Z4YJS5_MOUSE Loading...

Agrin

AlphaFold DB , UniProt , Accession Z4YJS5, Species MOUSE (Mus musculus, Mouse), Gene Agrn, Length 1,151 aa.

						>Z4YJS5_MOUSE|Z4YJS5|Agrn
MPPLPLEHRPRQQPGASVLVRYFMIPCNICLILLATSTLGFAVLLFLSNYKPGIHFTAAPSMPPDVCRGMLCGFGAVCEPSVEDPGRASCVCKKNVCPAMVAPVCGSDASTYSNECELQRAQCNQQRRIRLLRQGPCGSRDPCANVTCSFGSTCVPSADGQTASCLCPTTCFGAPDGTVCGSDGVDYPSECQLLRHACANQEHIFKKFDGPCDPCQGSMSDLNHICRVNPRTRHPEMLLRPENCPAQHTPICGDDGVTYENDCVMSRIGAARGLLLQKVRSGQCQTRDQCPETCQFNSVCLSRRGRPHCSCDRVTCDGAYRPVCAQDGHTYDNDCWRQQAECRQQQTIPPKHQGPCDQTPSPCRGAQCAFGATCTVKNGKAVCECQRVCSGGYDPVCGSDGVTYGSVCELESMACTLGREIRVARRGPCDRCGQCRFGSLCEVETGRCVCPSECVESAQPVCGSDGHTYASECELHVHACTHQISLYVASAGHCQTCGETVCTFGAVCSAGQCVCPRCEHPPPGPVCGSDGVTYLSACELREAACQQQVQIEEARAGPCEPAECGSGGSGSGEDNACEQELCRQHGGVWDEDSEDGPCVCDFSCQSVLKSPVCGSDGVTYSTECHLKKARCEARQELYVAAQGACRGPTLAPLLPMASPHCAQTPYGCCQDNVTAAQGVGLAGCPSTCHCNPHGSYSGTCDPVTGQCSCRPGVGGLRCDRCEPGFWNFRGIVTDGHSGCTPCSCDPRGAVRDDCEQMTGLCSCRPGVAGPKCGQCPDGQALGHLGCEADPTTPVTCVEMHCEFGASCVEEAGFAQCVCPTLTCPEANSTKVCGSDGVTYGNECQLKTIACRQRLDISIQSLGPCRESVAPGVSPTSASMTTPRHILSRTLASPHSSLPLSPSTTAHDWPTPLPTSPQTVVGTPRSTAATPSDVASLATAIFRESGSTNGSGDEELSGDEEASGGGSGGLEPPVGSVVVTHGPPIERASCYNSPLGCCSDGKTPSLDSEGSNCPATKAFQGVLELEGVEGQELFYTPEMADPKSELFGETARSIESTLDDLFRNSDVKKDFWSIRLRELGPGKLVRAIVDVHFDPTTAFQAPDVGQALLQQIQVSRPWALAVRRPLREHVRFLDFDPAPLSELPLELPPSLL
					

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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	25	Very low	36.8	Very low	240 Å²	240	161.9 Å²	161.9	100%	1.182	82%	0.816	S	S	*	*				0	151.9	0	-82.1	174.9	172.6	0	0	108.5
2	P	55.2	Low	36.2	Very low	120 Å²	120	159.3 Å²	159.3	78%	0.779	80%	0.799	S	S	*	*			trans	-75.6	-178.5	-173.9	36.9	-40.3	0	0	0	111.8
3	P	52	Low	35.9	Very low	123 Å²	123	160.3 Å²	160.3	80%	0.799	80%	0.799	S	S	*	*			cis	-151.1	-173.7	27.5	42	-18.1	0	0	0	120.6
4	L	30.3	Very low	36.5	Very low	161 Å²	161	158.1 Å²	158.1	84%	0.843	80%	0.802	S	S	*	*			trans	-59.5	-172.6	154.5	-62.2	160.9	0	0	0	111.4
5	P	50.8	Low	36.1	Very low	109 Å²	109	152.1 Å²	152.1	71%	0.708	80%	0.796	S	S	*	*			cis	-148.5	175.9	11.2	44.4	-23.3	0	0	0	120
6	L	28.9	Very low	35.9	Very low	148 Å²	148	149.4 Å²	149.4	78%	0.775	80%	0.802	S	S	*	*			trans	52.9	119.3	139.2	-70.3	166.2	0	0	0	125.2
7	E	30.5	Very low	35.7	Very low	153 Å²	153	146.8 Å²	146.8	72%	0.715	80%	0.798	S	S	*	*				49.1	122.9	124.1	-97.3	-162.3	91.2	0	0	124.7
8	H	27.3	Very low	35.7	Very low	176 Å²	176	145.7 Å²	145.7	82%	0.815	80%	0.796	S	S	*	*				-178.4	176.8	106.9	-113.8	36.7	0	0	0	114.6
9	R	28.9	Very low	35.6	Very low	235 Å²	235	146.3 Å²	146.3	89%	0.887	80%	0.798	S	S	*	*			trans	-99.5	-176.7	-172.4	-115.1	-179.3	178	178.9	0.9	112.8
10	P	46.4	Very low	35.6	Very low	102 Å²	102	144.7 Å²	144.7	66%	0.662	79%	0.793	S	S	*	*			cis	-143.1	-169.2	-19.7	40.5	-20.1	0	0	0	117.1
11	R	29.3	Very low	35.7	Very low	214 Å²	214	147 Å²	147	81%	0.808	79%	0.79	S	S	*	*			trans	98.2	123.6	139	-92.6	-177.3	170.6	-162.8	0	125.7
12	Q	29.8	Very low	36.3	Very low	131 Å²	131	142.5 Å²	142.5	61%	0.612	76%	0.76	S	S	*	*			trans	70.7	118.9	132.1	-78.7	176.3	-66.3	0	0	126.2
13	Q	32	Very low	35.1	Very low	172 Å²	172	144.4 Å²	144.4	80%	0.804	76%	0.757	S	S	*	*				43	167.6	121.7	-77.8	-179.9	-27	0	0	122.8
14	P	44.7	Very low	34.3	Very low	129 Å²	129	144.9 Å²	144.9	84%	0.838	75%	0.75	S	S	*	*			cis	-122.1	-159.2	0.3	43.1	-26.6	0	0	0	112.7
15	G	31.1	Very low	34.6	Very low	69 Å²	69	143.5 Å²	143.5	71%	0.711	74%	0.742	S	S	*	*			cis	148.4	165.5	-14.2	0	0	0	0	0	115.2
16	A	31.7	Very low	34.5	Very low	109 Å²	109	144.1 Å²	144.1	90%	0.901	75%	0.746	S	S	*	*			trans	75.6	156.8	169.2	0	0	0	0	0	120.7
17	S	32.3	Very low	34.9	Very low	104 Å²	104	141.8 Å²	141.8	73%	0.727	74%	0.741	S	S	*	*			cis	-177.3	152.2	-30.8	-164.2	0	0	0	0	114.3
18	V	36	Very low	34.9	Very low	127 Å²	127	141.6 Å²	141.6	77%	0.77	75%	0.745	S	S	*	*			trans	68.1	161	146.5	147.3	0	0	0	0	121.2
19	L	33.7	Very low	35.4	Very low	158 Å²	158	139.8 Å²	139.8	83%	0.827	74%	0.74	S	S	*	*			cis	178.5	-137.3	-39	-161.2	100.4	0	0	0	108.9
20	V	35.5	Very low	36.3	Very low	114 Å²	114	132.9 Å²	132.9	69%	0.691	73%	0.726	S	S	*	*			trans	82.2	134.7	172.3	179.7	0	0	0	0	114.6
21	R	39.3	Very low	36.1	Very low	194 Å²	194	135.7 Å²	135.7	73%	0.732	74%	0.735	S	S	*	*			cis	-158.4	-176.8	-6.7	-119.2	172.6	-178.5	161.9	0.7	107.3
22	Y	36.7	Very low	36.9	Very low	144 Å²	144	132 Å²	132	57%	0.565	73%	0.73	S	S	*	*			cis	-152.8	-158.8	0.6	-128.8	-24.8	0	0	0	106.6
23	F	30.4	Very low	38	Very low	161 Å²	161	131.9 Å²	131.9	71%	0.706	73%	0.733	S	S	*	*			cis	-148.9	144.5	-4.5	-96.6	-56	0	0	0	104.9
24	M	34.9	Very low	38.8	Very low	133 Å²	133	131.4 Å²	131.4	66%	0.655	74%	0.735	S	S	*	*				67.4	133.5	71.5	-55.1	-59.7	89.6	0	0	116
25	I	36.1	Very low	38.9	Very low	132 Å²	132	128.7 Å²	128.7	68%	0.677	72%	0.723	S	S	*	*			cis	-173.4	162.4	-12.9	-127.5	176.3	0	0	0	107.2
26	P	49.5	Very low	39.8	Very low	122 Å²	122	130.7 Å²	130.7	79%	0.792	72%	0.722	S	S	*	*				-146.7	-176.1	53.3	39.6	-16.8	0	0	0	117.5
27	C	37	Very low	40.8	Very low	98 Å²	98	130.7 Å²	130.7	66%	0.662	72%	0.716	S	S	*	*			trans	-106.8	149	-171.9	-51.3	0	0	0	0	114.4
28	N	31	Very low	41.7	Very low	150 Å²	150	130.1 Å²	130.1	80%	0.802	71%	0.708	S	S	*	*				-174.9	120	106.9	-109.9	-18.1	0	0	0	114.4
29	I	37.8	Very low	42.3	Very low	137 Å²	137	130.2 Å²	130.2	70%	0.703	70%	0.703	S	S	*	*			trans	171.6	75.2	135.6	-86.8	156.6	0	0	0	107.6	L31	I29-L31 PolarHBondContact O-N 3.22Å
30	C	46.2	Very low	43.2	Very low	90 Å²	90	125.4 Å²	125.4	61%	0.608	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	48.3	173.7	-67.9	0	0	0	0	111.8	L33	C30-L33 HydrophobicContact CB-CD1 4.28Å
31	L	43.9	Very low	43.8	Very low	162 Å²	162	127.6 Å²	127.6	85%	0.848	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.4	5.5	179.2	-78.7	173.2	0	0	0	114.3	I29	I29-L31 PolarHBondContact O-N 3.22Å
32	I	45.5	Very low	44.2	Very low	135 Å²	135	120.8 Å²	120.8	69%	0.692	68%	0.678	S	S	*	*	S	Bend	trans	-108.8	-0.8	161.3	-49.5	-176.8	0	0	0	110.8	L34	I32-L34 PolarHBondContact O-N 3.29Å; I32-L34 VanDerWaalsContact O-N 3.08Å
33	L	53.1	Low	44.8	Very low	129 Å²	129	118.4 Å²	118.4	68%	0.675	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	99	154.7	-75.3	176.7	0	0	0	108.7	C30	C30-L33 HydrophobicContact CB-CD1 4.28Å
34	L	48	Very low	45.6	Very low	162 Å²	162	117 Å²	117	85%	0.848	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	174.8	-17.4	146.5	-97.6	162	0	0	0	113.8	I32	I32-L34 PolarHBondContact O-N 3.29Å; I32-L34 VanDerWaalsContact O-N 3.08Å
35	A	47.6	Very low	46	Very low	72 Å²	72	117.1 Å²	117.1	60%	0.595	68%	0.68	S	S	*	*	S	Bend	trans	-101.1	-27.9	-164	0	0	0	0	0	117.4
36	T	50.2	Low	46	Very low	112 Å²	112	119.4 Å²	119.4	69%	0.687	69%	0.685	S	S	*	*	S	Bend	trans	-109.6	-29.4	-169.3	49.5	0	0	0	0	115	T38 L39	T36-T38 PolarHBondContact O-N 3.27Å; T36-L39 PolarHBondContact O-N 3.21Å
37	S	51.3	Low	45.6	Very low	109 Å²	109	120.7 Å²	120.7	76%	0.762	69%	0.685	S	S	*	*	H	α-helix	trans	-66.2	-21.9	178.3	-165.1	0	0	0	0	113.1
38	T	51.3	Low	45.7	Very low	92 Å²	92	120.5 Å²	120.5	56%	0.564	68%	0.684	S	S	*	*	H	α-helix	trans	-81	-20.3	179.1	42	0	0	0	0	114.2	T36	T36-T38 PolarHBondContact O-N 3.27Å
39	L	50.2	Low	45.8	Very low	128 Å²	128	120.5 Å²	120.5	67%	0.67	68%	0.684	S	S	*	*	H	α-helix	trans	-75.3	-36.6	176.6	-111.1	82.2	0	0	0	112.5	T36 F41	T36-L39 PolarHBondContact O-N 3.21Å; L39-F41 PolarHBondContact O-N 3.18Å
40	G	52.3	Low	45.5	Very low	58 Å²	58	125.2 Å²	125.2	60%	0.598	70%	0.695	S	S	*	*	H	α-helix	trans	-65.2	-33	-174.6	0	0	0	0	0	114.6
41	F	48.6	Very low	45.2	Very low	160 Å²	160	129.6 Å²	129.6	70%	0.702	70%	0.703	S	S	*	*	H	α-helix	trans	-96.8	-13.9	-176.5	-128.1	-92.8	0	0	0	114.4	L39	L39-F41 PolarHBondContact O-N 3.18Å
42	A	46.8	Very low	45.2	Very low	51 Å²	51	127.9 Å²	127.9	42%	0.421	70%	0.702	S	S	.	*	H	α-helix	trans	-78	-34.7	178.6	0	0	0	0	0	112.9	L44 L45 F46	A42-L44 PolarHBondContact O-N 2.9Å; A42-L45 PolarHBondContact O-N 3.35Å; A42-F46 PolarHBondContact O-N 2.93Å
43	V	48.8	Very low	44.4	Very low	94 Å²	94	124.1 Å²	124.1	57%	0.57	70%	0.696	S	S	*	*	H	α-helix	trans	-65.5	-36.6	-176.6	176.6	0	0	0	0	112.2	L45	V43-L45 VanDerWaalsContact C-N 3.31Å; V43-L45 PolarHBondContact O-N 2.81Å
44	L	46.7	Very low	43.4	Very low	132 Å²	132	125.6 Å²	125.6	69%	0.691	70%	0.703	S	S	*	*	H	α-helix	trans	-75.8	-12.8	-179.7	-76.1	170	0	0	0	114.6	A42	A42-L44 PolarHBondContact O-N 2.9Å
45	L	43.9	Very low	42.6	Very low	135 Å²	135	124.6 Å²	124.6	71%	0.707	69%	0.694	S	S	*	*	H	α-helix	trans	-102	-11.3	176.7	-71.3	174.6	0	0	0	113.8	A42 V43	A42-L45 PolarHBondContact O-N 3.35Å; V43-L45 VanDerWaalsContact C-N 3.31Å; V43-L45 PolarHBondContact O-N 2.81Å
46	F	36.3	Very low	41.7	Very low	180 Å²	180	129.6 Å²	129.6	79%	0.789	70%	0.703	S	S	*	*	H	α-helix	trans	-92.2	-10.3	179.7	-107.4	-80.6	0	0	0	115.4	A42 S48	A42-F46 PolarHBondContact O-N 2.93Å; F46-S48 VanDerWaalsContact C-N 3.33Å
47	L	41.9	Very low	40.8	Very low	149 Å²	149	130.6 Å²	130.6	78%	0.78	71%	0.709	S	S	*	*	S	Bend	trans	-87.2	4.6	178.3	-70.5	174.3	0	0	0	114.5
48	S	37.6	Very low	40.3	Very low	93 Å²	93	130 Å²	130	65%	0.65	71%	0.711	S	S	*	*	S	Bend	trans	-128.2	46.7	-175.2	-68.8	0	0	0	0	114	F46	F46-S48 VanDerWaalsContact C-N 3.33Å
49	N	34.3	Very low	39.2	Very low	151 Å²	151	130.3 Å²	130.3	81%	0.807	72%	0.722	S	S	*	*			trans	175	97.3	137.3	-101.4	-73.5	0	0	0	112.5
50	Y	31.3	Very low	38.8	Very low	236 Å²	236	130.2 Å²	130.2	93%	0.925	73%	0.729	S	S	*	*			trans	-150	128.5	142.2	-130.3	-87.3	0	0	0	109.8
51	K	40.7	Very low	38.2	Very low	181 Å²	181	133 Å²	133	79%	0.787	74%	0.74	S	S	*	*			trans	-132.8	143.2	-178.7	-150.6	179.4	-174.3	178.4	0	107.6
52	P	42.6	Very low	37.5	Very low	127 Å²	127	133.6 Å²	133.6	83%	0.825	75%	0.747	S	S	*	*				-125.9	152.8	101.3	13.7	5.7	0	0	0	110.1
53	G	29.1	Very low	37.6	Very low	55 Å²	55	136.3 Å²	136.3	57%	0.567	76%	0.76	S	S	*	*				98.5	123.2	60.1	0	0	0	0	0	106.2
54	I	31	Very low	38	Very low	160 Å²	160	137.4 Å²	137.4	82%	0.821	77%	0.769	S	S	*	*				-141.4	150.1	53.1	-73.7	154	0	0	0	111.8
55	H	32.6	Very low	38.6	Very low	142 Å²	142	137 Å²	137	66%	0.657	77%	0.768	S	S	*	*			trans	-17.6	151.6	154.8	-57.6	-88.3	0	0	0	117.8
56	F	28.7	Very low	39.7	Very low	176 Å²	176	133 Å²	133	77%	0.772	75%	0.749	S	S	*	*			cis	-151.8	-170.9	0.9	-106.8	-39.3	0	0	0	106.9
57	T	30	Very low	41.2	Very low	134 Å²	134	126 Å²	126	82%	0.822	72%	0.722	S	S	*	*			cis	-141.8	-142.9	14.2	-33.6	0	0	0	0	109.1
58	A	40.6	Very low	42.3	Very low	97 Å²	97	129.3 Å²	129.3	80%	0.802	72%	0.724	S	S	*	*			trans	-152.6	152.2	167.8	0	0	0	0	0	112
59	A	28.9	Very low	43.4	Very low	97 Å²	97	128.5 Å²	128.5	80%	0.802	73%	0.73	S	S	*	*			trans	-143.1	160.5	169.2	0	0	0	0	0	109
60	P	42.6	Very low	45	Very low	126 Å²	126	124.9 Å²	124.9	82%	0.818	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-86.5	159.9	-152	33.1	-37.2	0	0	0	116.3
61	S	38.7	Very low	46.3	Very low	118 Å²	118	121.9 Å²	121.9	83%	0.825	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-76.2	131	172.5	53.1	0	0	0	0	112.8
62	M	35.1	Very low	47.8	Very low	171 Å²	171	114.8 Å²	114.8	84%	0.842	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-75.4	155.4	165.2	-70.4	-67	-77.4	0	0	111.3
63	P	48.2	Very low	48.7	Very low	108 Å²	108	110.4 Å²	110.4	70%	0.701	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-70.3	160.7	178	30.4	-36.3	0	0	0	112.6
64	P	56.9	Low	50.7	Low	117 Å²	117	111.4 Å²	111.4	76%	0.76	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-70.9	142.8	177.3	30	-35.3	0	0	0	112.5	V66	P64-V66 PolarHBondContact O-N 2.97Å; P64-V66 VanDerWaalsContact O-N 3.08Å
65	D	60.5	Low	52.2	Low	123 Å²	123	106.8 Å²	106.8	66%	0.658	64%	0.64	S	S	*	*			trans	-62.2	106.7	174.9	-91.5	-52.6	0	0	0	112.2	C67 R68	D65-C67 PolarHBondContact O-N 3.45Å; D65-R68 HydrophobicContact CB-CB 3.77Å; D65-R68 VanDerWaalsContact O-CB 3.31Å; D65-R68 WeakPolarHBondContact O-CB 3.46Å; D65-R68 PolarHBondContact O-N 3.08Å
66	V	66.7	Low	54.2	Low	52 Å²	52	100.7 Å²	100.7	32%	0.315	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.2	-20.7	-178	-165.1	0	0	0	0	112.6	P64 A88	P64-V66 PolarHBondContact O-N 2.97Å; P64-V66 VanDerWaalsContact O-N 3.08Å; V66-A88 HydrophobicContact CB-CB 4.32Å; V66-A88 HydrophobicContact CG1-CB 3.87Å
67	C	66.2	Low	56.5	Low	34 Å²	34	95.5 Å²	95.5	23%	0.23	60%	0.596	C	S	.	*	T	Hydrogen-bonded Turn	trans	-89.8	-4.9	174.9	-77.6	0	0	0	0	114.6	D65 G69 M70 C78	D65-C67 PolarHBondContact O-N 3.45Å; C67-G69 PolarHBondContact O-N 3.11Å; C67-M70 PolarHBondContact O-N 3.3Å; C67-C78 WeakPolarHBondContact CA-SG 3.36Å; C67-C78 HydrophobicContact CB-CB 3.77Å; C67-C78 WeakPolarHBondContact CB-SG 3.42Å; C67-C78 WeakPolarHBondContact SG-CB 3.25Å; C67-C78 PolarHBondContact SG-O 3.31Å; C67-C78 CovalentContact SG-SG 2.04Å; C67-C78 PolarHBondContact SG-SG 2.8Å
68	R	66.3	Low	58.7	Low	217 Å²	217	90.3 Å²	90.3	82%	0.819	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	99.8	-173.3	-173.3	171.5	-178.2	144.2	-0.2	111.6	D65	D65-R68 HydrophobicContact CB-CB 3.77Å; D65-R68 VanDerWaalsContact O-CB 3.31Å; D65-R68 WeakPolarHBondContact O-CB 3.46Å; D65-R68 PolarHBondContact O-N 3.08Å
69	G	60.8	Low	60.4	Low	76 Å²	76	89.4 Å²	89.4	78%	0.784	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	104	2	-176.9	0	0	0	0	0	114.6	C67 L71	C67-G69 PolarHBondContact O-N 3.11Å; G69-L71 PolarHBondContact O-N 3.34Å
70	M	66.8	Low	62.5	Low	76 Å²	76	88.8 Å²	88.8	37%	0.374	53%	0.532	S	S	.	.			trans	-84.1	106.5	174.1	-170.5	172	-63.3	0	0	110.6	C67 C72 A88	C67-M70 PolarHBondContact O-N 3.3Å; M70-C72 PolarHBondContact O-N 2.86Å; M70-A88 HydrophobicContact CE-CB 3.86Å; M70-A88 HydrophobicContact SD-CB 4.15Å
71	L	59.5	Low	63.5	Low	173 Å²	173	84.2 Å²	84.2	91%	0.906	50%	0.504	S	S	*	.			trans	-85.3	106.2	177.6	-71.8	168.1	0	0	0	110.7	G69	G69-L71 PolarHBondContact O-N 3.34Å
72	C	71.9	Confident	64.7	Low	32 Å²	32	85.8 Å²	85.8	22%	0.216	51%	0.508	C	S	.	.			trans	-90.6	124.5	176.7	-66.1	0	0	0	0	111.5	M70 A76 C90	M70-C72 PolarHBondContact O-N 2.86Å; C72-A76 HydrophobicContact CB-CB 4.13Å; C72-A76 WeakPolarHBondContact CB-O 3.46Å; C72-C90 WeakPolarHBondContact CA-SG 3.36Å; C72-C90 HydrophobicContact CB-CB 3.68Å; C72-C90 WeakPolarHBondContact CB-SG 3.5Å; C72-C90 WeakPolarHBondContact SG-CA 3.46Å; C72-C90 WeakPolarHBondContact SG-CB 2.8Å; C72-C90 CovalentContact SG-SG 2.04Å; C72-C90 PolarHBondContact SG-SG 3.25Å
73	G	61.1	Low	66.1	Low	34 Å²	34	86.3 Å²	86.3	35%	0.351	51%	0.508	S	S	.	.			trans	-78.1	164.8	-179.5	0	0	0	0	0	114.2	G75 A76	G73-G75 PolarHBondContact O-N 3.45Å; G73-G75 VanDerWaalsContact O-N 3.1Å; G73-A76 WeakPolarHBondContact O-CB 3.28Å; G73-A76 PolarHBondContact O-N 3.31Å
74	F	71.4	Confident	66.8	Low	77 Å²	77	85.6 Å²	85.6	34%	0.338	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	28.1	166	-44.7	-79.6	0	0	0	115.9	Q122 C123 Q126 R128	F74-Q122 HydrophobicContact CB-CG 3.99Å; F74-Q122 HydrophobicContact CD1-CG 4.42Å; F74-C123 WeakPolarHBondContact O-CA 3.44Å; F74-C123 WeakPolarHBondContact O-CB 3.29Å; F74-C123 PolarHBondContact O-N 2.8Å; F74-Q126 HydrophobicContact CD2-CB 4.12Å; F74-Q126 HydrophobicContact CE2-CB 4.24Å; F74-R128 HydrophobicContact CD1-CB 4.35Å; F74-R128 HydrophobicContact CE1-CB 4.04Å
75	G	63.7	Low	66.8	Low	63 Å²	63	85.5 Å²	85.5	65%	0.649	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	9.2	-179.7	0	0	0	0	0	115.1	G73	G73-G75 PolarHBondContact O-N 3.45Å; G73-G75 VanDerWaalsContact O-N 3.1Å
76	A	73.6	Confident	67	Low	13 Å²	13	83 Å²	83	11%	0.107	50%	0.502	C	S	.	.			trans	-71.8	147.2	170.5	0	0	0	0	0	111.1	C72 G73 C90 C123	C72-A76 HydrophobicContact CB-CB 4.13Å; C72-A76 WeakPolarHBondContact CB-O 3.46Å; G73-A76 WeakPolarHBondContact O-CB 3.28Å; G73-A76 PolarHBondContact O-N 3.31Å; A76-C90 HydrophobicContact CB-CB 4.04Å; A76-C123 VanDerWaalsContact CA-SG 3.58Å; A76-C123 PolarHBondContact N-SG 3.02Å; A76-C123 VanDerWaalsContact N-SG 3.4Å
77	V	77.4	Confident	67	Low	67 Å²	67	88.8 Å²	88.8	41%	0.406	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	138.7	178.5	-177.8	0	0	0	0	108.7	V91 K93	V77-V91 PolarHBondContact N-O 2.04Å; V77-V91 WeakPolarHBondContact O-CG2 3.3Å; V77-V91 PolarHBondContact O-N 3.35Å; V77-K93 HydrophobicContact CB-CG 4.45Å; V77-K93 HydrophobicContact CG2-CD 4.34Å; V77-K93 HydrophobicContact CG2-CG 4.33Å
78	C	76.7	Confident	67.1	Low	26 Å²	26	87.7 Å²	87.7	18%	0.176	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	126.6	172.8	-177.1	0	0	0	0	110.3	C67	C67-C78 WeakPolarHBondContact CA-SG 3.36Å; C67-C78 HydrophobicContact CB-CB 3.77Å; C67-C78 WeakPolarHBondContact CB-SG 3.42Å; C67-C78 WeakPolarHBondContact SG-CB 3.25Å; C67-C78 PolarHBondContact SG-O 3.31Å; C67-C78 CovalentContact SG-SG 2.04Å; C67-C78 PolarHBondContact SG-SG 2.8Å
79	E	76.1	Confident	67.6	Low	78 Å²	78	80 Å²	80	36%	0.364	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	142.1	169.4	-64.2	-163.5	137.7	0	0	110.8	A88 S89 V91 K93	E79-A88 WeakPolarHBondContact O-CA 3.05Å; E79-S89 PolarHBondContact N-O 3.25Å; E79-S89 PolarHBondContact O-N 3.5Å; E79-V91 HydrophobicContact CB-CG2 4.03Å; E79-V91 HydrophobicContact CG-CG2 3.73Å; E79-V91 WeakPolarHBondContact OE2-CG2 3.07Å; E79-K93 WeakPolarHBondContact OE1-CE 3.02Å; E79-K93 IonicContact OE1-NZ 2.69Å; E79-K93 PolarHBondContact OE1-NZ 2.93Å
80	P	73.2	Confident	68.4	Low	83 Å²	83	79.2 Å²	79.2	54%	0.539	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	144.1	172.9	-21.5	33.8	0	0	0	112.2	V82	P80-V82 PolarHBondContact O-N 2.85Å
81	S	63.6	Low	68.9	Low	31 Å²	31	77.9 Å²	77.9	22%	0.217	47%	0.468	C	S	.	.			trans	-68.6	127.4	173.6	-175.4	0	0	0	0	110.7	E83 D84 R87	S81-E83 PolarHBondContact O-N 2.03Å; S81-E83 PolarHBondContact OG-N 3.38Å; S81-D84 PolarHBondContact O-N 2.04Å; S81-R87 WeakPolarHBondContact CB-O 3.17Å; S81-R87 PolarHBondContact N-O 3.09Å
82	V	63.2	Low	69.8	Low	151 Å²	151	71.3 Å²	71.3	92%	0.915	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-23.4	175.3	-170.7	0	0	0	0	111.7	P80	P80-V82 PolarHBondContact O-N 2.85Å
83	E	64.5	Low	69.4	Low	181 Å²	181	74.6 Å²	74.6	85%	0.846	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-20	-173.8	-61.6	174.8	172.3	0	0	113.3	S81	S81-E83 PolarHBondContact O-N 2.03Å; S81-E83 PolarHBondContact OG-N 3.38Å
84	D	61.7	Low	69.2	Low	93 Å²	93	81.6 Å²	81.6	50%	0.497	47%	0.468	S	S	.	.			trans	-150.7	94.5	-168.3	-137.1	-18.2	0	0	0	110.8	S81 G86 R87	S81-D84 PolarHBondContact O-N 2.04Å; D84-G86 PolarHBondContact O-N 2.87Å; D84-R87 HydrophobicContact CB-CB 4.33Å; D84-R87 PolarHBondContact O-N 2.63Å
85	P	58.3	Low	68.6	Low	116 Å²	116	83.2 Å²	83.2	75%	0.753	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-4.3	-170	-26.6	35.6	0	0	0	116.9
86	G	64.1	Low	68.8	Low	71 Å²	71	86.7 Å²	86.7	73%	0.732	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	3.3	174.4	0	0	0	0	0	114.6	D84	D84-G86 PolarHBondContact O-N 2.87Å
87	R	66	Low	68.8	Low	172 Å²	172	86.6 Å²	86.6	65%	0.649	49%	0.487	S	S	*	.			trans	-128.9	131.9	-173	-172	177.4	-177.4	-177.9	-0.2	110.9	S81 D84	S81-R87 WeakPolarHBondContact CB-O 3.17Å; S81-R87 PolarHBondContact N-O 3.09Å; D84-R87 HydrophobicContact CB-CB 4.33Å; D84-R87 PolarHBondContact O-N 2.63Å
88	A	69.9	Low	68.6	Low	12 Å²	12	87.5 Å²	87.5	10%	0.099	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	161.8	169.4	0	0	0	0	0	111	V66 M70 E79	V66-A88 HydrophobicContact CB-CB 4.32Å; V66-A88 HydrophobicContact CG1-CB 3.87Å; M70-A88 HydrophobicContact CE-CB 3.86Å; M70-A88 HydrophobicContact SD-CB 4.15Å; E79-A88 WeakPolarHBondContact O-CA 3.05Å
89	S	75.2	Confident	68.1	Low	55 Å²	55	91.3 Å²	91.3	39%	0.385	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	146.9	179.9	52.4	0	0	0	0	111.7	E79	E79-S89 PolarHBondContact N-O 3.25Å; E79-S89 PolarHBondContact O-N 3.5Å
90	C	77.7	Confident	67.3	Low	59 Å²	59	94.1 Å²	94.1	40%	0.399	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	122	172.7	-60.7	0	0	0	0	110	C72 A76	C72-C90 WeakPolarHBondContact CA-SG 3.36Å; C72-C90 HydrophobicContact CB-CB 3.68Å; C72-C90 WeakPolarHBondContact CB-SG 3.5Å; C72-C90 WeakPolarHBondContact SG-CA 3.46Å; C72-C90 WeakPolarHBondContact SG-CB 2.8Å; C72-C90 CovalentContact SG-SG 2.04Å; C72-C90 PolarHBondContact SG-SG 3.25Å; A76-C90 HydrophobicContact CB-CB 4.04Å
91	V	78.8	Confident	66.8	Low	48 Å²	48	95.7 Å²	95.7	29%	0.291	55%	0.55	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	134.8	179.9	-66.2	0	0	0	0	111.6	V77 E79 K93	V77-V91 PolarHBondContact N-O 2.04Å; V77-V91 WeakPolarHBondContact O-CG2 3.3Å; V77-V91 PolarHBondContact O-N 3.35Å; E79-V91 HydrophobicContact CB-CG2 4.03Å; E79-V91 HydrophobicContact CG-CG2 3.73Å; E79-V91 WeakPolarHBondContact OE2-CG2 3.07Å; V91-K93 PolarHBondContact O-N 3.49Å
92	C	77.4	Confident	67.2	Low	35 Å²	35	96.5 Å²	96.5	24%	0.236	56%	0.558	C	S	.	*			trans	-77	105.7	169.9	-65.7	0	0	0	0	109.1	K94 C123	C92-K94 PolarHBondContact O-N 2.98Å; C92-K94 VanDerWaalsContact O-N 3.16Å; C92-C123 WeakPolarHBondContact CA-SG 3.4Å; C92-C123 HydrophobicContact CB-CB 3.95Å; C92-C123 WeakPolarHBondContact CB-SG 3.4Å; C92-C123 WeakPolarHBondContact SG-CB 3.38Å; C92-C123 PolarHBondContact SG-O 3.01Å; C92-C123 CovalentContact SG-SG 2.04Å; C92-C123 PolarHBondContact SG-SG 2.93Å
93	K	64.8	Low	68	Low	101 Å²	101	91.6 Å²	91.6	44%	0.439	53%	0.53	S	S	.	.			trans	-62.8	119.2	177.4	-69.1	-161.3	172.7	-163.1	0	109.7	V77 E79 V91 N95	V77-K93 HydrophobicContact CB-CG 4.45Å; V77-K93 HydrophobicContact CG2-CD 4.34Å; V77-K93 HydrophobicContact CG2-CG 4.33Å; E79-K93 WeakPolarHBondContact OE1-CE 3.02Å; E79-K93 IonicContact OE1-NZ 2.69Å; E79-K93 PolarHBondContact OE1-NZ 2.93Å; V91-K93 PolarHBondContact O-N 3.49Å; K93-N95 PolarHBondContact O-N 3.37Å
94	K	56.8	Low	68.8	Low	182 Å²	182	83.1 Å²	83.1	79%	0.791	49%	0.491	S	S	*	.			trans	-75.1	63.5	176.2	-71.3	-175.3	177.2	178.3	0	110.9	C92 V96	C92-K94 PolarHBondContact O-N 2.98Å; C92-K94 VanDerWaalsContact O-N 3.16Å; K94-V96 PolarHBondContact O-N 3.07Å
95	N	59.1	Low	69.8	Low	111 Å²	111	79.3 Å²	79.3	59%	0.594	47%	0.471	S	S	*	.			trans	-60.9	133.5	164.4	-66.3	-3.7	0	0	0	107.8	K93 C97	K93-N95 PolarHBondContact O-N 3.37Å; N95-C97 PolarHBondContact O-N 2.76Å
96	V	67.8	Low	70.8	Confident	136 Å²	136	73.8 Å²	73.8	82%	0.824	44%	0.435	S	S	*	.			trans	-75.3	108.1	173.4	-180	0	0	0	0	106.6	K94	K94-V96 PolarHBondContact O-N 3.07Å
