact O-N 2.84Å; M2278-L2290 HydrophobicContact CB-CD1 3.79Å; M2278-L2290 HydrophobicContact CB-CD2 4.23Å; M2278-L2290 HydrophobicContact CE-CD1 4.36Å; M2278-L2290 HydrophobicContact CE-CD2 3.92Å; M2278-Q2295 HydrophobicContact CE-CG 4.11Å; M2278-L2334 HydrophobicContact CB-CD2 4.43Å; M2278-L2334 HydrophobicContact CE-CB 4.42Å; M2278-L2334 HydrophobicContact SD-CB 3.56Å; M2278-L2334 VanDerWaalsContact SD-CB 3.56Å; M2278-L2334 HydrophobicContact SD-CD2 3.77Å; M2278-L2334 HydrophobicContact SD-CG 4.21Å; M2278-L2334 VanDerWaalsContact SD-O 3.33Å; M2278-V2338 HydrophobicContact CG-CG2 3.4Å; M2278-V2338 HydrophobicContact SD-CG2 3.68Å
2279	Q	60.1	Low	49.2	Very low	121 Å²	121	71.9 Å²	71.9	57%	0.565	45%	0.448	S	S	*	.	H	α-helix	trans	-72.5	-39.4	-178.8	-72.5	-176.3	-73.3	0	0	111	N2276 I2277 H2283 L2290	N2276-Q2279 HydrophobicContact CB-CG 4.34Å; N2276-Q2279 PolarHBondContact O-N 2.71Å; I2277-Q2279 VanDerWaalsContact C-N 3.32Å; I2277-Q2279 PolarHBondContact O-N 3.39Å; Q2279-H2283 WeakPolarHBondContact O-CB 3.3Å; Q2279-H2283 PolarHBondContact O-N 2.92Å; Q2279-L2290 HydrophobicContact CG-CD1 3.69Å
2280	T	60	Low	50.4	Low	45 Å²	45	69.9 Å²	69.9	28%	0.276	42%	0.418	S	S	.	.	H	α-helix	trans	-60.7	-47.1	175.1	-48.7	0	0	0	0	110.9	N2276 I2277 H2283 I2284 T2315	N2276-T2280 PolarHBondContact O-N 3.11Å; I2277-T2280 PolarHBondContact O-N 3.43Å; T2280-H2283 WeakPolarHBondContact O-CB 3.31Å; T2280-H2283 PolarHBondContact O-N 2.93Å; T2280-I2284 WeakPolarHBondContact O-CG1 3.14Å; T2280-I2284 PolarHBondContact O-N 2.87Å; T2280-I2284 VanDerWaalsContact O-N 3.1Å; T2280-T2315 HydrophobicContact CG2-CG2 3.82Å
2281	I	65.9	Low	51.9	Low	0 Å²	0	75.5 Å²	75.5	0%	0	42%	0.424	C	S	.	.	H	α-helix	trans	-75.5	-33.4	-178.1	-73	178.8	0	0	0	112.4	I2277 H2283 I2284 L2285 L2299 I2312 L2334 L2337	I2277-I2281 HydrophobicContact CD1-CD1 4.16Å; I2277-I2281 HydrophobicContact CG1-CD1 3.82Å; I2277-I2281 HydrophobicContact CG1-CG1 4.41Å; I2277-I2281 WeakPolarHBondContact O-CB 3.25Å; I2277-I2281 PolarHBondContact O-N 2.74Å; I2281-H2283 VanDerWaalsContact C-N 3.3Å; I2281-H2283 PolarHBondContact O-N 3.36Å; I2281-I2284 HydrophobicContact CG1-CD1 4.48Å; I2281-I2284 PolarHBondContact O-N 3.48Å; I2281-L2285 HydrophobicContact CG2-CD1 4.19Å; I2281-L2285 WeakPolarHBondContact O-CG 3.42Å; I2281-L2285 PolarHBondContact O-N 3.45Å; I2281-L2299 HydrophobicContact CG2-CD2 3.66Å; I2281-I2312 HydrophobicContact CB-CD1 4.48Å; I2281-I2312 HydrophobicContact CD1-CG1 4.42Å; I2281-I2312 HydrophobicContact CD1-CG2 3.85Å; I2281-I2312 HydrophobicContact CG1-CD1 4.34Å; I2281-I2312 HydrophobicContact CG1-CG1 4.15Å; I2281-I2312 HydrophobicContact CG1-CG2 4.47Å; I2281-I2312 HydrophobicContact CG2-CD1 3.58Å; I2281-I2312 HydrophobicContact CG2-CG1 4.28Å; I2281-L2334 HydrophobicContact CG2-CD2 4.07Å; I2281-L2337 HydrophobicContact CB-CD1 4.35Å; I2281-L2337 HydrophobicContact CD1-CD1 3.41Å; I2281-L2337 VanDerWaalsContact CD1-CD1 3.41Å; I2281-L2337 HydrophobicContact CD1-CD2 3.54Å; I2281-L2337 HydrophobicContact CD1-CG 4.06Å; I2281-L2337 HydrophobicContact CG1-CD1 4.44Å; I2281-L2337 HydrophobicContact CG2-CD1 3.93Å
2282	A	63.2	Low	53	Low	2 Å²	2	74.9 Å²	74.9	2%	0.017	42%	0.416	C	S	.	.	H	α-helix	trans	-58.5	-42.8	166.3	0	0	0	0	0	111.4	M2278 I2284 L2285 G2286 I2287 L2290	M2278-A2282 WeakPolarHBondContact O-CB 3.44Å; M2278-A2282 PolarHBondContact O-N 2.84Å; A2282-I2284 PolarHBondContact O-N 2.99Å; A2282-L2285 CarbonylContact O-C 3.58Å; A2282-L2285 PolarHBondContact O-N 2.81Å; A2282-G2286 PolarHBondContact O-N 2.98Å; A2282-G2286 VanDerWaalsContact O-N 3.1Å; A2282-I2287 HydrophobicContact CB-CB 3.92Å; A2282-I2287 HydrophobicContact CB-CG2 4.19Å; A2282-I2287 WeakPolarHBondContact O-CA 3.47Å; A2282-I2287 WeakPolarHBondContact O-CB 3.12Å; A2282-I2287 PolarHBondContact O-N 3.46Å; A2282-L2290 HydrophobicContact CB-CD2 3.77Å; A2282-L2290 HydrophobicContact CB-CG 3.92Å
2283	H	57.4	Low	53.8	Low	154 Å²	154	73.4 Å²	73.4	71%	0.713	40%	0.395	S	S	*	.	H	α-helix	trans	-62.7	-43.6	178	-128.2	150.5	0	0	0	112.4	Q2279 T2280 I2281 L2285 G2286	Q2279-H2283 WeakPolarHBondContact O-CB 3.3Å; Q2279-H2283 PolarHBondContact O-N 2.92Å; T2280-H2283 WeakPolarHBondContact O-CB 3.31Å; T2280-H2283 PolarHBondContact O-N 2.93Å; I2281-H2283 VanDerWaalsContact C-N 3.3Å; I2281-H2283 PolarHBondContact O-N 3.36Å; H2283-L2285 VanDerWaalsContact C-N 3.27Å; H2283-L2285 PolarHBondContact O-N 2.89Å; H2283-G2286 PolarHBondContact O-N 2.94Å
2284	I	59.1	Low	54.7	Low	22 Å²	22	63.9 Å²	63.9	11%	0.113	35%	0.354	C	S	.	.	H	α-helix	trans	-58.9	-38.6	174.7	-68.5	166.3	0	0	0	111.4	T2280 I2281 A2282 G2286 M2308 E2311 I2312	T2280-I2284 WeakPolarHBondContact O-CG1 3.14Å; T2280-I2284 PolarHBondContact O-N 2.87Å; T2280-I2284 VanDerWaalsContact O-N 3.1Å; I2281-I2284 HydrophobicContact CG1-CD1 4.48Å; I2281-I2284 PolarHBondContact O-N 3.48Å; A2282-I2284 PolarHBondContact O-N 2.99Å; I2284-G2286 VanDerWaalsContact C-N 3.26Å; I2284-G2286 PolarHBondContact O-N 3.24Å; I2284-M2308 HydrophobicContact CG2-CB 4.12Å; I2284-E2311 HydrophobicContact CD1-CB 4.42Å; I2284-E2311 HydrophobicContact CD1-CG 4.06Å; I2284-E2311 HydrophobicContact CG1-CG 4.1Å; I2284-E2311 HydrophobicContact CG2-CB 4.04Å; I2284-E2311 HydrophobicContact CG2-CG 4.33Å; I2284-I2312 HydrophobicContact CD1-CG1 4.18Å; I2284-I2312 HydrophobicContact CG2-CG1 3.96Å
2285	L	57.7	Low	55.8	Low	16 Å²	16	58.4 Å²	58.4	8%	0.084	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	1.6	174.9	-69.9	170.1	0	0	0	113.9	I2281 A2282 H2283 I2287 L2299 L2302 L2304 M2308	I2281-L2285 HydrophobicContact CG2-CD1 4.19Å; I2281-L2285 WeakPolarHBondContact O-CG 3.42Å; I2281-L2285 PolarHBondContact O-N 3.45Å; A2282-L2285 CarbonylContact O-C 3.58Å; A2282-L2285 PolarHBondContact O-N 2.81Å; H2283-L2285 VanDerWaalsContact C-N 3.27Å; H2283-L2285 PolarHBondContact O-N 2.89Å; L2285-I2287 HydrophobicContact CB-CD1 3.55Å; L2285-I2287 HydrophobicContact CB-CG1 3.87Å; L2285-I2287 HydrophobicContact CD1-CD1 3.78Å; L2285-I2287 HydrophobicContact CG-CD1 4.32Å; L2285-I2287 PolarHBondContact O-N 2.67Å; L2285-L2299 HydrophobicContact CD1-CD2 3.94Å; L2285-L2302 HydrophobicContact CD1-CB 4.05Å; L2285-L2302 HydrophobicContact CD1-CD1 3.92Å; L2285-L2302 HydrophobicContact CD2-CB 4.29Å; L2285-L2304 HydrophobicContact CD2-CB 4.02Å; L2285-L2304 HydrophobicContact CD2-CD1 3.71Å; L2285-M2308 HydrophobicContact CD2-SD 4.03Å
2286	G	46.9	Very low	56.9	Low	62 Å²	62	56.7 Å²	56.7	64%	0.639	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	11.1	-176.5	0	0	0	0	0	115.2	A2282 H2283 I2284 S2288	A2282-G2286 PolarHBondContact O-N 2.98Å; A2282-G2286 VanDerWaalsContact O-N 3.1Å; H2283-G2286 PolarHBondContact O-N 2.94Å; I2284-G2286 VanDerWaalsContact C-N 3.26Å; I2284-G2286 PolarHBondContact O-N 3.24Å; G2286-S2288 PolarHBondContact O-N 2.88Å
2287	I	59.7	Low	56.8	Low	29 Å²	29	53.8 Å²	53.8	15%	0.149	29%	0.29	C	S	.	.			trans	-81.2	108.4	-177.3	-59.1	162.2	0	0	0	109.3	A2282 L2285 D2289 V2293	A2282-I2287 HydrophobicContact CB-CB 3.92Å; A2282-I2287 HydrophobicContact CB-CG2 4.19Å; A2282-I2287 WeakPolarHBondContact O-CA 3.47Å; A2282-I2287 WeakPolarHBondContact O-CB 3.12Å; A2282-I2287 PolarHBondContact O-N 3.46Å; L2285-I2287 HydrophobicContact CB-CD1 3.55Å; L2285-I2287 HydrophobicContact CB-CG1 3.87Å; L2285-I2287 HydrophobicContact CD1-CD1 3.78Å; L2285-I2287 HydrophobicContact CG-CD1 4.32Å; L2285-I2287 PolarHBondContact O-N 2.67Å; I2287-D2289 WeakPolarHBondContact CG2-O 3.49Å; I2287-V2293 HydrophobicContact CB-CG2 4.38Å; I2287-V2293 HydrophobicContact CD1-CB 4.25Å; I2287-V2293 HydrophobicContact CD1-CG1 3.95Å; I2287-V2293 HydrophobicContact CD1-CG2 3.81Å; I2287-V2293 HydrophobicContact CG1-CG2 3.93Å; I2287-V2293 HydrophobicContact CG2-CB 4.25Å; I2287-V2293 HydrophobicContact CG2-CG2 3.52Å
2288	S	42.1	Very low	56.5	Low	118 Å²	118	54.2 Å²	54.2	83%	0.825	29%	0.291	S	S	*	.	S	Bend	trans	-86.5	-12.3	-179.7	56.8	0	0	0	0	115.2	G2286	G2286-S2288 PolarHBondContact O-N 2.88Å
2289	D	49.7	Very low	56.2	Low	60 Å²	60	53.7 Å²	53.7	32%	0.321	29%	0.289	S	S	.	.			trans	-141.4	108.1	174.3	178.5	8.5	0	0	0	109.9	I2287 K2291 Q2292	I2287-D2289 WeakPolarHBondContact CG2-O 3.49Å; D2289-K2291 PolarHBondContact O-N 2.83Å; D2289-K2291 VanDerWaalsContact O-N 3.16Å; D2289-K2291 WeakPolarHBondContact OD1-CB 3.38Å; D2289-K2291 PolarHBondContact OD1-N 2.91Å; D2289-Q2292 HydrophobicContact CB-CG 4.25Å; D2289-Q2292 PolarHBondContact O-N 3.29Å; D2289-Q2292 VanDerWaalsContact O-N 3.15Å; D2289-Q2292 PolarHBondContact OD2-NE2 3.12Å
2290	L	52.9	Low	56.2	Low	36 Å²	36	49.1 Å²	49.1	19%	0.188	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-56.9	-27.2	178.4	-89	164.3	0	0	0	113.1	M2278 Q2279 A2282 Q2292 V2293 L2334	M2278-L2290 HydrophobicContact CB-CD1 3.79Å; M2278-L2290 HydrophobicContact CB-CD2 4.23Å; M2278-L2290 HydrophobicContact CE-CD1 4.36Å; M2278-L2290 HydrophobicContact CE-CD2 3.92Å; Q2279-L2290 HydrophobicContact CG-CD1 3.69Å; A2282-L2290 HydrophobicContact CB-CD2 3.77Å; A2282-L2290 HydrophobicContact CB-CG 3.92Å; L2290-Q2292 PolarHBondContact O-N 3.27Å; L2290-V2293 PolarHBondContact O-N 2.98Å; L2290-V2293 VanDerWaalsContact O-N 3.15Å; L2290-L2334 HydrophobicContact CD2-CD1 4.07Å; L2290-L2334 HydrophobicContact CD2-CD2 4.33Å
2291	K	55.2	Low	55.9	Low	181 Å²	181	49.6 Å²	49.6	79%	0.787	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-72.4	-14.8	-178.3	-62.4	179	178.2	178.5	0	113.5	D2289 V2293	D2289-K2291 PolarHBondContact O-N 2.83Å; D2289-K2291 VanDerWaalsContact O-N 3.16Å; D2289-K2291 WeakPolarHBondContact OD1-CB 3.38Å; D2289-K2291 PolarHBondContact OD1-N 2.91Å; K2291-V2293 VanDerWaalsContact C-N 3.33Å
2292	Q	49	Very low	55.4	Low	155 Å²	155	51.7 Å²	51.7	72%	0.724	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-89.3	-3.9	175.8	-63.1	177.5	42.8	0	0	112.2	D2289 L2290	D2289-Q2292 HydrophobicContact CB-CG 4.25Å; D2289-Q2292 PolarHBondContact O-N 3.29Å; D2289-Q2292 VanDerWaalsContact O-N 3.15Å; D2289-Q2292 PolarHBondContact OD2-NE2 3.12Å; L2290-Q2292 PolarHBondContact O-N 3.27Å
2293	V	46.8	Very low	54.6	Low	27 Å²	27	54.3 Å²	54.3	16%	0.164	31%	0.313	C	S	.	.	S	Bend	trans	-120	140.5	-177.2	-179.2	0	0	0	0	111.3	I2287 L2290 K2291 L2302 L2334	I2287-V2293 HydrophobicContact CB-CG2 4.38Å; I2287-V2293 HydrophobicContact CD1-CB 4.25Å; I2287-V2293 HydrophobicContact CD1-CG1 3.95Å; I2287-V2293 HydrophobicContact CD1-CG2 3.81Å; I2287-V2293 HydrophobicContact CG1-CG2 3.93Å; I2287-V2293 HydrophobicContact CG2-CB 4.25Å; I2287-V2293 HydrophobicContact CG2-CG2 3.52Å; L2290-V2293 PolarHBondContact O-N 2.98Å; L2290-V2293 VanDerWaalsContact O-N 3.15Å; K2291-V2293 VanDerWaalsContact C-N 3.33Å; V2293-L2302 HydrophobicContact CG1-CD1 3.79Å; V2293-L2302 HydrophobicContact CG1-CD2 3.51Å; V2293-L2302 HydrophobicContact CG1-CG 4.31Å; V2293-L2334 HydrophobicContact CG1-CD1 4.08Å
2294	D	52.1	Low	54.6	Low	6 Å²	6	47.2 Å²	47.2	3%	0.032	28%	0.28	C	S	.	.			trans	-83.9	112.8	-172.5	163	-33.1	0	0	0	108.2	D2296 S2297 R2497 N2501	D2294-D2296 PolarHBondContact O-N 2.84Å; D2294-S2297 WeakPolarHBondContact CB-OG 3.47Å; D2294-S2297 WeakPolarHBondContact O-CB 3.31Å; D2294-S2297 PolarHBondContact O-N 3.49Å; D2294-S2297 PolarHBondContact O-OG 3.03Å; D2294-S2297 PolarHBondContact OD1-N 2.98Å; D2294-S2297 VanDerWaalsContact OD1-N 3.08Å; D2294-S2297 PolarHBondContact OD1-OG 2.77Å; D2294-R2497 IonicContact OD2-CZ 3.73Å; D2294-R2497 VanDerWaalsContact OD2-CZ 3.3Å; D2294-R2497 IonicContact OD2-NE 3.85Å; D2294-R2497 PolarHBondContact OD2-NE 3.43Å; D2294-R2497 VanDerWaalsContact OD2-NE 3.07Å; D2294-R2497 IonicContact OD2-NH2 3.25Å; D2294-R2497 PolarHBondContact OD2-NH2 3.24Å; D2294-N2501 PolarHBondContact OD1-ND2 2.91Å; D2294-N2501 PolarHBondContact OD2-ND2 3.14Å
2295	Q	60.6	Low	54.4	Low	40 Å²	40	49.9 Å²	49.9	19%	0.187	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-18.3	-164.1	-59.1	-173	54	0	0	113.4	M2278 T2333 L2334 N2335	M2278-Q2295 HydrophobicContact CE-CG 4.11Å; Q2295-T2333 WeakPolarHBondContact O-CB 3.49Å; Q2295-T2333 PolarHBondContact O-OG1 3.17Å; Q2295-L2334 HydrophobicContact CB-CB 4.21Å; Q2295-L2334 WeakPolarHBondContact O-CB 3.31Å; Q2295-L2334 PolarHBondContact O-N 3.32Å; Q2295-N2335 PolarHBondContact O-N 3.28Å
2296	D	63.7	Low	54.4	Low	33 Å²	33	49.9 Å²	49.9	18%	0.176	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	10.3	171.5	-65.3	-45.5	0	0	0	113.4	D2294 R2298 N2335 L2498 L2505	D2294-D2296 PolarHBondContact O-N 2.84Å; D2296-R2298 PolarHBondContact O-N 3.39Å; D2296-N2335 VanDerWaalsContact CG-ND2 3.31Å; D2296-N2335 WeakPolarHBondContact OD1-CB 3.21Å; D2296-N2335 PolarHBondContact OD1-ND2 2.9Å; D2296-N2335 PolarHBondContact OD2-ND2 2.86Å; D2296-L2498 HydrophobicContact CB-CD2 4.32Å; D2296-L2498 HydrophobicContact CB-CG 4.25Å; D2296-L2498 WeakPolarHBondContact OD2-CD2 3.29Å; D2296-L2505 WeakPolarHBondContact O-CD1 3.46Å
2297	S	57.3	Low	54.6	Low	8 Å²	8	49 Å²	49	6%	0.056	28%	0.277	C	S	.	.	S	Bend	trans	-71	129.8	165.4	-65.5	0	0	0	0	109.8	D2294 L2299 N2501	D2294-S2297 WeakPolarHBondContact CB-OG 3.47Å; D2294-S2297 WeakPolarHBondContact O-CB 3.31Å; D2294-S2297 PolarHBondContact O-N 3.49Å; D2294-S2297 PolarHBondContact O-OG 3.03Å; D2294-S2297 PolarHBondContact OD1-N 2.98Å; D2294-S2297 VanDerWaalsContact OD1-N 3.08Å; D2294-S2297 PolarHBondContact OD1-OG 2.77Å; S2297-L2299 PolarHBondContact O-N 3.29Å; S2297-N2501 PolarHBondContact OG-ND2 3.29Å; S2297-N2501 VanDerWaalsContact OG-ND2 3.11Å
2298	R	59.5	Low	54.6	Low	13 Å²	13	50.1 Å²	50.1	5%	0.049	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-48.8	137	166	-88.6	-167.7	164	150.2	4.7	109.9	D2296 G2300 N2301 L2302 R2330 L2332 R2504 L2505 G2508 V2509	D2296-R2298 PolarHBondContact O-N 3.39Å; R2298-G2300 PolarHBondContact O-N 2.64Å; R2298-N2301 HydrophobicContact CB-CB 3.94Å; R2298-N2301 WeakPolarHBondContact O-CA 3.3Å; R2298-N2301 WeakPolarHBondContact O-CB 3.4Å; R2298-N2301 PolarHBondContact O-N 2.89Å; R2298-L2302 WeakPolarHBondContact O-CG 3.29Å; R2298-L2302 PolarHBondContact O-N 3.22Å; R2298-L2302 VanDerWaalsContact O-N 3.07Å; R2298-R2330 WeakPolarHBondContact CD-O 3.39Å; R2298-R2330 WeakPolarHBondContact CG-O 3.32Å; R2298-L2332 CarbonylContact C-O 3.58Å; R2298-L2332 VanDerWaalsContact CA-O 3.3Å; R2298-L2332 WeakPolarHBondContact CA-O 3.2Å; R2298-R2504 PolarHBondContact NH1-O 3.49Å; R2298-R2504 PolarHBondContact NH2-O 3.46Å; R2298-L2505 HydrophobicContact CB-CD1 4.21Å; R2298-L2505 HydrophobicContact CG-CB 4.46Å; R2298-L2505 HydrophobicContact CG-CD1 3.45Å; R2298-L2505 VanDerWaalsContact CG-CD1 3.45Å; R2298-L2505 HydrophobicContact CG-CG 3.57Å; R2298-L2505 VanDerWaalsContact NH2-C 3.31Å; R2298-L2505 PolarHBondContact NH2-O 2.83Å; R2298-G2508 PolarHBondContact NH1-O 2.78Å; R2298-G2508 VanDerWaalsContact NH2-CA 3.27Å; R2298-G2508 VanDerWaalsContact NH2-N 3.13Å; R2298-V2509 VanDerWaalsContact NH1-N 3.18Å; R2298-V2509 PolarHBondContact NH1-O 3.3Å
2299	L	62.2	Low	55.6	Low	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-51.6	-47.5	165.9	-58.3	171.4	0	0	0	109	I2281 L2285 S2297 N2301 L2302 L2304 I2312 L2332 L2334 L2337	I2281-L2299 HydrophobicContact CG2-CD2 3.66Å; L2285-L2299 HydrophobicContact CD1-CD2 3.94Å; S2297-L2299 PolarHBondContact O-N 3.29Å; L2299-N2301 PolarHBondContact O-N 2.98Å; L2299-L2302 PolarHBondContact O-N 3.28Å; L2299-L2304 VanDerWaalsContact C-CB 3.44Å; L2299-L2304 HydrophobicContact CB-CD1 4.27Å; L2299-L2304 HydrophobicContact CB-CD2 3.94Å; L2299-L2304 WeakPolarHBondContact O-CB 3.41Å; L2299-I2312 HydrophobicContact CB-CD1 4.42Å; L2299-I2312 HydrophobicContact CD1-CD1 3.83Å; L2299-I2312 HydrophobicContact CD1-CG2 4.18Å; L2299-I2312 HydrophobicContact CD2-CD1 4.12Å; L2299-I2312 HydrophobicContact CG-CD1 4.34Å; L2299-L2332 HydrophobicContact CD1-CB 3.65Å; L2299-L2332 HydrophobicContact CD1-CD1 4.33Å; L2299-L2332 HydrophobicContact CG-CB 4.34Å; L2299-L2332 WeakPolarHBondContact CG-O 3.48Å; L2299-L2332 PolarHBondContact N-O 2.96Å; L2299-L2334 HydrophobicContact CD2-CG 4.48Å; L2299-L2337 HydrophobicContact CD1-CD1 3.88Å; L2299-L2337 HydrophobicContact CD2-CD1 4.04Å; L2299-L2337 HydrophobicContact CG-CD1 4.46Å
2300	G	59.8	Low	56.1	Low	24 Å²	24	41.9 Å²	41.9	25%	0.247	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-51.4	-27.2	172.4	0	0	0	0	0	116.4	R2298 R2330	R2298-G2300 PolarHBondContact O-N 2.64Å; G2300-R2330 PolarHBondContact N-O 2.94Å
2301	N	53.3	Low	56.5	Low	55 Å²	55	40.9 Å²	40.9	29%	0.294	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-93.9	-17.2	178	-66.9	-11.6	0	0	0	113.2	R2298 L2299 G2303	R2298-N2301 HydrophobicContact CB-CB 3.94Å; R2298-N2301 WeakPolarHBondContact O-CA 3.3Å; R2298-N2301 WeakPolarHBondContact O-CB 3.4Å; R2298-N2301 PolarHBondContact O-N 2.89Å; L2299-N2301 PolarHBondContact O-N 2.98Å; N2301-G2303 PolarHBondContact O-N 2.91Å
2302	L	56.3	Low	57.1	Low	45 Å²	45	32.2 Å²	32.2	24%	0.236	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	15.9	178.5	-68.7	176.4	0	0	0	113.5	L2285 V2293 R2298 L2299 L2334	L2285-L2302 HydrophobicContact CD1-CB 4.05Å; L2285-L2302 HydrophobicContact CD1-CD1 3.92Å; L2285-L2302 HydrophobicContact CD2-CB 4.29Å; V2293-L2302 HydrophobicContact CG1-CD1 3.79Å; V2293-L2302 HydrophobicContact CG1-CD2 3.51Å; V2293-L2302 HydrophobicContact CG1-CG 4.31Å; R2298-L2302 WeakPolarHBondContact O-CG 3.29Å; R2298-L2302 PolarHBondContact O-N 3.22Å; R2298-L2302 VanDerWaalsContact O-N 3.07Å; L2299-L2302 PolarHBondContact O-N 3.28Å; L2302-L2334 HydrophobicContact CD1-CD1 4.14Å
2303	G	46.1	Very low	58.1	Low	57 Å²	57	25.2 Å²	25.2	59%	0.588	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.6	6.7	-177.9	0	0	0	0	0	114.6	N2301 D2305	N2301-G2303 PolarHBondContact O-N 2.91Å; G2303-D2305 PolarHBondContact O-N 3.3Å
2304	L	57.8	Low	58.8	Low	5 Å²	5	24.4 Å²	24.4	3%	0.026	15%	0.147	C	C	.	.			trans	-59	99.1	178.4	-170	94.7	0	0	0	112.2	L2285 L2299 M2308 I2312 R2330	L2285-L2304 HydrophobicContact CD2-CB 4.02Å; L2285-L2304 HydrophobicContact CD2-CD1 3.71Å; L2299-L2304 VanDerWaalsContact C-CB 3.44Å; L2299-L2304 HydrophobicContact CB-CD1 4.27Å; L2299-L2304 HydrophobicContact CB-CD2 3.94Å; L2299-L2304 WeakPolarHBondContact O-CB 3.41Å; L2304-M2308 HydrophobicContact CD1-CB 3.56Å; L2304-M2308 HydrophobicContact CG-CB 4.04Å; L2304-I2312 HydrophobicContact CD1-CD1 3.36Å; L2304-I2312 HydrophobicContact CD1-CG1 4.17Å; L2304-R2330 HydrophobicContact CD2-CG 4.14Å
2305	D	54.8	Low	59.3	Low	77 Å²	77	24.3 Å²	24.3	41%	0.412	15%	0.147	S	C	.	.			trans	-77.5	-176.2	172.5	76.4	7.2	0	0	0	111.9	G2303 L2307 M2308 G2309	G2303-D2305 PolarHBondContact O-N 3.3Å; D2305-L2307 PolarHBondContact O-N 2.95Å; D2305-L2307 WeakPolarHBondContact OD1-CA 3.23Å; D2305-L2307 WeakPolarHBondContact OD1-CB 3.19Å; D2305-L2307 PolarHBondContact OD1-N 2.83Å; D2305-M2308 PolarHBondContact OD1-N 2.98Å; D2305-G2309 PolarHBondContact O-N 3.03Å
2306	S	55.8	Low	59.4	Low	17 Å²	17	22.5 Å²	22.5	12%	0.119	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-9	179.4	-61.6	0	0	0	0	114.4	V2310	S2306-V2310 WeakPolarHBondContact O-CG2 3.26Å
2307	L	52.8	Low	59.3	Low	44 Å²	44	21.7 Å²	21.7	23%	0.23	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-51.2	170.8	-84.3	120.3	0	0	0	111	D2127 L2224 D2305 G2309 V2310 E2311	D2127-L2307 HydrophobicContact CB-CD1 3.96Å; L2224-L2307 HydrophobicContact CD1-CD2 3.97Å; L2224-L2307 HydrophobicContact CD2-CB 4.2Å; L2224-L2307 HydrophobicContact CD2-CD2 3.94Å; L2224-L2307 HydrophobicContact CG-CD2 4.25Å; D2305-L2307 PolarHBondContact O-N 2.95Å; D2305-L2307 WeakPolarHBondContact OD1-CA 3.23Å; D2305-L2307 WeakPolarHBondContact OD1-CB 3.19Å; D2305-L2307 PolarHBondContact OD1-N 2.83Å; L2307-G2309 VanDerWaalsContact C-N 3.28Å; L2307-G2309 PolarHBondContact O-N 2.84Å; L2307-V2310 WeakPolarHBondContact O-CB 3.5Å; L2307-V2310 PolarHBondContact O-N 2.87Å; L2307-E2311 PolarHBondContact O-N 2.8Å
2308	M	59.3	Low	59.3	Low	52 Å²	52	22.5 Å²	22.5	26%	0.256	14%	0.135	S	C	.	.	H	α-helix	trans	-57.3	-41.4	-179.2	-64.1	176	168.2	0	0	111.7	I2284 L2285 L2304 D2305 V2310 E2311 I2312	I2284-M2308 HydrophobicContact CG2-CB 4.12Å; L2285-M2308 HydrophobicContact CD2-SD 4.03Å; L2304-M2308 HydrophobicContact CD1-CB 3.56Å; L2304-M2308 HydrophobicContact CG-CB 4.04Å; D2305-M2308 PolarHBondContact OD1-N 2.98Å; M2308-V2310 PolarHBondContact O-N 2.88Å; M2308-E2311 PolarHBondContact O-N 2.92Å; M2308-I2312 WeakPolarHBondContact O-CG1 3.41Å; M2308-I2312 PolarHBondContact O-N 2.83Å
2309	G	62.7	Low	59.3	Low	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.9	-27.6	178.8	0	0	0	0	0	114	D2305 L2307 K2313	D2305-G2309 PolarHBondContact O-N 3.03Å; L2307-G2309 VanDerWaalsContact C-N 3.28Å; L2307-G2309 PolarHBondContact O-N 2.84Å; G2309-K2313 PolarHBondContact O-N 3.14Å
2310	V	59.9	Low	59	Low	5 Å²	5	26.7 Å²	26.7	3%	0.03	16%	0.155	C	C	.	.	H	α-helix	trans	-79.3	-35.5	177.2	176.7	0	0	0	0	110.8	N2179 S2306 L2307 M2308 I2312 K2313 Q2314 M2326	N2179-V2310 WeakPolarHBondContact OD1-CG1 3.48Å; S2306-V2310 WeakPolarHBondContact O-CG2 3.26Å; L2307-V2310 WeakPolarHBondContact O-CB 3.5Å; L2307-V2310 PolarHBondContact O-N 2.87Å; M2308-V2310 PolarHBondContact O-N 2.88Å; V2310-I2312 VanDerWaalsContact C-N 3.32Å; V2310-K2313 WeakPolarHBondContact O-CB 3.14Å; V2310-K2313 PolarHBondContact O-N 2.78Å; V2310-Q2314 WeakPolarHBondContact O-CB 3.23Å; V2310-Q2314 VanDerWaalsContact O-CG 3.29Å; V2310-Q2314 WeakPolarHBondContact O-CG 3.46Å; V2310-Q2314 PolarHBondContact O-N 2.87Å; V2310-M2326 HydrophobicContact CG2-CE 3.69Å; V2310-M2326 HydrophobicContact CG2-SD 3.67Å
2311	E	62.5	Low	58.7	Low	14 Å²	14	30.6 Å²	30.6	7%	0.065	17%	0.17	C	C	.	.	H	α-helix	trans	-66.6	-34.9	172.4	-157.7	162.5	-107.8	0	0	111.6	T2229 I2284 L2307 M2308 T2315	T2229-E2311 WeakPolarHBondContact CG2-OE1 3.41Å; I2284-E2311 HydrophobicContact CD1-CB 4.42Å; I2284-E2311 HydrophobicContact CD1-CG 4.06Å; I2284-E2311 HydrophobicContact CG1-CG 4.1Å; I2284-E2311 HydrophobicContact CG2-CB 4.04Å; I2284-E2311 HydrophobicContact CG2-CG 4.33Å; L2307-E2311 PolarHBondContact O-N 2.8Å; M2308-E2311 PolarHBondContact O-N 2.92Å; E2311-T2315 VanDerWaalsContact O-CB 3.29Å; E2311-T2315 WeakPolarHBondContact O-CB 3.43Å; E2311-T2315 PolarHBondContact O-N 2.72Å; E2311-T2315 PolarHBondContact O-OG1 2.72Å
2312	I	67.7	Low	58.9	Low	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-66.8	-47.2	168.2	-65.5	-173.7	0	0	0	111.8	I2281 I2284 L2299 L2304 M2308 V2310 Q2314 T2315 L2316 I2329	I2281-I2312 HydrophobicContact CB-CD1 4.48Å; I2281-I2312 HydrophobicContact CD1-CG1 4.42Å; I2281-I2312 HydrophobicContact CD1-CG2 3.85Å; I2281-I2312 HydrophobicContact CG1-CD1 4.34Å; I2281-I2312 HydrophobicContact CG1-CG1 4.15Å; I2281-I2312 HydrophobicContact CG1-CG2 4.47Å; I2281-I2312 HydrophobicContact CG2-CD1 3.58Å; I2281-I2312 HydrophobicContact CG2-CG1 4.28Å; I2284-I2312 HydrophobicContact CD1-CG1 4.18Å; I2284-I2312 HydrophobicContact CG2-CG1 3.96Å; L2299-I2312 HydrophobicContact CB-CD1 4.42Å; L2299-I2312 HydrophobicContact CD1-CD1 3.83Å; L2299-I2312 HydrophobicContact CD1-CG2 4.18Å; L2299-I2312 HydrophobicContact CD2-CD1 4.12Å; L2299-I2312 HydrophobicContact CG-CD1 4.34Å; L2304-I2312 HydrophobicContact CD1-CD1 3.36Å; L2304-I2312 HydrophobicContact CD1-CG1 4.17Å; M2308-I2312 WeakPolarHBondContact O-CG1 3.41Å; M2308-I2312 PolarHBondContact O-N 2.83Å; V2310-I2312 VanDerWaalsContact C-N 3.32Å; I2312-Q2314 VanDerWaalsContact C-N 3.32Å; I2312-Q2314 PolarHBondContact O-N 3.07Å; I2312-T2315 PolarHBondContact O-N 3.28Å; I2312-T2315 VanDerWaalsContact O-N 3.14Å; I2312-L2316 HydrophobicContact CG2-CD1 3.91Å; I2312-L2316 HydrophobicContact CG2-CG 4.48Å; I2312-L2316 PolarHBondContact O-N 2.96Å; I2312-I2329 HydrophobicContact CB-CG2 4.12Å; I2312-I2329 HydrophobicContact CG2-CG2 3.7Å
2313	K	69.1	Low	58.9	Low	7 Å²	7	30 Å²	30	3%	0.03	17%	0.17	C	C	.	.	H	α-helix	trans	-52.1	-52.6	175.8	-174.6	174.8	-177.7	-74.6	0	110.9	E1611 G2309 V2310 T2315 L2316 E2317 L2324 M2326 I2329	E1611-K2313 IonicContact OE2-NZ 2.73Å; G2309-K2313 PolarHBondContact O-N 3.14Å; V2310-K2313 WeakPolarHBondContact O-CB 3.14Å; V2310-K2313 PolarHBondContact O-N 2.78Å; K2313-T2315 VanDerWaalsContact C-N 3.29Å; K2313-T2315 PolarHBondContact O-N 3.33Å; K2313-L2316 PolarHBondContact O-N 3.49Å; K2313-E2317 VanDerWaalsContact CE-OE1 3.31Å; K2313-E2317 WeakPolarHBondContact CE-OE1 3.27Å; K2313-E2317 HydrophobicContact CG-CG 4.46Å; K2313-E2317 VanDerWaalsContact NZ-CD 3.27Å; K2313-E2317 IonicContact NZ-OE1 2.83Å; K2313-E2317 PolarHBondContact NZ-OE1 2.95Å; K2313-E2317 IonicContact NZ-OE2 3.88Å; K2313-E2317 PolarHBondContact NZ-OE2 2.94Å; K2313-E2317 VanDerWaalsContact NZ-OE2 3.09Å; K2313-E2317 WeakPolarHBondContact O-CB 3.35Å; K2313-E2317 WeakPolarHBondContact O-CG 3.3Å; K2313-E2317 PolarHBondContact O-N 2.83Å; K2313-L2324 WeakPolarHBondContact CE-O 3.47Å; K2313-M2326 HydrophobicContact CB-SD 4.39Å; K2313-M2326 HydrophobicContact CD-SD 4.34Å; K2313-I2329 VanDerWaalsContact CA-CD1 3.49Å; K2313-I2329 HydrophobicContact CB-CD1 3.4Å; K2313-I2329 VanDerWaalsContact CB-CD1 3.4Å; K2313-I2329 HydrophobicContact CD-CD1 4.29Å; K2313-I2329 HydrophobicContact CG-CD1 3.65Å
2314	Q	62	Low	59.7	Low	10 Å²	10	28.2 Å²	28.2	5%	0.047	15%	0.147	C	C	.	.	H	α-helix	trans	-68.7	-27.7	-177.7	-68.3	167.8	6.4	0	0	112.6	L1405 N2179 V2310 I2312 R2318	L1405-Q2314 HydrophobicContact CD2-CG 4.11Å; N2179-Q2314 PolarHBondContact OD1-NE2 3.02Å; V2310-Q2314 WeakPolarHBondContact O-CB 3.23Å; V2310-Q2314 VanDerWaalsContact O-CG 3.29Å; V2310-Q2314 WeakPolarHBondContact O-CG 3.46Å; V2310-Q2314 PolarHBondContact O-N 2.87Å; I2312-Q2314 VanDerWaalsContact C-N 3.32Å; I2312-Q2314 PolarHBondContact O-N 3.07Å; Q2314-R2318 WeakPolarHBondContact O-CB 3.39Å; Q2314-R2318 PolarHBondContact O-N 3.27Å
2315	T	61.3	Low	59.7	Low	5 Å²	5	28.6 Å²	28.6	3%	0.031	15%	0.15	C	C	.	.	H	α-helix	trans	-72.8	-42.7	173.2	-63.5	0	0	0	0	111.7	T2280 E2311 I2312 K2313 D2319 Y2320	T2280-T2315 HydrophobicContact CG2-CG2 3.82Å; E2311-T2315 VanDerWaalsContact O-CB 3.29Å; E2311-T2315 WeakPolarHBondContact O-CB 3.43Å; E2311-T2315 PolarHBondContact O-N 2.72Å; E2311-T2315 PolarHBondContact O-OG1 2.72Å; I2312-T2315 PolarHBondContact O-N 3.28Å; I2312-T2315 VanDerWaalsContact O-N 3.14Å; K2313-T2315 VanDerWaalsContact C-N 3.29Å; K2313-T2315 PolarHBondContact O-N 3.33Å; T2315-D2319 WeakPolarHBondContact O-CB 3.3Å; T2315-D2319 PolarHBondContact O-N 3.3Å; T2315-Y2320 HydrophobicContact CG2-CE2 4.49Å
2316	L	63.9	Low	60	Low	1 Å²	1	25.2 Å²	25.2	1%	0.005	13%	0.132	C	C	.	.	I	π-helix	trans	-62.3	-48.3	174.6	-82.1	167.2	0	0	0	112.2	I2277 I2312 K2313 Y2320 D2321 V2322 L2324 I2329 L2332 L2337	I2277-L2316 HydrophobicContact CD1-CD2 3.73Å; I2312-L2316 HydrophobicContact CG2-CD1 3.91Å; I2312-L2316 HydrophobicContact CG2-CG 4.48Å; I2312-L2316 PolarHBondContact O-N 2.96Å; K2313-L2316 PolarHBondContact O-N 3.49Å; L2316-Y2320 CarbonylContact O-C 3.48Å; L2316-Y2320 PolarHBondContact O-N 3.02Å; L2316-Y2320 VanDerWaalsContact O-N 3.16Å; L2316-D2321 PolarHBondContact O-N 3.03Å; L2316-V2322 CarbonylContact C-O 3.56Å; L2316-V2322 HydrophobicContact CB-CB 4.16Å; L2316-V2322 HydrophobicContact CB-CG1 4.44Å; L2316-V2322 HydrophobicContact CD2-CB 4.05Å; L2316-V2322 HydrophobicContact CD2-CG1 4.1Å; L2316-V2322 PolarHBondContact O-N 3.32Å; L2316-V2322 VanDerWaalsContact O-N 3.09Å; L2316-L2324 HydrophobicContact CD1-CD1 4.47Å; L2316-I2329 HydrophobicContact CD1-CG1 4.36Å; L2316-L2332 HydrophobicContact CD1-CD1 3.75Å; L2316-L2337 HydrophobicContact CD1-CD2 3.96Å; L2316-L2337 HydrophobicContact CD2-CD2 3.77Å; L2316-L2337 HydrophobicContact CG-CD2 4.2Å
2317	E	61.5	Low	60.2	Low	17 Å²	17	30.4 Å²	30.4	8%	0.079	15%	0.152	C	C	.	.	I	π-helix	trans	-64.5	-44.3	178.4	-69.3	175.3	154.2	0	0	111.5	K1407 K2313 V2322 V2323	K1407-E2317 PolarHBondContact NZ-O 3.38Å; K2313-E2317 VanDerWaalsContact CE-OE1 3.31Å; K2313-E2317 WeakPolarHBondContact CE-OE1 3.27Å; K2313-E2317 HydrophobicContact CG-CG 4.46Å; K2313-E2317 VanDerWaalsContact NZ-CD 3.27Å; K2313-E2317 IonicContact NZ-OE1 2.83Å; K2313-E2317 PolarHBondContact NZ-OE1 2.95Å; K2313-E2317 IonicContact NZ-OE2 3.88Å; K2313-E2317 PolarHBondContact NZ-OE2 2.94Å; K2313-E2317 VanDerWaalsContact NZ-OE2 3.09Å; K2313-E2317 WeakPolarHBondContact O-CB 3.35Å; K2313-E2317 WeakPolarHBondContact O-CG 3.3Å; K2313-E2317 PolarHBondContact O-N 2.83Å; E2317-V2322 WeakPolarHBondContact CG-O 3.48Å; E2317-V2322 PolarHBondContact N-O 3.14Å; E2317-V2323 HydrophobicContact CG-CG2 4.26Å
2318	R	58	Low	60.8	Low	25 Å²	25	33 Å²	33	9%	0.094	16%	0.164	C	C	.	.	I	π-helix	trans	-71.1	-55.7	-177.6	-175.8	-169.7	66.7	-120	-0.9	113	K1407 T2265 Q2314	K1407-R2318 VanDerWaalsContact CE-O 3.27Å; K1407-R2318 WeakPolarHBondContact CE-O 3.44Å; K1407-R2318 PolarHBondContact NZ-O 2.68Å; T2265-R2318 HydrophobicContact CG2-CG 3.77Å; Q2314-R2318 WeakPolarHBondContact O-CB 3.39Å; Q2314-R2318 PolarHBondContact O-N 3.27Å
2319	D	57.9	Low	61.2	Low	48 Å²	48	30.6 Å²	30.6	26%	0.257	15%	0.152	S	C	.	.	I	π-helix	trans	-92.5	-25.4	-166.2	-65.1	-18.1	0	0	0	113.2	T2315	T2315-D2319 WeakPolarHBondContact O-CB 3.3Å; T2315-D2319 PolarHBondContact O-N 3.3Å
2320	Y	56.6	Low	61.3	Low	52 Å²	52	33.9 Å²	33.9	20%	0.204	16%	0.164	C	C	.	.	I	π-helix	trans	-124.1	-2.8	-170.6	-56.6	-77.9	0	0	0	114.6	A2275 I2277 T2315 L2316 V2322 V2341	A2275-Y2320 PolarHBondContact O-OH 3.1Å; A2275-Y2320 VanDerWaalsContact O-OH 3.11Å; I2277-Y2320 WeakPolarHBondContact CA-OH 3.45Å; I2277-Y2320 HydrophobicContact CB-CE1 4.31Å; I2277-Y2320 HydrophobicContact CB-CE2 3.97Å; I2277-Y2320 HydrophobicContact CD1-CD2 3.64Å; I2277-Y2320 HydrophobicContact CD1-CE2 3.59Å; I2277-Y2320 HydrophobicContact CD1-CG 4.16Å; I2277-Y2320 HydrophobicContact CG1-CD2 4.22Å; I2277-Y2320 HydrophobicContact CG1-CE2 3.64Å; T2315-Y2320 HydrophobicContact CG2-CE2 4.49Å; L2316-Y2320 CarbonylContact O-C 3.48Å; L2316-Y2320 PolarHBondContact O-N 3.02Å; L2316-Y2320 VanDerWaalsContact O-N 3.16Å; Y2320-V2322 VanDerWaalsContact C-N 3.31Å; Y2320-V2322 PolarHBondContact O-N 2.79Å; Y2320-V2341 HydrophobicContact CD1-CB 4.27Å; Y2320-V2341 HydrophobicContact CD1-CG1 3.85Å; Y2320-V2341 HydrophobicContact CD1-CG2 3.4Å; Y2320-V2341 HydrophobicContact CD2-CG2 4.48Å; Y2320-V2341 HydrophobicContact CE1-CB 4.45Å; Y2320-V2341 HydrophobicContact CE1-CG1 3.74Å; Y2320-V2341 HydrophobicContact CE1-CG2 3.75Å; Y2320-V2341 HydrophobicContact CG-CG2 3.8Å
2321	D	53.2	Low	61.5	Low	107 Å²	107	34.4 Å²	34.4	57%	0.572	17%	0.17	S	C	*	.			trans	68.2	23.3	178.6	-127.4	33.2	0	0	0	114.8	K1407 L2316	K1407-D2321 WeakPolarHBondContact CD-OD1 3.45Å; K1407-D2321 WeakPolarHBondContact CE-OD1 3.47Å; K1407-D2321 IonicContact NZ-OD1 3.83Å; K1407-D2321 PolarHBondContact NZ-OD1 2.98Å; L2316-D2321 PolarHBondContact O-N 3.03Å
2322	V	58.1	Low	61.7	Low	28 Å²	28	34.4 Å²	34.4	17%	0.17	17%	0.171	C	C	.	.			trans	-103.8	106.6	-172.4	174.2	0	0	0	0	110.6	L2316 E2317 Y2320 L2324 I2340	L2316-V2322 CarbonylContact C-O 3.56Å; L2316-V2322 HydrophobicContact CB-CB 4.16Å; L2316-V2322 HydrophobicContact CB-CG1 4.44Å; L2316-V2322 HydrophobicContact CD2-CB 4.05Å; L2316-V2322 HydrophobicContact CD2-CG1 4.1Å; L2316-V2322 PolarHBondContact O-N 3.32Å; L2316-V2322 VanDerWaalsContact O-N 3.09Å; E2317-V2322 WeakPolarHBondContact CG-O 3.48Å; E2317-V2322 PolarHBondContact N-O 3.14Å; Y2320-V2322 VanDerWaalsContact C-N 3.31Å; Y2320-V2322 PolarHBondContact O-N 2.79Å; V2322-L2324 HydrophobicContact CG1-CD1 3.67Å; V2322-L2324 HydrophobicContact CG1-CG 3.83Å; V2322-I2340 HydrophobicContact CB-CG2 4.36Å; V2322-I2340 HydrophobicContact CG1-CG2 4.11Å; V2322-I2340 HydrophobicContact CG2-CG2 3.41Å; V2322-I2340 VanDerWaalsContact CG2-CG2 3.41Å
2323	V	56.4	Low	62	Low	58 Å²	58	34.6 Å²	34.6	35%	0.352	17%	0.172	S	C	.	.			trans	-90	116.4	174.8	-178.6	0	0	0	0	109.7	E2317	E2317-V2323 HydrophobicContact CG-CG2 4.26Å
2324	L	61.5	Low	62	Low	20 Å²	20	34.2 Å²	34.2	11%	0.105	17%	0.17	C	C	.	.			trans	-138.6	148.1	177.6	-71.2	172.4	0	0	0	110.6	K2313 L2316 V2322 E2328 I2329 L2332 I2340	K2313-L2324 WeakPolarHBondContact CE-O 3.47Å; L2316-L2324 HydrophobicContact CD1-CD1 4.47Å; V2322-L2324 HydrophobicContact CG1-CD1 3.67Å; V2322-L2324 HydrophobicContact CG1-CG 3.83Å; L2324-E2328 HydrophobicContact CB-CB 4.24Å; L2324-E2328 HydrophobicContact CD2-CB 4.19Å; L2324-I2329 HydrophobicContact CB-CD1 4.04Å; L2324-I2329 HydrophobicContact CB-CG1 3.78Å; L2324-I2329 WeakPolarHBondContact O-CD1 3.42Å; L2324-L2332 HydrophobicContact CD1-CD1 3.85Å; L2324-L2332 HydrophobicContact CD1-CD2 4.17Å; L2324-L2332 HydrophobicContact CD1-CG 4.34Å; L2324-I2340 HydrophobicContact CD1-CD1 4.44Å
2325	S	59	Low	62.1	Low	14 Å²	14	34.5 Å²	34.5	10%	0.098	17%	0.172	C	C	.	.			trans	-72.1	160.3	175.6	70.9	0	0	0	0	112.2	S1614 K2327 E2328 I2329	S1614-S2325 WeakPolarHBondContact OG-CA 3.5Å; S1614-S2325 WeakPolarHBondContact OG-CB 3.48Å; S1614-S2325 PolarHBondContact OG-N 3.44Å; S2325-K2327 PolarHBondContact O-N 3.44Å; S2325-K2327 VanDerWaalsContact O-N 3.11Å; S2325-K2327 PolarHBondContact OG-N 3.2Å; S2325-E2328 WeakPolarHBondContact CA-OE2 3.46Å; S2325-E2328 WeakPolarHBondContact CB-OE2 3.36Å; S2325-E2328 PolarHBondContact N-OE2 3.29Å; S2325-E2328 PolarHBondContact O-N 2.84Å; S2325-E2328 VanDerWaalsContact O-N 3.13Å; S2325-E2328 WeakPolarHBondContact OG-CG 3.49Å; S2325-E2328 PolarHBondContact OG-N 2.76Å; S2325-E2328 PolarHBondContact OG-OE2 2.83Å; S2325-I2329 WeakPolarHBondContact O-CG1 3.36Å; S2325-I2329 PolarHBondContact O-N 2.69Å
2326	M	61.6	Low	62.2	Low	5 Å²	5	37 Å²	37	3%	0.025	18%	0.182	C	C	.	.	H	α-helix	trans	-59.7	-22.9	173.4	-73.4	-62.8	-61.7	0	0	113.3	L2129 V2310 K2313 R2330	L2129-M2326 HydrophobicContact CD1-CB 4.24Å; L2129-M2326 HydrophobicContact CD2-CB 3.98Å; L2129-M2326 HydrophobicContact CD2-CE 4.19Å; L2129-M2326 HydrophobicContact CD2-CG 3.94Å; V2310-M2326 HydrophobicContact CG2-CE 3.69Å; V2310-M2326 HydrophobicContact CG2-SD 3.67Å; K2313-M2326 HydrophobicContact CB-SD 4.39Å; K2313-M2326 HydrophobicContact CD-SD 4.34Å; M2326-R2330 WeakPolarHBondContact O-CB 3.29Å; M2326-R2330 WeakPolarHBondContact O-CG 3.18Å; M2326-R2330 PolarHBondContact O-N 2.74Å; M2326-R2330 VanDerWaalsContact O-N 3.09Å
2327	K	60.1	Low	62.1	Low	126 Å²	126	37 Å²	37	55%	0.548	18%	0.182	S	C	.	.	H	α-helix	trans	-77.2	-42.1	176.7	-157.2	164.3	-171.5	161.7	0	111.1	F1584 S2325 G2331	F1584-K2327 HydrophobicContact CE1-CD 4.44Å; S2325-K2327 PolarHBondContact O-N 3.44Å; S2325-K2327 VanDerWaalsContact O-N 3.11Å; S2325-K2327 PolarHBondContact OG-N 3.2Å; K2327-G2331 PolarHBondContact O-N 3Å; K2327-G2331 VanDerWaalsContact O-N 3.15Å
2328	E	65.3	Low	62.1	Low	100 Å²	100	38.6 Å²	38.6	47%	0.467	19%	0.193	S	C	.	.	H	α-helix	trans	-68.4	-39	172.6	-70	154.2	130.2	0	0	111.9	L2324 S2325 G2331 L2332	L2324-E2328 HydrophobicContact CB-CB 4.24Å; L2324-E2328 HydrophobicContact CD2-CB 4.19Å; S2325-E2328 WeakPolarHBondContact CA-OE2 3.46Å; S2325-E2328 WeakPolarHBondContact CB-OE2 3.36Å; S2325-E2328 PolarHBondContact N-OE2 3.29Å; S2325-E2328 PolarHBondContact O-N 2.84Å; S2325-E2328 VanDerWaalsContact O-N 3.13Å; S2325-E2328 WeakPolarHBondContact OG-CG 3.49Å; S2325-E2328 PolarHBondContact OG-N 2.76Å; S2325-E2328 PolarHBondContact OG-OE2 2.83Å; E2328-G2331 CarbonylContact O-C 3.41Å; E2328-G2331 WeakPolarHBondContact O-CA 3.33Å; E2328-G2331 PolarHBondContact O-N 2.96Å; E2328-L2332 PolarHBondContact O-N 2.86Å
2329	I	66.6	Low	62.1	Low	1 Å²	1	40.5 Å²	40.5	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-70.3	-39.2	179.4	-69	165.4	0	0	0	112.1	I2312 K2313 L2316 L2324 S2325 G2331 L2332	I2312-I2329 HydrophobicContact CB-CG2 4.12Å; I2312-I2329 HydrophobicContact CG2-CG2 3.7Å; K2313-I2329 VanDerWaalsContact CA-CD1 3.49Å; K2313-I2329 HydrophobicContact CB-CD1 3.4Å; K2313-I2329 VanDerWaalsContact CB-CD1 3.4Å; K2313-I2329 HydrophobicContact CD-CD1 4.29Å; K2313-I2329 HydrophobicContact CG-CD1 3.65Å; L2316-I2329 HydrophobicContact CD1-CG1 4.36Å; L2324-I2329 HydrophobicContact CB-CD1 4.04Å; L2324-I2329 HydrophobicContact CB-CG1 3.78Å; L2324-I2329 WeakPolarHBondContact O-CD1 3.42Å; S2325-I2329 WeakPolarHBondContact O-CG1 3.36Å; S2325-I2329 PolarHBondContact O-N 2.69Å; I2329-G2331 PolarHBondContact O-N 3.31Å; I2329-L2332 HydrophobicContact CG1-CD1 4.16Å; I2329-L2332 PolarHBondContact O-N 3.42Å
2330	R	66.1	Low	62.2	Low	68 Å²	68	40.9 Å²	40.9	26%	0.257	21%	0.205	S	C	.	.	H	α-helix	trans	-58.8	-29.4	164.8	-82.1	176.6	141.3	-173.3	-8.7	111.6	E2131 R2298 G2300 L2304 M2326	E2131-R2330 IonicContact OE1-NH1 2.94Å; R2298-R2330 WeakPolarHBondContact CD-O 3.39Å; R2298-R2330 WeakPolarHBondContact CG-O 3.32Å; G2300-R2330 PolarHBondContact N-O 2.94Å; L2304-R2330 HydrophobicContact CD2-CG 4.14Å; M2326-R2330 WeakPolarHBondContact O-CB 3.29Å; M2326-R2330 WeakPolarHBondContact O-CG 3.18Å; M2326-R2330 PolarHBondContact O-N 2.74Å; M2326-R2330 VanDerWaalsContact O-N 3.09Å