97	C	73.1	Confident	71.5	Confident	10 Å²	10	73.2 Å²	73.2	7%	0.068	42%	0.42	C	S	.	.			trans	-60.9	140.2	174.9	-68.8	0	0	0	0	109.7	N95 A99 C116 E117	N95-C97 PolarHBondContact O-N 2.76Å; C97-A99 PolarHBondContact O-N 3.41Å; C97-C116 WeakPolarHBondContact CA-SG 3.37Å; C97-C116 HydrophobicContact CB-CB 3.73Å; C97-C116 WeakPolarHBondContact CB-SG 3.46Å; C97-C116 WeakPolarHBondContact SG-CB 3.45Å; C97-C116 PolarHBondContact SG-O 3.3Å; C97-C116 CovalentContact SG-SG 2.05Å; C97-C116 PolarHBondContact SG-SG 3.38Å; C97-E117 HydrophobicContact CB-CG 4.09Å
98	P	73.3	Confident	72.1	Confident	86 Å²	86	67.9 Å²	67.9	56%	0.558	40%	0.404	S	S	*	.			trans	-55.1	141.1	174.5	-25	34.3	0	0	0	110.9	M100 N114	P98-M100 PolarHBondContact O-N 3.15Å; P98-N114 PolarHBondContact O-ND2 3.41Å
99	A	65.8	Low	72.2	Confident	106 Å²	106	70.9 Å²	70.9	88%	0.876	43%	0.429	S	S	*	.	S	Bend	trans	-72.7	21	178.8	0	0	0	0	0	113.9	C97	C97-A99 PolarHBondContact O-N 3.41Å
100	M	58.6	Low	72.4	Confident	138 Å²	138	70.6 Å²	70.6	68%	0.68	43%	0.427	S	S	*	.			trans	-77.2	124.3	175.4	-164	-164.9	-56.7	0	0	108.8	P98 N114	P98-M100 PolarHBondContact O-N 3.15Å; M100-N114 PolarHBondContact O-ND2 2.82Å
101	V	64.1	Low	72.7	Confident	115 Å²	115	71 Å²	71	70%	0.697	43%	0.428	S	S	*	.			trans	-95.7	104.5	178.6	-177.5	0	0	0	0	108.7
102	A	72	Confident	72.9	Confident	48 Å²	48	70 Å²	70	40%	0.397	42%	0.419	S	S	.	.			trans	-137.6	80.4	178.4	0	0	0	0	0	107	S113 N114	A102-S113 CarbonylContact C-O 3.48Å; A102-S113 VanDerWaalsContact C-O 3.29Å; A102-S113 PolarHBondContact N-O 3.48Å; A102-N114 WeakPolarHBondContact O-CA 3.05Å
103	P	78.9	Confident	73.1	Confident	48 Å²	48	71.1 Å²	71.1	31%	0.312	43%	0.427	S	S	.	.			trans	-64.4	145.9	-162.4	24.2	-33.7	0	0	0	112.5	T111 Y112 G135	P103-T111 HydrophobicContact CB-CG2 3.85Å; P103-Y112 CarbonylContact C-O 3.54Å; P103-Y112 WeakPolarHBondContact CA-O 3.07Å; P103-G135 WeakPolarHBondContact O-CA 3.42Å; P103-G135 PolarHBondContact O-N 3.25Å
104	V	81.8	Confident	73.8	Confident	4 Å²	4	67.1 Å²	67.1	2%	0.024	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	142.5	178.8	-60.6	0	0	0	0	111	Y112 L118 L131 Q134 G135	V104-Y112 PolarHBondContact N-O 2.89Å; V104-Y112 PolarHBondContact O-N 2.94Å; V104-L118 HydrophobicContact CG2-CB 3.96Å; V104-L118 HydrophobicContact CG2-CD1 3.68Å; V104-L118 HydrophobicContact CG2-CG 4.48Å; V104-L131 HydrophobicContact CB-CD1 3.89Å; V104-L131 HydrophobicContact CB-CG 4.33Å; V104-L131 HydrophobicContact CG1-CD1 3.83Å; V104-L131 HydrophobicContact CG2-CD1 4.32Å; V104-Q134 HydrophobicContact CG1-CG 4.11Å; V104-G135 CarbonylContact C-O 3.51Å; V104-G135 WeakPolarHBondContact CA-O 3.28Å
105	C	83.6	Confident	75	Confident	13 Å²	13	62.8 Å²	62.8	9%	0.088	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	122.3	177.9	-178.5	0	0	0	0	110	L132 R133 G135 C137	C105-L132 PolarHBondContact O-N 2.87Å; C105-R133 PolarHBondContact N-O 2.97Å; C105-G135 PolarHBondContact N-O 2.78Å; C105-C137 WeakPolarHBondContact CA-SG 3.48Å; C105-C137 HydrophobicContact CB-CB 4.1Å; C105-C137 WeakPolarHBondContact CB-SG 3.36Å; C105-C137 WeakPolarHBondContact SG-CA 3.03Å; C105-C137 WeakPolarHBondContact SG-CB 3.38Å; C105-C137 CovalentContact SG-SG 2.03Å; C105-C137 PolarHBondContact SG-SG 3.1Å
106	G	79	Confident	76.2	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	157.7	174.4	0	0	0	0	0	112.9	D108 A109 S110 R130	G106-D108 WeakPolarHBondContact CA-OD1 3.48Å; G106-D108 PolarHBondContact O-N 3.37Å; G106-D108 VanDerWaalsContact O-N 3.07Å; G106-A109 WeakPolarHBondContact O-CA 3.18Å; G106-A109 PolarHBondContact O-N 3.34Å; G106-S110 PolarHBondContact N-O 3.3Å; G106-R130 CarbonylContact C-O 3.36Å; G106-R130 WeakPolarHBondContact CA-O 3.37Å
107	S	77.8	Confident	77	Confident	58 Å²	58	55.2 Å²	55.2	41%	0.406	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	0.3	176.3	71	0	0	0	0	114.7	R130	S107-R130 PolarHBondContact N-O 2.97Å; S107-R130 PolarHBondContact OG-N 3.2Å
108	D	79.6	Confident	77.5	Confident	61 Å²	61	55 Å²	55	33%	0.326	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	6.9	167.8	65.8	-35.2	0	0	0	112.6	G106 S110 Y112 I129	G106-D108 WeakPolarHBondContact CA-OD1 3.48Å; G106-D108 PolarHBondContact O-N 3.37Å; G106-D108 VanDerWaalsContact O-N 3.07Å; D108-S110 PolarHBondContact O-N 3.24Å; D108-S110 PolarHBondContact OD1-N 2.95Å; D108-S110 WeakPolarHBondContact OD2-CB 3.43Å; D108-S110 PolarHBondContact OD2-OG 3.39Å; D108-Y112 WeakPolarHBondContact OD1-CE2 3.48Å; D108-Y112 PolarHBondContact OD2-OH 2.9Å; D108-I129 HydrophobicContact CB-CG1 4.41Å
109	A	72.2	Confident	77.8	Confident	75 Å²	75	55.7 Å²	55.7	62%	0.62	34%	0.343	S	S	*	.	S	Bend	trans	61.4	15.1	-172.3	0	0	0	0	0	115.2	G106 C137	G106-A109 WeakPolarHBondContact O-CA 3.18Å; G106-A109 PolarHBondContact O-N 3.34Å; A109-C137 WeakPolarHBondContact O-CB 3.48Å; A109-C137 PolarHBondContact O-SG 3.42Å; A109-C137 VanDerWaalsContact O-SG 3.33Å
110	S	79.5	Confident	78.5	Confident	48 Å²	48	54.9 Å²	54.9	34%	0.336	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-87.3	142.6	173.2	-57.9	0	0	0	0	111.5	G106 D108 Y112 C137	G106-S110 PolarHBondContact N-O 3.3Å; D108-S110 PolarHBondContact O-N 3.24Å; D108-S110 PolarHBondContact OD1-N 2.95Å; D108-S110 WeakPolarHBondContact OD2-CB 3.43Å; D108-S110 PolarHBondContact OD2-OG 3.39Å; S110-Y112 WeakPolarHBondContact O-CD2 3.39Å; S110-C137 VanDerWaalsContact C-SG 3.56Å; S110-C137 PolarHBondContact O-SG 2.61Å
111	T	83.5	Confident	79.5	Confident	69 Å²	69	48.9 Å²	48.9	42%	0.423	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	123.3	168.6	-59.3	0	0	0	0	110	P103 P136 C137	P103-T111 HydrophobicContact CB-CG2 3.85Å; T111-P136 HydrophobicContact CG2-CB 3.86Å; T111-P136 WeakPolarHBondContact OG1-CA 3.39Å; T111-C137 PolarHBondContact OG1-N 2.98Å
112	Y	83.4	Confident	80.4	Confident	26 Å²	26	45.6 Å²	45.6	10%	0.102	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	145.7	173	-63.4	-86.1	0	0	0	109.7	P103 V104 D108 S110 N114 L118 A121 I129	P103-Y112 CarbonylContact C-O 3.54Å; P103-Y112 WeakPolarHBondContact CA-O 3.07Å; V104-Y112 PolarHBondContact N-O 2.89Å; V104-Y112 PolarHBondContact O-N 2.94Å; D108-Y112 WeakPolarHBondContact OD1-CE2 3.48Å; D108-Y112 PolarHBondContact OD2-OH 2.9Å; S110-Y112 WeakPolarHBondContact O-CD2 3.39Å; Y112-N114 VanDerWaalsContact C-N 3.31Å; Y112-N114 PolarHBondContact O-N 3.08Å; Y112-L118 HydrophobicContact CD1-CB 4.35Å; Y112-L118 HydrophobicContact CD2-CB 3.98Å; Y112-L118 HydrophobicContact CD2-CD1 3.88Å; Y112-L118 HydrophobicContact CD2-CG 3.92Å; Y112-L118 HydrophobicContact CE2-CD1 4.49Å; Y112-L118 HydrophobicContact CE2-CG 4.37Å; Y112-L118 HydrophobicContact CG-CB 3.77Å; Y112-L118 HydrophobicContact CG-CD1 4.49Å; Y112-L118 HydrophobicContact CG-CG 4.24Å; Y112-A121 HydrophobicContact CD1-CB 3.95Å; Y112-A121 HydrophobicContact CE1-CB 3.29Å; Y112-I129 HydrophobicContact CE2-CG2 3.96Å; Y112-I129 WeakPolarHBondContact OH-CD1 3.07Å
113	S	79.8	Confident	80.9	Confident	58 Å²	58	43.7 Å²	43.7	41%	0.406	25%	0.251	S	S	.	.	S	Bend	trans	-71.3	-22.6	-174.6	43.7	0	0	0	0	114.3	A102	A102-S113 CarbonylContact C-O 3.48Å; A102-S113 VanDerWaalsContact C-O 3.29Å; A102-S113 PolarHBondContact N-O 3.48Å
114	N	80	Confident	80.9	Confident	17 Å²	17	45.9 Å²	45.9	9%	0.091	26%	0.26	C	S	.	.	S	Bend	trans	-160.9	173.9	164.6	58.2	53.8	0	0	0	110.6	P98 M100 A102 Y112 C116 E117 L118	P98-N114 PolarHBondContact O-ND2 3.41Å; M100-N114 PolarHBondContact O-ND2 2.82Å; A102-N114 WeakPolarHBondContact O-CA 3.05Å; Y112-N114 VanDerWaalsContact C-N 3.31Å; Y112-N114 PolarHBondContact O-N 3.08Å; N114-C116 VanDerWaalsContact C-N 3.34Å; N114-C116 PolarHBondContact O-N 3.19Å; N114-C116 WeakPolarHBondContact OD1-CB 3.5Å; N114-C116 PolarHBondContact OD1-N 3.3Å; N114-E117 WeakPolarHBondContact O-CB 3.32Å; N114-E117 PolarHBondContact O-N 3.21Å; N114-E117 VanDerWaalsContact O-N 3.14Å; N114-E117 WeakPolarHBondContact OD1-CG 3.42Å; N114-E117 PolarHBondContact OD1-N 2.97Å; N114-L118 PolarHBondContact O-N 2.91Å; N114-L118 VanDerWaalsContact O-N 3.1Å
115	E	81.8	Confident	80.7	Confident	92 Å²	92	50.1 Å²	50.1	43%	0.43	28%	0.279	S	S	.	.	H	α-helix	trans	-64.3	-34.5	-178.2	-164.5	-175	153.9	0	0	113.3	E117 L118 Q119 L131	E115-E117 VanDerWaalsContact C-N 3.27Å; E115-E117 PolarHBondContact O-N 3.24Å; E115-L118 WeakPolarHBondContact O-CB 3.46Å; E115-L118 PolarHBondContact O-N 3.2Å; E115-L118 VanDerWaalsContact O-N 3.17Å; E115-Q119 HydrophobicContact CG-CG 4.45Å; E115-Q119 WeakPolarHBondContact O-CG 3.43Å; E115-Q119 PolarHBondContact O-N 2.92Å; E115-Q119 PolarHBondContact OE1-NE2 3.21Å; E115-L131 HydrophobicContact CG-CD1 4.04Å
116	C	84.6	Confident	80.1	Confident	43 Å²	43	54.2 Å²	54.2	29%	0.291	30%	0.297	S	S	.	.	H	α-helix	trans	-60.4	-39.9	173.3	177.7	0	0	0	0	111.1	C97 N114 Q119 R120	C97-C116 WeakPolarHBondContact CA-SG 3.37Å; C97-C116 HydrophobicContact CB-CB 3.73Å; C97-C116 WeakPolarHBondContact CB-SG 3.46Å; C97-C116 WeakPolarHBondContact SG-CB 3.45Å; C97-C116 PolarHBondContact SG-O 3.3Å; C97-C116 CovalentContact SG-SG 2.05Å; C97-C116 PolarHBondContact SG-SG 3.38Å; N114-C116 VanDerWaalsContact C-N 3.34Å; N114-C116 PolarHBondContact O-N 3.19Å; N114-C116 WeakPolarHBondContact OD1-CB 3.5Å; N114-C116 PolarHBondContact OD1-N 3.3Å; C116-Q119 PolarHBondContact O-N 2.88Å; C116-R120 WeakPolarHBondContact O-CB 3.37Å; C116-R120 PolarHBondContact O-N 3.36Å
117	E	84.5	Confident	79.9	Confident	44 Å²	44	62.1 Å²	62.1	21%	0.206	33%	0.327	C	S	.	.	H	α-helix	trans	-68.6	-34.7	175.7	-70	-71.6	178.4	0	0	112.7	C97 N114 E115 R120 A121	C97-E117 HydrophobicContact CB-CG 4.09Å; N114-E117 WeakPolarHBondContact O-CB 3.32Å; N114-E117 PolarHBondContact O-N 3.21Å; N114-E117 VanDerWaalsContact O-N 3.14Å; N114-E117 WeakPolarHBondContact OD1-CG 3.42Å; N114-E117 PolarHBondContact OD1-N 2.97Å; E115-E117 VanDerWaalsContact C-N 3.27Å; E115-E117 PolarHBondContact O-N 3.24Å; E117-R120 VanDerWaalsContact CD-CZ 3.46Å; E117-R120 IonicContact OE1-CZ 3.99Å; E117-R120 IonicContact OE1-NE 3.93Å; E117-R120 IonicContact OE1-NH1 2.73Å; E117-R120 IonicContact OE1-NH2 3.87Å; E117-R120 PolarHBondContact OE1-NH2 3.19Å; E117-R120 IonicContact OE2-CZ 3.47Å; E117-R120 IonicContact OE2-NE 3.17Å; E117-R120 PolarHBondContact OE2-NE 3.21Å; E117-R120 IonicContact OE2-NH2 3.53Å; E117-R120 PolarHBondContact OE2-NH2 2.92Å; E117-A121 VanDerWaalsContact O-CB 3.28Å; E117-A121 WeakPolarHBondContact O-CB 3.04Å; E117-A121 PolarHBondContact O-N 2.02Å
118	L	84.8	Confident	79.5	Confident	5 Å²	5	67.6 Å²	67.6	3%	0.026	34%	0.339	C	S	.	.	H	α-helix	trans	-64.3	-48.2	171.3	-177	155.2	0	0	0	111.4	V104 Y112 N114 E115 R120 A121 Q122 I129 L131	V104-L118 HydrophobicContact CG2-CB 3.96Å; V104-L118 HydrophobicContact CG2-CD1 3.68Å; V104-L118 HydrophobicContact CG2-CG 4.48Å; Y112-L118 HydrophobicContact CD1-CB 4.35Å; Y112-L118 HydrophobicContact CD2-CB 3.98Å; Y112-L118 HydrophobicContact CD2-CD1 3.88Å; Y112-L118 HydrophobicContact CD2-CG 3.92Å; Y112-L118 HydrophobicContact CE2-CD1 4.49Å; Y112-L118 HydrophobicContact CE2-CG 4.37Å; Y112-L118 HydrophobicContact CG-CB 3.77Å; Y112-L118 HydrophobicContact CG-CD1 4.49Å; Y112-L118 HydrophobicContact CG-CG 4.24Å; N114-L118 PolarHBondContact O-N 2.91Å; N114-L118 VanDerWaalsContact O-N 3.1Å; E115-L118 WeakPolarHBondContact O-CB 3.46Å; E115-L118 PolarHBondContact O-N 3.2Å; E115-L118 VanDerWaalsContact O-N 3.17Å; L118-R120 VanDerWaalsContact C-N 3.33Å; L118-R120 PolarHBondContact O-N 3.19Å; L118-A121 PolarHBondContact O-N 3.22Å; L118-Q122 WeakPolarHBondContact O-CB 3.4Å; L118-Q122 PolarHBondContact O-N 3.47Å; L118-I129 HydrophobicContact CD1-CG2 4.18Å; L118-I129 HydrophobicContact CD2-CG2 4.17Å; L118-I129 HydrophobicContact CG-CG2 3.92Å; L118-L131 HydrophobicContact CD1-CB 4.22Å
119	Q	77.7	Confident	79.3	Confident	101 Å²	101	64.9 Å²	64.9	47%	0.472	33%	0.325	S	S	.	.	H	α-helix	trans	-64.2	-38.6	177.4	-66.9	176.4	12.5	0	0	111.4	E115 C116 Q122 C123	E115-Q119 HydrophobicContact CG-CG 4.45Å; E115-Q119 WeakPolarHBondContact O-CG 3.43Å; E115-Q119 PolarHBondContact O-N 2.92Å; E115-Q119 PolarHBondContact OE1-NE2 3.21Å; C116-Q119 PolarHBondContact O-N 2.88Å; Q119-Q122 WeakPolarHBondContact O-CB 3.21Å; Q119-Q122 PolarHBondContact O-N 3.07Å; Q119-C123 PolarHBondContact O-N 3.09Å
120	R	81.6	Confident	79.3	Confident	89 Å²	89	68.5 Å²	68.5	34%	0.336	32%	0.322	S	S	.	.	H	α-helix	trans	-66.8	-37.1	175.1	-170	170.7	78.9	163.3	7.7	112.1	C116 E117 L118 N124	C116-R120 WeakPolarHBondContact O-CB 3.37Å; C116-R120 PolarHBondContact O-N 3.36Å; E117-R120 VanDerWaalsContact CD-CZ 3.46Å; E117-R120 IonicContact OE1-CZ 3.99Å; E117-R120 IonicContact OE1-NE 3.93Å; E117-R120 IonicContact OE1-NH1 2.73Å; E117-R120 IonicContact OE1-NH2 3.87Å; E117-R120 PolarHBondContact OE1-NH2 3.19Å; E117-R120 IonicContact OE2-CZ 3.47Å; E117-R120 IonicContact OE2-NE 3.17Å; E117-R120 PolarHBondContact OE2-NE 3.21Å; E117-R120 IonicContact OE2-NH2 3.53Å; E117-R120 PolarHBondContact OE2-NH2 2.92Å; L118-R120 VanDerWaalsContact C-N 3.33Å; L118-R120 PolarHBondContact O-N 3.19Å; R120-N124 WeakPolarHBondContact O-CB 3.36Å; R120-N124 VanDerWaalsContact O-CG 3.25Å; R120-N124 PolarHBondContact O-N 2.99Å; R120-N124 PolarHBondContact O-ND2 2.85Å
121	A	79.6	Confident	79.2	Confident	13 Å²	13	69.5 Å²	69.5	11%	0.107	32%	0.323	C	S	.	.	H	α-helix	trans	-66.9	-44.7	172	0	0	0	0	0	111.8	Y112 E117 L118 C123 N124 Q125 I129	Y112-A121 HydrophobicContact CD1-CB 3.95Å; Y112-A121 HydrophobicContact CE1-CB 3.29Å; E117-A121 VanDerWaalsContact O-CB 3.28Å; E117-A121 WeakPolarHBondContact O-CB 3.04Å; E117-A121 PolarHBondContact O-N 2.02Å; L118-A121 PolarHBondContact O-N 3.22Å; A121-C123 VanDerWaalsContact C-N 3.29Å; A121-C123 PolarHBondContact O-N 3.09Å; A121-N124 PolarHBondContact O-N 2.98Å; A121-Q125 VanDerWaalsContact O-CB 3.26Å; A121-Q125 WeakPolarHBondContact O-CB 3.36Å; A121-Q125 VanDerWaalsContact O-CG 3.3Å; A121-Q125 WeakPolarHBondContact O-CG 3.46Å; A121-Q125 PolarHBondContact O-N 2.82Å; A121-I129 HydrophobicContact CB-CD1 4.15Å
122	Q	82.1	Confident	78.5	Confident	45 Å²	45	71.7 Å²	71.7	21%	0.21	33%	0.332	C	S	.	.	H	α-helix	trans	-52	-47.4	174	163.6	172.7	127.9	0	0	111.4	F74 L118 Q119 Q126 R127 I129	F74-Q122 HydrophobicContact CB-CG 3.99Å; F74-Q122 HydrophobicContact CD1-CG 4.42Å; L118-Q122 WeakPolarHBondContact O-CB 3.4Å; L118-Q122 PolarHBondContact O-N 3.47Å; Q119-Q122 WeakPolarHBondContact O-CB 3.21Å; Q119-Q122 PolarHBondContact O-N 3.07Å; Q122-Q126 WeakPolarHBondContact O-CA 2.97Å; Q122-Q126 PolarHBondContact O-N 2.85Å; Q122-Q126 VanDerWaalsContact O-N 3.15Å; Q122-R127 WeakPolarHBondContact CA-O 3.49Å; Q122-R127 WeakPolarHBondContact CG-O 3.01Å; Q122-R127 PolarHBondContact O-N 3.12Å; Q122-I129 HydrophobicContact CB-CB 4.46Å; Q122-I129 PolarHBondContact NE2-O 3.05Å
123	C	82.3	Confident	77.9	Confident	9 Å²	9	77.4 Å²	77.4	6%	0.061	35%	0.353	C	S	.	.	H	α-helix	trans	-66.9	-55.3	176.7	-161.5	0	0	0	0	112.2	F74 A76 C92 Q119 A121 Q125 Q126	F74-C123 WeakPolarHBondContact O-CA 3.44Å; F74-C123 WeakPolarHBondContact O-CB 3.29Å; F74-C123 PolarHBondContact O-N 2.8Å; A76-C123 VanDerWaalsContact CA-SG 3.58Å; A76-C123 PolarHBondContact N-SG 3.02Å; A76-C123 VanDerWaalsContact N-SG 3.4Å; C92-C123 WeakPolarHBondContact CA-SG 3.4Å; C92-C123 HydrophobicContact CB-CB 3.95Å; C92-C123 WeakPolarHBondContact CB-SG 3.4Å; C92-C123 WeakPolarHBondContact SG-CB 3.38Å; C92-C123 PolarHBondContact SG-O 3.01Å; C92-C123 CovalentContact SG-SG 2.04Å; C92-C123 PolarHBondContact SG-SG 2.93Å; Q119-C123 PolarHBondContact O-N 3.09Å; A121-C123 VanDerWaalsContact C-N 3.29Å; A121-C123 PolarHBondContact O-N 3.09Å; C123-Q125 VanDerWaalsContact C-N 3.3Å; C123-Q125 PolarHBondContact O-N 3.47Å; C123-Q126 PolarHBondContact O-N 3.45Å; C123-Q126 VanDerWaalsContact O-N 3.11Å; C123-Q126 PolarHBondContact O-NE2 2.94Å
124	N	80.1	Confident	77.6	Confident	93 Å²	93	81.9 Å²	81.9	50%	0.497	37%	0.368	S	S	.	.	H	α-helix	trans	-63.6	-32.2	-174.3	-73.7	-28.4	0	0	0	113.5	R120 A121	R120-N124 WeakPolarHBondContact O-CB 3.36Å; R120-N124 VanDerWaalsContact O-CG 3.25Å; R120-N124 PolarHBondContact O-N 2.99Å; R120-N124 PolarHBondContact O-ND2 2.85Å; A121-N124 PolarHBondContact O-N 2.98Å
125	Q	77.8	Confident	77.1	Confident	93 Å²	93	82.2 Å²	82.2	44%	0.435	38%	0.376	S	S	.	.	H	α-helix	trans	-89.6	-9.3	178.1	-60	-177.7	27.7	0	0	113.3	A121 C123 R127	A121-Q125 VanDerWaalsContact O-CB 3.26Å; A121-Q125 WeakPolarHBondContact O-CB 3.36Å; A121-Q125 VanDerWaalsContact O-CG 3.3Å; A121-Q125 WeakPolarHBondContact O-CG 3.46Å; A121-Q125 PolarHBondContact O-N 2.82Å; C123-Q125 VanDerWaalsContact C-N 3.3Å; C123-Q125 PolarHBondContact O-N 3.47Å; Q125-R127 VanDerWaalsContact C-N 3.27Å; Q125-R127 HydrophobicContact CB-CB 4.27Å; Q125-R127 HydrophobicContact CB-CG 4.33Å; Q125-R127 PolarHBondContact O-N 2.85Å
126	Q	71.3	Confident	76.7	Confident	99 Å²	99	81.2 Å²	81.2	46%	0.463	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	44.4	-171.4	-63.2	-73.1	-76.5	0	0	112.4	F74 Q122 C123	F74-Q126 HydrophobicContact CD2-CB 4.12Å; F74-Q126 HydrophobicContact CE2-CB 4.24Å; Q122-Q126 WeakPolarHBondContact O-CA 2.97Å; Q122-Q126 PolarHBondContact O-N 2.85Å; Q122-Q126 VanDerWaalsContact O-N 3.15Å; C123-Q126 PolarHBondContact O-N 3.45Å; C123-Q126 VanDerWaalsContact O-N 3.11Å; C123-Q126 PolarHBondContact O-NE2 2.94Å
127	R	74.2	Confident	76.1	Confident	167 Å²	167	80.8 Å²	80.8	63%	0.63	37%	0.374	S	S	*	.			trans	-131	132.9	-176.4	-76.5	179.1	175.5	-142.8	-3.9	110.6	Q122 Q125 I129	Q122-R127 WeakPolarHBondContact CA-O 3.49Å; Q122-R127 WeakPolarHBondContact CG-O 3.01Å; Q122-R127 PolarHBondContact O-N 3.12Å; Q125-R127 VanDerWaalsContact C-N 3.27Å; Q125-R127 HydrophobicContact CB-CB 4.27Å; Q125-R127 HydrophobicContact CB-CG 4.33Å; Q125-R127 PolarHBondContact O-N 2.85Å; R127-I129 HydrophobicContact CB-CG1 4.4Å; R127-I129 PolarHBondContact O-N 2.98Å
128	R	68.6	Low	75.1	Confident	172 Å²	172	82.4 Å²	82.4	65%	0.649	40%	0.403	S	S	*	.			trans	-76.2	66.8	-179.8	-164.1	177.9	-176.5	-174.1	0.7	112.1	F74 R130	F74-R128 HydrophobicContact CD1-CB 4.35Å; F74-R128 HydrophobicContact CE1-CB 4.04Å; R128-R130 PolarHBondContact O-N 3.4Å; R128-R130 VanDerWaalsContact O-N 3.16Å
129	I	76.9	Confident	73.8	Confident	5 Å²	5	85.5 Å²	85.5	3%	0.026	43%	0.425	C	S	.	.			trans	-68.1	105.8	170.6	-58.3	156.4	0	0	0	107.5	D108 Y112 L118 A121 Q122 R127	D108-I129 HydrophobicContact CB-CG1 4.41Å; Y112-I129 HydrophobicContact CE2-CG2 3.96Å; Y112-I129 WeakPolarHBondContact OH-CD1 3.07Å; L118-I129 HydrophobicContact CD1-CG2 4.18Å; L118-I129 HydrophobicContact CD2-CG2 4.17Å; L118-I129 HydrophobicContact CG-CG2 3.92Å; A121-I129 HydrophobicContact CB-CD1 4.15Å; Q122-I129 HydrophobicContact CB-CB 4.46Å; Q122-I129 PolarHBondContact NE2-O 3.05Å; R127-I129 HydrophobicContact CB-CG1 4.4Å; R127-I129 PolarHBondContact O-N 2.98Å
130	R	71.9	Confident	72.8	Confident	151 Å²	151	91.8 Å²	91.8	57%	0.57	44%	0.444	S	S	*	.			trans	-81.3	152.6	170.6	-54.9	-173.7	-171	-166.3	5.1	108.9	G106 S107 R128 L132	G106-R130 CarbonylContact C-O 3.36Å; G106-R130 WeakPolarHBondContact CA-O 3.37Å; S107-R130 PolarHBondContact N-O 2.97Å; S107-R130 PolarHBondContact OG-N 3.2Å; R128-R130 PolarHBondContact O-N 3.4Å; R128-R130 VanDerWaalsContact O-N 3.16Å; R130-L132 PolarHBondContact O-N 3.35Å
131	L	76	Confident	71.7	Confident	68 Å²	68	91.2 Å²	91.2	36%	0.356	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	120.5	167.4	-173.8	151.5	0	0	0	108.2	V104 E115 L118	V104-L131 HydrophobicContact CB-CD1 3.89Å; V104-L131 HydrophobicContact CB-CG 4.33Å; V104-L131 HydrophobicContact CG1-CD1 3.83Å; V104-L131 HydrophobicContact CG2-CD1 4.32Å; E115-L131 HydrophobicContact CG-CD1 4.04Å; L118-L131 HydrophobicContact CD1-CB 4.22Å
132	L	69.8	Low	71.1	Confident	116 Å²	116	92 Å²	92	61%	0.607	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	-42.8	177.3	-91.8	177.5	0	0	0	112.1	C105 R130	C105-L132 PolarHBondContact O-N 2.87Å; R130-L132 PolarHBondContact O-N 3.35Å
133	R	70.8	Confident	70.3	Confident	145 Å²	145	91 Å²	91	55%	0.547	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	152	-177.7	-155.8	-178.8	-80.4	-164.1	-6.9	109.4	C105	C105-R133 PolarHBondContact N-O 2.97Å
134	Q	74	Confident	69.5	Low	152 Å²	152	94.3 Å²	94.3	71%	0.71	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.8	146	161	-74.8	169.5	-23.2	0	0	109.5	V104	V104-Q134 HydrophobicContact CG1-CG 4.11Å
135	G	68.6	Low	68.5	Low	25 Å²	25	97.3 Å²	97.3	26%	0.258	49%	0.494	S	S	.	.	S	Bend	trans	95.7	169.9	-166	0	0	0	0	0	113.5	P103 V104 C105	P103-G135 WeakPolarHBondContact O-CA 3.42Å; P103-G135 PolarHBondContact O-N 3.25Å; V104-G135 CarbonylContact C-O 3.51Å; V104-G135 WeakPolarHBondContact CA-O 3.28Å; C105-G135 PolarHBondContact N-O 2.78Å
136	P	74.1	Confident	67.9	Low	70 Å²	70	95.7 Å²	95.7	46%	0.455	49%	0.49	S	S	.	.			trans	-73.8	147.9	179.7	31.3	-35.6	0	0	0	112.7	T111 G138	T111-P136 HydrophobicContact CG2-CB 3.86Å; T111-P136 WeakPolarHBondContact OG1-CA 3.39Å; P136-G138 PolarHBondContact O-N 3.31Å
137	C	70.9	Confident	67.4	Low	34 Å²	34	97.5 Å²	97.5	23%	0.23	51%	0.508	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	132.6	169.6	-53.9	0	0	0	0	110.4	C105 A109 S110 T111	C105-C137 WeakPolarHBondContact CA-SG 3.48Å; C105-C137 HydrophobicContact CB-CB 4.1Å; C105-C137 WeakPolarHBondContact CB-SG 3.36Å; C105-C137 WeakPolarHBondContact SG-CA 3.03Å; C105-C137 WeakPolarHBondContact SG-CB 3.38Å; C105-C137 CovalentContact SG-SG 2.03Å; C105-C137 PolarHBondContact SG-SG 3.1Å; A109-C137 WeakPolarHBondContact O-CB 3.48Å; A109-C137 PolarHBondContact O-SG 3.42Å; A109-C137 VanDerWaalsContact O-SG 3.33Å; S110-C137 VanDerWaalsContact C-SG 3.56Å; S110-C137 PolarHBondContact O-SG 2.61Å; T111-C137 PolarHBondContact OG1-N 2.98Å
138	G	63.7	Low	67.1	Low	79 Å²	79	91 Å²	91	81%	0.814	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.4	-2.1	172.9	0	0	0	0	0	116.4	P136 R140	P136-G138 PolarHBondContact O-N 3.31Å; G138-R140 PolarHBondContact O-N 2.03Å
139	S	57.3	Low	67.1	Low	70 Å²	70	85.5 Å²	85.5	49%	0.49	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-65.2	116.6	164.7	55.4	0	0	0	0	109.6
140	R	58.1	Low	66.7	Low	233 Å²	233	87.3 Å²	87.3	88%	0.879	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-58.1	140.6	172.4	-79.6	-177	167.5	-177.6	-4.9	109.9	G138 P142	G138-R140 PolarHBondContact O-N 2.03Å; R140-P142 WeakPolarHBondContact O-CD 3.47Å
141	D	58.1	Low	66.5	Low	76 Å²	76	81 Å²	81	41%	0.406	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-67.6	118.6	171.3	-163.4	-51.1	0	0	0	109.5	C143 A144	D141-C143 PolarHBondContact O-N 3.03Å; D141-C143 WeakPolarHBondContact OD1-CB 3.47Å; D141-C143 PolarHBondContact OD1-N 2.95Å; D141-A144 HydrophobicContact CB-CB 4.45Å; D141-A144 PolarHBondContact O-N 3.15Å
142	P	65.6	Low	66.5	Low	30 Å²	30	78.8 Å²	78.8	20%	0.195	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-18.5	-177.2	31.1	-35.9	0	0	0	112.6	R140 V146 P156 T162 A163	R140-P142 WeakPolarHBondContact O-CD 3.47Å; P142-V146 WeakPolarHBondContact O-CG2 3.29Å; P142-P156 HydrophobicContact CG-CB 3.79Å; P142-T162 VanDerWaalsContact CB-C 3.5Å; P142-T162 VanDerWaalsContact CG-O 3.32Å; P142-T162 WeakPolarHBondContact CG-O 3.3Å; P142-A163 HydrophobicContact CB-CB 3.91Å; P142-A163 HydrophobicContact CG-CB 4.35Å; P142-A163 VanDerWaalsContact O-CB 3.31Å; P142-A163 WeakPolarHBondContact O-CB 3.41Å
143	C	66.2	Low	66.7	Low	25 Å²	25	77.4 Å²	77.4	17%	0.169	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-14.2	179.2	-80.7	0	0	0	0	113.9	D141 N145 V146 C154 V155	D141-C143 PolarHBondContact O-N 3.03Å; D141-C143 WeakPolarHBondContact OD1-CB 3.47Å; D141-C143 PolarHBondContact OD1-N 2.95Å; C143-N145 PolarHBondContact O-N 2.78Å; C143-V146 PolarHBondContact O-N 3.27Å; C143-C154 WeakPolarHBondContact CA-SG 3.25Å; C143-C154 HydrophobicContact CB-CB 3.78Å; C143-C154 WeakPolarHBondContact CB-SG 3.32Å; C143-C154 WeakPolarHBondContact SG-CB 3.41Å; C143-C154 CovalentContact SG-SG 2.04Å; C143-C154 PolarHBondContact SG-SG 2.03Å; C143-V155 PolarHBondContact SG-N 2.79Å; C143-V155 VanDerWaalsContact SG-N 3.42Å
144	A	65.9	Low	66.8	Low	77 Å²	77	71.9 Å²	71.9	64%	0.636	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-25.3	-174.7	0	0	0	0	0	114.8	D141	D141-A144 HydrophobicContact CB-CB 4.45Å; D141-A144 PolarHBondContact O-N 3.15Å
145	N	59.7	Low	67	Low	157 Å²	157	67.2 Å²	67.2	84%	0.84	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.5	15.7	178.8	-77.7	17.9	0	0	0	113.5	C143	C143-N145 PolarHBondContact O-N 2.78Å
146	V	63.4	Low	67.1	Low	59 Å²	59	69.7 Å²	69.7	36%	0.358	43%	0.428	S	S	.	.			trans	-112.5	101.2	-175	176.5	0	0	0	0	111.5	P142 C143 C148 A163	P142-V146 WeakPolarHBondContact O-CG2 3.29Å; C143-V146 PolarHBondContact O-N 3.27Å; V146-C148 PolarHBondContact O-N 2.7Å; V146-A163 HydrophobicContact CB-CB 4.16Å; V146-A163 HydrophobicContact CG1-CB 4.34Å; V146-A163 HydrophobicContact CG2-CB 3.81Å
147	T	61.2	Low	66.9	Low	136 Å²	136	67.2 Å²	67.2	83%	0.834	41%	0.413	S	S	*	.			trans	-81.6	112.9	175	-23.8	0	0	0	0	110.4
148	C	67.5	Low	66.2	Low	31 Å²	31	70.1 Å²	70.1	21%	0.209	44%	0.439	C	S	.	.			trans	-88.3	143	178.2	-66.3	0	0	0	0	111.7	V146 S152 C154 C165	V146-C148 PolarHBondContact O-N 2.7Å; C148-S152 WeakPolarHBondContact CB-O 3.17Å; C148-S152 WeakPolarHBondContact CB-OG 3.47Å; C148-C154 VanDerWaalsContact SG-CB 3.58Å; C148-C165 WeakPolarHBondContact CA-SG 3.5Å; C148-C165 HydrophobicContact CB-CB 3.7Å; C148-C165 WeakPolarHBondContact CB-SG 2.98Å; C148-C165 WeakPolarHBondContact SG-CA 3.45Å; C148-C165 WeakPolarHBondContact SG-CB 3.43Å; C148-C165 CovalentContact SG-SG 2.04Å; C148-C165 PolarHBondContact SG-SG 3.14Å
149	S	68.6	Low	65.8	Low	57 Å²	57	72 Å²	72	40%	0.399	43%	0.43	S	S	.	.			trans	-97	159.8	-176.1	-50.6	0	0	0	0	112.5	G151 S152	S149-G151 PolarHBondContact O-N 2.8Å; S149-S152 WeakPolarHBondContact O-CB 3.01Å; S149-S152 PolarHBondContact O-N 2.85Å; S149-S152 PolarHBondContact O-OG 3.45Å
150	F	70.4	Confident	65.8	Low	43 Å²	43	70.6 Å²	70.6	19%	0.189	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	60.1	166.9	-46.2	-62.4	0	0	0	113.8	S152 A197 C198 Q201 H203 V376	F150-S152 PolarHBondContact O-N 3.48Å; F150-A197 CarbonylContact O-C 3.54Å; F150-C198 WeakPolarHBondContact O-CA 3.45Å; F150-C198 WeakPolarHBondContact O-CB 2.99Å; F150-C198 PolarHBondContact O-N 2.65Å; F150-C198 VanDerWaalsContact O-N 3.1Å; F150-Q201 HydrophobicContact CD2-CB 4.3Å; F150-Q201 HydrophobicContact CG-CB 4.46Å; F150-H203 HydrophobicContact CD1-CB 4.29Å; F150-H203 HydrophobicContact CE1-CB 4.21Å; F150-V376 HydrophobicContact CE2-CG2 4.36Å
151	G	65.8	Low	65.7	Low	17 Å²	17	67.3 Å²	67.3	18%	0.175	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	5.1	175.3	0	0	0	0	0	116.9	S149	S149-G151 PolarHBondContact O-N 2.8Å
152	S	76.4	Confident	65.7	Low	23 Å²	23	67.1 Å²	67.1	16%	0.161	42%	0.423	C	S	.	.			trans	-82.4	144.6	175.7	63.8	0	0	0	0	112.6	C148 S149 F150 L166 C167	C148-S152 WeakPolarHBondContact CB-O 3.17Å; C148-S152 WeakPolarHBondContact CB-OG 3.47Å; S149-S152 WeakPolarHBondContact O-CB 3.01Å; S149-S152 PolarHBondContact O-N 2.85Å; S149-S152 PolarHBondContact O-OG 3.45Å; F150-S152 PolarHBondContact O-N 3.48Å; S152-L166 CarbonylContact C-O 3.42Å; S152-L166 WeakPolarHBondContact CA-O 3.49Å; S152-L166 WeakPolarHBondContact CB-O 3.14Å; S152-C167 VanDerWaalsContact CB-SG 3.56Å
153	T	75.2	Confident	65.8	Low	86 Å²	86	67.1 Å²	67.1	53%	0.528	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	139.5	-179.5	-50.5	0	0	0	0	110.2	L166	T153-L166 PolarHBondContact N-O 2.03Å; T153-L166 PolarHBondContact O-N 2.83Å
154	C	73	Confident	66	Low	30 Å²	30	68 Å²	68	20%	0.203	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	131.4	173.6	-167.7	0	0	0	0	110.9	C143 C148 A163	C143-C154 WeakPolarHBondContact CA-SG 3.25Å; C143-C154 HydrophobicContact CB-CB 3.78Å; C143-C154 WeakPolarHBondContact CB-SG 3.32Å; C143-C154 WeakPolarHBondContact SG-CB 3.41Å; C143-C154 CovalentContact SG-SG 2.04Å; C143-C154 PolarHBondContact SG-SG 2.03Å; C148-C154 VanDerWaalsContact SG-CB 3.58Å; C154-A163 VanDerWaalsContact SG-CB 3.57Å
155	V	77.2	Confident	66.6	Low	54 Å²	54	67 Å²	67	33%	0.327	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	148.4	166.1	-60.5	0	0	0	0	110.7	C143 S157 S164 L166	C143-V155 PolarHBondContact SG-N 2.79Å; C143-V155 VanDerWaalsContact SG-N 3.42Å; V155-S157 PolarHBondContact O-N 3.01Å; V155-S164 PolarHBondContact N-O 2.86Å; V155-S164 PolarHBondContact O-N 3.23Å; V155-L166 HydrophobicContact CG2-CD1 3.56Å; V155-L166 HydrophobicContact CG2-CG 3.84Å
156	P	71.1	Confident	67.4	Low	77 Å²	77	62.6 Å²	62.6	50%	0.5	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	135.3	169.1	27.7	-34.2	0	0	0	110.4	P142	P142-P156 HydrophobicContact CG-CB 3.79Å
157	S	69.2	Low	68	Low	18 Å²	18	62 Å²	62	13%	0.126	39%	0.394	C	S	.	.			trans	-66.1	161	173.6	-51.8	0	0	0	0	111.4	V155 D159 G160 T162 S164	V155-S157 PolarHBondContact O-N 3.01Å; S157-D159 PolarHBondContact O-N 3.18Å; S157-G160 PolarHBondContact O-N 2.82Å; S157-T162 WeakPolarHBondContact CB-OG1 3.43Å; S157-T162 PolarHBondContact N-O 3.39Å; S157-T162 PolarHBondContact OG-O 3.05Å; S157-T162 PolarHBondContact OG-OG1 3.09Å; S157-S164 PolarHBondContact OG-OG 3.35Å
158	A	56	Low	68.8	Low	95 Å²	95	57 Å²	57	79%	0.785	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-27.3	-178.9	0	0	0	0	0	114.8	G160	A158-G160 PolarHBondContact O-N 2.63Å
159	D	55.7	Low	69	Low	118 Å²	118	60.3 Å²	60.3	63%	0.631	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-4	176.4	-50.6	-68.9	0	0	0	114.4	S157 Q161	S157-D159 PolarHBondContact O-N 3.18Å; D159-Q161 PolarHBondContact O-N 3.2Å; D159-Q161 PolarHBondContact O-NE2 3.4Å; D159-Q161 VanDerWaalsContact O-NE2 3.1Å
160	G	58.4	Low	69.2	Low	41 Å²	41	61.7 Å²	61.7	42%	0.423	39%	0.389	S	S	.	.	S	Bend	trans	67.9	-0.6	179.8	0	0	0	0	0	116.1	S157 A158	S157-G160 PolarHBondContact O-N 2.82Å; A158-G160 PolarHBondContact O-N 2.63Å
161	Q	56.1	Low	69.4	Low	164 Å²	164	61 Å²	61	77%	0.766	39%	0.39	S	S	*	.	S	Bend	trans	-119.7	-8	-168.8	-72.2	165.3	82.3	0	0	114.2	D159	D159-Q161 PolarHBondContact O-N 3.2Å; D159-Q161 PolarHBondContact O-NE2 3.4Å; D159-Q161 VanDerWaalsContact O-NE2 3.1Å
162	T	57.1	Low	69.1	Low	71 Å²	71	69.6 Å²	69.6	44%	0.436	42%	0.422	S	S	.	.	S	Bend	trans	-130.9	163.4	178.5	62.6	0	0	0	0	110.2	P142 S157	P142-T162 VanDerWaalsContact CB-C 3.5Å; P142-T162 VanDerWaalsContact CG-O 3.32Å; P142-T162 WeakPolarHBondContact CG-O 3.3Å; S157-T162 WeakPolarHBondContact CB-OG1 3.43Å; S157-T162 PolarHBondContact N-O 3.39Å; S157-T162 PolarHBondContact OG-O 3.05Å; S157-T162 PolarHBondContact OG-OG1 3.09Å
163	A	68.5	Low	68.3	Low	30 Å²	30	72.5 Å²	72.5	25%	0.248	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	142.3	-178.8	0	0	0	0	0	110.6	P142 V146 C154	P142-A163 HydrophobicContact CB-CB 3.91Å; P142-A163 HydrophobicContact CG-CB 4.35Å; P142-A163 VanDerWaalsContact O-CB 3.31Å; P142-A163 WeakPolarHBondContact O-CB 3.41Å; V146-A163 HydrophobicContact CB-CB 4.16Å; V146-A163 HydrophobicContact CG1-CB 4.34Å; V146-A163 HydrophobicContact CG2-CB 3.81Å; C154-A163 VanDerWaalsContact SG-CB 3.57Å
164	S	70	Confident	67.4	Low	44 Å²	44	69.8 Å²	69.8	31%	0.308	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	129	-177.7	-68.5	0	0	0	0	109.9	V155 S157	V155-S164 PolarHBondContact N-O 2.86Å; V155-S164 PolarHBondContact O-N 3.23Å; S157-S164 PolarHBondContact OG-OG 3.35Å
165	C	77.9	Confident	66.7	Low	55 Å²	55	74 Å²	74	37%	0.372	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	116.2	171	-61.6	0	0	0	0	109.2	C148	C148-C165 WeakPolarHBondContact CA-SG 3.5Å; C148-C165 HydrophobicContact CB-CB 3.7Å; C148-C165 WeakPolarHBondContact CB-SG 2.98Å; C148-C165 WeakPolarHBondContact SG-CA 3.45Å; C148-C165 WeakPolarHBondContact SG-CB 3.43Å; C148-C165 CovalentContact SG-SG 2.04Å; C148-C165 PolarHBondContact SG-SG 3.14Å
166	L	76.7	Confident	65.9	Low	66 Å²	66	78.6 Å²	78.6	35%	0.346	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	150	177.7	-62.8	-174.2	0	0	0	111	S152 T153 V155	S152-L166 CarbonylContact C-O 3.42Å; S152-L166 WeakPolarHBondContact CA-O 3.49Å; S152-L166 WeakPolarHBondContact CB-O 3.14Å; T153-L166 PolarHBondContact N-O 2.03Å; T153-L166 PolarHBondContact O-N 2.83Å; V155-L166 HydrophobicContact CG2-CD1 3.56Å; V155-L166 HydrophobicContact CG2-CG 3.84Å
167	C	76.5	Confident	66.1	Low	46 Å²	46	76.9 Å²	76.9	31%	0.311	49%	0.489	S	S	.	.			trans	-101.8	146.1	177.5	-58.8	0	0	0	0	111.3	S152 T169 C198	S152-C167 VanDerWaalsContact CB-SG 3.56Å; C167-T169 PolarHBondContact O-N 3.16Å; C167-C198 HydrophobicContact CB-CB 3.59Å; C167-C198 WeakPolarHBondContact CB-SG 3.44Å; C167-C198 WeakPolarHBondContact SG-CB 3.35Å; C167-C198 CovalentContact SG-SG 2.01Å; C167-C198 PolarHBondContact SG-SG 3.23Å
168	P	76.7	Confident	67	Low	31 Å²	31	79 Å²	79	20%	0.201	50%	0.501	C	S	.	.			trans	-65.6	105	177.7	24.2	-31.5	0	0	0	110.9	L194 R195	P168-L194 HydrophobicContact CG-CB 4.32Å; P168-R195 HydrophobicContact CG-CB 3.98Å; P168-R195 VanDerWaalsContact O-CD 3.24Å; P168-R195 WeakPolarHBondContact O-CD 3.38Å; P168-R195 VanDerWaalsContact O-CG 3.22Å; P168-R195 WeakPolarHBondContact O-CG 3.37Å
169	T	72.5	Confident	68.7	Low	100 Å²	100	74.8 Å²	74.8	61%	0.613	47%	0.466	S	S	*	.	S	Bend	trans	-75.6	-29.7	176.9	51.2	0	0	0	0	112.2	C167 R195	C167-T169 PolarHBondContact O-N 3.16Å; T169-R195 PolarHBondContact O-NE 2.8Å; T169-R195 PolarHBondContact O-NH2 2.93Å; T169-R195 VanDerWaalsContact O-NH2 3.09Å
170	T	73.3	Confident	70.4	Confident	86 Å²	86	69.2 Å²	69.2	53%	0.528	44%	0.435	S	S	.	.			trans	-135.6	154	174.8	61	0	0	0	0	110.1	F172	T170-F172 HydrophobicContact CG2-CD2 4.46Å
171	C	73.6	Confident	72	Confident	29 Å²	29	67.2 Å²	67.2	20%	0.196	42%	0.415	C	S	.	.			trans	-121.8	24.7	-179.6	-69.6	0	0	0	0	112.8	G173 A174 C191 Q192	C171-G173 PolarHBondContact O-N 3Å; C171-A174 PolarHBondContact O-N 2.94Å; C171-C191 WeakPolarHBondContact CA-SG 3.29Å; C171-C191 HydrophobicContact CB-CB 3.73Å; C171-C191 WeakPolarHBondContact CB-SG 3.23Å; C171-C191 WeakPolarHBondContact SG-CB 3.46Å; C171-C191 PolarHBondContact SG-O 3.42Å; C171-C191 VanDerWaalsContact SG-O 3.4Å; C171-C191 CovalentContact SG-SG 2.04Å; C171-C191 PolarHBondContact SG-SG 2.92Å; C171-Q192 HydrophobicContact CB-CG 4.45Å
172	F	60.7	Low	73.5	Confident	197 Å²	197	60 Å²	60	86%	0.864	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	126.2	177.6	-73.1	-69.9	0	0	0	110.7	T170 A174	T170-F172 HydrophobicContact CG2-CD2 4.46Å; F172-A174 VanDerWaalsContact C-N 3.35Å
173	G	59.1	Low	75	Confident	85 Å²	85	58 Å²	58	88%	0.876	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	5.4	-179.6	0	0	0	0	0	115.3	C171	C171-G173 PolarHBondContact O-N 3Å
174	A	56.5	Low	75.9	Confident	29 Å²	29	57.8 Å²	57.8	24%	0.24	37%	0.37	C	S	.	.	S	Bend	trans	-65.2	148	161.3	0	0	0	0	0	109.8	C171 F172 D176 C191	C171-A174 PolarHBondContact O-N 2.94Å; F172-A174 VanDerWaalsContact C-N 3.35Å; A174-D176 PolarHBondContact O-N 3.29Å; A174-C191 HydrophobicContact CB-CB 3.81Å
175	P	57.3	Low	76.9	Confident	117 Å²	117	59 Å²	59	76%	0.76	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-64.4	127.5	173.9	26.7	-33.5	0	0	0	110.2	S189	P175-S189 WeakPolarHBondContact O-CB 3.38Å
176	D	61.2	Low	77.6	Confident	152 Å²	152	59.4 Å²	59.4	81%	0.813	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-71.7	129	173.6	-73.7	-44	0	0	0	110.2	A174	A174-D176 PolarHBondContact O-N 3.29Å
177	G	74.2	Confident	78.2	Confident	41 Å²	41	57 Å²	57	42%	0.423	36%	0.361	S	S	.	.			trans	168.9	117.7	-178.6	0	0	0	0	0	110.5	V179 P188 S189	G177-V179 PolarHBondContact O-N 3.5Å; G177-P188 CarbonylContact C-O 3.54Å; G177-P188 VanDerWaalsContact C-O 3.23Å; G177-P188 PolarHBondContact N-O 2.82Å; G177-P188 VanDerWaalsContact O-O 3.14Å; G177-S189 WeakPolarHBondContact O-CA 3.47Å
178	T	88.8	Confident	78.7	Confident	63 Å²	63	58 Å²	58	39%	0.387	37%	0.367	S	S	.	.			trans	-56.1	134.9	-179.8	-49.2	0	0	0	0	110.8	D186 Y187 G210 P211	T178-D186 HydrophobicContact CG2-CB 3.92Å; T178-Y187 CarbonylContact C-O 3.43Å; T178-Y187 VanDerWaalsContact CA-O 3.3Å; T178-Y187 WeakPolarHBondContact CA-O 3.26Å; T178-G210 CarbonylContact O-C 3.52Å; T178-G210 WeakPolarHBondContact O-CA 3.29Å; T178-G210 PolarHBondContact O-N 3.5Å; T178-P211 HydrophobicContact CG2-CB 4.27Å
179	V	91.6	Very high	79.2	Confident	6 Å²	6	56.7 Å²	56.7	4%	0.036	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	144.6	174.2	-59.7	0	0	0	0	110.7	G177 Y187 E190 L193 K206 G210	G177-V179 PolarHBondContact O-N 3.5Å; V179-Y187 PolarHBondContact N-O 3.31Å; V179-Y187 PolarHBondContact O-N 3.47Å; V179-E190 HydrophobicContact CG1-CB 4.39Å; V179-E190 HydrophobicContact CG2-CB 4.37Å; V179-L193 HydrophobicContact CG2-CB 4.29Å; V179-L193 HydrophobicContact CG2-CD1 3.87Å; V179-K206 HydrophobicContact CB-CD 3.8Å; V179-K206 HydrophobicContact CB-CG 4.05Å; V179-K206 HydrophobicContact CG1-CD 3.65Å; V179-K206 HydrophobicContact CG1-CG 4.45Å; V179-K206 HydrophobicContact CG2-CD 4.4Å; V179-G210 CarbonylContact C-O 3.48Å
180	C	92.9	Very high	79.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	121.7	178.1	176.4	0	0	0	0	110.5	K207 F208 G210 C212 Y320	C180-K207 PolarHBondContact O-N 3.44Å; C180-F208 HydrophobicContact CB-CB 4.07Å; C180-F208 HydrophobicContact CB-CD2 4.5Å; C180-F208 PolarHBondContact N-O 2.95Å; C180-F208 PolarHBondContact O-N 3.1Å; C180-G210 PolarHBondContact N-O 2.93Å; C180-C212 WeakPolarHBondContact CA-SG 3.44Å; C180-C212 HydrophobicContact CB-CB 3.94Å; C180-C212 WeakPolarHBondContact CB-SG 3.35Å; C180-C212 WeakPolarHBondContact SG-CA 3.44Å; C180-C212 WeakPolarHBondContact SG-CB 3.32Å; C180-C212 CovalentContact SG-SG 2.04Å; C180-C212 PolarHBondContact SG-SG 2.84Å; C180-Y320 WeakPolarHBondContact SG-CD1 3.32Å
181	G	90.5	Very high	80.5	Confident	0 Å²	0	53 Å²	53	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	157.8	173	0	0	0	0	0	113.5	D183 G184 V185 F205 Y320	G181-D183 VanDerWaalsContact CA-OD1 3.23Å; G181-D183 WeakPolarHBondContact CA-OD1 3.09Å; G181-D183 PolarHBondContact O-N 2.78Å; G181-G184 PolarHBondContact O-N 2.91Å; G181-V185 PolarHBondContact N-O 3.11Å; G181-F205 CarbonylContact C-O 3.55Å; G181-Y320 WeakPolarHBondContact O-CE1 3.3Å
182	S	88.6	Confident	81.1	Confident	11 Å²	11	55.4 Å²	55.4	8%	0.077	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-7.3	174	61.4	0	0	0	0	114.4	I204 F205 Y320	S182-I204 WeakPolarHBondContact OG-CA 3.48Å; S182-F205 WeakPolarHBondContact CB-O 3.5Å; S182-F205 PolarHBondContact N-O 2.95Å; S182-F205 VanDerWaalsContact OG-CD1 3.28Å; S182-F205 WeakPolarHBondContact OG-CD1 3.42Å; S182-F205 WeakPolarHBondContact OG-CE1 3.46Å; S182-F205 PolarHBondContact OG-N 3.21Å; S182-F205 PolarHBondContact OG-O 3.23Å; S182-Y320 PolarHBondContact O-OH 2.75Å
183	D	88	Confident	82.5	Confident	30 Å²	30	46 Å²	46	16%	0.16	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-20.1	167.5	52.5	2	0	0	0	113	G181 V185 Y187 I204 P322	G181-D183 VanDerWaalsContact CA-OD1 3.23Å; G181-D183 WeakPolarHBondContact CA-OD1 3.09Å; G181-D183 PolarHBondContact O-N 2.78Å; D183-V185 HydrophobicContact CB-CG2 4.34Å; D183-V185 PolarHBondContact OD1-N 3.31Å; D183-Y187 WeakPolarHBondContact OD2-CE2 3.03Å; D183-Y187 PolarHBondContact OD2-OH 3.41Å; D183-I204 HydrophobicContact CB-CG1 4.39Å; D183-P322 WeakPolarHBondContact O-CG 3.38Å
184	G	88.4	Confident	83.7	Confident	25 Å²	25	44.6 Å²	44.6	26%	0.258	27%	0.269	S	S	.	.	S	Bend	trans	92.5	15.9	-171.9	0	0	0	0	0	114.2	G181	G181-G184 PolarHBondContact O-N 2.91Å
185	V	90.6	Very high	85.1	Confident	71 Å²	71	49.4 Å²	49.4	43%	0.43	28%	0.282	S	S	.	.			trans	-102.9	142.5	-179.2	-179.3	0	0	0	0	111	G181 D183 Y187	G181-V185 PolarHBondContact N-O 3.11Å; D183-V185 HydrophobicContact CB-CG2 4.34Å; D183-V185 PolarHBondContact OD1-N 3.31Å; V185-Y187 HydrophobicContact CB-CD2 4.47Å; V185-Y187 HydrophobicContact CB-CE2 3.78Å; V185-Y187 HydrophobicContact CG1-CE2 4.03Å; V185-Y187 VanDerWaalsContact O-CD2 3.31Å; V185-Y187 WeakPolarHBondContact O-CD2 3.03Å
186	D	91.3	Very high	86.5	Confident	63 Å²	63	47.3 Å²	47.3	34%	0.337	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	117.5	173.7	-75.6	-13.2	0	0	0	111	T178 P211 C212	T178-D186 HydrophobicContact CG2-CB 3.92Å; D186-P211 VanDerWaalsContact OD1-CA 3.24Å; D186-P211 WeakPolarHBondContact OD1-CA 3.44Å; D186-P211 VanDerWaalsContact OD2-CB 3.28Å; D186-P211 WeakPolarHBondContact OD2-CB 3.36Å; D186-C212 WeakPolarHBondContact OD1-CB 3.41Å; D186-C212 PolarHBondContact OD1-N 3.31Å
187	Y	90	Very high	87.6	Confident	16 Å²	16	40 Å²	40	6%	0.063	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	135	176.3	-67.6	-88.9	0	0	0	110.4	T178 V179 D183 V185 S189 L193 H196 I204	T178-Y187 CarbonylContact C-O 3.43Å; T178-Y187 VanDerWaalsContact CA-O 3.3Å; T178-Y187 WeakPolarHBondContact CA-O 3.26Å; V179-Y187 PolarHBondContact N-O 3.31Å; V179-Y187 PolarHBondContact O-N 3.47Å; D183-Y187 WeakPolarHBondContact OD2-CE2 3.03Å; D183-Y187 PolarHBondContact OD2-OH 3.41Å; V185-Y187 HydrophobicContact CB-CD2 4.47Å; V185-Y187 HydrophobicContact CB-CE2 3.78Å; V185-Y187 HydrophobicContact CG1-CE2 4.03Å; V185-Y187 VanDerWaalsContact O-CD2 3.31Å; V185-Y187 WeakPolarHBondContact O-CD2 3.03Å; Y187-S189 PolarHBondContact O-N 3.21Å; Y187-S189 VanDerWaalsContact O-N 3.16Å; Y187-L193 HydrophobicContact CD1-CB 4.02Å; Y187-L193 HydrophobicContact CD2-CB 3.97Å; Y187-L193 HydrophobicContact CD2-CD1 3.8Å; Y187-L193 HydrophobicContact CD2-CG 3.81Å; Y187-L193 HydrophobicContact CE2-CD1 4.31Å; Y187-L193 HydrophobicContact CE2-CG 4.09Å; Y187-L193 HydrophobicContact CG-CB 3.66Å; Y187-L193 HydrophobicContact CG-CD1 4.31Å; Y187-L193 HydrophobicContact CG-CG 4.04Å; Y187-H196 HydrophobicContact CD1-CB 4.48Å; Y187-H196 HydrophobicContact CE1-CB 3.73Å; Y187-H196 AromaticContact CE1-CG 3.75Å; Y187-H196 AromaticContact CE1-ND1 3.55Å; Y187-H196 AromaticContact CZ-ND1 3.65Å; Y187-H196 PolarHBondContact OH-CE1 3.37Å; Y187-H196 PolarHBondContact OH-ND1 3.46Å; Y187-I204 HydrophobicContact CE2-CG2 4.21Å
188	P	87.8	Confident	88.1	Confident	67 Å²	67	39.4 Å²	39.4	44%	0.435	21%	0.211	S	C	.	.	S	Bend	trans	-63.7	-22.5	-176	-24.9	34.6	0	0	0	115.4	G177	G177-P188 CarbonylContact C-O 3.54Å; G177-P188 VanDerWaalsContact C-O 3.23Å; G177-P188 PolarHBondContact N-O 2.82Å; G177-P188 VanDerWaalsContact O-O 3.14Å
189	S	87.6	Confident	87.6	Confident	3 Å²	3	40.1 Å²	40.1	2%	0.021	22%	0.224	C	C	.	.	S	Bend	trans	-158.2	163.6	165.3	71.3	0	0	0	0	111.6	P175 G177 Y187 C191 Q192 L193	P175-S189 WeakPolarHBondContact O-CB 3.38Å; G177-S189 WeakPolarHBondContact O-CA 3.47Å; Y187-S189 PolarHBondContact O-N 3.21Å; Y187-S189 VanDerWaalsContact O-N 3.16Å; S189-C191 PolarHBondContact O-N 2.9Å; S189-Q192 WeakPolarHBondContact O-CB 3.42Å; S189-Q192 PolarHBondContact O-N 2.79Å; S189-L193 PolarHBondContact O-N 3.25Å; S189-L193 VanDerWaalsContact O-N 3.11Å
190	E	86.5	Confident	86.9	Confident	80 Å²	80	43.1 Å²	43.1	37%	0.374	24%	0.239	S	C	.	.	H	α-helix	trans	-59.3	-32.7	179.2	-174.8	160.7	-154.2	0	0	113.1	V179 Q192 L193 L194 K206	V179-E190 HydrophobicContact CG1-CB 4.39Å; V179-E190 HydrophobicContact CG2-CB 4.37Å; E190-Q192 VanDerWaalsContact C-N 3.32Å; E190-Q192 PolarHBondContact O-N 2.85Å; E190-L193 PolarHBondContact O-N 2.71Å; E190-L194 HydrophobicContact CG-CD1 4.08Å; E190-L194 HydrophobicContact CG-CG 4.46Å; E190-L194 WeakPolarHBondContact O-CB 3.43Å; E190-L194 VanDerWaalsContact O-CG 3.24Å; E190-L194 WeakPolarHBondContact O-CG 3.39Å; E190-L194 PolarHBondContact O-N 2.71Å; E190-K206 VanDerWaalsContact CD-CE 3.48Å; E190-K206 VanDerWaalsContact CD-NZ 3.34Å; E190-K206 HydrophobicContact CG-CD 4.38Å; E190-K206 WeakPolarHBondContact OE1-CE 3.37Å; E190-K206 IonicContact OE1-NZ 3.77Å; E190-K206 PolarHBondContact OE1-NZ 3.29Å; E190-K206 WeakPolarHBondContact OE2-CE 3.47Å; E190-K206 IonicContact OE2-NZ 2.81Å; E190-K206 PolarHBondContact OE2-NZ 3.31Å
191	C	85.6	Confident	85.8	Confident	27 Å²	27	45.3 Å²	45.3	18%	0.182	25%	0.249	C	C	.	.	H	α-helix	trans	-63.6	-37.6	172.2	-178.7	0	0	0	0	112.3	C171 A174 S189 L194 R195	C171-C191 WeakPolarHBondContact CA-SG 3.29Å; C171-C191 HydrophobicContact CB-CB 3.73Å; C171-C191 WeakPolarHBondContact CB-SG 3.23Å; C171-C191 WeakPolarHBondContact SG-CB 3.46Å; C171-C191 PolarHBondContact SG-O 3.42Å; C171-C191 VanDerWaalsContact SG-O 3.4Å; C171-C191 CovalentContact SG-SG 2.04Å; C171-C191 PolarHBondContact SG-SG 2.92Å; A174-C191 HydrophobicContact CB-CB 3.81Å; S189-C191 PolarHBondContact O-N 2.9Å; C191-L194 PolarHBondContact O-N 2.76Å; C191-R195 VanDerWaalsContact O-CB 3.24Å; C191-R195 WeakPolarHBondContact O-CB 3.46Å; C191-R195 PolarHBondContact O-N 2.91Å