2331	G	63.9	Low	61.9	Low	16 Å²	16	40.5 Å²	40.5	17%	0.165	21%	0.208	C	C	.	.	H	α-helix	trans	-70.1	-36.8	175.6	0	0	0	0	0	116	K2327 E2328 I2329 L2505	K2327-G2331 PolarHBondContact O-N 3Å; K2327-G2331 VanDerWaalsContact O-N 3.15Å; E2328-G2331 CarbonylContact O-C 3.41Å; E2328-G2331 WeakPolarHBondContact O-CA 3.33Å; E2328-G2331 PolarHBondContact O-N 2.96Å; I2329-G2331 PolarHBondContact O-N 3.31Å; G2331-L2505 VanDerWaalsContact O-CD2 3.23Å; G2331-L2505 WeakPolarHBondContact O-CD2 3.48Å; G2331-L2505 WeakPolarHBondContact O-CG 3.46Å
2332	L	66.4	Low	61.7	Low	15 Å²	15	39.6 Å²	39.6	8%	0.079	21%	0.21	C	C	.	.			trans	-61.5	158.9	-174.3	-70.2	174	0	0	0	114.3	R2298 L2299 L2316 L2324 E2328 I2329 K2336 L2337 I2340	R2298-L2332 CarbonylContact C-O 3.58Å; R2298-L2332 VanDerWaalsContact CA-O 3.3Å; R2298-L2332 WeakPolarHBondContact CA-O 3.2Å; L2299-L2332 HydrophobicContact CD1-CB 3.65Å; L2299-L2332 HydrophobicContact CD1-CD1 4.33Å; L2299-L2332 HydrophobicContact CG-CB 4.34Å; L2299-L2332 WeakPolarHBondContact CG-O 3.48Å; L2299-L2332 PolarHBondContact N-O 2.96Å; L2316-L2332 HydrophobicContact CD1-CD1 3.75Å; L2324-L2332 HydrophobicContact CD1-CD1 3.85Å; L2324-L2332 HydrophobicContact CD1-CD2 4.17Å; L2324-L2332 HydrophobicContact CD1-CG 4.34Å; E2328-L2332 PolarHBondContact O-N 2.86Å; I2329-L2332 HydrophobicContact CG1-CD1 4.16Å; I2329-L2332 PolarHBondContact O-N 3.42Å; L2332-K2336 HydrophobicContact CD2-CB 4.2Å; L2332-K2336 HydrophobicContact CD2-CG 4.36Å; L2332-L2337 HydrophobicContact CD1-CD2 3.89Å; L2332-L2337 HydrophobicContact CD1-CG 4.49Å; L2332-I2340 HydrophobicContact CD2-CD1 3.77Å
2333	T	74.5	Confident	61	Low	3 Å²	3	43.9 Å²	43.9	2%	0.018	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-116.9	167.4	167.9	86.9	0	0	0	0	111.5	Q2295 N2335 K2336 L2337 L2505	Q2295-T2333 WeakPolarHBondContact O-CB 3.49Å; Q2295-T2333 PolarHBondContact O-OG1 3.17Å; T2333-N2335 VanDerWaalsContact C-N 3.34Å; T2333-N2335 WeakPolarHBondContact OG1-CB 3.41Å; T2333-N2335 PolarHBondContact OG1-N 3.04Å; T2333-K2336 HydrophobicContact CG2-CB 4.48Å; T2333-K2336 PolarHBondContact O-N 3.07Å; T2333-K2336 PolarHBondContact OG1-N 3.04Å; T2333-L2337 WeakPolarHBondContact O-CD1 3.4Å; T2333-L2337 VanDerWaalsContact O-CG 3.23Å; T2333-L2337 WeakPolarHBondContact O-CG 3.37Å; T2333-L2337 PolarHBondContact O-N 3.48Å; T2333-L2505 HydrophobicContact CG2-CD1 3.26Å; T2333-L2505 HydrophobicContact CG2-CD2 3.19Å; T2333-L2505 HydrophobicContact CG2-CG 3.76Å
2334	L	67.7	Low	60.1	Low	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59.2	-41.7	169.1	-82.6	167.9	0	0	0	111.7	M2278 I2281 L2290 V2293 Q2295 L2299 L2302 L2337 V2338	M2278-L2334 HydrophobicContact CB-CD2 4.43Å; M2278-L2334 HydrophobicContact CE-CB 4.42Å; M2278-L2334 HydrophobicContact SD-CB 3.56Å; M2278-L2334 VanDerWaalsContact SD-CB 3.56Å; M2278-L2334 HydrophobicContact SD-CD2 3.77Å; M2278-L2334 HydrophobicContact SD-CG 4.21Å; M2278-L2334 VanDerWaalsContact SD-O 3.33Å; I2281-L2334 HydrophobicContact CG2-CD2 4.07Å; L2290-L2334 HydrophobicContact CD2-CD1 4.07Å; L2290-L2334 HydrophobicContact CD2-CD2 4.33Å; V2293-L2334 HydrophobicContact CG1-CD1 4.08Å; Q2295-L2334 HydrophobicContact CB-CB 4.21Å; Q2295-L2334 WeakPolarHBondContact O-CB 3.31Å; Q2295-L2334 PolarHBondContact O-N 3.32Å; L2299-L2334 HydrophobicContact CD2-CG 4.48Å; L2302-L2334 HydrophobicContact CD1-CD1 4.14Å; L2334-L2337 HydrophobicContact CD2-CD1 4.37Å; L2334-L2337 WeakPolarHBondContact O-CB 3.43Å; L2334-L2337 PolarHBondContact O-N 2.75Å; L2334-V2338 PolarHBondContact O-N 3.24Å
2335	N	64	Low	58.7	Low	16 Å²	16	55.1 Å²	55.1	9%	0.086	29%	0.287	C	S	.	.	H	α-helix	trans	-61.4	-45.9	170.3	-88.4	-34.3	0	0	0	113	Q2295 D2296 T2333 L2337 V2338 E2339 D2614	Q2295-N2335 PolarHBondContact O-N 3.28Å; D2296-N2335 VanDerWaalsContact CG-ND2 3.31Å; D2296-N2335 WeakPolarHBondContact OD1-CB 3.21Å; D2296-N2335 PolarHBondContact OD1-ND2 2.9Å; D2296-N2335 PolarHBondContact OD2-ND2 2.86Å; T2333-N2335 VanDerWaalsContact C-N 3.34Å; T2333-N2335 WeakPolarHBondContact OG1-CB 3.41Å; T2333-N2335 PolarHBondContact OG1-N 3.04Å; N2335-L2337 PolarHBondContact O-N 2.75Å; N2335-V2338 WeakPolarHBondContact O-CB 3.5Å; N2335-V2338 PolarHBondContact O-N 3.03Å; N2335-E2339 PolarHBondContact O-N 3.05Å; N2335-D2614 PolarHBondContact ND2-OD1 3.23Å
2336	K	63.1	Low	57.4	Low	57 Å²	57	57 Å²	57	25%	0.248	31%	0.308	C	S	.	.	H	α-helix	trans	-61.5	-32.9	-179.4	-132.2	70.1	-169.1	151.6	0	112.1	L2332 T2333 E2339 I2340 D2360	L2332-K2336 HydrophobicContact CD2-CB 4.2Å; L2332-K2336 HydrophobicContact CD2-CG 4.36Å; T2333-K2336 HydrophobicContact CG2-CB 4.48Å; T2333-K2336 PolarHBondContact O-N 3.07Å; T2333-K2336 PolarHBondContact OG1-N 3.04Å; K2336-E2339 WeakPolarHBondContact CE-OE2 3.49Å; K2336-E2339 IonicContact NZ-OE2 2.73Å; K2336-E2339 PolarHBondContact NZ-OE2 3.02Å; K2336-E2339 WeakPolarHBondContact O-CB 3.36Å; K2336-E2339 PolarHBondContact O-N 2.99Å; K2336-I2340 WeakPolarHBondContact O-CD1 3.49Å; K2336-I2340 VanDerWaalsContact O-CG1 3.25Å; K2336-I2340 WeakPolarHBondContact O-CG1 3.39Å; K2336-I2340 PolarHBondContact O-N 3.18Å; K2336-I2340 VanDerWaalsContact O-N 3.08Å; K2336-D2360 WeakPolarHBondContact CE-OD2 3.46Å; K2336-D2360 IonicContact NZ-OD1 3.75Å; K2336-D2360 PolarHBondContact NZ-OD1 3.32Å; K2336-D2360 IonicContact NZ-OD2 3.74Å; K2336-D2360 PolarHBondContact NZ-OD2 3.26Å
2337	L	63.3	Low	55.8	Low	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-66	-41	172.6	-70.8	159.8	0	0	0	112.6	I2277 I2281 L2299 L2316 L2332 T2333 L2334 N2335 E2339 V2341	I2277-L2337 HydrophobicContact CD1-CB 4.21Å; I2277-L2337 HydrophobicContact CD1-CD2 3.88Å; I2277-L2337 HydrophobicContact CG2-CB 4.2Å; I2281-L2337 HydrophobicContact CB-CD1 4.35Å; I2281-L2337 HydrophobicContact CD1-CD1 3.41Å; I2281-L2337 VanDerWaalsContact CD1-CD1 3.41Å; I2281-L2337 HydrophobicContact CD1-CD2 3.54Å; I2281-L2337 HydrophobicContact CD1-CG 4.06Å; I2281-L2337 HydrophobicContact CG1-CD1 4.44Å; I2281-L2337 HydrophobicContact CG2-CD1 3.93Å; L2299-L2337 HydrophobicContact CD1-CD1 3.88Å; L2299-L2337 HydrophobicContact CD2-CD1 4.04Å; L2299-L2337 HydrophobicContact CG-CD1 4.46Å; L2316-L2337 HydrophobicContact CD1-CD2 3.96Å; L2316-L2337 HydrophobicContact CD2-CD2 3.77Å; L2316-L2337 HydrophobicContact CG-CD2 4.2Å; L2332-L2337 HydrophobicContact CD1-CD2 3.89Å; L2332-L2337 HydrophobicContact CD1-CG 4.49Å; T2333-L2337 WeakPolarHBondContact O-CD1 3.4Å; T2333-L2337 VanDerWaalsContact O-CG 3.23Å; T2333-L2337 WeakPolarHBondContact O-CG 3.37Å; T2333-L2337 PolarHBondContact O-N 3.48Å; L2334-L2337 HydrophobicContact CD2-CD1 4.37Å; L2334-L2337 WeakPolarHBondContact O-CB 3.43Å; L2334-L2337 PolarHBondContact O-N 2.75Å; N2335-L2337 PolarHBondContact O-N 2.75Å; L2337-E2339 VanDerWaalsContact C-N 3.33Å; L2337-V2341 WeakPolarHBondContact O-CG2 3.47Å; L2337-V2341 PolarHBondContact O-N 3.49Å
2338	V	60.1	Low	54.2	Low	52 Å²	52	59.6 Å²	59.6	32%	0.315	33%	0.329	S	S	.	.	H	α-helix	trans	-64.2	-40.9	174.3	176.2	0	0	0	0	110.9	M2278 L2334 N2335 V2341 S2342	M2278-V2338 HydrophobicContact CG-CG2 3.4Å; M2278-V2338 HydrophobicContact SD-CG2 3.68Å; L2334-V2338 PolarHBondContact O-N 3.24Å; N2335-V2338 WeakPolarHBondContact O-CB 3.5Å; N2335-V2338 PolarHBondContact O-N 3.03Å; V2338-V2341 PolarHBondContact O-N 3.08Å; V2338-S2342 WeakPolarHBondContact O-CB 3.22Å; V2338-S2342 PolarHBondContact O-N 2.91Å; V2338-S2342 PolarHBondContact O-OG 2.9Å
2339	E	59.1	Low	52.3	Low	65 Å²	65	58.8 Å²	58.8	30%	0.304	33%	0.331	S	S	.	.	H	α-helix	trans	-61.5	-48.4	-179.8	-146.8	143.9	-105.5	0	0	111.8	N2335 K2336 L2337 V2341 S2342 R2611	N2335-E2339 PolarHBondContact O-N 3.05Å; K2336-E2339 WeakPolarHBondContact CE-OE2 3.49Å; K2336-E2339 IonicContact NZ-OE2 2.73Å; K2336-E2339 PolarHBondContact NZ-OE2 3.02Å; K2336-E2339 WeakPolarHBondContact O-CB 3.36Å; K2336-E2339 PolarHBondContact O-N 2.99Å; L2337-E2339 VanDerWaalsContact C-N 3.33Å; E2339-V2341 PolarHBondContact O-N 3.22Å; E2339-S2342 PolarHBondContact O-N 3.12Å; E2339-R2611 IonicContact OE1-CZ 2.7Å; E2339-R2611 IonicContact OE1-NH1 2.69Å; E2339-R2611 PolarHBondContact OE1-NH1 2.77Å; E2339-R2611 IonicContact OE1-NH2 2.83Å; E2339-R2611 PolarHBondContact OE1-NH2 2.96Å
2340	I	59.2	Low	50.6	Low	55 Å²	55	64.7 Å²	64.7	28%	0.282	37%	0.367	S	S	.	.	H	α-helix	trans	-58.7	-44.4	175.1	-72.4	166	0	0	0	111.6	V2322 L2324 L2332 K2336 S2342	V2322-I2340 HydrophobicContact CB-CG2 4.36Å; V2322-I2340 HydrophobicContact CG1-CG2 4.11Å; V2322-I2340 HydrophobicContact CG2-CG2 3.41Å; V2322-I2340 VanDerWaalsContact CG2-CG2 3.41Å; L2324-I2340 HydrophobicContact CD1-CD1 4.44Å; L2332-I2340 HydrophobicContact CD2-CD1 3.77Å; K2336-I2340 WeakPolarHBondContact O-CD1 3.49Å; K2336-I2340 VanDerWaalsContact O-CG1 3.25Å; K2336-I2340 WeakPolarHBondContact O-CG1 3.39Å; K2336-I2340 PolarHBondContact O-N 3.18Å; K2336-I2340 VanDerWaalsContact O-N 3.08Å; I2340-S2342 VanDerWaalsContact C-N 3.31Å; I2340-S2342 PolarHBondContact O-N 3.49Å
2341	V	50.1	Low	48.9	Very low	44 Å²	44	66 Å²	66	27%	0.267	38%	0.382	S	S	.	.	H	α-helix	trans	-74.9	-20.2	-178	172.6	0	0	0	0	113.1	I2277 Y2320 L2337 V2338 E2339 N2343 P2344	I2277-V2341 HydrophobicContact CB-CG2 4.12Å; I2277-V2341 HydrophobicContact CD1-CG2 3.53Å; I2277-V2341 HydrophobicContact CG1-CG2 4.41Å; I2277-V2341 HydrophobicContact CG2-CB 4.36Å; I2277-V2341 HydrophobicContact CG2-CG2 3.92Å; Y2320-V2341 HydrophobicContact CD1-CB 4.27Å; Y2320-V2341 HydrophobicContact CD1-CG1 3.85Å; Y2320-V2341 HydrophobicContact CD1-CG2 3.4Å; Y2320-V2341 HydrophobicContact CD2-CG2 4.48Å; Y2320-V2341 HydrophobicContact CE1-CB 4.45Å; Y2320-V2341 HydrophobicContact CE1-CG1 3.74Å; Y2320-V2341 HydrophobicContact CE1-CG2 3.75Å; Y2320-V2341 HydrophobicContact CG-CG2 3.8Å; L2337-V2341 WeakPolarHBondContact O-CG2 3.47Å; L2337-V2341 PolarHBondContact O-N 3.49Å; V2338-V2341 PolarHBondContact O-N 3.08Å; E2339-V2341 PolarHBondContact O-N 3.22Å; V2341-N2343 VanDerWaalsContact C-N 3.27Å; V2341-N2343 PolarHBondContact O-N 3.43Å; V2341-P2344 WeakPolarHBondContact O-CD 3.43Å
2342	S	49	Very low	47.2	Very low	89 Å²	89	71 Å²	71	62%	0.622	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-13.5	-177	-64.9	0	0	0	0	114.2	V2338 E2339 I2340 P2344	V2338-S2342 WeakPolarHBondContact O-CB 3.22Å; V2338-S2342 PolarHBondContact O-N 2.91Å; V2338-S2342 PolarHBondContact O-OG 2.9Å; E2339-S2342 PolarHBondContact O-N 3.12Å; I2340-S2342 VanDerWaalsContact C-N 3.31Å; I2340-S2342 PolarHBondContact O-N 3.49Å; S2342-P2344 VanDerWaalsContact C-CD 3.48Å
2343	N	44.8	Very low	45.5	Very low	117 Å²	117	75.3 Å²	75.3	63%	0.626	42%	0.424	S	S	*	.			trans	-127.6	58.2	-177.9	-163.5	5.6	0	0	0	114.5	V2341 K2345 G2346	V2341-N2343 VanDerWaalsContact C-N 3.27Å; V2341-N2343 PolarHBondContact O-N 3.43Å; N2343-K2345 PolarHBondContact O-N 3.49Å; N2343-G2346 PolarHBondContact O-N 3.36Å
2344	P	35.8	Very low	43.4	Very low	118 Å²	118	77.5 Å²	77.5	77%	0.766	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	22.1	-169.7	35.9	-39.2	0	0	0	114.6	V2341 S2342	V2341-P2344 WeakPolarHBondContact O-CD 3.43Å; S2342-P2344 VanDerWaalsContact C-CD 3.48Å
2345	K	32.4	Very low	41.8	Very low	196 Å²	196	83.7 Å²	83.7	85%	0.852	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.1	-2.3	175.2	-82.5	-165.1	170.3	-168.7	0	114	N2343 K2347	N2343-K2345 PolarHBondContact O-N 3.49Å; K2345-K2347 PolarHBondContact O-N 3.48Å
2346	G	31.4	Very low	40.2	Very low	53 Å²	53	86 Å²	86	55%	0.546	49%	0.486	S	S	.	.			trans	-71.8	96.4	173.7	0	0	0	0	0	111.9	N2343 G2348	N2343-G2346 PolarHBondContact O-N 3.36Å; G2346-G2348 PolarHBondContact O-N 3.36Å
2347	K	27.8	Very low	38.8	Very low	155 Å²	155	88.2 Å²	88.2	67%	0.674	50%	0.499	S	S	*	.			trans	-70.7	44.8	148.9	-90.6	-160.5	166.4	-158.6	0	110.3	H1381 K2345 T2349	H1381-K2347 PolarHBondContact NE2-NZ 2.9Å; H1381-K2347 VanDerWaalsContact NE2-NZ 3.16Å; K2345-K2347 PolarHBondContact O-N 3.48Å; K2347-T2349 PolarHBondContact O-N 3.26Å
2348	G	26.7	Very low	37.6	Very low	32 Å²	32	93 Å²	93	33%	0.33	52%	0.522	S	S	.	.			trans	-71.5	113.1	178.3	0	0	0	0	0	108.5	G2346 E2352	G2346-G2348 PolarHBondContact O-N 3.36Å; G2348-E2352 WeakPolarHBondContact CA-OE2 3.32Å
2349	T	26.1	Very low	36.4	Very low	82 Å²	82	97.1 Å²	97.1	50%	0.503	54%	0.537	S	S	.	.			trans	-53.2	162.5	169.5	58.5	0	0	0	0	110.5	K2347 T2351 E2352	K2347-T2349 PolarHBondContact O-N 3.26Å; T2349-T2351 PolarHBondContact O-N 3.23Å; T2349-T2351 WeakPolarHBondContact OG1-CB 3.39Å; T2349-T2351 PolarHBondContact OG1-OG1 2.98Å; T2349-E2352 PolarHBondContact O-N 2.92Å
2350	V	30.8	Very low	35.4	Very low	125 Å²	125	96.1 Å²	96.1	76%	0.758	53%	0.534	S	S	*	.	H	α-helix	trans	-49.4	-28.4	177.4	-179.4	0	0	0	0	112.3	E2352 L2353 A2354	V2350-E2352 VanDerWaalsContact C-N 3.33Å; V2350-E2352 PolarHBondContact O-N 3.5Å; V2350-L2353 PolarHBondContact O-N 3.28Å; V2350-A2354 VanDerWaalsContact O-CB 3.31Å; V2350-A2354 WeakPolarHBondContact O-CB 3.2Å; V2350-A2354 PolarHBondContact O-N 2.73Å
2351	T	29.9	Very low	34.5	Very low	96 Å²	96	96.5 Å²	96.5	59%	0.589	54%	0.536	S	S	*	.	H	α-helix	trans	-57.1	-30.4	171.2	-10.7	0	0	0	0	116	T2349 K2355	T2349-T2351 PolarHBondContact O-N 3.23Å; T2349-T2351 WeakPolarHBondContact OG1-CB 3.39Å; T2349-T2351 PolarHBondContact OG1-OG1 2.98Å; T2351-K2355 PolarHBondContact O-N 2.81Å
2352	E	29.5	Very low	34.1	Very low	121 Å²	121	100.3 Å²	100.3	57%	0.565	55%	0.549	S	S	*	.	H	α-helix	trans	-89.8	-35.2	176.3	-67.8	-165.6	141.2	0	0	111.9	G2348 T2349 V2350 A2354 K2355 S2356	G2348-E2352 WeakPolarHBondContact CA-OE2 3.32Å; T2349-E2352 PolarHBondContact O-N 2.92Å; V2350-E2352 VanDerWaalsContact C-N 3.33Å; V2350-E2352 PolarHBondContact O-N 3.5Å; E2352-A2354 PolarHBondContact O-N 2.93Å; E2352-K2355 PolarHBondContact O-N 2.71Å; E2352-K2355 VanDerWaalsContact O-N 3.09Å; E2352-S2356 PolarHBondContact O-N 3.03Å
2353	L	29.7	Very low	33.8	Very low	105 Å²	105	100.3 Å²	100.3	55%	0.55	55%	0.546	S	S	.	.	H	α-helix	trans	-60.4	-40	169.9	-143.9	83.2	0	0	0	110.7	V2350 K2355 S2356 M2357	V2350-L2353 PolarHBondContact O-N 3.28Å; L2353-K2355 VanDerWaalsContact C-N 3.34Å; L2353-K2355 PolarHBondContact O-N 2.97Å; L2353-S2356 PolarHBondContact O-N 2.91Å; L2353-M2357 WeakPolarHBondContact O-CB 3.36Å; L2353-M2357 WeakPolarHBondContact O-CG 3.39Å; L2353-M2357 PolarHBondContact O-N 3.44Å
2354	A	31.4	Very low	33.8	Very low	50 Å²	50	96.8 Å²	96.8	41%	0.413	53%	0.526	S	S	.	.	H	α-helix	trans	-62.8	-34.8	173.1	0	0	0	0	0	113.1	V2350 E2352 E2358	V2350-A2354 VanDerWaalsContact O-CB 3.31Å; V2350-A2354 WeakPolarHBondContact O-CB 3.2Å; V2350-A2354 PolarHBondContact O-N 2.73Å; E2352-A2354 PolarHBondContact O-N 2.93Å; A2354-E2358 WeakPolarHBondContact O-CB 3.33Å; A2354-E2358 PolarHBondContact O-N 3.36Å
2355	K	32.8	Very low	34.3	Very low	130 Å²	130	94 Å²	94	57%	0.565	50%	0.504	S	S	*	.	H	α-helix	trans	-73.7	-42.9	175.4	-80.3	-179.1	175.6	-178.4	0	112.9	T2351 E2352 L2353 M2357 E2358 E2359	T2351-K2355 PolarHBondContact O-N 2.81Å; E2352-K2355 PolarHBondContact O-N 2.71Å; E2352-K2355 VanDerWaalsContact O-N 3.09Å; L2353-K2355 VanDerWaalsContact C-N 3.34Å; L2353-K2355 PolarHBondContact O-N 2.97Å; K2355-M2357 VanDerWaalsContact C-N 3.28Å; K2355-M2357 PolarHBondContact O-N 3.09Å; K2355-E2358 WeakPolarHBondContact O-CB 3.41Å; K2355-E2358 PolarHBondContact O-N 2.55Å; K2355-E2358 VanDerWaalsContact O-N 3.09Å; K2355-E2359 PolarHBondContact O-N 3.33Å
2356	S	31.9	Very low	35.1	Very low	63 Å²	63	87.2 Å²	87.2	44%	0.441	49%	0.485	S	S	.	.	H	α-helix	trans	-57.5	-45.1	171.8	-175.1	0	0	0	0	110.4	E2352 L2353 E2359 D2360	E2352-S2356 PolarHBondContact O-N 3.03Å; L2353-S2356 PolarHBondContact O-N 2.91Å; S2356-E2359 PolarHBondContact O-N 2.96Å; S2356-D2360 WeakPolarHBondContact O-CB 3.23Å; S2356-D2360 PolarHBondContact O-N 3.38Å
2357	M	33	Very low	35.9	Very low	105 Å²	105	86.7 Å²	86.7	52%	0.517	47%	0.469	S	S	.	.	H	α-helix	trans	-67.7	-31.2	173.8	-75.1	-176.9	63.4	0	0	113.3	L2353 K2355 L2361	L2353-M2357 WeakPolarHBondContact O-CB 3.36Å; L2353-M2357 WeakPolarHBondContact O-CG 3.39Å; L2353-M2357 PolarHBondContact O-N 3.44Å; K2355-M2357 VanDerWaalsContact C-N 3.28Å; K2355-M2357 PolarHBondContact O-N 3.09Å; M2357-L2361 HydrophobicContact CB-CD1 4.44Å; M2357-L2361 HydrophobicContact CE-CD1 4.47Å; M2357-L2361 WeakPolarHBondContact O-CB 3.47Å; M2357-L2361 WeakPolarHBondContact O-CD1 3.47Å; M2357-L2361 PolarHBondContact O-N 3.19Å
2358	E	37.7	Very low	37.1	Very low	101 Å²	101	81 Å²	81	47%	0.472	44%	0.444	S	S	.	.	H	α-helix	trans	-68.1	-38.2	172.1	-90.3	-162.9	93.1	0	0	112.6	A2354 K2355 K2362	A2354-E2358 WeakPolarHBondContact O-CB 3.33Å; A2354-E2358 PolarHBondContact O-N 3.36Å; K2355-E2358 WeakPolarHBondContact O-CB 3.41Å; K2355-E2358 PolarHBondContact O-N 2.55Å; K2355-E2358 VanDerWaalsContact O-N 3.09Å; E2358-K2362 VanDerWaalsContact O-CB 3.3Å; E2358-K2362 WeakPolarHBondContact O-CB 3.43Å; E2358-K2362 WeakPolarHBondContact O-CD 3.45Å; E2358-K2362 WeakPolarHBondContact O-CG 3.44Å; E2358-K2362 PolarHBondContact O-N 2.89Å; E2358-K2362 IonicContact OE1-NZ 2.83Å; E2358-K2362 PolarHBondContact OE1-NZ 2.92Å
2359	E	35.9	Very low	38.6	Very low	138 Å²	138	84.7 Å²	84.7	65%	0.645	45%	0.453	S	S	*	.	H	α-helix	trans	-71.5	-43.4	177.4	-69.6	-176.5	152.2	0	0	110.5	K2355 S2356 K2362 T2363	K2355-E2359 PolarHBondContact O-N 3.33Å; S2356-E2359 PolarHBondContact O-N 2.96Å; E2359-K2362 PolarHBondContact O-N 2.66Å; E2359-T2363 PolarHBondContact O-N 3.1Å; E2359-T2363 PolarHBondContact O-OG1 3.34Å; E2359-T2363 VanDerWaalsContact O-OG1 3.07Å
2360	D	37.2	Very low	40.3	Very low	44 Å²	44	81.4 Å²	81.4	24%	0.235	43%	0.432	C	S	.	.	H	α-helix	trans	-59.4	-47.6	169.3	-81.5	-36.8	0	0	0	112.7	K2336 S2356 K2362 T2363 I2364	K2336-D2360 WeakPolarHBondContact CE-OD2 3.46Å; K2336-D2360 IonicContact NZ-OD1 3.75Å; K2336-D2360 PolarHBondContact NZ-OD1 3.32Å; K2336-D2360 IonicContact NZ-OD2 3.74Å; K2336-D2360 PolarHBondContact NZ-OD2 3.26Å; S2356-D2360 WeakPolarHBondContact O-CB 3.23Å; S2356-D2360 PolarHBondContact O-N 3.38Å; D2360-K2362 VanDerWaalsContact C-N 3.31Å; D2360-K2362 PolarHBondContact O-N 3.02Å; D2360-T2363 PolarHBondContact O-N 3.42Å; D2360-I2364 WeakPolarHBondContact O-CB 3.47Å; D2360-I2364 WeakPolarHBondContact O-CG1 3.37Å; D2360-I2364 PolarHBondContact O-N 3.37Å
2361	L	40.4	Very low	42.1	Very low	62 Å²	62	77.6 Å²	77.6	33%	0.325	40%	0.404	S	S	.	.	H	α-helix	trans	-66.2	-33.1	178.3	-97.9	87	0	0	0	111.5	M2357 I2364 M2365	M2357-L2361 HydrophobicContact CB-CD1 4.44Å; M2357-L2361 HydrophobicContact CE-CD1 4.47Å; M2357-L2361 WeakPolarHBondContact O-CB 3.47Å; M2357-L2361 WeakPolarHBondContact O-CD1 3.47Å; M2357-L2361 PolarHBondContact O-N 3.19Å; L2361-I2364 PolarHBondContact O-N 2.79Å; L2361-M2365 WeakPolarHBondContact O-CB 3.25Å; L2361-M2365 WeakPolarHBondContact O-CG 3.26Å; L2361-M2365 PolarHBondContact O-N 2.96Å
2362	K	42.6	Very low	44.3	Very low	124 Å²	124	73.8 Å²	73.8	54%	0.539	38%	0.379	S	S	.	.	H	α-helix	trans	-65.7	-43.7	172.8	-79.6	165.1	-172.3	160.1	0	111	E2358 E2359 D2360 M2365 A2366	E2358-K2362 VanDerWaalsContact O-CB 3.3Å; E2358-K2362 WeakPolarHBondContact O-CB 3.43Å; E2358-K2362 WeakPolarHBondContact O-CD 3.45Å; E2358-K2362 WeakPolarHBondContact O-CG 3.44Å; E2358-K2362 PolarHBondContact O-N 2.89Å; E2358-K2362 IonicContact OE1-NZ 2.83Å; E2358-K2362 PolarHBondContact OE1-NZ 2.92Å; E2359-K2362 PolarHBondContact O-N 2.66Å; D2360-K2362 VanDerWaalsContact C-N 3.31Å; D2360-K2362 PolarHBondContact O-N 3.02Å; K2362-M2365 PolarHBondContact O-N 3.18Å; K2362-A2366 WeakPolarHBondContact O-CB 3.39Å; K2362-A2366 PolarHBondContact O-N 2.86Å
2363	T	42.6	Very low	46.3	Very low	89 Å²	89	74.8 Å²	74.8	55%	0.546	38%	0.384	S	S	.	.	H	α-helix	trans	-61.9	-43	174.9	-56.9	0	0	0	0	111.6	E2359 D2360 M2367	E2359-T2363 PolarHBondContact O-N 3.1Å; E2359-T2363 PolarHBondContact O-OG1 3.34Å; E2359-T2363 VanDerWaalsContact O-OG1 3.07Å; D2360-T2363 PolarHBondContact O-N 3.42Å; T2363-M2367 WeakPolarHBondContact O-CG 3.45Å
2364	I	44.9	Very low	48.3	Very low	43 Å²	43	70.8 Å²	70.8	22%	0.221	37%	0.366	C	S	.	.	H	α-helix	trans	-71.4	-39.6	177.4	-66.6	168.3	0	0	0	111.7	D2360 L2361 A2366 M2367 F2368 A2506	D2360-I2364 WeakPolarHBondContact O-CB 3.47Å; D2360-I2364 WeakPolarHBondContact O-CG1 3.37Å; D2360-I2364 PolarHBondContact O-N 3.37Å; L2361-I2364 PolarHBondContact O-N 2.79Å; I2364-A2366 VanDerWaalsContact C-N 3.34Å; I2364-A2366 PolarHBondContact O-N 3.09Å; I2364-M2367 VanDerWaalsContact O-CB 3.27Å; I2364-M2367 WeakPolarHBondContact O-CB 3.36Å; I2364-M2367 PolarHBondContact O-N 3.43Å; I2364-F2368 HydrophobicContact CG2-CD2 4.37Å; I2364-F2368 HydrophobicContact CG2-CE2 4.02Å; I2364-F2368 WeakPolarHBondContact O-CD2 3.3Å; I2364-A2506 HydrophobicContact CG2-CB 4.39Å
2365	M	46.1	Very low	50.3	Low	59 Å²	59	72.8 Å²	72.8	29%	0.291	37%	0.37	S	S	.	.	H	α-helix	trans	-66.8	-35	177.5	-80.1	-179.6	157.1	0	0	112.2	L2361 K2362 M2367 F2368 Q2369 Y2537	L2361-M2365 WeakPolarHBondContact O-CB 3.25Å; L2361-M2365 WeakPolarHBondContact O-CG 3.26Å; L2361-M2365 PolarHBondContact O-N 2.96Å; K2362-M2365 PolarHBondContact O-N 3.18Å; M2365-M2367 PolarHBondContact O-N 3.21Å; M2365-F2368 PolarHBondContact O-N 2.82Å; M2365-F2368 VanDerWaalsContact O-N 3.07Å; M2365-Q2369 PolarHBondContact O-N 3.44Å; M2365-Y2537 HydrophobicContact CE-CD2 4.47Å; M2365-Y2537 HydrophobicContact CE-CE1 4.18Å; M2365-Y2537 HydrophobicContact CE-CE2 3.68Å; M2365-Y2537 VanDerWaalsContact CE-CZ 3.49Å; M2365-Y2537 WeakPolarHBondContact CE-OH 3.1Å
2366	A	48	Very low	52.4	Low	55 Å²	55	68.4 Å²	68.4	46%	0.455	35%	0.352	S	S	.	.	H	α-helix	trans	-58.6	-36.1	173	0	0	0	0	0	112	K2362 I2364 F2368 Q2369	K2362-A2366 WeakPolarHBondContact O-CB 3.39Å; K2362-A2366 PolarHBondContact O-N 2.86Å; I2364-A2366 VanDerWaalsContact C-N 3.34Å; I2364-A2366 PolarHBondContact O-N 3.09Å; A2366-F2368 PolarHBondContact O-N 3.13Å; A2366-Q2369 PolarHBondContact O-N 3.22Å
2367	M	48.5	Very low	54.6	Low	42 Å²	42	65.7 Å²	65.7	21%	0.207	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-17.5	175.9	-59.5	171.5	160	0	0	114.7	T2363 I2364 M2365 Y2499 G2609	T2363-M2367 WeakPolarHBondContact O-CG 3.45Å; I2364-M2367 VanDerWaalsContact O-CB 3.27Å; I2364-M2367 WeakPolarHBondContact O-CB 3.36Å; I2364-M2367 PolarHBondContact O-N 3.43Å; M2365-M2367 PolarHBondContact O-N 3.21Å; M2367-Y2499 HydrophobicContact CB-CE1 3.87Å; M2367-Y2499 WeakPolarHBondContact CB-OH 3.27Å; M2367-Y2499 HydrophobicContact CG-CE1 4.41Å; M2367-Y2499 WeakPolarHBondContact CG-OH 3.34Å; M2367-Y2499 HydrophobicContact SD-CE1 4.2Å; M2367-G2609 WeakPolarHBondContact CE-O 3.4Å
2368	F	52.6	Low	57.1	Low	35 Å²	35	65 Å²	65	15%	0.154	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	19.4	-177.7	-61.5	-70.5	0	0	0	112.8	I2364 M2365 A2366 L2370 Y2499 Y2503	I2364-F2368 HydrophobicContact CG2-CD2 4.37Å; I2364-F2368 HydrophobicContact CG2-CE2 4.02Å; I2364-F2368 WeakPolarHBondContact O-CD2 3.3Å; M2365-F2368 PolarHBondContact O-N 2.82Å; M2365-F2368 VanDerWaalsContact O-N 3.07Å; A2366-F2368 PolarHBondContact O-N 3.13Å; F2368-L2370 PolarHBondContact O-N 2.88Å; F2368-L2370 VanDerWaalsContact O-N 3.11Å; F2368-Y2499 AromaticContact CE1-CD1 3.78Å; F2368-Y2499 HydrophobicContact CE1-CD1 3.78Å; F2368-Y2499 HydrophobicContact CE1-CE1 4.02Å; F2368-Y2499 AromaticContact CZ-CD1 3.59Å; F2368-Y2499 HydrophobicContact CZ-CD1 3.59Å; F2368-Y2499 AromaticContact CZ-CE1 3.82Å; F2368-Y2499 HydrophobicContact CZ-CE1 3.82Å; F2368-Y2503 HydrophobicContact CD1-CD2 4.11Å; F2368-Y2503 HydrophobicContact CD1-CE2 4.28Å; F2368-Y2503 HydrophobicContact CD2-CD2 4.1Å; F2368-Y2503 HydrophobicContact CD2-CE2 4.33Å; F2368-Y2503 AromaticContact CE1-CD2 3.74Å; F2368-Y2503 HydrophobicContact CE1-CD2 3.74Å; F2368-Y2503 HydrophobicContact CE1-CE2 4.35Å; F2368-Y2503 AromaticContact CE2-CD2 3.75Å; F2368-Y2503 HydrophobicContact CE2-CD2 3.75Å; F2368-Y2503 HydrophobicContact CE2-CE2 4.43Å; F2368-Y2503 HydrophobicContact CG-CD2 4.3Å; F2368-Y2503 HydrophobicContact CG-CE2 4.29Å; F2368-Y2503 AromaticContact CZ-CD2 3.57Å; F2368-Y2503 HydrophobicContact CZ-CD2 3.57Å; F2368-Y2503 HydrophobicContact CZ-CE2 4.46Å; F2368-Y2503 HydrophobicContact CZ-CG 4.4Å
2369	Q	58	Low	59.4	Low	110 Å²	110	60.6 Å²	60.6	51%	0.514	31%	0.305	S	S	.	.			trans	-61.4	114.1	160.1	-70.6	-165.4	-2.3	0	0	108.7	M2365 A2366 Y2371	M2365-Q2369 PolarHBondContact O-N 3.44Å; A2366-Q2369 PolarHBondContact O-N 3.22Å; Q2369-Y2371 HydrophobicContact CB-CD2 4.46Å; Q2369-Y2371 HydrophobicContact CB-CE2 3.67Å; Q2369-Y2371 WeakPolarHBondContact O-CD2 3.14Å; Q2369-Y2371 WeakPolarHBondContact O-CE2 3.26Å; Q2369-Y2371 PolarHBondContact OE1-OH 2.94Å; Q2369-Y2371 VanDerWaalsContact OE1-OH 3.07Å
2370	L	62.8	Low	61.7	Low	12 Å²	12	61.2 Å²	61.2	6%	0.063	31%	0.312	C	S	.	.			trans	-82.6	135.1	175.2	-69.3	163.3	0	0	0	109.1	F2368 F2372 I2401 E2402 R2531 L2580	F2368-L2370 PolarHBondContact O-N 2.88Å; F2368-L2370 VanDerWaalsContact O-N 3.11Å; L2370-F2372 HydrophobicContact CB-CD1 4.09Å; L2370-F2372 HydrophobicContact CB-CE1 3.65Å; L2370-F2372 HydrophobicContact CD1-CE1 4.17Å; L2370-F2372 HydrophobicContact CD2-CE1 4.38Å; L2370-F2372 HydrophobicContact CG-CE1 4.29Å; L2370-I2401 HydrophobicContact CD2-CG2 4.18Å; L2370-E2402 HydrophobicContact CD2-CG 4.35Å; L2370-R2531 WeakPolarHBondContact O-CD 3.41Å; L2370-R2531 WeakPolarHBondContact O-CG 3.41Å; L2370-R2531 PolarHBondContact O-NE 3.24Å; L2370-L2580 HydrophobicContact CD1-CD2 3.77Å; L2370-L2580 HydrophobicContact CD2-CD1 4.08Å; L2370-L2580 HydrophobicContact CD2-CD2 4.28Å
2371	Y	69.2	Low	64.2	Low	46 Å²	46	64.3 Å²	64.3	18%	0.18	33%	0.329	C	S	.	.			trans	-116.1	95.4	-177	-66.4	-98.4	0	0	0	111.8	Q2369 E2402 P2407 Y2639	Q2369-Y2371 HydrophobicContact CB-CD2 4.46Å; Q2369-Y2371 HydrophobicContact CB-CE2 3.67Å; Q2369-Y2371 WeakPolarHBondContact O-CD2 3.14Å; Q2369-Y2371 WeakPolarHBondContact O-CE2 3.26Å; Q2369-Y2371 PolarHBondContact OE1-OH 2.94Å; Q2369-Y2371 VanDerWaalsContact OE1-OH 3.07Å; Y2371-E2402 PolarHBondContact N-OE1 2.72Å; Y2371-E2402 VanDerWaalsContact N-OE1 3.11Å; Y2371-P2407 WeakPolarHBondContact O-CD 3.38Å; Y2371-P2407 WeakPolarHBondContact O-CG 3.29Å; Y2371-Y2639 AromaticContact CD1-CD1 3.76Å; Y2371-Y2639 HydrophobicContact CD1-CD1 3.76Å; Y2371-Y2639 AromaticContact CD1-CD2 3.72Å; Y2371-Y2639 HydrophobicContact CD1-CD2 3.72Å; Y2371-Y2639 AromaticContact CD1-CE1 3.61Å; Y2371-Y2639 HydrophobicContact CD1-CE1 3.61Å; Y2371-Y2639 AromaticContact CD1-CE2 3.56Å; Y2371-Y2639 HydrophobicContact CD1-CE2 3.56Å; Y2371-Y2639 AromaticContact CD1-CG 3.81Å; Y2371-Y2639 HydrophobicContact CD1-CG 3.81Å; Y2371-Y2639 AromaticContact CD1-CZ 3.49Å; Y2371-Y2639 VanDerWaalsContact CD1-CZ 3.49Å; Y2371-Y2639 AromaticContact CD2-CD2 3.44Å; Y2371-Y2639 HydrophobicContact CD2-CD2 3.44Å; Y2371-Y2639 VanDerWaalsContact CD2-CD2 3.44Å; Y2371-Y2639 AromaticContact CD2-CE2 3.89Å; Y2371-Y2639 HydrophobicContact CD2-CE2 3.89Å; Y2371-Y2639 AromaticContact CD2-CG 3.85Å; Y2371-Y2639 HydrophobicContact CD2-CG 3.85Å; Y2371-Y2639 AromaticContact CE1-CD1 3.61Å; Y2371-Y2639 HydrophobicContact CE1-CD1 3.61Å; Y2371-Y2639 HydrophobicContact CE1-CD2 4.14Å; Y2371-Y2639 AromaticContact CE1-CE1 3.86Å; Y2371-Y2639 HydrophobicContact CE1-CE1 3.86Å; Y2371-Y2639 HydrophobicContact CE1-CE2 4.35Å; Y2371-Y2639 AromaticContact CE1-CG 3.75Å; Y2371-Y2639 HydrophobicContact CE1-CG 3.75Å; Y2371-Y2639 HydrophobicContact CE2-CD1 4.48Å; Y2371-Y2639 AromaticContact CE2-CD2 3.88Å; Y2371-Y2639 HydrophobicContact CE2-CD2 3.88Å; Y2371-Y2639 AromaticContact CE2-CG 3.79Å; Y2371-Y2639 HydrophobicContact CE2-CG 3.79Å; Y2371-Y2639 HydrophobicContact CG-CD1 4.28Å; Y2371-Y2639 AromaticContact CG-CD2 3.35Å; Y2371-Y2639 HydrophobicContact CG-CD2 3.35Å; Y2371-Y2639 HydrophobicContact CG-CE1 4.23Å; Y2371-Y2639 AromaticContact CG-CE2 3.28Å; Y2371-Y2639 HydrophobicContact CG-CE2 3.28Å; Y2371-Y2639 AromaticContact CG-CG 3.86Å; Y2371-Y2639 HydrophobicContact CG-CG 3.86Å; Y2371-Y2639 AromaticContact CG-CZ 3.74Å; Y2371-Y2639 AromaticContact CZ-CD1 3.99Å; Y2371-Y2639 AromaticContact CZ-CG 3.73Å
2372	F	74.4	Confident	66.5	Low	16 Å²	16	62.8 Å²	62.8	7%	0.07	32%	0.322	C	S	.	.			trans	-157.7	149.2	171.9	54.4	-88.6	0	0	0	110.9	L2370 L2377 E2402 V2404 F2528 F2532	L2370-F2372 HydrophobicContact CB-CD1 4.09Å; L2370-F2372 HydrophobicContact CB-CE1 3.65Å; L2370-F2372 HydrophobicContact CD1-CE1 4.17Å; L2370-F2372 HydrophobicContact CD2-CE1 4.38Å; L2370-F2372 HydrophobicContact CG-CE1 4.29Å; F2372-L2377 HydrophobicContact CD2-CD1 3.58Å; F2372-L2377 HydrophobicContact CD2-CD2 4.23Å; F2372-L2377 HydrophobicContact CD2-CG 3.55Å; F2372-L2377 HydrophobicContact CE2-CD1 3.6Å; F2372-L2377 HydrophobicContact CE2-CD2 3.49Å; F2372-L2377 VanDerWaalsContact CE2-CD2 3.49Å; F2372-L2377 HydrophobicContact CE2-CG 3.35Å; F2372-L2377 HydrophobicContact CZ-CD2 4.22Å; F2372-L2377 HydrophobicContact CZ-CG 4.36Å; F2372-E2402 HydrophobicContact CD1-CB 3.91Å; F2372-E2402 HydrophobicContact CD1-CG 3.37Å; F2372-E2402 HydrophobicContact CE1-CB 4.45Å; F2372-E2402 HydrophobicContact CE1-CG 3.95Å; F2372-E2402 HydrophobicContact CG-CG 4.35Å; F2372-V2404 HydrophobicContact CB-CG2 3.74Å; F2372-F2528 HydrophobicContact CE2-CE2 4.27Å; F2372-F2528 AromaticContact CZ-CD2 3.99Å; F2372-F2528 HydrophobicContact CZ-CD2 3.99Å; F2372-F2528 AromaticContact CZ-CE2 3.88Å; F2372-F2528 HydrophobicContact CZ-CE2 3.88Å; F2372-F2532 HydrophobicContact CD2-CE2 4.1Å; F2372-F2532 AromaticContact CD2-CZ 3.53Å; F2372-F2532 HydrophobicContact CD2-CZ 3.53Å; F2372-F2532 AromaticContact CE2-CE2 3.36Å; F2372-F2532 HydrophobicContact CE2-CE2 3.36Å; F2372-F2532 AromaticContact CE2-CZ 3.28Å; F2372-F2532 HydrophobicContact CE2-CZ 3.28Å; F2372-F2532 HydrophobicContact CG-CZ 4.46Å; F2372-F2532 AromaticContact CZ-CE2 3.85Å; F2372-F2532 HydrophobicContact CZ-CE2 3.85Å; F2372-F2532 HydrophobicContact CZ-CZ 4.12Å
2373	E	71.9	Confident	68.9	Low	142 Å²	142	58.4 Å²	58.4	66%	0.664	31%	0.306	S	S	*	.			trans	-79.8	154.9	169.5	-68.1	-157.3	170.9	0	0	111.6	D2375 D2376 L2377	E2373-D2375 PolarHBondContact O-N 2.97Å; E2373-D2375 VanDerWaalsContact O-N 3.11Å; E2373-D2376 PolarHBondContact O-N 2.82Å; E2373-D2376 VanDerWaalsContact O-N 3.1Å; E2373-L2377 WeakPolarHBondContact O-CD1 3.43Å
2374	A	71.2	Confident	71.2	Confident	20 Å²	20	55.8 Å²	55.8	17%	0.165	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.8	-176.2	0	0	0	0	0	114.5	L2377 F2532 S2566 F2567	A2374-L2377 VanDerWaalsContact C-CD1 3.46Å; A2374-L2377 VanDerWaalsContact CA-CD1 3.44Å; A2374-L2377 WeakPolarHBondContact O-CD1 3.23Å; A2374-F2532 HydrophobicContact CB-CD1 3.95Å; A2374-F2532 HydrophobicContact CB-CE1 3.75Å; A2374-S2566 WeakPolarHBondContact CB-O 3.22Å; A2374-F2567 HydrophobicContact CB-CD1 4.23Å; A2374-F2567 HydrophobicContact CB-CE1 4.3Å
2375	D	73.4	Confident	73.5	Confident	93 Å²	93	56.6 Å²	56.6	50%	0.497	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-23.6	176.9	-86.9	-18.4	0	0	0	113.8	E2373 K2568	E2373-D2375 PolarHBondContact O-N 2.97Å; E2373-D2375 VanDerWaalsContact O-N 3.11Å; D2375-K2568 VanDerWaalsContact OD1-CD 3.3Å; D2375-K2568 WeakPolarHBondContact OD1-CD 3.48Å; D2375-K2568 WeakPolarHBondContact OD1-CE 3.32Å; D2375-K2568 IonicContact OD1-NZ 2.76Å; D2375-K2568 PolarHBondContact OD1-NZ 2.98Å; D2375-K2568 IonicContact OD2-NZ 2.69Å; D2375-K2568 PolarHBondContact OD2-NZ 3.22Å
2376	D	77.6	Confident	75.7	Confident	37 Å²	37	54.5 Å²	54.5	20%	0.198	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-15.6	-171.7	-99.9	-21	0	0	0	113.6	E2373 R2378 P2379 V2404 K2405 S2406	E2373-D2376 PolarHBondContact O-N 2.82Å; E2373-D2376 VanDerWaalsContact O-N 3.1Å; D2376-R2378 PolarHBondContact O-N 3.3Å; D2376-P2379 WeakPolarHBondContact O-CD 3.46Å; D2376-V2404 HydrophobicContact CB-CB 4.25Å; D2376-V2404 HydrophobicContact CB-CG1 4.22Å; D2376-V2404 WeakPolarHBondContact O-CG1 3.41Å; D2376-K2405 IonicContact OD1-NZ 3.13Å; D2376-K2405 IonicContact OD2-NZ 2.66Å; D2376-S2406 WeakPolarHBondContact OD2-CB 3.31Å; D2376-S2406 PolarHBondContact OD2-OG 3.45Å
2377	L	79	Confident	77.9	Confident	6 Å²	6	52.6 Å²	52.6	3%	0.031	26%	0.264	C	S	.	.	S	Bend	trans	-53.1	-31.2	-169.7	-77	91.2	0	0	0	115.4	F2372 E2373 A2374 P2379 F2528 F2532 F2567 F2575	F2372-L2377 HydrophobicContact CD2-CD1 3.58Å; F2372-L2377 HydrophobicContact CD2-CD2 4.23Å; F2372-L2377 HydrophobicContact CD2-CG 3.55Å; F2372-L2377 HydrophobicContact CE2-CD1 3.6Å; F2372-L2377 HydrophobicContact CE2-CD2 3.49Å; F2372-L2377 VanDerWaalsContact CE2-CD2 3.49Å; F2372-L2377 HydrophobicContact CE2-CG 3.35Å; F2372-L2377 HydrophobicContact CZ-CD2 4.22Å; F2372-L2377 HydrophobicContact CZ-CG 4.36Å; E2373-L2377 WeakPolarHBondContact O-CD1 3.43Å; A2374-L2377 VanDerWaalsContact C-CD1 3.46Å; A2374-L2377 VanDerWaalsContact CA-CD1 3.44Å; A2374-L2377 WeakPolarHBondContact O-CD1 3.23Å; L2377-P2379 VanDerWaalsContact O-CD 3.25Å; L2377-P2379 WeakPolarHBondContact O-CD 3.29Å; L2377-F2528 HydrophobicContact CD2-CE2 3.54Å; L2377-F2528 HydrophobicContact CD2-CZ 3.35Å; L2377-F2532 HydrophobicContact CD1-CZ 4.46Å; L2377-F2567 HydrophobicContact CD1-CD1 4.46Å; L2377-F2567 HydrophobicContact CD1-CE1 3.71Å; L2377-F2567 HydrophobicContact CD2-CE1 3.88Å; L2377-F2567 HydrophobicContact CG-CE1 4.47Å; L2377-F2575 WeakPolarHBondContact O-CD1 3.49Å; L2377-F2575 WeakPolarHBondContact O-CE1 3.38Å
2378	R	85.2	Confident	79.6	Confident	90 Å²	90	55.1 Å²	55.1	34%	0.34	29%	0.291	S	S	.	.	S	Bend	trans	-118.1	73	-175.2	-173.1	-172.6	179.3	169.8	5.6	108.7	D2376 D2380 P2426 E2571 F2575	D2376-R2378 PolarHBondContact O-N 3.3Å; R2378-D2380 PolarHBondContact O-N 3.2Å; R2378-P2426 HydrophobicContact CG-CG 4.45Å; R2378-E2571 IonicContact CZ-OE2 3.77Å; R2378-E2571 VanDerWaalsContact CZ-OE2 3.26Å; R2378-E2571 IonicContact NH1-OE2 3.68Å; R2378-E2571 PolarHBondContact NH1-OE2 3.36Å; R2378-E2571 IonicContact NH2-OE2 2.97Å; R2378-E2571 PolarHBondContact NH2-OE2 2.97Å; R2378-F2575 HydrophobicContact CB-CD1 3.91Å; R2378-F2575 HydrophobicContact CG-CB 4.41Å; R2378-F2575 HydrophobicContact CG-CD1 3.92Å; R2378-F2575 HydrophobicContact CG-CG 4.22Å
2379	P	85.7	Confident	81.3	Confident	9 Å²	9	56.2 Å²	56.2	6%	0.058	30%	0.298	C	S	.	.			trans	-66.4	134.9	-177.9	25.9	-32	0	0	0	110.7	D2376 L2377 Q2423 T2425	D2376-P2379 WeakPolarHBondContact O-CD 3.46Å; L2377-P2379 VanDerWaalsContact O-CD 3.25Å; L2377-P2379 WeakPolarHBondContact O-CD 3.29Å; P2379-Q2423 HydrophobicContact CB-CB 3.88Å; P2379-Q2423 HydrophobicContact CB-CG 4.41Å; P2379-Q2423 VanDerWaalsContact CB-NE2 3.33Å; P2379-Q2423 HydrophobicContact CG-CB 3.85Å; P2379-T2425 HydrophobicContact CB-CG2 4.44Å; P2379-T2425 HydrophobicContact CG-CG2 4.37Å; P2379-T2425 WeakPolarHBondContact O-CB 3.08Å; P2379-T2425 WeakPolarHBondContact O-CG2 3.43Å
2380	D	83.7	Confident	82.4	Confident	151 Å²	151	58.8 Å²	58.8	81%	0.807	31%	0.31	S	S	*	.	S	Bend	trans	-78.2	-29.1	176.9	-74.1	-46.4	0	0	0	113.1	R2378	R2378-D2380 PolarHBondContact O-N 3.2Å
2381	L	89.3	Confident	83.1	Confident	110 Å²	110	66.6 Å²	66.6	58%	0.576	35%	0.346	S	S	*	.			trans	-115	125.2	-171.5	-68.6	176.1	0	0	0	112	V2383 V2384 Q2423	L2381-V2383 VanDerWaalsContact C-N 3.3Å; L2381-V2383 PolarHBondContact O-N 3.07Å; L2381-V2384 HydrophobicContact CB-CG2 3.85Å; L2381-Q2423 PolarHBondContact O-NE2 3.42Å
2382	P	90.1	Very high	83.7	Confident	29 Å²	29	66.9 Å²	66.9	19%	0.188	36%	0.363	C	S	.	.	S	Bend	trans	-78.6	-9.9	-173.6	31.9	-36.6	0	0	0	114.8	F2422 Q2423 T2425 Y2439	P2382-F2422 CarbonylContact O-C 3.45Å; P2382-F2422 VanDerWaalsContact O-CA 3.3Å; P2382-F2422 WeakPolarHBondContact O-CA 3.45Å; P2382-Q2423 PolarHBondContact O-N 3.07Å; P2382-T2425 VanDerWaalsContact CA-CG2 3.48Å; P2382-T2425 HydrophobicContact CB-CG2 3.85Å; P2382-T2425 VanDerWaalsContact N-CG2 3.34Å; P2382-Y2439 HydrophobicContact CB-CE1 3.92Å
2383	V	92.7	Very high	84.3	Confident	32 Å²	32	69.1 Å²	69.1	19%	0.194	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	136.7	166.2	69.2	0	0	0	0	108.3	L2381 C2421 F2422 C2443 I2447	L2381-V2383 VanDerWaalsContact C-N 3.3Å; L2381-V2383 PolarHBondContact O-N 3.07Å; V2383-C2421 CarbonylContact C-O 3.57Å; V2383-C2421 VanDerWaalsContact CA-O 3.31Å; V2383-C2421 WeakPolarHBondContact CA-O 3.25Å; V2383-F2422 HydrophobicContact CB-CD1 3.86Å; V2383-F2422 HydrophobicContact CB-CE1 4.09Å; V2383-F2422 HydrophobicContact CG2-CD1 3.78Å; V2383-F2422 HydrophobicContact CG2-CE1 3.79Å; V2383-C2443 HydrophobicContact CG1-CB 4.47Å; V2383-I2447 HydrophobicContact CG1-CD1 3.68Å; V2383-I2447 HydrophobicContact CG2-CD1 4.01Å
2384	V	91.7	Very high	85.2	Confident	35 Å²	35	63.6 Å²	63.6	21%	0.212	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	136.8	-176.4	179.2	0	0	0	0	108.9	L2381 K2405 Y2420 C2421 Q2423	L2381-V2384 HydrophobicContact CB-CG2 3.85Å; V2384-K2405 HydrophobicContact CG1-CD 4.47Å; V2384-Y2420 CarbonylContact O-C 3.44Å; V2384-Y2420 WeakPolarHBondContact O-CA 3.35Å; V2384-C2421 PolarHBondContact N-O 3.06Å; V2384-C2421 PolarHBondContact O-N 2.93Å; V2384-Q2423 VanDerWaalsContact CG2-NE2 3.32Å