192	Q	87.3	Confident	85	Confident	80 Å²	80	46.6 Å²	46.6	37%	0.374	26%	0.256	S	S	.	.	H	α-helix	trans	-71.2	-36.9	178.3	-60.7	-170.8	31.5	0	0	111.7	C171 S189 E190 R195 H196	C171-Q192 HydrophobicContact CB-CG 4.45Å; S189-Q192 WeakPolarHBondContact O-CB 3.42Å; S189-Q192 PolarHBondContact O-N 2.79Å; E190-Q192 VanDerWaalsContact C-N 3.32Å; E190-Q192 PolarHBondContact O-N 2.85Å; Q192-R195 PolarHBondContact O-N 3.22Å; Q192-H196 WeakPolarHBondContact O-CB 3.42Å; Q192-H196 PolarHBondContact O-N 3.41Å
193	L	88.8	Confident	84.2	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-58.5	-53	170	-175.1	162.8	0	0	0	111	V179 Y187 S189 E190 R195 H196 A197 I204 K206	V179-L193 HydrophobicContact CG2-CB 4.29Å; V179-L193 HydrophobicContact CG2-CD1 3.87Å; Y187-L193 HydrophobicContact CD1-CB 4.02Å; Y187-L193 HydrophobicContact CD2-CB 3.97Å; Y187-L193 HydrophobicContact CD2-CD1 3.8Å; Y187-L193 HydrophobicContact CD2-CG 3.81Å; Y187-L193 HydrophobicContact CE2-CD1 4.31Å; Y187-L193 HydrophobicContact CE2-CG 4.09Å; Y187-L193 HydrophobicContact CG-CB 3.66Å; Y187-L193 HydrophobicContact CG-CD1 4.31Å; Y187-L193 HydrophobicContact CG-CG 4.04Å; S189-L193 PolarHBondContact O-N 3.25Å; S189-L193 VanDerWaalsContact O-N 3.11Å; E190-L193 PolarHBondContact O-N 2.71Å; L193-R195 VanDerWaalsContact C-N 3.3Å; L193-R195 PolarHBondContact O-N 2.82Å; L193-H196 PolarHBondContact O-N 3.07Å; L193-A197 WeakPolarHBondContact O-CB 3.35Å; L193-A197 PolarHBondContact O-N 2.94Å; L193-I204 HydrophobicContact CD2-CG2 4.07Å; L193-I204 HydrophobicContact CG-CG2 4.13Å; L193-K206 HydrophobicContact CD1-CB 4.18Å
194	L	85	Confident	83.9	Confident	55 Å²	55	52 Å²	52	29%	0.288	28%	0.279	S	S	.	.	H	α-helix	trans	-63.4	-35.9	-179.3	-67.3	168.3	0	0	0	112.2	P168 E190 C191 C198	P168-L194 HydrophobicContact CG-CB 4.32Å; E190-L194 HydrophobicContact CG-CD1 4.08Å; E190-L194 HydrophobicContact CG-CG 4.46Å; E190-L194 WeakPolarHBondContact O-CB 3.43Å; E190-L194 VanDerWaalsContact O-CG 3.24Å; E190-L194 WeakPolarHBondContact O-CG 3.39Å; E190-L194 PolarHBondContact O-N 2.71Å; C191-L194 PolarHBondContact O-N 2.76Å; L194-C198 PolarHBondContact O-N 3.12Å; L194-C198 VanDerWaalsContact O-N 3.08Å
195	R	85.9	Confident	83.7	Confident	131 Å²	131	55.9 Å²	55.9	49%	0.494	29%	0.289	S	S	.	.	H	α-helix	trans	-63.7	-45.7	173	-176.5	170	-175	-151.1	0.5	112.2	P168 T169 C191 Q192 L193 C198 A199	P168-R195 HydrophobicContact CG-CB 3.98Å; P168-R195 VanDerWaalsContact O-CD 3.24Å; P168-R195 WeakPolarHBondContact O-CD 3.38Å; P168-R195 VanDerWaalsContact O-CG 3.22Å; P168-R195 WeakPolarHBondContact O-CG 3.37Å; T169-R195 PolarHBondContact O-NE 2.8Å; T169-R195 PolarHBondContact O-NH2 2.93Å; T169-R195 VanDerWaalsContact O-NH2 3.09Å; C191-R195 VanDerWaalsContact O-CB 3.24Å; C191-R195 WeakPolarHBondContact O-CB 3.46Å; C191-R195 PolarHBondContact O-N 2.91Å; Q192-R195 PolarHBondContact O-N 3.22Å; L193-R195 VanDerWaalsContact C-N 3.3Å; L193-R195 PolarHBondContact O-N 2.82Å; R195-C198 PolarHBondContact O-N 2.89Å; R195-A199 VanDerWaalsContact O-CB 3.3Å; R195-A199 WeakPolarHBondContact O-CB 3.44Å; R195-A199 PolarHBondContact O-N 2.76Å
196	H	86.3	Confident	83.6	Confident	72 Å²	72	55.3 Å²	55.3	33%	0.333	28%	0.28	S	S	.	.	H	α-helix	trans	-64.8	-46.7	177.5	-173.5	-112.5	0	0	0	111.4	Y187 Q192 L193 C198 A199 N200	Y187-H196 HydrophobicContact CD1-CB 4.48Å; Y187-H196 HydrophobicContact CE1-CB 3.73Å; Y187-H196 AromaticContact CE1-CG 3.75Å; Y187-H196 AromaticContact CE1-ND1 3.55Å; Y187-H196 AromaticContact CZ-ND1 3.65Å; Y187-H196 PolarHBondContact OH-CE1 3.37Å; Y187-H196 PolarHBondContact OH-ND1 3.46Å; Q192-H196 WeakPolarHBondContact O-CB 3.42Å; Q192-H196 PolarHBondContact O-N 3.41Å; L193-H196 PolarHBondContact O-N 3.07Å; H196-C198 VanDerWaalsContact C-N 3.31Å; H196-C198 PolarHBondContact O-N 3.11Å; H196-A199 PolarHBondContact O-N 3.32Å; H196-N200 PolarHBondContact CE1-ND2 3.45Å; H196-N200 PolarHBondContact NE2-ND2 2.94Å; H196-N200 PolarHBondContact O-N 2.03Å
197	A	85.2	Confident	83.4	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-53.6	-45	175.5	0	0	0	0	0	112.1	F150 L193 Q201 E202 I204	F150-A197 CarbonylContact O-C 3.54Å; L193-A197 WeakPolarHBondContact O-CB 3.35Å; L193-A197 PolarHBondContact O-N 2.94Å; A197-Q201 CarbonylContact O-C 2.96Å; A197-Q201 VanDerWaalsContact O-CA 3.23Å; A197-Q201 WeakPolarHBondContact O-CA 3.05Å; A197-Q201 PolarHBondContact O-N 3.21Å; A197-E202 PolarHBondContact O-N 3.21Å; A197-I204 HydrophobicContact CB-CB 4.1Å
198	C	83.4	Confident	83.3	Confident	28 Å²	28	57.2 Å²	57.2	19%	0.189	29%	0.286	C	S	.	.	H	α-helix	trans	-70.3	-47.9	174.9	174	0	0	0	0	113.1	F150 C167 L194 R195 H196 N200 Q201	F150-C198 WeakPolarHBondContact O-CA 3.45Å; F150-C198 WeakPolarHBondContact O-CB 2.99Å; F150-C198 PolarHBondContact O-N 2.65Å; F150-C198 VanDerWaalsContact O-N 3.1Å; C167-C198 HydrophobicContact CB-CB 3.59Å; C167-C198 WeakPolarHBondContact CB-SG 3.44Å; C167-C198 WeakPolarHBondContact SG-CB 3.35Å; C167-C198 CovalentContact SG-SG 2.01Å; C167-C198 PolarHBondContact SG-SG 3.23Å; L194-C198 PolarHBondContact O-N 3.12Å; L194-C198 VanDerWaalsContact O-N 3.08Å; R195-C198 PolarHBondContact O-N 2.89Å; H196-C198 VanDerWaalsContact C-N 3.31Å; H196-C198 PolarHBondContact O-N 3.11Å; C198-N200 VanDerWaalsContact C-N 3.26Å; C198-N200 PolarHBondContact O-N 3.09Å; C198-Q201 WeakPolarHBondContact O-CG 3.32Å; C198-Q201 PolarHBondContact O-N 3.39Å
199	A	77.9	Confident	83.3	Confident	78 Å²	78	59.3 Å²	59.3	65%	0.645	29%	0.294	S	S	*	.	H	α-helix	trans	-57.9	-40.3	-174.5	0	0	0	0	0	112.2	R195 H196	R195-A199 VanDerWaalsContact O-CB 3.3Å; R195-A199 WeakPolarHBondContact O-CB 3.44Å; R195-A199 PolarHBondContact O-N 2.76Å; H196-A199 PolarHBondContact O-N 3.32Å
200	N	76.6	Confident	83.3	Confident	68 Å²	68	60.3 Å²	60.3	36%	0.364	31%	0.305	S	S	.	.	H	α-helix	trans	-89.8	-12.3	177.3	-58.1	-3.8	0	0	0	113.2	H196 C198 E202	H196-N200 PolarHBondContact CE1-ND2 3.45Å; H196-N200 PolarHBondContact NE2-ND2 2.94Å; H196-N200 PolarHBondContact O-N 2.03Å; C198-N200 VanDerWaalsContact C-N 3.26Å; C198-N200 PolarHBondContact O-N 3.09Å; N200-E202 HydrophobicContact CB-CB 4.36Å; N200-E202 HydrophobicContact CB-CG 3.7Å; N200-E202 WeakPolarHBondContact CB-OE2 3.49Å; N200-E202 PolarHBondContact ND2-OE2 2.88Å
201	Q	70	Confident	83.5	Confident	46 Å²	46	58.7 Å²	58.7	22%	0.215	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	44	-171.7	-53.4	-175.7	-22.3	0	0	113.2	F150 A197 C198 S361 C374	F150-Q201 HydrophobicContact CD2-CB 4.3Å; F150-Q201 HydrophobicContact CG-CB 4.46Å; A197-Q201 CarbonylContact O-C 2.96Å; A197-Q201 VanDerWaalsContact O-CA 3.23Å; A197-Q201 WeakPolarHBondContact O-CA 3.05Å; A197-Q201 PolarHBondContact O-N 3.21Å; C198-Q201 WeakPolarHBondContact O-CG 3.32Å; C198-Q201 PolarHBondContact O-N 3.39Å; Q201-S361 PolarHBondContact OE1-OG 2.72Å; Q201-C374 PolarHBondContact NE2-O 3.33Å; Q201-C374 VanDerWaalsContact NE2-O 3.14Å
202	E	73.6	Confident	83.8	Confident	28 Å²	28	57.6 Å²	57.6	13%	0.131	29%	0.293	C	S	.	.			trans	-105.9	143.2	-178.4	-66.7	176	134	0	0	110.1	A197 N200 I204 Q358	A197-E202 PolarHBondContact O-N 3.21Å; N200-E202 HydrophobicContact CB-CB 4.36Å; N200-E202 HydrophobicContact CB-CG 3.7Å; N200-E202 WeakPolarHBondContact CB-OE2 3.49Å; N200-E202 PolarHBondContact ND2-OE2 2.88Å; E202-I204 HydrophobicContact CB-CD1 3.76Å; E202-I204 HydrophobicContact CB-CG1 3.91Å; E202-I204 PolarHBondContact O-N 2.89Å; E202-Q358 PolarHBondContact OE1-NE2 2.9Å; E202-Q358 PolarHBondContact OE1-OE1 2.7Å
203	H	72.6	Confident	84	Confident	140 Å²	140	54.6 Å²	54.6	65%	0.648	28%	0.28	S	S	*	.			trans	-81.5	52.7	-176.5	-161.5	-71.8	0	0	0	112.1	F150	F150-H203 HydrophobicContact CD1-CB 4.29Å; F150-H203 HydrophobicContact CE1-CB 4.21Å
204	I	81.8	Confident	84	Confident	14 Å²	14	56 Å²	56	7%	0.072	29%	0.29	C	S	.	.			trans	-87.4	128.4	179.5	-55.5	163.7	0	0	0	108.5	S182 D183 Y187 L193 A197 E202	S182-I204 WeakPolarHBondContact OG-CA 3.48Å; D183-I204 HydrophobicContact CB-CG1 4.39Å; Y187-I204 HydrophobicContact CE2-CG2 4.21Å; L193-I204 HydrophobicContact CD2-CG2 4.07Å; L193-I204 HydrophobicContact CG-CG2 4.13Å; A197-I204 HydrophobicContact CB-CB 4.1Å; E202-I204 HydrophobicContact CB-CD1 3.76Å; E202-I204 HydrophobicContact CB-CG1 3.91Å; E202-I204 PolarHBondContact O-N 2.89Å
205	F	83.6	Confident	84	Confident	106 Å²	106	54.3 Å²	54.3	47%	0.465	28%	0.282	S	S	.	.			trans	-131.2	159.4	176.5	60.2	-87.3	0	0	0	110.2	G181 S182 K207	G181-F205 CarbonylContact C-O 3.55Å; S182-F205 WeakPolarHBondContact CB-O 3.5Å; S182-F205 PolarHBondContact N-O 2.95Å; S182-F205 VanDerWaalsContact OG-CD1 3.28Å; S182-F205 WeakPolarHBondContact OG-CD1 3.42Å; S182-F205 WeakPolarHBondContact OG-CE1 3.46Å; S182-F205 PolarHBondContact OG-N 3.21Å; S182-F205 PolarHBondContact OG-O 3.23Å; F205-K207 PolarHBondContact O-N 3.16Å; F205-K207 VanDerWaalsContact O-N 3.15Å
206	K	88.6	Confident	83.7	Confident	60 Å²	60	54.9 Å²	54.9	26%	0.261	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	114.3	173.9	-175.6	171.8	70.3	176.5	0	109.6	V179 E190 L193 D209	V179-K206 HydrophobicContact CB-CD 3.8Å; V179-K206 HydrophobicContact CB-CG 4.05Å; V179-K206 HydrophobicContact CG1-CD 3.65Å; V179-K206 HydrophobicContact CG1-CG 4.45Å; V179-K206 HydrophobicContact CG2-CD 4.4Å; E190-K206 VanDerWaalsContact CD-CE 3.48Å; E190-K206 VanDerWaalsContact CD-NZ 3.34Å; E190-K206 HydrophobicContact CG-CD 4.38Å; E190-K206 WeakPolarHBondContact OE1-CE 3.37Å; E190-K206 IonicContact OE1-NZ 3.77Å; E190-K206 PolarHBondContact OE1-NZ 3.29Å; E190-K206 WeakPolarHBondContact OE2-CE 3.47Å; E190-K206 IonicContact OE2-NZ 2.81Å; E190-K206 PolarHBondContact OE2-NZ 3.31Å; L193-K206 HydrophobicContact CD1-CB 4.18Å; K206-D209 WeakPolarHBondContact CD-OD1 3.3Å; K206-D209 WeakPolarHBondContact CE-OD1 3.29Å; K206-D209 IonicContact NZ-OD1 3.41Å; K206-D209 PolarHBondContact NZ-OD1 3.4Å; K206-D209 IonicContact NZ-OD2 2.7Å
207	K	87.3	Confident	82.7	Confident	59 Å²	59	55.2 Å²	55.2	26%	0.257	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-41.5	176.6	173.6	85.8	-177.6	-166.1	0	110.6	C180 F205 Y320 D332	C180-K207 PolarHBondContact O-N 3.44Å; F205-K207 PolarHBondContact O-N 3.16Å; F205-K207 VanDerWaalsContact O-N 3.15Å; K207-Y320 HydrophobicContact CB-CE1 4.35Å; K207-Y320 HydrophobicContact CD-CD2 4.49Å; K207-Y320 HydrophobicContact CD-CE1 4.31Å; K207-Y320 HydrophobicContact CD-CE2 3.95Å; K207-Y320 HydrophobicContact CG-CD1 4.12Å; K207-Y320 HydrophobicContact CG-CD2 4.37Å; K207-Y320 HydrophobicContact CG-CE1 3.87Å; K207-Y320 HydrophobicContact CG-CE2 4.18Å; K207-Y320 HydrophobicContact CG-CG 4.34Å; K207-D332 IonicContact NZ-OD1 3.78Å; K207-D332 PolarHBondContact NZ-OD1 2.96Å; K207-D332 IonicContact NZ-OD2 3.46Å; K207-D332 PolarHBondContact NZ-OD2 2.04Å
208	F	88.4	Confident	81.6	Confident	60 Å²	60	57.3 Å²	57.3	26%	0.263	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	153.2	176.1	-56.6	-69.5	0	0	0	111.4	C180 R233 Y320	C180-F208 HydrophobicContact CB-CB 4.07Å; C180-F208 HydrophobicContact CB-CD2 4.5Å; C180-F208 PolarHBondContact N-O 2.95Å; C180-F208 PolarHBondContact O-N 3.1Å; F208-R233 VanDerWaalsContact CD2-CZ 3.43Å; F208-R233 VanDerWaalsContact CD2-NH1 3.32Å; F208-Y320 HydrophobicContact CD2-CG 4.38Å; F208-Y320 HydrophobicContact CE2-CD2 4.03Å; F208-Y320 AromaticContact CE2-CG 3.93Å; F208-Y320 HydrophobicContact CE2-CG 3.93Å
209	D	87.9	Confident	80	Confident	110 Å²	110	64 Å²	64	59%	0.588	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	146.4	162.6	-57.8	-80.9	0	0	0	110.4	K206	K206-D209 WeakPolarHBondContact CD-OD1 3.3Å; K206-D209 WeakPolarHBondContact CE-OD1 3.29Å; K206-D209 IonicContact NZ-OD1 3.41Å; K206-D209 PolarHBondContact NZ-OD1 3.4Å; K206-D209 IonicContact NZ-OD2 2.7Å
210	G	87.3	Confident	78.9	Confident	25 Å²	25	65.4 Å²	65.4	26%	0.258	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	79.3	175.2	-166.2	0	0	0	0	0	113	T178 V179 C180	T178-G210 CarbonylContact O-C 3.52Å; T178-G210 WeakPolarHBondContact O-CA 3.29Å; T178-G210 PolarHBondContact O-N 3.5Å; V179-G210 CarbonylContact C-O 3.48Å; C180-G210 PolarHBondContact N-O 2.93Å
211	P	90.8	Very high	78	Confident	45 Å²	45	66 Å²	66	29%	0.292	37%	0.366	S	S	.	.			trans	-66.4	156.6	179.3	28.7	-35.8	0	0	0	112.6	T178 D186 D213 P214 R233	T178-P211 HydrophobicContact CG2-CB 4.27Å; D186-P211 VanDerWaalsContact OD1-CA 3.24Å; D186-P211 WeakPolarHBondContact OD1-CA 3.44Å; D186-P211 VanDerWaalsContact OD2-CB 3.28Å; D186-P211 WeakPolarHBondContact OD2-CB 3.36Å; P211-D213 PolarHBondContact O-N 3.39Å; P211-P214 HydrophobicContact CG-CG 4.32Å; P211-P214 WeakPolarHBondContact O-CD 3.48Å; P211-R233 PolarHBondContact O-NH2 3.09Å
212	C	90.9	Very high	77.7	Confident	4 Å²	4	71 Å²	71	3%	0.027	39%	0.394	C	S	.	.	S	Bend	trans	-64.3	-36.3	178.9	-72.4	0	0	0	0	112.6	C180 D186 R233 Y320	C180-C212 WeakPolarHBondContact CA-SG 3.44Å; C180-C212 HydrophobicContact CB-CB 3.94Å; C180-C212 WeakPolarHBondContact CB-SG 3.35Å; C180-C212 WeakPolarHBondContact SG-CA 3.44Å; C180-C212 WeakPolarHBondContact SG-CB 3.32Å; C180-C212 CovalentContact SG-SG 2.04Å; C180-C212 PolarHBondContact SG-SG 2.84Å; D186-C212 WeakPolarHBondContact OD1-CB 3.41Å; D186-C212 PolarHBondContact OD1-N 3.31Å; C212-R233 VanDerWaalsContact C-NH2 3.29Å; C212-R233 PolarHBondContact O-NH2 3.49Å; C212-Y320 WeakPolarHBondContact CB-O 3Å; C212-Y320 PolarHBondContact O-N 2.83Å
213	D	91.4	Very high	77.6	Confident	17 Å²	17	73.2 Å²	73.2	9%	0.091	41%	0.406	C	S	.	.			trans	-123.6	95.1	169.1	-170	-15	0	0	0	111.3	P211 C215 Q216 A319 R321	P211-D213 PolarHBondContact O-N 3.39Å; D213-C215 PolarHBondContact O-N 3.36Å; D213-C215 WeakPolarHBondContact OD1-CB 3.49Å; D213-C215 PolarHBondContact OD1-N 3.06Å; D213-Q216 HydrophobicContact CB-CB 3.99Å; D213-Q216 VanDerWaalsContact O-CB 3.22Å; D213-Q216 WeakPolarHBondContact O-CB 3.33Å; D213-Q216 PolarHBondContact O-N 2.04Å; D213-A319 HydrophobicContact CB-CB 4.16Å; D213-R321 IonicContact OD2-CZ 3.31Å; D213-R321 IonicContact OD2-NH1 2.94Å; D213-R321 PolarHBondContact OD2-NH1 3.46Å
214	P	88.9	Confident	78	Confident	31 Å²	31	68.8 Å²	68.8	20%	0.201	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-4.3	175.4	-29	38.6	0	0	0	116.4	P211 V228 R233	P211-P214 HydrophobicContact CG-CG 4.32Å; P211-P214 WeakPolarHBondContact O-CD 3.48Å; P214-V228 HydrophobicContact CB-CG2 4.36Å; P214-V228 HydrophobicContact CG-CG1 4.43Å; P214-R233 WeakPolarHBondContact CG-O 3.29Å
215	C	85.8	Confident	78	Confident	18 Å²	18	70.7 Å²	70.7	12%	0.122	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-14.3	168.2	-74.3	0	0	0	0	113.4	D213 G217 S218 C226 R227 V228	D213-C215 PolarHBondContact O-N 3.36Å; D213-C215 WeakPolarHBondContact OD1-CB 3.49Å; D213-C215 PolarHBondContact OD1-N 3.06Å; C215-G217 PolarHBondContact O-N 3.41Å; C215-S218 WeakPolarHBondContact O-CB 3.07Å; C215-S218 PolarHBondContact O-N 3.4Å; C215-S218 VanDerWaalsContact O-N 3.1Å; C215-S218 PolarHBondContact O-OG 2.99Å; C215-C226 WeakPolarHBondContact CA-SG 3.16Å; C215-C226 HydrophobicContact CB-CB 3.64Å; C215-C226 WeakPolarHBondContact CB-SG 3Å; C215-C226 WeakPolarHBondContact SG-CB 3.35Å; C215-C226 CovalentContact SG-SG 2.03Å; C215-C226 PolarHBondContact SG-SG 3.15Å; C215-R227 PolarHBondContact SG-N 3.43Å; C215-R227 VanDerWaalsContact SG-N 3.4Å; C215-V228 HydrophobicContact CB-CG2 4.16Å
216	Q	79.4	Confident	78	Confident	144 Å²	144	67.1 Å²	67.1	67%	0.673	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	128.3	-180	-172.5	167.3	-20.5	0	0	110.5	D213 S218	D213-Q216 HydrophobicContact CB-CB 3.99Å; D213-Q216 VanDerWaalsContact O-CB 3.22Å; D213-Q216 WeakPolarHBondContact O-CB 3.33Å; D213-Q216 PolarHBondContact O-N 2.04Å; Q216-S218 VanDerWaalsContact C-N 3.25Å; Q216-S218 PolarHBondContact O-N 3.14Å
217	G	64.7	Low	77.9	Confident	79 Å²	79	66.1 Å²	66.1	81%	0.814	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	-4.9	-172.7	0	0	0	0	0	115.1	C215 M219	C215-G217 PolarHBondContact O-N 3.41Å; G217-M219 PolarHBondContact O-N 3.25Å
218	S	62.2	Low	77.9	Confident	43 Å²	43	63.3 Å²	63.3	30%	0.301	37%	0.366	S	S	.	.			trans	-63.6	123.3	165.5	69.4	0	0	0	0	109.1	C215 Q216 S220	C215-S218 WeakPolarHBondContact O-CB 3.07Å; C215-S218 PolarHBondContact O-N 3.4Å; C215-S218 VanDerWaalsContact O-N 3.1Å; C215-S218 PolarHBondContact O-OG 2.99Å; Q216-S218 VanDerWaalsContact C-N 3.25Å; Q216-S218 PolarHBondContact O-N 3.14Å; S218-S220 PolarHBondContact O-N 3.4Å; S218-S220 VanDerWaalsContact O-N 3.1Å
219	M	51.4	Low	77.8	Confident	170 Å²	170	62 Å²	62	84%	0.837	36%	0.362	S	S	*	.			trans	-56.3	121.5	176.7	-79.5	-71.9	-78.7	0	0	108.2	G217 D221	G217-M219 PolarHBondContact O-N 3.25Å; M219-D221 PolarHBondContact O-N 2.94Å
220	S	53.8	Low	77.6	Confident	106 Å²	106	59.9 Å²	59.9	74%	0.741	35%	0.354	S	S	*	.			trans	-73.4	73.3	-176	-70	0	0	0	0	110.8	S218 L222	S218-S220 PolarHBondContact O-N 3.4Å; S218-S220 VanDerWaalsContact O-N 3.1Å; S220-L222 PolarHBondContact O-N 3.33Å
221	D	58	Low	77.4	Confident	80 Å²	80	69.9 Å²	69.9	43%	0.428	38%	0.384	S	S	.	.			trans	-50.4	126.8	179.8	-154.2	29.4	0	0	0	109.4	M219 N223 H224	M219-D221 PolarHBondContact O-N 2.94Å; D221-N223 PolarHBondContact O-N 3.01Å; D221-H224 HydrophobicContact CB-CB 4.23Å; D221-H224 PolarHBondContact O-N 3.36Å; D221-H224 IonicContact OD2-CE1 2.68Å; D221-H224 PolarHBondContact OD2-CE1 2.8Å; D221-H224 IonicContact OD2-CG 3.03Å; D221-H224 IonicContact OD2-ND1 2.75Å; D221-H224 PolarHBondContact OD2-ND1 2.98Å
222	L	63.2	Low	77.1	Confident	152 Å²	152	71.5 Å²	71.5	80%	0.796	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-14.1	-171.6	-70.9	168.3	0	0	0	113.5	S220 R240	S220-L222 PolarHBondContact O-N 3.33Å; L222-R240 WeakPolarHBondContact O-CD 3.08Å
223	N	72.6	Confident	77	Confident	75 Å²	75	72.9 Å²	72.9	40%	0.401	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-11	-179.1	-70.7	-31.4	0	0	0	115.3	D221 R240 N243	D221-N223 PolarHBondContact O-N 3.01Å; N223-R240 WeakPolarHBondContact O-CB 3.38Å; N223-R240 PolarHBondContact O-N 3.25Å; N223-N243 VanDerWaalsContact CA-ND2 3.27Å; N223-N243 WeakPolarHBondContact CA-ND2 3.35Å; N223-N243 VanDerWaalsContact CB-ND2 3.26Å; N223-N243 WeakPolarHBondContact CB-ND2 3.24Å; N223-N243 VanDerWaalsContact CG-ND2 3.29Å; N223-N243 PolarHBondContact O-ND2 3.01Å; N223-N243 PolarHBondContact OD1-ND2 3.46Å; N223-N243 PolarHBondContact OD1-OD1 2.89Å
224	H	80	Confident	76.6	Confident	47 Å²	47	78.2 Å²	78.2	22%	0.218	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	165.1	-169.5	-61.9	107.3	0	0	0	113.7	D221 M237 L238 L239 R240	D221-H224 HydrophobicContact CB-CB 4.23Å; D221-H224 PolarHBondContact O-N 3.36Å; D221-H224 IonicContact OD2-CE1 2.68Å; D221-H224 PolarHBondContact OD2-CE1 2.8Å; D221-H224 IonicContact OD2-CG 3.03Å; D221-H224 IonicContact OD2-ND1 2.75Å; D221-H224 PolarHBondContact OD2-ND1 2.98Å; H224-M237 HydrophobicContact CB-CE 3.83Å; H224-L238 CarbonylContact C-O 3.09Å; H224-L238 VanDerWaalsContact CA-O 3.28Å; H224-L238 WeakPolarHBondContact CA-O 3.33Å; H224-L239 VanDerWaalsContact NE2-CD2 3.3Å; H224-L239 WeakPolarHBondContact NE2-CD2 3.41Å; H224-R240 PolarHBondContact O-NE 3.49Å
225	I	81	Confident	76.4	Confident	54 Å²	54	79.7 Å²	79.7	28%	0.277	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	119	170.1	-65.5	167.7	0	0	0	105.8	L238 R240 A271	I225-L238 PolarHBondContact N-O 3.05Å; I225-L238 WeakPolarHBondContact O-CB 3.32Å; I225-L238 PolarHBondContact O-N 3.21Å; I225-R240 HydrophobicContact CD1-CG 4Å; I225-R240 HydrophobicContact CG1-CG 3.76Å; I225-A271 HydrophobicContact CD1-CB 3.65Å
226	C	84.6	Confident	76.3	Confident	31 Å²	31	82.6 Å²	82.6	21%	0.209	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	134.5	172.3	-170.4	0	0	0	0	109.8	C215 P235 M237	C215-C226 WeakPolarHBondContact CA-SG 3.16Å; C215-C226 HydrophobicContact CB-CB 3.64Å; C215-C226 WeakPolarHBondContact CB-SG 3Å; C215-C226 WeakPolarHBondContact SG-CB 3.35Å; C215-C226 CovalentContact SG-SG 2.03Å; C215-C226 PolarHBondContact SG-SG 3.15Å; C226-P235 WeakPolarHBondContact SG-CB 3.32Å; C226-M237 HydrophobicContact CB-SD 3.69Å
227	R	85.6	Confident	76.5	Confident	39 Å²	39	80 Å²	80	15%	0.147	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	127.8	173.4	-179.1	178.9	173.4	165.7	-4.5	109.9	C215 E236 L238 A270 T315 C316 D317	C215-R227 PolarHBondContact SG-N 3.43Å; C215-R227 VanDerWaalsContact SG-N 3.4Å; R227-E236 PolarHBondContact N-O 3.42Å; R227-E236 WeakPolarHBondContact O-CA 3.48Å; R227-E236 WeakPolarHBondContact O-CB 3.46Å; R227-E236 PolarHBondContact O-N 3.43Å; R227-L238 HydrophobicContact CB-CD1 3.91Å; R227-A270 PolarHBondContact NH1-O 2.83Å; R227-T315 PolarHBondContact NH1-OG1 2.92Å; R227-T315 VanDerWaalsContact NH2-CB 3.3Å; R227-T315 PolarHBondContact NH2-O 3Å; R227-T315 PolarHBondContact NH2-OG1 3.25Å; R227-C316 PolarHBondContact NH2-O 3.39Å; R227-D317 HydrophobicContact CG-CB 3.94Å
228	V	87.9	Confident	77.1	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	130	178.8	-177	0	0	0	0	110.4	P214 C215 R233 D317 G318 A319	P214-V228 HydrophobicContact CB-CG2 4.36Å; P214-V228 HydrophobicContact CG-CG1 4.43Å; C215-V228 HydrophobicContact CB-CG2 4.16Å; V228-R233 HydrophobicContact CG1-CB 4.42Å; V228-D317 CarbonylContact O-C 3.29Å; V228-D317 WeakPolarHBondContact O-CA 3.44Å; V228-D317 WeakPolarHBondContact O-CB 3.44Å; V228-G318 PolarHBondContact O-N 2.97Å; V228-A319 HydrophobicContact CB-CB 4.18Å; V228-A319 HydrophobicContact CG2-CB 3.88Å
229	N	86.3	Confident	78	Confident	32 Å²	32	80.1 Å²	80.1	17%	0.171	41%	0.41	C	S	.	.			trans	-68.5	127.6	175.2	-177.7	-66.1	0	0	0	111	R231 T232 R233 H234 E236	N229-R231 PolarHBondContact O-N 3.28Å; N229-R231 VanDerWaalsContact O-N 3.16Å; N229-R231 WeakPolarHBondContact OD1-CA 3.3Å; N229-R231 PolarHBondContact OD1-N 3.02Å; N229-T232 WeakPolarHBondContact CB-OG1 3.29Å; N229-T232 VanDerWaalsContact CG-OG1 3.26Å; N229-T232 PolarHBondContact OD1-N 2.95Å; N229-T232 PolarHBondContact OD1-OG1 2.81Å; N229-R233 VanDerWaalsContact O-CA 3.3Å; N229-R233 WeakPolarHBondContact O-CA 3.17Å; N229-R233 PolarHBondContact O-N 3.45Å; N229-H234 PolarHBondContact N-O 2.77Å; N229-E236 HydrophobicContact CB-CG 4.25Å; N229-E236 PolarHBondContact ND2-OE1 2.83Å