2385	K	92.8	Very high	86.3	Confident	59 Å²	59	62.7 Å²	62.7	26%	0.257	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	126.4	174.5	-161.7	-173.8	-175.6	-168.1	0	108.9	N2387 I2389 E2390 A2419 Y2420	K2385-N2387 VanDerWaalsContact CD-O 3.29Å; K2385-N2387 WeakPolarHBondContact CD-O 3.48Å; K2385-N2387 WeakPolarHBondContact CE-O 3.17Å; K2385-N2387 WeakPolarHBondContact CG-O 3.36Å; K2385-I2389 WeakPolarHBondContact CE-O 3.28Å; K2385-I2389 PolarHBondContact NZ-O 3.4Å; K2385-E2390 IonicContact NZ-OE1 3.15Å; K2385-E2390 PolarHBondContact NZ-OE1 3.46Å; K2385-A2419 CarbonylContact C-O 3.59Å; K2385-A2419 WeakPolarHBondContact CA-O 3.42Å; K2385-A2419 WeakPolarHBondContact CG-O 3.43Å; K2385-Y2420 HydrophobicContact CB-CD1 3.85Å; K2385-Y2420 HydrophobicContact CB-CE1 3.67Å; K2385-Y2420 HydrophobicContact CD-CE1 4.19Å; K2385-Y2420 HydrophobicContact CG-CD1 4.05Å; K2385-Y2420 HydrophobicContact CG-CE1 3.68Å; K2385-Y2420 HydrophobicContact CG-CE2 4.36Å
2386	L	92.8	Very high	87.4	Confident	15 Å²	15	58.2 Å²	58.2	8%	0.079	32%	0.324	C	S	.	.			trans	-91.8	-15.4	-176.7	-62.9	-167.3	0	0	0	114	L2397 K2405 L2408 E2409 A2419 C2421	L2386-L2397 HydrophobicContact CD1-CD1 4.49Å; L2386-L2397 HydrophobicContact CD1-CD2 4.42Å; L2386-K2405 HydrophobicContact CD2-CB 4.11Å; L2386-L2408 HydrophobicContact CD1-CB 4.42Å; L2386-L2408 VanDerWaalsContact CD1-O 3.29Å; L2386-L2408 WeakPolarHBondContact CD1-O 3.49Å; L2386-E2409 HydrophobicContact CD2-CG 4.33Å; L2386-A2419 HydrophobicContact CB-CB 4.3Å; L2386-A2419 PolarHBondContact N-O 2.8Å; L2386-C2421 HydrophobicContact CD1-CB 3.55Å; L2386-C2421 HydrophobicContact CD2-CB 3.82Å; L2386-C2421 HydrophobicContact CG-CB 3.71Å
2387	N	92.4	Very high	88.3	Confident	16 Å²	16	56.5 Å²	56.5	9%	0.086	32%	0.315	C	S	.	.	S	Bend	trans	-138.2	166.8	-179.4	68.4	9.6	0	0	0	113.4	K2385 I2389 G2412 L2415 F2417 A2419	K2385-N2387 VanDerWaalsContact CD-O 3.29Å; K2385-N2387 WeakPolarHBondContact CD-O 3.48Å; K2385-N2387 WeakPolarHBondContact CE-O 3.17Å; K2385-N2387 WeakPolarHBondContact CG-O 3.36Å; N2387-I2389 VanDerWaalsContact C-N 3.3Å; N2387-I2389 PolarHBondContact O-N 3.47Å; N2387-G2412 PolarHBondContact ND2-O 3.18Å; N2387-L2415 PolarHBondContact ND2-O 3.27Å; N2387-F2417 PolarHBondContact ND2-O 3.35Å; N2387-A2419 PolarHBondContact OD1-N 3.25Å
2388	A	85.7	Confident	89.1	Confident	94 Å²	94	56.2 Å²	56.2	78%	0.777	31%	0.313	S	S	*	.	S	Bend	trans	-80.3	-5.6	-179	0	0	0	0	0	114	E2390	A2388-E2390 PolarHBondContact O-N 2.9Å
2389	I	87.2	Confident	89.4	Confident	59 Å²	59	51.9 Å²	51.9	30%	0.303	30%	0.297	S	S	.	.			trans	-70.8	128.6	-172.2	-55.2	-177	0	0	0	110.4	K2385 N2387 E2391 L2415 P2418	K2385-I2389 WeakPolarHBondContact CE-O 3.28Å; K2385-I2389 PolarHBondContact NZ-O 3.4Å; N2387-I2389 VanDerWaalsContact C-N 3.3Å; N2387-I2389 PolarHBondContact O-N 3.47Å; I2389-E2391 WeakPolarHBondContact CG2-O 3.43Å; I2389-L2415 VanDerWaalsContact CD1-O 3.26Å; I2389-L2415 WeakPolarHBondContact CD1-O 3.41Å; I2389-P2418 HydrophobicContact CG2-CG 4.1Å; I2389-P2418 WeakPolarHBondContact O-CB 3.22Å
2390	E	82.6	Confident	89.7	Confident	164 Å²	164	51.5 Å²	51.5	77%	0.766	29%	0.294	S	S	*	.			trans	-109	-24.3	-176.8	-55.3	-116.8	109	0	0	113.2	K2385 A2388	K2385-E2390 IonicContact NZ-OE1 3.15Å; K2385-E2390 PolarHBondContact NZ-OE1 3.46Å; A2388-E2390 PolarHBondContact O-N 2.9Å
2391	E	77.2	Confident	89.8	Confident	175 Å²	175	45.2 Å²	45.2	82%	0.818	26%	0.261	S	S	*	.	S	Bend	trans	-102.9	143.5	-178.6	-62.9	-168.9	149.6	0	0	112	I2389 P2418	I2389-E2391 WeakPolarHBondContact CG2-O 3.43Å; E2391-P2418 WeakPolarHBondContact O-CD 3.38Å; E2391-P2418 WeakPolarHBondContact O-CG 3.48Å
2392	G	81.6	Confident	89.6	Confident	52 Å²	52	41 Å²	41	54%	0.536	24%	0.238	S	C	.	.	S	Bend	trans	110.8	170.1	178.2	0	0	0	0	0	114.1
2393	P	86.4	Confident	89.5	Confident	63 Å²	63	39.6 Å²	39.6	41%	0.409	23%	0.229	S	C	.	.			trans	-68.4	126.4	-180	-17.3	31.6	0	0	0	111
2394	P	91.6	Very high	89.3	Confident	27 Å²	27	38.1 Å²	38.1	18%	0.175	22%	0.22	C	C	.	.			trans	-59.4	147.4	-179.8	-25.7	35.4	0	0	0	113.4	F2396 P2418 Y2420 R2454	P2394-F2396 HydrophobicContact CB-CE2 3.8Å; P2394-F2396 HydrophobicContact CB-CZ 3.9Å; P2394-P2418 CarbonylContact C-O 3.48Å; P2394-P2418 WeakPolarHBondContact CA-O 3.43Å; P2394-Y2420 HydrophobicContact CB-CD2 4.33Å; P2394-Y2420 HydrophobicContact CB-CE2 4.32Å; P2394-R2454 WeakPolarHBondContact O-CB 3.3Å
2395	V	94.7	Very high	89.2	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127.7	172	175.6	0	0	0	0	109	L2397 L2415 F2417 P2418 Y2420 R2454 I2456 F2658	V2395-L2397 HydrophobicContact CG1-CD1 4.15Å; V2395-L2415 HydrophobicContact CG1-CD1 4.05Å; V2395-F2417 HydrophobicContact CG2-CB 3.81Å; V2395-F2417 HydrophobicContact CG2-CD2 3.85Å; V2395-F2417 HydrophobicContact CG2-CG 4.09Å; V2395-P2418 PolarHBondContact N-O 3.17Å; V2395-Y2420 PolarHBondContact O-N 3.08Å; V2395-R2454 HydrophobicContact CB-CB 4.49Å; V2395-R2454 HydrophobicContact CG2-CB 3.98Å; V2395-I2456 HydrophobicContact CG1-CD1 3.54Å; V2395-I2456 HydrophobicContact CG1-CG1 3.8Å; V2395-F2658 HydrophobicContact CG1-CE2 4.26Å; V2395-F2658 HydrophobicContact CG1-CZ 4.34Å; V2395-F2658 HydrophobicContact CG2-CD2 4.47Å; V2395-F2658 HydrophobicContact CG2-CE2 3.81Å; V2395-F2658 HydrophobicContact CG2-CZ 4.18Å
2396	F	95.9	Very high	88.9	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	116	-179.4	-63.2	-80.4	0	0	0	111	P2394 Y2420 F2422 M2444 I2447 Q2448 Y2453 R2454 I2455 I2456	P2394-F2396 HydrophobicContact CB-CE2 3.8Å; P2394-F2396 HydrophobicContact CB-CZ 3.9Å; F2396-Y2420 CarbonylContact C-O 3.59Å; F2396-Y2420 WeakPolarHBondContact CA-O 3.46Å; F2396-Y2420 HydrophobicContact CE1-CD2 4.25Å; F2396-Y2420 HydrophobicContact CE1-CG 4.22Å; F2396-F2422 HydrophobicContact CB-CE2 3.86Å; F2396-F2422 HydrophobicContact CB-CZ 4.21Å; F2396-F2422 HydrophobicContact CD1-CE2 4.33Å; F2396-F2422 AromaticContact CD1-CZ 3.89Å; F2396-F2422 HydrophobicContact CD1-CZ 3.89Å; F2396-F2422 HydrophobicContact CG-CE2 4.45Å; F2396-F2422 HydrophobicContact CG-CZ 4.32Å; F2396-M2444 HydrophobicContact CB-CG 4.47Å; F2396-M2444 HydrophobicContact CB-SD 4.21Å; F2396-M2444 HydrophobicContact CD1-CG 3.75Å; F2396-M2444 HydrophobicContact CD2-CG 3.5Å; F2396-M2444 VanDerWaalsContact CD2-CG 3.5Å; F2396-M2444 HydrophobicContact CD2-SD 3.65Å; F2396-M2444 HydrophobicContact CE1-CG 3.74Å; F2396-M2444 HydrophobicContact CE2-CG 3.48Å; F2396-M2444 VanDerWaalsContact CE2-CG 3.48Å; F2396-M2444 HydrophobicContact CE2-SD 4.13Å; F2396-M2444 HydrophobicContact CG-CG 3.62Å; F2396-M2444 HydrophobicContact CG-SD 3.88Å; F2396-M2444 HydrophobicContact CZ-CG 3.6Å; F2396-I2447 HydrophobicContact CE1-CB 4.1Å; F2396-I2447 HydrophobicContact CE1-CD1 4.06Å; F2396-I2447 HydrophobicContact CE1-CG2 4.04Å; F2396-I2447 HydrophobicContact CZ-CB 4.06Å; F2396-I2447 HydrophobicContact CZ-CG2 3.87Å; F2396-Q2448 HydrophobicContact CE2-CB 4.1Å; F2396-Q2448 HydrophobicContact CZ-CB 4.05Å; F2396-Y2453 HydrophobicContact CE2-CD1 4.4Å; F2396-R2454 PolarHBondContact N-O 2.88Å; F2396-I2455 WeakPolarHBondContact O-CA 3.34Å; F2396-I2456 PolarHBondContact O-N 2.98Å
2397	L	96.2	Very high	88.5	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	140.3	178.7	-59.1	89.5	0	0	0	110	L2386 V2395 L2408 L2411 L2415 A2419 Y2420 C2421 F2422 I2456	L2386-L2397 HydrophobicContact CD1-CD1 4.49Å; L2386-L2397 HydrophobicContact CD1-CD2 4.42Å; V2395-L2397 HydrophobicContact CG1-CD1 4.15Å; L2397-L2408 HydrophobicContact CB-CD1 4.34Å; L2397-L2408 HydrophobicContact CD2-CB 4.48Å; L2397-L2408 HydrophobicContact CD2-CD2 4.29Å; L2397-L2411 HydrophobicContact CD2-CD2 4.07Å; L2397-L2411 HydrophobicContact CD2-CG 4.47Å; L2397-L2415 HydrophobicContact CD1-CD1 4.14Å; L2397-L2415 HydrophobicContact CD2-CD1 4.17Å; L2397-A2419 HydrophobicContact CD1-CB 3.97Å; L2397-Y2420 PolarHBondContact N-O 2.95Å; L2397-C2421 HydrophobicContact CB-CB 4.24Å; L2397-C2421 WeakPolarHBondContact O-CA 3.35Å; L2397-F2422 WeakPolarHBondContact O-CD2 3.43Å; L2397-F2422 PolarHBondContact O-N 3.3Å; L2397-I2456 CarbonylContact C-O 3.59Å; L2397-I2456 VanDerWaalsContact CA-O 3.27Å; L2397-I2456 WeakPolarHBondContact CA-O 3.07Å; L2397-I2456 HydrophobicContact CG-CB 4.38Å
2398	V	95.5	Very high	88.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.4	177.9	-161.9	0	0	0	0	111.2	L2408 F2422 Y2440 I2455 I2456 Y2458 I2464 A2465 M2468	V2398-L2408 WeakPolarHBondContact O-CD1 3.17Å; V2398-F2422 HydrophobicContact CG2-CD2 4.06Å; V2398-F2422 HydrophobicContact CG2-CE2 4.49Å; V2398-Y2440 HydrophobicContact CG1-CD2 4.04Å; V2398-Y2440 HydrophobicContact CG1-CE2 4.06Å; V2398-I2455 HydrophobicContact CG2-CG2 4.41Å; V2398-I2456 PolarHBondContact N-O 3.47Å; V2398-Y2458 PolarHBondContact O-N 3.24Å; V2398-I2464 HydrophobicContact CG1-CB 3.8Å; V2398-I2464 HydrophobicContact CG1-CD1 3.99Å; V2398-I2464 HydrophobicContact CG1-CG1 4.49Å; V2398-I2464 HydrophobicContact CG1-CG2 3.79Å; V2398-A2465 HydrophobicContact CG2-CB 3.93Å; V2398-M2468 HydrophobicContact CG2-SD 4Å
2399	H	92.3	Very high	88.6	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.183	C	C	.	.			trans	-54.3	152.9	-174.2	65.2	67.9	0	0	0	115.3	F2422 Y2440 G2461	H2399-F2422 WeakPolarHBondContact CB-O 3.19Å; H2399-F2422 PolarHBondContact CD2-O 2.93Å; H2399-Y2440 AromaticContact CD2-CE2 3.8Å; H2399-Y2440 AromaticContact CD2-CZ 3.83Å; H2399-Y2440 PolarHBondContact CD2-OH 2.82Å; H2399-Y2440 AromaticContact NE2-CE2 3.43Å; H2399-Y2440 WeakPolarHBondContact NE2-CE2 3.48Å; H2399-Y2440 AromaticContact NE2-CZ 3.46Å; H2399-Y2440 PolarHBondContact NE2-OH 2.8Å; H2399-G2461 WeakPolarHBondContact O-CA 3.28Å; H2399-G2461 PolarHBondContact O-N 3.29Å; H2399-G2461 VanDerWaalsContact O-N 3.12Å
2400	P	90.9	Very high	88.6	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.183	C	C	.	.			trans	-74.1	-170	166.9	35.3	-37.7	0	0	0	112.3	E2402 G2403 P2407 Y2458	P2400-E2402 WeakPolarHBondContact CB-OE2 3.43Å; P2400-E2402 WeakPolarHBondContact CG-OE2 3.49Å; P2400-E2402 PolarHBondContact O-N 2.69Å; P2400-G2403 PolarHBondContact O-N 2.89Å; P2400-P2407 HydrophobicContact CG-CB 3.84Å; P2400-P2407 HydrophobicContact CG-CG 3.77Å; P2400-Y2458 HydrophobicContact CB-CD1 3.6Å; P2400-Y2458 HydrophobicContact CB-CE1 3.54Å; P2400-Y2458 HydrophobicContact CG-CD1 3.85Å; P2400-Y2458 HydrophobicContact CG-CE1 3.77Å
2401	I	86.9	Confident	89.1	Confident	20 Å²	20	26 Å²	26	10%	0.103	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-22.7	-167	-158.1	163.1	0	0	0	113.5	L2370 G2403 Y2460 L2580 K2583 F2584	L2370-I2401 HydrophobicContact CD2-CG2 4.18Å; I2401-G2403 PolarHBondContact O-N 2.78Å; I2401-Y2460 HydrophobicContact CB-CG 4.18Å; I2401-Y2460 HydrophobicContact CD1-CD2 4.35Å; I2401-Y2460 HydrophobicContact CG1-CD2 4.26Å; I2401-Y2460 HydrophobicContact CG1-CG 4.14Å; I2401-L2580 HydrophobicContact CG1-CD1 4.24Å; I2401-L2580 HydrophobicContact CG2-CD1 4.19Å; I2401-K2583 HydrophobicContact CG1-CB 4.02Å; I2401-K2583 VanDerWaalsContact O-CD 3.27Å; I2401-K2583 WeakPolarHBondContact O-CD 3.49Å; I2401-K2583 VanDerWaalsContact O-CE 3.27Å; I2401-K2583 WeakPolarHBondContact O-CE 3.49Å; I2401-K2583 PolarHBondContact O-NZ 3.47Å; I2401-F2584 HydrophobicContact CD1-CD1 3.97Å; I2401-F2584 HydrophobicContact CD1-CD2 3.69Å; I2401-F2584 HydrophobicContact CD1-CE1 3.97Å; I2401-F2584 HydrophobicContact CD1-CE2 3.69Å; I2401-F2584 HydrophobicContact CD1-CG 3.84Å; I2401-F2584 HydrophobicContact CD1-CZ 3.83Å; I2401-F2584 HydrophobicContact CG1-CD2 4.4Å; I2401-F2584 HydrophobicContact CG1-CE2 4.41Å
2402	E	83.9	Confident	89.6	Confident	20 Å²	20	17.7 Å²	17.7	9%	0.093	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-36.9	169.5	-65.8	76.8	-177.7	0	0	111.7	L2370 Y2371 F2372 P2400 V2404 K2583	L2370-E2402 HydrophobicContact CD2-CG 4.35Å; Y2371-E2402 PolarHBondContact N-OE1 2.72Å; Y2371-E2402 VanDerWaalsContact N-OE1 3.11Å; F2372-E2402 HydrophobicContact CD1-CB 3.91Å; F2372-E2402 HydrophobicContact CD1-CG 3.37Å; F2372-E2402 HydrophobicContact CE1-CB 4.45Å; F2372-E2402 HydrophobicContact CE1-CG 3.95Å; F2372-E2402 HydrophobicContact CG-CG 4.35Å; P2400-E2402 WeakPolarHBondContact CB-OE2 3.43Å; P2400-E2402 WeakPolarHBondContact CG-OE2 3.49Å; P2400-E2402 PolarHBondContact O-N 2.69Å; E2402-V2404 HydrophobicContact CB-CG2 4.01Å; E2402-K2583 PolarHBondContact O-NZ 2.95Å
2403	G	88	Confident	90.1	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.01	10%	0.103	C	C	.	.			trans	85.3	2.6	-178.9	0	0	0	0	0	115.4	P2400 I2401 Q2423 C2424	P2400-G2403 PolarHBondContact O-N 2.89Å; I2401-G2403 PolarHBondContact O-N 2.78Å; G2403-Q2423 WeakPolarHBondContact O-CA 3.35Å; G2403-C2424 WeakPolarHBondContact O-CB 3.41Å; G2403-C2424 PolarHBondContact O-N 2.72Å
2404	V	88.9	Confident	90.3	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.006	10%	0.096	C	C	.	.	S	Bend	trans	-110.5	163.7	-174.8	-53.8	0	0	0	0	111.3	F2372 D2376 E2402 S2406	F2372-V2404 HydrophobicContact CB-CG2 3.74Å; D2376-V2404 HydrophobicContact CB-CB 4.25Å; D2376-V2404 HydrophobicContact CB-CG1 4.22Å; D2376-V2404 WeakPolarHBondContact O-CG1 3.41Å; E2402-V2404 HydrophobicContact CB-CG2 4.01Å; V2404-S2406 VanDerWaalsContact C-N 3.35Å; V2404-S2406 VanDerWaalsContact CG2-OG 3.22Å; V2404-S2406 WeakPolarHBondContact CG2-OG 3.44Å
2405	K	89.1	Confident	90.3	Very high	37 Å²	37	17 Å²	17	16%	0.161	9%	0.088	C	C	.	.	S	Bend	trans	-67.3	-29.6	176	64.3	-171.1	170.5	80.9	0	114.2	D2376 V2384 L2386 L2408 E2409 Q2423	D2376-K2405 IonicContact OD1-NZ 3.13Å; D2376-K2405 IonicContact OD2-NZ 2.66Å; V2384-K2405 HydrophobicContact CG1-CD 4.47Å; L2386-K2405 HydrophobicContact CD2-CB 4.11Å; K2405-L2408 CarbonylContact O-C 3.59Å; K2405-L2408 WeakPolarHBondContact O-CA 3.39Å; K2405-L2408 PolarHBondContact O-N 3.25Å; K2405-E2409 IonicContact NZ-OE1 3.92Å; K2405-E2409 PolarHBondContact NZ-OE1 3.46Å; K2405-E2409 IonicContact NZ-OE2 2.67Å; K2405-E2409 PolarHBondContact NZ-OE2 3.27Å; K2405-E2409 PolarHBondContact O-N 2.97Å; K2405-Q2423 HydrophobicContact CB-CG 4.31Å; K2405-Q2423 VanDerWaalsContact CB-OE1 3.29Å; K2405-Q2423 VanDerWaalsContact CG-OE1 3.3Å
2406	S	86.6	Confident	90	Very high	18 Å²	18	20 Å²	20	13%	0.126	11%	0.108	C	C	.	.	H	α-helix	trans	-54.5	-48.9	-156.3	-13.2	0	0	0	0	114.2	D2376 V2404 L2408 E2409	D2376-S2406 WeakPolarHBondContact OD2-CB 3.31Å; D2376-S2406 PolarHBondContact OD2-OG 3.45Å; V2404-S2406 VanDerWaalsContact C-N 3.35Å; V2404-S2406 VanDerWaalsContact CG2-OG 3.22Å; V2404-S2406 WeakPolarHBondContact CG2-OG 3.44Å; S2406-L2408 PolarHBondContact O-N 3.22Å; S2406-L2408 VanDerWaalsContact O-N 3.11Å; S2406-E2409 WeakPolarHBondContact O-CB 3.47Å; S2406-E2409 PolarHBondContact O-N 3.46Å
2407	P	85	Confident	89.8	Confident	1 Å²	1	21 Å²	21	1%	0.006	11%	0.112	C	C	.	.	H	α-helix	trans	-57.8	-26.1	175.2	-30.5	39.6	0	0	0	115.4	Y2371 P2400 Y2458 Y2639 I2642 H2643	Y2371-P2407 WeakPolarHBondContact O-CD 3.38Å; Y2371-P2407 WeakPolarHBondContact O-CG 3.29Å; P2400-P2407 HydrophobicContact CG-CB 3.84Å; P2400-P2407 HydrophobicContact CG-CG 3.77Å; P2407-Y2458 HydrophobicContact CB-CE1 4.08Å; P2407-Y2639 HydrophobicContact CB-CE2 3.88Å; P2407-Y2639 HydrophobicContact CG-CE2 4.21Å; P2407-I2642 WeakPolarHBondContact O-CD1 3.43Å; P2407-H2643 PolarHBondContact O-CE1 3.22Å; P2407-H2643 PolarHBondContact O-ND1 3.22Å; P2407-H2643 VanDerWaalsContact O-ND1 3.1Å
2408	L	91.1	Very high	89.6	Confident	1 Å²	1	21.1 Å²	21.1	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-100.8	-4.7	179.7	-71.4	168.2	0	0	0	113.1	L2386 L2397 V2398 K2405 S2406 L2411 G2412 Y2458 I2642	L2386-L2408 HydrophobicContact CD1-CB 4.42Å; L2386-L2408 VanDerWaalsContact CD1-O 3.29Å; L2386-L2408 WeakPolarHBondContact CD1-O 3.49Å; L2397-L2408 HydrophobicContact CB-CD1 4.34Å; L2397-L2408 HydrophobicContact CD2-CB 4.48Å; L2397-L2408 HydrophobicContact CD2-CD2 4.29Å; V2398-L2408 WeakPolarHBondContact O-CD1 3.17Å; K2405-L2408 CarbonylContact O-C 3.59Å; K2405-L2408 WeakPolarHBondContact O-CA 3.39Å; K2405-L2408 PolarHBondContact O-N 3.25Å; S2406-L2408 PolarHBondContact O-N 3.22Å; S2406-L2408 VanDerWaalsContact O-N 3.11Å; L2408-L2411 HydrophobicContact CD2-CD2 3.78Å; L2408-L2411 PolarHBondContact O-N 2.84Å; L2408-G2412 PolarHBondContact O-N 2.85Å; L2408-Y2458 HydrophobicContact CD2-CD1 4Å; L2408-Y2458 HydrophobicContact CD2-CG 4.14Å; L2408-Y2458 HydrophobicContact CG-CD1 4.14Å; L2408-I2642 HydrophobicContact CD2-CD1 3.98Å
2409	E	88.2	Confident	89.6	Confident	69 Å²	69	21.1 Å²	21.1	32%	0.322	11%	0.113	S	C	.	.	H	α-helix	trans	-68.1	-42.2	-173.2	-162.8	156	-157	0	0	111	L2386 K2405 S2406 S2413	L2386-E2409 HydrophobicContact CD2-CG 4.33Å; K2405-E2409 IonicContact NZ-OE1 3.92Å; K2405-E2409 PolarHBondContact NZ-OE1 3.46Å; K2405-E2409 IonicContact NZ-OE2 2.67Å; K2405-E2409 PolarHBondContact NZ-OE2 3.27Å; K2405-E2409 PolarHBondContact O-N 2.97Å; S2406-E2409 WeakPolarHBondContact O-CB 3.47Å; S2406-E2409 PolarHBondContact O-N 3.46Å; E2409-S2413 VanDerWaalsContact O-CB 3.23Å; E2409-S2413 WeakPolarHBondContact O-CB 3.48Å; E2409-S2413 PolarHBondContact O-N 3.37Å; E2409-S2413 PolarHBondContact O-OG 3.49Å
2410	M	88.9	Confident	89.7	Confident	62 Å²	62	23.4 Å²	23.4	31%	0.305	12%	0.122	S	C	.	.	H	α-helix	trans	-59.7	-54.9	172	-168.5	173.3	-72.4	0	0	111.8	G2412 S2413 K2414 H2643 D2644 V2647	M2410-G2412 PolarHBondContact O-N 2.81Å; M2410-S2413 PolarHBondContact O-N 2.95Å; M2410-S2413 PolarHBondContact O-OG 3.06Å; M2410-K2414 PolarHBondContact O-N 2.93Å; M2410-H2643 HydrophobicContact SD-CB 4.32Å; M2410-D2644 PolarHBondContact SD-N 2.89Å; M2410-D2644 VanDerWaalsContact SD-N 3.43Å; M2410-V2647 HydrophobicContact CG-CG1 4.48Å; M2410-V2647 HydrophobicContact CG-CG2 4.46Å; M2410-V2647 HydrophobicContact SD-CG1 4.45Å
2411	L	92.3	Very high	89.9	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-53.3	-51.3	176.6	-178.2	72.5	0	0	0	112.4	L2397 L2408 S2413 K2414 L2415 L2489 I2642 V2647 T2650 V2651 I2654	L2397-L2411 HydrophobicContact CD2-CD2 4.07Å; L2397-L2411 HydrophobicContact CD2-CG 4.47Å; L2408-L2411 HydrophobicContact CD2-CD2 3.78Å; L2408-L2411 PolarHBondContact O-N 2.84Å; L2411-S2413 VanDerWaalsContact C-N 3.35Å; L2411-S2413 PolarHBondContact O-N 3.15Å; L2411-K2414 PolarHBondContact O-N 2.91Å; L2411-L2415 WeakPolarHBondContact O-CG 3.12Å; L2411-L2415 PolarHBondContact O-N 2.87Å; L2411-L2489 HydrophobicContact CD2-CD1 3.45Å; L2411-L2489 VanDerWaalsContact CD2-CD1 3.45Å; L2411-I2642 HydrophobicContact CD2-CG2 4.46Å; L2411-V2647 HydrophobicContact CB-CG2 3.99Å; L2411-V2647 HydrophobicContact CD1-CG2 3.74Å; L2411-V2647 HydrophobicContact CG-CG2 4.5Å; L2411-T2650 HydrophobicContact CD1-CG2 3.84Å; L2411-V2651 HydrophobicContact CD1-CG2 3.73Å; L2411-I2654 HydrophobicContact CD1-CD1 4.07Å; L2411-I2654 HydrophobicContact CD2-CD1 4.43Å
2412	G	88.6	Confident	90.3	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-68.3	-30.9	-178.4	0	0	0	0	0	113.7	N2387 L2408 M2410 A2419	N2387-G2412 PolarHBondContact ND2-O 3.18Å; L2408-G2412 PolarHBondContact O-N 2.85Å; M2410-G2412 PolarHBondContact O-N 2.81Å; G2412-A2419 WeakPolarHBondContact O-CB 3.4Å
2413	S	90.8	Very high	90.7	Very high	62 Å²	62	21.9 Å²	21.9	43%	0.434	12%	0.115	S	C	.	.	H	α-helix	trans	-64.2	-38.5	174.4	75.8	0	0	0	0	112.6	E2409 M2410 L2411	E2409-S2413 VanDerWaalsContact O-CB 3.23Å; E2409-S2413 WeakPolarHBondContact O-CB 3.48Å; E2409-S2413 PolarHBondContact O-N 3.37Å; E2409-S2413 PolarHBondContact O-OG 3.49Å; M2410-S2413 PolarHBondContact O-N 2.95Å; M2410-S2413 PolarHBondContact O-OG 3.06Å; L2411-S2413 VanDerWaalsContact C-N 3.35Å; L2411-S2413 PolarHBondContact O-N 3.15Å
2414	K	90.7	Very high	90.9	Very high	64 Å²	64	21.9 Å²	21.9	28%	0.278	12%	0.115	S	C	.	.	H	α-helix	trans	-83.7	-12.9	-178.9	-76.6	-179.1	163.2	-167.4	0	114.3	E819 M2410 L2411 V2647 D2648 V2651	E819-K2414 IonicContact OE1-NZ 3.27Å; E819-K2414 PolarHBondContact OE1-NZ 3.47Å; M2410-K2414 PolarHBondContact O-N 2.93Å; L2411-K2414 PolarHBondContact O-N 2.91Å; K2414-V2647 HydrophobicContact CD-CG1 3.61Å; K2414-D2648 VanDerWaalsContact CD-OD1 3.28Å; K2414-D2648 WeakPolarHBondContact CD-OD1 3.26Å; K2414-D2648 WeakPolarHBondContact CE-OD1 3.49Å; K2414-D2648 IonicContact NZ-OD1 2.7Å; K2414-D2648 PolarHBondContact NZ-OD1 3.14Å; K2414-D2648 IonicContact NZ-OD2 3.71Å; K2414-D2648 PolarHBondContact NZ-OD2 3.17Å; K2414-D2648 VanDerWaalsContact NZ-OD2 3.17Å; K2414-V2651 HydrophobicContact CB-CG2 3.97Å
2415	L	91.5	Very high	91	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	12%	0.116	C	C	.	.			trans	-65.4	133.2	177.8	-77.6	175.6	0	0	0	112.2	N2387 I2389 V2395 L2397 L2411 F2417 A2419 I2456 V2651 I2654	N2387-L2415 PolarHBondContact ND2-O 3.27Å; I2389-L2415 VanDerWaalsContact CD1-O 3.26Å; I2389-L2415 WeakPolarHBondContact CD1-O 3.41Å; V2395-L2415 HydrophobicContact CG1-CD1 4.05Å; L2397-L2415 HydrophobicContact CD1-CD1 4.14Å; L2397-L2415 HydrophobicContact CD2-CD1 4.17Å; L2411-L2415 WeakPolarHBondContact O-CG 3.12Å; L2411-L2415 PolarHBondContact O-N 2.87Å; L2415-F2417 PolarHBondContact O-N 3.45Å; L2415-A2419 HydrophobicContact CB-CB 4.45Å; L2415-A2419 HydrophobicContact CD1-CB 4.35Å; L2415-I2456 HydrophobicContact CD1-CD1 4.17Å; L2415-V2651 HydrophobicContact CD2-CG1 4.39Å; L2415-V2651 HydrophobicContact CD2-CG2 4.36Å; L2415-I2654 HydrophobicContact CD2-CB 4.2Å; L2415-I2654 HydrophobicContact CD2-CD1 4.3Å; L2415-I2654 HydrophobicContact CD2-CG2 3.54Å
2416	P	89.7	Confident	90.9	Very high	64 Å²	64	24.2 Å²	24.2	42%	0.416	13%	0.133	S	C	.	.	S	Bend	trans	-80.4	23.2	-177.6	34.1	-37.1	0	0	0	114.3	T2655	P2416-T2655 HydrophobicContact CG-CG2 3.99Å
2417	F	90	Very high	91	Very high	19 Å²	19	26.3 Å²	26.3	8%	0.083	15%	0.152	C	C	.	.	S	Bend	trans	-136.8	155.1	-178.5	-39.5	-74.9	0	0	0	109.5	N2387 V2395 L2415 A2419 R2454 T2655 F2658	N2387-F2417 PolarHBondContact ND2-O 3.35Å; V2395-F2417 HydrophobicContact CG2-CB 3.81Å; V2395-F2417 HydrophobicContact CG2-CD2 3.85Å; V2395-F2417 HydrophobicContact CG2-CG 4.09Å; L2415-F2417 PolarHBondContact O-N 3.45Å; F2417-A2419 PolarHBondContact O-N 3.24Å; F2417-R2454 VanDerWaalsContact CE1-NH1 3.28Å; F2417-T2655 HydrophobicContact CZ-CG2 4.26Å; F2417-F2658 HydrophobicContact CD2-CD2 4.19Å; F2417-F2658 HydrophobicContact CE2-CB 4.46Å; F2417-F2658 AromaticContact CE2-CD2 3.62Å; F2417-F2658 HydrophobicContact CE2-CD2 3.62Å; F2417-F2658 HydrophobicContact CE2-CE2 4.36Å; F2417-F2658 HydrophobicContact CE2-CG 4.49Å; F2417-F2658 HydrophobicContact CZ-CB 4.15Å; F2417-F2658 HydrophobicContact CZ-CD2 4.16Å
2418	P	92.8	Very high	91.3	Very high	4 Å²	4	26.8 Å²	26.8	3%	0.026	16%	0.155	C	C	.	.			trans	-56.9	106.9	177.6	-24.5	34.8	0	0	0	111.7	I2389 E2391 P2394 V2395 Y2420	I2389-P2418 HydrophobicContact CG2-CG 4.1Å; I2389-P2418 WeakPolarHBondContact O-CB 3.22Å; E2391-P2418 WeakPolarHBondContact O-CD 3.38Å; E2391-P2418 WeakPolarHBondContact O-CG 3.48Å; P2394-P2418 CarbonylContact C-O 3.48Å; P2394-P2418 WeakPolarHBondContact CA-O 3.43Å; V2395-P2418 PolarHBondContact N-O 3.17Å; P2418-Y2420 HydrophobicContact CB-CE2 4.11Å
2419	A	94.6	Very high	91.3	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	131.8	-169.5	0	0	0	0	0	111.4	K2385 L2386 N2387 L2397 G2412 L2415 F2417	K2385-A2419 CarbonylContact C-O 3.59Å; K2385-A2419 WeakPolarHBondContact CA-O 3.42Å; K2385-A2419 WeakPolarHBondContact CG-O 3.43Å; L2386-A2419 HydrophobicContact CB-CB 4.3Å; L2386-A2419 PolarHBondContact N-O 2.8Å; N2387-A2419 PolarHBondContact OD1-N 3.25Å; L2397-A2419 HydrophobicContact CD1-CB 3.97Å; G2412-A2419 WeakPolarHBondContact O-CB 3.4Å; L2415-A2419 HydrophobicContact CB-CB 4.45Å; L2415-A2419 HydrophobicContact CD1-CB 4.35Å; F2417-A2419 PolarHBondContact O-N 3.24Å
2420	Y	95.5	Very high	91.4	Very high	48 Å²	48	27.1 Å²	27.1	19%	0.188	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	128	179.8	-67.3	-92.6	0	0	0	110.2	V2384 K2385 P2394 V2395 F2396 L2397 P2418 I2447	V2384-Y2420 CarbonylContact O-C 3.44Å; V2384-Y2420 WeakPolarHBondContact O-CA 3.35Å; K2385-Y2420 HydrophobicContact CB-CD1 3.85Å; K2385-Y2420 HydrophobicContact CB-CE1 3.67Å; K2385-Y2420 HydrophobicContact CD-CE1 4.19Å; K2385-Y2420 HydrophobicContact CG-CD1 4.05Å; K2385-Y2420 HydrophobicContact CG-CE1 3.68Å; K2385-Y2420 HydrophobicContact CG-CE2 4.36Å; P2394-Y2420 HydrophobicContact CB-CD2 4.33Å; P2394-Y2420 HydrophobicContact CB-CE2 4.32Å; V2395-Y2420 PolarHBondContact O-N 3.08Å; F2396-Y2420 CarbonylContact C-O 3.59Å; F2396-Y2420 WeakPolarHBondContact CA-O 3.46Å; F2396-Y2420 HydrophobicContact CE1-CD2 4.25Å; F2396-Y2420 HydrophobicContact CE1-CG 4.22Å; L2397-Y2420 PolarHBondContact N-O 2.95Å; P2418-Y2420 HydrophobicContact CB-CE2 4.11Å; Y2420-I2447 HydrophobicContact CD1-CD1 3.74Å; Y2420-I2447 HydrophobicContact CD2-CG2 4.39Å; Y2420-I2447 HydrophobicContact CE1-CD1 4Å; Y2420-I2447 HydrophobicContact CE1-CG2 4.27Å; Y2420-I2447 HydrophobicContact CE2-CG2 4.02Å; Y2420-I2447 HydrophobicContact CG-CD1 4.23Å
2421	C	95.2	Very high	91.4	Very high	0 Å²	0	29 Å²	29	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	133.9	175.9	-171.1	0	0	0	0	111.5	V2383 V2384 L2386 L2397	V2383-C2421 CarbonylContact C-O 3.57Å; V2383-C2421 VanDerWaalsContact CA-O 3.31Å; V2383-C2421 WeakPolarHBondContact CA-O 3.25Å; V2384-C2421 PolarHBondContact N-O 3.06Å; V2384-C2421 PolarHBondContact O-N 2.93Å; L2386-C2421 HydrophobicContact CD1-CB 3.55Å; L2386-C2421 HydrophobicContact CD2-CB 3.82Å; L2386-C2421 HydrophobicContact CG-CB 3.71Å; L2397-C2421 HydrophobicContact CB-CB 4.24Å; L2397-C2421 WeakPolarHBondContact O-CA 3.35Å
2422	F	95.5	Very high	91.3	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	149.8	169.7	-60.9	-71	0	0	0	111.5	P2382 V2383 F2396 L2397 V2398 H2399 Y2440 C2443 M2444 M2468	P2382-F2422 CarbonylContact O-C 3.45Å; P2382-F2422 VanDerWaalsContact O-CA 3.3Å; P2382-F2422 WeakPolarHBondContact O-CA 3.45Å; V2383-F2422 HydrophobicContact CB-CD1 3.86Å; V2383-F2422 HydrophobicContact CB-CE1 4.09Å; V2383-F2422 HydrophobicContact CG2-CD1 3.78Å; V2383-F2422 HydrophobicContact CG2-CE1 3.79Å; F2396-F2422 HydrophobicContact CB-CE2 3.86Å; F2396-F2422 HydrophobicContact CB-CZ 4.21Å; F2396-F2422 HydrophobicContact CD1-CE2 4.33Å; F2396-F2422 AromaticContact CD1-CZ 3.89Å; F2396-F2422 HydrophobicContact CD1-CZ 3.89Å; F2396-F2422 HydrophobicContact CG-CE2 4.45Å; F2396-F2422 HydrophobicContact CG-CZ 4.32Å; L2397-F2422 WeakPolarHBondContact O-CD2 3.43Å; L2397-F2422 PolarHBondContact O-N 3.3Å; V2398-F2422 HydrophobicContact CG2-CD2 4.06Å; V2398-F2422 HydrophobicContact CG2-CE2 4.49Å; H2399-F2422 WeakPolarHBondContact CB-O 3.19Å; H2399-F2422 PolarHBondContact CD2-O 2.93Å; F2422-Y2440 HydrophobicContact CB-CD1 3.82Å; F2422-Y2440 HydrophobicContact CB-CD2 3.7Å; F2422-Y2440 HydrophobicContact CB-CE1 3.85Å; F2422-Y2440 HydrophobicContact CB-CE2 3.71Å; F2422-Y2440 HydrophobicContact CB-CG 3.79Å; F2422-Y2440 AromaticContact CD1-CD1 3.67Å; F2422-Y2440 HydrophobicContact CD1-CD1 3.67Å; F2422-Y2440 HydrophobicContact CD1-CD2 4.42Å; F2422-Y2440 HydrophobicContact CD1-CE1 4.41Å; F2422-Y2440 AromaticContact CD1-CG 3.71Å; F2422-Y2440 HydrophobicContact CD1-CG 3.71Å; F2422-Y2440 HydrophobicContact CD2-CD2 4.13Å; F2422-Y2440 HydrophobicContact CD2-CG 4.09Å; F2422-Y2440 HydrophobicContact CE1-CG 4.37Å; F2422-Y2440 WeakPolarHBondContact CE1-O 3.37Å; F2422-Y2440 AromaticContact CG-CD1 3.83Å; F2422-Y2440 HydrophobicContact CG-CD1 3.83Å; F2422-Y2440 AromaticContact CG-CD2 3.82Å; F2422-Y2440 HydrophobicContact CG-CD2 3.82Å; F2422-Y2440 HydrophobicContact CG-CE1 4.38Å; F2422-Y2440 HydrophobicContact CG-CE2 4.35Å; F2422-Y2440 AromaticContact CG-CG 3.57Å; F2422-Y2440 HydrophobicContact CG-CG 3.57Å; F2422-C2443 HydrophobicContact CD1-CB 4.33Å; F2422-C2443 HydrophobicContact CE1-CB 3.88Å; F2422-M2444 HydrophobicContact CE1-CB 4.45Å; F2422-M2444 HydrophobicContact CZ-CB 3.87Å; F2422-M2444 HydrophobicContact CZ-CG 4.18Å; F2422-M2468 HydrophobicContact CE2-CE 3.79Å; F2422-M2468 HydrophobicContact CE2-SD 4.35Å; F2422-M2468 HydrophobicContact CZ-CE 4.11Å
2423	Q	92.2	Very high	91.5	Very high	7 Å²	7	31.2 Å²	31.2	3%	0.033	19%	0.192	C	C	.	.			trans	-133.2	143.8	175.9	-55.2	-165.9	108.5	0	0	112.2	P2379 L2381 P2382 V2384 G2403 K2405 T2425 Y2440	P2379-Q2423 HydrophobicContact CB-CB 3.88Å; P2379-Q2423 HydrophobicContact CB-CG 4.41Å; P2379-Q2423 VanDerWaalsContact CB-NE2 3.33Å; P2379-Q2423 HydrophobicContact CG-CB 3.85Å; L2381-Q2423 PolarHBondContact O-NE2 3.42Å; P2382-Q2423 PolarHBondContact O-N 3.07Å; V2384-Q2423 VanDerWaalsContact CG2-NE2 3.32Å; G2403-Q2423 WeakPolarHBondContact O-CA 3.35Å; K2405-Q2423 HydrophobicContact CB-CG 4.31Å; K2405-Q2423 VanDerWaalsContact CB-OE1 3.29Å; K2405-Q2423 VanDerWaalsContact CG-OE1 3.3Å; Q2423-T2425 VanDerWaalsContact C-N 3.26Å; Q2423-T2425 PolarHBondContact O-N 2.84Å; Q2423-Y2440 VanDerWaalsContact C-OH 3.29Å; Q2423-Y2440 PolarHBondContact O-OH 2.65Å
2424	C	91.6	Very high	91.5	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.014	19%	0.188	C	C	.	.			trans	-77.6	68.2	179.4	-175.7	0	0	0	0	111.3	G2403 Y2440 F2575 K2583	G2403-C2424 WeakPolarHBondContact O-CB 3.41Å; G2403-C2424 PolarHBondContact O-N 2.72Å; C2424-Y2440 WeakPolarHBondContact CA-OH 3.41Å; C2424-Y2440 PolarHBondContact N-OH 3.03Å; C2424-F2575 WeakPolarHBondContact O-CE1 3.32Å; C2424-F2575 VanDerWaalsContact O-CZ 3.26Å; C2424-F2575 WeakPolarHBondContact O-CZ 3.3Å; C2424-K2583 HydrophobicContact CB-CD 4.43Å
2425	T	91.4	Very high	91.6	Very high	5 Å²	5	30.2 Å²	30.2	3%	0.031	18%	0.184	C	C	.	.			trans	-66.3	165.5	172.1	71.5	0	0	0	0	111.7	P2379 P2382 Q2423 A2427 V2428	P2379-T2425 HydrophobicContact CB-CG2 4.44Å; P2379-T2425 HydrophobicContact CG-CG2 4.37Å; P2379-T2425 WeakPolarHBondContact O-CB 3.08Å; P2379-T2425 WeakPolarHBondContact O-CG2 3.43Å; P2382-T2425 VanDerWaalsContact CA-CG2 3.48Å; P2382-T2425 HydrophobicContact CB-CG2 3.85Å; P2382-T2425 VanDerWaalsContact N-CG2 3.34Å; Q2423-T2425 VanDerWaalsContact C-N 3.26Å; Q2423-T2425 PolarHBondContact O-N 2.84Å; T2425-A2427 PolarHBondContact O-N 2.8Å; T2425-A2427 PolarHBondContact OG1-N 3.34Å; T2425-V2428 WeakPolarHBondContact O-CB 3.3Å; T2425-V2428 PolarHBondContact O-N 2.82Å
2426	P	87.1	Confident	91.8	Very high	81 Å²	81	30.2 Å²	30.2	53%	0.526	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-11.8	171.2	-25.6	34.6	0	0	0	116	R2378 F2575	R2378-P2426 HydrophobicContact CG-CG 4.45Å; P2426-F2575 HydrophobicContact CB-CD2 4.37Å; P2426-F2575 HydrophobicContact CB-CE2 3.95Å; P2426-F2575 HydrophobicContact CG-CD2 3.94Å; P2426-F2575 HydrophobicContact CG-CE1 4.45Å; P2426-F2575 HydrophobicContact CG-CE2 3.69Å; P2426-F2575 HydrophobicContact CG-CG 4.43Å; P2426-F2575 HydrophobicContact CG-CZ 3.96Å
2427	A	87.9	Confident	92	Very high	62 Å²	62	27.1 Å²	27.1	51%	0.512	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-8.7	175.3	0	0	0	0	0	114.1	T2425 Y2439	T2425-A2427 PolarHBondContact O-N 2.8Å; T2425-A2427 PolarHBondContact OG1-N 3.34Å; A2427-Y2439 WeakPolarHBondContact CB-OH 3.39Å
2428	V	91.6	Very high	92.2	Very high	12 Å²	12	30.5 Å²	30.5	7%	0.073	18%	0.183	C	C	.	.	S	Bend	trans	-80.3	125.5	-176.8	179.9	0	0	0	0	110.8	T2425 L2430 I2436 Y2439 Y2440	T2425-V2428 WeakPolarHBondContact O-CB 3.3Å; T2425-V2428 PolarHBondContact O-N 2.82Å; V2428-L2430 HydrophobicContact CG1-CD2 4.35Å; V2428-L2430 PolarHBondContact O-N 3.4Å; V2428-I2436 HydrophobicContact CG1-CG1 4.19Å; V2428-I2436 HydrophobicContact CG1-CG2 4.02Å; V2428-Y2439 HydrophobicContact CG2-CD1 3.94Å; V2428-Y2439 HydrophobicContact CG2-CE1 3.75Å; V2428-Y2440 HydrophobicContact CG1-CE1 4.22Å; V2428-Y2440 HydrophobicContact CG2-CE1 3.82Å
2429	P	91.4	Very high	92.3	Very high	49 Å²	49	33.4 Å²	33.4	32%	0.318	19%	0.194	S	C	.	.			trans	-78.9	88.7	-175.8	31.8	-35.8	0	0	0	112.1	T2431 S2435	P2429-T2431 PolarHBondContact O-N 2.89Å; P2429-S2435 WeakPolarHBondContact CG-O 3.47Å; P2429-S2435 WeakPolarHBondContact O-CB 3.33Å
2430	L	90.5	Very high	92.4	Very high	27 Å²	27	33.4 Å²	33.4	14%	0.141	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	50.4	177.4	-62.7	-179.8	0	0	0	114.1	V2428 I2436 Q2582 K2583	V2428-L2430 HydrophobicContact CG1-CD2 4.35Å; V2428-L2430 PolarHBondContact O-N 3.4Å; L2430-I2436 HydrophobicContact CD2-CD1 3.65Å; L2430-I2436 HydrophobicContact CD2-CG1 4.12Å; L2430-Q2582 HydrophobicContact CB-CB 3.99Å; L2430-Q2582 HydrophobicContact CD1-CB 3.97Å; L2430-K2583 HydrophobicContact CD1-CG 4.16Å; L2430-K2583 HydrophobicContact CD2-CD 4.31Å; L2430-K2583 HydrophobicContact CD2-CG 3.68Å
2431	T	88	Confident	92.3	Very high	102 Å²	102	31.6 Å²	31.6	63%	0.626	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105	-30.2	178.9	54.7	0	0	0	0	113.6	P2429 S2435	P2429-T2431 PolarHBondContact O-N 2.89Å; T2431-S2435 WeakPolarHBondContact OG1-CB 3.44Å; T2431-S2435 PolarHBondContact OG1-OG 2.88Å
2432	S	90.7	Very high	92.2	Very high	43 Å²	43	39.4 Å²	39.4	30%	0.301	22%	0.221	S	C	.	.			trans	-161	164	174.1	79.9	0	0	0	0	110.7	E2434 S2435 I2436	S2432-E2434 VanDerWaalsContact C-N 3.3Å; S2432-E2434 PolarHBondContact O-N 3Å; S2432-E2434 PolarHBondContact OG-N 3.17Å; S2432-S2435 PolarHBondContact N-OG 2.82Å; S2432-S2435 WeakPolarHBondContact O-CB 3.49Å; S2432-S2435 PolarHBondContact O-N 2.84Å; S2432-S2435 VanDerWaalsContact O-N 3.17Å; S2432-S2435 PolarHBondContact OG-N 3.05Å; S2432-S2435 PolarHBondContact OG-OG 3.04Å; S2432-I2436 WeakPolarHBondContact O-CG1 3.49Å; S2432-I2436 PolarHBondContact O-N 3.03Å
2433	M	92	Very high	92.1	Very high	4 Å²	4	40.6 Å²	40.6	2%	0.02	23%	0.229	C	C	.	.	H	α-helix	trans	-63.4	-37.5	177.8	-149	73.4	80.4	0	0	111.6	I2436 A2437 Y2460 N2463 I2464 V2586 Y2590	M2433-I2436 PolarHBondContact O-N 2.73Å; M2433-A2437 WeakPolarHBondContact O-CB 3.34Å; M2433-A2437 PolarHBondContact O-N 2.61Å; M2433-Y2460 HydrophobicContact CE-CD2 4.22Å; M2433-Y2460 HydrophobicContact CE-CE2 3.67Å; M2433-Y2460 HydrophobicContact SD-CE1 4.49Å; M2433-Y2460 HydrophobicContact SD-CE2 3.94Å; M2433-N2463 HydrophobicContact CE-CB 3.87Å; M2433-N2463 HydrophobicContact CG-CB 4.5Å; M2433-N2463 HydrophobicContact SD-CB 4.39Å; M2433-I2464 HydrophobicContact CG-CG1 3.9Å; M2433-I2464 HydrophobicContact SD-CD1 4.23Å; M2433-I2464 HydrophobicContact SD-CG1 3.37Å; M2433-I2464 WeakPolarHBondContact SD-CG1 3.46Å; M2433-V2586 HydrophobicContact CB-CG1 4.23Å; M2433-V2586 HydrophobicContact CE-CG1 4.1Å; M2433-V2586 HydrophobicContact SD-CG1 3.95Å; M2433-Y2590 HydrophobicContact CB-CD2 3.38Å; M2433-Y2590 HydrophobicContact CB-CE2 3.69Å; M2433-Y2590 HydrophobicContact CB-CG 4.08Å; M2433-Y2590 HydrophobicContact CE-CD1 3.98Å; M2433-Y2590 HydrophobicContact CE-CD2 4.28Å; M2433-Y2590 HydrophobicContact CE-CG 3.72Å; M2433-Y2590 HydrophobicContact CG-CD2 3.87Å; M2433-Y2590 HydrophobicContact CG-CE2 3.94Å; M2433-Y2590 HydrophobicContact CG-CG 4.25Å
2434	E	91.6	Very high	92.2	Very high	75 Å²	75	40.3 Å²	40.3	35%	0.35	23%	0.228	S	C	.	.	H	α-helix	trans	-64.3	-38.2	173.4	174.7	166	-141.2	0	0	112	S2432 I2436 A2437 L2438 L2471 R2594	S2432-E2434 VanDerWaalsContact C-N 3.3Å; S2432-E2434 PolarHBondContact O-N 3Å; S2432-E2434 PolarHBondContact OG-N 3.17Å; E2434-I2436 VanDerWaalsContact C-N 3.33Å; E2434-I2436 PolarHBondContact O-N 3.49Å; E2434-A2437 PolarHBondContact O-N 3Å; E2434-L2438 HydrophobicContact CG-CD1 3.9Å; E2434-L2438 HydrophobicContact CG-CG 4.35Å; E2434-L2438 WeakPolarHBondContact O-CB 3.25Å; E2434-L2438 VanDerWaalsContact O-CG 3.27Å; E2434-L2438 WeakPolarHBondContact O-CG 3.3Å; E2434-L2438 PolarHBondContact O-N 2.61Å; E2434-L2471 HydrophobicContact CG-CD1 4.38Å; E2434-R2594 IonicContact OE1-CZ 2.7Å; E2434-R2594 VanDerWaalsContact OE1-CZ 3.3Å; E2434-R2594 IonicContact OE1-NH1 3.18Å; E2434-R2594 PolarHBondContact OE1-NH1 3.43Å; E2434-R2594 IonicContact OE1-NH2 3.68Å; E2434-R2594 PolarHBondContact OE1-NH2 2.63Å; E2434-R2594 IonicContact OE2-NH2 2.75Å; E2434-R2594 PolarHBondContact OE2-NH2 3.32Å
2435	S	93.3	Very high	92.2	Very high	30 Å²	30	42.2 Å²	42.2	21%	0.21	24%	0.236	C	C	.	.	H	α-helix	trans	-60.8	-42.6	175.1	-51.9	0	0	0	0	111.9	P2429 T2431 S2432 Y2439	P2429-S2435 WeakPolarHBondContact CG-O 3.47Å; P2429-S2435 WeakPolarHBondContact O-CB 3.33Å; T2431-S2435 WeakPolarHBondContact OG1-CB 3.44Å; T2431-S2435 PolarHBondContact OG1-OG 2.88Å; S2432-S2435 PolarHBondContact N-OG 2.82Å; S2432-S2435 WeakPolarHBondContact O-CB 3.49Å; S2432-S2435 PolarHBondContact O-N 2.84Å; S2432-S2435 VanDerWaalsContact O-N 3.17Å; S2432-S2435 PolarHBondContact OG-N 3.05Å; S2432-S2435 PolarHBondContact OG-OG 3.04Å; S2435-Y2439 PolarHBondContact O-N 3.14Å
2436	I	94.5	Very high	92	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-70.2	-46.8	178.3	-58.9	165.4	0	0	0	109.9	V2428 L2430 S2432 M2433 E2434 L2438 Y2439 Y2440 Y2460 I2464 V2586	V2428-I2436 HydrophobicContact CG1-CG1 4.19Å; V2428-I2436 HydrophobicContact CG1-CG2 4.02Å; L2430-I2436 HydrophobicContact CD2-CD1 3.65Å; L2430-I2436 HydrophobicContact CD2-CG1 4.12Å; S2432-I2436 WeakPolarHBondContact O-CG1 3.49Å; S2432-I2436 PolarHBondContact O-N 3.03Å; M2433-I2436 PolarHBondContact O-N 2.73Å; E2434-I2436 VanDerWaalsContact C-N 3.33Å; E2434-I2436 PolarHBondContact O-N 3.49Å; I2436-L2438 PolarHBondContact O-N 3.21Å; I2436-Y2439 WeakPolarHBondContact O-CB 3.35Å; I2436-Y2439 PolarHBondContact O-N 2.89Å; I2436-Y2439 VanDerWaalsContact O-N 3.13Å; I2436-Y2440 HydrophobicContact CG2-CD2 3.77Å; I2436-Y2440 HydrophobicContact CG2-CE2 3.38Å; I2436-Y2440 PolarHBondContact O-N 3.36Å; I2436-Y2460 WeakPolarHBondContact CD1-OH 3.38Å; I2436-I2464 HydrophobicContact CG2-CD1 3.78Å; I2436-I2464 HydrophobicContact CG2-CG1 4.31Å; I2436-I2464 HydrophobicContact CG2-CG2 4.14Å; I2436-V2586 HydrophobicContact CD1-CG1 4.17Å
2437	A	94.6	Very high	92.2	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.9	-44	177.8	0	0	0	0	0	112.5	M2433 E2434 Y2439 Y2440 I2441 I2464 M2468 L2471	M2433-A2437 WeakPolarHBondContact O-CB 3.34Å; M2433-A2437 PolarHBondContact O-N 2.61Å; E2434-A2437 PolarHBondContact O-N 3Å; A2437-Y2439 VanDerWaalsContact C-N 3.32Å; A2437-Y2439 PolarHBondContact O-N 3.36Å; A2437-Y2440 PolarHBondContact O-N 3.33Å; A2437-I2441 WeakPolarHBondContact O-CB 3.12Å; A2437-I2441 VanDerWaalsContact O-CG1 3.29Å; A2437-I2441 WeakPolarHBondContact O-CG1 3.48Å; A2437-I2441 PolarHBondContact O-N 2.85Å; A2437-I2464 HydrophobicContact CB-CG2 4.2Å; A2437-M2468 HydrophobicContact CB-CB 4.49Å; A2437-M2468 HydrophobicContact CB-CG 3.59Å; A2437-L2471 HydrophobicContact CB-CD1 3.88Å
2438	L	94	Very high	92.4	Very high	90 Å²	90	42.3 Å²	42.3	47%	0.471	24%	0.238	S	C	.	.	H	α-helix	trans	-63.4	-35.5	175.4	-75.2	169.4	0	0	0	112.7	E2434 I2436 K2442 L2471	E2434-L2438 HydrophobicContact CG-CD1 3.9Å; E2434-L2438 HydrophobicContact CG-CG 4.35Å; E2434-L2438 WeakPolarHBondContact O-CB 3.25Å; E2434-L2438 VanDerWaalsContact O-CG 3.27Å; E2434-L2438 WeakPolarHBondContact O-CG 3.3Å; E2434-L2438 PolarHBondContact O-N 2.61Å; I2436-L2438 PolarHBondContact O-N 3.21Å; L2438-K2442 WeakPolarHBondContact O-CB 3.44Å; L2438-K2442 PolarHBondContact O-N 2.99Å; L2438-L2471 HydrophobicContact CD2-CD1 3.96Å; L2438-L2471 HydrophobicContact CD2-CD2 4.22Å; L2438-L2471 HydrophobicContact CG-CD1 3.92Å
2439	Y	95.1	Very high	92.2	Very high	65 Å²	65	46.7 Å²	46.7	26%	0.255	27%	0.267	S	S	.	.	H	α-helix	trans	-69	-45.6	174.9	-173.1	-91.5	0	0	0	111.2	P2382 A2427 V2428 S2435 I2436 A2437 K2442 C2443	P2382-Y2439 HydrophobicContact CB-CE1 3.92Å; A2427-Y2439 WeakPolarHBondContact CB-OH 3.39Å; V2428-Y2439 HydrophobicContact CG2-CD1 3.94Å; V2428-Y2439 HydrophobicContact CG2-CE1 3.75Å; S2435-Y2439 PolarHBondContact O-N 3.14Å; I2436-Y2439 WeakPolarHBondContact O-CB 3.35Å; I2436-Y2439 PolarHBondContact O-N 2.89Å; I2436-Y2439 VanDerWaalsContact O-N 3.13Å; A2437-Y2439 VanDerWaalsContact C-N 3.32Å; A2437-Y2439 PolarHBondContact O-N 3.36Å; Y2439-K2442 WeakPolarHBondContact O-CB 3.45Å; Y2439-K2442 PolarHBondContact O-N 3Å; Y2439-C2443 PolarHBondContact O-N 2.94Å; Y2439-C2443 VanDerWaalsContact O-N 3.08Å
2440	Y	96	Very high	91.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-69.9	-36.6	178.4	-66.6	-20.1	0	0	0	113.6	V2398 H2399 F2422 Q2423 C2424 V2428 I2436 A2437 K2442 C2443 M2444 I2464	V2398-Y2440 HydrophobicContact CG1-CD2 4.04Å; V2398-Y2440 HydrophobicContact CG1-CE2 4.06Å; H2399-Y2440 AromaticContact CD2-CE2 3.8Å; H2399-Y2440 AromaticContact CD2-CZ 3.83Å; H2399-Y2440 PolarHBondContact CD2-OH 2.82Å; H2399-Y2440 AromaticContact NE2-CE2 3.43Å; H2399-Y2440 WeakPolarHBondContact NE2-CE2 3.48Å; H2399-Y2440 AromaticContact NE2-CZ 3.46Å; H2399-Y2440 PolarHBondContact NE2-OH 2.8Å; F2422-Y2440 HydrophobicContact CB-CD1 3.82Å; F2422-Y2440 HydrophobicContact CB-CD2 3.7Å; F2422-Y2440 HydrophobicContact CB-CE1 3.85Å; F2422-Y2440 HydrophobicContact CB-CE2 3.71Å; F2422-Y2440 HydrophobicContact CB-CG 3.79Å; F2422-Y2440 AromaticContact CD1-CD1 3.67Å; F2422-Y2440 HydrophobicContact CD1-CD1 3.67Å; F2422-Y2440 HydrophobicContact CD1-CD2 4.42Å; F2422-Y2440 HydrophobicContact CD1-CE1 4.41Å; F2422-Y2440 AromaticContact CD1-CG 3.71Å; F2422-Y2440 HydrophobicContact CD1-CG 3.71Å; F2422-Y2440 HydrophobicContact CD2-CD2 4.13Å; F2422-Y2440 HydrophobicContact CD2-CG 4.09Å; F2422-Y2440 HydrophobicContact CE1-CG 4.37Å; F2422-Y2440 WeakPolarHBondContact CE1-O 3.37Å; F2422-Y2440 AromaticContact CG-CD1 3.83Å; F2422-Y2440 HydrophobicContact CG-CD1 3.83Å; F2422-Y2440 AromaticContact CG-CD2 3.82Å; F2422-Y2440 HydrophobicContact CG-CD2 3.82Å; F2422-Y2440 HydrophobicContact CG-CE1 4.38Å; F2422-Y2440 HydrophobicContact CG-CE2 4.35Å; F2422-Y2440 AromaticContact CG-CG 3.57Å; F2422-Y2440 HydrophobicContact CG-CG 3.57Å; Q2423-Y2440 VanDerWaalsContact C-OH 3.29Å; Q2423-Y2440 PolarHBondContact O-OH 2.65Å; C2424-Y2440 WeakPolarHBondContact CA-OH 3.41Å; C2424-Y2440 PolarHBondContact N-OH 3.03Å; V2428-Y2440 HydrophobicContact CG1-CE1 4.22Å; V2428-Y2440 HydrophobicContact CG2-CE1 3.82Å; I2436-Y2440 HydrophobicContact CG2-CD2 3.77Å; I2436-Y2440 HydrophobicContact CG2-CE2 3.38Å; I2436-Y2440 PolarHBondContact O-N 3.36Å; A2437-Y2440 PolarHBondContact O-N 3.33Å; Y2440-K2442 PolarHBondContact O-N 3.39Å; Y2440-C2443 PolarHBondContact O-N 2.86Å; Y2440-M2444 VanDerWaalsContact O-CB 3.32Å; Y2440-M2444 WeakPolarHBondContact O-CB 3.4Å; Y2440-M2444 PolarHBondContact O-N 2.94Å; Y2440-I2464 HydrophobicContact CD2-CG2 4.03Å; Y2440-I2464 HydrophobicContact CE2-CD1 4.49Å
2441	I	94.8	Very high	91.7	Very high	10 Å²	10	48.2 Å²	48.2	5%	0.051	28%	0.28	C	S	.	.	H	α-helix	trans	-54.9	-44	167.6	-73.1	165.2	0	0	0	110.3	A2437 C2443 M2444 E2445 M2468 L2471 L2472	A2437-I2441 WeakPolarHBondContact O-CB 3.12Å; A2437-I2441 VanDerWaalsContact O-CG1 3.29Å; A2437-I2441 WeakPolarHBondContact O-CG1 3.48Å; A2437-I2441 PolarHBondContact O-N 2.85Å; I2441-C2443 VanDerWaalsContact C-N 3.32Å; I2441-C2443 PolarHBondContact O-N 3.17Å; I2441-M2444 WeakPolarHBondContact O-CB 3.27Å; I2441-M2444 PolarHBondContact O-N 2.89Å; I2441-M2444 VanDerWaalsContact O-N 3.15Å; I2441-E2445 HydrophobicContact CG2-CG 4.19Å; I2441-E2445 WeakPolarHBondContact O-CB 3.49Å; I2441-E2445 WeakPolarHBondContact O-CG 3.47Å; I2441-E2445 PolarHBondContact O-N 2.99Å; I2441-M2468 HydrophobicContact CD1-CB 4.35Å; I2441-M2468 HydrophobicContact CD1-CG 4.42Å; I2441-M2468 HydrophobicContact CG1-CB 4.23Å; I2441-M2468 HydrophobicContact CG1-CE 4.05Å; I2441-M2468 HydrophobicContact CG1-CG 4.09Å; I2441-L2471 HydrophobicContact CD1-CB 3.63Å; I2441-L2471 HydrophobicContact CD1-CD1 3.99Å; I2441-L2471 HydrophobicContact CD1-CG 4.49Å; I2441-L2472 HydrophobicContact CD1-CD2 4.35Å; I2441-L2472 HydrophobicContact CD1-CG 4.04Å; I2441-L2472 HydrophobicContact CG1-CD1 4.37Å; I2441-L2472 HydrophobicContact CG1-CD2 4.23Å; I2441-L2472 HydrophobicContact CG1-CG 4.15Å; I2441-L2472 HydrophobicContact CG2-CD2 4.02Å
2442	K	92.1	Very high	91.8	Very high	163 Å²	163	46 Å²	46	71%	0.709	27%	0.268	S	S	*	.	H	α-helix	trans	-68.3	-29.5	-178.8	-164.1	175.7	-177.5	-177.9	0	113.3	L2438 Y2439 Y2440	L2438-K2442 WeakPolarHBondContact O-CB 3.44Å; L2438-K2442 PolarHBondContact O-N 2.99Å; Y2439-K2442 WeakPolarHBondContact O-CB 3.45Å; Y2439-K2442 PolarHBondContact O-N 3Å; Y2440-K2442 PolarHBondContact O-N 3.39Å
2443	C	93.2	Very high	91.9	Very high	26 Å²	26	44 Å²	44	18%	0.176	25%	0.254	C	S	.	.	H	α-helix	trans	-73.6	-40.6	168.6	-67.8	0	0	0	0	111.9	V2383 F2422 Y2439 Y2440 I2441 G2446	V2383-C2443 HydrophobicContact CG1-CB 4.47Å; F2422-C2443 HydrophobicContact CD1-CB 4.33Å; F2422-C2443 HydrophobicContact CE1-CB 3.88Å; Y2439-C2443 PolarHBondContact O-N 2.94Å; Y2439-C2443 VanDerWaalsContact O-N 3.08Å; Y2440-C2443 PolarHBondContact O-N 2.86Å; I2441-C2443 VanDerWaalsContact C-N 3.32Å; I2441-C2443 PolarHBondContact O-N 3.17Å; C2443-G2446 PolarHBondContact O-N 3.49Å; C2443-G2446 VanDerWaalsContact O-N 3.15Å
2444	M	94.5	Very high	92	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60.1	-46.6	178.3	-160.9	178.3	64.4	0	0	111.8	F2396 F2422 Y2440 I2441 G2446 I2447 Q2448 Y2453 I2455 M2468 L2472	F2396-M2444 HydrophobicContact CB-CG 4.47Å; F2396-M2444 HydrophobicContact CB-SD 4.21Å; F2396-M2444 HydrophobicContact CD1-CG 3.75Å; F2396-M2444 HydrophobicContact CD2-CG 3.5Å; F2396-M2444 VanDerWaalsContact CD2-CG 3.5Å; F2396-M2444 HydrophobicContact CD2-SD 3.65Å; F2396-M2444 HydrophobicContact CE1-CG 3.74Å; F2396-M2444 HydrophobicContact CE2-CG 3.48Å; F2396-M2444 VanDerWaalsContact CE2-CG 3.48Å; F2396-M2444 HydrophobicContact CE2-SD 4.13Å; F2396-M2444 HydrophobicContact CG-CG 3.62Å; F2396-M2444 HydrophobicContact CG-SD 3.88Å; F2396-M2444 HydrophobicContact CZ-CG 3.6Å; F2422-M2444 HydrophobicContact CE1-CB 4.45Å; F2422-M2444 HydrophobicContact CZ-CB 3.87Å; F2422-M2444 HydrophobicContact CZ-CG 4.18Å; Y2440-M2444 VanDerWaalsContact O-CB 3.32Å; Y2440-M2444 WeakPolarHBondContact O-CB 3.4Å; Y2440-M2444 PolarHBondContact O-N 2.94Å; I2441-M2444 WeakPolarHBondContact O-CB 3.27Å; I2441-M2444 PolarHBondContact O-N 2.89Å; I2441-M2444 VanDerWaalsContact O-N 3.15Å; M2444-G2446 PolarHBondContact O-N 2.89Å; M2444-I2447 PolarHBondContact O-N 3.33Å; M2444-Q2448 PolarHBondContact O-N 3.08Å; M2444-Y2453 HydrophobicContact CE-CD1 3.35Å; M2444-Y2453 HydrophobicContact CE-CD2 3.76Å; M2444-Y2453 HydrophobicContact CE-CE1 3.58Å; M2444-Y2453 HydrophobicContact CE-CE2 3.99Å; M2444-Y2453 HydrophobicContact CE-CG 3.44Å; M2444-Y2453 VanDerWaalsContact CE-CG 3.44Å; M2444-Y2453 HydrophobicContact CG-CD1 4.18Å; M2444-Y2453 HydrophobicContact CG-CE1 4.34Å; M2444-Y2453 HydrophobicContact SD-CD1 3.81Å; M2444-Y2453 HydrophobicContact SD-CE1 4.39Å; M2444-Y2453 HydrophobicContact SD-CG 4.12Å; M2444-I2455 HydrophobicContact SD-CD1 4.36Å; M2444-I2455 HydrophobicContact SD-CG1 4.48Å; M2444-M2468 HydrophobicContact SD-CE 3.93Å; M2444-L2472 HydrophobicContact CE-CD1 3.56Å; M2444-L2472 HydrophobicContact CE-CD2 3.9Å; M2444-L2472 HydrophobicContact CE-CG 4.35Å
2445	E	91.2	Very high	92.1	Very high	42 Å²	42	40.8 Å²	40.8	20%	0.196	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-16.5	177.6	-71.1	-179.7	165.9	0	0	113.1	I2441 Q2448 K2475 Y2476	I2441-E2445 HydrophobicContact CG2-CG 4.19Å; I2441-E2445 WeakPolarHBondContact O-CB 3.49Å; I2441-E2445 WeakPolarHBondContact O-CG 3.47Å; I2441-E2445 PolarHBondContact O-N 2.99Å; E2445-Q2448 WeakPolarHBondContact CA-O 3.32Å; E2445-K2475 IonicContact OE1-NZ 3.5Å; E2445-K2475 PolarHBondContact OE1-NZ 3.29Å; E2445-K2475 IonicContact OE2-NZ 2.69Å; E2445-K2475 PolarHBondContact OE2-NZ 3.32Å; E2445-Y2476 WeakPolarHBondContact OE1-CE2 3.13Å; E2445-Y2476 PolarHBondContact OE1-OH 2.9Å
2446	G	88.4	Confident	92.3	Very high	67 Å²	67	39.4 Å²	39.4	69%	0.691	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-15.9	169.7	0	0	0	0	0	114.4	C2443 M2444	C2443-G2446 PolarHBondContact O-N 3.49Å; C2443-G2446 VanDerWaalsContact O-N 3.15Å; M2444-G2446 PolarHBondContact O-N 2.89Å
2447	I	91.3	Very high	92.2	Very high	58 Å²	58	39.4 Å²	39.4	30%	0.297	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	-48.6	178.5	-66.1	168.2	0	0	0	110.2	V2383 F2396 Y2420 M2444	V2383-I2447 HydrophobicContact CG1-CD1 3.68Å; V2383-I2447 HydrophobicContact CG2-CD1 4.01Å; F2396-I2447 HydrophobicContact CE1-CB 4.1Å; F2396-I2447 HydrophobicContact CE1-CD1 4.06Å; F2396-I2447 HydrophobicContact CE1-CG2 4.04Å; F2396-I2447 HydrophobicContact CZ-CB 4.06Å; F2396-I2447 HydrophobicContact CZ-CG2 3.87Å; Y2420-I2447 HydrophobicContact CD1-CD1 3.74Å; Y2420-I2447 HydrophobicContact CD2-CG2 4.39Å; Y2420-I2447 HydrophobicContact CE1-CD1 4Å; Y2420-I2447 HydrophobicContact CE1-CG2 4.27Å; Y2420-I2447 HydrophobicContact CE2-CG2 4.02Å; Y2420-I2447 HydrophobicContact CG-CD1 4.23Å; M2444-I2447 PolarHBondContact O-N 3.33Å
2448	Q	92.4	Very high	92.2	Very high	26 Å²	26	39.7 Å²	39.7	12%	0.121	23%	0.229	C	C	.	.			trans	-118.5	101.7	175.2	178.3	179.4	-17	0	0	108.5	F2396 M2444 E2445 S2450 P2452 Y2453	F2396-Q2448 HydrophobicContact CE2-CB 4.1Å; F2396-Q2448 HydrophobicContact CZ-CB 4.05Å; M2444-Q2448 PolarHBondContact O-N 3.08Å; E2445-Q2448 WeakPolarHBondContact CA-O 3.32Å; Q2448-S2450 VanDerWaalsContact CG-O 3.29Å; Q2448-S2450 WeakPolarHBondContact CG-O 3.29Å; Q2448-S2450 PolarHBondContact NE2-O 2.55Å; Q2448-S2450 PolarHBondContact O-N 2.82Å; Q2448-P2452 PolarHBondContact NE2-O 3.42Å; Q2448-Y2453 HydrophobicContact CB-CD1 4.41Å; Q2448-Y2453 HydrophobicContact CB-CE1 3.96Å; Q2448-Y2453 HydrophobicContact CG-CD1 4.13Å; Q2448-Y2453 HydrophobicContact CG-CE1 3.72Å; Q2448-Y2453 WeakPolarHBondContact O-CE1 3.15Å; Q2448-Y2453 PolarHBondContact O-OH 2.91Å
2449	P	86.4	Confident	92	Very high	103 Å²	103	36 Å²	36	67%	0.669	21%	0.211	S	C	*	.			trans	-71.1	-11	-173.7	-23.5	35.4	0	0	0	116
2450	S	85.5	Confident	91.8	Very high	73 Å²	73	32.9 Å²	32.9	51%	0.51	20%	0.199	S	C	.	.	S	Bend	trans	-145.2	142.7	-173.9	57.7	0	0	0	0	112.4	Q2448 Y2453	Q2448-S2450 VanDerWaalsContact CG-O 3.29Å; Q2448-S2450 WeakPolarHBondContact CG-O 3.29Å; Q2448-S2450 PolarHBondContact NE2-O 2.55Å; Q2448-S2450 PolarHBondContact O-N 2.82Å; S2450-Y2453 PolarHBondContact N-OH 3.14Å
2451	P	86.9	Confident	91.6	Very high	35 Å²	35	32.9 Å²	32.9	23%	0.227	20%	0.199	C	C	.	.	S	Bend	trans	-63.6	170	173.8	30	-37.5	0	0	0	112.8	Y2453 Y2476 E2481 S2482	P2451-Y2453 HydrophobicContact CB-CD2 3.83Å; P2451-Y2453 HydrophobicContact CB-CE2 3.65Å; P2451-Y2453 HydrophobicContact CG-CE2 4.35Å; P2451-Y2476 HydrophobicContact CG-CD1 3.88Å; P2451-Y2476 HydrophobicContact CG-CD2 4.3Å; P2451-Y2476 HydrophobicContact CG-CE1 4.34Å; P2451-Y2476 HydrophobicContact CG-CG 3.87Å; P2451-E2481 WeakPolarHBondContact CB-O 3.47Å; P2451-S2482 WeakPolarHBondContact CB-O 3.43Å
2452	P	89.8	Confident	91.6	Very high	57 Å²	57	32.4 Å²	32.4	37%	0.37	20%	0.196	S	C	.	.	P	Polyproline II helix	cis	-80.1	139.2	4.1	32.8	-36.4	0	0	0	113.5	Q2448 K2480 E2481 Q2484	Q2448-P2452 PolarHBondContact NE2-O 3.42Å; P2452-K2480 WeakPolarHBondContact CB-O 3.28Å; P2452-E2481 WeakPolarHBondContact CB-O 3.43Å; P2452-Q2484 HydrophobicContact CB-CB 4.08Å
2453	Y	92.7	Very high	91.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	148.3	178.7	-61	-74.7	0	0	0	112.3	F2396 M2444 Q2448 S2450 P2451 L2472 Y2476 S2482 V2483 Q2484	F2396-Y2453 HydrophobicContact CE2-CD1 4.4Å; M2444-Y2453 HydrophobicContact CE-CD1 3.35Å; M2444-Y2453 HydrophobicContact CE-CD2 3.76Å; M2444-Y2453 HydrophobicContact CE-CE1 3.58Å; M2444-Y2453 HydrophobicContact CE-CE2 3.99Å; M2444-Y2453 HydrophobicContact CE-CG 3.44Å; M2444-Y2453 VanDerWaalsContact CE-CG 3.44Å; M2444-Y2453 HydrophobicContact CG-CD1 4.18Å; M2444-Y2453 HydrophobicContact CG-CE1 4.34Å; M2444-Y2453 HydrophobicContact SD-CD1 3.81Å; M2444-Y2453 HydrophobicContact SD-CE1 4.39Å; M2444-Y2453 HydrophobicContact SD-CG 4.12Å; Q2448-Y2453 HydrophobicContact CB-CD1 4.41Å; Q2448-Y2453 HydrophobicContact CB-CE1 3.96Å; Q2448-Y2453 HydrophobicContact CG-CD1 4.13Å; Q2448-Y2453 HydrophobicContact CG-CE1 3.72Å; Q2448-Y2453 WeakPolarHBondContact O-CE1 3.15Å; Q2448-Y2453 PolarHBondContact O-OH 2.91Å; S2450-Y2453 PolarHBondContact N-OH 3.14Å; P2451-Y2453 HydrophobicContact CB-CD2 3.83Å; P2451-Y2453 HydrophobicContact CB-CE2 3.65Å; P2451-Y2453 HydrophobicContact CG-CE2 4.35Å; Y2453-L2472 HydrophobicContact CD2-CD1 3.98Å; Y2453-L2472 HydrophobicContact CD2-CD2 3.88Å; Y2453-L2472 HydrophobicContact CD2-CG 4.43Å; Y2453-L2472 HydrophobicContact CE2-CD2 3.75Å; Y2453-L2472 HydrophobicContact CG-CD1 4.4Å; Y2453-Y2476 HydrophobicContact CE2-CD2 4.33Å; Y2453-Y2476 AromaticContact CE2-CE2 3.96Å; Y2453-Y2476 HydrophobicContact CE2-CE2 3.96Å; Y2453-S2482 WeakPolarHBondContact CD2-O 3.5Å; Y2453-S2482 PolarHBondContact N-O 3.4Å; Y2453-V2483 CarbonylContact O-C 3.54Å; Y2453-V2483 WeakPolarHBondContact O-CA 3.32Å; Y2453-Q2484 PolarHBondContact O-N 3.25Å
2454	R	93.5	Very high	91.7	Very high	12 Å²	12	23.5 Å²	23.5	5%	0.045	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	118.3	169.9	-65.3	178.2	172.2	-161.8	-12.3	108.9	P2394 V2395 F2396 F2417 Q2484 F2658	P2394-R2454 WeakPolarHBondContact O-CB 3.3Å; V2395-R2454 HydrophobicContact CB-CB 4.49Å; V2395-R2454 HydrophobicContact CG2-CB 3.98Å; F2396-R2454 PolarHBondContact N-O 2.88Å; F2417-R2454 VanDerWaalsContact CE1-NH1 3.28Å; R2454-Q2484 HydrophobicContact CG-CB 4.33Å; R2454-Q2484 VanDerWaalsContact NH2-OE1 3.14Å; R2454-F2658 HydrophobicContact CB-CD1 4.42Å; R2454-F2658 HydrophobicContact CB-CE1 3.6Å; R2454-F2658 HydrophobicContact CB-CZ 3.71Å; R2454-F2658 HydrophobicContact CG-CD1 3.94Å; R2454-F2658 HydrophobicContact CG-CE1 3.6Å; R2454-F2658 HydrophobicContact CG-CZ 4.11Å
2455	I	94.8	Very high	91.7	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	128.8	-172.5	-49.9	179.9	0	0	0	110.2	F2396 V2398 M2444 A2465 M2468 L2472 S2485 L2486 I2487	F2396-I2455 WeakPolarHBondContact O-CA 3.34Å; V2398-I2455 HydrophobicContact CG2-CG2 4.41Å; M2444-I2455 HydrophobicContact SD-CD1 4.36Å; M2444-I2455 HydrophobicContact SD-CG1 4.48Å; I2455-A2465 HydrophobicContact CG2-CB 3.69Å; I2455-M2468 HydrophobicContact CD1-CB 4.24Å; I2455-L2472 HydrophobicContact CD1-CD1 3.46Å; I2455-L2472 VanDerWaalsContact CD1-CD1 3.46Å; I2455-S2485 PolarHBondContact N-O 3.36Å; I2455-L2486 HydrophobicContact CB-CD1 4.41Å; I2455-I2487 PolarHBondContact O-N 2.8Å
2456	I	95.8	Very high	91.9	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	131.5	175.1	-51	-173.5	0	0	0	108.1	V2395 F2396 L2397 V2398 L2415 I2487 L2489 I2654 F2658	V2395-I2456 HydrophobicContact CG1-CD1 3.54Å; V2395-I2456 HydrophobicContact CG1-CG1 3.8Å; F2396-I2456 PolarHBondContact O-N 2.98Å; L2397-I2456 CarbonylContact C-O 3.59Å; L2397-I2456 VanDerWaalsContact CA-O 3.27Å; L2397-I2456 WeakPolarHBondContact CA-O 3.07Å; L2397-I2456 HydrophobicContact CG-CB 4.38Å; V2398-I2456 PolarHBondContact N-O 3.47Å; L2415-I2456 HydrophobicContact CD1-CD1 4.17Å; I2456-I2487 VanDerWaalsContact CA-O 3.31Å; I2456-I2487 WeakPolarHBondContact CA-O 3.5Å; I2456-I2487 HydrophobicContact CG1-CB 4.25Å; I2456-I2487 HydrophobicContact CG2-CB 4.44Å; I2456-L2489 HydrophobicContact CG2-CD1 3.53Å; I2456-L2489 HydrophobicContact CG2-CD2 4.42Å; I2456-L2489 HydrophobicContact CG2-CG 3.78Å; I2456-I2654 HydrophobicContact CD1-CD1 3.99Å; I2456-I2654 HydrophobicContact CD1-CG1 4.23Å; I2456-I2654 HydrophobicContact CD1-CG2 3.69Å; I2456-F2658 HydrophobicContact CD1-CE2 4.14Å; I2456-F2658 HydrophobicContact CD1-CZ 4.25Å; I2456-F2658 HydrophobicContact CG1-CZ 4.22Å
2457	G	94.2	Very high	92.1	Very high	0 Å²	0	19 Å²	19	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134	173.1	0	0	0	0	0	111.6	A2462 I2487 L2488 L2489	G2457-A2462 VanDerWaalsContact C-CA 3.47Å; G2457-A2462 WeakPolarHBondContact O-CA 3.4Å; G2457-A2462 WeakPolarHBondContact O-CB 3.27Å; G2457-I2487 PolarHBondContact N-O 2.8Å; G2457-L2488 WeakPolarHBondContact O-CA 3.41Å; G2457-L2489 PolarHBondContact O-N 3.32Å
2458	Y	92.8	Very high	92.3	Very high	6 Å²	6	16.2 Å²	16.2	2%	0.024	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	139.1	-178.6	163.2	-121.1	0	0	0	111.3	V2398 P2400 P2407 L2408 Y2460 G2461 A2462 L2489 H2638 F2641 I2642	V2398-Y2458 PolarHBondContact O-N 3.24Å; P2400-Y2458 HydrophobicContact CB-CD1 3.6Å; P2400-Y2458 HydrophobicContact CB-CE1 3.54Å; P2400-Y2458 HydrophobicContact CG-CD1 3.85Å; P2400-Y2458 HydrophobicContact CG-CE1 3.77Å; P2407-Y2458 HydrophobicContact CB-CE1 4.08Å; L2408-Y2458 HydrophobicContact CD2-CD1 4Å; L2408-Y2458 HydrophobicContact CD2-CG 4.14Å; L2408-Y2458 HydrophobicContact CG-CD1 4.14Å; Y2458-Y2460 PolarHBondContact O-N 3.35Å; Y2458-G2461 VanDerWaalsContact O-CA 3.23Å; Y2458-G2461 WeakPolarHBondContact O-CA 3.5Å; Y2458-G2461 PolarHBondContact O-N 3.23Å; Y2458-A2462 PolarHBondContact O-N 3.01Å; Y2458-L2489 WeakPolarHBondContact CA-O 3.32Å; Y2458-L2489 HydrophobicContact CD2-CB 4.02Å; Y2458-L2489 HydrophobicContact CG-CB 4.46Å; Y2458-H2638 AromaticContact CE2-CE1 3.89Å; Y2458-H2638 AromaticContact CE2-NE2 3.87Å; Y2458-H2638 WeakPolarHBondContact CE2-O 3.41Å; Y2458-H2638 AromaticContact CZ-NE2 3.93Å; Y2458-H2638 PolarHBondContact OH-CD2 3.3Å; Y2458-H2638 PolarHBondContact OH-O 3.43Å; Y2458-F2641 HydrophobicContact CD2-CE1 4.32Å; Y2458-F2641 HydrophobicContact CD2-CZ 4.38Å; Y2458-F2641 AromaticContact CE2-CE1 3.95Å; Y2458-F2641 HydrophobicContact CE2-CE1 3.95Å; Y2458-F2641 HydrophobicContact CE2-CZ 4.46Å; Y2458-I2642 HydrophobicContact CD1-CD1 3.42Å; Y2458-I2642 VanDerWaalsContact CD1-CD1 3.42Å; Y2458-I2642 HydrophobicContact CD2-CD1 3.86Å; Y2458-I2642 HydrophobicContact CD2-CG2 4.42Å; Y2458-I2642 HydrophobicContact CE1-CD1 3.28Å; Y2458-I2642 HydrophobicContact CE1-CG1 4.36Å; Y2458-I2642 HydrophobicContact CE2-CD1 3.75Å; Y2458-I2642 HydrophobicContact CE2-CG1 4.17Å; Y2458-I2642 HydrophobicContact CG-CD1 3.73Å; Y2458-I2642 VanDerWaalsContact CZ-CD1 3.45Å
2459	S	90.8	Very high	92.3	Very high	11 Å²	11	15 Å²	15	8%	0.077	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	-125.8	175.6	-171.5	0	0	0	0	111.5	G2461 A2462 L2489 S2491 H2638	S2459-G2461 PolarHBondContact O-N 2.87Å; S2459-A2462 VanDerWaalsContact O-CB 3.28Å; S2459-A2462 WeakPolarHBondContact O-CB 3.36Å; S2459-A2462 PolarHBondContact O-N 3.18Å; S2459-A2462 VanDerWaalsContact O-N 3.13Å; S2459-L2489 PolarHBondContact N-O 3.16Å; S2459-S2491 WeakPolarHBondContact O-CB 3.46Å; S2459-S2491 PolarHBondContact O-OG 3.46Å; S2459-H2638 WeakPolarHBondContact CB-NE2 3.18Å; S2459-H2638 PolarHBondContact OG-NE2 2.93Å
2460	Y	90.1	Very high	92.6	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-50.4	-42.3	169.2	177.2	-105.8	0	0	0	113	I2401 M2433 I2436 Y2458 A2462 N2463 I2464 K2583 V2586 A2587	I2401-Y2460 HydrophobicContact CB-CG 4.18Å; I2401-Y2460 HydrophobicContact CD1-CD2 4.35Å; I2401-Y2460 HydrophobicContact CG1-CD2 4.26Å; I2401-Y2460 HydrophobicContact CG1-CG 4.14Å; M2433-Y2460 HydrophobicContact CE-CD2 4.22Å; M2433-Y2460 HydrophobicContact CE-CE2 3.67Å; M2433-Y2460 HydrophobicContact SD-CE1 4.49Å; M2433-Y2460 HydrophobicContact SD-CE2 3.94Å; I2436-Y2460 WeakPolarHBondContact CD1-OH 3.38Å; Y2458-Y2460 PolarHBondContact O-N 3.35Å; Y2460-A2462 VanDerWaalsContact C-N 3.26Å; Y2460-A2462 PolarHBondContact O-N 3.08Å; Y2460-N2463 WeakPolarHBondContact O-CB 3.3Å; Y2460-N2463 PolarHBondContact O-N 3.5Å; Y2460-N2463 VanDerWaalsContact O-N 3.08Å; Y2460-I2464 HydrophobicContact CD1-CD1 3.93Å; Y2460-I2464 HydrophobicContact CE1-CD1 3.59Å; Y2460-I2464 HydrophobicContact CE1-CG1 4.43Å; Y2460-K2583 HydrophobicContact CE1-CB 4.17Å; Y2460-K2583 HydrophobicContact CE1-CD 4.3Å; Y2460-K2583 HydrophobicContact CE1-CG 3.97Å; Y2460-K2583 HydrophobicContact CE2-CB 4.39Å; Y2460-K2583 WeakPolarHBondContact CE2-O 3.48Å; Y2460-V2586 WeakPolarHBondContact OH-CG1 2.96Å; Y2460-A2587 HydrophobicContact CD2-CB 4.01Å; Y2460-A2587 HydrophobicContact CE2-CB 3.86Å
2461	G	92.5	Very high	93	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-61.6	-24.4	177.7	0	0	0	0	0	115.1	H2399 Y2458 S2459 N2463 I2464 A2465	H2399-G2461 WeakPolarHBondContact O-CA 3.28Å; H2399-G2461 PolarHBondContact O-N 3.29Å; H2399-G2461 VanDerWaalsContact O-N 3.12Å; Y2458-G2461 VanDerWaalsContact O-CA 3.23Å; Y2458-G2461 WeakPolarHBondContact O-CA 3.5Å; Y2458-G2461 PolarHBondContact O-N 3.23Å; S2459-G2461 PolarHBondContact O-N 2.87Å; G2461-N2463 PolarHBondContact O-N 2.8Å; G2461-I2464 PolarHBondContact O-N 2.81Å; G2461-A2465 WeakPolarHBondContact O-CB 3.47Å; G2461-A2465 PolarHBondContact O-N 2.97Å
2462	A	93.9	Very high	93.2	Very high	1 Å²	1	6 Å²	6	1%	0.008	3%	0.034	C	C	.	.	H	α-helix	trans	-58.9	-36	172.3	0	0	0	0	0	111.9	G2457 Y2458 S2459 Y2460 F2466 L2488	G2457-A2462 VanDerWaalsContact C-CA 3.47Å; G2457-A2462 WeakPolarHBondContact O-CA 3.4Å; G2457-A2462 WeakPolarHBondContact O-CB 3.27Å; Y2458-A2462 PolarHBondContact O-N 3.01Å; S2459-A2462 VanDerWaalsContact O-CB 3.28Å; S2459-A2462 WeakPolarHBondContact O-CB 3.36Å; S2459-A2462 PolarHBondContact O-N 3.18Å; S2459-A2462 VanDerWaalsContact O-N 3.13Å; Y2460-A2462 VanDerWaalsContact C-N 3.26Å; Y2460-A2462 PolarHBondContact O-N 3.08Å; A2462-F2466 WeakPolarHBondContact O-CB 3.46Å; A2462-F2466 PolarHBondContact O-N 3.3Å; A2462-L2488 HydrophobicContact CB-CB 4.32Å; A2462-L2488 HydrophobicContact CB-CD2 4.05Å; A2462-L2488 WeakPolarHBondContact O-CD2 3.49Å
2463	N	93.4	Very high	93.3	Very high	2 Å²	2	3.5 Å²	3.5	1%	0.011	2%	0.018	C	C	.	.	H	α-helix	trans	-74.8	-34.6	179.5	-67.7	-79.7	0	0	0	112.1	M2433 Y2460 G2461 E2467 S2491 S2492 H2493 Y2590	M2433-N2463 HydrophobicContact CE-CB 3.87Å; M2433-N2463 HydrophobicContact CG-CB 4.5Å; M2433-N2463 HydrophobicContact SD-CB 4.39Å; Y2460-N2463 WeakPolarHBondContact O-CB 3.3Å; Y2460-N2463 PolarHBondContact O-N 3.5Å; Y2460-N2463 VanDerWaalsContact O-N 3.08Å; G2461-N2463 PolarHBondContact O-N 2.8Å; N2463-E2467 PolarHBondContact O-N 2.85Å; N2463-S2491 PolarHBondContact ND2-OG 3.28Å; N2463-S2492 VanDerWaalsContact OD1-C 3.31Å; N2463-S2492 PolarHBondContact OD1-O 3.43Å; N2463-H2493 WeakPolarHBondContact OD1-CA 3.39Å; N2463-H2493 PolarHBondContact OD1-N 2.72Å; N2463-Y2590 HydrophobicContact CB-CD1 3.89Å; N2463-Y2590 HydrophobicContact CB-CE1 3.61Å; N2463-Y2590 PolarHBondContact O-OH 2.77Å; N2463-Y2590 WeakPolarHBondContact OD1-CE1 3.47Å
2464	I	94.2	Very high	93	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-68.4	-47.1	171.7	-58.3	166.4	0	0	0	110	V2398 M2433 I2436 A2437 Y2440 Y2460 G2461 F2466 E2467 M2468	V2398-I2464 HydrophobicContact CG1-CB 3.8Å; V2398-I2464 HydrophobicContact CG1-CD1 3.99Å; V2398-I2464 HydrophobicContact CG1-CG1 4.49Å; V2398-I2464 HydrophobicContact CG1-CG2 3.79Å; M2433-I2464 HydrophobicContact CG-CG1 3.9Å; M2433-I2464 HydrophobicContact SD-CD1 4.23Å; M2433-I2464 HydrophobicContact SD-CG1 3.37Å; M2433-I2464 WeakPolarHBondContact SD-CG1 3.46Å; I2436-I2464 HydrophobicContact CG2-CD1 3.78Å; I2436-I2464 HydrophobicContact CG2-CG1 4.31Å; I2436-I2464 HydrophobicContact CG2-CG2 4.14Å; A2437-I2464 HydrophobicContact CB-CG2 4.2Å; Y2440-I2464 HydrophobicContact CD2-CG2 4.03Å; Y2440-I2464 HydrophobicContact CE2-CD1 4.49Å; Y2460-I2464 HydrophobicContact CD1-CD1 3.93Å; Y2460-I2464 HydrophobicContact CE1-CD1 3.59Å; Y2460-I2464 HydrophobicContact CE1-CG1 4.43Å; G2461-I2464 PolarHBondContact O-N 2.81Å; I2464-F2466 VanDerWaalsContact C-N 3.34Å; I2464-F2466 PolarHBondContact O-N 2.84Å; I2464-E2467 PolarHBondContact O-N 2.96Å; I2464-M2468 HydrophobicContact CG2-CG 4.18Å; I2464-M2468 HydrophobicContact CG2-SD 4.03Å; I2464-M2468 WeakPolarHBondContact O-CB 3.5Å; I2464-M2468 VanDerWaalsContact O-CG 3.31Å; I2464-M2468 WeakPolarHBondContact O-CG 3.37Å; I2464-M2468 PolarHBondContact O-N 3.06Å
2465	A	94.7	Very high	92.8	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-58.6	-42.6	178.3	0	0	0	0	0	112.6	V2398 I2455 G2461 M2468 A2469 L2486 L2488	V2398-A2465 HydrophobicContact CG2-CB 3.93Å; I2455-A2465 HydrophobicContact CG2-CB 3.69Å; G2461-A2465 WeakPolarHBondContact O-CB 3.47Å; G2461-A2465 PolarHBondContact O-N 2.97Å; A2465-M2468 PolarHBondContact O-N 2.96Å; A2465-A2469 WeakPolarHBondContact O-CB 3.39Å; A2465-A2469 PolarHBondContact O-N 2.99Å; A2465-L2486 HydrophobicContact CB-CD1 4.19Å; A2465-L2488 HydrophobicContact CB-CD2 4.36Å
2466	F	94.9	Very high	92.4	Very high	7 Å²	7	19 Å²	19	3%	0.031	9%	0.086	C	C	.	.	H	α-helix	trans	-57.9	-50.4	173.5	-178.1	-86.1	0	0	0	111.6	A2462 I2464 A2469 T2470 L2486 P2592 V2624 V2625	A2462-F2466 WeakPolarHBondContact O-CB 3.46Å; A2462-F2466 PolarHBondContact O-N 3.3Å; I2464-F2466 VanDerWaalsContact C-N 3.34Å; I2464-F2466 PolarHBondContact O-N 2.84Å; F2466-A2469 WeakPolarHBondContact O-CB 3.41Å; F2466-A2469 PolarHBondContact O-N 2.87Å; F2466-A2469 VanDerWaalsContact O-N 3.13Å; F2466-T2470 HydrophobicContact CD1-CG2 4.09Å; F2466-T2470 HydrophobicContact CE1-CG2 3.59Å; F2466-T2470 HydrophobicContact CZ-CG2 3.96Å; F2466-T2470 PolarHBondContact O-N 3.35Å; F2466-L2486 HydrophobicContact CD2-CD2 3.95Å; F2466-P2592 HydrophobicContact CD1-CB 4.46Å; F2466-P2592 HydrophobicContact CE1-CB 4.01Å; F2466-V2624 HydrophobicContact CE1-CB 4.43Å; F2466-V2624 HydrophobicContact CE1-CG2 4.45Å; F2466-V2624 HydrophobicContact CE2-CB 4.24Å; F2466-V2624 HydrophobicContact CE2-CG2 3.67Å; F2466-V2624 HydrophobicContact CZ-CB 3.69Å; F2466-V2624 HydrophobicContact CZ-CG2 3.62Å; F2466-V2625 HydrophobicContact CE2-CG2 4.09Å
2467	E	94.2	Very high	91.5	Very high	6 Å²	6	20.5 Å²	20.5	3%	0.028	10%	0.102	C	C	.	.	H	α-helix	trans	-76.9	-22.5	-177.4	-159.9	69.7	159.4	0	0	113	N2463 I2464 T2470 L2471 R2594	N2463-E2467 PolarHBondContact O-N 2.85Å; I2464-E2467 PolarHBondContact O-N 2.96Å; E2467-T2470 WeakPolarHBondContact CA-OG1 3.47Å; E2467-T2470 VanDerWaalsContact CD-OG1 3.3Å; E2467-T2470 PolarHBondContact O-OG1 3.11Å; E2467-T2470 VanDerWaalsContact O-OG1 3.09Å; E2467-T2470 PolarHBondContact OE2-OG1 2.89Å; E2467-L2471 VanDerWaalsContact O-CB 3.28Å; E2467-L2471 WeakPolarHBondContact O-CB 3.3Å; E2467-L2471 VanDerWaalsContact O-CD1 3.31Å; E2467-L2471 WeakPolarHBondContact O-CD1 3.4Å; E2467-L2471 WeakPolarHBondContact O-CG 3.24Å; E2467-L2471 PolarHBondContact O-N 2.63Å; E2467-L2471 VanDerWaalsContact O-N 3.08Å; E2467-R2594 IonicContact OE1-CZ 3.74Å; E2467-R2594 VanDerWaalsContact OE1-CZ 3.24Å; E2467-R2594 IonicContact OE1-NE 3.78Å; E2467-R2594 PolarHBondContact OE1-NE 3.49Å; E2467-R2594 IonicContact OE1-NH2 4Å; E2467-R2594 PolarHBondContact OE1-NH2 2.63Å; E2467-R2594 IonicContact OE2-NE 3.73Å
2468	M	94.3	Very high	90.5	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-61.1	-46.8	163.5	-73.9	178	64	0	0	110.4	V2398 F2422 A2437 I2441 M2444 I2455 I2464 A2465 L2471 L2472	V2398-M2468 HydrophobicContact CG2-SD 4Å; F2422-M2468 HydrophobicContact CE2-CE 3.79Å; F2422-M2468 HydrophobicContact CE2-SD 4.35Å; F2422-M2468 HydrophobicContact CZ-CE 4.11Å; A2437-M2468 HydrophobicContact CB-CB 4.49Å; A2437-M2468 HydrophobicContact CB-CG 3.59Å; I2441-M2468 HydrophobicContact CD1-CB 4.35Å; I2441-M2468 HydrophobicContact CD1-CG 4.42Å; I2441-M2468 HydrophobicContact CG1-CB 4.23Å; I2441-M2468 HydrophobicContact CG1-CE 4.05Å; I2441-M2468 HydrophobicContact CG1-CG 4.09Å; M2444-M2468 HydrophobicContact SD-CE 3.93Å; I2455-M2468 HydrophobicContact CD1-CB 4.24Å; I2464-M2468 HydrophobicContact CG2-CG 4.18Å; I2464-M2468 HydrophobicContact CG2-SD 4.03Å; I2464-M2468 WeakPolarHBondContact O-CB 3.5Å; I2464-M2468 VanDerWaalsContact O-CG 3.31Å; I2464-M2468 WeakPolarHBondContact O-CG 3.37Å; I2464-M2468 PolarHBondContact O-N 3.06Å; A2465-M2468 PolarHBondContact O-N 2.96Å; M2468-L2471 PolarHBondContact O-N 3.25Å; M2468-L2472 WeakPolarHBondContact O-CB 3.42Å; M2468-L2472 WeakPolarHBondContact O-CD1 3.28Å; M2468-L2472 WeakPolarHBondContact O-CG 3.45Å; M2468-L2472 PolarHBondContact O-N 3.23Å
2469	A	93.7	Very high	89.3	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.8	-40.6	-178.7	0	0	0	0	0	112.9	A2465 F2466 L2472 Q2473 V2483 L2486 Y2596	A2465-A2469 WeakPolarHBondContact O-CB 3.39Å; A2465-A2469 PolarHBondContact O-N 2.99Å; F2466-A2469 WeakPolarHBondContact O-CB 3.41Å; F2466-A2469 PolarHBondContact O-N 2.87Å; F2466-A2469 VanDerWaalsContact O-N 3.13Å; A2469-L2472 PolarHBondContact O-N 3.1Å; A2469-Q2473 WeakPolarHBondContact O-CG 3.4Å; A2469-Q2473 PolarHBondContact O-N 3.38Å; A2469-V2483 HydrophobicContact CB-CG1 4.36Å; A2469-V2483 HydrophobicContact CB-CG2 4.15Å; A2469-L2486 HydrophobicContact CB-CD1 4.11Å; A2469-L2486 HydrophobicContact CB-CD2 3.97Å; A2469-L2486 HydrophobicContact CB-CG 4.45Å; A2469-Y2596 HydrophobicContact CB-CD2 3.89Å; A2469-Y2596 HydrophobicContact CB-CE2 3.77Å
2470	T	92.7	Very high	88.3	Confident	5 Å²	5	30 Å²	30	3%	0.031	15%	0.153	C	C	.	.	H	α-helix	trans	-66.2	-40.1	175	64.1	0	0	0	0	112.2	F2466 E2467 Q2473 Q2474 R2594	F2466-T2470 HydrophobicContact CD1-CG2 4.09Å; F2466-T2470 HydrophobicContact CE1-CG2 3.59Å; F2466-T2470 HydrophobicContact CZ-CG2 3.96Å; F2466-T2470 PolarHBondContact O-N 3.35Å; E2467-T2470 WeakPolarHBondContact CA-OG1 3.47Å; E2467-T2470 VanDerWaalsContact CD-OG1 3.3Å; E2467-T2470 PolarHBondContact O-OG1 3.11Å; E2467-T2470 VanDerWaalsContact O-OG1 3.09Å; E2467-T2470 PolarHBondContact OE2-OG1 2.89Å; T2470-Q2473 PolarHBondContact O-N 2.94Å; T2470-Q2474 WeakPolarHBondContact O-CB 3.36Å; T2470-Q2474 PolarHBondContact O-N 3.33Å; T2470-R2594 HydrophobicContact CG2-CB 3.94Å
2471	L	92.3	Very high	87.7	Confident	17 Å²	17	37.7 Å²	37.7	9%	0.089	19%	0.189	C	C	.	.	H	α-helix	trans	-64.7	-37.6	174.4	-76.8	168	0	0	0	112.4	E2434 A2437 L2438 I2441 E2467 M2468 Q2474 K2475 R2594	E2434-L2471 HydrophobicContact CG-CD1 4.38Å; A2437-L2471 HydrophobicContact CB-CD1 3.88Å; L2438-L2471 HydrophobicContact CD2-CD1 3.96Å; L2438-L2471 HydrophobicContact CD2-CD2 4.22Å; L2438-L2471 HydrophobicContact CG-CD1 3.92Å; I2441-L2471 HydrophobicContact CD1-CB 3.63Å; I2441-L2471 HydrophobicContact CD1-CD1 3.99Å; I2441-L2471 HydrophobicContact CD1-CG 4.49Å; E2467-L2471 VanDerWaalsContact O-CB 3.28Å; E2467-L2471 WeakPolarHBondContact O-CB 3.3Å; E2467-L2471 VanDerWaalsContact O-CD1 3.31Å; E2467-L2471 WeakPolarHBondContact O-CD1 3.4Å; E2467-L2471 WeakPolarHBondContact O-CG 3.24Å; E2467-L2471 PolarHBondContact O-N 2.63Å; E2467-L2471 VanDerWaalsContact O-N 3.08Å; M2468-L2471 PolarHBondContact O-N 3.25Å; L2471-Q2474 PolarHBondContact O-N 3.3Å; L2471-K2475 WeakPolarHBondContact O-CB 3.41Å; L2471-K2475 PolarHBondContact O-N 3.29Å; L2471-R2594 VanDerWaalsContact CD2-NH1 3.33Å
2472	L	92.8	Very high	87.5	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.5	-39.4	176.4	-71.3	162.6	0	0	0	111.8	I2441 M2444 Y2453 I2455 M2468 A2469 K2475 Y2476 V2483	I2441-L2472 HydrophobicContact CD1-CD2 4.35Å; I2441-L2472 HydrophobicContact CD1-CG 4.04Å; I2441-L2472 HydrophobicContact CG1-CD1 4.37Å; I2441-L2472 HydrophobicContact CG1-CD2 4.23Å; I2441-L2472 HydrophobicContact CG1-CG 4.15Å; I2441-L2472 HydrophobicContact CG2-CD2 4.02Å; M2444-L2472 HydrophobicContact CE-CD1 3.56Å; M2444-L2472 HydrophobicContact CE-CD2 3.9Å; M2444-L2472 HydrophobicContact CE-CG 4.35Å; Y2453-L2472 HydrophobicContact CD2-CD1 3.98Å; Y2453-L2472 HydrophobicContact CD2-CD2 3.88Å; Y2453-L2472 HydrophobicContact CD2-CG 4.43Å; Y2453-L2472 HydrophobicContact CE2-CD2 3.75Å; Y2453-L2472 HydrophobicContact CG-CD1 4.4Å; I2455-L2472 HydrophobicContact CD1-CD1 3.46Å; I2455-L2472 VanDerWaalsContact CD1-CD1 3.46Å; M2468-L2472 WeakPolarHBondContact O-CB 3.42Å; M2468-L2472 WeakPolarHBondContact O-CD1 3.28Å; M2468-L2472 WeakPolarHBondContact O-CG 3.45Å; M2468-L2472 PolarHBondContact O-N 3.23Å; A2469-L2472 PolarHBondContact O-N 3.1Å; L2472-K2475 PolarHBondContact O-N 3.1Å; L2472-K2475 VanDerWaalsContact O-N 3.17Å; L2472-Y2476 HydrophobicContact CD2-CD2 4.01Å; L2472-Y2476 HydrophobicContact CD2-CE2 3.76Å; L2472-Y2476 WeakPolarHBondContact O-CB 3.37Å; L2472-Y2476 WeakPolarHBondContact O-CD2 3.43Å; L2472-Y2476 PolarHBondContact O-N 3.49Å; L2472-V2483 HydrophobicContact CB-CG2 4Å; L2472-V2483 HydrophobicContact CD1-CG2 4.28Å
2473	Q	90	Very high	87.3	Confident	6 Å²	6	37.7 Å²	37.7	3%	0.028	19%	0.189	C	C	.	.	H	α-helix	trans	-62.5	-42.9	170.5	-75.3	-174.5	-29.2	0	0	111.6	A2469 T2470 K2475 G2477 S2482 Y2596 Q2597	A2469-Q2473 WeakPolarHBondContact O-CG 3.4Å; A2469-Q2473 PolarHBondContact O-N 3.38Å; T2470-Q2473 PolarHBondContact O-N 2.94Å; Q2473-K2475 PolarHBondContact O-N 3.46Å; Q2473-G2477 WeakPolarHBondContact CA-O 3.3Å; Q2473-G2477 CarbonylContact O-C 3.6Å; Q2473-G2477 WeakPolarHBondContact O-CA 3.2Å; Q2473-G2477 PolarHBondContact O-N 2.92Å; Q2473-S2482 VanDerWaalsContact CG-OG 3.32Å; Q2473-S2482 WeakPolarHBondContact CG-OG 3.36Å; Q2473-Y2596 HydrophobicContact CG-CE2 4.44Å; Q2473-Q2597 PolarHBondContact NE2-O 3.44Å
2474	Q	88.1	Confident	86.9	Confident	137 Å²	137	39.4 Å²	39.4	64%	0.64	20%	0.197	S	C	*	.	H	α-helix	trans	-63.1	-22.2	174.7	-166.4	172	21	0	0	113.5	T2470 L2471	T2470-Q2474 WeakPolarHBondContact O-CB 3.36Å; T2470-Q2474 PolarHBondContact O-N 3.33Å; L2471-Q2474 PolarHBondContact O-N 3.3Å
2475	K	88.4	Confident	86.6	Confident	115 Å²	115	39.8 Å²	39.8	50%	0.5	20%	0.199	S	C	.	.	H	α-helix	trans	-96	-35.9	179.7	-176.1	174.8	175.5	-176.9	0	114.2	E2445 L2471 L2472 Q2473	E2445-K2475 IonicContact OE1-NZ 3.5Å; E2445-K2475 PolarHBondContact OE1-NZ 3.29Å; E2445-K2475 IonicContact OE2-NZ 2.69Å; E2445-K2475 PolarHBondContact OE2-NZ 3.32Å; L2471-K2475 WeakPolarHBondContact O-CB 3.41Å; L2471-K2475 PolarHBondContact O-N 3.29Å; L2472-K2475 PolarHBondContact O-N 3.1Å; L2472-K2475 VanDerWaalsContact O-N 3.17Å; Q2473-K2475 PolarHBondContact O-N 3.46Å