230	P	84.8	Confident	79.5	Confident	66 Å²	66	76.1 Å²	76.1	43%	0.429	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-0.5	-175	30.5	-36.4	0	0	0	115.8	W336	P230-W336 HydrophobicContact CB-CZ2 4.15Å
231	R	82.6	Confident	80.7	Confident	234 Å²	234	72.2 Å²	72.2	88%	0.883	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	-42.5	174.4	-68.2	-175	176.5	-173.2	-1.5	113.3	N229	N229-R231 PolarHBondContact O-N 3.28Å; N229-R231 VanDerWaalsContact O-N 3.16Å; N229-R231 WeakPolarHBondContact OD1-CA 3.3Å; N229-R231 PolarHBondContact OD1-N 3.02Å
232	T	84.6	Confident	81.9	Confident	79 Å²	79	75.2 Å²	75.2	49%	0.485	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-10.5	-176.2	61	0	0	0	0	113.7	N229 H234	N229-T232 WeakPolarHBondContact CB-OG1 3.29Å; N229-T232 VanDerWaalsContact CG-OG1 3.26Å; N229-T232 PolarHBondContact OD1-N 2.95Å; N229-T232 PolarHBondContact OD1-OG1 2.81Å; T232-H234 PolarHBondContact O-N 3.22Å; T232-H234 PolarHBondContact OG1-N 2.72Å
233	R	87.8	Confident	82.9	Confident	33 Å²	33	71.1 Å²	71.1	13%	0.125	35%	0.348	C	S	.	.			trans	55	6.5	-170.1	-66.6	-177.9	61	75.3	5	115.4	F208 P211 C212 P214 V228 N229 G318	F208-R233 VanDerWaalsContact CD2-CZ 3.43Å; F208-R233 VanDerWaalsContact CD2-NH1 3.32Å; P211-R233 PolarHBondContact O-NH2 3.09Å; C212-R233 VanDerWaalsContact C-NH2 3.29Å; C212-R233 PolarHBondContact O-NH2 3.49Å; P214-R233 WeakPolarHBondContact CG-O 3.29Å; V228-R233 HydrophobicContact CG1-CB 4.42Å; N229-R233 VanDerWaalsContact O-CA 3.3Å; N229-R233 WeakPolarHBondContact O-CA 3.17Å; N229-R233 PolarHBondContact O-N 3.45Å; R233-G318 PolarHBondContact NH1-O 2.82Å
234	H	83.3	Confident	83.5	Confident	130 Å²	130	68.4 Å²	68.4	60%	0.602	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-71.1	144.7	173.5	-69.6	-46.6	0	0	0	111.5	N229 T232	N229-H234 PolarHBondContact N-O 2.77Å; T232-H234 PolarHBondContact O-N 3.22Å; T232-H234 PolarHBondContact OG1-N 2.72Å
235	P	85.1	Confident	83.8	Confident	62 Å²	62	69.8 Å²	69.8	40%	0.403	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	122	173.5	28.7	-32.5	0	0	0	111.3	C226	C226-P235 WeakPolarHBondContact SG-CB 3.32Å
236	E	84.1	Confident	83.7	Confident	78 Å²	78	71.7 Å²	71.7	36%	0.364	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	118.5	172.7	-61	-179.6	167.6	0	0	109.5	R227 N229 L238	R227-E236 PolarHBondContact N-O 3.42Å; R227-E236 WeakPolarHBondContact O-CA 3.48Å; R227-E236 WeakPolarHBondContact O-CB 3.46Å; R227-E236 PolarHBondContact O-N 3.43Å; N229-E236 HydrophobicContact CB-CG 4.25Å; N229-E236 PolarHBondContact ND2-OE1 2.83Å; E236-L238 PolarHBondContact O-N 3.18Å
237	M	82	Confident	83.4	Confident	91 Å²	91	76.3 Å²	76.3	45%	0.448	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	90.5	178.3	-66.6	-63.8	-82.5	0	0	110.4	H224 C226	H224-M237 HydrophobicContact CB-CE 3.83Å; C226-M237 HydrophobicContact CB-SD 3.69Å
238	L	78.9	Confident	83.1	Confident	48 Å²	48	80.9 Å²	80.9	25%	0.251	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	126.1	178.9	-61.6	173.5	0	0	0	110.3	H224 I225 R227 E236 A270	H224-L238 CarbonylContact C-O 3.09Å; H224-L238 VanDerWaalsContact CA-O 3.28Å; H224-L238 WeakPolarHBondContact CA-O 3.33Å; I225-L238 PolarHBondContact N-O 3.05Å; I225-L238 WeakPolarHBondContact O-CB 3.32Å; I225-L238 PolarHBondContact O-N 3.21Å; R227-L238 HydrophobicContact CB-CD1 3.91Å; E236-L238 PolarHBondContact O-N 3.18Å; L238-A270 HydrophobicContact CD1-CB 4.1Å
239	L	81.1	Confident	83.2	Confident	76 Å²	76	84.7 Å²	84.7	40%	0.398	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	139.8	170.3	-82.3	162.6	0	0	0	110.7	H224 N243 R267	H224-L239 VanDerWaalsContact NE2-CD2 3.3Å; H224-L239 WeakPolarHBondContact NE2-CD2 3.41Å; L239-N243 HydrophobicContact CD2-CB 4.29Å; L239-R267 VanDerWaalsContact O-CD 3.23Å; L239-R267 WeakPolarHBondContact O-CD 3.49Å
240	R	81.6	Confident	83.4	Confident	86 Å²	86	85.7 Å²	85.7	33%	0.325	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-70.3	157.4	177.7	-78.5	-178.9	178.2	-129.8	2.3	113.7	L222 N223 H224 I225 E242 N243 R267	L222-R240 WeakPolarHBondContact O-CD 3.08Å; N223-R240 WeakPolarHBondContact O-CB 3.38Å; N223-R240 PolarHBondContact O-N 3.25Å; H224-R240 PolarHBondContact O-NE 3.49Å; I225-R240 HydrophobicContact CD1-CG 4Å; I225-R240 HydrophobicContact CG1-CG 3.76Å; R240-E242 VanDerWaalsContact C-N 3.28Å; R240-E242 WeakPolarHBondContact CB-OE2 3.07Å; R240-E242 PolarHBondContact O-N 2.83Å; R240-N243 PolarHBondContact O-N 3.43Å; R240-R267 VanDerWaalsContact O-CD 3.27Å; R240-R267 WeakPolarHBondContact O-CD 3.27Å; R240-R267 PolarHBondContact O-NH1 3.29Å
241	P	80.3	Confident	83.8	Confident	23 Å²	23	82.7 Å²	82.7	15%	0.149	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-57.4	-35.1	178.4	-25.1	35.5	0	0	0	114.5	N243 C244 R267 I268	P241-N243 PolarHBondContact O-N 3.38Å; P241-C244 WeakPolarHBondContact O-CB 3.08Å; P241-C244 PolarHBondContact O-N 2.81Å; P241-C244 VanDerWaalsContact O-N 3.16Å; P241-C244 PolarHBondContact O-SG 2.05Å; P241-R267 HydrophobicContact CB-CB 4.39Å; P241-R267 HydrophobicContact CG-CB 4.09Å; P241-I268 HydrophobicContact CB-CD1 4.45Å; P241-I268 HydrophobicContact CB-CG1 3.85Å; P241-I268 HydrophobicContact CG-CG1 3.66Å
242	E	83.3	Confident	84.1	Confident	143 Å²	143	71.5 Å²	71.5	67%	0.668	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-65.1	-23	-177.6	-60.2	72.8	-155.4	0	0	112.4	R240 C244	R240-E242 VanDerWaalsContact C-N 3.28Å; R240-E242 WeakPolarHBondContact CB-OE2 3.07Å; R240-E242 PolarHBondContact O-N 2.83Å; E242-C244 PolarHBondContact O-N 3.23Å
243	N	83.6	Confident	84.4	Confident	66 Å²	66	67.8 Å²	67.8	35%	0.353	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-86.4	22.8	176.4	-73.3	-51	0	0	0	113.5	N223 L239 R240 P241 R267	N223-N243 VanDerWaalsContact CA-ND2 3.27Å; N223-N243 WeakPolarHBondContact CA-ND2 3.35Å; N223-N243 VanDerWaalsContact CB-ND2 3.26Å; N223-N243 WeakPolarHBondContact CB-ND2 3.24Å; N223-N243 VanDerWaalsContact CG-ND2 3.29Å; N223-N243 PolarHBondContact O-ND2 3.01Å; N223-N243 PolarHBondContact OD1-ND2 3.46Å; N223-N243 PolarHBondContact OD1-OD1 2.89Å; L239-N243 HydrophobicContact CD2-CB 4.29Å; R240-N243 PolarHBondContact O-N 3.43Å; P241-N243 PolarHBondContact O-N 3.38Å; N243-R267 PolarHBondContact O-NH1 3.05Å
244	C	85.9	Confident	84.3	Confident	19 Å²	19	66.6 Å²	66.6	13%	0.128	36%	0.356	C	S	.	.	S	Bend	trans	-88	151.1	170.8	-76	0	0	0	0	111	P241 E242 A246 C263 V264 R267	P241-C244 WeakPolarHBondContact O-CB 3.08Å; P241-C244 PolarHBondContact O-N 2.81Å; P241-C244 VanDerWaalsContact O-N 3.16Å; P241-C244 PolarHBondContact O-SG 2.05Å; E242-C244 PolarHBondContact O-N 3.23Å; C244-A246 PolarHBondContact O-N 3.05Å; C244-C263 VanDerWaalsContact CA-SG 3.57Å; C244-C263 HydrophobicContact CB-CB 3.82Å; C244-C263 WeakPolarHBondContact CB-SG 3.32Å; C244-C263 WeakPolarHBondContact SG-CB 3.37Å; C244-C263 CovalentContact SG-SG 2.04Å; C244-C263 PolarHBondContact SG-SG 3.31Å; C244-V264 HydrophobicContact CB-CG2 3.63Å; C244-V264 PolarHBondContact SG-N 3.05Å; C244-V264 VanDerWaalsContact SG-N 3.39Å; C244-R267 VanDerWaalsContact SG-CD 3.6Å
245	P	86	Confident	84.5	Confident	75 Å²	75	61.6 Å²	61.6	49%	0.487	33%	0.334	S	S	.	.			trans	-58.8	137.1	172.6	-22.7	33.8	0	0	0	111.3	Q247 N261	P245-Q247 HydrophobicContact CB-CG 4.14Å; P245-Q247 PolarHBondContact O-N 3.4Å; P245-N261 PolarHBondContact O-ND2 3Å; P245-N261 VanDerWaalsContact O-ND2 3.1Å
246	A	79.3	Confident	84.5	Confident	95 Å²	95	59 Å²	59	79%	0.785	32%	0.318	S	S	*	.			trans	-72.6	43.2	177.3	0	0	0	0	0	113.4	C244	C244-A246 PolarHBondContact O-N 3.05Å
247	Q	76.7	Confident	84.7	Confident	127 Å²	127	58.4 Å²	58.4	59%	0.593	32%	0.32	S	S	*	.			trans	-90.8	105.1	174.7	-63.2	-177.5	14.9	0	0	108.5	P245 T249 N261	P245-Q247 HydrophobicContact CB-CG 4.14Å; P245-Q247 PolarHBondContact O-N 3.4Å; Q247-T249 VanDerWaalsContact C-N 3.32Å; Q247-T249 PolarHBondContact O-N 2.97Å; Q247-N261 WeakPolarHBondContact O-CB 3.34Å; Q247-N261 PolarHBondContact O-ND2 3.07Å
248	H	80.4	Confident	85.1	Confident	136 Å²	136	56.9 Å²	56.9	63%	0.63	32%	0.316	S	S	*	.			trans	-74.2	86.5	172	-66.4	-71.6	0	0	0	110.2	P250 E260	H248-P250 VanDerWaalsContact C-CD 3.47Å; H248-P250 WeakPolarHBondContact O-CD 3.44Å; H248-E260 IonicContact CE1-OE1 2.94Å; H248-E260 PolarHBondContact CE1-OE1 3.26Å; H248-E260 IonicContact CE1-OE2 2.63Å; H248-E260 IonicContact ND1-OE1 3.62Å
249	T	89.2	Confident	85.7	Confident	80 Å²	80	55.3 Å²	55.3	49%	0.491	31%	0.307	S	S	.	.			trans	-119.7	69.5	173.8	48.6	0	0	0	0	108.9	Q247 I251 E260 N261	Q247-T249 VanDerWaalsContact C-N 3.32Å; Q247-T249 PolarHBondContact O-N 2.97Å; T249-I251 WeakPolarHBondContact O-CG2 3.2Å; T249-E260 CarbonylContact C-O 3.4Å; T249-E260 PolarHBondContact N-O 2.87Å; T249-N261 WeakPolarHBondContact OG1-CB 3.5Å
250	P	91.3	Very high	86.2	Confident	53 Å²	53	56.4 Å²	56.4	34%	0.344	31%	0.31	S	S	.	.			trans	-60	142.4	-162.9	22.2	-34.1	0	0	0	112.8	H248 T258 Y259 E260 G282	H248-P250 VanDerWaalsContact C-CD 3.47Å; H248-P250 WeakPolarHBondContact O-CD 3.44Å; P250-T258 HydrophobicContact CB-CG2 4.32Å; P250-Y259 VanDerWaalsContact CA-O 3.25Å; P250-Y259 WeakPolarHBondContact CA-O 3.44Å; P250-E260 WeakPolarHBondContact CA-O 3.14Å; P250-G282 VanDerWaalsContact O-CA 3.3Å; P250-G282 WeakPolarHBondContact O-CA 3.48Å; P250-G282 PolarHBondContact O-N 2.87Å
251	I	91.8	Very high	86.6	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	160.4	179.5	66.4	167.2	0	0	0	110.7	T249 T258 Y259 D262 M265 K278 G282	T249-I251 WeakPolarHBondContact O-CG2 3.2Å; I251-T258 CarbonylContact O-C 3.42Å; I251-T258 VanDerWaalsContact O-CA 3.32Å; I251-T258 WeakPolarHBondContact O-CA 3.35Å; I251-Y259 PolarHBondContact N-O 3.26Å; I251-Y259 PolarHBondContact O-N 2.04Å; I251-D262 HydrophobicContact CD1-CB 4.2Å; I251-M265 HydrophobicContact CD1-CB 3.9Å; I251-M265 HydrophobicContact CD1-CE 3.9Å; I251-M265 HydrophobicContact CD1-CG 4.3Å; I251-M265 HydrophobicContact CD1-SD 3.51Å; I251-M265 VanDerWaalsContact CD1-SD 3.51Å; I251-M265 HydrophobicContact CG1-SD 4.46Å; I251-K278 HydrophobicContact CB-CD 4.15Å; I251-K278 HydrophobicContact CB-CG 4.29Å; I251-K278 HydrophobicContact CD1-CB 4.24Å; I251-K278 HydrophobicContact CD1-CD 4.01Å; I251-K278 HydrophobicContact CD1-CG 4.2Å; I251-K278 HydrophobicContact CG2-CD 3.87Å; I251-K278 VanDerWaalsContact CG2-CE 3.44Å; I251-G282 CarbonylContact C-O 3.15Å; I251-G282 VanDerWaalsContact C-O 3.27Å; I251-G282 WeakPolarHBondContact CA-O 3.42Å
252	C	90.5	Very high	87	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	124.2	170.1	-173.2	0	0	0	0	109.5	V279 R280 G282 C284	C252-V279 PolarHBondContact O-N 2.91Å; C252-R280 HydrophobicContact CB-CG 3.48Å; C252-R280 VanDerWaalsContact CB-CG 3.48Å; C252-R280 PolarHBondContact N-O 2.87Å; C252-G282 PolarHBondContact N-O 2.69Å; C252-C284 WeakPolarHBondContact CA-SG 3.31Å; C252-C284 HydrophobicContact CB-CB 4Å; C252-C284 WeakPolarHBondContact CB-SG 3.21Å; C252-C284 WeakPolarHBondContact SG-CA 3.32Å; C252-C284 WeakPolarHBondContact SG-CB 3.31Å; C252-C284 CovalentContact SG-SG 2.03Å; C252-C284 PolarHBondContact SG-SG 3.29Å
253	G	89.7	Confident	87.3	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	169	171.4	0	0	0	0	0	112.1	D255 G256 V257 Q277 V279	G253-D255 PolarHBondContact O-N 3.05Å; G253-G256 PolarHBondContact O-N 3.37Å; G253-G256 VanDerWaalsContact O-N 3.15Å; G253-V257 PolarHBondContact N-O 3.24Å; G253-Q277 CarbonylContact C-O 3.36Å; G253-V279 WeakPolarHBondContact O-CG2 3.36Å
254	D	86.7	Confident	87.7	Confident	9 Å²	9	47.5 Å²	47.5	5%	0.048	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-12.9	173.5	61.8	-21	0	0	0	112.7	G256 L276 Q277 V279 L301 S302 R313	D254-G256 PolarHBondContact O-N 2.99Å; D254-L276 WeakPolarHBondContact OD1-CA 3.44Å; D254-Q277 PolarHBondContact N-O 2.93Å; D254-Q277 PolarHBondContact OD1-N 3.37Å; D254-V279 VanDerWaalsContact CA-CG2 3.48Å; D254-V279 HydrophobicContact CB-CG2 3.71Å; D254-L301 CarbonylContact O-C 3.41Å; D254-L301 VanDerWaalsContact O-CA 3.23Å; D254-L301 WeakPolarHBondContact O-CA 3.39Å; D254-S302 WeakPolarHBondContact O-CB 3.42Å; D254-S302 PolarHBondContact O-N 2.99Å; D254-R313 IonicContact OD2-CZ 2.7Å; D254-R313 VanDerWaalsContact OD2-CZ 3.25Å; D254-R313 IonicContact OD2-NE 3.44Å; D254-R313 PolarHBondContact OD2-NE 3.01Å; D254-R313 IonicContact OD2-NH2 3.26Å; D254-R313 PolarHBondContact OD2-NH2 2.04Å
255	D	86.1	Confident	87.9	Confident	24 Å²	24	46.7 Å²	46.7	13%	0.128	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-4.7	163.2	64.6	-8.5	0	0	0	114.4	G253 V257 Y259 L276	G253-D255 PolarHBondContact O-N 3.05Å; D255-V257 HydrophobicContact CB-CG2 4.39Å; D255-V257 PolarHBondContact O-N 2.81Å; D255-V257 WeakPolarHBondContact OD1-CB 3.5Å; D255-V257 PolarHBondContact OD1-N 2.95Å; D255-V257 WeakPolarHBondContact OD2-CB 3.04Å; D255-V257 WeakPolarHBondContact OD2-CG2 3.47Å; D255-Y259 WeakPolarHBondContact OD2-CE2 3.24Å; D255-Y259 PolarHBondContact OD2-OH 3.4Å; D255-L276 HydrophobicContact CB-CD2 3.86Å
256	G	85.8	Confident	88	Confident	8 Å²	8	45.8 Å²	45.8	8%	0.082	26%	0.264	C	S	.	.	S	Bend	trans	74.8	11.4	-175.9	0	0	0	0	0	114	G253 D254 C284 D288	G253-G256 PolarHBondContact O-N 3.37Å; G253-G256 VanDerWaalsContact O-N 3.15Å; D254-G256 PolarHBondContact O-N 2.99Å; G256-C284 PolarHBondContact O-SG 2.87Å; G256-D288 WeakPolarHBondContact CA-O 3.29Å
257	V	88.6	Confident	88.4	Confident	65 Å²	65	43.9 Å²	43.9	39%	0.394	24%	0.237	S	C	.	.			trans	-94	143.1	176.3	-179	0	0	0	0	110.1	G253 D255 Y259 C284	G253-V257 PolarHBondContact N-O 3.24Å; D255-V257 HydrophobicContact CB-CG2 4.39Å; D255-V257 PolarHBondContact O-N 2.81Å; D255-V257 WeakPolarHBondContact OD1-CB 3.5Å; D255-V257 PolarHBondContact OD1-N 2.95Å; D255-V257 WeakPolarHBondContact OD2-CB 3.04Å; D255-V257 WeakPolarHBondContact OD2-CG2 3.47Å; V257-Y259 HydrophobicContact CB-CD2 4.47Å; V257-Y259 HydrophobicContact CB-CE2 3.74Å; V257-Y259 HydrophobicContact CG1-CD2 4.44Å; V257-Y259 HydrophobicContact CG1-CE1 4.43Å; V257-Y259 HydrophobicContact CG1-CE2 3.93Å; V257-Y259 WeakPolarHBondContact O-CD2 3.06Å; V257-C284 PolarHBondContact O-SG 3.31Å
258	T	90.9	Very high	89	Confident	60 Å²	60	39.7 Å²	39.7	37%	0.368	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	125	173.6	-60.2	0	0	0	0	110.3	P250 I251 Q283 C284	P250-T258 HydrophobicContact CB-CG2 4.32Å; I251-T258 CarbonylContact O-C 3.42Å; I251-T258 VanDerWaalsContact O-CA 3.32Å; I251-T258 WeakPolarHBondContact O-CA 3.35Å; T258-Q283 HydrophobicContact CG2-CB 4.2Å; T258-Q283 HydrophobicContact CG2-CG 4.09Å; T258-C284 PolarHBondContact OG1-N 2.9Å; T258-C284 PolarHBondContact OG1-SG 2.82Å; T258-C284 VanDerWaalsContact OG1-SG 3.35Å
259	Y	90.9	Very high	89.3	Confident	14 Å²	14	33.2 Å²	33.2	6%	0.055	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	152.6	178.1	-67.2	-85.2	0	0	0	110.8	P250 I251 D255 V257 N261 V264 M265 I268 L276	P250-Y259 VanDerWaalsContact CA-O 3.25Å; P250-Y259 WeakPolarHBondContact CA-O 3.44Å; I251-Y259 PolarHBondContact N-O 3.26Å; I251-Y259 PolarHBondContact O-N 2.04Å; D255-Y259 WeakPolarHBondContact OD2-CE2 3.24Å; D255-Y259 PolarHBondContact OD2-OH 3.4Å; V257-Y259 HydrophobicContact CB-CD2 4.47Å; V257-Y259 HydrophobicContact CB-CE2 3.74Å; V257-Y259 HydrophobicContact CG1-CD2 4.44Å; V257-Y259 HydrophobicContact CG1-CE1 4.43Å; V257-Y259 HydrophobicContact CG1-CE2 3.93Å; V257-Y259 WeakPolarHBondContact O-CD2 3.06Å; Y259-N261 VanDerWaalsContact C-N 3.31Å; Y259-N261 PolarHBondContact O-N 3.43Å; Y259-V264 HydrophobicContact CD1-CG1 4.36Å; Y259-M265 HydrophobicContact CD1-CB 4.08Å; Y259-M265 HydrophobicContact CD2-CB 3.76Å; Y259-M265 HydrophobicContact CD2-CG 3.63Å; Y259-M265 HydrophobicContact CE2-CB 4.37Å; Y259-M265 HydrophobicContact CE2-CG 3.89Å; Y259-M265 HydrophobicContact CG-CB 3.59Å; Y259-M265 HydrophobicContact CG-CG 4.02Å; Y259-I268 HydrophobicContact CD1-CD1 4.17Å; Y259-I268 HydrophobicContact CE1-CB 4.02Å; Y259-I268 HydrophobicContact CE1-CD1 3.96Å; Y259-I268 HydrophobicContact CE1-CG2 3.96Å; Y259-L276 HydrophobicContact CE2-CD1 4.06Å; Y259-L276 WeakPolarHBondContact OH-CD1 3.29Å
260	E	91	Very high	89.1	Confident	99 Å²	99	30.9 Å²	30.9	46%	0.463	18%	0.177	S	C	.	.	S	Bend	trans	-65.5	-33.7	-177.9	-57.3	-161.3	129.6	0	0	113.4	H248 T249 P250	H248-E260 IonicContact CE1-OE1 2.94Å; H248-E260 PolarHBondContact CE1-OE1 3.26Å; H248-E260 IonicContact CE1-OE2 2.63Å; H248-E260 IonicContact ND1-OE1 3.62Å; T249-E260 CarbonylContact C-O 3.4Å; T249-E260 PolarHBondContact N-O 2.87Å; P250-E260 WeakPolarHBondContact CA-O 3.14Å
261	N	89.9	Confident	88.6	Confident	9 Å²	9	30.8 Å²	30.8	5%	0.048	18%	0.181	C	C	.	.	S	Bend	trans	-163.3	177.8	172.1	59.2	60.1	0	0	0	111.2	P245 Q247 T249 Y259 C263 V264 M265	P245-N261 PolarHBondContact O-ND2 3Å; P245-N261 VanDerWaalsContact O-ND2 3.1Å; Q247-N261 WeakPolarHBondContact O-CB 3.34Å; Q247-N261 PolarHBondContact O-ND2 3.07Å; T249-N261 WeakPolarHBondContact OG1-CB 3.5Å; Y259-N261 VanDerWaalsContact C-N 3.31Å; Y259-N261 PolarHBondContact O-N 3.43Å; N261-C263 PolarHBondContact O-N 2.81Å; N261-C263 WeakPolarHBondContact OD1-CB 3.35Å; N261-C263 PolarHBondContact OD1-N 3.31Å; N261-C263 VanDerWaalsContact OD1-N 3.14Å; N261-V264 PolarHBondContact O-N 3.2Å; N261-V264 WeakPolarHBondContact OD1-CG2 3.15Å; N261-V264 PolarHBondContact OD1-N 3.36Å; N261-M265 PolarHBondContact O-N 3.27Å; N261-M265 VanDerWaalsContact O-N 3.11Å
262	D	88.8	Confident	88.2	Confident	70 Å²	70	38.5 Å²	38.5	37%	0.374	21%	0.21	S	C	.	.	H	α-helix	trans	-63.4	-35.9	-176.4	-137.7	-79.6	0	0	0	114	I251 S266 K278	I251-D262 HydrophobicContact CD1-CB 4.2Å; D262-S266 WeakPolarHBondContact O-CB 3.47Å; D262-S266 PolarHBondContact O-N 3Å; D262-S266 PolarHBondContact O-OG 2.9Å; D262-K278 WeakPolarHBondContact OD2-CD 3.48Å; D262-K278 IonicContact OD2-NZ 3.63Å
263	C	90.8	Very high	87.8	Confident	34 Å²	34	39.2 Å²	39.2	23%	0.23	22%	0.217	C	C	.	.	H	α-helix	trans	-65.7	-47	176.3	176.4	0	0	0	0	110.9	C244 N261 S266 R267	C244-C263 VanDerWaalsContact CA-SG 3.57Å; C244-C263 HydrophobicContact CB-CB 3.82Å; C244-C263 WeakPolarHBondContact CB-SG 3.32Å; C244-C263 WeakPolarHBondContact SG-CB 3.37Å; C244-C263 CovalentContact SG-SG 2.04Å; C244-C263 PolarHBondContact SG-SG 3.31Å; N261-C263 PolarHBondContact O-N 2.81Å; N261-C263 WeakPolarHBondContact OD1-CB 3.35Å; N261-C263 PolarHBondContact OD1-N 3.31Å; N261-C263 VanDerWaalsContact OD1-N 3.14Å; C263-S266 PolarHBondContact O-N 2.89Å; C263-R267 WeakPolarHBondContact O-CG 3.03Å; C263-R267 PolarHBondContact O-N 2.6Å; C263-R267 VanDerWaalsContact SG-CZ 3.55Å
264	V	90.9	Very high	87.6	Confident	18 Å²	18	40.7 Å²	40.7	11%	0.109	23%	0.225	C	C	.	.	H	α-helix	trans	-64.8	-43.5	-179.5	175.2	0	0	0	0	110.9	C244 Y259 N261 I268	C244-V264 HydrophobicContact CB-CG2 3.63Å; C244-V264 PolarHBondContact SG-N 3.05Å; C244-V264 VanDerWaalsContact SG-N 3.39Å; Y259-V264 HydrophobicContact CD1-CG1 4.36Å; N261-V264 PolarHBondContact O-N 3.2Å; N261-V264 WeakPolarHBondContact OD1-CG2 3.15Å; N261-V264 PolarHBondContact OD1-N 3.36Å; V264-I268 HydrophobicContact CG1-CD1 3.62Å; V264-I268 HydrophobicContact CG1-CG1 4.37Å; V264-I268 WeakPolarHBondContact O-CB 3.29Å; V264-I268 VanDerWaalsContact O-CG1 3.3Å; V264-I268 WeakPolarHBondContact O-CG1 3.41Å; V264-I268 PolarHBondContact O-N 2.79Å
265	M	90.4	Very high	87.6	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.015	25%	0.248	C	C	.	.	H	α-helix	trans	-55.5	-54.5	172	-179.9	-168	70.8	0	0	111.4	I251 Y259 N261 R267 I268 G269 L276 K278	I251-M265 HydrophobicContact CD1-CB 3.9Å; I251-M265 HydrophobicContact CD1-CE 3.9Å; I251-M265 HydrophobicContact CD1-CG 4.3Å; I251-M265 HydrophobicContact CD1-SD 3.51Å; I251-M265 VanDerWaalsContact CD1-SD 3.51Å; I251-M265 HydrophobicContact CG1-SD 4.46Å; Y259-M265 HydrophobicContact CD1-CB 4.08Å; Y259-M265 HydrophobicContact CD2-CB 3.76Å; Y259-M265 HydrophobicContact CD2-CG 3.63Å; Y259-M265 HydrophobicContact CE2-CB 4.37Å; Y259-M265 HydrophobicContact CE2-CG 3.89Å; Y259-M265 HydrophobicContact CG-CB 3.59Å; Y259-M265 HydrophobicContact CG-CG 4.02Å; N261-M265 PolarHBondContact O-N 3.27Å; N261-M265 VanDerWaalsContact O-N 3.11Å; M265-R267 VanDerWaalsContact C-N 3.33Å; M265-R267 PolarHBondContact O-N 3.09Å; M265-I268 PolarHBondContact O-N 2.97Å; M265-G269 PolarHBondContact O-N 3.44Å; M265-L276 HydrophobicContact CG-CB 3.98Å; M265-L276 HydrophobicContact CG-CD1 4.12Å; M265-L276 HydrophobicContact SD-CB 4.37Å; M265-K278 HydrophobicContact CE-CB 4.19Å; M265-K278 HydrophobicContact SD-CB 4.38Å
266	S	87.8	Confident	87.7	Confident	55 Å²	55	44.5 Å²	44.5	39%	0.385	25%	0.245	S	C	.	.	H	α-helix	trans	-63	-38.9	-173.4	-59.6	0	0	0	0	112.3	D262 C263 A270	D262-S266 WeakPolarHBondContact O-CB 3.47Å; D262-S266 PolarHBondContact O-N 3Å; D262-S266 PolarHBondContact O-OG 2.9Å; C263-S266 PolarHBondContact O-N 2.89Å; S266-A270 WeakPolarHBondContact O-CB 3.35Å; S266-A270 PolarHBondContact O-N 2.94Å
267	R	89.1	Confident	87.8	Confident	55 Å²	55	48.7 Å²	48.7	21%	0.208	26%	0.262	C	S	.	.	H	α-helix	trans	-76.3	-39.1	178.6	-68.3	-178.5	-175.4	175.7	9	113.4	L239 R240 P241 N243 C244 C263 M265 G269 A270 A271	L239-R267 VanDerWaalsContact O-CD 3.23Å; L239-R267 WeakPolarHBondContact O-CD 3.49Å; R240-R267 VanDerWaalsContact O-CD 3.27Å; R240-R267 WeakPolarHBondContact O-CD 3.27Å; R240-R267 PolarHBondContact O-NH1 3.29Å; P241-R267 HydrophobicContact CB-CB 4.39Å; P241-R267 HydrophobicContact CG-CB 4.09Å; N243-R267 PolarHBondContact O-NH1 3.05Å; C244-R267 VanDerWaalsContact SG-CD 3.6Å; C263-R267 WeakPolarHBondContact O-CG 3.03Å; C263-R267 PolarHBondContact O-N 2.6Å; C263-R267 VanDerWaalsContact SG-CZ 3.55Å; M265-R267 VanDerWaalsContact C-N 3.33Å; M265-R267 PolarHBondContact O-N 3.09Å; R267-G269 VanDerWaalsContact C-N 3.3Å; R267-A270 PolarHBondContact O-N 2.89Å; R267-A271 VanDerWaalsContact O-CB 3.24Å; R267-A271 WeakPolarHBondContact O-CB 3.38Å; R267-A271 PolarHBondContact O-N 2.9Å