2476	Y	87.6	Confident	86.5	Confident	84 Å²	84	39.8 Å²	39.8	33%	0.329	20%	0.199	S	C	.	.	H	α-helix	trans	-119.8	-13.2	-169.9	-64.6	-71.2	0	0	0	114.7	E2445 P2451 Y2453 L2472	E2445-Y2476 WeakPolarHBondContact OE1-CE2 3.13Å; E2445-Y2476 PolarHBondContact OE1-OH 2.9Å; P2451-Y2476 HydrophobicContact CG-CD1 3.88Å; P2451-Y2476 HydrophobicContact CG-CD2 4.3Å; P2451-Y2476 HydrophobicContact CG-CE1 4.34Å; P2451-Y2476 HydrophobicContact CG-CG 3.87Å; Y2453-Y2476 HydrophobicContact CE2-CD2 4.33Å; Y2453-Y2476 AromaticContact CE2-CE2 3.96Å; Y2453-Y2476 HydrophobicContact CE2-CE2 3.96Å; L2472-Y2476 HydrophobicContact CD2-CD2 4.01Å; L2472-Y2476 HydrophobicContact CD2-CE2 3.76Å; L2472-Y2476 WeakPolarHBondContact O-CB 3.37Å; L2472-Y2476 WeakPolarHBondContact O-CD2 3.43Å; L2472-Y2476 PolarHBondContact O-N 3.49Å
2477	G	76.4	Confident	86.5	Confident	34 Å²	34	39.4 Å²	39.4	35%	0.351	20%	0.198	S	C	.	.			trans	116.6	158.3	-179.9	0	0	0	0	0	113.8	Q2473 S2482	Q2473-G2477 WeakPolarHBondContact CA-O 3.3Å; Q2473-G2477 CarbonylContact O-C 3.6Å; Q2473-G2477 WeakPolarHBondContact O-CA 3.2Å; Q2473-G2477 PolarHBondContact O-N 2.92Å; G2477-S2482 VanDerWaalsContact O-CB 3.24Å; G2477-S2482 WeakPolarHBondContact O-CB 3.42Å; G2477-S2482 PolarHBondContact O-OG 2.99Å
2478	D	71.9	Confident	86.6	Confident	101 Å²	101	39.2 Å²	39.2	54%	0.54	20%	0.197	S	C	.	.	S	Bend	trans	-70.4	149.5	-179.8	-71.2	-15.1	0	0	0	112.4	Q2597	D2478-Q2597 HydrophobicContact CB-CB 3.86Å; D2478-Q2597 HydrophobicContact CB-CG 4.24Å; D2478-Q2597 PolarHBondContact OD2-NE2 3.48Å
2479	G	68.8	Low	86.6	Confident	21 Å²	21	39.2 Å²	39.2	22%	0.216	20%	0.197	C	C	.	.	S	Bend	trans	91	-165	173.2	0	0	0	0	0	115.8	E2481 S2482 Q2597	G2479-E2481 VanDerWaalsContact C-N 3.26Å; G2479-E2481 PolarHBondContact O-N 3.38Å; G2479-S2482 PolarHBondContact O-N 3.45Å; G2479-S2482 PolarHBondContact O-OG 2.97Å; G2479-Q2597 WeakPolarHBondContact CA-O 3.14Å; G2479-Q2597 PolarHBondContact N-O 3.19Å
2480	K	70.2	Confident	86.4	Confident	93 Å²	93	39.2 Å²	39.2	40%	0.404	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-11.4	-168.2	-69.8	174.3	179.4	165.7	0	114.7	P2452 V2483 D2599 L2661	P2452-K2480 WeakPolarHBondContact CB-O 3.28Å; K2480-V2483 WeakPolarHBondContact CA-O 3.33Å; K2480-D2599 WeakPolarHBondContact CE-OD2 3.48Å; K2480-D2599 IonicContact NZ-OD2 3.75Å; K2480-D2599 PolarHBondContact NZ-OD2 3.32Å; K2480-L2661 HydrophobicContact CD-CD1 4.41Å; K2480-L2661 HydrophobicContact CD-CD2 4.11Å
2481	E	77.6	Confident	86.3	Confident	163 Å²	163	39 Å²	39	76%	0.762	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-32.5	174.7	-67	-77.9	142.6	0	0	112.6	P2451 P2452 G2479	P2451-E2481 WeakPolarHBondContact CB-O 3.47Å; P2452-E2481 WeakPolarHBondContact CB-O 3.43Å; G2479-E2481 VanDerWaalsContact C-N 3.26Å; G2479-E2481 PolarHBondContact O-N 3.38Å
2482	S	87	Confident	86.2	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99	-40.9	-177.3	56.2	0	0	0	0	113	P2451 Y2453 Q2473 G2477 G2479	P2451-S2482 WeakPolarHBondContact CB-O 3.43Å; Y2453-S2482 WeakPolarHBondContact CD2-O 3.5Å; Y2453-S2482 PolarHBondContact N-O 3.4Å; Q2473-S2482 VanDerWaalsContact CG-OG 3.32Å; Q2473-S2482 WeakPolarHBondContact CG-OG 3.36Å; G2477-S2482 VanDerWaalsContact O-CB 3.24Å; G2477-S2482 WeakPolarHBondContact O-CB 3.42Å; G2477-S2482 PolarHBondContact O-OG 2.99Å; G2479-S2482 PolarHBondContact O-N 3.45Å; G2479-S2482 PolarHBondContact O-OG 2.97Å
2483	V	89.3	Confident	86	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	114.4	175.5	-178.1	0	0	0	0	108	Y2453 A2469 L2472 K2480 Y2596	Y2453-V2483 CarbonylContact O-C 3.54Å; Y2453-V2483 WeakPolarHBondContact O-CA 3.32Å; A2469-V2483 HydrophobicContact CB-CG1 4.36Å; A2469-V2483 HydrophobicContact CB-CG2 4.15Å; L2472-V2483 HydrophobicContact CB-CG2 4Å; L2472-V2483 HydrophobicContact CD1-CG2 4.28Å; K2480-V2483 WeakPolarHBondContact CA-O 3.33Å; V2483-Y2596 HydrophobicContact CB-CE2 4.28Å; V2483-Y2596 HydrophobicContact CG1-CE2 4.38Å
2484	Q	86	Confident	85.6	Confident	39 Å²	39	41.6 Å²	41.6	18%	0.182	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	-44.4	-175.3	-174.4	173.7	22.7	0	0	111.2	P2452 Y2453 R2454 L2661	P2452-Q2484 HydrophobicContact CB-CB 4.08Å; Y2453-Q2484 PolarHBondContact O-N 3.25Å; R2454-Q2484 HydrophobicContact CG-CB 4.33Å; R2454-Q2484 VanDerWaalsContact NH2-OE1 3.14Å; Q2484-L2661 HydrophobicContact CG-CD1 4.11Å; Q2484-L2661 WeakPolarHBondContact O-CD1 3.48Å
2485	S	87.5	Confident	85.4	Confident	7 Å²	7	35.1 Å²	35.1	5%	0.049	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	144.8	174.6	-179.9	0	0	0	0	109.5	I2455	I2455-S2485 PolarHBondContact N-O 3.36Å
2486	L	93.4	Very high	85.1	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	118.8	173.9	172.5	64.1	0	0	0	108	I2455 A2465 F2466 A2469 L2488 Y2596 V2601	I2455-L2486 HydrophobicContact CB-CD1 4.41Å; A2465-L2486 HydrophobicContact CB-CD1 4.19Å; F2466-L2486 HydrophobicContact CD2-CD2 3.95Å; A2469-L2486 HydrophobicContact CB-CD1 4.11Å; A2469-L2486 HydrophobicContact CB-CD2 3.97Å; A2469-L2486 HydrophobicContact CB-CG 4.45Å; L2486-L2488 HydrophobicContact CD1-CD2 3.92Å; L2486-L2488 HydrophobicContact CG-CD2 4.14Å; L2486-L2488 HydrophobicContact CG-CG 4.4Å; L2486-Y2596 HydrophobicContact CB-CE1 3.99Å; L2486-Y2596 HydrophobicContact CB-CE2 4.46Å; L2486-Y2596 HydrophobicContact CD2-CD1 4.07Å; L2486-Y2596 HydrophobicContact CD2-CD2 4.32Å; L2486-Y2596 HydrophobicContact CD2-CE1 4.14Å; L2486-Y2596 HydrophobicContact CD2-CE2 4.4Å; L2486-Y2596 HydrophobicContact CD2-CG 4.16Å; L2486-V2601 PolarHBondContact O-N 3.29Å
2487	I	95.1	Very high	84.6	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	129.3	179.6	-49.1	-178.2	0	0	0	109.4	I2455 I2456 G2457 L2489 V2601 I2603 I2654 A2657 F2658	I2455-I2487 PolarHBondContact O-N 2.8Å; I2456-I2487 VanDerWaalsContact CA-O 3.31Å; I2456-I2487 WeakPolarHBondContact CA-O 3.5Å; I2456-I2487 HydrophobicContact CG1-CB 4.25Å; I2456-I2487 HydrophobicContact CG2-CB 4.44Å; G2457-I2487 PolarHBondContact N-O 2.8Å; I2487-L2489 HydrophobicContact CG2-CD2 3.85Å; I2487-V2601 CarbonylContact C-O 3.53Å; I2487-V2601 WeakPolarHBondContact CA-O 3.38Å; I2487-V2601 HydrophobicContact CG1-CB 4.28Å; I2487-V2601 HydrophobicContact CG2-CB 4.29Å; I2487-V2601 HydrophobicContact CG2-CG1 4.48Å; I2487-I2603 HydrophobicContact CG2-CD1 4.03Å; I2487-I2603 HydrophobicContact CG2-CG1 4.22Å; I2487-I2654 HydrophobicContact CD1-CB 4.14Å; I2487-I2654 HydrophobicContact CD1-CG1 3.97Å; I2487-I2654 HydrophobicContact CD1-CG2 3.92Å; I2487-I2654 HydrophobicContact CG2-CG1 4.24Å; I2487-A2657 HydrophobicContact CD1-CB 3.98Å; I2487-F2658 HydrophobicContact CD1-CE1 4.17Å; I2487-F2658 HydrophobicContact CD1-CE2 4.05Å; I2487-F2658 HydrophobicContact CD1-CZ 3.81Å; I2487-F2658 HydrophobicContact CG1-CZ 4.48Å
2488	L	95.8	Very high	84.2	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.005	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	126.9	-179.1	-55.5	-179.9	0	0	0	108.6	G2457 A2462 A2465 L2486 V2601 L2602 I2603 L2621	G2457-L2488 WeakPolarHBondContact O-CA 3.41Å; A2462-L2488 HydrophobicContact CB-CB 4.32Å; A2462-L2488 HydrophobicContact CB-CD2 4.05Å; A2462-L2488 WeakPolarHBondContact O-CD2 3.49Å; A2465-L2488 HydrophobicContact CB-CD2 4.36Å; L2486-L2488 HydrophobicContact CD1-CD2 3.92Å; L2486-L2488 HydrophobicContact CG-CD2 4.14Å; L2486-L2488 HydrophobicContact CG-CG 4.4Å; L2488-V2601 PolarHBondContact N-O 3.4Å; L2488-L2602 HydrophobicContact CB-CD1 4.29Å; L2488-L2602 WeakPolarHBondContact O-CA 3.39Å; L2488-I2603 PolarHBondContact O-N 3.38Å; L2488-L2621 HydrophobicContact CD1-CD1 3.88Å; L2488-L2621 HydrophobicContact CD1-CD2 3.56Å; L2488-L2621 HydrophobicContact CD1-CG 4.39Å
2489	L	93.5	Very high	84.1	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	114	-175.5	-52.4	-177.4	0	0	0	109.5	L2411 I2456 G2457 Y2458 S2459 I2487 S2491 I2603 F2641 I2642 T2650 I2654	L2411-L2489 HydrophobicContact CD2-CD1 3.45Å; L2411-L2489 VanDerWaalsContact CD2-CD1 3.45Å; I2456-L2489 HydrophobicContact CG2-CD1 3.53Å; I2456-L2489 HydrophobicContact CG2-CD2 4.42Å; I2456-L2489 HydrophobicContact CG2-CG 3.78Å; G2457-L2489 PolarHBondContact O-N 3.32Å; Y2458-L2489 WeakPolarHBondContact CA-O 3.32Å; Y2458-L2489 HydrophobicContact CD2-CB 4.02Å; Y2458-L2489 HydrophobicContact CG-CB 4.46Å; S2459-L2489 PolarHBondContact N-O 3.16Å; I2487-L2489 HydrophobicContact CG2-CD2 3.85Å; L2489-S2491 VanDerWaalsContact C-N 3.26Å; L2489-S2491 PolarHBondContact O-N 2.98Å; L2489-S2491 VanDerWaalsContact O-N 3.15Å; L2489-I2603 CarbonylContact C-O 3.47Å; L2489-I2603 WeakPolarHBondContact CA-O 3.43Å; L2489-I2603 HydrophobicContact CD2-CB 3.78Å; L2489-I2603 HydrophobicContact CD2-CD1 3.74Å; L2489-I2603 HydrophobicContact CD2-CG1 3.98Å; L2489-F2641 HydrophobicContact CB-CE2 4.23Å; L2489-F2641 HydrophobicContact CB-CZ 3.8Å; L2489-I2642 HydrophobicContact CD1-CG2 4.11Å; L2489-T2650 HydrophobicContact CD1-CG2 4.41Å; L2489-T2650 HydrophobicContact CD2-CG2 4.02Å; L2489-I2654 HydrophobicContact CD2-CD1 4.43Å
2490	D	90.7	Very high	84.3	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	39.3	45.8	-178.6	-158.2	62.7	0	0	0	115.1	Y2495 I2603 K2604 S2605 Y2619 H2638 F2641	D2490-Y2495 WeakPolarHBondContact O-CE1 3.41Å; D2490-Y2495 PolarHBondContact OD2-OH 2.98Å; D2490-I2603 PolarHBondContact N-O 3.49Å; D2490-K2604 WeakPolarHBondContact OD1-CA 3.4Å; D2490-K2604 VanDerWaalsContact OD1-CB 3.26Å; D2490-K2604 WeakPolarHBondContact OD1-CB 3.45Å; D2490-S2605 PolarHBondContact OD1-N 3.24Å; D2490-Y2619 PolarHBondContact OD1-OH 2.93Å; D2490-H2638 PolarHBondContact O-CE1 3.02Å; D2490-H2638 IonicContact OD2-CE1 2.88Å; D2490-H2638 IonicContact OD2-CG 2.8Å; D2490-H2638 IonicContact OD2-ND1 3.78Å; D2490-H2638 PolarHBondContact OD2-ND1 3.27Å; D2490-F2641 HydrophobicContact CB-CD1 4.3Å; D2490-F2641 HydrophobicContact CB-CE1 3.33Å; D2490-F2641 HydrophobicContact CB-CE2 4.33Å; D2490-F2641 HydrophobicContact CB-CZ 3.35Å
2491	S	90.2	Very high	84	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	11%	0.107	C	C	.	.			trans	-166.8	156.4	178.7	173.6	0	0	0	0	113.1	S2459 N2463 L2489 M2496	S2459-S2491 WeakPolarHBondContact O-CB 3.46Å; S2459-S2491 PolarHBondContact O-OG 3.46Å; N2463-S2491 PolarHBondContact ND2-OG 3.28Å; L2489-S2491 VanDerWaalsContact C-N 3.26Å; L2489-S2491 PolarHBondContact O-N 2.98Å; L2489-S2491 VanDerWaalsContact O-N 3.15Å; S2491-M2496 VanDerWaalsContact OG-CE 3.31Å; S2491-M2496 WeakPolarHBondContact OG-CE 3.41Å
2492	S	89.8	Confident	83.2	Confident	1 Å²	1	18.4 Å²	18.4	1%	0.007	8%	0.082	C	C	.	.			trans	-154	175.1	168.3	87.1	0	0	0	0	109.4	N2463 R2494 Y2495 M2496 Y2619	N2463-S2492 VanDerWaalsContact OD1-C 3.31Å; N2463-S2492 PolarHBondContact OD1-O 3.43Å; S2492-R2494 PolarHBondContact O-N 3.35Å; S2492-R2494 PolarHBondContact OG-N 3.18Å; S2492-Y2495 PolarHBondContact O-N 2.93Å; S2492-Y2495 PolarHBondContact OG-N 2.99Å; S2492-Y2495 VanDerWaalsContact OG-N 3.08Å; S2492-M2496 VanDerWaalsContact O-CB 3.28Å; S2492-M2496 WeakPolarHBondContact O-CB 3.46Å; S2492-M2496 PolarHBondContact O-N 2.64Å; S2492-Y2619 WeakPolarHBondContact CB-O 3.39Å; S2492-Y2619 WeakPolarHBondContact OG-CB 3.38Å; S2492-Y2619 PolarHBondContact OG-O 3.01Å
2493	H	88.1	Confident	82.1	Confident	32 Å²	32	19 Å²	19	15%	0.148	8%	0.084	C	C	.	.	H	α-helix	trans	-58.7	-29.5	170.5	75.8	-72.2	0	0	0	114	N2463 R2497 Y2590 P2592 G2620	N2463-H2493 WeakPolarHBondContact OD1-CA 3.39Å; N2463-H2493 PolarHBondContact OD1-N 2.72Å; H2493-R2497 WeakPolarHBondContact O-CB 3.19Å; H2493-R2497 PolarHBondContact O-N 3.41Å; H2493-Y2590 HydrophobicContact CB-CE1 4.14Å; H2493-P2592 HydrophobicContact CB-CG 3.66Å; H2493-G2620 PolarHBondContact CE1-O 3.24Å
2494	R	83	Confident	81	Confident	46 Å²	46	19.5 Å²	19.5	17%	0.174	9%	0.086	C	C	.	.	H	α-helix	trans	-86.1	-40.4	179.2	-165.2	176.9	178.8	129.8	-10.3	111.2	S2492 R2497 L2498 V2615 Y2619 E2623	S2492-R2494 PolarHBondContact O-N 3.35Å; S2492-R2494 PolarHBondContact OG-N 3.18Å; R2494-R2497 WeakPolarHBondContact O-CB 3.49Å; R2494-R2497 PolarHBondContact O-N 3.19Å; R2494-L2498 PolarHBondContact O-N 2.75Å; R2494-V2615 HydrophobicContact CB-CG1 4.02Å; R2494-V2615 HydrophobicContact CG-CG1 3.94Å; R2494-Y2619 WeakPolarHBondContact CB-O 3.48Å; R2494-E2623 IonicContact CZ-OE2 3.58Å; R2494-E2623 IonicContact NH1-OE1 3.59Å; R2494-E2623 PolarHBondContact NH1-OE1 3.36Å; R2494-E2623 IonicContact NH1-OE2 2.74Å; R2494-E2623 PolarHBondContact NH1-OE2 3.43Å
2495	Y	84.2	Confident	79.4	Confident	1 Å²	1	19.3 Å²	19.3	0%	0.004	9%	0.086	C	C	.	.	H	α-helix	trans	-58.8	-48.5	172.6	-173.6	-107.4	0	0	0	111.2	D2490 S2492 R2497 L2498 Y2499 T2610 V2615 Y2619	D2490-Y2495 WeakPolarHBondContact O-CE1 3.41Å; D2490-Y2495 PolarHBondContact OD2-OH 2.98Å; S2492-Y2495 PolarHBondContact O-N 2.93Å; S2492-Y2495 PolarHBondContact OG-N 2.99Å; S2492-Y2495 VanDerWaalsContact OG-N 3.08Å; Y2495-R2497 VanDerWaalsContact C-N 3.3Å; Y2495-R2497 PolarHBondContact O-N 2.65Å; Y2495-L2498 WeakPolarHBondContact O-CA 3.45Å; Y2495-L2498 WeakPolarHBondContact O-CB 3.45Å; Y2495-L2498 PolarHBondContact O-N 3.05Å; Y2495-Y2499 HydrophobicContact CD1-CD2 4.29Å; Y2495-Y2499 HydrophobicContact CD1-CE2 4.48Å; Y2495-Y2499 HydrophobicContact CE1-CD2 4.06Å; Y2495-Y2499 AromaticContact CE1-CE2 3.81Å; Y2495-Y2499 HydrophobicContact CE1-CE2 3.81Å; Y2495-Y2499 HydrophobicContact CE2-CD2 4.42Å; Y2495-Y2499 HydrophobicContact CE2-CE2 4.04Å; Y2495-Y2499 AromaticContact CZ-CE2 3.59Å; Y2495-Y2499 PolarHBondContact O-N 3.4Å; Y2495-T2610 HydrophobicContact CD2-CG2 3.96Å; Y2495-T2610 HydrophobicContact CE2-CG2 3.66Å; Y2495-T2610 WeakPolarHBondContact CE2-OG1 3.23Å; Y2495-V2615 HydrophobicContact CD2-CG2 4.37Å; Y2495-Y2619 HydrophobicContact CD1-CE2 4.48Å; Y2495-Y2619 HydrophobicContact CD2-CD1 4.22Å; Y2495-Y2619 AromaticContact CD2-CD2 3.92Å; Y2495-Y2619 HydrophobicContact CD2-CD2 3.92Å; Y2495-Y2619 AromaticContact CD2-CE1 3.89Å; Y2495-Y2619 HydrophobicContact CD2-CE1 3.89Å; Y2495-Y2619 AromaticContact CD2-CE2 3.59Å; Y2495-Y2619 HydrophobicContact CD2-CE2 3.59Å; Y2495-Y2619 HydrophobicContact CD2-CG 4.22Å; Y2495-Y2619 AromaticContact CD2-CZ 3.56Å; Y2495-Y2619 HydrophobicContact CE2-CE1 4.1Å; Y2495-Y2619 AromaticContact CE2-CE2 3.75Å; Y2495-Y2619 HydrophobicContact CE2-CE2 3.75Å; Y2495-Y2619 AromaticContact CE2-CZ 3.48Å; Y2495-Y2619 VanDerWaalsContact CE2-CZ 3.48Å; Y2495-Y2619 WeakPolarHBondContact CE2-OH 3.48Å; Y2495-Y2619 HydrophobicContact CG-CD2 4.01Å; Y2495-Y2619 AromaticContact CG-CE2 3.97Å; Y2495-Y2619 HydrophobicContact CG-CE2 3.97Å
2496	M	81.3	Confident	77.8	Confident	25 Å²	25	21 Å²	21	12%	0.123	10%	0.1	C	C	.	.	H	α-helix	trans	-66.8	-30.6	178.5	-156.4	57.6	49.5	0	0	112.2	S2491 S2492 R2500	S2491-M2496 VanDerWaalsContact OG-CE 3.31Å; S2491-M2496 WeakPolarHBondContact OG-CE 3.41Å; S2492-M2496 VanDerWaalsContact O-CB 3.28Å; S2492-M2496 WeakPolarHBondContact O-CB 3.46Å; S2492-M2496 PolarHBondContact O-N 2.64Å; M2496-R2500 WeakPolarHBondContact O-CB 3.3Å; M2496-R2500 PolarHBondContact O-N 3.48Å
2497	R	77.2	Confident	76.2	Confident	92 Å²	92	21.9 Å²	21.9	35%	0.347	10%	0.103	S	C	.	.	H	α-helix	trans	-68.4	-36.9	170.8	-163.3	-171.1	93.6	175.5	14.6	112.3	D2294 H2493 R2494 Y2495 R2500 N2501	D2294-R2497 IonicContact OD2-CZ 3.73Å; D2294-R2497 VanDerWaalsContact OD2-CZ 3.3Å; D2294-R2497 IonicContact OD2-NE 3.85Å; D2294-R2497 PolarHBondContact OD2-NE 3.43Å; D2294-R2497 VanDerWaalsContact OD2-NE 3.07Å; D2294-R2497 IonicContact OD2-NH2 3.25Å; D2294-R2497 PolarHBondContact OD2-NH2 3.24Å; H2493-R2497 WeakPolarHBondContact O-CB 3.19Å; H2493-R2497 PolarHBondContact O-N 3.41Å; R2494-R2497 WeakPolarHBondContact O-CB 3.49Å; R2494-R2497 PolarHBondContact O-N 3.19Å; Y2495-R2497 VanDerWaalsContact C-N 3.3Å; Y2495-R2497 PolarHBondContact O-N 2.65Å; R2497-R2500 WeakPolarHBondContact O-CB 3.2Å; R2497-N2501 PolarHBondContact O-N 3.08Å; R2497-N2501 PolarHBondContact O-ND2 3.48Å; R2497-N2501 PolarHBondContact O-OD1 3.39Å
2498	L	67.7	Low	74	Confident	4 Å²	4	24.1 Å²	24.1	2%	0.021	13%	0.127	C	C	.	.	H	α-helix	trans	-65.9	-50.4	175.2	-140.3	99.2	0	0	0	110.3	D2296 R2494 Y2495 R2500 N2501 A2502 T2610 D2614 V2615	D2296-L2498 HydrophobicContact CB-CD2 4.32Å; D2296-L2498 HydrophobicContact CB-CG 4.25Å; D2296-L2498 WeakPolarHBondContact OD2-CD2 3.29Å; R2494-L2498 PolarHBondContact O-N 2.75Å; Y2495-L2498 WeakPolarHBondContact O-CA 3.45Å; Y2495-L2498 WeakPolarHBondContact O-CB 3.45Å; Y2495-L2498 PolarHBondContact O-N 3.05Å; L2498-R2500 VanDerWaalsContact C-N 3.31Å; L2498-R2500 PolarHBondContact O-N 3.2Å; L2498-N2501 CarbonylContact O-C 3.59Å; L2498-N2501 WeakPolarHBondContact O-CA 3.47Å; L2498-N2501 WeakPolarHBondContact O-CB 3.31Å; L2498-N2501 PolarHBondContact O-N 3.13Å; L2498-A2502 WeakPolarHBondContact O-CB 2.99Å; L2498-A2502 PolarHBondContact O-N 2.92Å; L2498-T2610 HydrophobicContact CD2-CG2 3.56Å; L2498-D2614 HydrophobicContact CD1-CB 4.04Å; L2498-D2614 HydrophobicContact CD2-CB 3.92Å; L2498-V2615 HydrophobicContact CD1-CG2 4.45Å; L2498-V2615 HydrophobicContact CD2-CG2 4Å
2499	Y	70.8	Confident	72.3	Confident	25 Å²	25	24.1 Å²	24.1	10%	0.098	13%	0.127	C	C	.	.	H	α-helix	trans	-55.2	-43.6	174	-104.1	-107.6	0	0	0	112.7	M2367 F2368 Y2495 N2501 A2502 Y2503 T2610	M2367-Y2499 HydrophobicContact CB-CE1 3.87Å; M2367-Y2499 WeakPolarHBondContact CB-OH 3.27Å; M2367-Y2499 HydrophobicContact CG-CE1 4.41Å; M2367-Y2499 WeakPolarHBondContact CG-OH 3.34Å; M2367-Y2499 HydrophobicContact SD-CE1 4.2Å; F2368-Y2499 AromaticContact CE1-CD1 3.78Å; F2368-Y2499 HydrophobicContact CE1-CD1 3.78Å; F2368-Y2499 HydrophobicContact CE1-CE1 4.02Å; F2368-Y2499 AromaticContact CZ-CD1 3.59Å; F2368-Y2499 HydrophobicContact CZ-CD1 3.59Å; F2368-Y2499 AromaticContact CZ-CE1 3.82Å; F2368-Y2499 HydrophobicContact CZ-CE1 3.82Å; Y2495-Y2499 HydrophobicContact CD1-CD2 4.29Å; Y2495-Y2499 HydrophobicContact CD1-CE2 4.48Å; Y2495-Y2499 HydrophobicContact CE1-CD2 4.06Å; Y2495-Y2499 AromaticContact CE1-CE2 3.81Å; Y2495-Y2499 HydrophobicContact CE1-CE2 3.81Å; Y2495-Y2499 HydrophobicContact CE2-CD2 4.42Å; Y2495-Y2499 HydrophobicContact CE2-CE2 4.04Å; Y2495-Y2499 AromaticContact CZ-CE2 3.59Å; Y2495-Y2499 PolarHBondContact O-N 3.4Å; Y2499-N2501 VanDerWaalsContact C-N 3.3Å; Y2499-N2501 PolarHBondContact O-N 2.79Å; Y2499-A2502 PolarHBondContact O-N 3.45Å; Y2499-Y2503 WeakPolarHBondContact O-CB 3.25Å; Y2499-Y2503 PolarHBondContact O-N 3.39Å; Y2499-T2610 HydrophobicContact CD2-CG2 4.28Å; Y2499-T2610 HydrophobicContact CE2-CG2 4.1Å
2500	R	72.5	Confident	69.9	Low	83 Å²	83	27.1 Å²	27.1	31%	0.313	15%	0.151	S	C	.	.	H	α-helix	trans	-61.4	-35.3	173.7	179.4	-152.4	85.4	129.2	8.7	113	M2496 R2497 L2498 R2504 D2588	M2496-R2500 WeakPolarHBondContact O-CB 3.3Å; M2496-R2500 PolarHBondContact O-N 3.48Å; R2497-R2500 WeakPolarHBondContact O-CB 3.2Å; L2498-R2500 VanDerWaalsContact C-N 3.31Å; L2498-R2500 PolarHBondContact O-N 3.2Å; R2500-R2504 PolarHBondContact O-N 2.71Å; R2500-D2588 WeakPolarHBondContact CD-O 3.24Å; R2500-D2588 WeakPolarHBondContact CD-OD1 3.27Å; R2500-D2588 HydrophobicContact CG-CB 4.37Å; R2500-D2588 VanDerWaalsContact CG-OD1 3.26Å; R2500-D2588 WeakPolarHBondContact CG-OD1 3.17Å; R2500-D2588 IonicContact CZ-OD1 3.77Å; R2500-D2588 IonicContact NE-OD1 3.69Å; R2500-D2588 PolarHBondContact NH1-O 3.46Å; R2500-D2588 IonicContact NH1-OD1 2.86Å
2501	N	63.2	Low	67.8	Low	3 Å²	3	29.4 Å²	29.4	2%	0.016	17%	0.171	C	C	.	.	H	α-helix	trans	-73.1	-46.8	174.4	-69.7	-13.7	0	0	0	110.6	D2294 S2297 R2497 L2498 Y2499 Y2503 R2504 L2505	D2294-N2501 PolarHBondContact OD1-ND2 2.91Å; D2294-N2501 PolarHBondContact OD2-ND2 3.14Å; S2297-N2501 PolarHBondContact OG-ND2 3.29Å; S2297-N2501 VanDerWaalsContact OG-ND2 3.11Å; R2497-N2501 PolarHBondContact O-N 3.08Å; R2497-N2501 PolarHBondContact O-ND2 3.48Å; R2497-N2501 PolarHBondContact O-OD1 3.39Å; L2498-N2501 CarbonylContact O-C 3.59Å; L2498-N2501 WeakPolarHBondContact O-CA 3.47Å; L2498-N2501 WeakPolarHBondContact O-CB 3.31Å; L2498-N2501 PolarHBondContact O-N 3.13Å; Y2499-N2501 VanDerWaalsContact C-N 3.3Å; Y2499-N2501 PolarHBondContact O-N 2.79Å; N2501-Y2503 PolarHBondContact O-N 2.93Å; N2501-R2504 WeakPolarHBondContact O-CB 3.41Å; N2501-R2504 PolarHBondContact O-N 2.86Å; N2501-L2505 WeakPolarHBondContact O-CB 3.47Å; N2501-L2505 PolarHBondContact O-N 3.16Å
2502	A	60.4	Low	66.1	Low	28 Å²	28	38.6 Å²	38.6	23%	0.231	21%	0.213	C	C	.	.	H	α-helix	trans	-60.7	-40	177.1	0	0	0	0	0	113.4	L2498 Y2499 L2505 A2506	L2498-A2502 WeakPolarHBondContact O-CB 2.99Å; L2498-A2502 PolarHBondContact O-N 2.92Å; Y2499-A2502 PolarHBondContact O-N 3.45Å; A2502-L2505 CarbonylContact O-C 3.49Å; A2502-L2505 WeakPolarHBondContact O-CA 3.42Å; A2502-L2505 WeakPolarHBondContact O-CB 3.43Å; A2502-L2505 PolarHBondContact O-N 3.11Å; A2502-A2506 PolarHBondContact O-N 2.91Å
2503	Y	64.6	Low	64.7	Low	13 Å²	13	42.4 Å²	42.4	5%	0.051	23%	0.234	C	C	.	.	H	α-helix	trans	-69.9	-41.9	176.2	-166.2	-81	0	0	0	111.9	F2368 Y2499 N2501 L2505 Y2507 F2520 E2523	F2368-Y2503 HydrophobicContact CD1-CD2 4.11Å; F2368-Y2503 HydrophobicContact CD1-CE2 4.28Å; F2368-Y2503 HydrophobicContact CD2-CD2 4.1Å; F2368-Y2503 HydrophobicContact CD2-CE2 4.33Å; F2368-Y2503 AromaticContact CE1-CD2 3.74Å; F2368-Y2503 HydrophobicContact CE1-CD2 3.74Å; F2368-Y2503 HydrophobicContact CE1-CE2 4.35Å; F2368-Y2503 AromaticContact CE2-CD2 3.75Å; F2368-Y2503 HydrophobicContact CE2-CD2 3.75Å; F2368-Y2503 HydrophobicContact CE2-CE2 4.43Å; F2368-Y2503 HydrophobicContact CG-CD2 4.3Å; F2368-Y2503 HydrophobicContact CG-CE2 4.29Å; F2368-Y2503 AromaticContact CZ-CD2 3.57Å; F2368-Y2503 HydrophobicContact CZ-CD2 3.57Å; F2368-Y2503 HydrophobicContact CZ-CE2 4.46Å; F2368-Y2503 HydrophobicContact CZ-CG 4.4Å; Y2499-Y2503 WeakPolarHBondContact O-CB 3.25Å; Y2499-Y2503 PolarHBondContact O-N 3.39Å; N2501-Y2503 PolarHBondContact O-N 2.93Å; Y2503-L2505 PolarHBondContact O-N 2.76Å; Y2503-Y2507 AromaticContact CD1-CD2 3.91Å; Y2503-Y2507 HydrophobicContact CD1-CD2 3.91Å; Y2503-Y2507 HydrophobicContact CD1-CE2 4.45Å; Y2503-Y2507 HydrophobicContact CD2-CD2 4.13Å; Y2503-Y2507 AromaticContact CD2-CE2 3.86Å; Y2503-Y2507 HydrophobicContact CD2-CE2 3.86Å; Y2503-Y2507 AromaticContact CE1-CD2 3.64Å; Y2503-Y2507 HydrophobicContact CE1-CD2 3.64Å; Y2503-Y2507 HydrophobicContact CE1-CE2 4.12Å; Y2503-Y2507 AromaticContact CE2-CD2 3.92Å; Y2503-Y2507 HydrophobicContact CE2-CD2 3.92Å; Y2503-Y2507 AromaticContact CE2-CE2 3.52Å; Y2503-Y2507 HydrophobicContact CE2-CE2 3.52Å; Y2503-Y2507 HydrophobicContact CG-CD2 4.14Å; Y2503-Y2507 HydrophobicContact CG-CE2 4.33Å; Y2503-Y2507 AromaticContact CZ-CD2 3.67Å; Y2503-Y2507 AromaticContact CZ-CE2 3.67Å; Y2503-Y2507 WeakPolarHBondContact O-CD2 3.42Å; Y2503-F2520 HydrophobicContact CD1-CD2 4.46Å; Y2503-F2520 AromaticContact CE1-CD2 3.88Å; Y2503-F2520 HydrophobicContact CE1-CD2 3.88Å; Y2503-E2523 VanDerWaalsContact OH-CB 3.25Å; Y2503-E2523 WeakPolarHBondContact OH-CB 3.4Å
2504	R	65.6	Low	63.8	Low	10 Å²	10	41.4 Å²	41.4	4%	0.038	23%	0.229	C	C	.	.	H	α-helix	trans	-53	-39.8	167.1	-82.9	-166.4	173.6	81.3	1.8	109.9	R2298 R2500 N2501 V2509 A2511 L2514 D2588	R2298-R2504 PolarHBondContact NH1-O 3.49Å; R2298-R2504 PolarHBondContact NH2-O 3.46Å; R2500-R2504 PolarHBondContact O-N 2.71Å; N2501-R2504 WeakPolarHBondContact O-CB 3.41Å; N2501-R2504 PolarHBondContact O-N 2.86Å; R2504-V2509 HydrophobicContact CB-CB 4.34Å; R2504-V2509 HydrophobicContact CG-CB 4.08Å; R2504-V2509 HydrophobicContact CG-CG1 4.1Å; R2504-V2509 PolarHBondContact O-N 2.67Å; R2504-A2511 PolarHBondContact NE-O 3.44Å; R2504-L2514 HydrophobicContact CG-CD1 3.98Å; R2504-L2514 VanDerWaalsContact CZ-CD1 3.48Å; R2504-D2588 IonicContact CZ-OD1 2.71Å; R2504-D2588 IonicContact CZ-OD2 3.62Å; R2504-D2588 IonicContact NH1-OD1 3.32Å; R2504-D2588 PolarHBondContact NH1-OD1 3.06Å; R2504-D2588 VanDerWaalsContact NH2-CG 3.32Å; R2504-D2588 IonicContact NH2-OD1 3.95Å; R2504-D2588 PolarHBondContact NH2-OD1 2.84Å; R2504-D2588 IonicContact NH2-OD2 2.79Å; R2504-D2588 PolarHBondContact NH2-OD2 3.1Å
2505	L	53.7	Low	63.2	Low	35 Å²	35	39.7 Å²	39.7	18%	0.183	23%	0.226	C	C	.	.	H	α-helix	trans	-65.5	-46	-174.2	-127.7	120.5	0	0	0	116	D2296 R2298 G2331 T2333 N2501 A2502 Y2503 Y2507	D2296-L2505 WeakPolarHBondContact O-CD1 3.46Å; R2298-L2505 HydrophobicContact CB-CD1 4.21Å; R2298-L2505 HydrophobicContact CG-CB 4.46Å; R2298-L2505 HydrophobicContact CG-CD1 3.45Å; R2298-L2505 VanDerWaalsContact CG-CD1 3.45Å; R2298-L2505 HydrophobicContact CG-CG 3.57Å; R2298-L2505 VanDerWaalsContact NH2-C 3.31Å; R2298-L2505 PolarHBondContact NH2-O 2.83Å; G2331-L2505 VanDerWaalsContact O-CD2 3.23Å; G2331-L2505 WeakPolarHBondContact O-CD2 3.48Å; G2331-L2505 WeakPolarHBondContact O-CG 3.46Å; T2333-L2505 HydrophobicContact CG2-CD1 3.26Å; T2333-L2505 HydrophobicContact CG2-CD2 3.19Å; T2333-L2505 HydrophobicContact CG2-CG 3.76Å; N2501-L2505 WeakPolarHBondContact O-CB 3.47Å; N2501-L2505 PolarHBondContact O-N 3.16Å; A2502-L2505 CarbonylContact O-C 3.49Å; A2502-L2505 WeakPolarHBondContact O-CA 3.42Å; A2502-L2505 WeakPolarHBondContact O-CB 3.43Å; A2502-L2505 PolarHBondContact O-N 3.11Å; Y2503-L2505 PolarHBondContact O-N 2.76Å; L2505-Y2507 VanDerWaalsContact C-N 3.31Å; L2505-Y2507 PolarHBondContact O-N 3Å
2506	A	52.8	Low	62.6	Low	41 Å²	41	46.9 Å²	46.9	34%	0.339	26%	0.259	S	S	.	.	H	α-helix	trans	-65.8	-35.7	178.4	0	0	0	0	0	111.9	I2364 A2502	I2364-A2506 HydrophobicContact CG2-CB 4.39Å; A2502-A2506 PolarHBondContact O-N 2.91Å
2507	Y	61.1	Low	62.5	Low	19 Å²	19	47 Å²	47	8%	0.075	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	31.6	-162.3	-56.8	-66.5	0	0	0	115.3	Y2503 L2505 V2509 N2519 E2523	Y2503-Y2507 AromaticContact CD1-CD2 3.91Å; Y2503-Y2507 HydrophobicContact CD1-CD2 3.91Å; Y2503-Y2507 HydrophobicContact CD1-CE2 4.45Å; Y2503-Y2507 HydrophobicContact CD2-CD2 4.13Å; Y2503-Y2507 AromaticContact CD2-CE2 3.86Å; Y2503-Y2507 HydrophobicContact CD2-CE2 3.86Å; Y2503-Y2507 AromaticContact CE1-CD2 3.64Å; Y2503-Y2507 HydrophobicContact CE1-CD2 3.64Å; Y2503-Y2507 HydrophobicContact CE1-CE2 4.12Å; Y2503-Y2507 AromaticContact CE2-CD2 3.92Å; Y2503-Y2507 HydrophobicContact CE2-CD2 3.92Å; Y2503-Y2507 AromaticContact CE2-CE2 3.52Å; Y2503-Y2507 HydrophobicContact CE2-CE2 3.52Å; Y2503-Y2507 HydrophobicContact CG-CD2 4.14Å; Y2503-Y2507 HydrophobicContact CG-CE2 4.33Å; Y2503-Y2507 AromaticContact CZ-CD2 3.67Å; Y2503-Y2507 AromaticContact CZ-CE2 3.67Å; Y2503-Y2507 WeakPolarHBondContact O-CD2 3.42Å; L2505-Y2507 VanDerWaalsContact C-N 3.31Å; L2505-Y2507 PolarHBondContact O-N 3Å; Y2507-V2509 WeakPolarHBondContact O-CG2 3.49Å; Y2507-V2509 PolarHBondContact O-N 3.33Å; Y2507-N2519 WeakPolarHBondContact O-CB 3.46Å; Y2507-E2523 HydrophobicContact CD1-CB 4.28Å; Y2507-E2523 HydrophobicContact CD1-CG 3.44Å; Y2507-E2523 VanDerWaalsContact CD1-CG 3.44Å; Y2507-E2523 VanDerWaalsContact CD1-OE1 3.29Å; Y2507-E2523 WeakPolarHBondContact CD1-OE1 3.35Å; Y2507-E2523 HydrophobicContact CD2-CG 4.48Å; Y2507-E2523 HydrophobicContact CE1-CB 4.34Å; Y2507-E2523 HydrophobicContact CE1-CG 3.78Å; Y2507-E2523 WeakPolarHBondContact CE1-OE1 3.44Å; Y2507-E2523 HydrophobicContact CG-CB 4.36Å; Y2507-E2523 HydrophobicContact CG-CG 3.81Å
2508	G	48.5	Very low	62.6	Low	48 Å²	48	45 Å²	45	50%	0.495	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	-9.1	171.7	0	0	0	0	0	117.8	R2298 A2510	R2298-G2508 PolarHBondContact NH1-O 2.78Å; R2298-G2508 VanDerWaalsContact NH2-CA 3.27Å; R2298-G2508 VanDerWaalsContact NH2-N 3.13Å; G2508-A2510 PolarHBondContact O-N 2.94Å
2509	V	58.9	Low	63.1	Low	1 Å²	1	48.1 Å²	48.1	1%	0.006	28%	0.275	C	S	.	.			trans	-61.8	102.3	-173	-173.9	0	0	0	0	113.1	R2298 R2504 Y2507 L2514 D2517 F2520	R2298-V2509 VanDerWaalsContact NH1-N 3.18Å; R2298-V2509 PolarHBondContact NH1-O 3.3Å; R2504-V2509 HydrophobicContact CB-CB 4.34Å; R2504-V2509 HydrophobicContact CG-CB 4.08Å; R2504-V2509 HydrophobicContact CG-CG1 4.1Å; R2504-V2509 PolarHBondContact O-N 2.67Å; Y2507-V2509 WeakPolarHBondContact O-CG2 3.49Å; Y2507-V2509 PolarHBondContact O-N 3.33Å; V2509-L2514 HydrophobicContact CG1-CD1 3.79Å; V2509-D2517 HydrophobicContact CG1-CB 4.19Å; V2509-F2520 HydrophobicContact CG2-CB 4.18Å
2510	A	44.7	Very low	63.6	Low	62 Å²	62	47 Å²	47	51%	0.512	27%	0.27	S	S	.	.			trans	-102.6	-5.7	-174.9	0	0	0	0	0	114.5	G2508	G2508-A2510 PolarHBondContact O-N 2.94Å
2511	A	45.8	Very low	64.1	Low	49 Å²	49	43.4 Å²	43.4	41%	0.405	26%	0.257	S	S	.	.	S	Bend	trans	-89.8	151.5	-178.5	0	0	0	0	0	113	R2504 N2513	R2504-A2511 PolarHBondContact NE-O 3.44Å; A2511-N2513 PolarHBondContact O-N 3.02Å; A2511-N2513 VanDerWaalsContact O-N 3.16Å
2512	Q	53.5	Low	65.2	Low	192 Å²	192	43.4 Å²	43.4	90%	0.897	26%	0.258	S	S	*	.	S	Bend	trans	-66.6	-8.3	170.5	-72.6	-170.4	-7.3	0	0	113.7
2513	N	60.8	Low	66.2	Low	82 Å²	82	42.2 Å²	42.2	44%	0.439	25%	0.247	S	C	.	.			trans	-123	100.5	-174.5	-131.3	-12.9	0	0	0	109.8	A2511 A2515 R2589	A2511-N2513 PolarHBondContact O-N 3.02Å; A2511-N2513 VanDerWaalsContact O-N 3.16Å; N2513-A2515 PolarHBondContact O-N 2.76Å; N2513-R2589 PolarHBondContact OD1-NH2 2.89Å
2514	L	70	Confident	67	Low	10 Å²	10	41.8 Å²	41.8	5%	0.052	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-61.6	-21.8	174.5	-113.2	66.9	0	0	0	112.9	R2504 V2509 H2516 D2517 F2520 L2585 D2588	R2504-L2514 HydrophobicContact CG-CD1 3.98Å; R2504-L2514 VanDerWaalsContact CZ-CD1 3.48Å; V2509-L2514 HydrophobicContact CG1-CD1 3.79Å; L2514-H2516 PolarHBondContact O-N 2.92Å; L2514-D2517 PolarHBondContact O-N 2.78Å; L2514-F2520 HydrophobicContact CB-CD1 4.24Å; L2514-F2520 HydrophobicContact CB-CE1 4.19Å; L2514-F2520 HydrophobicContact CB-CZ 4.45Å; L2514-F2520 HydrophobicContact CD2-CD2 3.67Å; L2514-F2520 HydrophobicContact CD2-CE1 4.28Å; L2514-F2520 HydrophobicContact CD2-CE2 3.43Å; L2514-F2520 VanDerWaalsContact CD2-CE2 3.43Å; L2514-F2520 HydrophobicContact CD2-CG 4.21Å; L2514-F2520 HydrophobicContact CD2-CZ 3.76Å; L2514-F2520 HydrophobicContact CG-CD1 4.17Å; L2514-F2520 HydrophobicContact CG-CD2 3.91Å; L2514-F2520 HydrophobicContact CG-CE1 4.32Å; L2514-F2520 HydrophobicContact CG-CE2 4.09Å; L2514-F2520 HydrophobicContact CG-CG 3.95Å; L2514-F2520 HydrophobicContact CG-CZ 4.28Å; L2514-F2520 WeakPolarHBondContact O-CD1 3.37Å; L2514-L2585 HydrophobicContact CB-CD2 3.53Å; L2514-D2588 HydrophobicContact CD2-CB 4.27Å
2515	A	69.2	Low	68.1	Low	11 Å²	11	41.3 Å²	41.3	9%	0.091	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-63.1	-14.7	-164.3	0	0	0	0	0	116.3	N2513 R2581 L2585	N2513-A2515 PolarHBondContact O-N 2.76Å; A2515-R2581 PolarHBondContact O-NH2 3.11Å; A2515-R2581 VanDerWaalsContact O-NH2 3.13Å; A2515-L2585 HydrophobicContact CB-CD1 4.13Å; A2515-L2585 HydrophobicContact CB-CD2 3.85Å
2516	H	71.8	Confident	69.6	Low	151 Å²	151	39.6 Å²	39.6	70%	0.699	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-139.6	17.5	-175.3	-55.7	-52.2	0	0	0	112.9	L2514	L2514-H2516 PolarHBondContact O-N 2.92Å
2517	D	78.8	Confident	70.7	Confident	27 Å²	27	39 Å²	39	14%	0.144	23%	0.23	C	C	.	.			trans	-84.7	117.9	176.9	-173.2	-62.3	0	0	0	110.2	V2509 L2514 N2519 F2520 E2521	V2509-D2517 HydrophobicContact CG1-CB 4.19Å; L2514-D2517 PolarHBondContact O-N 2.78Å; D2517-N2519 VanDerWaalsContact C-N 3.26Å; D2517-N2519 PolarHBondContact O-N 2.71Å; D2517-N2519 WeakPolarHBondContact OD1-CA 3.21Å; D2517-N2519 WeakPolarHBondContact OD1-CB 3.44Å; D2517-N2519 PolarHBondContact OD1-N 3.07Å; D2517-N2519 PolarHBondContact OD1-ND2 2.82Å; D2517-F2520 HydrophobicContact CB-CB 4.06Å; D2517-F2520 PolarHBondContact O-N 3.04Å; D2517-F2520 PolarHBondContact OD1-N 3.11Å; D2517-F2520 VanDerWaalsContact OD1-N 3.16Å; D2517-E2521 PolarHBondContact O-N 3.38Å
2518	T	81.1	Confident	71.7	Confident	52 Å²	52	38.1 Å²	38.1	32%	0.319	23%	0.226	S	C	.	.	H	α-helix	trans	-59.1	-34.1	-178.5	-59.2	0	0	0	0	112.8	C2522	T2518-C2522 WeakPolarHBondContact O-CB 3.41Å; T2518-C2522 PolarHBondContact O-N 2.95Å; T2518-C2522 PolarHBondContact O-SG 3.1Å
2519	N	78.3	Confident	73.4	Confident	69 Å²	69	35.8 Å²	35.8	37%	0.369	20%	0.203	S	C	.	.	H	α-helix	trans	-71.2	-46.8	178.5	-54.1	-75.7	0	0	0	109.9	Y2507 D2517 E2521 C2522 E2523	Y2507-N2519 WeakPolarHBondContact O-CB 3.46Å; D2517-N2519 VanDerWaalsContact C-N 3.26Å; D2517-N2519 PolarHBondContact O-N 2.71Å; D2517-N2519 WeakPolarHBondContact OD1-CA 3.21Å; D2517-N2519 WeakPolarHBondContact OD1-CB 3.44Å; D2517-N2519 PolarHBondContact OD1-N 3.07Å; D2517-N2519 PolarHBondContact OD1-ND2 2.82Å; N2519-E2521 VanDerWaalsContact C-N 3.28Å; N2519-E2521 PolarHBondContact O-N 3.4Å; N2519-C2522 PolarHBondContact O-N 3.12Å; N2519-E2523 WeakPolarHBondContact O-CB 3.47Å; N2519-E2523 WeakPolarHBondContact O-CG 3.13Å; N2519-E2523 PolarHBondContact O-N 2.9Å
2520	F	79.3	Confident	74.4	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-56.1	-42.4	174	167.7	-107.4	0	0	0	112.3	Y2503 V2509 L2514 D2517 I2524 R2581 F2584 L2585	Y2503-F2520 HydrophobicContact CD1-CD2 4.46Å; Y2503-F2520 AromaticContact CE1-CD2 3.88Å; Y2503-F2520 HydrophobicContact CE1-CD2 3.88Å; V2509-F2520 HydrophobicContact CG2-CB 4.18Å; L2514-F2520 HydrophobicContact CB-CD1 4.24Å; L2514-F2520 HydrophobicContact CB-CE1 4.19Å; L2514-F2520 HydrophobicContact CB-CZ 4.45Å; L2514-F2520 HydrophobicContact CD2-CD2 3.67Å; L2514-F2520 HydrophobicContact CD2-CE1 4.28Å; L2514-F2520 HydrophobicContact CD2-CE2 3.43Å; L2514-F2520 VanDerWaalsContact CD2-CE2 3.43Å; L2514-F2520 HydrophobicContact CD2-CG 4.21Å; L2514-F2520 HydrophobicContact CD2-CZ 3.76Å; L2514-F2520 HydrophobicContact CG-CD1 4.17Å; L2514-F2520 HydrophobicContact CG-CD2 3.91Å; L2514-F2520 HydrophobicContact CG-CE1 4.32Å; L2514-F2520 HydrophobicContact CG-CE2 4.09Å; L2514-F2520 HydrophobicContact CG-CG 3.95Å; L2514-F2520 HydrophobicContact CG-CZ 4.28Å; L2514-F2520 WeakPolarHBondContact O-CD1 3.37Å; D2517-F2520 HydrophobicContact CB-CB 4.06Å; D2517-F2520 PolarHBondContact O-N 3.04Å; D2517-F2520 PolarHBondContact OD1-N 3.11Å; D2517-F2520 VanDerWaalsContact OD1-N 3.16Å; F2520-I2524 HydrophobicContact CD2-CD1 4.22Å; F2520-I2524 HydrophobicContact CD2-CG1 4.41Å; F2520-I2524 HydrophobicContact CE1-CD1 4.08Å; F2520-I2524 HydrophobicContact CE2-CD1 3.39Å; F2520-I2524 HydrophobicContact CE2-CG1 3.98Å; F2520-I2524 HydrophobicContact CZ-CD1 3.31Å; F2520-I2524 HydrophobicContact CZ-CG1 4.32Å; F2520-I2524 WeakPolarHBondContact O-CB 3.31Å; F2520-I2524 PolarHBondContact O-N 3.08Å; F2520-R2581 HydrophobicContact CE1-CG 4.13Å; F2520-F2584 HydrophobicContact CE2-CB 3.94Å; F2520-F2584 HydrophobicContact CE2-CD1 4.35Å; F2520-F2584 HydrophobicContact CE2-CG 4.18Å; F2520-F2584 HydrophobicContact CZ-CB 3.73Å; F2520-F2584 HydrophobicContact CZ-CG 4.4Å; F2520-L2585 HydrophobicContact CE1-CD2 4.48Å
2521	E	85.1	Confident	75.9	Confident	8 Å²	8	42.3 Å²	42.3	4%	0.037	22%	0.218	C	C	.	.	H	α-helix	trans	-65.2	-45.7	176.1	-74.2	-172	176.5	0	0	112.5	D2517 N2519 L2525 W2550 R2553 R2581	D2517-E2521 PolarHBondContact O-N 3.38Å; N2519-E2521 VanDerWaalsContact C-N 3.28Å; N2519-E2521 PolarHBondContact O-N 3.4Å; E2521-L2525 WeakPolarHBondContact O-CB 3.3Å; E2521-L2525 WeakPolarHBondContact O-CD1 3.32Å; E2521-L2525 VanDerWaalsContact O-CG 3.23Å; E2521-L2525 WeakPolarHBondContact O-CG 3.44Å; E2521-L2525 PolarHBondContact O-N 2.92Å; E2521-L2525 VanDerWaalsContact O-N 3.15Å; E2521-W2550 HydrophobicContact CB-CE3 3.69Å; E2521-W2550 HydrophobicContact CB-CZ3 3.7Å; E2521-W2550 VanDerWaalsContact CD-CE3 3.44Å; E2521-W2550 HydrophobicContact CG-CE3 3.53Å; E2521-W2550 HydrophobicContact CG-CZ3 3.77Å; E2521-R2553 IonicContact OE2-CZ 2.73Å; E2521-R2553 IonicContact OE2-NH1 3.26Å; E2521-R2553 PolarHBondContact OE2-NH1 3.5Å; E2521-R2581 IonicContact OE1-CZ 3.17Å; E2521-R2581 VanDerWaalsContact OE1-CZ 3.31Å; E2521-R2581 IonicContact OE1-NE 3.47Å; E2521-R2581 PolarHBondContact OE1-NE 3.02Å; E2521-R2581 IonicContact OE1-NH2 3.56Å; E2521-R2581 PolarHBondContact OE1-NH2 2.95Å
2522	C	86.2	Confident	77.5	Confident	4 Å²	4	41.3 Å²	41.3	3%	0.027	20%	0.204	C	C	.	.	H	α-helix	trans	-64	-40.6	176.3	-70.7	0	0	0	0	112.7	T2518 N2519 L2525 L2526 L2544	T2518-C2522 WeakPolarHBondContact O-CB 3.41Å; T2518-C2522 PolarHBondContact O-N 2.95Å; T2518-C2522 PolarHBondContact O-SG 3.1Å; N2519-C2522 PolarHBondContact O-N 3.12Å; C2522-L2525 CarbonylContact O-C 3.58Å; C2522-L2525 WeakPolarHBondContact O-CB 3.48Å; C2522-L2525 PolarHBondContact O-N 3.16Å; C2522-L2526 WeakPolarHBondContact O-CB 3.32Å; C2522-L2526 WeakPolarHBondContact O-CD1 3.5Å; C2522-L2526 WeakPolarHBondContact O-CG 3.27Å; C2522-L2526 PolarHBondContact O-N 2.97Å; C2522-L2544 HydrophobicContact CB-CB 4.29Å
2523	E	81.3	Confident	78.6	Confident	3 Å²	3	33 Å²	33	1%	0.014	17%	0.168	C	C	.	.	H	α-helix	trans	-76.5	-33.7	-175.6	-62.1	-71.4	-176.4	0	0	112.4	Y2503 Y2507 N2519 L2525 L2526 A2527 Y2537 R2541	Y2503-E2523 VanDerWaalsContact OH-CB 3.25Å; Y2503-E2523 WeakPolarHBondContact OH-CB 3.4Å; Y2507-E2523 HydrophobicContact CD1-CB 4.28Å; Y2507-E2523 HydrophobicContact CD1-CG 3.44Å; Y2507-E2523 VanDerWaalsContact CD1-CG 3.44Å; Y2507-E2523 VanDerWaalsContact CD1-OE1 3.29Å; Y2507-E2523 WeakPolarHBondContact CD1-OE1 3.35Å; Y2507-E2523 HydrophobicContact CD2-CG 4.48Å; Y2507-E2523 HydrophobicContact CE1-CB 4.34Å; Y2507-E2523 HydrophobicContact CE1-CG 3.78Å; Y2507-E2523 WeakPolarHBondContact CE1-OE1 3.44Å; Y2507-E2523 HydrophobicContact CG-CB 4.36Å; Y2507-E2523 HydrophobicContact CG-CG 3.81Å; N2519-E2523 WeakPolarHBondContact O-CB 3.47Å; N2519-E2523 WeakPolarHBondContact O-CG 3.13Å; N2519-E2523 PolarHBondContact O-N 2.9Å; E2523-L2525 VanDerWaalsContact C-N 3.31Å; E2523-L2526 PolarHBondContact O-N 2.91Å; E2523-L2526 WeakPolarHBondContact OE2-CD1 3.39Å; E2523-A2527 WeakPolarHBondContact O-CB 3.46Å; E2523-A2527 PolarHBondContact O-N 3.47Å; E2523-Y2537 PolarHBondContact OE1-OH 3.33Å; E2523-Y2537 PolarHBondContact OE2-OH 2.92Å; E2523-R2541 IonicContact OE1-CZ 2.66Å; E2523-R2541 IonicContact OE1-NE 3.97Å; E2523-R2541 PolarHBondContact OE1-NE 2.9Å; E2523-R2541 IonicContact OE1-NH2 2.64Å; E2523-R2541 PolarHBondContact OE1-NH2 2.84Å
2524	I	81.5	Confident	79	Confident	3 Å²	3	39 Å²	39	2%	0.015	19%	0.193	C	C	.	.	H	α-helix	trans	-59.8	-44.1	164.9	-84.9	-171.9	0	0	0	110.6	F2520 F2528 W2550 V2577 L2580 R2581 F2584	F2520-I2524 HydrophobicContact CD2-CD1 4.22Å; F2520-I2524 HydrophobicContact CD2-CG1 4.41Å; F2520-I2524 HydrophobicContact CE1-CD1 4.08Å; F2520-I2524 HydrophobicContact CE2-CD1 3.39Å; F2520-I2524 HydrophobicContact CE2-CG1 3.98Å; F2520-I2524 HydrophobicContact CZ-CD1 3.31Å; F2520-I2524 HydrophobicContact CZ-CG1 4.32Å; F2520-I2524 WeakPolarHBondContact O-CB 3.31Å; F2520-I2524 PolarHBondContact O-N 3.08Å; I2524-F2528 WeakPolarHBondContact O-CB 3.44Å; I2524-F2528 PolarHBondContact O-N 3.35Å; I2524-W2550 HydrophobicContact CG2-CH2 4.32Å; I2524-V2577 HydrophobicContact CG2-CG1 4.37Å; I2524-L2580 HydrophobicContact CG2-CD2 4.38Å; I2524-R2581 HydrophobicContact CD1-CB 4.33Å; I2524-F2584 HydrophobicContact CD1-CB 4.14Å; I2524-F2584 HydrophobicContact CD1-CD2 3.55Å; I2524-F2584 HydrophobicContact CD1-CE2 4.14Å; I2524-F2584 HydrophobicContact CD1-CG 3.97Å; I2524-F2584 HydrophobicContact CG1-CD2 4.25Å; I2524-F2584 HydrophobicContact CG1-CE2 4.35Å
2525	L	87.1	Confident	79.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-67.8	-35.1	179.5	-73.8	167.1	0	0	0	112.3	E2521 C2522 E2523 S2529 L2544 W2550 R2553 V2554 T2557 V2577	E2521-L2525 WeakPolarHBondContact O-CB 3.3Å; E2521-L2525 WeakPolarHBondContact O-CD1 3.32Å; E2521-L2525 VanDerWaalsContact O-CG 3.23Å; E2521-L2525 WeakPolarHBondContact O-CG 3.44Å; E2521-L2525 PolarHBondContact O-N 2.92Å; E2521-L2525 VanDerWaalsContact O-N 3.15Å; C2522-L2525 CarbonylContact O-C 3.58Å; C2522-L2525 WeakPolarHBondContact O-CB 3.48Å; C2522-L2525 PolarHBondContact O-N 3.16Å; E2523-L2525 VanDerWaalsContact C-N 3.31Å; L2525-S2529 WeakPolarHBondContact O-CB 3.42Å; L2525-S2529 PolarHBondContact O-N 3.43Å; L2525-S2529 PolarHBondContact O-OG 3.44Å; L2525-L2544 HydrophobicContact CB-CD1 4Å; L2525-L2544 HydrophobicContact CD1-CD2 4.11Å; L2525-W2550 HydrophobicContact CD1-CE3 4.27Å; L2525-W2550 HydrophobicContact CD1-CH2 4.4Å; L2525-W2550 HydrophobicContact CD1-CZ3 3.74Å; L2525-W2550 HydrophobicContact CD2-CH2 4.3Å; L2525-W2550 HydrophobicContact CD2-CZ3 4.43Å; L2525-W2550 HydrophobicContact CG-CH2 4.17Å; L2525-W2550 HydrophobicContact CG-CZ3 3.92Å; L2525-R2553 HydrophobicContact CD1-CB 3.44Å; L2525-R2553 VanDerWaalsContact CD1-CB 3.44Å; L2525-V2554 HydrophobicContact CD2-CG2 4.18Å; L2525-T2557 HydrophobicContact CD2-CG2 3.91Å; L2525-V2577 HydrophobicContact CD2-CG1 3.48Å; L2525-V2577 VanDerWaalsContact CD2-CG1 3.48Å; L2525-V2577 HydrophobicContact CD2-CG2 4.31Å; L2525-V2577 HydrophobicContact CG-CG1 4.35Å
2526	L	84.7	Confident	79.7	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-70.8	-50.3	176.6	-73.5	157.8	0	0	0	111.6	C2522 E2523 F2528 S2529 Q2530 I2535 Y2537 L2540 R2541 L2544	C2522-L2526 WeakPolarHBondContact O-CB 3.32Å; C2522-L2526 WeakPolarHBondContact O-CD1 3.5Å; C2522-L2526 WeakPolarHBondContact O-CG 3.27Å; C2522-L2526 PolarHBondContact O-N 2.97Å; E2523-L2526 PolarHBondContact O-N 2.91Å; E2523-L2526 WeakPolarHBondContact OE2-CD1 3.39Å; L2526-F2528 VanDerWaalsContact C-N 3.31Å; L2526-F2528 PolarHBondContact O-N 3.07Å; L2526-S2529 PolarHBondContact O-N 2.85Å; L2526-Q2530 WeakPolarHBondContact O-CB 3.45Å; L2526-Q2530 WeakPolarHBondContact O-CG 3.4Å; L2526-Q2530 PolarHBondContact O-N 3.19Å; L2526-I2535 HydrophobicContact CD2-CD1 4.19Å; L2526-Y2537 HydrophobicContact CB-CD2 4.32Å; L2526-Y2537 HydrophobicContact CB-CE2 4.05Å; L2526-Y2537 HydrophobicContact CD1-CD2 4.46Å; L2526-Y2537 HydrophobicContact CD1-CE2 4Å; L2526-Y2537 HydrophobicContact CD2-CD2 4.12Å; L2526-Y2537 HydrophobicContact CD2-CE2 4.45Å; L2526-Y2537 HydrophobicContact CG-CE2 4.39Å; L2526-L2540 HydrophobicContact CD2-CB 4.16Å; L2526-L2540 HydrophobicContact CD2-CD2 4.25Å; L2526-L2540 HydrophobicContact CD2-CG 4.33Å; L2526-R2541 HydrophobicContact CD1-CB 3.6Å; L2526-R2541 HydrophobicContact CD1-CG 3.67Å; L2526-R2541 HydrophobicContact CD2-CB 4.18Å; L2526-L2544 HydrophobicContact CD2-CD1 4.18Å; L2526-L2544 HydrophobicContact CG-CD1 4.02Å
2527	A	76.1	Confident	80.1	Confident	27 Å²	27	40 Å²	40	22%	0.223	20%	0.199	C	C	.	.	H	α-helix	trans	-60.2	-41.4	177	0	0	0	0	0	111.8	E2523	E2523-A2527 WeakPolarHBondContact O-CB 3.46Å; E2523-A2527 PolarHBondContact O-N 3.47Å
2528	F	82.4	Confident	79.8	Confident	1 Å²	1	48 Å²	48	0%	0.004	23%	0.227	C	C	.	.	H	α-helix	trans	-63.3	-42	172.1	-173.9	-80	0	0	0	111.8	F2372 L2377 I2524 L2526 F2532 T2557 L2561 F2567 I2573 V2577 L2580	F2372-F2528 HydrophobicContact CE2-CE2 4.27Å; F2372-F2528 AromaticContact CZ-CD2 3.99Å; F2372-F2528 HydrophobicContact CZ-CD2 3.99Å; F2372-F2528 AromaticContact CZ-CE2 3.88Å; F2372-F2528 HydrophobicContact CZ-CE2 3.88Å; L2377-F2528 HydrophobicContact CD2-CE2 3.54Å; L2377-F2528 HydrophobicContact CD2-CZ 3.35Å; I2524-F2528 WeakPolarHBondContact O-CB 3.44Å; I2524-F2528 PolarHBondContact O-N 3.35Å; L2526-F2528 VanDerWaalsContact C-N 3.31Å; L2526-F2528 PolarHBondContact O-N 3.07Å; F2528-F2532 WeakPolarHBondContact O-CD2 3.49Å; F2528-T2557 HydrophobicContact CD1-CG2 4.44Å; F2528-L2561 HydrophobicContact CD1-CD1 3.78Å; F2528-L2561 HydrophobicContact CE1-CD1 3.65Å; F2528-F2567 AromaticContact CE1-CZ 3.97Å; F2528-F2567 HydrophobicContact CE1-CZ 3.97Å; F2528-F2567 HydrophobicContact CZ-CE1 4.46Å; F2528-F2567 HydrophobicContact CZ-CZ 4.22Å; F2528-I2573 HydrophobicContact CE1-CG2 4.14Å; F2528-I2573 HydrophobicContact CZ-CG2 4.48Å; F2528-V2577 HydrophobicContact CD1-CG2 3.69Å; F2528-V2577 HydrophobicContact CD2-CG2 3.87Å; F2528-V2577 HydrophobicContact CE1-CG2 3.49Å; F2528-V2577 VanDerWaalsContact CE1-CG2 3.49Å; F2528-V2577 HydrophobicContact CE2-CB 4.49Å; F2528-V2577 HydrophobicContact CE2-CG2 3.67Å; F2528-V2577 HydrophobicContact CG-CG2 3.88Å; F2528-V2577 HydrophobicContact CZ-CG2 3.46Å; F2528-V2577 VanDerWaalsContact CZ-CG2 3.46Å; F2528-L2580 HydrophobicContact CD2-CD2 4.12Å
2529	S	84.9	Confident	79.6	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-72	-42.1	-177.4	-59.7	0	0	0	0	113	L2525 L2526 R2531 F2532 A2533 T2557	L2525-S2529 WeakPolarHBondContact O-CB 3.42Å; L2525-S2529 PolarHBondContact O-N 3.43Å; L2525-S2529 PolarHBondContact O-OG 3.44Å; L2526-S2529 PolarHBondContact O-N 2.85Å; S2529-R2531 PolarHBondContact O-N 3.42Å; S2529-R2531 VanDerWaalsContact O-N 3.15Å; S2529-F2532 PolarHBondContact O-N 2.9Å; S2529-A2533 PolarHBondContact O-N 3.17Å; S2529-T2557 WeakPolarHBondContact OG-CG2 2.98Å
2530	Q	78.9	Confident	79.9	Confident	91 Å²	91	44.7 Å²	44.7	43%	0.425	21%	0.213	S	C	.	.	H	α-helix	trans	-59	-25	177.8	-75.6	-175.1	-71.1	0	0	112.5	L2526 F2532 I2535	L2526-Q2530 WeakPolarHBondContact O-CB 3.45Å; L2526-Q2530 WeakPolarHBondContact O-CG 3.4Å; L2526-Q2530 PolarHBondContact O-N 3.19Å; Q2530-F2532 VanDerWaalsContact C-N 3.28Å; Q2530-F2532 PolarHBondContact O-N 3Å; Q2530-I2535 HydrophobicContact CG-CD1 3.82Å; Q2530-I2535 HydrophobicContact CG-CG1 3.79Å
2531	R	78.2	Confident	80.1	Confident	109 Å²	109	48.5 Å²	48.5	41%	0.411	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-19.1	178.5	-165	50.2	165.2	121.5	-14	114.1	L2370 S2529	L2370-R2531 WeakPolarHBondContact O-CD 3.41Å; L2370-R2531 WeakPolarHBondContact O-CG 3.41Å; L2370-R2531 PolarHBondContact O-NE 3.24Å; S2529-R2531 PolarHBondContact O-N 3.42Å; S2529-R2531 VanDerWaalsContact O-N 3.15Å
2532	F	79.1	Confident	79.9	Confident	28 Å²	28	53.1 Å²	53.1	12%	0.123	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.4	-6.5	-174.4	-62.8	-69.9	0	0	0	114.8	F2372 A2374 L2377 F2528 S2529 Q2530 L2561 S2566 F2567	F2372-F2532 HydrophobicContact CD2-CE2 4.1Å; F2372-F2532 AromaticContact CD2-CZ 3.53Å; F2372-F2532 HydrophobicContact CD2-CZ 3.53Å; F2372-F2532 AromaticContact CE2-CE2 3.36Å; F2372-F2532 HydrophobicContact CE2-CE2 3.36Å; F2372-F2532 AromaticContact CE2-CZ 3.28Å; F2372-F2532 HydrophobicContact CE2-CZ 3.28Å; F2372-F2532 HydrophobicContact CG-CZ 4.46Å; F2372-F2532 AromaticContact CZ-CE2 3.85Å; F2372-F2532 HydrophobicContact CZ-CE2 3.85Å; F2372-F2532 HydrophobicContact CZ-CZ 4.12Å; A2374-F2532 HydrophobicContact CB-CD1 3.95Å; A2374-F2532 HydrophobicContact CB-CE1 3.75Å; L2377-F2532 HydrophobicContact CD1-CZ 4.46Å; F2528-F2532 WeakPolarHBondContact O-CD2 3.49Å; S2529-F2532 PolarHBondContact O-N 2.9Å; Q2530-F2532 VanDerWaalsContact C-N 3.28Å; Q2530-F2532 PolarHBondContact O-N 3Å; F2532-L2561 HydrophobicContact CB-CD2 3.81Å; F2532-S2566 PolarHBondContact O-OG 2.78Å; F2532-F2567 HydrophobicContact CB-CE2 3.67Å; F2532-F2567 HydrophobicContact CB-CZ 4.22Å; F2532-F2567 HydrophobicContact CD1-CE2 4.12Å; F2532-F2567 HydrophobicContact CD1-CZ 4.08Å; F2532-F2567 AromaticContact CD2-CE2 3.83Å; F2532-F2567 HydrophobicContact CD2-CE2 3.83Å; F2532-F2567 AromaticContact CD2-CZ 3.47Å; F2532-F2567 HydrophobicContact CD2-CZ 3.47Å; F2532-F2567 VanDerWaalsContact CD2-CZ 3.47Å; F2532-F2567 HydrophobicContact CE1-CZ 4.42Å; F2532-F2567 AromaticContact CE2-CZ 3.87Å; F2532-F2567 HydrophobicContact CE2-CZ 3.87Å; F2532-F2567 AromaticContact CG-CE2 3.56Å; F2532-F2567 HydrophobicContact CG-CE2 3.56Å; F2532-F2567 AromaticContact CG-CZ 3.61Å; F2532-F2567 HydrophobicContact CG-CZ 3.61Å; F2532-F2567 HydrophobicContact CZ-CZ 4.34Å
2533	A	76	Confident	79.8	Confident	17 Å²	17	57.6 Å²	57.6	14%	0.14	27%	0.273	C	S	.	.	S	Bend	trans	-152.9	136.8	177.3	0	0	0	0	0	110.8	S2529 I2535 L2561 A2564	S2529-A2533 PolarHBondContact O-N 3.17Å; A2533-I2535 HydrophobicContact CB-CG2 3.99Å; A2533-I2535 PolarHBondContact O-N 2.73Å; A2533-L2561 HydrophobicContact CB-CD2 3.93Å; A2533-A2564 HydrophobicContact CB-CB 3.66Å
2534	E	69.6	Low	80.1	Confident	207 Å²	207	57.5 Å²	57.5	97%	0.967	27%	0.272	S	S	*	.			trans	-63.7	116.6	159.1	-74.3	-166.8	124	0	0	108.5
2535	I	76	Confident	80.2	Confident	36 Å²	36	59.9 Å²	59.9	19%	0.185	29%	0.292	C	S	.	.			trans	-128.9	140.8	179.8	49.7	163.7	0	0	0	110	L2526 Q2530 A2533 Y2537 L2540 T2560	L2526-I2535 HydrophobicContact CD2-CD1 4.19Å; Q2530-I2535 HydrophobicContact CG-CD1 3.82Å; Q2530-I2535 HydrophobicContact CG-CG1 3.79Å; A2533-I2535 HydrophobicContact CB-CG2 3.99Å; A2533-I2535 PolarHBondContact O-N 2.73Å; I2535-Y2537 PolarHBondContact O-N 2.76Å; I2535-L2540 HydrophobicContact CB-CD2 4.47Å; I2535-L2540 HydrophobicContact CD1-CB 4.47Å; I2535-L2540 HydrophobicContact CD1-CD2 3.45Å; I2535-L2540 VanDerWaalsContact CD1-CD2 3.45Å; I2535-L2540 HydrophobicContact CG2-CD2 4.35Å; I2535-T2560 HydrophobicContact CG2-CG2 4.07Å
2536	D	78.1	Confident	80.1	Confident	108 Å²	108	64.4 Å²	64.4	58%	0.578	32%	0.324	S	S	*	.			trans	-64.3	103	163.4	178.6	-21.8	0	0	0	107.7	R2538 A2539 L2540	D2536-R2538 VanDerWaalsContact C-N 3.25Å; D2536-R2538 PolarHBondContact O-N 2.88Å; D2536-R2538 PolarHBondContact OD1-N 2.83Å; D2536-A2539 HydrophobicContact CB-CB 3.84Å; D2536-A2539 VanDerWaalsContact CG-CB 3.47Å; D2536-A2539 PolarHBondContact O-N 3.35Å; D2536-A2539 PolarHBondContact OD1-N 2.79Å; D2536-L2540 PolarHBondContact O-N 2.96Å
2537	Y	80.2	Confident	80.1	Confident	51 Å²	51	66.8 Å²	66.8	20%	0.2	34%	0.337	C	S	.	.	H	α-helix	trans	-58	-36.3	-176.8	175.5	-89.6	0	0	0	111.9	M2365 E2523 L2526 I2535 R2541	M2365-Y2537 HydrophobicContact CE-CD2 4.47Å; M2365-Y2537 HydrophobicContact CE-CE1 4.18Å; M2365-Y2537 HydrophobicContact CE-CE2 3.68Å; M2365-Y2537 VanDerWaalsContact CE-CZ 3.49Å; M2365-Y2537 WeakPolarHBondContact CE-OH 3.1Å; E2523-Y2537 PolarHBondContact OE1-OH 3.33Å; E2523-Y2537 PolarHBondContact OE2-OH 2.92Å; L2526-Y2537 HydrophobicContact CB-CD2 4.32Å; L2526-Y2537 HydrophobicContact CB-CE2 4.05Å; L2526-Y2537 HydrophobicContact CD1-CD2 4.46Å; L2526-Y2537 HydrophobicContact CD1-CE2 4Å; L2526-Y2537 HydrophobicContact CD2-CD2 4.12Å; L2526-Y2537 HydrophobicContact CD2-CE2 4.45Å; L2526-Y2537 HydrophobicContact CG-CE2 4.39Å; I2535-Y2537 PolarHBondContact O-N 2.76Å; Y2537-R2541 WeakPolarHBondContact O-CB 3.47Å; Y2537-R2541 PolarHBondContact O-N 3.01Å; Y2537-R2541 VanDerWaalsContact O-N 3.12Å
2538	R	71.1	Confident	80.4	Confident	194 Å²	194	70.5 Å²	70.5	73%	0.732	36%	0.361	S	S	*	.	H	α-helix	trans	-70.9	-51.3	175.2	-84.3	-173.3	176.1	173.6	0.5	110.8	D2536 L2540 R2541 D2542	D2536-R2538 VanDerWaalsContact C-N 3.25Å; D2536-R2538 PolarHBondContact O-N 2.88Å; D2536-R2538 PolarHBondContact OD1-N 2.83Å; R2538-L2540 VanDerWaalsContact C-N 3.34Å; R2538-L2540 PolarHBondContact O-N 2.95Å; R2538-R2541 PolarHBondContact O-N 2.93Å; R2538-D2542 PolarHBondContact O-N 3.16Å
2539	A	78.5	Confident	80.5	Confident	40 Å²	40	72.4 Å²	72.4	33%	0.331	38%	0.375	S	S	.	.	H	α-helix	trans	-62	-39.6	-175.3	0	0	0	0	0	112.8	D2536 Q2543	D2536-A2539 HydrophobicContact CB-CB 3.84Å; D2536-A2539 VanDerWaalsContact CG-CB 3.47Å; D2536-A2539 PolarHBondContact O-N 3.35Å; D2536-A2539 PolarHBondContact OD1-N 2.79Å; A2539-Q2543 VanDerWaalsContact O-CG 3.31Å; A2539-Q2543 WeakPolarHBondContact O-CG 3.38Å; A2539-Q2543 PolarHBondContact O-N 3.46Å
2540	L	82.7	Confident	80.7	Confident	11 Å²	11	73.4 Å²	73.4	6%	0.058	38%	0.378	C	S	.	.	H	α-helix	trans	-75	-35.7	176	-168.6	67.3	0	0	0	112.1	L2526 I2535 D2536 R2538 Q2543 L2544 L2556	L2526-L2540 HydrophobicContact CD2-CB 4.16Å; L2526-L2540 HydrophobicContact CD2-CD2 4.25Å; L2526-L2540 HydrophobicContact CD2-CG 4.33Å; I2535-L2540 HydrophobicContact CB-CD2 4.47Å; I2535-L2540 HydrophobicContact CD1-CB 4.47Å; I2535-L2540 HydrophobicContact CD1-CD2 3.45Å; I2535-L2540 VanDerWaalsContact CD1-CD2 3.45Å; I2535-L2540 HydrophobicContact CG2-CD2 4.35Å; D2536-L2540 PolarHBondContact O-N 2.96Å; R2538-L2540 VanDerWaalsContact C-N 3.34Å; R2538-L2540 PolarHBondContact O-N 2.95Å; L2540-Q2543 PolarHBondContact O-N 3.17Å; L2540-L2544 HydrophobicContact CD2-CD1 4.25Å; L2540-L2544 HydrophobicContact CG-CD1 3.91Å; L2540-L2544 HydrophobicContact CG-CG 4.21Å; L2540-L2544 WeakPolarHBondContact O-CB 3.4Å; L2540-L2544 VanDerWaalsContact O-CG 3.31Å; L2540-L2544 WeakPolarHBondContact O-CG 3.16Å; L2540-L2544 PolarHBondContact O-N 2.88Å; L2540-L2556 HydrophobicContact CD1-CD2 4.11Å; L2540-L2556 HydrophobicContact CD1-CG 4.33Å
2541	R	84.6	Confident	81.2	Confident	80 Å²	80	73.9 Å²	73.9	30%	0.302	38%	0.384	S	S	.	.	H	α-helix	trans	-62.1	-45.3	176.6	-177.7	172.3	-161.6	-95	3.3	112	E2523 L2526 Y2537 R2538 Q2543 L2544 A2545	E2523-R2541 IonicContact OE1-CZ 2.66Å; E2523-R2541 IonicContact OE1-NE 3.97Å; E2523-R2541 PolarHBondContact OE1-NE 2.9Å; E2523-R2541 IonicContact OE1-NH2 2.64Å; E2523-R2541 PolarHBondContact OE1-NH2 2.84Å; L2526-R2541 HydrophobicContact CD1-CB 3.6Å; L2526-R2541 HydrophobicContact CD1-CG 3.67Å; L2526-R2541 HydrophobicContact CD2-CB 4.18Å; Y2537-R2541 WeakPolarHBondContact O-CB 3.47Å; Y2537-R2541 PolarHBondContact O-N 3.01Å; Y2537-R2541 VanDerWaalsContact O-N 3.12Å; R2538-R2541 PolarHBondContact O-N 2.93Å; R2541-Q2543 VanDerWaalsContact C-N 3.33Å; R2541-Q2543 PolarHBondContact O-N 3.25Å; R2541-L2544 PolarHBondContact O-N 2.79Å; R2541-A2545 VanDerWaalsContact O-CB 3.26Å; R2541-A2545 WeakPolarHBondContact O-CB 3.34Å; R2541-A2545 PolarHBondContact O-N 3.11Å
2542	D	80.7	Confident	81.6	Confident	106 Å²	106	71.7 Å²	71.7	57%	0.567	38%	0.38	S	S	*	.	H	α-helix	trans	-65.4	-37.8	177.1	-67.6	-16.8	0	0	0	111.1	R2538 S2546	R2538-D2542 PolarHBondContact O-N 3.16Å; D2542-S2546 WeakPolarHBondContact O-CB 3.39Å; D2542-S2546 PolarHBondContact O-N 2.95Å
2543	Q	83.8	Confident	82.2	Confident	98 Å²	98	71 Å²	71	46%	0.458	38%	0.377	S	S	.	.	H	α-helix	trans	-64.7	-49	172.6	-73.6	179.2	26.3	0	0	112.4	A2539 L2540 R2541 A2545 S2546 L2547 L2556	A2539-Q2543 VanDerWaalsContact O-CG 3.31Å; A2539-Q2543 WeakPolarHBondContact O-CG 3.38Å; A2539-Q2543 PolarHBondContact O-N 3.46Å; L2540-Q2543 PolarHBondContact O-N 3.17Å; R2541-Q2543 VanDerWaalsContact C-N 3.33Å; R2541-Q2543 PolarHBondContact O-N 3.25Å; Q2543-A2545 VanDerWaalsContact C-N 3.33Å; Q2543-A2545 PolarHBondContact O-N 2.96Å; Q2543-S2546 PolarHBondContact O-N 3.45Å; Q2543-S2546 VanDerWaalsContact O-N 3.14Å; Q2543-S2546 PolarHBondContact O-OG 2.78Å; Q2543-L2547 PolarHBondContact O-N 3.28Å; Q2543-L2556 HydrophobicContact CB-CD2 3.75Å
2544	L	88.1	Confident	82.9	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-62.7	-39.5	179.1	-71.6	168	0	0	0	111.8	C2522 L2525 L2526 L2540 R2541 S2546 L2547 R2553 L2556	C2522-L2544 HydrophobicContact CB-CB 4.29Å; L2525-L2544 HydrophobicContact CB-CD1 4Å; L2525-L2544 HydrophobicContact CD1-CD2 4.11Å; L2526-L2544 HydrophobicContact CD2-CD1 4.18Å; L2526-L2544 HydrophobicContact CG-CD1 4.02Å; L2540-L2544 HydrophobicContact CD2-CD1 4.25Å; L2540-L2544 HydrophobicContact CG-CD1 3.91Å; L2540-L2544 HydrophobicContact CG-CG 4.21Å; L2540-L2544 WeakPolarHBondContact O-CB 3.4Å; L2540-L2544 VanDerWaalsContact O-CG 3.31Å; L2540-L2544 WeakPolarHBondContact O-CG 3.16Å; L2540-L2544 PolarHBondContact O-N 2.88Å; R2541-L2544 PolarHBondContact O-N 2.79Å; L2544-S2546 VanDerWaalsContact C-N 3.31Å; L2544-S2546 PolarHBondContact O-N 2.74Å; L2544-L2547 PolarHBondContact O-N 3.35Å; L2544-R2553 HydrophobicContact CD2-CB 3.95Å; L2544-R2553 HydrophobicContact CD2-CG 4.42Å; L2544-R2553 WeakPolarHBondContact O-CG 3.41Å; L2544-R2553 PolarHBondContact O-NE 2.85Å; L2544-L2556 HydrophobicContact CD2-CB 4.31Å; L2544-L2556 HydrophobicContact CD2-CD2 4.01Å; L2544-L2556 HydrophobicContact CD2-CG 4.41Å; L2544-L2556 HydrophobicContact CG-CD2 4.28Å
2545	A	82.7	Confident	83.7	Confident	53 Å²	53	64.6 Å²	64.6	44%	0.438	35%	0.347	S	S	.	.	H	α-helix	trans	-66.6	-30.6	174.9	0	0	0	0	0	112.9	R2541 Q2543 L2547	R2541-A2545 VanDerWaalsContact O-CB 3.26Å; R2541-A2545 WeakPolarHBondContact O-CB 3.34Å; R2541-A2545 PolarHBondContact O-N 3.11Å; Q2543-A2545 VanDerWaalsContact C-N 3.33Å; Q2543-A2545 PolarHBondContact O-N 2.96Å; A2545-L2547 VanDerWaalsContact C-N 3.3Å; A2545-L2547 PolarHBondContact O-N 3.28Å
2546	S	85.1	Confident	84.4	Confident	95 Å²	95	64.5 Å²	64.5	66%	0.664	35%	0.346	S	S	*	.	H	α-helix	trans	-74.5	-15.8	177.2	77.7	0	0	0	0	114.5	D2542 Q2543 L2544	D2542-S2546 WeakPolarHBondContact O-CB 3.39Å; D2542-S2546 PolarHBondContact O-N 2.95Å; Q2543-S2546 PolarHBondContact O-N 3.45Å; Q2543-S2546 VanDerWaalsContact O-N 3.14Å; Q2543-S2546 PolarHBondContact O-OG 2.78Å; L2544-S2546 VanDerWaalsContact C-N 3.31Å; L2544-S2546 PolarHBondContact O-N 2.74Å
2547	L	86.4	Confident	84.8	Confident	51 Å²	51	59.3 Å²	59.3	27%	0.267	32%	0.319	S	S	.	.	S	Bend	trans	-82.7	148.5	179.6	-68.7	174.1	0	0	0	111.9	Q2543 L2544 A2545 D2552 R2553 L2556	Q2543-L2547 PolarHBondContact O-N 3.28Å; L2544-L2547 PolarHBondContact O-N 3.35Å; A2545-L2547 VanDerWaalsContact C-N 3.3Å; A2545-L2547 PolarHBondContact O-N 3.28Å; L2547-D2552 HydrophobicContact CB-CB 3.91Å; L2547-D2552 HydrophobicContact CD1-CB 4.26Å; L2547-D2552 HydrophobicContact CD2-CB 4.24Å; L2547-D2552 HydrophobicContact CG-CB 4.36Å; L2547-R2553 HydrophobicContact CB-CG 3.81Å; L2547-R2553 HydrophobicContact CD1-CG 4.39Å; L2547-R2553 PolarHBondContact O-NE 3.04Å; L2547-R2553 PolarHBondContact O-NH2 3.46Å; L2547-L2556 HydrophobicContact CD1-CB 3.67Å; L2547-L2556 HydrophobicContact CD1-CD2 3.7Å; L2547-L2556 HydrophobicContact CD1-CG 4.3Å
2548	S	81.5	Confident	85.2	Confident	105 Å²	105	58.2 Å²	58.2	73%	0.734	32%	0.315	S	S	*	.	S	Bend	trans	-83	-40.6	-166.3	79.3	0	0	0	0	114.4	D2552 R2553	S2548-D2552 PolarHBondContact N-OD2 3.4Å; S2548-D2552 PolarHBondContact OG-OD2 3.33Å; S2548-R2553 PolarHBondContact O-NH2 3.13Å
2549	S	84.7	Confident	85.8	Confident	41 Å²	41	55.3 Å²	55.3	29%	0.287	31%	0.308	S	S	.	.	S	Bend	trans	-122.7	160.8	-171.8	70.3	0	0	0	0	112.7	D2551 D2552 R2553	S2549-D2551 VanDerWaalsContact C-N 3.26Å; S2549-D2551 PolarHBondContact O-N 3.12Å; S2549-D2552 WeakPolarHBondContact CB-OD2 3.33Å; S2549-D2552 PolarHBondContact N-OD2 3.02Å; S2549-D2552 WeakPolarHBondContact O-CB 3.35Å; S2549-D2552 PolarHBondContact O-N 3.32Å; S2549-D2552 PolarHBondContact OG-N 3.39Å; S2549-D2552 VanDerWaalsContact OG-N 3.11Å; S2549-D2552 PolarHBondContact OG-OD2 3.05Å; S2549-R2553 VanDerWaalsContact O-CG 3.3Å; S2549-R2553 WeakPolarHBondContact O-CG 3.41Å; S2549-R2553 PolarHBondContact O-N 3.41Å; S2549-R2553 VanDerWaalsContact O-N 3.12Å
2550	W	89.4	Confident	86.1	Confident	21 Å²	21	54.8 Å²	54.8	8%	0.08	30%	0.301	C	S	.	.	H	α-helix	trans	-53.3	-44.5	170.5	175.2	-111.6	0	0	0	111.8	E2521 I2524 L2525 D2552 R2553 V2554 V2577 N2578 R2581	E2521-W2550 HydrophobicContact CB-CE3 3.69Å; E2521-W2550 HydrophobicContact CB-CZ3 3.7Å; E2521-W2550 VanDerWaalsContact CD-CE3 3.44Å; E2521-W2550 HydrophobicContact CG-CE3 3.53Å; E2521-W2550 HydrophobicContact CG-CZ3 3.77Å; I2524-W2550 HydrophobicContact CG2-CH2 4.32Å; L2525-W2550 HydrophobicContact CD1-CE3 4.27Å; L2525-W2550 HydrophobicContact CD1-CH2 4.4Å; L2525-W2550 HydrophobicContact CD1-CZ3 3.74Å; L2525-W2550 HydrophobicContact CD2-CH2 4.3Å; L2525-W2550 HydrophobicContact CD2-CZ3 4.43Å; L2525-W2550 HydrophobicContact CG-CH2 4.17Å; L2525-W2550 HydrophobicContact CG-CZ3 3.92Å; W2550-D2552 PolarHBondContact O-N 3.31Å; W2550-R2553 PolarHBondContact O-N 3.28Å; W2550-V2554 HydrophobicContact CD2-CG2 3.79Å; W2550-V2554 VanDerWaalsContact CE2-CG2 3.42Å; W2550-V2554 HydrophobicContact CE3-CG2 4.21Å; W2550-V2554 HydrophobicContact CG-CG2 4.3Å; W2550-V2554 HydrophobicContact CH2-CG2 4.08Å; W2550-V2554 HydrophobicContact CZ2-CG2 3.6Å; W2550-V2554 HydrophobicContact CZ3-CG2 4.35Å; W2550-V2554 WeakPolarHBondContact O-CB 3.44Å; W2550-V2554 VanDerWaalsContact O-CG2 3.31Å; W2550-V2554 WeakPolarHBondContact O-CG2 3.19Å; W2550-V2554 PolarHBondContact O-N 2.9Å; W2550-V2577 HydrophobicContact CH2-CG1 3.43Å; W2550-V2577 VanDerWaalsContact CH2-CG1 3.43Å; W2550-V2577 HydrophobicContact CZ2-CG1 3.55Å; W2550-N2578 PolarHBondContact NE1-OD1 2.9Å; W2550-R2581 HydrophobicContact CH2-CB 4.15Å; W2550-R2581 HydrophobicContact CH2-CG 4.37Å; W2550-R2581 HydrophobicContact CZ2-CB 4.07Å; W2550-R2581 HydrophobicContact CZ2-CG 4.32Å
2551	D	87.9	Confident	86.2	Confident	101 Å²	101	54.3 Å²	54.3	54%	0.54	30%	0.298	S	S	.	.	H	α-helix	trans	-67.2	-35.9	-178.8	-58.7	-39.1	0	0	0	112	S2549 N2555	S2549-D2551 VanDerWaalsContact C-N 3.26Å; S2549-D2551 PolarHBondContact O-N 3.12Å; D2551-N2555 VanDerWaalsContact O-CB 3.28Å; D2551-N2555 WeakPolarHBondContact O-CB 3.47Å; D2551-N2555 VanDerWaalsContact O-CG 3.27Å; D2551-N2555 PolarHBondContact O-N 3.18Å; D2551-N2555 PolarHBondContact O-ND2 3.42Å
2552	D	88	Confident	86.2	Confident	63 Å²	63	54.4 Å²	54.4	34%	0.337	30%	0.303	S	S	.	.	H	α-helix	trans	-60	-48.5	171.5	-62.7	-47.2	0	0	0	110.8	L2547 S2548 S2549 W2550 N2555 L2556	L2547-D2552 HydrophobicContact CB-CB 3.91Å; L2547-D2552 HydrophobicContact CD1-CB 4.26Å; L2547-D2552 HydrophobicContact CD2-CB 4.24Å; L2547-D2552 HydrophobicContact CG-CB 4.36Å; S2548-D2552 PolarHBondContact N-OD2 3.4Å; S2548-D2552 PolarHBondContact OG-OD2 3.33Å; S2549-D2552 WeakPolarHBondContact CB-OD2 3.33Å; S2549-D2552 PolarHBondContact N-OD2 3.02Å; S2549-D2552 WeakPolarHBondContact O-CB 3.35Å; S2549-D2552 PolarHBondContact O-N 3.32Å; S2549-D2552 PolarHBondContact OG-N 3.39Å; S2549-D2552 VanDerWaalsContact OG-N 3.11Å; S2549-D2552 PolarHBondContact OG-OD2 3.05Å; W2550-D2552 PolarHBondContact O-N 3.31Å; D2552-N2555 PolarHBondContact O-N 2.9Å; D2552-L2556 PolarHBondContact O-N 3.16Å
2553	R	91.6	Very high	86.2	Confident	14 Å²	14	56.6 Å²	56.6	5%	0.053	31%	0.309	C	S	.	.	H	α-helix	trans	-65.1	-45.6	-176.9	-64.8	170	-169.1	129.1	11.2	111.5	E2521 L2525 L2544 L2547 S2548 S2549 W2550 N2555 L2556 T2557	E2521-R2553 IonicContact OE2-CZ 2.73Å; E2521-R2553 IonicContact OE2-NH1 3.26Å; E2521-R2553 PolarHBondContact OE2-NH1 3.5Å; L2525-R2553 HydrophobicContact CD1-CB 3.44Å; L2525-R2553 VanDerWaalsContact CD1-CB 3.44Å; L2544-R2553 HydrophobicContact CD2-CB 3.95Å; L2544-R2553 HydrophobicContact CD2-CG 4.42Å; L2544-R2553 WeakPolarHBondContact O-CG 3.41Å; L2544-R2553 PolarHBondContact O-NE 2.85Å; L2547-R2553 HydrophobicContact CB-CG 3.81Å; L2547-R2553 HydrophobicContact CD1-CG 4.39Å; L2547-R2553 PolarHBondContact O-NE 3.04Å; L2547-R2553 PolarHBondContact O-NH2 3.46Å; S2548-R2553 PolarHBondContact O-NH2 3.13Å; S2549-R2553 VanDerWaalsContact O-CG 3.3Å; S2549-R2553 WeakPolarHBondContact O-CG 3.41Å; S2549-R2553 PolarHBondContact O-N 3.41Å; S2549-R2553 VanDerWaalsContact O-N 3.12Å; W2550-R2553 PolarHBondContact O-N 3.28Å; R2553-N2555 VanDerWaalsContact C-N 3.32Å; R2553-N2555 PolarHBondContact O-N 3.12Å; R2553-L2556 PolarHBondContact O-N 3.42Å; R2553-T2557 PolarHBondContact O-N 3.43Å
2554	V	89.5	Confident	85.9	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	31%	0.309	C	S	.	.	H	α-helix	trans	-61	-39.6	173.1	173	0	0	0	0	111.1	L2525 W2550 T2557 K2558 D2574 V2577	L2525-V2554 HydrophobicContact CD2-CG2 4.18Å; W2550-V2554 HydrophobicContact CD2-CG2 3.79Å; W2550-V2554 VanDerWaalsContact CE2-CG2 3.42Å; W2550-V2554 HydrophobicContact CE3-CG2 4.21Å; W2550-V2554 HydrophobicContact CG-CG2 4.3Å; W2550-V2554 HydrophobicContact CH2-CG2 4.08Å; W2550-V2554 HydrophobicContact CZ2-CG2 3.6Å; W2550-V2554 HydrophobicContact CZ3-CG2 4.35Å; W2550-V2554 WeakPolarHBondContact O-CB 3.44Å; W2550-V2554 VanDerWaalsContact O-CG2 3.31Å; W2550-V2554 WeakPolarHBondContact O-CG2 3.19Å; W2550-V2554 PolarHBondContact O-N 2.9Å; V2554-T2557 PolarHBondContact O-N 2.65Å; V2554-K2558 HydrophobicContact CG1-CD 4.36Å; V2554-K2558 HydrophobicContact CG1-CG 4.42Å; V2554-K2558 WeakPolarHBondContact O-CB 3.41Å; V2554-K2558 WeakPolarHBondContact O-CG 3.08Å; V2554-K2558 PolarHBondContact O-N 3.41Å; V2554-D2574 WeakPolarHBondContact CG1-OD1 3.43Å; V2554-V2577 HydrophobicContact CG2-CG1 4.27Å
2555	N	88.3	Confident	85.3	Confident	88 Å²	88	57.1 Å²	57.1	47%	0.471	34%	0.337	S	S	.	.	H	α-helix	trans	-69.1	-32.6	176.3	-77.7	-52.4	0	0	0	113.2	D2551 D2552 R2553 K2559	D2551-N2555 VanDerWaalsContact O-CB 3.28Å; D2551-N2555 WeakPolarHBondContact O-CB 3.47Å; D2551-N2555 VanDerWaalsContact O-CG 3.27Å; D2551-N2555 PolarHBondContact O-N 3.18Å; D2551-N2555 PolarHBondContact O-ND2 3.42Å; D2552-N2555 PolarHBondContact O-N 2.9Å; R2553-N2555 VanDerWaalsContact C-N 3.32Å; R2553-N2555 PolarHBondContact O-N 3.12Å; N2555-K2559 WeakPolarHBondContact O-CB 3.26Å; N2555-K2559 PolarHBondContact O-N 2.98Å; N2555-K2559 VanDerWaalsContact O-N 3.07Å
2556	L	88.7	Confident	84.9	Confident	33 Å²	33	56.9 Å²	56.9	17%	0.173	33%	0.332	C	S	.	.	H	α-helix	trans	-65.4	-50.8	169.4	179.8	61.1	0	0	0	110.9	L2540 Q2543 L2544 L2547 D2552 R2553 K2558 K2559 T2560	L2540-L2556 HydrophobicContact CD1-CD2 4.11Å; L2540-L2556 HydrophobicContact CD1-CG 4.33Å; Q2543-L2556 HydrophobicContact CB-CD2 3.75Å; L2544-L2556 HydrophobicContact CD2-CB 4.31Å; L2544-L2556 HydrophobicContact CD2-CD2 4.01Å; L2544-L2556 HydrophobicContact CD2-CG 4.41Å; L2544-L2556 HydrophobicContact CG-CD2 4.28Å; L2547-L2556 HydrophobicContact CD1-CB 3.67Å; L2547-L2556 HydrophobicContact CD1-CD2 3.7Å; L2547-L2556 HydrophobicContact CD1-CG 4.3Å; D2552-L2556 PolarHBondContact O-N 3.16Å; R2553-L2556 PolarHBondContact O-N 3.42Å; L2556-K2558 PolarHBondContact O-N 3.2Å; L2556-K2559 WeakPolarHBondContact O-CA 3.17Å; L2556-K2559 WeakPolarHBondContact O-CB 3.47Å; L2556-K2559 PolarHBondContact O-N 3.05Å; L2556-T2560 PolarHBondContact O-N 3Å; L2556-T2560 PolarHBondContact O-OG1 2.74Å
2557	T	88.4	Confident	84.5	Confident	0 Å²	0	53 Å²	53	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59	-44.4	177.6	-76.5	0	0	0	0	112.4	L2525 F2528 S2529 R2553 V2554 K2559 T2560 L2561	L2525-T2557 HydrophobicContact CD2-CG2 3.91Å; F2528-T2557 HydrophobicContact CD1-CG2 4.44Å; S2529-T2557 WeakPolarHBondContact OG-CG2 2.98Å; R2553-T2557 PolarHBondContact O-N 3.43Å; V2554-T2557 PolarHBondContact O-N 2.65Å; T2557-K2559 VanDerWaalsContact C-N 3.3Å; T2557-K2559 PolarHBondContact O-N 3.18Å; T2557-T2560 PolarHBondContact O-N 3.05Å; T2557-L2561 HydrophobicContact CG2-CD1 3.65Å; T2557-L2561 HydrophobicContact CG2-CG 4.29Å; T2557-L2561 WeakPolarHBondContact O-CB 3.39Å; T2557-L2561 WeakPolarHBondContact O-CG 3.37Å; T2557-L2561 PolarHBondContact O-N 3.11Å
2558	K	87.2	Confident	84	Confident	28 Å²	28	58.1 Å²	58.1	12%	0.122	32%	0.323	C	S	.	.	H	α-helix	trans	-52	-48.9	169.7	-80.7	174.4	-176.8	167.9	0	111.3	V2554 L2556 L2561 M2562 A2570 I2573 D2574	V2554-K2558 HydrophobicContact CG1-CD 4.36Å; V2554-K2558 HydrophobicContact CG1-CG 4.42Å; V2554-K2558 WeakPolarHBondContact O-CB 3.41Å; V2554-K2558 WeakPolarHBondContact O-CG 3.08Å; V2554-K2558 PolarHBondContact O-N 3.41Å; L2556-K2558 PolarHBondContact O-N 3.2Å; K2558-L2561 PolarHBondContact O-N 3.25Å; K2558-M2562 VanDerWaalsContact O-CB 3.24Å; K2558-M2562 WeakPolarHBondContact O-CB 3.37Å; K2558-M2562 WeakPolarHBondContact O-CG 3.3Å; K2558-M2562 PolarHBondContact O-N 3.27Å; K2558-A2570 HydrophobicContact CD-CB 4.49Å; K2558-A2570 WeakPolarHBondContact CE-O 3.29Å; K2558-I2573 HydrophobicContact CG-CB 4.07Å; K2558-I2573 HydrophobicContact CG-CD1 4.44Å; K2558-I2573 HydrophobicContact CG-CG2 3.66Å; K2558-D2574 WeakPolarHBondContact CE-OD1 3.3Å; K2558-D2574 WeakPolarHBondContact CE-OD2 3.46Å; K2558-D2574 IonicContact NZ-OD1 3.39Å; K2558-D2574 PolarHBondContact NZ-OD1 3.1Å; K2558-D2574 IonicContact NZ-OD2 3.98Å; K2558-D2574 PolarHBondContact NZ-OD2 3.48Å
2559	K	83.9	Confident	84.1	Confident	133 Å²	133	55.7 Å²	55.7	58%	0.578	30%	0.302	S	S	*	.	H	α-helix	trans	-64.7	-43	-177.1	-168.2	-178.9	-179.5	-173.2	0	111.9	N2555 L2556 T2557 Q2563	N2555-K2559 WeakPolarHBondContact O-CB 3.26Å; N2555-K2559 PolarHBondContact O-N 2.98Å; N2555-K2559 VanDerWaalsContact O-N 3.07Å; L2556-K2559 WeakPolarHBondContact O-CA 3.17Å; L2556-K2559 WeakPolarHBondContact O-CB 3.47Å; L2556-K2559 PolarHBondContact O-N 3.05Å; T2557-K2559 VanDerWaalsContact C-N 3.3Å; T2557-K2559 PolarHBondContact O-N 3.18Å; K2559-Q2563 WeakPolarHBondContact O-CB 3.21Å; K2559-Q2563 VanDerWaalsContact O-CG 3.26Å; K2559-Q2563 WeakPolarHBondContact O-CG 3.27Å; K2559-Q2563 PolarHBondContact O-N 3.27Å; K2559-Q2563 VanDerWaalsContact O-N 3.08Å
2560	T	85.2	Confident	84.1	Confident	29 Å²	29	55.9 Å²	55.9	18%	0.178	31%	0.305	C	S	.	.	H	α-helix	trans	-63	-46.4	175.7	-56.1	0	0	0	0	111.5	I2535 L2556 T2557 Q2563 A2564	I2535-T2560 HydrophobicContact CG2-CG2 4.07Å; L2556-T2560 PolarHBondContact O-N 3Å; L2556-T2560 PolarHBondContact O-OG1 2.74Å; T2557-T2560 PolarHBondContact O-N 3.05Å; T2560-Q2563 WeakPolarHBondContact O-CB 3.34Å; T2560-Q2563 PolarHBondContact O-N 3.46Å; T2560-A2564 PolarHBondContact O-N 2.83Å
2561	L	85.7	Confident	83.8	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-73.8	-35.9	-177.7	-68.1	178.8	0	0	0	113.5	F2528 F2532 A2533 T2557 K2558 Q2563 A2564 G2565 F2567 I2573	F2528-L2561 HydrophobicContact CD1-CD1 3.78Å; F2528-L2561 HydrophobicContact CE1-CD1 3.65Å; F2532-L2561 HydrophobicContact CB-CD2 3.81Å; A2533-L2561 HydrophobicContact CB-CD2 3.93Å; T2557-L2561 HydrophobicContact CG2-CD1 3.65Å; T2557-L2561 HydrophobicContact CG2-CG 4.29Å; T2557-L2561 WeakPolarHBondContact O-CB 3.39Å; T2557-L2561 WeakPolarHBondContact O-CG 3.37Å; T2557-L2561 PolarHBondContact O-N 3.11Å; K2558-L2561 PolarHBondContact O-N 3.25Å; L2561-Q2563 PolarHBondContact O-N 2.78Å; L2561-A2564 PolarHBondContact O-N 3.34Å; L2561-G2565 PolarHBondContact O-N 3.26Å; L2561-G2565 VanDerWaalsContact O-N 3.09Å; L2561-F2567 HydrophobicContact CB-CD2 3.95Å; L2561-F2567 HydrophobicContact CB-CE2 3.86Å; L2561-F2567 HydrophobicContact CD1-CE2 3.78Å; L2561-F2567 HydrophobicContact CD1-CZ 4.2Å; L2561-F2567 HydrophobicContact CD2-CE2 4.31Å; L2561-F2567 HydrophobicContact CG-CE2 4.19Å; L2561-I2573 HydrophobicContact CB-CD1 4.07Å
2562	M	83.5	Confident	83.6	Confident	82 Å²	82	56.6 Å²	56.6	40%	0.404	31%	0.309	S	S	.	.	H	α-helix	trans	-67.7	-22.4	169.3	-67.9	-62.4	-57.9	0	0	112.4	K2558 F2567 I2573	K2558-M2562 VanDerWaalsContact O-CB 3.24Å; K2558-M2562 WeakPolarHBondContact O-CB 3.37Å; K2558-M2562 WeakPolarHBondContact O-CG 3.3Å; K2558-M2562 PolarHBondContact O-N 3.27Å; M2562-F2567 HydrophobicContact SD-CB 4.14Å; M2562-I2573 HydrophobicContact CG-CD1 3.94Å; M2562-I2573 HydrophobicContact SD-CD1 3.92Å
2563	Q	80.2	Confident	83.5	Confident	152 Å²	152	53.6 Å²	53.6	71%	0.71	29%	0.292	S	S	*	.	H	α-helix	trans	-82	-30.3	171.5	-78.9	-177.8	-38.1	0	0	113.1	K2559 T2560 L2561 G2565	K2559-Q2563 WeakPolarHBondContact O-CB 3.21Å; K2559-Q2563 VanDerWaalsContact O-CG 3.26Å; K2559-Q2563 WeakPolarHBondContact O-CG 3.27Å; K2559-Q2563 PolarHBondContact O-N 3.27Å; K2559-Q2563 VanDerWaalsContact O-N 3.08Å; T2560-Q2563 WeakPolarHBondContact O-CB 3.34Å; T2560-Q2563 PolarHBondContact O-N 3.46Å; L2561-Q2563 PolarHBondContact O-N 2.78Å; Q2563-G2565 VanDerWaalsContact C-N 3.26Å
2564	A	77.5	Confident	83.2	Confident	53 Å²	53	55.5 Å²	55.5	44%	0.438	30%	0.304	S	S	.	.	H	α-helix	trans	-67.4	-28.1	168.7	0	0	0	0	0	112.3	A2533 T2560 L2561	A2533-A2564 HydrophobicContact CB-CB 3.66Å; T2560-A2564 PolarHBondContact O-N 2.83Å; L2561-A2564 PolarHBondContact O-N 3.34Å
2565	G	76.3	Confident	83.1	Confident	57 Å²	57	57.3 Å²	57.3	59%	0.588	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.4	5.4	172.3	0	0	0	0	0	115	L2561 Q2563 F2567	L2561-G2565 PolarHBondContact O-N 3.26Å; L2561-G2565 VanDerWaalsContact O-N 3.09Å; Q2563-G2565 VanDerWaalsContact C-N 3.26Å; G2565-F2567 VanDerWaalsContact C-N 3.34Å; G2565-F2567 PolarHBondContact O-N 3.03Å
2566	S	73.8	Confident	83	Confident	48 Å²	48	53.3 Å²	53.3	34%	0.336	29%	0.291	S	S	.	.			trans	-76.7	-13.3	-169.9	-40.3	0	0	0	0	114.6	A2374 F2532	A2374-S2566 WeakPolarHBondContact CB-O 3.22Å; F2532-S2566 PolarHBondContact O-OG 2.78Å
2567	F	76.7	Confident	82.9	Confident	13 Å²	13	51.7 Å²	51.7	6%	0.057	28%	0.283	C	S	.	.			trans	-119.2	142.4	-174.5	-68.4	-96.9	0	0	0	112.3	A2374 L2377 F2528 F2532 L2561 M2562 G2565 I2573	A2374-F2567 HydrophobicContact CB-CD1 4.23Å; A2374-F2567 HydrophobicContact CB-CE1 4.3Å; L2377-F2567 HydrophobicContact CD1-CD1 4.46Å; L2377-F2567 HydrophobicContact CD1-CE1 3.71Å; L2377-F2567 HydrophobicContact CD2-CE1 3.88Å; L2377-F2567 HydrophobicContact CG-CE1 4.47Å; F2528-F2567 AromaticContact CE1-CZ 3.97Å; F2528-F2567 HydrophobicContact CE1-CZ 3.97Å; F2528-F2567 HydrophobicContact CZ-CE1 4.46Å; F2528-F2567 HydrophobicContact CZ-CZ 4.22Å; F2532-F2567 HydrophobicContact CB-CE2 3.67Å; F2532-F2567 HydrophobicContact CB-CZ 4.22Å; F2532-F2567 HydrophobicContact CD1-CE2 4.12Å; F2532-F2567 HydrophobicContact CD1-CZ 4.08Å; F2532-F2567 AromaticContact CD2-CE2 3.83Å; F2532-F2567 HydrophobicContact CD2-CE2 3.83Å; F2532-F2567 AromaticContact CD2-CZ 3.47Å; F2532-F2567 HydrophobicContact CD2-CZ 3.47Å; F2532-F2567 VanDerWaalsContact CD2-CZ 3.47Å; F2532-F2567 HydrophobicContact CE1-CZ 4.42Å; F2532-F2567 AromaticContact CE2-CZ 3.87Å; F2532-F2567 HydrophobicContact CE2-CZ 3.87Å; F2532-F2567 AromaticContact CG-CE2 3.56Å; F2532-F2567 HydrophobicContact CG-CE2 3.56Å; F2532-F2567 AromaticContact CG-CZ 3.61Å; F2532-F2567 HydrophobicContact CG-CZ 3.61Å; F2532-F2567 HydrophobicContact CZ-CZ 4.34Å; L2561-F2567 HydrophobicContact CB-CD2 3.95Å; L2561-F2567 HydrophobicContact CB-CE2 3.86Å; L2561-F2567 HydrophobicContact CD1-CE2 3.78Å; L2561-F2567 HydrophobicContact CD1-CZ 4.2Å; L2561-F2567 HydrophobicContact CD2-CE2 4.31Å; L2561-F2567 HydrophobicContact CG-CE2 4.19Å; M2562-F2567 HydrophobicContact SD-CB 4.14Å; G2565-F2567 VanDerWaalsContact C-N 3.34Å; G2565-F2567 PolarHBondContact O-N 3.03Å; F2567-I2573 HydrophobicContact CB-CD1 3.99Å; F2567-I2573 HydrophobicContact CB-CG1 4.07Å; F2567-I2573 HydrophobicContact CD1-CD1 4.22Å; F2567-I2573 HydrophobicContact CD1-CG1 3.45Å; F2567-I2573 VanDerWaalsContact CD1-CG1 3.45Å; F2567-I2573 HydrophobicContact CD2-CD1 3.91Å; F2567-I2573 HydrophobicContact CD2-CG1 3.97Å; F2567-I2573 HydrophobicContact CE1-CG1 3.74Å; F2567-I2573 HydrophobicContact CE2-CD1 4.43Å; F2567-I2573 HydrophobicContact CE2-CG1 4.24Å; F2567-I2573 HydrophobicContact CG-CD1 3.79Å; F2567-I2573 HydrophobicContact CG-CG1 3.56Å; F2567-I2573 HydrophobicContact CZ-CG1 4.13Å