268	I	87.6	Confident	87.9	Confident	40 Å²	40	49.9 Å²	49.9	21%	0.205	26%	0.262	C	S	.	.	H	α-helix	trans	-65.1	-37.8	173.5	-68.8	174.6	0	0	0	110.5	P241 Y259 V264 M265 R272	P241-I268 HydrophobicContact CB-CD1 4.45Å; P241-I268 HydrophobicContact CB-CG1 3.85Å; P241-I268 HydrophobicContact CG-CG1 3.66Å; Y259-I268 HydrophobicContact CD1-CD1 4.17Å; Y259-I268 HydrophobicContact CE1-CB 4.02Å; Y259-I268 HydrophobicContact CE1-CD1 3.96Å; Y259-I268 HydrophobicContact CE1-CG2 3.96Å; V264-I268 HydrophobicContact CG1-CD1 3.62Å; V264-I268 HydrophobicContact CG1-CG1 4.37Å; V264-I268 WeakPolarHBondContact O-CB 3.29Å; V264-I268 VanDerWaalsContact O-CG1 3.3Å; V264-I268 WeakPolarHBondContact O-CG1 3.41Å; V264-I268 PolarHBondContact O-N 2.79Å; M265-I268 PolarHBondContact O-N 2.97Å; I268-R272 WeakPolarHBondContact O-CB 3.36Å; I268-R272 VanDerWaalsContact O-CG 3.29Å; I268-R272 WeakPolarHBondContact O-CG 3.41Å; I268-R272 PolarHBondContact O-N 2.88Å
269	G	87.5	Confident	87.7	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.1	-59.6	169.8	0	0	0	0	0	111.6	M265 R267 A271 R272 G273 L274	M265-G269 PolarHBondContact O-N 3.44Å; R267-G269 VanDerWaalsContact C-N 3.3Å; G269-A271 VanDerWaalsContact C-N 3.29Å; G269-A271 PolarHBondContact O-N 3.35Å; G269-R272 CarbonylContact O-C 3.33Å; G269-R272 WeakPolarHBondContact O-CA 3.11Å; G269-R272 PolarHBondContact O-N 2.88Å; G269-G273 PolarHBondContact O-N 2.83Å; G269-G273 VanDerWaalsContact O-N 3.15Å; G269-L274 CarbonylContact C-O 3.56Å; G269-L274 WeakPolarHBondContact CA-O 3.05Å; G269-L274 PolarHBondContact O-N 3.47Å
270	A	84.2	Confident	87.5	Confident	30 Å²	30	52.3 Å²	52.3	25%	0.248	27%	0.27	C	S	.	.	H	α-helix	trans	-57.3	-39.3	-177	0	0	0	0	0	113.5	R227 L238 S266 R267 R272 G273	R227-A270 PolarHBondContact NH1-O 2.83Å; L238-A270 HydrophobicContact CD1-CB 4.1Å; S266-A270 WeakPolarHBondContact O-CB 3.35Å; S266-A270 PolarHBondContact O-N 2.94Å; R267-A270 PolarHBondContact O-N 2.89Å; A270-R272 VanDerWaalsContact C-N 3.29Å; A270-R272 PolarHBondContact O-N 3.31Å; A270-G273 PolarHBondContact O-N 2.81Å
271	A	81.6	Confident	87.4	Confident	51 Å²	51	51.6 Å²	51.6	42%	0.421	28%	0.276	S	S	.	.	H	α-helix	trans	-68.4	-22.1	175.4	0	0	0	0	0	114.1	I225 R267 G269	I225-A271 HydrophobicContact CD1-CB 3.65Å; R267-A271 VanDerWaalsContact O-CB 3.24Å; R267-A271 WeakPolarHBondContact O-CB 3.38Å; R267-A271 PolarHBondContact O-N 2.9Å; G269-A271 VanDerWaalsContact C-N 3.29Å; G269-A271 PolarHBondContact O-N 3.35Å
272	R	82.8	Confident	87.4	Confident	164 Å²	164	52.6 Å²	52.6	62%	0.619	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	4.3	173.5	-70.1	175.4	174.9	179.2	-1.2	113.3	I268 G269 A270 L274	I268-R272 WeakPolarHBondContact O-CB 3.36Å; I268-R272 VanDerWaalsContact O-CG 3.29Å; I268-R272 WeakPolarHBondContact O-CG 3.41Å; I268-R272 PolarHBondContact O-N 2.88Å; G269-R272 CarbonylContact O-C 3.33Å; G269-R272 WeakPolarHBondContact O-CA 3.11Å; G269-R272 PolarHBondContact O-N 2.88Å; A270-R272 VanDerWaalsContact C-N 3.29Å; A270-R272 PolarHBondContact O-N 3.31Å; R272-L274 VanDerWaalsContact C-N 3.28Å; R272-L274 HydrophobicContact CB-CD1 4.35Å; R272-L274 HydrophobicContact CB-CG 4.18Å; R272-L274 PolarHBondContact O-N 3.47Å
273	G	82.9	Confident	87.4	Confident	15 Å²	15	56.1 Å²	56.1	16%	0.155	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	16.9	-172.2	0	0	0	0	0	114.3	G269 A270 T315	G269-G273 PolarHBondContact O-N 2.83Å; G269-G273 VanDerWaalsContact O-N 3.15Å; A270-G273 PolarHBondContact O-N 2.81Å; G273-T315 VanDerWaalsContact C-OG1 3.27Å; G273-T315 WeakPolarHBondContact CA-O 3.04Å; G273-T315 WeakPolarHBondContact O-CA 3.44Å; G273-T315 PolarHBondContact O-N 2.95Å; G273-T315 VanDerWaalsContact O-O 3.11Å; G273-T315 PolarHBondContact O-OG1 3.12Å
274	L	85.8	Confident	87.3	Confident	31 Å²	31	55.2 Å²	55.2	16%	0.162	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-110.5	124	-174.8	-60.5	-177	0	0	0	112.9	G269 R272 L276 V299 R313 V314	G269-L274 CarbonylContact C-O 3.56Å; G269-L274 WeakPolarHBondContact CA-O 3.05Å; G269-L274 PolarHBondContact O-N 3.47Å; R272-L274 VanDerWaalsContact C-N 3.28Å; R272-L274 HydrophobicContact CB-CD1 4.35Å; R272-L274 HydrophobicContact CB-CG 4.18Å; R272-L274 PolarHBondContact O-N 3.47Å; L274-L276 VanDerWaalsContact C-N 3.3Å; L274-L276 HydrophobicContact CB-CD2 4.14Å; L274-L276 HydrophobicContact CB-CG 4.23Å; L274-L276 HydrophobicContact CD1-CD2 4.48Å; L274-L276 PolarHBondContact O-N 2.04Å; L274-V299 HydrophobicContact CD1-CG1 4.34Å; L274-V299 HydrophobicContact CD2-CG1 4.4Å; L274-V299 HydrophobicContact CD2-CG2 3.72Å; L274-R313 WeakPolarHBondContact CA-O 3.42Å; L274-V314 HydrophobicContact CD2-CG2 4.43Å
275	L	86.6	Confident	87.1	Confident	102 Å²	102	57.9 Å²	57.9	53%	0.534	31%	0.308	S	S	.	.			trans	-81.9	74.2	171.8	-173.1	63.8	0	0	0	111.2	R313 T315	L275-R313 PolarHBondContact N-O 3.35Å; L275-R313 VanDerWaalsContact N-O 3.09Å; L275-R313 VanDerWaalsContact O-CD 3.24Å; L275-R313 WeakPolarHBondContact O-CD 3.38Å; L275-R313 PolarHBondContact O-NE 3.1Å; L275-T315 HydrophobicContact CB-CG2 4.24Å
276	L	88.7	Confident	86.7	Confident	12 Å²	12	63.7 Å²	63.7	6%	0.063	34%	0.343	C	S	.	.			trans	-65.5	142.8	178.3	-60.8	-179.1	0	0	0	111.9	D254 D255 Y259 M265 L274	D254-L276 WeakPolarHBondContact OD1-CA 3.44Å; D255-L276 HydrophobicContact CB-CD2 3.86Å; Y259-L276 HydrophobicContact CE2-CD1 4.06Å; Y259-L276 WeakPolarHBondContact OH-CD1 3.29Å; M265-L276 HydrophobicContact CG-CB 3.98Å; M265-L276 HydrophobicContact CG-CD1 4.12Å; M265-L276 HydrophobicContact SD-CB 4.37Å; L274-L276 VanDerWaalsContact C-N 3.3Å; L274-L276 HydrophobicContact CB-CD2 4.14Å; L274-L276 HydrophobicContact CB-CG 4.23Å; L274-L276 HydrophobicContact CD1-CD2 4.48Å; L274-L276 PolarHBondContact O-N 2.04Å
277	Q	88.1	Confident	86.2	Confident	95 Å²	95	68.5 Å²	68.5	44%	0.444	35%	0.353	S	S	.	.			trans	-127.7	140.2	175.5	-68.3	-168.6	-20.3	0	0	111.8	G253 D254 V279	G253-Q277 CarbonylContact C-O 3.36Å; D254-Q277 PolarHBondContact N-O 2.93Å; D254-Q277 PolarHBondContact OD1-N 3.37Å; Q277-V279 PolarHBondContact O-N 2.73Å
278	K	90.1	Very high	85.6	Confident	90 Å²	90	66.1 Å²	66.1	39%	0.391	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	116.8	177.4	176.8	170.5	176.6	174.3	0	111.8	I251 D262 M265 S281	I251-K278 HydrophobicContact CB-CD 4.15Å; I251-K278 HydrophobicContact CB-CG 4.29Å; I251-K278 HydrophobicContact CD1-CB 4.24Å; I251-K278 HydrophobicContact CD1-CD 4.01Å; I251-K278 HydrophobicContact CD1-CG 4.2Å; I251-K278 HydrophobicContact CG2-CD 3.87Å; I251-K278 VanDerWaalsContact CG2-CE 3.44Å; D262-K278 WeakPolarHBondContact OD2-CD 3.48Å; D262-K278 IonicContact OD2-NZ 3.63Å; M265-K278 HydrophobicContact CE-CB 4.19Å; M265-K278 HydrophobicContact SD-CB 4.38Å; K278-S281 VanDerWaalsContact CE-OG 3.29Å; K278-S281 WeakPolarHBondContact CE-OG 3.42Å; K278-S281 PolarHBondContact NZ-OG 2.79Å
279	V	86.7	Confident	84.9	Confident	51 Å²	51	68.8 Å²	68.8	31%	0.309	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	-38	172.7	176.7	0	0	0	0	110.9	C252 G253 D254 Q277 S302	C252-V279 PolarHBondContact O-N 2.91Å; G253-V279 WeakPolarHBondContact O-CG2 3.36Å; D254-V279 VanDerWaalsContact CA-CG2 3.48Å; D254-V279 HydrophobicContact CB-CG2 3.71Å; Q277-V279 PolarHBondContact O-N 2.73Å; V279-S302 VanDerWaalsContact CG2-O 3.26Å; V279-S302 WeakPolarHBondContact CG2-O 3.47Å
280	R	86	Confident	84.3	Confident	74 Å²	74	71 Å²	71	28%	0.279	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	157.7	-172.8	56.1	-173.7	-57.1	162.6	4.4	112	C252 D288	C252-R280 HydrophobicContact CB-CG 3.48Å; C252-R280 VanDerWaalsContact CB-CG 3.48Å; C252-R280 PolarHBondContact N-O 2.87Å; R280-D288 VanDerWaalsContact CD-OD2 3.29Å; R280-D288 WeakPolarHBondContact CD-OD2 3.24Å; R280-D288 IonicContact CZ-OD2 3.95Å; R280-D288 IonicContact NE-OD2 3.94Å; R280-D288 IonicContact NH1-OD1 3.2Å; R280-D288 IonicContact NH1-OD2 3.51Å; R280-D288 PolarHBondContact NH1-OD2 2.86Å
281	S	89.8	Confident	83.4	Confident	85 Å²	85	75 Å²	75	59%	0.594	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	151.9	161	-57.9	0	0	0	0	110.6	K278	K278-S281 VanDerWaalsContact CE-OG 3.29Å; K278-S281 WeakPolarHBondContact CE-OG 3.42Å; K278-S281 PolarHBondContact NZ-OG 2.79Å
282	G	88.6	Confident	82.6	Confident	29 Å²	29	80.7 Å²	80.7	30%	0.299	41%	0.412	S	S	.	.	S	Bend	trans	85.1	175.7	-171.9	0	0	0	0	0	113.1	P250 I251 C252	P250-G282 VanDerWaalsContact O-CA 3.3Å; P250-G282 WeakPolarHBondContact O-CA 3.48Å; P250-G282 PolarHBondContact O-N 2.87Å; I251-G282 CarbonylContact C-O 3.15Å; I251-G282 VanDerWaalsContact C-O 3.27Å; I251-G282 WeakPolarHBondContact CA-O 3.42Å; C252-G282 PolarHBondContact N-O 2.69Å
283	Q	90	Very high	82.3	Confident	144 Å²	144	79.2 Å²	79.2	67%	0.673	42%	0.421	S	S	*	.	S	Bend	trans	-64.6	150.6	177.9	-57.3	177.7	-28.4	0	0	111.7	T258	T258-Q283 HydrophobicContact CG2-CB 4.2Å; T258-Q283 HydrophobicContact CG2-CG 4.09Å
284	C	88.2	Confident	82.3	Confident	16 Å²	16	80 Å²	80	11%	0.108	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-62.4	142.9	172.9	-61.5	0	0	0	0	111.6	C252 G256 V257 T258 D288	C252-C284 WeakPolarHBondContact CA-SG 3.31Å; C252-C284 HydrophobicContact CB-CB 4Å; C252-C284 WeakPolarHBondContact CB-SG 3.21Å; C252-C284 WeakPolarHBondContact SG-CA 3.32Å; C252-C284 WeakPolarHBondContact SG-CB 3.31Å; C252-C284 CovalentContact SG-SG 2.03Å; C252-C284 PolarHBondContact SG-SG 3.29Å; G256-C284 PolarHBondContact O-SG 2.87Å; V257-C284 PolarHBondContact O-SG 3.31Å; T258-C284 PolarHBondContact OG1-N 2.9Å; T258-C284 PolarHBondContact OG1-SG 2.82Å; T258-C284 VanDerWaalsContact OG1-SG 3.35Å; C284-D288 HydrophobicContact CB-CB 4.23Å
285	Q	87.4	Confident	82.3	Confident	74 Å²	74	85 Å²	85	35%	0.346	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-92.8	165.3	171.8	-64	-179.9	-26.8	0	0	110.8	R287 D288 Q289	Q285-R287 HydrophobicContact CB-CG 4.13Å; Q285-R287 PolarHBondContact O-N 3.1Å; Q285-R287 VanDerWaalsContact O-N 3.09Å; Q285-R287 VanDerWaalsContact OE1-NE 3.12Å; Q285-D288 WeakPolarHBondContact CB-OD2 3.23Å; Q285-D288 PolarHBondContact N-OD2 2.74Å; Q285-D288 WeakPolarHBondContact O-CA 3.28Å; Q285-D288 WeakPolarHBondContact O-CB 3.44Å; Q285-D288 PolarHBondContact O-N 2.9Å; Q285-Q289 PolarHBondContact O-N 3.31Å
286	T	81.4	Confident	82.2	Confident	125 Å²	125	83.4 Å²	83.4	77%	0.767	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-20.7	-180	49.3	0	0	0	0	114.7
287	R	78	Confident	82	Confident	156 Å²	156	86.9 Å²	86.9	59%	0.589	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-14.7	170.6	59.6	167.7	165.2	-168.2	-7.6	114.6	Q285 G305	Q285-R287 HydrophobicContact CB-CG 4.13Å; Q285-R287 PolarHBondContact O-N 3.1Å; Q285-R287 VanDerWaalsContact O-N 3.09Å; Q285-R287 VanDerWaalsContact OE1-NE 3.12Å; R287-G305 CarbonylContact O-C 3.55Å
288	D	74.8	Confident	81.8	Confident	4 Å²	4	83.6 Å²	83.6	2%	0.021	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-21.1	177.6	-53	-33.3	0	0	0	110.1	G256 R280 C284 Q285 S302 G305	G256-D288 WeakPolarHBondContact CA-O 3.29Å; R280-D288 VanDerWaalsContact CD-OD2 3.29Å; R280-D288 WeakPolarHBondContact CD-OD2 3.24Å; R280-D288 IonicContact CZ-OD2 3.95Å; R280-D288 IonicContact NE-OD2 3.94Å; R280-D288 IonicContact NH1-OD1 3.2Å; R280-D288 IonicContact NH1-OD2 3.51Å; R280-D288 PolarHBondContact NH1-OD2 2.86Å; C284-D288 HydrophobicContact CB-CB 4.23Å; Q285-D288 WeakPolarHBondContact CB-OD2 3.23Å; Q285-D288 PolarHBondContact N-OD2 2.74Å; Q285-D288 WeakPolarHBondContact O-CA 3.28Å; Q285-D288 WeakPolarHBondContact O-CB 3.44Å; Q285-D288 PolarHBondContact O-N 2.9Å; D288-S302 WeakPolarHBondContact CA-OG 3.37Å; D288-S302 VanDerWaalsContact O-CB 3.29Å; D288-S302 WeakPolarHBondContact O-CB 3.26Å; D288-S302 PolarHBondContact O-OG 3.19Å; D288-G305 WeakPolarHBondContact OD1-CA 3.01Å
289	Q	74.6	Confident	81.6	Confident	97 Å²	97	80.4 Å²	80.4	45%	0.453	43%	0.43	S	S	.	.	S	Bend	trans	-77.3	148.9	177	-69.3	172	-25.8	0	0	113.1	Q285 P291	Q285-Q289 PolarHBondContact O-N 3.31Å; Q289-P291 WeakPolarHBondContact O-CD 3.26Å
290	C	73.9	Confident	81.5	Confident	45 Å²	45	79 Å²	79	30%	0.304	42%	0.422	S	S	.	.			trans	-86.3	118.8	-179.3	-61.3	0	0	0	0	111.9	C300	C290-C300 HydrophobicContact CB-CB 3.82Å; C290-C300 WeakPolarHBondContact CB-SG 3.27Å; C290-C300 WeakPolarHBondContact SG-CB 3.08Å; C290-C300 CovalentContact SG-SG 2.02Å; C290-C300 PolarHBondContact SG-SG 3.19Å
291	P	66.1	Low	81.5	Confident	115 Å²	115	76.4 Å²	76.4	75%	0.747	41%	0.414	S	S	*	.			trans	-80.2	-20.5	-174.5	-17.4	33	0	0	0	115.6	Q289	Q289-P291 WeakPolarHBondContact O-CD 3.26Å
292	E	65.1	Low	81.2	Confident	171 Å²	171	72.4 Å²	72.4	80%	0.799	39%	0.385	S	S	*	.	S	Bend	trans	-136.6	155.1	-175.7	-67.6	-174.4	-179.1	0	0	111.1	C294	E292-C294 PolarHBondContact O-N 2.86Å
293	T	75.6	Confident	80.7	Confident	132 Å²	132	80.6 Å²	80.6	81%	0.81	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-75.7	117.6	175.1	50.3	0	0	0	0	110.8
294	C	82.8	Confident	80	Confident	33 Å²	33	85.2 Å²	85.2	22%	0.223	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-59.8	137.4	175.6	-70.3	0	0	0	0	112.4	E292 S298 C300 C309	E292-C294 PolarHBondContact O-N 2.86Å; C294-S298 WeakPolarHBondContact CB-O 3.39Å; C294-S298 WeakPolarHBondContact CB-OG 3.28Å; C294-C300 VanDerWaalsContact SG-CA 3.59Å; C294-C300 VanDerWaalsContact SG-CB 3.58Å; C294-C309 WeakPolarHBondContact CA-SG 3.39Å; C294-C309 HydrophobicContact CB-CB 3.72Å; C294-C309 WeakPolarHBondContact CB-SG 3.23Å; C294-C309 WeakPolarHBondContact SG-CB 3.3Å; C294-C309 CovalentContact SG-SG 2.03Å; C294-C309 PolarHBondContact SG-SG 2.83Å
295	Q	85.1	Confident	79.1	Confident	136 Å²	136	85.3 Å²	85.3	64%	0.636	42%	0.422	S	S	*	.	S	Bend	trans	-87.2	168.6	-178.4	-62.1	-176.6	6.8	0	0	111.8	N297 S298	Q295-N297 VanDerWaalsContact C-N 3.27Å; Q295-N297 PolarHBondContact O-N 2.95Å; Q295-S298 WeakPolarHBondContact O-CB 3.5Å; Q295-S298 PolarHBondContact O-N 2.89Å; Q295-S298 PolarHBondContact O-OG 2.93Å
296	F	85.3	Confident	78.7	Confident	68 Å²	68	91.3 Å²	91.3	30%	0.298	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	36.8	174	-47.1	-71.8	0	0	0	114.7	S298 C342 Q345 T347	F296-S298 PolarHBondContact O-N 3.4Å; F296-S298 VanDerWaalsContact O-N 3.09Å; F296-C342 WeakPolarHBondContact O-CA 3.44Å; F296-C342 WeakPolarHBondContact O-CB 3.23Å; F296-C342 PolarHBondContact O-N 2.98Å; F296-C342 VanDerWaalsContact O-N 3.11Å; F296-Q345 HydrophobicContact CD2-CB 4.22Å; F296-Q345 WeakPolarHBondContact CE1-O 3.5Å; F296-Q345 HydrophobicContact CE2-CB 4.38Å; F296-Q345 WeakPolarHBondContact CZ-O 3.37Å; F296-T347 HydrophobicContact CD1-CG2 4.07Å; F296-T347 HydrophobicContact CE1-CG2 4.15Å
297	N	84.2	Confident	78.6	Confident	85 Å²	85	87.9 Å²	87.9	46%	0.455	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	23.8	-177.6	-62.4	-41.5	0	0	0	114.5	Q295 Q338 E341	Q295-N297 VanDerWaalsContact C-N 3.27Å; Q295-N297 PolarHBondContact O-N 2.95Å; N297-Q338 HydrophobicContact CB-CB 4.16Å; N297-E341 PolarHBondContact ND2-OE2 3.16Å
298	S	85	Confident	79	Confident	25 Å²	25	87.1 Å²	87.1	18%	0.175	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-77.6	148.7	172.2	62.4	0	0	0	0	112.4	C294 Q295 F296 C309 C342	C294-S298 WeakPolarHBondContact CB-O 3.39Å; C294-S298 WeakPolarHBondContact CB-OG 3.28Å; Q295-S298 WeakPolarHBondContact O-CB 3.5Å; Q295-S298 PolarHBondContact O-N 2.89Å; Q295-S298 PolarHBondContact O-OG 2.93Å; F296-S298 PolarHBondContact O-N 3.4Å; F296-S298 VanDerWaalsContact O-N 3.09Å; S298-C309 WeakPolarHBondContact OG-CB 3.43Å; S298-C342 WeakPolarHBondContact CA-SG 3.42Å; S298-C342 WeakPolarHBondContact CB-SG 3.47Å
299	V	85.1	Confident	79.5	Confident	24 Å²	24	89.2 Å²	89.2	15%	0.145	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	132.5	-175.1	-176.6	0	0	0	0	109.2	L274 L301 C309 S310 V314	L274-V299 HydrophobicContact CD1-CG1 4.34Å; L274-V299 HydrophobicContact CD2-CG1 4.4Å; L274-V299 HydrophobicContact CD2-CG2 3.72Å; V299-L301 HydrophobicContact CG1-CD2 4.03Å; V299-L301 PolarHBondContact O-N 2.72Å; V299-C309 CarbonylContact O-C 3.2Å; V299-C309 WeakPolarHBondContact O-CA 3.32Å; V299-S310 PolarHBondContact N-O 2.82Å; V299-S310 PolarHBondContact O-N 2.88Å; V299-V314 HydrophobicContact CG2-CG2 3.63Å
300	C	85.6	Confident	80.1	Confident	21 Å²	21	85.5 Å²	85.5	14%	0.142	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	127.4	173.7	-175.9	0	0	0	0	110.6	C290 C294	C290-C300 HydrophobicContact CB-CB 3.82Å; C290-C300 WeakPolarHBondContact CB-SG 3.27Å; C290-C300 WeakPolarHBondContact SG-CB 3.08Å; C290-C300 CovalentContact SG-SG 2.02Å; C290-C300 PolarHBondContact SG-SG 3.19Å; C294-C300 VanDerWaalsContact SG-CA 3.59Å; C294-C300 VanDerWaalsContact SG-CB 3.58Å
301	L	85.8	Confident	80.7	Confident	20 Å²	20	84.3 Å²	84.3	11%	0.105	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	128.9	178.9	-55.2	179.5	0	0	0	111.6	D254 V299 P307 H308 R313	D254-L301 CarbonylContact O-C 3.41Å; D254-L301 VanDerWaalsContact O-CA 3.23Å; D254-L301 WeakPolarHBondContact O-CA 3.39Å; V299-L301 HydrophobicContact CG1-CD2 4.03Å; V299-L301 PolarHBondContact O-N 2.72Å; L301-P307 CarbonylContact O-C 3.52Å; L301-P307 WeakPolarHBondContact O-CA 3.35Å; L301-H308 PolarHBondContact N-O 3.41Å; L301-H308 PolarHBondContact O-N 2.04Å; L301-R313 HydrophobicContact CD1-CG 3.68Å; L301-R313 HydrophobicContact CD2-CB 4.26Å; L301-R313 HydrophobicContact CD2-CG 3.41Å; L301-R313 VanDerWaalsContact CD2-CG 3.41Å; L301-R313 HydrophobicContact CG-CG 4.2Å
302	S	83.7	Confident	81.5	Confident	0 Å²	0	85.1 Å²	85.1	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	85.3	-173	-163.6	0	0	0	0	111.5	D254 V279 D288 R306	D254-S302 WeakPolarHBondContact O-CB 3.42Å; D254-S302 PolarHBondContact O-N 2.99Å; V279-S302 VanDerWaalsContact CG2-O 3.26Å; V279-S302 WeakPolarHBondContact CG2-O 3.47Å; D288-S302 WeakPolarHBondContact CA-OG 3.37Å; D288-S302 VanDerWaalsContact O-CB 3.29Å; D288-S302 WeakPolarHBondContact O-CB 3.26Å; D288-S302 PolarHBondContact O-OG 3.19Å; S302-R306 CarbonylContact C-O 3.56Å; S302-R306 WeakPolarHBondContact CA-O 3.37Å
303	R	77.5	Confident	82.3	Confident	202 Å²	202	78.8 Å²	78.8	76%	0.762	38%	0.383	S	S	*	.	S	Bend	trans	-95.4	107.4	-174.9	-147	175.5	-166.3	-167.5	5.3	111	R306	R303-R306 PolarHBondContact N-O 3.22Å
304	R	74.6	Confident	82.8	Confident	241 Å²	241	73.6 Å²	73.6	91%	0.909	35%	0.351	S	S	*	.	S	Bend	trans	63.6	37.1	-176.5	-51.3	176.5	176.6	172.1	-1.4	113.8
305	G	70.4	Confident	82.9	Confident	18 Å²	18	74.3 Å²	74.3	19%	0.186	35%	0.354	C	S	.	.	S	Bend	trans	71.7	41.3	-178	0	0	0	0	0	112.8	R287 D288	R287-G305 CarbonylContact O-C 3.55Å; D288-G305 WeakPolarHBondContact OD1-CA 3.01Å
306	R	77.7	Confident	83.2	Confident	200 Å²	200	68 Å²	68	76%	0.755	33%	0.325	S	S	*	.			trans	-140.7	107.7	172	-69.4	-171.1	177.6	-156	-1.1	108.3	S302 R303	S302-R306 CarbonylContact C-O 3.56Å; S302-R306 WeakPolarHBondContact CA-O 3.37Å; R303-R306 PolarHBondContact N-O 3.22Å
307	P	79.5	Confident	83.3	Confident	52 Å²	52	66.1 Å²	66.1	34%	0.338	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	140.3	175.1	28.9	-32.6	0	0	0	111.3	L301	L301-P307 CarbonylContact O-C 3.52Å; L301-P307 WeakPolarHBondContact O-CA 3.35Å
308	H	86.4	Confident	83.6	Confident	140 Å²	140	62.7 Å²	62.7	65%	0.648	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-154.9	141.3	174.5	177.1	58.1	0	0	0	110	L301	L301-H308 PolarHBondContact N-O 3.41Å; L301-H308 PolarHBondContact O-N 2.04Å
309	C	86.4	Confident	83.8	Confident	49 Å²	49	61.5 Å²	61.5	33%	0.331	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	130.6	179.9	-54.2	0	0	0	0	111.6	C294 S298 V299	C294-C309 WeakPolarHBondContact CA-SG 3.39Å; C294-C309 HydrophobicContact CB-CB 3.72Å; C294-C309 WeakPolarHBondContact CB-SG 3.23Å; C294-C309 WeakPolarHBondContact SG-CB 3.3Å; C294-C309 CovalentContact SG-SG 2.03Å; C294-C309 PolarHBondContact SG-SG 2.83Å; S298-C309 WeakPolarHBondContact OG-CB 3.43Å; V299-C309 CarbonylContact O-C 3.2Å; V299-C309 WeakPolarHBondContact O-CA 3.32Å
310	S	86.1	Confident	84.2	Confident	19 Å²	19	60.9 Å²	60.9	13%	0.133	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	160.7	177.1	176.7	0	0	0	0	112.9	V299 D312	V299-S310 PolarHBondContact N-O 2.82Å; V299-S310 PolarHBondContact O-N 2.88Å; S310-D312 PolarHBondContact OG-N 3.5Å; S310-D312 VanDerWaalsContact OG-N 3.12Å; S310-D312 PolarHBondContact OG-OD2 2.83Å
311	C	86.4	Confident	84.5	Confident	19 Å²	19	64.9 Å²	64.9	13%	0.128	30%	0.302	C	S	.	.	S	Bend	trans	-89.2	-11.7	174.1	-41.6	0	0	0	0	113.3	R313 V314 C342 R343	C311-R313 PolarHBondContact O-N 3.35Å; C311-V314 WeakPolarHBondContact O-CB 3.46Å; C311-V314 PolarHBondContact O-N 2.89Å; C311-C342 WeakPolarHBondContact CA-SG 3.35Å; C311-C342 HydrophobicContact CB-CB 4.01Å; C311-C342 WeakPolarHBondContact CB-SG 3.16Å; C311-C342 WeakPolarHBondContact SG-CB 3.36Å; C311-C342 PolarHBondContact SG-O 3.42Å; C311-C342 VanDerWaalsContact SG-O 3.37Å; C311-C342 CovalentContact SG-SG 2.03Å; C311-C342 PolarHBondContact SG-SG 3.18Å; C311-R343 HydrophobicContact CB-CG 4.17Å; C311-R343 PolarHBondContact SG-N 3.3Å
312	D	82.3	Confident	84.8	Confident	133 Å²	133	64.2 Å²	64.2	71%	0.711	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-16.4	-164.1	-58	-38.8	0	0	0	115	S310	S310-D312 PolarHBondContact OG-N 3.5Å; S310-D312 VanDerWaalsContact OG-N 3.12Å; S310-D312 PolarHBondContact OG-OD2 2.83Å
313	R	83	Confident	85.2	Confident	38 Å²	38	64.7 Å²	64.7	14%	0.143	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-9.5	176.4	-56.6	-48	-160.4	-174.1	2.1	114.2	D254 L274 L275 L301 C311 T315	D254-R313 IonicContact OD2-CZ 2.7Å; D254-R313 VanDerWaalsContact OD2-CZ 3.25Å; D254-R313 IonicContact OD2-NE 3.44Å; D254-R313 PolarHBondContact OD2-NE 3.01Å; D254-R313 IonicContact OD2-NH2 3.26Å; D254-R313 PolarHBondContact OD2-NH2 2.04Å; L274-R313 WeakPolarHBondContact CA-O 3.42Å; L275-R313 PolarHBondContact N-O 3.35Å; L275-R313 VanDerWaalsContact N-O 3.09Å; L275-R313 VanDerWaalsContact O-CD 3.24Å; L275-R313 WeakPolarHBondContact O-CD 3.38Å; L275-R313 PolarHBondContact O-NE 3.1Å; L301-R313 HydrophobicContact CD1-CG 3.68Å; L301-R313 HydrophobicContact CD2-CB 4.26Å; L301-R313 HydrophobicContact CD2-CG 3.41Å; L301-R313 VanDerWaalsContact CD2-CG 3.41Å; L301-R313 HydrophobicContact CG-CG 4.2Å; C311-R313 PolarHBondContact O-N 3.35Å; R313-T315 PolarHBondContact O-N 3.04Å
314	V	85.4	Confident	85.8	Confident	23 Å²	23	55 Å²	55	14%	0.139	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-71.4	114.2	177.9	-178.6	0	0	0	0	108	L274 V299 C311 Q339	L274-V314 HydrophobicContact CD2-CG2 4.43Å; V299-V314 HydrophobicContact CG2-CG2 3.63Å; C311-V314 WeakPolarHBondContact O-CB 3.46Å; C311-V314 PolarHBondContact O-N 2.89Å; V314-Q339 HydrophobicContact CG1-CB 4.22Å; V314-Q339 PolarHBondContact O-NE2 2.86Å
315	T	86.3	Confident	86.6	Confident	47 Å²	47	43.6 Å²	43.6	29%	0.288	22%	0.222	S	C	.	.			trans	-118.9	112.2	177.4	63.2	0	0	0	0	107.7	R227 G273 L275 R313	R227-T315 PolarHBondContact NH1-OG1 2.92Å; R227-T315 VanDerWaalsContact NH2-CB 3.3Å; R227-T315 PolarHBondContact NH2-O 3Å; R227-T315 PolarHBondContact NH2-OG1 3.25Å; G273-T315 VanDerWaalsContact C-OG1 3.27Å; G273-T315 WeakPolarHBondContact CA-O 3.04Å; G273-T315 WeakPolarHBondContact O-CA 3.44Å; G273-T315 PolarHBondContact O-N 2.95Å; G273-T315 VanDerWaalsContact O-O 3.11Å; G273-T315 PolarHBondContact O-OG1 3.12Å; L275-T315 HydrophobicContact CB-CG2 4.24Å; R313-T315 PolarHBondContact O-N 3.04Å
316	C	89.6	Confident	87.3	Confident	5 Å²	5	48.8 Å²	48.8	3%	0.034	24%	0.241	C	C	.	.			trans	-81.5	167.6	175.5	-57.1	0	0	0	0	111.3	R227 C335 W336	R227-C316 PolarHBondContact NH2-O 3.39Å; C316-C335 WeakPolarHBondContact CA-SG 3.26Å; C316-C335 HydrophobicContact CB-CB 3.7Å; C316-C335 WeakPolarHBondContact CB-SG 3.05Å; C316-C335 WeakPolarHBondContact SG-CB 3.46Å; C316-C335 PolarHBondContact SG-O 3.17Å; C316-C335 VanDerWaalsContact SG-O 3.38Å; C316-C335 CovalentContact SG-SG 2.05Å; C316-C335 PolarHBondContact SG-SG 3.23Å; C316-W336 HydrophobicContact CB-CD2 3.87Å; C316-W336 HydrophobicContact CB-CE3 4.42Å; C316-W336 HydrophobicContact CB-CG 4.23Å; C316-W336 HydrophobicContact CB-CH2 4.44Å; C316-W336 HydrophobicContact CB-CZ2 3.86Å; C316-W336 PolarHBondContact SG-N 3.18Å
317	D	88.9	Confident	87.8	Confident	27 Å²	27	42 Å²	42	14%	0.144	22%	0.22	C	C	.	.			trans	-92.6	164	168.9	65.9	-29.7	0	0	0	111.1	R227 V228 A319 R321 N333 W336	R227-D317 HydrophobicContact CG-CB 3.94Å; V228-D317 CarbonylContact O-C 3.29Å; V228-D317 WeakPolarHBondContact O-CA 3.44Å; V228-D317 WeakPolarHBondContact O-CB 3.44Å; D317-A319 VanDerWaalsContact C-N 3.34Å; D317-A319 WeakPolarHBondContact OD2-CB 3.06Å; D317-R321 VanDerWaalsContact CG-NH2 3.3Å; D317-R321 IonicContact OD1-NH2 2.76Å; D317-R321 PolarHBondContact OD1-NH2 3.44Å; D317-R321 VanDerWaalsContact OD1-NH2 3.1Å; D317-R321 IonicContact OD2-CZ 3.74Å; D317-R321 IonicContact OD2-NH1 3.15Å; D317-R321 PolarHBondContact OD2-NH1 3.25Å; D317-R321 IonicContact OD2-NH2 2.71Å; D317-R321 PolarHBondContact OD2-NH2 3.4Å; D317-N333 PolarHBondContact O-ND2 3.11Å; D317-N333 PolarHBondContact OD1-ND2 3.17Å; D317-W336 PolarHBondContact O-NE1 3.15Å
318	G	89.1	Confident	88	Confident	13 Å²	13	41.3 Å²	41.3	13%	0.134	22%	0.223	C	C	.	.	S	Bend	trans	-84.1	-1.2	179.9	0	0	0	0	0	115.2	V228 R233 Y320	V228-G318 PolarHBondContact O-N 2.97Å; R233-G318 PolarHBondContact NH1-O 2.82Å; G318-Y320 PolarHBondContact O-N 3.41Å
319	A	90.8	Very high	88.1	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.008	22%	0.217	C	C	.	.			trans	-65.7	132.3	179.4	0	0	0	0	0	110.3	D213 V228 D317 R321 N333	D213-A319 HydrophobicContact CB-CB 4.16Å; V228-A319 HydrophobicContact CB-CB 4.18Å; V228-A319 HydrophobicContact CG2-CB 3.88Å; D317-A319 VanDerWaalsContact C-N 3.34Å; D317-A319 WeakPolarHBondContact OD2-CB 3.06Å; A319-R321 VanDerWaalsContact CB-CZ 3.45Å; A319-N333 PolarHBondContact O-ND2 3.19Å
320	Y	92.9	Very high	88.3	Confident	10 Å²	10	40.1 Å²	40.1	4%	0.039	22%	0.216	C	C	.	.			trans	-93.3	107.9	-179.8	-171.9	-113.7	0	0	0	109	C180 G181 S182 K207 F208 C212 G318 P322 D332	C180-Y320 WeakPolarHBondContact SG-CD1 3.32Å; G181-Y320 WeakPolarHBondContact O-CE1 3.3Å; S182-Y320 PolarHBondContact O-OH 2.75Å; K207-Y320 HydrophobicContact CB-CE1 4.35Å; K207-Y320 HydrophobicContact CD-CD2 4.49Å; K207-Y320 HydrophobicContact CD-CE1 4.31Å; K207-Y320 HydrophobicContact CD-CE2 3.95Å; K207-Y320 HydrophobicContact CG-CD1 4.12Å; K207-Y320 HydrophobicContact CG-CD2 4.37Å; K207-Y320 HydrophobicContact CG-CE1 3.87Å; K207-Y320 HydrophobicContact CG-CE2 4.18Å; K207-Y320 HydrophobicContact CG-CG 4.34Å; F208-Y320 HydrophobicContact CD2-CG 4.38Å; F208-Y320 HydrophobicContact CE2-CD2 4.03Å; F208-Y320 AromaticContact CE2-CG 3.93Å; F208-Y320 HydrophobicContact CE2-CG 3.93Å; C212-Y320 WeakPolarHBondContact CB-O 3Å; C212-Y320 PolarHBondContact O-N 2.83Å; G318-Y320 PolarHBondContact O-N 3.41Å; Y320-P322 HydrophobicContact CD1-CG 4.34Å; Y320-P322 HydrophobicContact CE1-CB 4.29Å; Y320-P322 HydrophobicContact CE1-CG 3.78Å; Y320-P322 HydrophobicContact CE2-CB 4.19Å; Y320-D332 HydrophobicContact CD2-CB 3.86Å; Y320-D332 HydrophobicContact CE2-CB 4.04Å; Y320-D332 WeakPolarHBondContact CE2-OD1 3.27Å
321	R	92.1	Very high	88.6	Confident	105 Å²	105	40.6 Å²	40.6	40%	0.396	22%	0.215	S	C	.	.			trans	-139.4	72.4	-177.3	-64.5	178.4	-60.5	-117.5	-8.6	106	D213 D317 A319 D332 N333	D213-R321 IonicContact OD2-CZ 3.31Å; D213-R321 IonicContact OD2-NH1 2.94Å; D213-R321 PolarHBondContact OD2-NH1 3.46Å; D317-R321 VanDerWaalsContact CG-NH2 3.3Å; D317-R321 IonicContact OD1-NH2 2.76Å; D317-R321 PolarHBondContact OD1-NH2 3.44Å; D317-R321 VanDerWaalsContact OD1-NH2 3.1Å; D317-R321 IonicContact OD2-CZ 3.74Å; D317-R321 IonicContact OD2-NH1 3.15Å; D317-R321 PolarHBondContact OD2-NH1 3.25Å; D317-R321 IonicContact OD2-NH2 2.71Å; D317-R321 PolarHBondContact OD2-NH2 3.4Å; A319-R321 VanDerWaalsContact CB-CZ 3.45Å; R321-D332 CarbonylContact C-O 3.52Å; R321-D332 PolarHBondContact N-O 2.78Å; R321-N333 HydrophobicContact CB-CB 4.32Å; R321-N333 WeakPolarHBondContact O-CA 3.31Å
322	P	92.3	Very high	88.8	Confident	7 Å²	7	42.3 Å²	42.3	5%	0.045	22%	0.223	C	C	.	.			trans	-62	142.5	-161	21.1	-32	0	0	0	112.8	D183 Y320 T330 Y331 G354	D183-P322 WeakPolarHBondContact O-CG 3.38Å; Y320-P322 HydrophobicContact CD1-CG 4.34Å; Y320-P322 HydrophobicContact CE1-CB 4.29Å; Y320-P322 HydrophobicContact CE1-CG 3.78Å; Y320-P322 HydrophobicContact CE2-CB 4.19Å; P322-T330 HydrophobicContact CB-CG2 3.93Å; P322-Y331 WeakPolarHBondContact CA-O 3.25Å; P322-G354 WeakPolarHBondContact O-CA 3.42Å; P322-G354 PolarHBondContact O-N 2.92Å
323	V	91.8	Very high	89.2	Confident	9 Å²	9	36.1 Å²	36.1	6%	0.055	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	123.1	178.1	-179.1	0	0	0	0	109.2	Y331 D334 P350 G354	V323-Y331 PolarHBondContact N-O 2.67Å; V323-Y331 PolarHBondContact O-N 3.1Å; V323-D334 HydrophobicContact CG2-CB 4.18Å; V323-P350 HydrophobicContact CG1-CB 3.81Å; V323-G354 CarbonylContact C-O 3.54Å
324	C	90.4	Very high	89.6	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	123.7	169.5	-179.9	0	0	0	0	108.8	K351 H352 G354 C356	C324-K351 WeakPolarHBondContact O-CB 3.47Å; C324-K351 PolarHBondContact O-N 3.39Å; C324-H352 WeakPolarHBondContact CB-CE1 2.99Å; C324-H352 PolarHBondContact N-O 2.99Å; C324-H352 PolarHBondContact O-N 3.01Å; C324-G354 WeakPolarHBondContact CB-O 3.19Å; C324-G354 PolarHBondContact N-O 2.88Å; C324-C356 WeakPolarHBondContact CA-SG 3.49Å; C324-C356 HydrophobicContact CB-CB 4.06Å; C324-C356 WeakPolarHBondContact CB-SG 3.46Å; C324-C356 WeakPolarHBondContact SG-CA 3.37Å; C324-C356 WeakPolarHBondContact SG-CB 3.41Å; C324-C356 CovalentContact SG-SG 2.04Å; C324-C356 PolarHBondContact SG-SG 2.03Å
325	A	90.3	Very high	89.9	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	166.2	178.2	0	0	0	0	0	112.7	D327 G328 H329 Y331 R337 I348 P349	A325-D327 WeakPolarHBondContact CB-OD1 3.34Å; A325-D327 PolarHBondContact O-N 2.94Å; A325-G328 PolarHBondContact O-N 2.89Å; A325-G328 VanDerWaalsContact O-N 3.09Å; A325-H329 PolarHBondContact N-O 3.26Å; A325-H329 VanDerWaalsContact N-O 3.07Å; A325-Y331 HydrophobicContact CB-CD2 3.87Å; A325-Y331 HydrophobicContact CB-CE2 3.69Å; A325-R337 HydrophobicContact CB-CG 4.45Å; A325-I348 HydrophobicContact CB-CG2 3.6Å; A325-P349 WeakPolarHBondContact CA-O 3.01Å
326	Q	86.8	Confident	90.2	Very high	127 Å²	127	39.9 Å²	39.9	59%	0.593	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-11.9	-177.6	-167.8	58.9	24.8	0	0	113.5	G328 P349	Q326-G328 VanDerWaalsContact C-N 3.32Å; Q326-P349 HydrophobicContact CB-CB 4.49Å; Q326-P349 PolarHBondContact N-O 2.04Å
327	D	86.2	Confident	90.4	Very high	57 Å²	57	40.3 Å²	40.3	31%	0.305	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-8.1	171.7	67.8	-16.2	0	0	0	113.4	A325 H329 Y331 I348	A325-D327 WeakPolarHBondContact CB-OD1 3.34Å; A325-D327 PolarHBondContact O-N 2.94Å; D327-H329 PolarHBondContact OD1-N 3.4Å; D327-H329 IonicContact OD1-ND1 2.71Å; D327-H329 IonicContact OD2-CE1 3.41Å; D327-H329 IonicContact OD2-CG 3.25Å; D327-H329 IonicContact OD2-ND1 3.41Å; D327-H329 PolarHBondContact OD2-ND1 3Å; D327-Y331 PolarHBondContact OD2-OH 2.73Å; D327-I348 HydrophobicContact CB-CG2 4.27Å
328	G	84.8	Confident	90.4	Very high	39 Å²	39	42.6 Å²	42.6	40%	0.402	22%	0.216	S	C	.	.	S	Bend	trans	90.2	1.4	-177.2	0	0	0	0	0	114.8	A325 Q326 C356	A325-G328 PolarHBondContact O-N 2.89Å; A325-G328 VanDerWaalsContact O-N 3.09Å; Q326-G328 VanDerWaalsContact C-N 3.32Å; G328-C356 WeakPolarHBondContact O-CB 3.08Å; G328-C356 PolarHBondContact O-SG 3.49Å; G328-C356 VanDerWaalsContact O-SG 3.37Å
329	H	88.4	Confident	90.5	Very high	114 Å²	114	42.4 Å²	42.4	53%	0.528	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-95	141	178.9	-59.3	107.7	0	0	0	112.5	A325 D327 Y331 C356	A325-H329 PolarHBondContact N-O 3.26Å; A325-H329 VanDerWaalsContact N-O 3.07Å; D327-H329 PolarHBondContact OD1-N 3.4Å; D327-H329 IonicContact OD1-ND1 2.71Å; D327-H329 IonicContact OD2-CE1 3.41Å; D327-H329 IonicContact OD2-CG 3.25Å; D327-H329 IonicContact OD2-ND1 3.41Å; D327-H329 PolarHBondContact OD2-ND1 3Å; H329-Y331 HydrophobicContact CB-CD2 4.45Å; H329-Y331 HydrophobicContact CB-CE2 3.78Å; H329-C356 VanDerWaalsContact C-SG 3.53Å; H329-C356 PolarHBondContact O-SG 2.89Å; H329-C356 VanDerWaalsContact O-SG 3.4Å
330	T	89.7	Confident	90.6	Very high	50 Å²	50	43 Å²	43	31%	0.307	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	123.6	166.2	-57.7	0	0	0	0	109.6	P322 P355 C356	P322-T330 HydrophobicContact CB-CG2 3.93Å; T330-P355 HydrophobicContact CG2-CB 3.88Å; T330-P355 WeakPolarHBondContact OG1-CA 3.47Å; T330-C356 PolarHBondContact OG1-N 2.97Å
331	Y	92.4	Very high	90.5	Very high	29 Å²	29	43.1 Å²	43.1	11%	0.114	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	135.9	171	-67.2	-89.9	0	0	0	110.1	P322 V323 A325 D327 H329 N333 R337 A340 I348	P322-Y331 WeakPolarHBondContact CA-O 3.25Å; V323-Y331 PolarHBondContact N-O 2.67Å; V323-Y331 PolarHBondContact O-N 3.1Å; A325-Y331 HydrophobicContact CB-CD2 3.87Å; A325-Y331 HydrophobicContact CB-CE2 3.69Å; D327-Y331 PolarHBondContact OD2-OH 2.73Å; H329-Y331 HydrophobicContact CB-CD2 4.45Å; H329-Y331 HydrophobicContact CB-CE2 3.78Å; Y331-N333 PolarHBondContact O-N 2.84Å; Y331-N333 VanDerWaalsContact O-N 3.16Å; Y331-R337 HydrophobicContact CD1-CB 4.18Å; Y331-R337 HydrophobicContact CD2-CB 4.06Å; Y331-R337 HydrophobicContact CD2-CG 3.9Å; Y331-R337 HydrophobicContact CE2-CG 4.22Å; Y331-R337 HydrophobicContact CG-CB 3.77Å; Y331-R337 HydrophobicContact CG-CG 4.14Å; Y331-A340 HydrophobicContact CD1-CB 4.31Å; Y331-A340 HydrophobicContact CE1-CB 3.47Å; Y331-A340 VanDerWaalsContact CE1-CB 3.47Å; Y331-I348 HydrophobicContact CE2-CG2 4.04Å
332	D	91.3	Very high	90.5	Very high	55 Å²	55	38.4 Å²	38.4	29%	0.294	20%	0.201	S	C	.	.	S	Bend	trans	-59.1	-29.2	-174.9	-83.6	17.3	0	0	0	113.4	K207 Y320 R321	K207-D332 IonicContact NZ-OD1 3.78Å; K207-D332 PolarHBondContact NZ-OD1 2.96Å; K207-D332 IonicContact NZ-OD2 3.46Å; K207-D332 PolarHBondContact NZ-OD2 2.04Å; Y320-D332 HydrophobicContact CD2-CB 3.86Å; Y320-D332 HydrophobicContact CE2-CB 4.04Å; Y320-D332 WeakPolarHBondContact CE2-OD1 3.27Å; R321-D332 CarbonylContact C-O 3.52Å; R321-D332 PolarHBondContact N-O 2.78Å
333	N	91.8	Very high	90.4	Very high	3 Å²	3	46 Å²	46	2%	0.016	23%	0.229	C	C	.	.	S	Bend	trans	-158.8	174.6	158.6	65.5	49.6	0	0	0	111.6	D317 A319 R321 Y331 C335 W336 R337	D317-N333 PolarHBondContact O-ND2 3.11Å; D317-N333 PolarHBondContact OD1-ND2 3.17Å; A319-N333 PolarHBondContact O-ND2 3.19Å; R321-N333 HydrophobicContact CB-CB 4.32Å; R321-N333 WeakPolarHBondContact O-CA 3.31Å; Y331-N333 PolarHBondContact O-N 2.84Å; Y331-N333 VanDerWaalsContact O-N 3.16Å; N333-C335 VanDerWaalsContact C-N 3.27Å; N333-C335 PolarHBondContact O-N 3.46Å; N333-C335 WeakPolarHBondContact OD1-CB 3.46Å; N333-C335 PolarHBondContact OD1-N 2.84Å; N333-W336 VanDerWaalsContact CG-CD1 3.5Å; N333-W336 WeakPolarHBondContact O-CB 3.41Å; N333-W336 PolarHBondContact O-N 3.5Å; N333-W336 VanDerWaalsContact OD1-CD1 3.3Å; N333-W336 PolarHBondContact OD1-N 2.93Å; N333-R337 PolarHBondContact O-N 2.79Å
334	D	90.2	Very high	90.4	Very high	68 Å²	68	50.6 Å²	50.6	36%	0.364	25%	0.25	S	C	.	.	H	α-helix	trans	-62.3	-27.4	-175.1	-139.7	-9.8	0	0	0	113.9	V323 R337 Q338	V323-D334 HydrophobicContact CG2-CB 4.18Å; D334-R337 WeakPolarHBondContact O-CB 3.33Å; D334-R337 PolarHBondContact O-N 2.79Å; D334-R337 IonicContact OD1-CZ 2.78Å; D334-R337 IonicContact OD1-NE 3.48Å; D334-R337 PolarHBondContact OD1-NE 2.97Å; D334-R337 IonicContact OD1-NH2 3.68Å; D334-R337 PolarHBondContact OD1-NH2 3.34Å; D334-Q338 VanDerWaalsContact O-CG 3.32Å; D334-Q338 WeakPolarHBondContact O-CG 3.36Å; D334-Q338 PolarHBondContact O-N 2.84Å
335	C	91.5	Very high	90.3	Very high	32 Å²	32	57.7 Å²	57.7	22%	0.216	28%	0.283	C	S	.	.	H	α-helix	trans	-69.9	-40.6	173	176.4	0	0	0	0	111.4	C316 N333 R337 Q338 Q339	C316-C335 WeakPolarHBondContact CA-SG 3.26Å; C316-C335 HydrophobicContact CB-CB 3.7Å; C316-C335 WeakPolarHBondContact CB-SG 3.05Å; C316-C335 WeakPolarHBondContact SG-CB 3.46Å; C316-C335 PolarHBondContact SG-O 3.17Å; C316-C335 VanDerWaalsContact SG-O 3.38Å; C316-C335 CovalentContact SG-SG 2.05Å; C316-C335 PolarHBondContact SG-SG 3.23Å; N333-C335 VanDerWaalsContact C-N 3.27Å; N333-C335 PolarHBondContact O-N 3.46Å; N333-C335 WeakPolarHBondContact OD1-CB 3.46Å; N333-C335 PolarHBondContact OD1-N 2.84Å; C335-R337 VanDerWaalsContact C-N 3.28Å; C335-R337 PolarHBondContact O-N 3.39Å; C335-Q338 PolarHBondContact O-N 2.99Å; C335-Q339 WeakPolarHBondContact O-CB 3Å; C335-Q339 PolarHBondContact O-N 2.57Å
336	W	92.9	Very high	90.3	Very high	86 Å²	86	62.9 Å²	62.9	33%	0.326	31%	0.307	S	S	.	.	H	α-helix	trans	-64.4	-34.8	175.4	-67.6	109.8	0	0	0	111.8	P230 C316 D317 N333 Q339 A340	P230-W336 HydrophobicContact CB-CZ2 4.15Å; C316-W336 HydrophobicContact CB-CD2 3.87Å; C316-W336 HydrophobicContact CB-CE3 4.42Å; C316-W336 HydrophobicContact CB-CG 4.23Å; C316-W336 HydrophobicContact CB-CH2 4.44Å; C316-W336 HydrophobicContact CB-CZ2 3.86Å; C316-W336 PolarHBondContact SG-N 3.18Å; D317-W336 PolarHBondContact O-NE1 3.15Å; N333-W336 VanDerWaalsContact CG-CD1 3.5Å; N333-W336 WeakPolarHBondContact O-CB 3.41Å; N333-W336 PolarHBondContact O-N 3.5Å; N333-W336 VanDerWaalsContact OD1-CD1 3.3Å; N333-W336 PolarHBondContact OD1-N 2.93Å; W336-Q339 VanDerWaalsContact CZ3-OE1 3.28Å; W336-A340 WeakPolarHBondContact O-CB 3.5Å; W336-A340 PolarHBondContact O-N 2.94Å
337	R	93.3	Very high	90.4	Very high	14 Å²	14	61.1 Å²	61.1	5%	0.053	31%	0.305	C	S	.	.	H	α-helix	trans	-61	-51.5	169.4	-170.7	-172	61.9	64.5	11.3	111.4	A325 Y331 N333 D334 C335 Q339 A340 E341 I348	A325-R337 HydrophobicContact CB-CG 4.45Å; Y331-R337 HydrophobicContact CD1-CB 4.18Å; Y331-R337 HydrophobicContact CD2-CB 4.06Å; Y331-R337 HydrophobicContact CD2-CG 3.9Å; Y331-R337 HydrophobicContact CE2-CG 4.22Å; Y331-R337 HydrophobicContact CG-CB 3.77Å; Y331-R337 HydrophobicContact CG-CG 4.14Å; N333-R337 PolarHBondContact O-N 2.79Å; D334-R337 WeakPolarHBondContact O-CB 3.33Å; D334-R337 PolarHBondContact O-N 2.79Å; D334-R337 IonicContact OD1-CZ 2.78Å; D334-R337 IonicContact OD1-NE 3.48Å; D334-R337 PolarHBondContact OD1-NE 2.97Å; D334-R337 IonicContact OD1-NH2 3.68Å; D334-R337 PolarHBondContact OD1-NH2 3.34Å; C335-R337 VanDerWaalsContact C-N 3.28Å; C335-R337 PolarHBondContact O-N 3.39Å; R337-Q339 VanDerWaalsContact C-N 3.32Å; R337-Q339 PolarHBondContact O-N 3.19Å; R337-A340 WeakPolarHBondContact O-CA 3Å; R337-A340 WeakPolarHBondContact O-CB 3.22Å; R337-A340 PolarHBondContact O-N 3.02Å; R337-E341 IonicContact CZ-OE2 3.87Å; R337-E341 IonicContact NH1-OE1 2.61Å; R337-E341 PolarHBondContact NH1-OE1 3.43Å; R337-E341 IonicContact NH1-OE2 3.39Å; R337-E341 PolarHBondContact NH1-OE2 2.74Å; R337-E341 PolarHBondContact O-N 2.71Å; R337-I348 WeakPolarHBondContact CD-O 3.49Å; R337-I348 HydrophobicContact CG-CG2 4.29Å; R337-I348 PolarHBondContact NH1-O 2.92Å
338	Q	89.9	Confident	90.7	Very high	75 Å²	75	58.5 Å²	58.5	35%	0.35	29%	0.291	S	S	.	.	H	α-helix	trans	-62.8	-35	178.5	-68.8	173.1	23.8	0	0	113.1	N297 D334 C335 A340 E341 C342	N297-Q338 HydrophobicContact CB-CB 4.16Å; D334-Q338 VanDerWaalsContact O-CG 3.32Å; D334-Q338 WeakPolarHBondContact O-CG 3.36Å; D334-Q338 PolarHBondContact O-N 2.84Å; C335-Q338 PolarHBondContact O-N 2.99Å; Q338-A340 VanDerWaalsContact C-N 3.34Å; Q338-E341 WeakPolarHBondContact O-CB 3.07Å; Q338-E341 PolarHBondContact O-N 3.2Å; Q338-C342 WeakPolarHBondContact O-CB 3.48Å; Q338-C342 PolarHBondContact O-N 2.9Å
339	Q	91	Very high	90.9	Very high	9 Å²	9	59.7 Å²	59.7	4%	0.042	29%	0.292	C	S	.	.	H	α-helix	trans	-69.4	-32.5	173.3	-176.5	167.5	79.3	0	0	112	V314 C335 W336 R337 R343	V314-Q339 HydrophobicContact CG1-CB 4.22Å; V314-Q339 PolarHBondContact O-NE2 2.86Å; C335-Q339 WeakPolarHBondContact O-CB 3Å; C335-Q339 PolarHBondContact O-N 2.57Å; W336-Q339 VanDerWaalsContact CZ3-OE1 3.28Å; R337-Q339 VanDerWaalsContact C-N 3.32Å; R337-Q339 PolarHBondContact O-N 3.19Å; Q339-R343 VanDerWaalsContact CD-CZ 3.45Å; Q339-R343 HydrophobicContact CG-CG 4.43Å; Q339-R343 WeakPolarHBondContact O-CB 3.39Å; Q339-R343 VanDerWaalsContact O-CG 3.29Å; Q339-R343 WeakPolarHBondContact O-CG 3.5Å; Q339-R343 PolarHBondContact O-N 2.92Å; Q339-R343 VanDerWaalsContact OE1-CZ 3.27Å
340	A	91.6	Very high	91	Very high	14 Å²	14	57.6 Å²	57.6	12%	0.116	29%	0.288	C	S	.	.	H	α-helix	trans	-67.1	-44.4	171.1	0	0	0	0	0	111.6	Y331 W336 R337 Q338 C342 R343 Q344 I348	Y331-A340 HydrophobicContact CD1-CB 4.31Å; Y331-A340 HydrophobicContact CE1-CB 3.47Å; Y331-A340 VanDerWaalsContact CE1-CB 3.47Å; W336-A340 WeakPolarHBondContact O-CB 3.5Å; W336-A340 PolarHBondContact O-N 2.94Å; R337-A340 WeakPolarHBondContact O-CA 3Å; R337-A340 WeakPolarHBondContact O-CB 3.22Å; R337-A340 PolarHBondContact O-N 3.02Å; Q338-A340 VanDerWaalsContact C-N 3.34Å; A340-C342 VanDerWaalsContact C-N 3.28Å; A340-C342 PolarHBondContact O-N 3.36Å; A340-R343 PolarHBondContact O-N 3Å; A340-Q344 WeakPolarHBondContact O-CB 3.49Å; A340-Q344 VanDerWaalsContact O-CG 3.3Å; A340-Q344 WeakPolarHBondContact O-CG 3.35Å; A340-Q344 PolarHBondContact O-N 2.95Å; A340-I348 HydrophobicContact CB-CD1 4.18Å
341	E	92.3	Very high	90.6	Very high	12 Å²	12	60.7 Å²	60.7	6%	0.056	30%	0.297	C	S	.	.	H	α-helix	trans	-52.1	-49.2	173.5	-68.1	-176.1	110.9	0	0	111.3	N297 R337 Q338 Q345 Q346 I348	N297-E341 PolarHBondContact ND2-OE2 3.16Å; R337-E341 IonicContact CZ-OE2 3.87Å; R337-E341 IonicContact NH1-OE1 2.61Å; R337-E341 PolarHBondContact NH1-OE1 3.43Å; R337-E341 IonicContact NH1-OE2 3.39Å; R337-E341 PolarHBondContact NH1-OE2 2.74Å; R337-E341 PolarHBondContact O-N 2.71Å; Q338-E341 WeakPolarHBondContact O-CB 3.07Å; Q338-E341 PolarHBondContact O-N 3.2Å; E341-Q345 WeakPolarHBondContact O-CA 3.39Å; E341-Q345 PolarHBondContact O-N 3.37Å; E341-Q346 WeakPolarHBondContact CA-O 3.47Å; E341-Q346 VanDerWaalsContact CB-O 3.29Å; E341-Q346 WeakPolarHBondContact CB-O 3.31Å; E341-Q346 PolarHBondContact O-N 3.43Å; E341-I348 HydrophobicContact CG-CB 3.62Å; E341-I348 HydrophobicContact CG-CD1 4.12Å; E341-I348 HydrophobicContact CG-CG1 3.91Å; E341-I348 PolarHBondContact OE1-N 2.96Å
342	C	91.1	Very high	90.2	Very high	6 Å²	6	63.4 Å²	63.4	4%	0.041	31%	0.311	C	S	.	.	H	α-helix	trans	-61.4	-48.6	178.8	-177	0	0	0	0	112.6	F296 S298 C311 Q338 A340 Q345	F296-C342 WeakPolarHBondContact O-CA 3.44Å; F296-C342 WeakPolarHBondContact O-CB 3.23Å; F296-C342 PolarHBondContact O-N 2.98Å; F296-C342 VanDerWaalsContact O-N 3.11Å; S298-C342 WeakPolarHBondContact CA-SG 3.42Å; S298-C342 WeakPolarHBondContact CB-SG 3.47Å; C311-C342 WeakPolarHBondContact CA-SG 3.35Å; C311-C342 HydrophobicContact CB-CB 4.01Å; C311-C342 WeakPolarHBondContact CB-SG 3.16Å; C311-C342 WeakPolarHBondContact SG-CB 3.36Å; C311-C342 PolarHBondContact SG-O 3.42Å; C311-C342 VanDerWaalsContact SG-O 3.37Å; C311-C342 CovalentContact SG-SG 2.03Å; C311-C342 PolarHBondContact SG-SG 3.18Å; Q338-C342 WeakPolarHBondContact O-CB 3.48Å; Q338-C342 PolarHBondContact O-N 2.9Å; A340-C342 VanDerWaalsContact C-N 3.28Å; A340-C342 PolarHBondContact O-N 3.36Å; C342-Q345 PolarHBondContact O-N 3.48Å
343	R	91.4	Very high	89.6	Confident	167 Å²	167	69.1 Å²	69.1	63%	0.63	34%	0.336	S	S	*	.	H	α-helix	trans	-70.4	-33.5	-176.8	-75.1	176.4	178.9	163.9	6.1	113.1	C311 Q339 A340	C311-R343 HydrophobicContact CB-CG 4.17Å; C311-R343 PolarHBondContact SG-N 3.3Å; Q339-R343 VanDerWaalsContact CD-CZ 3.45Å; Q339-R343 HydrophobicContact CG-CG 4.43Å; Q339-R343 WeakPolarHBondContact O-CB 3.39Å; Q339-R343 VanDerWaalsContact O-CG 3.29Å; Q339-R343 WeakPolarHBondContact O-CG 3.5Å; Q339-R343 PolarHBondContact O-N 2.92Å; Q339-R343 VanDerWaalsContact OE1-CZ 3.27Å; A340-R343 PolarHBondContact O-N 3Å
344	Q	90.6	Very high	89.1	Confident	105 Å²	105	69.9 Å²	69.9	49%	0.491	35%	0.345	S	S	.	.	H	α-helix	trans	-87.7	-12.6	179.6	-62.1	179.7	27.5	0	0	112.7	A340 Q346	A340-Q344 WeakPolarHBondContact O-CB 3.49Å; A340-Q344 VanDerWaalsContact O-CG 3.3Å; A340-Q344 WeakPolarHBondContact O-CG 3.35Å; A340-Q344 PolarHBondContact O-N 2.95Å; Q344-Q346 HydrophobicContact CB-CB 4.3Å; Q344-Q346 PolarHBondContact O-N 2.04Å
345	Q	88.8	Confident	88.9	Confident	149 Å²	149	68.7 Å²	68.7	70%	0.696	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	40	-172.6	-56.5	-174.2	-8.3	0	0	112.4	F296 E341 C342	F296-Q345 HydrophobicContact CD2-CB 4.22Å; F296-Q345 WeakPolarHBondContact CE1-O 3.5Å; F296-Q345 HydrophobicContact CE2-CB 4.38Å; F296-Q345 WeakPolarHBondContact CZ-O 3.37Å; E341-Q345 WeakPolarHBondContact O-CA 3.39Å; E341-Q345 PolarHBondContact O-N 3.37Å; C342-Q345 PolarHBondContact O-N 3.48Å