2568	K	76.8	Confident	82.9	Confident	158 Å²	158	54 Å²	54	69%	0.687	30%	0.295	S	S	*	.	S	Bend	trans	-69.9	-35.7	175.8	-72.7	176.2	-177.4	147.2	0	113.7	D2375	D2375-K2568 VanDerWaalsContact OD1-CD 3.3Å; D2375-K2568 WeakPolarHBondContact OD1-CD 3.48Å; D2375-K2568 WeakPolarHBondContact OD1-CE 3.32Å; D2375-K2568 IonicContact OD1-NZ 2.76Å; D2375-K2568 PolarHBondContact OD1-NZ 2.98Å; D2375-K2568 IonicContact OD2-NZ 2.69Å; D2375-K2568 PolarHBondContact OD2-NZ 3.22Å
2569	D	83.7	Confident	82.9	Confident	55 Å²	55	53 Å²	53	29%	0.294	29%	0.291	S	S	.	.			trans	-152.5	162.2	-173.4	79.6	89.2	0	0	0	112.7	E2571 S2572	D2569-E2571 WeakPolarHBondContact OD1-CA 3.4Å; D2569-E2571 VanDerWaalsContact OD1-CB 3.31Å; D2569-E2571 WeakPolarHBondContact OD1-CB 3.37Å; D2569-E2571 PolarHBondContact OD1-N 2.77Å; D2569-S2572 PolarHBondContact OD1-N 2.97Å; D2569-S2572 PolarHBondContact OD1-OG 3.39Å; D2569-S2572 WeakPolarHBondContact OD2-CB 3.35Å; D2569-S2572 PolarHBondContact OD2-OG 3.07Å
2570	A	83.3	Confident	83.1	Confident	44 Å²	44	46.8 Å²	46.8	36%	0.364	27%	0.265	S	S	.	.	H	α-helix	trans	-86	-15.4	-176.2	0	0	0	0	0	114.8	K2558 D2574	K2558-A2570 HydrophobicContact CD-CB 4.49Å; K2558-A2570 WeakPolarHBondContact CE-O 3.29Å; A2570-D2574 PolarHBondContact O-N 2.83Å
2571	E	82.8	Confident	83.2	Confident	118 Å²	118	46.8 Å²	46.8	55%	0.551	26%	0.262	S	S	*	.	H	α-helix	trans	-75.3	-34.7	173.9	-66.1	-172.4	177.2	0	0	111.1	R2378 D2569 I2573 D2574 F2575	R2378-E2571 IonicContact CZ-OE2 3.77Å; R2378-E2571 VanDerWaalsContact CZ-OE2 3.26Å; R2378-E2571 IonicContact NH1-OE2 3.68Å; R2378-E2571 PolarHBondContact NH1-OE2 3.36Å; R2378-E2571 IonicContact NH2-OE2 2.97Å; R2378-E2571 PolarHBondContact NH2-OE2 2.97Å; D2569-E2571 WeakPolarHBondContact OD1-CA 3.4Å; D2569-E2571 VanDerWaalsContact OD1-CB 3.31Å; D2569-E2571 WeakPolarHBondContact OD1-CB 3.37Å; D2569-E2571 PolarHBondContact OD1-N 2.77Å; E2571-I2573 VanDerWaalsContact C-N 3.35Å; E2571-D2574 WeakPolarHBondContact O-CB 3.5Å; E2571-D2574 PolarHBondContact O-N 3.18Å; E2571-D2574 VanDerWaalsContact O-N 3.13Å; E2571-F2575 WeakPolarHBondContact O-CB 3.37Å; E2571-F2575 PolarHBondContact O-N 2.94Å
2572	S	83.8	Confident	83.3	Confident	19 Å²	19	50.4 Å²	50.4	13%	0.133	28%	0.278	C	S	.	.	H	α-helix	trans	-65.2	-37.2	177.1	-63.5	0	0	0	0	112.1	D2569 G2576	D2569-S2572 PolarHBondContact OD1-N 2.97Å; D2569-S2572 PolarHBondContact OD1-OG 3.39Å; D2569-S2572 WeakPolarHBondContact OD2-CB 3.35Å; D2569-S2572 PolarHBondContact OD2-OG 3.07Å; S2572-G2576 PolarHBondContact O-N 2.8Å
2573	I	86.3	Confident	83.6	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.4	-48.2	167.4	-59.7	171.4	0	0	0	110.2	F2528 K2558 L2561 M2562 F2567 E2571 F2575 G2576 V2577	F2528-I2573 HydrophobicContact CE1-CG2 4.14Å; F2528-I2573 HydrophobicContact CZ-CG2 4.48Å; K2558-I2573 HydrophobicContact CG-CB 4.07Å; K2558-I2573 HydrophobicContact CG-CD1 4.44Å; K2558-I2573 HydrophobicContact CG-CG2 3.66Å; L2561-I2573 HydrophobicContact CB-CD1 4.07Å; M2562-I2573 HydrophobicContact CG-CD1 3.94Å; M2562-I2573 HydrophobicContact SD-CD1 3.92Å; F2567-I2573 HydrophobicContact CB-CD1 3.99Å; F2567-I2573 HydrophobicContact CB-CG1 4.07Å; F2567-I2573 HydrophobicContact CD1-CD1 4.22Å; F2567-I2573 HydrophobicContact CD1-CG1 3.45Å; F2567-I2573 VanDerWaalsContact CD1-CG1 3.45Å; F2567-I2573 HydrophobicContact CD2-CD1 3.91Å; F2567-I2573 HydrophobicContact CD2-CG1 3.97Å; F2567-I2573 HydrophobicContact CE1-CG1 3.74Å; F2567-I2573 HydrophobicContact CE2-CD1 4.43Å; F2567-I2573 HydrophobicContact CE2-CG1 4.24Å; F2567-I2573 HydrophobicContact CG-CD1 3.79Å; F2567-I2573 HydrophobicContact CG-CG1 3.56Å; F2567-I2573 HydrophobicContact CZ-CG1 4.13Å; E2571-I2573 VanDerWaalsContact C-N 3.35Å; I2573-F2575 PolarHBondContact O-N 3.43Å; I2573-G2576 PolarHBondContact O-N 3.36Å; I2573-V2577 HydrophobicContact CG2-CG2 4.18Å; I2573-V2577 WeakPolarHBondContact O-CG2 3.4Å; I2573-V2577 PolarHBondContact O-N 3.1Å
2574	D	86.4	Confident	83.8	Confident	55 Å²	55	40.8 Å²	40.8	29%	0.294	23%	0.232	S	C	.	.	H	α-helix	trans	-58	-47.2	-177.5	-134.5	7.2	0	0	0	112	V2554 K2558 A2570 E2571 N2578	V2554-D2574 WeakPolarHBondContact CG1-OD1 3.43Å; K2558-D2574 WeakPolarHBondContact CE-OD1 3.3Å; K2558-D2574 WeakPolarHBondContact CE-OD2 3.46Å; K2558-D2574 IonicContact NZ-OD1 3.39Å; K2558-D2574 PolarHBondContact NZ-OD1 3.1Å; K2558-D2574 IonicContact NZ-OD2 3.98Å; K2558-D2574 PolarHBondContact NZ-OD2 3.48Å; A2570-D2574 PolarHBondContact O-N 2.83Å; E2571-D2574 WeakPolarHBondContact O-CB 3.5Å; E2571-D2574 PolarHBondContact O-N 3.18Å; E2571-D2574 VanDerWaalsContact O-N 3.13Å; D2574-N2578 VanDerWaalsContact O-CB 3.26Å; D2574-N2578 WeakPolarHBondContact O-CB 3.38Å; D2574-N2578 PolarHBondContact O-N 3.29Å; D2574-N2578 VanDerWaalsContact O-N 3.11Å; D2574-N2578 PolarHBondContact O-ND2 3.5Å
2575	F	87.3	Confident	84.1	Confident	38 Å²	38	38.5 Å²	38.5	17%	0.167	21%	0.212	C	C	.	.	H	α-helix	trans	-66.8	-45.5	177.1	179	-101.4	0	0	0	111.7	L2377 R2378 C2424 P2426 E2571 I2573 N2578 S2579	L2377-F2575 WeakPolarHBondContact O-CD1 3.49Å; L2377-F2575 WeakPolarHBondContact O-CE1 3.38Å; R2378-F2575 HydrophobicContact CB-CD1 3.91Å; R2378-F2575 HydrophobicContact CG-CB 4.41Å; R2378-F2575 HydrophobicContact CG-CD1 3.92Å; R2378-F2575 HydrophobicContact CG-CG 4.22Å; C2424-F2575 WeakPolarHBondContact O-CE1 3.32Å; C2424-F2575 VanDerWaalsContact O-CZ 3.26Å; C2424-F2575 WeakPolarHBondContact O-CZ 3.3Å; P2426-F2575 HydrophobicContact CB-CD2 4.37Å; P2426-F2575 HydrophobicContact CB-CE2 3.95Å; P2426-F2575 HydrophobicContact CG-CD2 3.94Å; P2426-F2575 HydrophobicContact CG-CE1 4.45Å; P2426-F2575 HydrophobicContact CG-CE2 3.69Å; P2426-F2575 HydrophobicContact CG-CG 4.43Å; P2426-F2575 HydrophobicContact CG-CZ 3.96Å; E2571-F2575 WeakPolarHBondContact O-CB 3.37Å; E2571-F2575 PolarHBondContact O-N 2.94Å; I2573-F2575 PolarHBondContact O-N 3.43Å; F2575-N2578 PolarHBondContact O-N 3.38Å; F2575-S2579 WeakPolarHBondContact O-CB 3.46Å; F2575-S2579 PolarHBondContact O-N 3.14Å; F2575-S2579 PolarHBondContact O-OG 3.35Å
2576	G	85.1	Confident	84.7	Confident	4 Å²	4	36.1 Å²	36.1	4%	0.041	19%	0.186	C	C	.	.	H	α-helix	trans	-53	-59	178.5	0	0	0	0	0	112.2	S2572 I2573 S2579 L2580	S2572-G2576 PolarHBondContact O-N 2.8Å; I2573-G2576 PolarHBondContact O-N 3.36Å; G2576-S2579 PolarHBondContact O-N 3.2Å; G2576-S2579 PolarHBondContact O-OG 3.43Å; G2576-S2579 VanDerWaalsContact O-OG 3.06Å; G2576-L2580 WeakPolarHBondContact O-CB 3.37Å; G2576-L2580 PolarHBondContact O-N 2.91Å
2577	V	87.6	Confident	85.1	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.6	-45.8	-178	-175.2	0	0	0	0	111.7	I2524 L2525 F2528 W2550 V2554 I2573 S2579 L2580 R2581	I2524-V2577 HydrophobicContact CG2-CG1 4.37Å; L2525-V2577 HydrophobicContact CD2-CG1 3.48Å; L2525-V2577 VanDerWaalsContact CD2-CG1 3.48Å; L2525-V2577 HydrophobicContact CD2-CG2 4.31Å; L2525-V2577 HydrophobicContact CG-CG1 4.35Å; F2528-V2577 HydrophobicContact CD1-CG2 3.69Å; F2528-V2577 HydrophobicContact CD2-CG2 3.87Å; F2528-V2577 HydrophobicContact CE1-CG2 3.49Å; F2528-V2577 VanDerWaalsContact CE1-CG2 3.49Å; F2528-V2577 HydrophobicContact CE2-CB 4.49Å; F2528-V2577 HydrophobicContact CE2-CG2 3.67Å; F2528-V2577 HydrophobicContact CG-CG2 3.88Å; F2528-V2577 HydrophobicContact CZ-CG2 3.46Å; F2528-V2577 VanDerWaalsContact CZ-CG2 3.46Å; W2550-V2577 HydrophobicContact CH2-CG1 3.43Å; W2550-V2577 VanDerWaalsContact CH2-CG1 3.43Å; W2550-V2577 HydrophobicContact CZ2-CG1 3.55Å; V2554-V2577 HydrophobicContact CG2-CG1 4.27Å; I2573-V2577 HydrophobicContact CG2-CG2 4.18Å; I2573-V2577 WeakPolarHBondContact O-CG2 3.4Å; I2573-V2577 PolarHBondContact O-N 3.1Å; V2577-S2579 PolarHBondContact O-N 3.29Å; V2577-L2580 PolarHBondContact O-N 3.49Å; V2577-R2581 PolarHBondContact O-N 2.77Å
2578	N	87.6	Confident	85.2	Confident	48 Å²	48	34.1 Å²	34.1	26%	0.257	17%	0.174	S	C	.	.	H	α-helix	trans	-66.6	-38.6	-179.5	-79.9	-74	0	0	0	112.4	W2550 D2574 F2575 Q2582	W2550-N2578 PolarHBondContact NE1-OD1 2.9Å; D2574-N2578 VanDerWaalsContact O-CB 3.26Å; D2574-N2578 WeakPolarHBondContact O-CB 3.38Å; D2574-N2578 PolarHBondContact O-N 3.29Å; D2574-N2578 VanDerWaalsContact O-N 3.11Å; D2574-N2578 PolarHBondContact O-ND2 3.5Å; F2575-N2578 PolarHBondContact O-N 3.38Å; N2578-Q2582 WeakPolarHBondContact O-CG 3.4Å; N2578-Q2582 PolarHBondContact O-N 3.03Å
2579	S	88.4	Confident	85.5	Confident	6 Å²	6	34 Å²	34	4%	0.042	17%	0.169	C	C	.	.	H	α-helix	trans	-65.3	-42.8	175.4	81.9	0	0	0	0	110.8	F2575 G2576 V2577 Q2582 K2583	F2575-S2579 WeakPolarHBondContact O-CB 3.46Å; F2575-S2579 PolarHBondContact O-N 3.14Å; F2575-S2579 PolarHBondContact O-OG 3.35Å; G2576-S2579 PolarHBondContact O-N 3.2Å; G2576-S2579 PolarHBondContact O-OG 3.43Å; G2576-S2579 VanDerWaalsContact O-OG 3.06Å; V2577-S2579 PolarHBondContact O-N 3.29Å; S2579-Q2582 PolarHBondContact O-N 3.15Å; S2579-K2583 WeakPolarHBondContact O-CE 3.44Å; S2579-K2583 WeakPolarHBondContact O-CG 3.47Å; S2579-K2583 PolarHBondContact O-N 2.83Å; S2579-K2583 WeakPolarHBondContact OG-CE 3.03Å; S2579-K2583 PolarHBondContact OG-NZ 3.07Å; S2579-K2583 VanDerWaalsContact OG-NZ 3.12Å
2580	L	86.4	Confident	85.7	Confident	4 Å²	4	33 Å²	33	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-61	-48.9	178.9	-170.9	66	0	0	0	110.8	L2370 I2401 I2524 F2528 G2576 V2577 Q2582 K2583 F2584	L2370-L2580 HydrophobicContact CD1-CD2 3.77Å; L2370-L2580 HydrophobicContact CD2-CD1 4.08Å; L2370-L2580 HydrophobicContact CD2-CD2 4.28Å; I2401-L2580 HydrophobicContact CG1-CD1 4.24Å; I2401-L2580 HydrophobicContact CG2-CD1 4.19Å; I2524-L2580 HydrophobicContact CG2-CD2 4.38Å; F2528-L2580 HydrophobicContact CD2-CD2 4.12Å; G2576-L2580 WeakPolarHBondContact O-CB 3.37Å; G2576-L2580 PolarHBondContact O-N 2.91Å; V2577-L2580 PolarHBondContact O-N 3.49Å; L2580-Q2582 VanDerWaalsContact C-N 3.33Å; L2580-Q2582 PolarHBondContact O-N 2.91Å; L2580-K2583 PolarHBondContact O-N 3.33Å; L2580-F2584 HydrophobicContact CD1-CD2 4.25Å; L2580-F2584 HydrophobicContact CD1-CE2 4.04Å; L2580-F2584 HydrophobicContact CG-CD2 4.12Å; L2580-F2584 HydrophobicContact CG-CE2 4.1Å; L2580-F2584 WeakPolarHBondContact O-CD2 3.46Å; L2580-F2584 PolarHBondContact O-N 2.94Å
2581	R	87	Confident	85.7	Confident	29 Å²	29	38.7 Å²	38.7	11%	0.109	18%	0.178	C	C	.	.	H	α-helix	trans	-55.5	-44.3	173.6	177.9	167.5	167.5	-109.6	12.9	112.3	A2515 F2520 E2521 I2524 W2550 V2577 L2585	A2515-R2581 PolarHBondContact O-NH2 3.11Å; A2515-R2581 VanDerWaalsContact O-NH2 3.13Å; F2520-R2581 HydrophobicContact CE1-CG 4.13Å; E2521-R2581 IonicContact OE1-CZ 3.17Å; E2521-R2581 VanDerWaalsContact OE1-CZ 3.31Å; E2521-R2581 IonicContact OE1-NE 3.47Å; E2521-R2581 PolarHBondContact OE1-NE 3.02Å; E2521-R2581 IonicContact OE1-NH2 3.56Å; E2521-R2581 PolarHBondContact OE1-NH2 2.95Å; I2524-R2581 HydrophobicContact CD1-CB 4.33Å; W2550-R2581 HydrophobicContact CH2-CB 4.15Å; W2550-R2581 HydrophobicContact CH2-CG 4.37Å; W2550-R2581 HydrophobicContact CZ2-CB 4.07Å; W2550-R2581 HydrophobicContact CZ2-CG 4.32Å; V2577-R2581 PolarHBondContact O-N 2.77Å; R2581-L2585 HydrophobicContact CG-CD1 4.22Å; R2581-L2585 VanDerWaalsContact O-CG 3.27Å; R2581-L2585 WeakPolarHBondContact O-CG 3.15Å; R2581-L2585 PolarHBondContact O-N 3.24Å
2582	Q	88.8	Confident	85.8	Confident	75 Å²	75	34 Å²	34	35%	0.35	16%	0.158	S	C	.	.	H	α-helix	trans	-69.6	-37.3	177.4	-68.5	-66.3	-2.2	0	0	113.2	L2430 N2578 S2579 L2580 L2585 V2586	L2430-Q2582 HydrophobicContact CB-CB 3.99Å; L2430-Q2582 HydrophobicContact CD1-CB 3.97Å; N2578-Q2582 WeakPolarHBondContact O-CG 3.4Å; N2578-Q2582 PolarHBondContact O-N 3.03Å; S2579-Q2582 PolarHBondContact O-N 3.15Å; L2580-Q2582 VanDerWaalsContact C-N 3.33Å; L2580-Q2582 PolarHBondContact O-N 2.91Å; Q2582-L2585 PolarHBondContact O-N 3.03Å; Q2582-L2585 VanDerWaalsContact O-N 3.16Å; Q2582-V2586 WeakPolarHBondContact O-CG2 3.44Å; Q2582-V2586 PolarHBondContact O-N 2.86Å
2583	K	89.6	Confident	85.8	Confident	1 Å²	1	39.1 Å²	39.1	0%	0.004	19%	0.189	C	C	.	.	H	α-helix	trans	-65	-39.9	175.2	-76.3	168.6	-75.9	165.7	0	111.8	I2401 E2402 C2424 L2430 Y2460 S2579 L2580 L2585 V2586 A2587	I2401-K2583 HydrophobicContact CG1-CB 4.02Å; I2401-K2583 VanDerWaalsContact O-CD 3.27Å; I2401-K2583 WeakPolarHBondContact O-CD 3.49Å; I2401-K2583 VanDerWaalsContact O-CE 3.27Å; I2401-K2583 WeakPolarHBondContact O-CE 3.49Å; I2401-K2583 PolarHBondContact O-NZ 3.47Å; E2402-K2583 PolarHBondContact O-NZ 2.95Å; C2424-K2583 HydrophobicContact CB-CD 4.43Å; L2430-K2583 HydrophobicContact CD1-CG 4.16Å; L2430-K2583 HydrophobicContact CD2-CD 4.31Å; L2430-K2583 HydrophobicContact CD2-CG 3.68Å; Y2460-K2583 HydrophobicContact CE1-CB 4.17Å; Y2460-K2583 HydrophobicContact CE1-CD 4.3Å; Y2460-K2583 HydrophobicContact CE1-CG 3.97Å; Y2460-K2583 HydrophobicContact CE2-CB 4.39Å; Y2460-K2583 WeakPolarHBondContact CE2-O 3.48Å; S2579-K2583 WeakPolarHBondContact O-CE 3.44Å; S2579-K2583 WeakPolarHBondContact O-CG 3.47Å; S2579-K2583 PolarHBondContact O-N 2.83Å; S2579-K2583 WeakPolarHBondContact OG-CE 3.03Å; S2579-K2583 PolarHBondContact OG-NZ 3.07Å; S2579-K2583 VanDerWaalsContact OG-NZ 3.12Å; L2580-K2583 PolarHBondContact O-N 3.33Å; K2583-L2585 PolarHBondContact O-N 3.37Å; K2583-V2586 PolarHBondContact O-N 3.44Å; K2583-A2587 WeakPolarHBondContact O-CB 3.04Å; K2583-A2587 PolarHBondContact O-N 3.14Å
2584	F	84	Confident	85.8	Confident	32 Å²	32	41.5 Å²	41.5	14%	0.14	20%	0.198	C	C	.	.	H	α-helix	trans	-60.7	-40.7	168.8	-90.6	-80.8	0	0	0	112.6	I2401 F2520 I2524 L2580 A2587 D2588	I2401-F2584 HydrophobicContact CD1-CD1 3.97Å; I2401-F2584 HydrophobicContact CD1-CD2 3.69Å; I2401-F2584 HydrophobicContact CD1-CE1 3.97Å; I2401-F2584 HydrophobicContact CD1-CE2 3.69Å; I2401-F2584 HydrophobicContact CD1-CG 3.84Å; I2401-F2584 HydrophobicContact CD1-CZ 3.83Å; I2401-F2584 HydrophobicContact CG1-CD2 4.4Å; I2401-F2584 HydrophobicContact CG1-CE2 4.41Å; F2520-F2584 HydrophobicContact CE2-CB 3.94Å; F2520-F2584 HydrophobicContact CE2-CD1 4.35Å; F2520-F2584 HydrophobicContact CE2-CG 4.18Å; F2520-F2584 HydrophobicContact CZ-CB 3.73Å; F2520-F2584 HydrophobicContact CZ-CG 4.4Å; I2524-F2584 HydrophobicContact CD1-CB 4.14Å; I2524-F2584 HydrophobicContact CD1-CD2 3.55Å; I2524-F2584 HydrophobicContact CD1-CE2 4.14Å; I2524-F2584 HydrophobicContact CD1-CG 3.97Å; I2524-F2584 HydrophobicContact CG1-CD2 4.25Å; I2524-F2584 HydrophobicContact CG1-CE2 4.35Å; L2580-F2584 HydrophobicContact CD1-CD2 4.25Å; L2580-F2584 HydrophobicContact CD1-CE2 4.04Å; L2580-F2584 HydrophobicContact CG-CD2 4.12Å; L2580-F2584 HydrophobicContact CG-CE2 4.1Å; L2580-F2584 WeakPolarHBondContact O-CD2 3.46Å; L2580-F2584 PolarHBondContact O-N 2.94Å; F2584-A2587 PolarHBondContact O-N 2.92Å; F2584-D2588 WeakPolarHBondContact O-CB 3.45Å; F2584-D2588 PolarHBondContact O-N 2.78Å
2585	L	85.3	Confident	85.9	Confident	5 Å²	5	44.6 Å²	44.6	3%	0.026	21%	0.208	C	C	.	.	H	α-helix	trans	-68.3	-31.5	176.6	-70.6	168.7	0	0	0	113.6	L2514 A2515 F2520 R2581 Q2582 K2583 R2589	L2514-L2585 HydrophobicContact CB-CD2 3.53Å; A2515-L2585 HydrophobicContact CB-CD1 4.13Å; A2515-L2585 HydrophobicContact CB-CD2 3.85Å; F2520-L2585 HydrophobicContact CE1-CD2 4.48Å; R2581-L2585 HydrophobicContact CG-CD1 4.22Å; R2581-L2585 VanDerWaalsContact O-CG 3.27Å; R2581-L2585 WeakPolarHBondContact O-CG 3.15Å; R2581-L2585 PolarHBondContact O-N 3.24Å; Q2582-L2585 PolarHBondContact O-N 3.03Å; Q2582-L2585 VanDerWaalsContact O-N 3.16Å; K2583-L2585 PolarHBondContact O-N 3.37Å; L2585-R2589 WeakPolarHBondContact O-CD 3.33Å; L2585-R2589 WeakPolarHBondContact O-CG 3.49Å
2586	V	87.9	Confident	86.1	Confident	7 Å²	7	42.9 Å²	42.9	4%	0.042	20%	0.201	C	C	.	.	H	α-helix	trans	-72.2	-41.5	171.9	170.1	0	0	0	0	110.8	M2433 I2436 Y2460 Q2582 K2583 R2589 Y2590	M2433-V2586 HydrophobicContact CB-CG1 4.23Å; M2433-V2586 HydrophobicContact CE-CG1 4.1Å; M2433-V2586 HydrophobicContact SD-CG1 3.95Å; I2436-V2586 HydrophobicContact CD1-CG1 4.17Å; Y2460-V2586 WeakPolarHBondContact OH-CG1 2.96Å; Q2582-V2586 WeakPolarHBondContact O-CG2 3.44Å; Q2582-V2586 PolarHBondContact O-N 2.86Å; K2583-V2586 PolarHBondContact O-N 3.44Å; V2586-R2589 PolarHBondContact O-N 3.08Å; V2586-Y2590 PolarHBondContact O-N 3.06Å; V2586-Y2590 VanDerWaalsContact O-N 3.16Å
2587	A	83.1	Confident	86.2	Confident	11 Å²	11	46.8 Å²	46.8	9%	0.091	22%	0.218	C	C	.	.	H	α-helix	trans	-59.9	-45.3	173.1	0	0	0	0	0	111.9	Y2460 K2583 F2584 R2589 Y2590	Y2460-A2587 HydrophobicContact CD2-CB 4.01Å; Y2460-A2587 HydrophobicContact CE2-CB 3.86Å; K2583-A2587 WeakPolarHBondContact O-CB 3.04Å; K2583-A2587 PolarHBondContact O-N 3.14Å; F2584-A2587 PolarHBondContact O-N 2.92Å; A2587-R2589 PolarHBondContact O-N 3.29Å; A2587-Y2590 PolarHBondContact O-N 3.15Å; A2587-Y2590 VanDerWaalsContact O-N 3.15Å
2588	D	78.2	Confident	85.9	Confident	8 Å²	8	47.4 Å²	47.4	4%	0.043	22%	0.224	C	C	.	.	H	α-helix	trans	-58	-34.1	-178.1	-176.3	39.5	0	0	0	113.6	R2500 R2504 L2514 F2584	R2500-D2588 WeakPolarHBondContact CD-O 3.24Å; R2500-D2588 WeakPolarHBondContact CD-OD1 3.27Å; R2500-D2588 HydrophobicContact CG-CB 4.37Å; R2500-D2588 VanDerWaalsContact CG-OD1 3.26Å; R2500-D2588 WeakPolarHBondContact CG-OD1 3.17Å; R2500-D2588 IonicContact CZ-OD1 3.77Å; R2500-D2588 IonicContact NE-OD1 3.69Å; R2500-D2588 PolarHBondContact NH1-O 3.46Å; R2500-D2588 IonicContact NH1-OD1 2.86Å; R2504-D2588 IonicContact CZ-OD1 2.71Å; R2504-D2588 IonicContact CZ-OD2 3.62Å; R2504-D2588 IonicContact NH1-OD1 3.32Å; R2504-D2588 PolarHBondContact NH1-OD1 3.06Å; R2504-D2588 VanDerWaalsContact NH2-CG 3.32Å; R2504-D2588 IonicContact NH2-OD1 3.95Å; R2504-D2588 PolarHBondContact NH2-OD1 2.84Å; R2504-D2588 IonicContact NH2-OD2 2.79Å; R2504-D2588 PolarHBondContact NH2-OD2 3.1Å; L2514-D2588 HydrophobicContact CD2-CB 4.27Å; F2584-D2588 WeakPolarHBondContact O-CB 3.45Å; F2584-D2588 PolarHBondContact O-N 2.78Å
2589	R	82.6	Confident	85.9	Confident	154 Å²	154	47 Å²	47	58%	0.581	22%	0.222	S	C	*	.	H	α-helix	trans	-94.5	-9.2	-176.4	-65.7	172.7	178.4	175.1	-0.1	113.4	N2513 L2585 V2586 A2587 K2591	N2513-R2589 PolarHBondContact OD1-NH2 2.89Å; L2585-R2589 WeakPolarHBondContact O-CD 3.33Å; L2585-R2589 WeakPolarHBondContact O-CG 3.49Å; V2586-R2589 PolarHBondContact O-N 3.08Å; A2587-R2589 PolarHBondContact O-N 3.29Å; R2589-K2591 PolarHBondContact O-N 2.86Å
2590	Y	87.6	Confident	86	Confident	35 Å²	35	46.7 Å²	46.7	14%	0.137	22%	0.22	C	C	.	.			trans	-74.6	127.8	-175.2	-177.2	-117.3	0	0	0	112.1	M2433 N2463 H2493 V2586 A2587	M2433-Y2590 HydrophobicContact CB-CD2 3.38Å; M2433-Y2590 HydrophobicContact CB-CE2 3.69Å; M2433-Y2590 HydrophobicContact CB-CG 4.08Å; M2433-Y2590 HydrophobicContact CE-CD1 3.98Å; M2433-Y2590 HydrophobicContact CE-CD2 4.28Å; M2433-Y2590 HydrophobicContact CE-CG 3.72Å; M2433-Y2590 HydrophobicContact CG-CD2 3.87Å; M2433-Y2590 HydrophobicContact CG-CE2 3.94Å; M2433-Y2590 HydrophobicContact CG-CG 4.25Å; N2463-Y2590 HydrophobicContact CB-CD1 3.89Å; N2463-Y2590 HydrophobicContact CB-CE1 3.61Å; N2463-Y2590 PolarHBondContact O-OH 2.77Å; N2463-Y2590 WeakPolarHBondContact OD1-CE1 3.47Å; H2493-Y2590 HydrophobicContact CB-CE1 4.14Å; V2586-Y2590 PolarHBondContact O-N 3.06Å; V2586-Y2590 VanDerWaalsContact O-N 3.16Å; A2587-Y2590 PolarHBondContact O-N 3.15Å; A2587-Y2590 VanDerWaalsContact O-N 3.15Å
2591	K	83.8	Confident	86.4	Confident	163 Å²	163	47 Å²	47	71%	0.709	22%	0.222	S	C	*	.			trans	-149.2	111.8	170	-169.9	177.1	-177.6	-177.6	0	107.3	R2589 T2593	R2589-K2591 PolarHBondContact O-N 2.86Å; K2591-T2593 PolarHBondContact O-N 3.32Å
2592	P	84.1	Confident	86.8	Confident	20 Å²	20	45.6 Å²	45.6	13%	0.13	22%	0.217	C	C	.	.			trans	-61.4	134.6	-176.4	23.7	-33.7	0	0	0	110.9	F2466 H2493 V2624	F2466-P2592 HydrophobicContact CD1-CB 4.46Å; F2466-P2592 HydrophobicContact CE1-CB 4.01Å; H2493-P2592 HydrophobicContact CB-CG 3.66Å; P2592-V2624 HydrophobicContact CB-CG1 4.49Å; P2592-V2624 HydrophobicContact CG-CG1 3.83Å
2593	T	84.4	Confident	87	Confident	127 Å²	127	42 Å²	42	78%	0.779	20%	0.2	S	C	*	.			trans	-106.7	-21	176.6	55	0	0	0	0	112.3	K2591	K2591-T2593 PolarHBondContact O-N 3.32Å
2594	R	86.9	Confident	87	Confident	50 Å²	50	42.6 Å²	42.6	19%	0.189	20%	0.203	C	C	.	.	S	Bend	trans	-91.8	154.5	171.4	-75.9	167.9	-81.2	-120.9	-12.7	110.9	E2434 E2467 T2470 L2471	E2434-R2594 IonicContact OE1-CZ 2.7Å; E2434-R2594 VanDerWaalsContact OE1-CZ 3.3Å; E2434-R2594 IonicContact OE1-NH1 3.18Å; E2434-R2594 PolarHBondContact OE1-NH1 3.43Å; E2434-R2594 IonicContact OE1-NH2 3.68Å; E2434-R2594 PolarHBondContact OE1-NH2 2.63Å; E2434-R2594 IonicContact OE2-NH2 2.75Å; E2434-R2594 PolarHBondContact OE2-NH2 3.32Å; E2467-R2594 IonicContact OE1-CZ 3.74Å; E2467-R2594 VanDerWaalsContact OE1-CZ 3.24Å; E2467-R2594 IonicContact OE1-NE 3.78Å; E2467-R2594 PolarHBondContact OE1-NE 3.49Å; E2467-R2594 IonicContact OE1-NH2 4Å; E2467-R2594 PolarHBondContact OE1-NH2 2.63Å; E2467-R2594 IonicContact OE2-NE 3.73Å; T2470-R2594 HydrophobicContact CG2-CB 3.94Å; L2471-R2594 VanDerWaalsContact CD2-NH1 3.33Å
2595	K	89	Confident	87.1	Confident	119 Å²	119	41.4 Å²	41.4	52%	0.517	20%	0.198	S	C	.	.			trans	-106.4	149.9	166	-67	-150.7	-174.6	-155	0	110.4	E2623 V2624	K2595-E2623 WeakPolarHBondContact CE-O 3.32Å; K2595-E2623 PolarHBondContact NZ-O 2.64Å; K2595-V2624 CarbonylContact C-O 3.55Å; K2595-V2624 WeakPolarHBondContact CA-O 3.24Å; K2595-V2624 VanDerWaalsContact CB-O 3.27Å; K2595-V2624 WeakPolarHBondContact CB-O 3.45Å
2596	Y	91.7	Very high	86.7	Confident	3 Å²	3	42.9 Å²	42.9	1%	0.012	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-88.3	129.2	173.3	179.4	-113.8	0	0	0	110.5	A2469 Q2473 V2483 L2486 G2598 D2599 A2600 V2624 V2625 S2626	A2469-Y2596 HydrophobicContact CB-CD2 3.89Å; A2469-Y2596 HydrophobicContact CB-CE2 3.77Å; Q2473-Y2596 HydrophobicContact CG-CE2 4.44Å; V2483-Y2596 HydrophobicContact CB-CE2 4.28Å; V2483-Y2596 HydrophobicContact CG1-CE2 4.38Å; L2486-Y2596 HydrophobicContact CB-CE1 3.99Å; L2486-Y2596 HydrophobicContact CB-CE2 4.46Å; L2486-Y2596 HydrophobicContact CD2-CD1 4.07Å; L2486-Y2596 HydrophobicContact CD2-CD2 4.32Å; L2486-Y2596 HydrophobicContact CD2-CE1 4.14Å; L2486-Y2596 HydrophobicContact CD2-CE2 4.4Å; L2486-Y2596 HydrophobicContact CD2-CG 4.16Å; Y2596-G2598 PolarHBondContact O-N 3.29Å; Y2596-D2599 WeakPolarHBondContact CE1-O 3.38Å; Y2596-A2600 HydrophobicContact CD1-CB 4.37Å; Y2596-A2600 HydrophobicContact CE1-CB 4.34Å; Y2596-V2624 PolarHBondContact N-O 3.48Å; Y2596-V2625 HydrophobicContact CD1-CG1 4.37Å; Y2596-S2626 VanDerWaalsContact O-CB 3.3Å; Y2596-S2626 WeakPolarHBondContact O-CB 3.49Å; Y2596-S2626 PolarHBondContact O-N 3.35Å; Y2596-S2626 PolarHBondContact O-OG 3.07Å
2597	Q	87.1	Confident	85.7	Confident	86 Å²	86	47.6 Å²	47.6	40%	0.402	23%	0.229	S	C	.	.			trans	-97.6	70.5	-177.5	-72.2	-93.4	60.1	0	0	110.1	Q2473 D2478 G2479	Q2473-Q2597 PolarHBondContact NE2-O 3.44Å; D2478-Q2597 HydrophobicContact CB-CB 3.86Å; D2478-Q2597 HydrophobicContact CB-CG 4.24Å; D2478-Q2597 PolarHBondContact OD2-NE2 3.48Å; G2479-Q2597 WeakPolarHBondContact CA-O 3.14Å; G2479-Q2597 PolarHBondContact N-O 3.19Å
2598	G	81.3	Confident	84.6	Confident	12 Å²	12	47.8 Å²	47.8	12%	0.124	23%	0.231	C	C	.	.	S	Bend	trans	-179.4	176.6	-179.3	0	0	0	0	0	112.8	Y2596 V2625 G2627	Y2596-G2598 PolarHBondContact O-N 3.29Å; G2598-V2625 VanDerWaalsContact O-CG1 3.26Å; G2598-V2625 WeakPolarHBondContact O-CG1 3.43Å; G2598-G2627 VanDerWaalsContact O-CA 3.27Å; G2598-G2627 WeakPolarHBondContact O-CA 3.49Å; G2598-G2627 PolarHBondContact O-N 2.7Å; G2598-G2627 VanDerWaalsContact O-N 3.14Å
2599	D	87.4	Confident	83.5	Confident	40 Å²	40	49.5 Å²	49.5	21%	0.214	25%	0.251	C	S	.	.			trans	-75.8	140.6	167.8	-53.9	-59.4	0	0	0	109.7	K2480 Y2596 N2628 F2630	K2480-D2599 WeakPolarHBondContact CE-OD2 3.48Å; K2480-D2599 IonicContact NZ-OD2 3.75Å; K2480-D2599 PolarHBondContact NZ-OD2 3.32Å; Y2596-D2599 WeakPolarHBondContact CE1-O 3.38Å; D2599-N2628 CarbonylContact C-O 3.6Å; D2599-N2628 VanDerWaalsContact CA-O 3.28Å; D2599-N2628 WeakPolarHBondContact CA-O 3.46Å; D2599-N2628 WeakPolarHBondContact OD1-CB 3.47Å; D2599-N2628 PolarHBondContact OD1-N 3.23Å; D2599-N2628 PolarHBondContact OD1-ND2 3.25Å; D2599-F2630 HydrophobicContact CB-CD2 4.44Å; D2599-F2630 HydrophobicContact CB-CE2 4.03Å
2600	A	90.8	Very high	82	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	146	178.3	0	0	0	0	0	110.7	Y2596 V2625 N2628 V2629 F2630	Y2596-A2600 HydrophobicContact CD1-CB 4.37Å; Y2596-A2600 HydrophobicContact CE1-CB 4.34Å; A2600-V2625 HydrophobicContact CB-CG1 4.08Å; A2600-V2625 HydrophobicContact CB-CG2 3.96Å; A2600-N2628 PolarHBondContact N-O 2.79Å; A2600-V2629 WeakPolarHBondContact O-CA 3.43Å; A2600-F2630 PolarHBondContact O-N 2.71Å
2601	V	93.7	Very high	80.3	Confident	10 Å²	10	46.7 Å²	46.7	6%	0.061	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	124.7	178.6	-173.1	0	0	0	0	109.5	L2486 I2487 L2488 I2603 F2630 I2653 A2657	L2486-V2601 PolarHBondContact O-N 3.29Å; I2487-V2601 CarbonylContact C-O 3.53Å; I2487-V2601 WeakPolarHBondContact CA-O 3.38Å; I2487-V2601 HydrophobicContact CG1-CB 4.28Å; I2487-V2601 HydrophobicContact CG2-CB 4.29Å; I2487-V2601 HydrophobicContact CG2-CG1 4.48Å; L2488-V2601 PolarHBondContact N-O 3.4Å; V2601-I2603 HydrophobicContact CG1-CG1 4.16Å; V2601-F2630 HydrophobicContact CG2-CB 4.39Å; V2601-I2653 HydrophobicContact CG1-CG2 4.47Å; V2601-A2657 HydrophobicContact CG2-CB 3.99Å
2602	L	94.7	Very high	78.7	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	118.1	169.3	175.2	62.8	0	0	0	108.7	L2488 K2604 D2618 Y2619 L2621 F2630 V2631 H2632	L2488-L2602 HydrophobicContact CB-CD1 4.29Å; L2488-L2602 WeakPolarHBondContact O-CA 3.39Å; L2602-K2604 HydrophobicContact CD1-CB 4.42Å; L2602-K2604 HydrophobicContact CD2-CD 3.9Å; L2602-K2604 HydrophobicContact CD2-CG 4.34Å; L2602-K2604 HydrophobicContact CG-CB 4.37Å; L2602-K2604 HydrophobicContact CG-CD 4.32Å; L2602-K2604 HydrophobicContact CG-CG 4.21Å; L2602-D2618 VanDerWaalsContact CD2-C 3.49Å; L2602-D2618 WeakPolarHBondContact CD2-O 3.35Å; L2602-Y2619 HydrophobicContact CD1-CD2 4Å; L2602-Y2619 HydrophobicContact CD2-CD2 3.82Å; L2602-Y2619 HydrophobicContact CD2-CG 3.84Å; L2602-Y2619 HydrophobicContact CG-CD2 4.49Å; L2602-L2621 HydrophobicContact CB-CD1 3.78Å; L2602-L2621 HydrophobicContact CD1-CD1 4.35Å; L2602-L2621 HydrophobicContact CD2-CD1 3.99Å; L2602-L2621 HydrophobicContact CG-CD1 4.26Å; L2602-F2630 PolarHBondContact N-O 3.05Å; L2602-V2631 WeakPolarHBondContact O-CA 3.47Å; L2602-H2632 PolarHBondContact O-N 3.49Å
2603	I	93.5	Very high	77.1	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	119.2	167.6	-48	179.8	0	0	0	105.8	I2487 L2488 L2489 D2490 V2601 V2634 F2641 T2650 I2653 I2654	I2487-I2603 HydrophobicContact CG2-CD1 4.03Å; I2487-I2603 HydrophobicContact CG2-CG1 4.22Å; L2488-I2603 PolarHBondContact O-N 3.38Å; L2489-I2603 CarbonylContact C-O 3.47Å; L2489-I2603 WeakPolarHBondContact CA-O 3.43Å; L2489-I2603 HydrophobicContact CD2-CB 3.78Å; L2489-I2603 HydrophobicContact CD2-CD1 3.74Å; L2489-I2603 HydrophobicContact CD2-CG1 3.98Å; D2490-I2603 PolarHBondContact N-O 3.49Å; V2601-I2603 HydrophobicContact CG1-CG1 4.16Å; I2603-V2634 HydrophobicContact CG2-CB 4.38Å; I2603-V2634 HydrophobicContact CG2-CG2 3.52Å; I2603-F2641 HydrophobicContact CB-CE2 4.45Å; I2603-F2641 HydrophobicContact CG2-CD2 4.29Å; I2603-F2641 HydrophobicContact CG2-CE2 4.06Å; I2603-T2650 HydrophobicContact CD1-CG2 4.08Å; I2603-T2650 HydrophobicContact CG2-CG2 4.39Å; I2603-I2653 HydrophobicContact CD1-CB 3.81Å; I2603-I2653 HydrophobicContact CD1-CG2 3.52Å; I2603-I2653 HydrophobicContact CG1-CG2 3.84Å; I2603-I2653 HydrophobicContact CG2-CD1 4.26Å; I2603-I2654 HydrophobicContact CD1-CD1 4.49Å; I2603-I2654 HydrophobicContact CD1-CG1 3.82Å
2604	K	89.8	Confident	75.8	Confident	13 Å²	13	44.1 Å²	44.1	6%	0.057	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	155.9	-177.4	50.1	174.2	168.7	67.5	0	112.1	D2490 L2602 N2617 Y2619 H2632 V2633 V2634	D2490-K2604 WeakPolarHBondContact OD1-CA 3.4Å; D2490-K2604 VanDerWaalsContact OD1-CB 3.26Å; D2490-K2604 WeakPolarHBondContact OD1-CB 3.45Å; L2602-K2604 HydrophobicContact CD1-CB 4.42Å; L2602-K2604 HydrophobicContact CD2-CD 3.9Å; L2602-K2604 HydrophobicContact CD2-CG 4.34Å; L2602-K2604 HydrophobicContact CG-CB 4.37Å; L2602-K2604 HydrophobicContact CG-CD 4.32Å; L2602-K2604 HydrophobicContact CG-CG 4.21Å; K2604-N2617 WeakPolarHBondContact CE-O 3.2Å; K2604-N2617 PolarHBondContact NZ-O 2.96Å; K2604-N2617 PolarHBondContact NZ-OD1 3.31Å; K2604-Y2619 HydrophobicContact CB-CE2 3.71Å; K2604-Y2619 HydrophobicContact CD-CD1 3.88Å; K2604-Y2619 HydrophobicContact CD-CD2 4.06Å; K2604-Y2619 HydrophobicContact CD-CE1 3.47Å; K2604-Y2619 VanDerWaalsContact CD-CE1 3.47Å; K2604-Y2619 HydrophobicContact CD-CE2 3.65Å; K2604-Y2619 HydrophobicContact CD-CG 4.17Å; K2604-Y2619 HydrophobicContact CG-CE2 4.36Å; K2604-H2632 PolarHBondContact N-O 3.18Å; K2604-V2633 HydrophobicContact CG-CG2 4.44Å; K2604-V2633 CarbonylContact O-C 3.56Å; K2604-V2633 VanDerWaalsContact O-CA 3.29Å; K2604-V2633 WeakPolarHBondContact O-CA 3.49Å; K2604-V2634 PolarHBondContact O-N 3.33Å
2605	S	87.1	Confident	75	Confident	7 Å²	7	41.9 Å²	41.9	5%	0.049	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	156.7	-173.5	84.8	0	0	0	0	112.1	D2490 G2608 V2634 G2636 D2637	D2490-S2605 PolarHBondContact OD1-N 3.24Å; S2605-G2608 VanDerWaalsContact OG-CA 3.31Å; S2605-G2608 WeakPolarHBondContact OG-CA 3.49Å; S2605-G2608 PolarHBondContact OG-N 2.81Å; S2605-V2634 CarbonylContact C-O 3.35Å; S2605-V2634 WeakPolarHBondContact CA-O 3.3Å; S2605-G2636 VanDerWaalsContact CB-O 3.27Å; S2605-G2636 WeakPolarHBondContact CB-O 3.37Å; S2605-G2636 PolarHBondContact OG-O 2.7Å; S2605-D2637 WeakPolarHBondContact CB-O 3.45Å; S2605-D2637 PolarHBondContact OG-O 3.39Å
2606	S	75.5	Confident	74	Confident	36 Å²	36	37.4 Å²	37.4	25%	0.252	21%	0.21	S	C	.	.	S	Bend	trans	-71.5	-40.5	178.5	54.9	0	0	0	0	112.4	E854 G2608 V2634 D2635 G2636	E854-S2606 VanDerWaalsContact CD-OG 3.26Å; E854-S2606 VanDerWaalsContact OE1-CB 3.31Å; E854-S2606 WeakPolarHBondContact OE1-CB 3.42Å; E854-S2606 PolarHBondContact OE1-OG 3.33Å; S2606-G2608 VanDerWaalsContact C-N 3.3Å; S2606-V2634 PolarHBondContact N-O 3.09Å; S2606-D2635 WeakPolarHBondContact OG-CA 3.41Å; S2606-G2636 PolarHBondContact N-O 2.92Å; S2606-G2636 PolarHBondContact OG-N 3.01Å; S2606-G2636 PolarHBondContact OG-O 3.11Å; S2606-G2636 VanDerWaalsContact OG-O 3.1Å
2607	K	68.3	Low	73.4	Confident	106 Å²	106	42.3 Å²	42.3	46%	0.461	24%	0.236	S	C	.	.	S	Bend	trans	-87.8	10.2	175.5	-67.3	131.9	171.9	172.1	0	113.1	E854 G2609 G2636 D2637	E854-K2607 WeakPolarHBondContact OE1-CD 3.45Å; E854-K2607 WeakPolarHBondContact OE1-CE 3.37Å; E854-K2607 VanDerWaalsContact OE1-CG 3.26Å; E854-K2607 WeakPolarHBondContact OE1-CG 3.4Å; E854-K2607 IonicContact OE1-NZ 2.74Å; K2607-G2609 PolarHBondContact O-N 3.05Å; K2607-G2636 WeakPolarHBondContact CB-O 3.39Å; K2607-G2636 PolarHBondContact N-O 3.5Å; K2607-D2637 HydrophobicContact CB-CB 4.25Å; K2607-D2637 HydrophobicContact CD-CB 4.49Å
2608	G	59.9	Low	73.5	Confident	14 Å²	14	39.1 Å²	39.1	14%	0.144	22%	0.222	C	C	.	.			trans	-56.1	105.2	177	0	0	0	0	0	110.3	S2605 S2606 T2610	S2605-G2608 VanDerWaalsContact OG-CA 3.31Å; S2605-G2608 WeakPolarHBondContact OG-CA 3.49Å; S2605-G2608 PolarHBondContact OG-N 2.81Å; S2606-G2608 VanDerWaalsContact C-N 3.3Å; G2608-T2610 PolarHBondContact O-N 3.43Å
2609	G	53.5	Low	73.9	Confident	44 Å²	44	39.1 Å²	39.1	45%	0.454	22%	0.218	S	C	.	.	S	Bend	trans	-76.6	30.8	-154.2	0	0	0	0	0	117	M2367 K2607	M2367-G2609 WeakPolarHBondContact CE-O 3.4Å; K2607-G2609 PolarHBondContact O-N 3.05Å
2610	T	52.9	Low	73.8	Confident	17 Å²	17	37.5 Å²	37.5	10%	0.104	21%	0.211	C	C	.	.	S	Bend	trans	-113.7	133.3	171.5	61.6	0	0	0	0	108.6	Y2495 L2498 Y2499 G2608 V2615	Y2495-T2610 HydrophobicContact CD2-CG2 3.96Å; Y2495-T2610 HydrophobicContact CE2-CG2 3.66Å; Y2495-T2610 WeakPolarHBondContact CE2-OG1 3.23Å; L2498-T2610 HydrophobicContact CD2-CG2 3.56Å; Y2499-T2610 HydrophobicContact CD2-CG2 4.28Å; Y2499-T2610 HydrophobicContact CE2-CG2 4.1Å; G2608-T2610 PolarHBondContact O-N 3.43Å; T2610-V2615 HydrophobicContact CG2-CG2 4.17Å; T2610-V2615 VanDerWaalsContact OG1-CG2 3.31Å; T2610-V2615 WeakPolarHBondContact OG1-CG2 3.46Å
2611	R	51.6	Low	73.7	Confident	114 Å²	114	37.6 Å²	37.6	43%	0.43	21%	0.211	S	C	.	.			trans	-70.1	150.4	-174.7	-50.9	176.6	174.9	159.6	2.2	109	E2339 E2613 D2614	E2339-R2611 IonicContact OE1-CZ 2.7Å; E2339-R2611 IonicContact OE1-NH1 2.69Å; E2339-R2611 PolarHBondContact OE1-NH1 2.77Å; E2339-R2611 IonicContact OE1-NH2 2.83Å; E2339-R2611 PolarHBondContact OE1-NH2 2.96Å; R2611-E2613 PolarHBondContact O-N 2.98Å; R2611-D2614 WeakPolarHBondContact CA-OD2 3.3Å; R2611-D2614 WeakPolarHBondContact CB-OD2 3.19Å; R2611-D2614 PolarHBondContact N-OD2 2.85Å; R2611-D2614 PolarHBondContact O-N 2.65Å; R2611-D2614 VanDerWaalsContact O-N 3.09Å
2612	P	50.1	Low	73.4	Confident	94 Å²	94	43.6 Å²	43.6	61%	0.61	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-15.6	179.1	-25.9	35.4	0	0	0	114.4	G2616	P2612-G2616 CarbonylContact O-C 3.59Å; P2612-G2616 VanDerWaalsContact O-CA 3.31Å; P2612-G2616 WeakPolarHBondContact O-CA 3.4Å; P2612-G2616 PolarHBondContact O-N 3.27Å
2613	E	51	Low	73	Confident	155 Å²	155	48.4 Å²	48.4	72%	0.724	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-28.1	-178.5	-52.9	-173.1	-114.7	0	0	113	R2611	R2611-E2613 PolarHBondContact O-N 2.98Å
2614	D	56.9	Low	72.8	Confident	7 Å²	7	49 Å²	49	4%	0.037	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-48.5	-171.9	-49.4	-55.1	0	0	0	112.3	N2335 L2498 R2611	N2335-D2614 PolarHBondContact ND2-OD1 3.23Å; L2498-D2614 HydrophobicContact CD1-CB 4.04Å; L2498-D2614 HydrophobicContact CD2-CB 3.92Å; R2611-D2614 WeakPolarHBondContact CA-OD2 3.3Å; R2611-D2614 WeakPolarHBondContact CB-OD2 3.19Å; R2611-D2614 PolarHBondContact N-OD2 2.85Å; R2611-D2614 PolarHBondContact O-N 2.65Å; R2611-D2614 VanDerWaalsContact O-N 3.09Å
2615	V	69.3	Low	72.8	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.012	26%	0.262	C	S	.	.	S	Bend	trans	-96.4	-15.8	-176.5	-143.6	0	0	0	0	112.4	R2494 Y2495 L2498 T2610 Y2619 G2620	R2494-V2615 HydrophobicContact CB-CG1 4.02Å; R2494-V2615 HydrophobicContact CG-CG1 3.94Å; Y2495-V2615 HydrophobicContact CD2-CG2 4.37Å; L2498-V2615 HydrophobicContact CD1-CG2 4.45Å; L2498-V2615 HydrophobicContact CD2-CG2 4Å; T2610-V2615 HydrophobicContact CG2-CG2 4.17Å; T2610-V2615 VanDerWaalsContact OG1-CG2 3.31Å; T2610-V2615 WeakPolarHBondContact OG1-CG2 3.46Å; V2615-Y2619 HydrophobicContact CB-CD1 3.88Å; V2615-Y2619 HydrophobicContact CG1-CD1 4.01Å; V2615-Y2619 HydrophobicContact CG1-CG 4.23Å; V2615-Y2619 HydrophobicContact CG2-CD1 4.35Å; V2615-Y2619 CarbonylContact O-C 3.42Å; V2615-Y2619 WeakPolarHBondContact O-CA 3.48Å; V2615-G2620 PolarHBondContact O-N 2.87Å
2616	G	67.4	Low	72.6	Confident	25 Å²	25	51.3 Å²	51.3	26%	0.258	28%	0.28	S	S	.	.			trans	76.2	154.4	-165.8	0	0	0	0	0	112.4	P2612 D2618 Y2619	P2612-G2616 CarbonylContact O-C 3.59Å; P2612-G2616 VanDerWaalsContact O-CA 3.31Å; P2612-G2616 WeakPolarHBondContact O-CA 3.4Å; P2612-G2616 PolarHBondContact O-N 3.27Å; G2616-D2618 PolarHBondContact O-N 3.42Å; G2616-Y2619 PolarHBondContact O-N 3.03Å
2617	N	79.7	Confident	72.9	Confident	106 Å²	106	51.1 Å²	51.1	57%	0.567	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-3.6	-174.2	-158.1	5.6	0	0	0	114.2	K2604 V2631	K2604-N2617 WeakPolarHBondContact CE-O 3.2Å; K2604-N2617 PolarHBondContact NZ-O 2.96Å; K2604-N2617 PolarHBondContact NZ-OD1 3.31Å; N2617-V2631 WeakPolarHBondContact O-CG1 3.49Å
2618	D	88.3	Confident	73.6	Confident	19 Å²	19	50.7 Å²	50.7	10%	0.102	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	14.2	171.4	71.8	-37	0	0	0	112.9	L2602 G2616 G2620 L2621 K2622 V2629 V2631	L2602-D2618 VanDerWaalsContact CD2-C 3.49Å; L2602-D2618 WeakPolarHBondContact CD2-O 3.35Å; G2616-D2618 PolarHBondContact O-N 3.42Å; D2618-G2620 PolarHBondContact O-N 3.5Å; D2618-G2620 VanDerWaalsContact O-N 3.12Å; D2618-G2620 PolarHBondContact OD1-N 3.23Å; D2618-L2621 WeakPolarHBondContact O-CB 3.33Å; D2618-L2621 WeakPolarHBondContact O-CG 3.48Å; D2618-L2621 PolarHBondContact O-N 3.2Å; D2618-L2621 VanDerWaalsContact O-N 3.07Å; D2618-L2621 PolarHBondContact OD2-N 3.18Å; D2618-K2622 VanDerWaalsContact OD2-CB 3.31Å; D2618-K2622 WeakPolarHBondContact OD2-CB 3.32Å; D2618-K2622 VanDerWaalsContact OD2-CD 3.31Å; D2618-K2622 WeakPolarHBondContact OD2-CD 3.31Å; D2618-K2622 WeakPolarHBondContact OD2-CG 3.42Å; D2618-K2622 PolarHBondContact OD2-N 3.23Å; D2618-V2629 HydrophobicContact CB-CG1 4.14Å; D2618-V2631 HydrophobicContact CB-CG2 3.96Å
2619	Y	89.8	Confident	75.1	Confident	13 Å²	13	50.9 Å²	50.9	5%	0.051	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.9	35.7	-167.6	-65.9	-14.6	0	0	0	112.7	D2490 S2492 R2494 Y2495 L2602 K2604 V2615 G2616 L2621	D2490-Y2619 PolarHBondContact OD1-OH 2.93Å; S2492-Y2619 WeakPolarHBondContact CB-O 3.39Å; S2492-Y2619 WeakPolarHBondContact OG-CB 3.38Å; S2492-Y2619 PolarHBondContact OG-O 3.01Å; R2494-Y2619 WeakPolarHBondContact CB-O 3.48Å; Y2495-Y2619 HydrophobicContact CD1-CE2 4.48Å; Y2495-Y2619 HydrophobicContact CD2-CD1 4.22Å; Y2495-Y2619 AromaticContact CD2-CD2 3.92Å; Y2495-Y2619 HydrophobicContact CD2-CD2 3.92Å; Y2495-Y2619 AromaticContact CD2-CE1 3.89Å; Y2495-Y2619 HydrophobicContact CD2-CE1 3.89Å; Y2495-Y2619 AromaticContact CD2-CE2 3.59Å; Y2495-Y2619 HydrophobicContact CD2-CE2 3.59Å; Y2495-Y2619 HydrophobicContact CD2-CG 4.22Å; Y2495-Y2619 AromaticContact CD2-CZ 3.56Å; Y2495-Y2619 HydrophobicContact CE2-CE1 4.1Å; Y2495-Y2619 AromaticContact CE2-CE2 3.75Å; Y2495-Y2619 HydrophobicContact CE2-CE2 3.75Å; Y2495-Y2619 AromaticContact CE2-CZ 3.48Å; Y2495-Y2619 VanDerWaalsContact CE2-CZ 3.48Å; Y2495-Y2619 WeakPolarHBondContact CE2-OH 3.48Å; Y2495-Y2619 HydrophobicContact CG-CD2 4.01Å; Y2495-Y2619 AromaticContact CG-CE2 3.97Å; Y2495-Y2619 HydrophobicContact CG-CE2 3.97Å; L2602-Y2619 HydrophobicContact CD1-CD2 4Å; L2602-Y2619 HydrophobicContact CD2-CD2 3.82Å; L2602-Y2619 HydrophobicContact CD2-CG 3.84Å; L2602-Y2619 HydrophobicContact CG-CD2 4.49Å; K2604-Y2619 HydrophobicContact CB-CE2 3.71Å; K2604-Y2619 HydrophobicContact CD-CD1 3.88Å; K2604-Y2619 HydrophobicContact CD-CD2 4.06Å; K2604-Y2619 HydrophobicContact CD-CE1 3.47Å; K2604-Y2619 VanDerWaalsContact CD-CE1 3.47Å; K2604-Y2619 HydrophobicContact CD-CE2 3.65Å; K2604-Y2619 HydrophobicContact CD-CG 4.17Å; K2604-Y2619 HydrophobicContact CG-CE2 4.36Å; V2615-Y2619 HydrophobicContact CB-CD1 3.88Å; V2615-Y2619 HydrophobicContact CG1-CD1 4.01Å; V2615-Y2619 HydrophobicContact CG1-CG 4.23Å; V2615-Y2619 HydrophobicContact CG2-CD1 4.35Å; V2615-Y2619 CarbonylContact O-C 3.42Å; V2615-Y2619 WeakPolarHBondContact O-CA 3.48Å; G2616-Y2619 PolarHBondContact O-N 3.03Å; Y2619-L2621 PolarHBondContact O-N 3.48Å
2620	G	86.4	Confident	76.9	Confident	6 Å²	6	53.6 Å²	53.6	6%	0.062	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.9	11.3	178.3	0	0	0	0	0	115.1	H2493 V2615 D2618 K2622 E2623	H2493-G2620 PolarHBondContact CE1-O 3.24Å; V2615-G2620 PolarHBondContact O-N 2.87Å; D2618-G2620 PolarHBondContact O-N 3.5Å; D2618-G2620 VanDerWaalsContact O-N 3.12Å; D2618-G2620 PolarHBondContact OD1-N 3.23Å; G2620-K2622 PolarHBondContact O-N 2.93Å; G2620-K2622 VanDerWaalsContact O-N 3.16Å; G2620-E2623 WeakPolarHBondContact O-CB 3.45Å; G2620-E2623 PolarHBondContact O-N 2.98Å
2621	L	89.6	Confident	78.8	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.005	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-59.1	-28.9	-176.9	-75.4	169.8	0	0	0	113.1	L2488 L2602 D2618 Y2619 E2623 V2624 V2625 V2629	L2488-L2621 HydrophobicContact CD1-CD1 3.88Å; L2488-L2621 HydrophobicContact CD1-CD2 3.56Å; L2488-L2621 HydrophobicContact CD1-CG 4.39Å; L2602-L2621 HydrophobicContact CB-CD1 3.78Å; L2602-L2621 HydrophobicContact CD1-CD1 4.35Å; L2602-L2621 HydrophobicContact CD2-CD1 3.99Å; L2602-L2621 HydrophobicContact CG-CD1 4.26Å; D2618-L2621 WeakPolarHBondContact O-CB 3.33Å; D2618-L2621 WeakPolarHBondContact O-CG 3.48Å; D2618-L2621 PolarHBondContact O-N 3.2Å; D2618-L2621 VanDerWaalsContact O-N 3.07Å; D2618-L2621 PolarHBondContact OD2-N 3.18Å; Y2619-L2621 PolarHBondContact O-N 3.48Å; L2621-E2623 PolarHBondContact O-N 2.98Å; L2621-E2623 VanDerWaalsContact O-N 3.09Å; L2621-V2624 HydrophobicContact CD2-CG2 4.25Å; L2621-V2624 CarbonylContact O-C 3.6Å; L2621-V2624 WeakPolarHBondContact O-CG2 3.31Å; L2621-V2624 PolarHBondContact O-N 3.42Å; L2621-V2625 HydrophobicContact CB-CG2 4.2Å; L2621-V2625 HydrophobicContact CD2-CG2 4.47Å; L2621-V2625 WeakPolarHBondContact O-CB 3.42Å; L2621-V2625 WeakPolarHBondContact O-CG2 3.37Å; L2621-V2625 PolarHBondContact O-N 2.96Å; L2621-V2629 HydrophobicContact CB-CB 4.49Å; L2621-V2629 HydrophobicContact CB-CG1 3.92Å; L2621-V2629 HydrophobicContact CB-CG2 3.77Å; L2621-V2629 HydrophobicContact CD1-CG1 3.95Å
2622	K	86.3	Confident	80.6	Confident	137 Å²	137	53.3 Å²	53.3	60%	0.596	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-60	-16	172.6	-73.4	163.8	-171.1	167	0	114.7	D2618 G2620 V2624 V2629	D2618-K2622 VanDerWaalsContact OD2-CB 3.31Å; D2618-K2622 WeakPolarHBondContact OD2-CB 3.32Å; D2618-K2622 VanDerWaalsContact OD2-CD 3.31Å; D2618-K2622 WeakPolarHBondContact OD2-CD 3.31Å; D2618-K2622 WeakPolarHBondContact OD2-CG 3.42Å; D2618-K2622 PolarHBondContact OD2-N 3.23Å; G2620-K2622 PolarHBondContact O-N 2.93Å; G2620-K2622 VanDerWaalsContact O-N 3.16Å; K2622-V2624 VanDerWaalsContact C-N 3.33Å; K2622-V2629 HydrophobicContact CG-CB 4.41Å; K2622-V2629 HydrophobicContact CG-CG2 3.94Å
2623	E	86.2	Confident	82.5	Confident	101 Å²	101	52.8 Å²	52.8	47%	0.472	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-73.4	-26.6	171.7	-64.2	-175.5	143.2	0	0	112	R2494 K2595 G2620 L2621	R2494-E2623 IonicContact CZ-OE2 3.58Å; R2494-E2623 IonicContact NH1-OE1 3.59Å; R2494-E2623 PolarHBondContact NH1-OE1 3.36Å; R2494-E2623 IonicContact NH1-OE2 2.74Å; R2494-E2623 PolarHBondContact NH1-OE2 3.43Å; K2595-E2623 WeakPolarHBondContact CE-O 3.32Å; K2595-E2623 PolarHBondContact NZ-O 2.64Å; G2620-E2623 WeakPolarHBondContact O-CB 3.45Å; G2620-E2623 PolarHBondContact O-N 2.98Å; L2621-E2623 PolarHBondContact O-N 2.98Å; L2621-E2623 VanDerWaalsContact O-N 3.09Å
2624	V	89.5	Confident	84.2	Confident	12 Å²	12	45.5 Å²	45.5	7%	0.073	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.7	-12.2	-172.6	-59.6	0	0	0	0	114.6	F2466 P2592 K2595 Y2596 L2621 K2622	F2466-V2624 HydrophobicContact CE1-CB 4.43Å; F2466-V2624 HydrophobicContact CE1-CG2 4.45Å; F2466-V2624 HydrophobicContact CE2-CB 4.24Å; F2466-V2624 HydrophobicContact CE2-CG2 3.67Å; F2466-V2624 HydrophobicContact CZ-CB 3.69Å; F2466-V2624 HydrophobicContact CZ-CG2 3.62Å; P2592-V2624 HydrophobicContact CB-CG1 4.49Å; P2592-V2624 HydrophobicContact CG-CG1 3.83Å; K2595-V2624 CarbonylContact C-O 3.55Å; K2595-V2624 WeakPolarHBondContact CA-O 3.24Å; K2595-V2624 VanDerWaalsContact CB-O 3.27Å; K2595-V2624 WeakPolarHBondContact CB-O 3.45Å; Y2596-V2624 PolarHBondContact N-O 3.48Å; L2621-V2624 HydrophobicContact CD2-CG2 4.25Å; L2621-V2624 CarbonylContact O-C 3.6Å; L2621-V2624 WeakPolarHBondContact O-CG2 3.31Å; L2621-V2624 PolarHBondContact O-N 3.42Å; K2622-V2624 VanDerWaalsContact C-N 3.33Å
2625	V	90.8	Very high	85.1	Confident	7 Å²	7	47.4 Å²	47.4	4%	0.042	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-101	139.4	173.5	177	0	0	0	0	109.3	F2466 Y2596 G2598 A2600 L2621 V2629	F2466-V2625 HydrophobicContact CE2-CG2 4.09Å; Y2596-V2625 HydrophobicContact CD1-CG1 4.37Å; G2598-V2625 VanDerWaalsContact O-CG1 3.26Å; G2598-V2625 WeakPolarHBondContact O-CG1 3.43Å; A2600-V2625 HydrophobicContact CB-CG1 4.08Å; A2600-V2625 HydrophobicContact CB-CG2 3.96Å; L2621-V2625 HydrophobicContact CB-CG2 4.2Å; L2621-V2625 HydrophobicContact CD2-CG2 4.47Å; L2621-V2625 WeakPolarHBondContact O-CB 3.42Å; L2621-V2625 WeakPolarHBondContact O-CG2 3.37Å; L2621-V2625 PolarHBondContact O-N 2.96Å; V2625-V2629 HydrophobicContact CB-CG2 3.85Å; V2625-V2629 HydrophobicContact CG1-CG2 3.93Å; V2625-V2629 HydrophobicContact CG2-CG2 4.2Å
2626	S	82.9	Confident	85.4	Confident	62 Å²	62	47.5 Å²	47.5	43%	0.434	26%	0.263	S	S	.	.	S	Bend	trans	-100	-23.9	-176	-42	0	0	0	0	113.4	Y2596	Y2596-S2626 VanDerWaalsContact O-CB 3.3Å; Y2596-S2626 WeakPolarHBondContact O-CB 3.49Å; Y2596-S2626 PolarHBondContact O-N 3.35Å; Y2596-S2626 PolarHBondContact O-OG 3.07Å
2627	G	81.2	Confident	86	Confident	32 Å²	32	49.1 Å²	49.1	33%	0.33	27%	0.265	S	S	.	.	S	Bend	trans	-93.8	-156.1	172.4	0	0	0	0	0	112.7	G2598	G2598-G2627 VanDerWaalsContact O-CA 3.27Å; G2598-G2627 WeakPolarHBondContact O-CA 3.49Å; G2598-G2627 PolarHBondContact O-N 2.7Å; G2598-G2627 VanDerWaalsContact O-N 3.14Å
2628	N	83.6	Confident	86.1	Confident	97 Å²	97	45.8 Å²	45.8	52%	0.519	25%	0.246	S	C	.	.			trans	-76.8	139.2	179	-57.8	-80.1	0	0	0	110.9	D2599 A2600 F2630	D2599-N2628 CarbonylContact C-O 3.6Å; D2599-N2628 VanDerWaalsContact CA-O 3.28Å; D2599-N2628 WeakPolarHBondContact CA-O 3.46Å; D2599-N2628 WeakPolarHBondContact OD1-CB 3.47Å; D2599-N2628 PolarHBondContact OD1-N 3.23Å; D2599-N2628 PolarHBondContact OD1-ND2 3.25Å; A2600-N2628 PolarHBondContact N-O 2.79Å; N2628-F2630 HydrophobicContact CB-CD2 4.26Å; N2628-F2630 HydrophobicContact CB-CE2 3.67Å; N2628-F2630 HydrophobicContact CB-CZ 3.84Å
2629	V	90.7	Very high	85.8	Confident	17 Å²	17	46.5 Å²	46.5	10%	0.103	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	109	164.7	-176.1	0	0	0	0	107.9	A2600 D2618 L2621 K2622 V2625 V2631	A2600-V2629 WeakPolarHBondContact O-CA 3.43Å; D2618-V2629 HydrophobicContact CB-CG1 4.14Å; L2621-V2629 HydrophobicContact CB-CB 4.49Å; L2621-V2629 HydrophobicContact CB-CG1 3.92Å; L2621-V2629 HydrophobicContact CB-CG2 3.77Å; L2621-V2629 HydrophobicContact CD1-CG1 3.95Å; K2622-V2629 HydrophobicContact CG-CB 4.41Å; K2622-V2629 HydrophobicContact CG-CG2 3.94Å; V2625-V2629 HydrophobicContact CB-CG2 3.85Å; V2625-V2629 HydrophobicContact CG1-CG2 3.93Å; V2625-V2629 HydrophobicContact CG2-CG2 4.2Å; V2629-V2631 HydrophobicContact CG1-CG2 4.15Å
2630	F	90.6	Very high	85.5	Confident	101 Å²	101	47 Å²	47	44%	0.443	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	130.3	171.4	-64.4	-79	0	0	0	108.8	D2599 A2600 V2601 L2602 N2628	D2599-F2630 HydrophobicContact CB-CD2 4.44Å; D2599-F2630 HydrophobicContact CB-CE2 4.03Å; A2600-F2630 PolarHBondContact O-N 2.71Å; V2601-F2630 HydrophobicContact CG2-CB 4.39Å; L2602-F2630 PolarHBondContact N-O 3.05Å; N2628-F2630 HydrophobicContact CB-CD2 4.26Å; N2628-F2630 HydrophobicContact CB-CE2 3.67Å; N2628-F2630 HydrophobicContact CB-CZ 3.84Å
2631	V	92.5	Very high	85.6	Confident	53 Å²	53	46.7 Å²	46.7	32%	0.321	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	123.3	-176.2	176.4	0	0	0	0	108.9	L2602 N2617 D2618 V2629	L2602-V2631 WeakPolarHBondContact O-CA 3.47Å; N2617-V2631 WeakPolarHBondContact O-CG1 3.49Å; D2618-V2631 HydrophobicContact CB-CG2 3.96Å; V2629-V2631 HydrophobicContact CG1-CG2 4.15Å
2632	H	91	Very high	85.5	Confident	73 Å²	73	46.7 Å²	46.7	34%	0.338	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	143.6	171.1	-57.7	-102.1	0	0	0	108.6	L2602 K2604 I2653	L2602-H2632 PolarHBondContact O-N 3.49Å; K2604-H2632 PolarHBondContact N-O 3.18Å; H2632-I2653 HydrophobicContact CB-CD1 3.86Å; H2632-I2653 HydrophobicContact CB-CG2 4.11Å
2633	V	89	Confident	85.4	Confident	83 Å²	83	41.2 Å²	41.2	50%	0.503	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	131.3	171.2	-176.7	0	0	0	0	107.5	K2604	K2604-V2633 HydrophobicContact CG-CG2 4.44Å; K2604-V2633 CarbonylContact O-C 3.56Å; K2604-V2633 VanDerWaalsContact O-CA 3.29Å; K2604-V2633 WeakPolarHBondContact O-CA 3.49Å
2634	V	85.9	Confident	85	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138.1	176.4	174.1	0	0	0	0	107.9	I2603 K2604 S2605 S2606 G2636 F2641 K2649 I2653	I2603-V2634 HydrophobicContact CG2-CB 4.38Å; I2603-V2634 HydrophobicContact CG2-CG2 3.52Å; K2604-V2634 PolarHBondContact O-N 3.33Å; S2605-V2634 CarbonylContact C-O 3.35Å; S2605-V2634 WeakPolarHBondContact CA-O 3.3Å; S2606-V2634 PolarHBondContact N-O 3.09Å; V2634-G2636 PolarHBondContact O-N 3.25Å; V2634-F2641 HydrophobicContact CB-CB 4.32Å; V2634-F2641 HydrophobicContact CB-CD2 4.2Å; V2634-F2641 HydrophobicContact CG1-CB 3.97Å; V2634-F2641 HydrophobicContact CG1-CD2 4.46Å; V2634-K2649 HydrophobicContact CG1-CB 3.93Å; V2634-K2649 HydrophobicContact CG1-CD 4.29Å; V2634-K2649 HydrophobicContact CG2-CB 4.3Å; V2634-I2653 HydrophobicContact CG2-CD1 3.58Å
2635	D	76.4	Confident	84.2	Confident	48 Å²	48	40.3 Å²	40.3	26%	0.257	23%	0.225	S	C	.	.	S	Bend	trans	-65.2	130.3	177.1	-59.6	-78.5	0	0	0	110.1	E854 S2606 K2649	E854-D2635 WeakPolarHBondContact CB-OD1 3.48Å; E854-D2635 PolarHBondContact N-OD1 3.1Å; S2606-D2635 WeakPolarHBondContact OG-CA 3.41Å; D2635-K2649 IonicContact OD2-NZ 2.6Å; D2635-K2649 PolarHBondContact OD2-NZ 3.19Å
2636	G	76.6	Confident	83.8	Confident	4 Å²	4	40.2 Å²	40.2	4%	0.041	23%	0.225	C	C	.	.	S	Bend	trans	148.4	169.6	-175.2	0	0	0	0	0	112.6	S2605 S2606 K2607 V2634	S2605-G2636 VanDerWaalsContact CB-O 3.27Å; S2605-G2636 WeakPolarHBondContact CB-O 3.37Å; S2605-G2636 PolarHBondContact OG-O 2.7Å; S2606-G2636 PolarHBondContact N-O 2.92Å; S2606-G2636 PolarHBondContact OG-N 3.01Å; S2606-G2636 PolarHBondContact OG-O 3.11Å; S2606-G2636 VanDerWaalsContact OG-O 3.1Å; K2607-G2636 WeakPolarHBondContact CB-O 3.39Å; K2607-G2636 PolarHBondContact N-O 3.5Å; V2634-G2636 PolarHBondContact O-N 3.25Å
2637	D	78.8	Confident	84	Confident	58 Å²	58	37.3 Å²	37.3	31%	0.31	21%	0.205	S	C	.	.			trans	-88.6	-167.7	161.7	60.4	67.3	0	0	0	110.5	S2605 K2607 Y2639 S2640 F2641	S2605-D2637 WeakPolarHBondContact CB-O 3.45Å; S2605-D2637 PolarHBondContact OG-O 3.39Å; K2607-D2637 HydrophobicContact CB-CB 4.25Å; K2607-D2637 HydrophobicContact CD-CB 4.49Å; D2637-Y2639 PolarHBondContact O-N 3.18Å; D2637-Y2639 WeakPolarHBondContact OD1-CA 3.31Å; D2637-Y2639 PolarHBondContact OD1-N 3.28Å; D2637-S2640 PolarHBondContact N-OG 3.29Å; D2637-S2640 PolarHBondContact OD1-N 3.41Å; D2637-S2640 PolarHBondContact OD1-OG 3.37Å; D2637-S2640 PolarHBondContact OD2-OG 2.93Å; D2637-F2641 VanDerWaalsContact O-CD1 3.32Å; D2637-F2641 WeakPolarHBondContact O-CD1 3.43Å
2638	H	82.7	Confident	84.3	Confident	36 Å²	36	39 Å²	39	17%	0.167	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-31.6	-178.7	-167.7	62.6	0	0	0	113.4	Y2458 S2459 D2490 F2641	Y2458-H2638 AromaticContact CE2-CE1 3.89Å; Y2458-H2638 AromaticContact CE2-NE2 3.87Å; Y2458-H2638 WeakPolarHBondContact CE2-O 3.41Å; Y2458-H2638 AromaticContact CZ-NE2 3.93Å; Y2458-H2638 PolarHBondContact OH-CD2 3.3Å; Y2458-H2638 PolarHBondContact OH-O 3.43Å; S2459-H2638 WeakPolarHBondContact CB-NE2 3.18Å; S2459-H2638 PolarHBondContact OG-NE2 2.93Å; D2490-H2638 PolarHBondContact O-CE1 3.02Å; D2490-H2638 IonicContact OD2-CE1 2.88Å; D2490-H2638 IonicContact OD2-CG 2.8Å; D2490-H2638 IonicContact OD2-ND1 3.78Å; D2490-H2638 PolarHBondContact OD2-ND1 3.27Å; H2638-F2641 VanDerWaalsContact O-CD1 3.31Å; H2638-F2641 WeakPolarHBondContact O-CD1 3.5Å; H2638-F2641 VanDerWaalsContact O-CE1 3.23Å; H2638-F2641 WeakPolarHBondContact O-CE1 3.42Å
2639	Y	82.5	Confident	84.4	Confident	35 Å²	35	39.1 Å²	39.1	14%	0.137	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-50.4	-179.7	-168.6	-101.2	0	0	0	112	Y2371 P2407 D2637 F2641 I2642 H2643	Y2371-Y2639 AromaticContact CD1-CD1 3.76Å; Y2371-Y2639 HydrophobicContact CD1-CD1 3.76Å; Y2371-Y2639 AromaticContact CD1-CD2 3.72Å; Y2371-Y2639 HydrophobicContact CD1-CD2 3.72Å; Y2371-Y2639 AromaticContact CD1-CE1 3.61Å; Y2371-Y2639 HydrophobicContact CD1-CE1 3.61Å; Y2371-Y2639 AromaticContact CD1-CE2 3.56Å; Y2371-Y2639 HydrophobicContact CD1-CE2 3.56Å; Y2371-Y2639 AromaticContact CD1-CG 3.81Å; Y2371-Y2639 HydrophobicContact CD1-CG 3.81Å; Y2371-Y2639 AromaticContact CD1-CZ 3.49Å; Y2371-Y2639 VanDerWaalsContact CD1-CZ 3.49Å; Y2371-Y2639 AromaticContact CD2-CD2 3.44Å; Y2371-Y2639 HydrophobicContact CD2-CD2 3.44Å; Y2371-Y2639 VanDerWaalsContact CD2-CD2 3.44Å; Y2371-Y2639 AromaticContact CD2-CE2 3.89Å; Y2371-Y2639 HydrophobicContact CD2-CE2 3.89Å; Y2371-Y2639 AromaticContact CD2-CG 3.85Å; Y2371-Y2639 HydrophobicContact CD2-CG 3.85Å; Y2371-Y2639 AromaticContact CE1-CD1 3.61Å; Y2371-Y2639 HydrophobicContact CE1-CD1 3.61Å; Y2371-Y2639 HydrophobicContact CE1-CD2 4.14Å; Y2371-Y2639 AromaticContact CE1-CE1 3.86Å; Y2371-Y2639 HydrophobicContact CE1-CE1 3.86Å; Y2371-Y2639 HydrophobicContact CE1-CE2 4.35Å; Y2371-Y2639 AromaticContact CE1-CG 3.75Å; Y2371-Y2639 HydrophobicContact CE1-CG 3.75Å; Y2371-Y2639 HydrophobicContact CE2-CD1 4.48Å; Y2371-Y2639 AromaticContact CE2-CD2 3.88Å; Y2371-Y2639 HydrophobicContact CE2-CD2 3.88Å; Y2371-Y2639 AromaticContact CE2-CG 3.79Å; Y2371-Y2639 HydrophobicContact CE2-CG 3.79Å; Y2371-Y2639 HydrophobicContact CG-CD1 4.28Å; Y2371-Y2639 AromaticContact CG-CD2 3.35Å; Y2371-Y2639 HydrophobicContact CG-CD2 3.35Å; Y2371-Y2639 HydrophobicContact CG-CE1 4.23Å; Y2371-Y2639 AromaticContact CG-CE2 3.28Å; Y2371-Y2639 HydrophobicContact CG-CE2 3.28Å; Y2371-Y2639 AromaticContact CG-CG 3.86Å; Y2371-Y2639 HydrophobicContact CG-CG 3.86Å; Y2371-Y2639 AromaticContact CG-CZ 3.74Å; Y2371-Y2639 AromaticContact CZ-CD1 3.99Å; Y2371-Y2639 AromaticContact CZ-CG 3.73Å; P2407-Y2639 HydrophobicContact CB-CE2 3.88Å; P2407-Y2639 HydrophobicContact CG-CE2 4.21Å; D2637-Y2639 PolarHBondContact O-N 3.18Å; D2637-Y2639 WeakPolarHBondContact OD1-CA 3.31Å; D2637-Y2639 PolarHBondContact OD1-N 3.28Å; Y2639-F2641 PolarHBondContact O-N 3.2Å; Y2639-I2642 WeakPolarHBondContact O-CG1 3.42Å; Y2639-I2642 PolarHBondContact O-N 3.37Å; Y2639-H2643 HydrophobicContact CD1-CB 3.93Å; Y2639-H2643 HydrophobicContact CE1-CB 3.63Å; Y2639-H2643 AromaticContact CE1-CD2 3.59Å; Y2639-H2643 AromaticContact CE1-CG 3.46Å; Y2639-H2643 VanDerWaalsContact CE1-CG 3.46Å; Y2639-H2643 AromaticContact CZ-CD2 3.66Å; Y2639-H2643 AromaticContact CZ-CE1 3.85Å; Y2639-H2643 AromaticContact CZ-CG 3.6Å; Y2639-H2643 AromaticContact CZ-ND1 3.74Å; Y2639-H2643 AromaticContact CZ-NE2 3.82Å; Y2639-H2643 PolarHBondContact O-N 3.28Å; Y2639-H2643 VanDerWaalsContact O-N 3.08Å; Y2639-H2643 PolarHBondContact OH-CD2 2.97Å; Y2639-H2643 VanDerWaalsContact OH-CD2 3.29Å; Y2639-H2643 PolarHBondContact OH-CE1 3.3Å; Y2639-H2643 PolarHBondContact OH-NE2 2.61Å
2640	S	82.7	Confident	84.4	Confident	23 Å²	23	38.3 Å²	38.3	16%	0.161	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	2.2	-172.4	60.2	0	0	0	0	115.5	D2637 H2643 G2646	D2637-S2640 PolarHBondContact N-OG 3.29Å; D2637-S2640 PolarHBondContact OD1-N 3.41Å; D2637-S2640 PolarHBondContact OD1-OG 3.37Å; D2637-S2640 PolarHBondContact OD2-OG 2.93Å; S2640-H2643 CarbonylContact C-O 3.52Å; S2640-G2646 PolarHBondContact O-N 3.01Å
2641	F	88	Confident	84.4	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-12	168.2	97	-75.2	0	0	0	114.4	Y2458 L2489 D2490 I2603 V2634 D2637 H2638 Y2639 G2646 T2650	Y2458-F2641 HydrophobicContact CD2-CE1 4.32Å; Y2458-F2641 HydrophobicContact CD2-CZ 4.38Å; Y2458-F2641 AromaticContact CE2-CE1 3.95Å; Y2458-F2641 HydrophobicContact CE2-CE1 3.95Å; Y2458-F2641 HydrophobicContact CE2-CZ 4.46Å; L2489-F2641 HydrophobicContact CB-CE2 4.23Å; L2489-F2641 HydrophobicContact CB-CZ 3.8Å; D2490-F2641 HydrophobicContact CB-CD1 4.3Å; D2490-F2641 HydrophobicContact CB-CE1 3.33Å; D2490-F2641 HydrophobicContact CB-CE2 4.33Å; D2490-F2641 HydrophobicContact CB-CZ 3.35Å; I2603-F2641 HydrophobicContact CB-CE2 4.45Å; I2603-F2641 HydrophobicContact CG2-CD2 4.29Å; I2603-F2641 HydrophobicContact CG2-CE2 4.06Å; V2634-F2641 HydrophobicContact CB-CB 4.32Å; V2634-F2641 HydrophobicContact CB-CD2 4.2Å; V2634-F2641 HydrophobicContact CG1-CB 3.97Å; V2634-F2641 HydrophobicContact CG1-CD2 4.46Å; D2637-F2641 VanDerWaalsContact O-CD1 3.32Å; D2637-F2641 WeakPolarHBondContact O-CD1 3.43Å; H2638-F2641 VanDerWaalsContact O-CD1 3.31Å; H2638-F2641 WeakPolarHBondContact O-CD1 3.5Å; H2638-F2641 VanDerWaalsContact O-CE1 3.23Å; H2638-F2641 WeakPolarHBondContact O-CE1 3.42Å; Y2639-F2641 PolarHBondContact O-N 3.2Å; F2641-G2646 CarbonylContact O-C 3.39Å; F2641-G2646 VanDerWaalsContact O-C 3.26Å; F2641-T2650 PolarHBondContact O-OG1 3.43Å
2642	I	87.7	Confident	84.2	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-3.8	172.6	65.6	153.9	0	0	0	113.7	P2407 L2408 L2411 Y2458 L2489 Y2639 V2647 T2650	P2407-I2642 WeakPolarHBondContact O-CD1 3.43Å; L2408-I2642 HydrophobicContact CD2-CD1 3.98Å; L2411-I2642 HydrophobicContact CD2-CG2 4.46Å; Y2458-I2642 HydrophobicContact CD1-CD1 3.42Å; Y2458-I2642 VanDerWaalsContact CD1-CD1 3.42Å; Y2458-I2642 HydrophobicContact CD2-CD1 3.86Å; Y2458-I2642 HydrophobicContact CD2-CG2 4.42Å; Y2458-I2642 HydrophobicContact CE1-CD1 3.28Å; Y2458-I2642 HydrophobicContact CE1-CG1 4.36Å; Y2458-I2642 HydrophobicContact CE2-CD1 3.75Å; Y2458-I2642 HydrophobicContact CE2-CG1 4.17Å; Y2458-I2642 HydrophobicContact CG-CD1 3.73Å; Y2458-I2642 VanDerWaalsContact CZ-CD1 3.45Å; L2489-I2642 HydrophobicContact CD1-CG2 4.11Å; Y2639-I2642 WeakPolarHBondContact O-CG1 3.42Å; Y2639-I2642 PolarHBondContact O-N 3.37Å; I2642-V2647 WeakPolarHBondContact O-CG2 3.39Å; I2642-T2650 HydrophobicContact CG2-CG2 4.36Å
2643	H	83.8	Confident	84.3	Confident	22 Å²	22	32.4 Å²	32.4	10%	0.102	18%	0.176	C	C	.	.	S	Bend	trans	-114.7	177.1	162.3	-98.3	56.9	0	0	0	108.4	P2407 M2410 Y2639 S2640 D2645 V2647	P2407-H2643 PolarHBondContact O-CE1 3.22Å; P2407-H2643 PolarHBondContact O-ND1 3.22Å; P2407-H2643 VanDerWaalsContact O-ND1 3.1Å; M2410-H2643 HydrophobicContact SD-CB 4.32Å; Y2639-H2643 HydrophobicContact CD1-CB 3.93Å; Y2639-H2643 HydrophobicContact CE1-CB 3.63Å; Y2639-H2643 AromaticContact CE1-CD2 3.59Å; Y2639-H2643 AromaticContact CE1-CG 3.46Å; Y2639-H2643 VanDerWaalsContact CE1-CG 3.46Å; Y2639-H2643 AromaticContact CZ-CD2 3.66Å; Y2639-H2643 AromaticContact CZ-CE1 3.85Å; Y2639-H2643 AromaticContact CZ-CG 3.6Å; Y2639-H2643 AromaticContact CZ-ND1 3.74Å; Y2639-H2643 AromaticContact CZ-NE2 3.82Å; Y2639-H2643 PolarHBondContact O-N 3.28Å; Y2639-H2643 VanDerWaalsContact O-N 3.08Å; Y2639-H2643 PolarHBondContact OH-CD2 2.97Å; Y2639-H2643 VanDerWaalsContact OH-CD2 3.29Å; Y2639-H2643 PolarHBondContact OH-CE1 3.3Å; Y2639-H2643 PolarHBondContact OH-NE2 2.61Å; S2640-H2643 CarbonylContact C-O 3.52Å; H2643-D2645 PolarHBondContact O-N 2.97Å; H2643-V2647 PolarHBondContact O-N 2.83Å
2644	D	79.3	Confident	84.4	Confident	64 Å²	64	28.4 Å²	28.4	34%	0.342	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	-138.2	170.9	-42.8	-36.5	0	0	0	111	M2410 G2646 V2647	M2410-D2644 PolarHBondContact SD-N 2.89Å; M2410-D2644 VanDerWaalsContact SD-N 3.43Å; D2644-G2646 VanDerWaalsContact C-N 3.34Å; D2644-G2646 PolarHBondContact O-N 3.35Å; D2644-V2647 WeakPolarHBondContact O-CB 3.13Å; D2644-V2647 WeakPolarHBondContact O-CG1 3.31Å; D2644-V2647 PolarHBondContact O-N 2.97Å
2645	D	72.3	Confident	84.5	Confident	31 Å²	31	29.6 Å²	29.6	17%	0.166	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-19.1	-163.5	-59.2	9	0	0	0	113.7	L850 H851 H2643 V2647	L850-D2645 WeakPolarHBondContact CA-OD2 3.48Å; L850-D2645 WeakPolarHBondContact CB-OD2 3.46Å; H851-D2645 VanDerWaalsContact CA-OD2 3.24Å; H851-D2645 WeakPolarHBondContact CA-OD2 3.43Å; H851-D2645 HydrophobicContact CB-CB 4.48Å; H851-D2645 IonicContact CD2-OD2 2.76Å; H851-D2645 PolarHBondContact CD2-OD2 3.09Å; H851-D2645 IonicContact CE1-OD1 2.84Å; H851-D2645 PolarHBondContact CE1-OD1 2.75Å; H851-D2645 IonicContact CE1-OD2 2.67Å; H851-D2645 PolarHBondContact CE1-OD2 3.29Å; H851-D2645 VanDerWaalsContact CG-CG 3.5Å; H851-D2645 IonicContact CG-OD2 3.78Å; H851-D2645 PolarHBondContact N-OD2 3.26Å; H851-D2645 WeakPolarHBondContact ND1-CB 3.42Å; H851-D2645 VanDerWaalsContact ND1-CG 3.32Å; H851-D2645 IonicContact ND1-OD1 3.19Å; H851-D2645 IonicContact ND1-OD2 3.53Å; H851-D2645 PolarHBondContact ND1-OD2 2.88Å; H851-D2645 IonicContact NE2-OD1 3.24Å; H851-D2645 IonicContact NE2-OD2 2.65Å; H851-D2645 PolarHBondContact NE2-OD2 2.76Å; H2643-D2645 PolarHBondContact O-N 2.97Å; D2645-V2647 VanDerWaalsContact C-N 3.35Å
2646	G	81.4	Confident	84.9	Confident	5 Å²	5	32.1 Å²	32.1	5%	0.052	17%	0.173	C	C	.	.	H	α-helix	trans	-76.3	-22.8	173.6	0	0	0	0	0	113.1	S2640 F2641 D2644 D2648 K2649 T2650	S2640-G2646 PolarHBondContact O-N 3.01Å; F2641-G2646 CarbonylContact O-C 3.39Å; F2641-G2646 VanDerWaalsContact O-C 3.26Å; D2644-G2646 VanDerWaalsContact C-N 3.34Å; D2644-G2646 PolarHBondContact O-N 3.35Å; G2646-D2648 VanDerWaalsContact C-N 3.31Å; G2646-D2648 PolarHBondContact O-N 3.45Å; G2646-K2649 WeakPolarHBondContact O-CB 3.1Å; G2646-K2649 PolarHBondContact O-N 3.5Å; G2646-T2650 PolarHBondContact O-N 2.85Å; G2646-T2650 PolarHBondContact O-OG1 3.02Å
2647	V	88	Confident	85.3	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59.5	-40	-174.6	82.8	0	0	0	0	112.3	M2410 L2411 K2414 I2642 H2643 D2644 D2645 T2650 V2651	M2410-V2647 HydrophobicContact CG-CG1 4.48Å; M2410-V2647 HydrophobicContact CG-CG2 4.46Å; M2410-V2647 HydrophobicContact SD-CG1 4.45Å; L2411-V2647 HydrophobicContact CB-CG2 3.99Å; L2411-V2647 HydrophobicContact CD1-CG2 3.74Å; L2411-V2647 HydrophobicContact CG-CG2 4.5Å; K2414-V2647 HydrophobicContact CD-CG1 3.61Å; I2642-V2647 WeakPolarHBondContact O-CG2 3.39Å; H2643-V2647 PolarHBondContact O-N 2.83Å; D2644-V2647 WeakPolarHBondContact O-CB 3.13Å; D2644-V2647 WeakPolarHBondContact O-CG1 3.31Å; D2644-V2647 PolarHBondContact O-N 2.97Å; D2645-V2647 VanDerWaalsContact C-N 3.35Å; V2647-T2650 CarbonylContact O-C 3.55Å; V2647-T2650 PolarHBondContact O-N 3.26Å; V2647-V2651 HydrophobicContact CG2-CG2 4.41Å; V2647-V2651 WeakPolarHBondContact O-CB 3.25Å; V2647-V2651 VanDerWaalsContact O-CG2 3.3Å; V2647-V2651 WeakPolarHBondContact O-CG2 3.39Å; V2647-V2651 PolarHBondContact O-N 3.14Å
2648	D	86.5	Confident	85.6	Confident	69 Å²	69	30 Å²	30	37%	0.369	16%	0.163	S	C	.	.	H	α-helix	trans	-69.4	-36.7	-178.6	-73.9	-23.5	0	0	0	112.2	K2414 G2646 T2650 V2651 S2652	K2414-D2648 VanDerWaalsContact CD-OD1 3.28Å; K2414-D2648 WeakPolarHBondContact CD-OD1 3.26Å; K2414-D2648 WeakPolarHBondContact CE-OD1 3.49Å; K2414-D2648 IonicContact NZ-OD1 2.7Å; K2414-D2648 PolarHBondContact NZ-OD1 3.14Å; K2414-D2648 IonicContact NZ-OD2 3.71Å; K2414-D2648 PolarHBondContact NZ-OD2 3.17Å; K2414-D2648 VanDerWaalsContact NZ-OD2 3.17Å; G2646-D2648 VanDerWaalsContact C-N 3.31Å; G2646-D2648 PolarHBondContact O-N 3.45Å; D2648-T2650 VanDerWaalsContact C-N 3.34Å; D2648-V2651 PolarHBondContact O-N 2.94Å; D2648-S2652 WeakPolarHBondContact O-CB 3.33Å; D2648-S2652 PolarHBondContact O-N 3.04Å
2649	K	87.2	Confident	85.3	Confident	98 Å²	98	31.7 Å²	31.7	43%	0.426	17%	0.173	S	C	.	.	H	α-helix	trans	-64.4	-43.5	173.7	-130.9	168	-176.7	172.2	0	109.7	V2634 D2635 G2646 S2652 I2653	V2634-K2649 HydrophobicContact CG1-CB 3.93Å; V2634-K2649 HydrophobicContact CG1-CD 4.29Å; V2634-K2649 HydrophobicContact CG2-CB 4.3Å; D2635-K2649 IonicContact OD2-NZ 2.6Å; D2635-K2649 PolarHBondContact OD2-NZ 3.19Å; G2646-K2649 WeakPolarHBondContact O-CB 3.1Å; G2646-K2649 PolarHBondContact O-N 3.5Å; K2649-S2652 PolarHBondContact O-N 3.4Å; K2649-I2653 WeakPolarHBondContact O-CD1 3.31Å; K2649-I2653 VanDerWaalsContact O-CG1 3.25Å; K2649-I2653 WeakPolarHBondContact O-CG1 3.22Å; K2649-I2653 PolarHBondContact O-N 3.22Å
2650	T	90.6	Very high	84	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65.6	-44.9	175.9	-63.6	0	0	0	0	112.2	L2411 L2489 I2603 F2641 I2642 G2646 V2647 D2648 S2652 I2653 I2654	L2411-T2650 HydrophobicContact CD1-CG2 3.84Å; L2489-T2650 HydrophobicContact CD1-CG2 4.41Å; L2489-T2650 HydrophobicContact CD2-CG2 4.02Å; I2603-T2650 HydrophobicContact CD1-CG2 4.08Å; I2603-T2650 HydrophobicContact CG2-CG2 4.39Å; F2641-T2650 PolarHBondContact O-OG1 3.43Å; I2642-T2650 HydrophobicContact CG2-CG2 4.36Å; G2646-T2650 PolarHBondContact O-N 2.85Å; G2646-T2650 PolarHBondContact O-OG1 3.02Å; V2647-T2650 CarbonylContact O-C 3.55Å; V2647-T2650 PolarHBondContact O-N 3.26Å; D2648-T2650 VanDerWaalsContact C-N 3.34Å; T2650-S2652 VanDerWaalsContact C-N 3.34Å; T2650-S2652 PolarHBondContact O-N 3.22Å; T2650-I2653 PolarHBondContact O-N 3.13Å; T2650-I2654 HydrophobicContact CG2-CD1 3.76Å; T2650-I2654 WeakPolarHBondContact O-CB 3.43Å; T2650-I2654 WeakPolarHBondContact O-CD1 3.48Å; T2650-I2654 WeakPolarHBondContact O-CG1 3.27Å; T2650-I2654 PolarHBondContact O-N 2.74Å
2651	V	90.2	Very high	82.4	Confident	14 Å²	14	35.5 Å²	35.5	9%	0.085	20%	0.204	C	C	.	.	H	α-helix	trans	-61	-41.4	174	167.8	0	0	0	0	111.4	L2411 K2414 L2415 V2647 D2648 I2654 T2655	L2411-V2651 HydrophobicContact CD1-CG2 3.73Å; K2414-V2651 HydrophobicContact CB-CG2 3.97Å; L2415-V2651 HydrophobicContact CD2-CG1 4.39Å; L2415-V2651 HydrophobicContact CD2-CG2 4.36Å; V2647-V2651 HydrophobicContact CG2-CG2 4.41Å; V2647-V2651 WeakPolarHBondContact O-CB 3.25Å; V2647-V2651 VanDerWaalsContact O-CG2 3.3Å; V2647-V2651 WeakPolarHBondContact O-CG2 3.39Å; V2647-V2651 PolarHBondContact O-N 3.14Å; D2648-V2651 PolarHBondContact O-N 2.94Å; V2651-I2654 PolarHBondContact O-N 3.32Å; V2651-T2655 VanDerWaalsContact O-CB 3.24Å; V2651-T2655 WeakPolarHBondContact O-CB 3.12Å; V2651-T2655 PolarHBondContact O-N 3Å; V2651-T2655 PolarHBondContact O-OG1 2.91Å
2652	S	88.7	Confident	80.1	Confident	64 Å²	64	40.3 Å²	40.3	45%	0.448	23%	0.234	S	C	.	.	H	α-helix	trans	-60.6	-51.6	176.3	-177.2	0	0	0	0	111.2	D2648 K2649 T2650 I2654 T2655 D2656	D2648-S2652 WeakPolarHBondContact O-CB 3.33Å; D2648-S2652 PolarHBondContact O-N 3.04Å; K2649-S2652 PolarHBondContact O-N 3.4Å; T2650-S2652 VanDerWaalsContact C-N 3.34Å; T2650-S2652 PolarHBondContact O-N 3.22Å; S2652-I2654 VanDerWaalsContact C-N 3.34Å; S2652-I2654 PolarHBondContact O-N 3.12Å; S2652-T2655 WeakPolarHBondContact O-CB 2.97Å; S2652-T2655 PolarHBondContact O-N 2.94Å; S2652-T2655 VanDerWaalsContact O-N 3.09Å; S2652-D2656 PolarHBondContact O-N 3.2Å
2653	I	91.3	Very high	77.4	Confident	25 Å²	25	46.3 Å²	46.3	13%	0.128	27%	0.27	C	S	.	.	H	α-helix	trans	-61.9	-39.7	177.4	-62.7	156.3	0	0	0	111.6	V2601 I2603 H2632 V2634 K2649 T2650 T2655 A2657	V2601-I2653 HydrophobicContact CG1-CG2 4.47Å; I2603-I2653 HydrophobicContact CD1-CB 3.81Å; I2603-I2653 HydrophobicContact CD1-CG2 3.52Å; I2603-I2653 HydrophobicContact CG1-CG2 3.84Å; I2603-I2653 HydrophobicContact CG2-CD1 4.26Å; H2632-I2653 HydrophobicContact CB-CD1 3.86Å; H2632-I2653 HydrophobicContact CB-CG2 4.11Å; V2634-I2653 HydrophobicContact CG2-CD1 3.58Å; K2649-I2653 WeakPolarHBondContact O-CD1 3.31Å; K2649-I2653 VanDerWaalsContact O-CG1 3.25Å; K2649-I2653 WeakPolarHBondContact O-CG1 3.22Å; K2649-I2653 PolarHBondContact O-N 3.22Å; T2650-I2653 PolarHBondContact O-N 3.13Å; I2653-T2655 VanDerWaalsContact C-N 3.34Å; I2653-A2657 WeakPolarHBondContact O-CB 3.09Å; I2653-A2657 PolarHBondContact O-N 3.17Å
2654	I	91.1	Very high	74.6	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-61.7	-43.4	174.1	-72.5	161.2	0	0	0	111.1	L2411 L2415 I2456 I2487 L2489 I2603 T2650 V2651 S2652 A2657 F2658	L2411-I2654 HydrophobicContact CD1-CD1 4.07Å; L2411-I2654 HydrophobicContact CD2-CD1 4.43Å; L2415-I2654 HydrophobicContact CD2-CB 4.2Å; L2415-I2654 HydrophobicContact CD2-CD1 4.3Å; L2415-I2654 HydrophobicContact CD2-CG2 3.54Å; I2456-I2654 HydrophobicContact CD1-CD1 3.99Å; I2456-I2654 HydrophobicContact CD1-CG1 4.23Å; I2456-I2654 HydrophobicContact CD1-CG2 3.69Å; I2487-I2654 HydrophobicContact CD1-CB 4.14Å; I2487-I2654 HydrophobicContact CD1-CG1 3.97Å; I2487-I2654 HydrophobicContact CD1-CG2 3.92Å; I2487-I2654 HydrophobicContact CG2-CG1 4.24Å; L2489-I2654 HydrophobicContact CD2-CD1 4.43Å; I2603-I2654 HydrophobicContact CD1-CD1 4.49Å; I2603-I2654 HydrophobicContact CD1-CG1 3.82Å; T2650-I2654 HydrophobicContact CG2-CD1 3.76Å; T2650-I2654 WeakPolarHBondContact O-CB 3.43Å; T2650-I2654 WeakPolarHBondContact O-CD1 3.48Å; T2650-I2654 WeakPolarHBondContact O-CG1 3.27Å; T2650-I2654 PolarHBondContact O-N 2.74Å; V2651-I2654 PolarHBondContact O-N 3.32Å; S2652-I2654 VanDerWaalsContact C-N 3.34Å; S2652-I2654 PolarHBondContact O-N 3.12Å; I2654-A2657 PolarHBondContact O-N 3.17Å; I2654-F2658 HydrophobicContact CG2-CD2 3.74Å; I2654-F2658 HydrophobicContact CG2-CE2 3.43Å; I2654-F2658 VanDerWaalsContact CG2-CE2 3.43Å; I2654-F2658 HydrophobicContact CG2-CZ 4.43Å; I2654-F2658 WeakPolarHBondContact O-CD2 3.44Å; I2654-F2658 PolarHBondContact O-N 3.19Å; I2654-F2658 VanDerWaalsContact O-N 3.07Å
2655	T	89.5	Confident	74.4	Confident	25 Å²	25	53.9 Å²	53.9	15%	0.153	33%	0.326	C	S	.	.	H	α-helix	trans	-67	-45.8	-178.4	-61.8	0	0	0	0	110.7	P2416 F2417 V2651 S2652 I2653 F2658 N2659	P2416-T2655 HydrophobicContact CG-CG2 3.99Å; F2417-T2655 HydrophobicContact CZ-CG2 4.26Å; V2651-T2655 VanDerWaalsContact O-CB 3.24Å; V2651-T2655 WeakPolarHBondContact O-CB 3.12Å; V2651-T2655 PolarHBondContact O-N 3Å; V2651-T2655 PolarHBondContact O-OG1 2.91Å; S2652-T2655 WeakPolarHBondContact O-CB 2.97Å; S2652-T2655 PolarHBondContact O-N 2.94Å; S2652-T2655 VanDerWaalsContact O-N 3.09Å; I2653-T2655 VanDerWaalsContact C-N 3.34Å; T2655-F2658 PolarHBondContact O-N 3.33Å; T2655-N2659 WeakPolarHBondContact CG2-ND2 3.35Å; T2655-N2659 VanDerWaalsContact O-CB 3.23Å; T2655-N2659 WeakPolarHBondContact O-CB 3.46Å; T2655-N2659 PolarHBondContact O-N 3.37Å; T2655-N2659 PolarHBondContact O-ND2 3.34Å
2656	D	83.8	Confident	74.5	Confident	101 Å²	101	55.1 Å²	55.1	54%	0.54	34%	0.335	S	S	.	.	H	α-helix	trans	-62.8	-41.3	173.3	-81.4	-8.6	0	0	0	112.1	S2652 F2658 N2659 A2660	S2652-D2656 PolarHBondContact O-N 3.2Å; D2656-F2658 VanDerWaalsContact C-N 3.28Å; D2656-F2658 PolarHBondContact O-N 2.88Å; D2656-N2659 PolarHBondContact O-N 3.44Å; D2656-N2659 VanDerWaalsContact O-N 3.17Å; D2656-A2660 WeakPolarHBondContact O-CB 3.38Å; D2656-A2660 PolarHBondContact O-N 3.19Å
2657	A	85.5	Confident	74.1	Confident	19 Å²	19	57.9 Å²	57.9	16%	0.157	35%	0.35	C	S	.	.	H	α-helix	trans	-62.3	-32	176.8	0	0	0	0	0	113.5	I2487 V2601 I2653 I2654	I2487-A2657 HydrophobicContact CD1-CB 3.98Å; V2601-A2657 HydrophobicContact CG2-CB 3.99Å; I2653-A2657 WeakPolarHBondContact O-CB 3.09Å; I2653-A2657 PolarHBondContact O-N 3.17Å; I2654-A2657 PolarHBondContact O-N 3.17Å
2658	F	84.3	Confident	73.3	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-83.5	-31.4	172.1	-68.2	-48.8	0	0	0	113.1	V2395 F2417 R2454 I2456 I2487 I2654 T2655 D2656	V2395-F2658 HydrophobicContact CG1-CE2 4.26Å; V2395-F2658 HydrophobicContact CG1-CZ 4.34Å; V2395-F2658 HydrophobicContact CG2-CD2 4.47Å; V2395-F2658 HydrophobicContact CG2-CE2 3.81Å; V2395-F2658 HydrophobicContact CG2-CZ 4.18Å; F2417-F2658 HydrophobicContact CD2-CD2 4.19Å; F2417-F2658 HydrophobicContact CE2-CB 4.46Å; F2417-F2658 AromaticContact CE2-CD2 3.62Å; F2417-F2658 HydrophobicContact CE2-CD2 3.62Å; F2417-F2658 HydrophobicContact CE2-CE2 4.36Å; F2417-F2658 HydrophobicContact CE2-CG 4.49Å; F2417-F2658 HydrophobicContact CZ-CB 4.15Å; F2417-F2658 HydrophobicContact CZ-CD2 4.16Å; R2454-F2658 HydrophobicContact CB-CD1 4.42Å; R2454-F2658 HydrophobicContact CB-CE1 3.6Å; R2454-F2658 HydrophobicContact CB-CZ 3.71Å; R2454-F2658 HydrophobicContact CG-CD1 3.94Å; R2454-F2658 HydrophobicContact CG-CE1 3.6Å; R2454-F2658 HydrophobicContact CG-CZ 4.11Å; I2456-F2658 HydrophobicContact CD1-CE2 4.14Å; I2456-F2658 HydrophobicContact CD1-CZ 4.25Å; I2456-F2658 HydrophobicContact CG1-CZ 4.22Å; I2487-F2658 HydrophobicContact CD1-CE1 4.17Å; I2487-F2658 HydrophobicContact CD1-CE2 4.05Å; I2487-F2658 HydrophobicContact CD1-CZ 3.81Å; I2487-F2658 HydrophobicContact CG1-CZ 4.48Å; I2654-F2658 HydrophobicContact CG2-CD2 3.74Å; I2654-F2658 HydrophobicContact CG2-CE2 3.43Å; I2654-F2658 VanDerWaalsContact CG2-CE2 3.43Å; I2654-F2658 HydrophobicContact CG2-CZ 4.43Å; I2654-F2658 WeakPolarHBondContact O-CD2 3.44Å; I2654-F2658 PolarHBondContact O-N 3.19Å; I2654-F2658 VanDerWaalsContact O-N 3.07Å; T2655-F2658 PolarHBondContact O-N 3.33Å; D2656-F2658 VanDerWaalsContact C-N 3.28Å; D2656-F2658 PolarHBondContact O-N 2.88Å
2659	N	76.4	Confident	72.5	Confident	70 Å²	70	60.8 Å²	60.8	37%	0.374	37%	0.371	S	S	.	.	H	α-helix	trans	-82.5	-34.6	-175.9	-73.5	-15.1	0	0	0	113.5	T2655 D2656 L2661 T2662	T2655-N2659 WeakPolarHBondContact CG2-ND2 3.35Å; T2655-N2659 VanDerWaalsContact O-CB 3.23Å; T2655-N2659 WeakPolarHBondContact O-CB 3.46Å; T2655-N2659 PolarHBondContact O-N 3.37Å; T2655-N2659 PolarHBondContact O-ND2 3.34Å; D2656-N2659 PolarHBondContact O-N 3.44Å; D2656-N2659 VanDerWaalsContact O-N 3.17Å; N2659-L2661 PolarHBondContact O-N 2.85Å; N2659-T2662 WeakPolarHBondContact O-CB 3.19Å; N2659-T2662 PolarHBondContact O-N 3.46Å; N2659-T2662 PolarHBondContact O-OG1 2.66Å
2660	A	56.5	Low	71.5	Confident	73 Å²	73	58.3 Å²	58.3	60%	0.603	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-13.7	-178.4	0	0	0	0	0	114	D2656	D2656-A2660 WeakPolarHBondContact O-CB 3.38Å; D2656-A2660 PolarHBondContact O-N 3.19Å
2661	L	49.1	Very low	70.2	Confident	65 Å²	65	62.5 Å²	62.5	34%	0.34	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	4.6	174.2	-61.7	174.1	0	0	0	113.6	K2480 Q2484 N2659	K2480-L2661 HydrophobicContact CD-CD1 4.41Å; K2480-L2661 HydrophobicContact CD-CD2 4.11Å; Q2484-L2661 HydrophobicContact CG-CD1 4.11Å; Q2484-L2661 WeakPolarHBondContact O-CD1 3.48Å; N2659-L2661 PolarHBondContact O-N 2.85Å
2662	T	39.7	Very low	68.6	Low	101 Å²	101	66.2 Å²	66.2	62%	0.62	42%	0.417	S	S	*	.	S	Bend	trans	-107.5	6.2	-175.6	-20.7	0	0	0	0	113.7	N2659	N2659-T2662 WeakPolarHBondContact O-CB 3.19Å; N2659-T2662 PolarHBondContact O-N 3.46Å; N2659-T2662 PolarHBondContact O-OG1 2.66Å
2663	V	30.3	Very low	66.9	Low	127 Å²	127	66.4 Å²	66.4	77%	0.77	42%	0.415	S	S	*	.			trans	-132.2	44.5	-174	-159.7	0	0	0	0	111
2664	C	25.7	Very low	64.7	Low	191 Å²	191	70.2 Å²	70.2	100%	1.291	44%	0.441	S	S	*	.			trans	-141.7	0	173.5	-77.9	0	0	0	0	109.7

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