346	Q	91.1	Very high	88.4	Confident	109 Å²	109	67.9 Å²	67.9	51%	0.509	34%	0.335	S	S	.	.	S	Bend	trans	-136.6	142.1	-176.5	-179.5	169.5	-14.7	0	0	109.4	E341 Q344 I348	E341-Q346 WeakPolarHBondContact CA-O 3.47Å; E341-Q346 VanDerWaalsContact CB-O 3.29Å; E341-Q346 WeakPolarHBondContact CB-O 3.31Å; E341-Q346 PolarHBondContact O-N 3.43Å; Q344-Q346 HydrophobicContact CB-CB 4.3Å; Q344-Q346 PolarHBondContact O-N 2.04Å; Q346-I348 HydrophobicContact CG-CG1 4.48Å
347	T	88.9	Confident	87.1	Confident	90 Å²	90	70.2 Å²	70.2	55%	0.552	35%	0.354	S	S	*	.			trans	-76	129.1	169.7	50.8	0	0	0	0	109.8	F296	F296-T347 HydrophobicContact CD1-CG2 4.07Å; F296-T347 HydrophobicContact CE1-CG2 4.15Å
348	I	92.1	Very high	85.5	Confident	3 Å²	3	74.7 Å²	74.7	2%	0.015	38%	0.376	C	S	.	.			trans	-128.5	75.9	-177.2	-55.4	169.2	0	0	0	106.7	A325 D327 Y331 R337 A340 E341 Q346	A325-I348 HydrophobicContact CB-CG2 3.6Å; D327-I348 HydrophobicContact CB-CG2 4.27Å; Y331-I348 HydrophobicContact CE2-CG2 4.04Å; R337-I348 WeakPolarHBondContact CD-O 3.49Å; R337-I348 HydrophobicContact CG-CG2 4.29Å; R337-I348 PolarHBondContact NH1-O 2.92Å; A340-I348 HydrophobicContact CB-CD1 4.18Å; E341-I348 HydrophobicContact CG-CB 3.62Å; E341-I348 HydrophobicContact CG-CD1 4.12Å; E341-I348 HydrophobicContact CG-CG1 3.91Å; E341-I348 PolarHBondContact OE1-N 2.96Å; Q346-I348 HydrophobicContact CG-CG1 4.48Å
349	P	89.1	Confident	83.6	Confident	63 Å²	63	76.6 Å²	76.6	41%	0.409	39%	0.392	S	S	.	.			trans	-61.8	146.4	-173.8	-23	34.4	0	0	0	112.2	A325 Q326	A325-P349 WeakPolarHBondContact CA-O 3.01Å; Q326-P349 HydrophobicContact CB-CB 4.49Å; Q326-P349 PolarHBondContact N-O 2.04Å
350	P	88.9	Confident	81.9	Confident	71 Å²	71	80.4 Å²	80.4	46%	0.461	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	134.9	169.4	30.7	-33	0	0	0	109.4	V323	V323-P350 HydrophobicContact CG1-CB 3.81Å
351	K	82.6	Confident	80	Confident	114 Å²	114	80.1 Å²	80.1	50%	0.496	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-44.8	178.4	179.5	-168.8	169.3	-158.5	0	110.7	C324	C324-K351 WeakPolarHBondContact O-CB 3.47Å; C324-K351 PolarHBondContact O-N 3.39Å
352	H	82.9	Confident	78.5	Confident	87 Å²	87	82.7 Å²	82.7	40%	0.403	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	167	168.2	56	85.8	0	0	0	110.8	C324 P355	C324-H352 WeakPolarHBondContact CB-CE1 2.99Å; C324-H352 PolarHBondContact N-O 2.99Å; C324-H352 PolarHBondContact O-N 3.01Å; H352-P355 PolarHBondContact CE1-O 2.73Å
353	Q	79.7	Confident	77	Confident	175 Å²	175	82.8 Å²	82.8	82%	0.818	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	157.9	166.8	-62.6	-179.3	5.3	0	0	110.2
354	G	81.8	Confident	75.4	Confident	19 Å²	19	81.8 Å²	81.8	20%	0.196	43%	0.43	C	S	.	.	B	Isolated β-bridge	trans	82.5	170.5	-168.6	0	0	0	0	0	112.9	P322 V323 C324	P322-G354 WeakPolarHBondContact O-CA 3.42Å; P322-G354 PolarHBondContact O-N 2.92Å; V323-G354 CarbonylContact C-O 3.54Å; C324-G354 WeakPolarHBondContact CB-O 3.19Å; C324-G354 PolarHBondContact N-O 2.88Å
355	P	86	Confident	73.6	Confident	42 Å²	42	80.5 Å²	80.5	27%	0.273	45%	0.445	S	S	.	.			trans	-71.6	155.4	-177.6	31.1	-38	0	0	0	113.5	T330 H352	T330-P355 HydrophobicContact CG2-CB 3.88Å; T330-P355 WeakPolarHBondContact OG1-CA 3.47Å; H352-P355 PolarHBondContact CE1-O 2.73Å
356	C	80.1	Confident	72.2	Confident	15 Å²	15	75.3 Å²	75.3	10%	0.101	43%	0.427	C	S	.	.	S	Bend	trans	-70.8	158.5	163.5	-59.1	0	0	0	0	111.2	C324 G328 H329 T330	C324-C356 WeakPolarHBondContact CA-SG 3.49Å; C324-C356 HydrophobicContact CB-CB 4.06Å; C324-C356 WeakPolarHBondContact CB-SG 3.46Å; C324-C356 WeakPolarHBondContact SG-CA 3.37Å; C324-C356 WeakPolarHBondContact SG-CB 3.41Å; C324-C356 CovalentContact SG-SG 2.04Å; C324-C356 PolarHBondContact SG-SG 2.03Å; G328-C356 WeakPolarHBondContact O-CB 3.08Å; G328-C356 PolarHBondContact O-SG 3.49Å; G328-C356 VanDerWaalsContact O-SG 3.37Å; H329-C356 VanDerWaalsContact C-SG 3.53Å; H329-C356 PolarHBondContact O-SG 2.89Å; H329-C356 VanDerWaalsContact O-SG 3.4Å; T330-C356 PolarHBondContact OG1-N 2.97Å
357	D	65.5	Low	70.6	Confident	135 Å²	135	79.4 Å²	79.4	72%	0.722	45%	0.446	S	S	*	.			trans	59.1	64.8	174	-67.5	-4.5	0	0	0	117.7	T359	D357-T359 VanDerWaalsContact C-N 3.31Å; D357-T359 PolarHBondContact O-N 3.02Å
358	Q	59.2	Low	69.6	Low	109 Å²	109	76.6 Å²	76.6	51%	0.509	43%	0.43	S	S	.	.			trans	-72.1	91.6	136.1	-73.7	-158.3	7.1	0	0	109.4	E202 P360	E202-Q358 PolarHBondContact OE1-NE2 2.9Å; E202-Q358 PolarHBondContact OE1-OE1 2.7Å; Q358-P360 WeakPolarHBondContact O-CD 3.29Å
359	T	50.7	Low	68.3	Low	114 Å²	114	79.2 Å²	79.2	70%	0.699	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-70.7	119.4	156.4	40.9	0	0	0	0	107.6	D357 S361	D357-T359 VanDerWaalsContact C-N 3.31Å; D357-T359 PolarHBondContact O-N 3.02Å; T359-S361 PolarHBondContact O-N 2.87Å
360	P	56.3	Low	67.4	Low	90 Å²	90	81.1 Å²	81.1	58%	0.584	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-64.7	136.5	-176.2	26.5	-34.1	0	0	0	109.8	Q358 R364	Q358-P360 WeakPolarHBondContact O-CD 3.29Å; P360-R364 HydrophobicContact CB-CB 4.43Å
361	S	51.7	Low	66	Low	8 Å²	8	80.2 Å²	80.2	6%	0.056	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-57	147.2	179.2	88.6	0	0	0	0	110.2	Q201 T359 C363 R364	Q201-S361 PolarHBondContact OE1-OG 2.72Å; T359-S361 PolarHBondContact O-N 2.87Å; S361-C363 PolarHBondContact O-N 3.16Å; S361-C363 PolarHBondContact OG-N 2.99Å; S361-R364 WeakPolarHBondContact O-CB 3.28Å; S361-R364 PolarHBondContact O-N 3.33Å; S361-R364 PolarHBondContact OG-N 3.01Å
362	P	60.4	Low	65.3	Low	66 Å²	66	75.7 Å²	75.7	43%	0.429	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-16.4	171.6	-27.9	35.7	0	0	0	114.3	V376 G379 A381	P362-V376 HydrophobicContact CG-CG1 4.16Å; P362-V376 HydrophobicContact CG-CG2 4.38Å; P362-G379 WeakPolarHBondContact CG-O 3.26Å; P362-A381 HydrophobicContact CB-CB 4.21Å; P362-A381 WeakPolarHBondContact O-CB 3.05Å
363	C	59.2	Low	64.3	Low	8 Å²	8	75 Å²	75	5%	0.054	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-10.8	178.5	-79.7	0	0	0	0	113.6	S361 G365 A366 C374	S361-C363 PolarHBondContact O-N 3.16Å; S361-C363 PolarHBondContact OG-N 2.99Å; C363-G365 VanDerWaalsContact C-N 3.34Å; C363-G365 PolarHBondContact O-N 2.84Å; C363-A366 WeakPolarHBondContact O-CB 3.39Å; C363-A366 PolarHBondContact O-N 3.34Å; C363-C374 VanDerWaalsContact CA-SG 3.58Å; C363-C374 HydrophobicContact CB-CB 3.64Å; C363-C374 WeakPolarHBondContact CB-SG 3.3Å; C363-C374 WeakPolarHBondContact SG-CB 3.5Å; C363-C374 CovalentContact SG-SG 2.03Å; C363-C374 PolarHBondContact SG-SG 2.82Å
364	R	57.1	Low	63.7	Low	146 Å²	146	67.4 Å²	67.4	55%	0.551	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	85.5	178.7	-167.4	171.8	-175.4	164.4	1.6	110.1	P360 S361	P360-R364 HydrophobicContact CB-CB 4.43Å; S361-R364 WeakPolarHBondContact O-CB 3.28Å; S361-R364 PolarHBondContact O-N 3.33Å; S361-R364 PolarHBondContact OG-N 3.01Å
365	G	54.8	Low	63.1	Low	78 Å²	78	68.5 Å²	68.5	80%	0.804	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	121.6	-4.2	-172	0	0	0	0	0	114.4	C363 Q367	C363-G365 VanDerWaalsContact C-N 3.34Å; C363-G365 PolarHBondContact O-N 2.84Å; G365-Q367 PolarHBondContact O-N 2.79Å
366	A	58.2	Low	62	Low	39 Å²	39	68.5 Å²	68.5	32%	0.322	41%	0.412	S	S	.	.			trans	-84.1	100.5	176.5	0	0	0	0	0	111	C363 C368 A381	C363-A366 WeakPolarHBondContact O-CB 3.39Å; C363-A366 PolarHBondContact O-N 3.34Å; A366-C368 PolarHBondContact O-N 2.68Å; A366-A381 HydrophobicContact CB-CB 4.41Å
367	Q	57.3	Low	60.7	Low	196 Å²	196	72.6 Å²	72.6	92%	0.916	43%	0.428	S	S	*	.			trans	-77.1	101.1	173.9	-69.5	-177.4	-7.1	0	0	110.7	G365	G365-Q367 PolarHBondContact O-N 2.79Å
368	C	68.2	Low	59.9	Low	30 Å²	30	74.2 Å²	74.2	20%	0.203	44%	0.436	C	S	.	.			trans	-82.1	127.8	171.3	-64.6	0	0	0	0	110.4	A366 A372 C374 C383	A366-C368 PolarHBondContact O-N 2.68Å; C368-A372 HydrophobicContact CB-CB 3.95Å; C368-A372 WeakPolarHBondContact CB-O 3.38Å; C368-C374 VanDerWaalsContact SG-CB 3.52Å; C368-C383 WeakPolarHBondContact CA-SG 3.47Å; C368-C383 HydrophobicContact CB-CB 3.76Å; C368-C383 WeakPolarHBondContact CB-SG 3.31Å; C368-C383 VanDerWaalsContact SG-CA 3.57Å; C368-C383 WeakPolarHBondContact SG-CB 3.23Å; C368-C383 CovalentContact SG-SG 2.04Å; C368-C383 PolarHBondContact SG-SG 2.86Å
369	A	64.4	Low	59.6	Low	59 Å²	59	71.9 Å²	71.9	49%	0.488	44%	0.441	S	S	.	.	S	Bend	trans	-80.2	161	-178.1	0	0	0	0	0	112.8	G371 A372	A369-G371 PolarHBondContact O-N 3.19Å; A369-G371 VanDerWaalsContact O-N 3.1Å; A369-A372 PolarHBondContact O-N 3.31Å; A369-A372 VanDerWaalsContact O-N 3.13Å
370	F	70.6	Confident	59.9	Low	103 Å²	103	73.7 Å²	73.7	45%	0.452	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	22.8	168.4	-44.6	-67	0	0	0	116.4	C415 G418 R419	F370-C415 WeakPolarHBondContact O-CA 3.24Å; F370-C415 VanDerWaalsContact O-CB 3.23Å; F370-C415 WeakPolarHBondContact O-CB 3.3Å; F370-C415 PolarHBondContact O-N 3.03Å; F370-C415 VanDerWaalsContact O-N 3.13Å; F370-G418 WeakPolarHBondContact CZ-O 3.33Å; F370-R419 VanDerWaalsContact CD1-C 3.44Å
371	G	59.3	Low	60	Low	52 Å²	52	71.4 Å²	71.4	54%	0.536	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	15.4	-178.9	0	0	0	0	0	114.9	A369	A369-G371 PolarHBondContact O-N 3.19Å; A369-G371 VanDerWaalsContact O-N 3.1Å
372	A	67.6	Low	61.2	Low	19 Å²	19	73.6 Å²	73.6	16%	0.157	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-69.6	142	166.8	0	0	0	0	0	111.2	C368 A369 C383 C415	C368-A372 HydrophobicContact CB-CB 3.95Å; C368-A372 WeakPolarHBondContact CB-O 3.38Å; A369-A372 PolarHBondContact O-N 3.31Å; A369-A372 VanDerWaalsContact O-N 3.13Å; A372-C383 HydrophobicContact CB-CB 4.04Å; A372-C415 WeakPolarHBondContact CA-SG 3.39Å; A372-C415 WeakPolarHBondContact CB-SG 3.15Å; A372-C415 PolarHBondContact N-SG 3.32Å; A372-C415 VanDerWaalsContact N-SG 3.42Å
373	T	62	Low	61.8	Low	72 Å²	72	73.6 Å²	73.6	44%	0.442	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	135.2	176.6	-60.6	0	0	0	0	109.9	T375 C383 E384	T373-T375 PolarHBondContact O-N 2.87Å; T373-C383 WeakPolarHBondContact O-CA 3.33Å; T373-E384 PolarHBondContact N-O 2.88Å; T373-E384 PolarHBondContact O-N 3.46Å
374	C	67.1	Low	62.4	Low	16 Å²	16	77 Å²	77	11%	0.108	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	116.1	176	-163.2	0	0	0	0	110.9	Q201 C363 C368	Q201-C374 PolarHBondContact NE2-O 3.33Å; Q201-C374 VanDerWaalsContact NE2-O 3.14Å; C363-C374 VanDerWaalsContact CA-SG 3.58Å; C363-C374 HydrophobicContact CB-CB 3.64Å; C363-C374 WeakPolarHBondContact CB-SG 3.3Å; C363-C374 WeakPolarHBondContact SG-CB 3.5Å; C363-C374 CovalentContact SG-SG 2.03Å; C363-C374 PolarHBondContact SG-SG 2.82Å; C368-C374 VanDerWaalsContact SG-CB 3.52Å
375	T	70.1	Confident	63.3	Low	42 Å²	42	71.8 Å²	71.8	26%	0.258	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	154.3	175.5	67.6	0	0	0	0	110.5	T373 A381 V382	T373-T375 PolarHBondContact O-N 2.87Å; T375-A381 CarbonylContact O-C 3.49Å; T375-V382 PolarHBondContact N-O 3.1Å; T375-V382 PolarHBondContact O-N 3.15Å; T375-V382 PolarHBondContact OG1-O 3.08Å; T375-V382 VanDerWaalsContact OG1-O 3.05Å
376	V	62.1	Low	63.8	Low	42 Å²	42	72.3 Å²	72.3	26%	0.255	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	111.6	176.7	-177.3	0	0	0	0	109.4	F150 P362 K380	F150-V376 HydrophobicContact CE2-CG2 4.36Å; P362-V376 HydrophobicContact CG-CG1 4.16Å; P362-V376 HydrophobicContact CG-CG2 4.38Å; V376-K380 CarbonylContact C-O 3.31Å; V376-K380 WeakPolarHBondContact CA-O 3.4Å
377	K	52.2	Low	64.1	Low	100 Å²	100	80.1 Å²	80.1	44%	0.435	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.9	173.7	-67.3	-174.7	-177.5	176.7	0	109.6	G379 K380 V382 E384	K377-G379 PolarHBondContact O-N 2.93Å; K377-K380 PolarHBondContact N-O 3.28Å; K377-K380 PolarHBondContact O-N 3.02Å; K377-V382 HydrophobicContact CB-CG2 4.19Å; K377-E384 WeakPolarHBondContact CE-OE1 3.28Å; K377-E384 WeakPolarHBondContact CE-OE2 3.47Å; K377-E384 IonicContact NZ-OE1 3.05Å; K377-E384 PolarHBondContact NZ-OE1 3.14Å; K377-E384 IonicContact NZ-OE2 2.95Å; K377-E384 PolarHBondContact NZ-OE2 2.04Å
378	N	49.9	Very low	64.4	Low	170 Å²	170	73.9 Å²	73.9	91%	0.909	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	42.9	-178.3	-57.8	-22.9	0	0	0	113.4	K380	N378-K380 VanDerWaalsContact C-N 3.3Å; N378-K380 PolarHBondContact O-N 3.02Å
379	G	53.1	Low	64.6	Low	59 Å²	59	74.2 Å²	74.2	61%	0.608	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	10.9	-179.9	0	0	0	0	0	115.6	P362 K377	P362-G379 WeakPolarHBondContact CG-O 3.26Å; K377-G379 PolarHBondContact O-N 2.93Å
380	K	55.9	Low	64.5	Low	152 Å²	152	77 Å²	77	66%	0.661	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122	144.7	178.6	-64.2	-178.2	-179.8	179.9	0	111.6	V376 K377 N378	V376-K380 CarbonylContact C-O 3.31Å; V376-K380 WeakPolarHBondContact CA-O 3.4Å; K377-K380 PolarHBondContact N-O 3.28Å; K377-K380 PolarHBondContact O-N 3.02Å; N378-K380 VanDerWaalsContact C-N 3.3Å; N378-K380 PolarHBondContact O-N 3.02Å
381	A	59.4	Low	63.6	Low	43 Å²	43	75.1 Å²	75.1	36%	0.355	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	132.3	170.5	0	0	0	0	0	111.5	P362 A366 T375	P362-A381 HydrophobicContact CB-CB 4.21Å; P362-A381 WeakPolarHBondContact O-CB 3.05Å; A366-A381 HydrophobicContact CB-CB 4.41Å; T375-A381 CarbonylContact O-C 3.49Å
382	V	76.1	Confident	63.5	Low	53 Å²	53	75 Å²	75	32%	0.321	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	115	176	-172.9	0	0	0	0	108.3	T375 K377 E384	T375-V382 PolarHBondContact N-O 3.1Å; T375-V382 PolarHBondContact O-N 3.15Å; T375-V382 PolarHBondContact OG1-O 3.08Å; T375-V382 VanDerWaalsContact OG1-O 3.05Å; K377-V382 HydrophobicContact CB-CG2 4.19Å; V382-E384 HydrophobicContact CG1-CG 3.86Å; V382-E384 PolarHBondContact O-N 3.04Å
383	C	73.1	Confident	63.6	Low	66 Å²	66	82.2 Å²	82.2	45%	0.446	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	120.6	171.6	-61.5	0	0	0	0	109.8	C368 A372 T373	C368-C383 WeakPolarHBondContact CA-SG 3.47Å; C368-C383 HydrophobicContact CB-CB 3.76Å; C368-C383 WeakPolarHBondContact CB-SG 3.31Å; C368-C383 VanDerWaalsContact SG-CA 3.57Å; C368-C383 WeakPolarHBondContact SG-CB 3.23Å; C368-C383 CovalentContact SG-SG 2.04Å; C368-C383 PolarHBondContact SG-SG 2.86Å; A372-C383 HydrophobicContact CB-CB 4.04Å; T373-C383 WeakPolarHBondContact O-CA 3.33Å
384	E	72.3	Confident	64.1	Low	79 Å²	79	84.4 Å²	84.4	37%	0.369	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	141.4	176.3	-61.7	-166.7	163.2	0	0	111	T373 K377 V382	T373-E384 PolarHBondContact N-O 2.88Å; T373-E384 PolarHBondContact O-N 3.46Å; K377-E384 WeakPolarHBondContact CE-OE1 3.28Å; K377-E384 WeakPolarHBondContact CE-OE2 3.47Å; K377-E384 IonicContact NZ-OE1 3.05Å; K377-E384 PolarHBondContact NZ-OE1 3.14Å; K377-E384 IonicContact NZ-OE2 2.95Å; K377-E384 PolarHBondContact NZ-OE2 2.04Å; V382-E384 HydrophobicContact CG1-CG 3.86Å; V382-E384 PolarHBondContact O-N 3.04Å
385	C	75.9	Confident	64.8	Low	38 Å²	38	84.8 Å²	84.8	26%	0.257	48%	0.483	S	S	.	.			trans	-75.7	131.2	175.8	-62.3	0	0	0	0	110.5	R387 C415 T416	C385-R387 VanDerWaalsContact O-CG 3.3Å; C385-R387 WeakPolarHBondContact O-CG 3.47Å; C385-R387 PolarHBondContact O-N 2.8Å; C385-R387 VanDerWaalsContact O-N 3.1Å; C385-C415 WeakPolarHBondContact CA-SG 3.43Å; C385-C415 HydrophobicContact CB-CB 3.8Å; C385-C415 WeakPolarHBondContact CB-SG 3.36Å; C385-C415 WeakPolarHBondContact SG-CB 3.32Å; C385-C415 CovalentContact SG-SG 2.03Å; C385-C415 PolarHBondContact SG-SG 2.93Å; C385-T416 HydrophobicContact CB-CG2 3.9Å
386	Q	66.2	Low	65.4	Low	88 Å²	88	83 Å²	83	41%	0.411	47%	0.472	S	S	.	.			trans	-69.4	106.1	173.1	-179.3	168.2	-19.2	0	0	110	V388 S412	Q386-V388 PolarHBondContact NE2-O 2.03Å; Q386-S412 WeakPolarHBondContact O-CB 3.24Å; Q386-S412 PolarHBondContact O-OG 3.11Å; Q386-S412 VanDerWaalsContact O-OG 3.05Å
387	R	62.9	Low	66.5	Low	204 Å²	204	81.8 Å²	81.8	77%	0.77	47%	0.465	S	S	*	.			trans	-92.5	3.7	-174.6	-51	-166.9	72.1	-164.2	0.7	114.9	C385	C385-R387 VanDerWaalsContact O-CG 3.3Å; C385-R387 WeakPolarHBondContact O-CG 3.47Å; C385-R387 PolarHBondContact O-N 2.8Å; C385-R387 VanDerWaalsContact O-N 3.1Å
388	V	63.6	Low	67.9	Low	65 Å²	65	77.1 Å²	77.1	39%	0.394	45%	0.445	S	S	.	.			trans	-129.4	117.5	-177.1	-176.6	0	0	0	0	108.9	Q386	Q386-V388 PolarHBondContact NE2-O 2.03Å
389	C	72.2	Confident	69.2	Low	36 Å²	36	72.5 Å²	72.5	24%	0.243	43%	0.426	C	S	.	.			trans	-110.7	101.4	177.8	-66.7	0	0	0	0	109.5	G391 C408 E409	C389-G391 PolarHBondContact O-N 3.01Å; C389-C408 WeakPolarHBondContact CA-SG 3.3Å; C389-C408 HydrophobicContact CB-CB 3.71Å; C389-C408 WeakPolarHBondContact CB-SG 3.47Å; C389-C408 WeakPolarHBondContact SG-CB 3.49Å; C389-C408 PolarHBondContact SG-O 3.09Å; C389-C408 VanDerWaalsContact SG-O 3.38Å; C389-C408 CovalentContact SG-SG 2.04Å; C389-C408 PolarHBondContact SG-SG 2.91Å; C389-E409 HydrophobicContact CB-CG 4.37Å; C389-E409 PolarHBondContact SG-N 3.13Å
390	S	63.2	Low	70.5	Confident	119 Å²	119	73.4 Å²	73.4	83%	0.832	42%	0.417	S	S	*	.			trans	-86.9	79.2	177.5	-57.2	0	0	0	0	110
391	G	51.4	Low	71.5	Confident	62 Å²	62	68.6 Å²	68.6	64%	0.639	41%	0.41	S	S	*	.			trans	-148.1	164.1	-177.9	0	0	0	0	0	112.9	C389	C389-G391 PolarHBondContact O-N 3.01Å
392	G	58.3	Low	72.4	Confident	50 Å²	50	69.7 Å²	69.7	52%	0.515	41%	0.412	S	S	.	.			trans	-70.6	169.1	170.6	0	0	0	0	0	112.1	D394	G392-D394 VanDerWaalsContact C-N 3.28Å; G392-D394 PolarHBondContact O-N 3.22Å
393	Y	68.2	Low	72.6	Confident	170 Å²	170	69.8 Å²	69.8	67%	0.667	41%	0.413	S	S	*	.			trans	-76.1	82.4	173.5	-175.8	-104.6	0	0	0	109.9	P395	Y393-P395 HydrophobicContact CD1-CG 4.23Å; Y393-P395 HydrophobicContact CE1-CB 4.16Å; Y393-P395 HydrophobicContact CE1-CG 3.75Å; Y393-P395 HydrophobicContact CE2-CB 4.36Å; Y393-P395 WeakPolarHBondContact O-CD 3.05Å
394	D	74.1	Confident	73.1	Confident	119 Å²	119	67.2 Å²	67.2	64%	0.636	39%	0.394	S	S	*	.			trans	-105.1	75.3	173.7	-73.8	-39.5	0	0	0	108.8	G392 G405	G392-D394 VanDerWaalsContact C-N 3.28Å; G392-D394 PolarHBondContact O-N 3.22Å; D394-G405 CarbonylContact C-O 3.5Å; D394-G405 VanDerWaalsContact C-O 3.29Å; D394-G405 PolarHBondContact N-O 3.39Å
395	P	79.9	Confident	73.3	Confident	24 Å²	24	63.7 Å²	63.7	16%	0.156	38%	0.379	C	S	.	.			trans	-62.7	143.3	-167.2	24.7	-35.7	0	0	0	112.2	Y393 T403 Y404 G427 P428	Y393-P395 HydrophobicContact CD1-CG 4.23Å; Y393-P395 HydrophobicContact CE1-CB 4.16Å; Y393-P395 HydrophobicContact CE1-CG 3.75Å; Y393-P395 HydrophobicContact CE2-CB 4.36Å; Y393-P395 WeakPolarHBondContact O-CD 3.05Å; P395-T403 HydrophobicContact CB-CG2 4.08Å; P395-Y404 CarbonylContact C-O 3.56Å; P395-Y404 WeakPolarHBondContact CA-O 3.39Å; P395-G427 CarbonylContact O-C 3.26Å; P395-G427 WeakPolarHBondContact O-CA 3.36Å; P395-G427 PolarHBondContact O-N 3.1Å; P395-P428 HydrophobicContact CB-CB 4.46Å
396	V	84.1	Confident	73.7	Confident	4 Å²	4	62.6 Å²	62.6	2%	0.024	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	143.5	174.7	-63	0	0	0	0	111.1	Y404 V407 L410 V423 G427	V396-Y404 PolarHBondContact N-O 3.36Å; V396-Y404 PolarHBondContact O-N 3.25Å; V396-V407 HydrophobicContact CG1-CG2 3.79Å; V396-V407 HydrophobicContact CG2-CG2 4.29Å; V396-L410 HydrophobicContact CG2-CB 4.33Å; V396-L410 HydrophobicContact CG2-CD1 3.95Å; V396-V423 HydrophobicContact CB-CG1 4.26Å; V396-V423 HydrophobicContact CB-CG2 4.47Å; V396-V423 HydrophobicContact CG1-CG1 4.45Å; V396-V423 HydrophobicContact CG2-CG2 4.34Å; V396-G427 CarbonylContact C-O 3.59Å; V396-G427 WeakPolarHBondContact CA-O 3.07Å
397	C	84.3	Confident	74.4	Confident	17 Å²	17	60.8 Å²	60.8	12%	0.115	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	122.5	174.4	-174.7	0	0	0	0	109.7	A424 R425 G427 C429	C397-A424 PolarHBondContact O-N 3.01Å; C397-R425 HydrophobicContact CB-CB 4.06Å; C397-R425 PolarHBondContact N-O 2.03Å; C397-R425 PolarHBondContact O-N 3.42Å; C397-G427 PolarHBondContact N-O 2.91Å; C397-C429 WeakPolarHBondContact CA-SG 3.23Å; C397-C429 HydrophobicContact CB-CB 3.97Å; C397-C429 WeakPolarHBondContact CB-SG 3.49Å; C397-C429 WeakPolarHBondContact SG-CA 3.13Å; C397-C429 WeakPolarHBondContact SG-CB 3.04Å; C397-C429 CovalentContact SG-SG 2.03Å; C397-C429 PolarHBondContact SG-SG 3.03Å
398	G	81.6	Confident	75.3	Confident	2 Å²	2	52.9 Å²	52.9	2%	0.021	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	161.2	176	0	0	0	0	0	113.6	D400 G401 V402 R422	G398-D400 PolarHBondContact O-N 3.02Å; G398-D400 VanDerWaalsContact O-N 3.16Å; G398-G401 PolarHBondContact O-N 2.94Å; G398-V402 PolarHBondContact N-O 2.95Å; G398-R422 CarbonylContact C-O 3.6Å; G398-R422 WeakPolarHBondContact CA-O 3.04Å
399	S	78.4	Confident	76.1	Confident	73 Å²	73	54 Å²	54	51%	0.51	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-10	174.4	58	0	0	0	0	114.1	R422	S399-R422 WeakPolarHBondContact CB-O 3.03Å; S399-R422 PolarHBondContact N-O 2.96Å; S399-R422 PolarHBondContact OG-N 3.47Å; S399-R422 PolarHBondContact OG-O 2.88Å
400	D	78.9	Confident	76.8	Confident	78 Å²	78	52.4 Å²	52.4	42%	0.417	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-4	171.2	68.3	-25.1	0	0	0	113.4	G398 V402 Y404	G398-D400 PolarHBondContact O-N 3.02Å; G398-D400 VanDerWaalsContact O-N 3.16Å; D400-V402 PolarHBondContact OD1-N 3.42Å; D400-V402 VanDerWaalsContact OD1-N 3.14Å; D400-V402 VanDerWaalsContact OD2-CG2 3.24Å; D400-V402 WeakPolarHBondContact OD2-CG2 3.49Å; D400-Y404 PolarHBondContact OD2-OH 2.9Å
401	G	77.1	Confident	77.5	Confident	50 Å²	50	51.9 Å²	51.9	52%	0.515	32%	0.316	S	S	.	.	S	Bend	trans	82.6	15.7	-177.7	0	0	0	0	0	114.5	G398 C429	G398-G401 PolarHBondContact O-N 2.94Å; G401-C429 PolarHBondContact O-SG 3.23Å; G401-C429 VanDerWaalsContact O-SG 3.32Å
402	V	79.4	Confident	78.8	Confident	66 Å²	66	50 Å²	50	40%	0.4	29%	0.294	S	S	.	.			trans	-99.1	136.7	177.4	177.9	0	0	0	0	111.1	G398 D400 Y404 C429	G398-V402 PolarHBondContact N-O 2.95Å; D400-V402 PolarHBondContact OD1-N 3.42Å; D400-V402 VanDerWaalsContact OD1-N 3.14Å; D400-V402 VanDerWaalsContact OD2-CG2 3.24Å; D400-V402 WeakPolarHBondContact OD2-CG2 3.49Å; V402-Y404 HydrophobicContact CB-CE2 3.92Å; V402-Y404 HydrophobicContact CG1-CE1 4.32Å; V402-Y404 HydrophobicContact CG1-CE2 4.07Å; V402-Y404 WeakPolarHBondContact O-CD2 2.99Å; V402-Y404 WeakPolarHBondContact O-CE2 3.35Å; V402-C429 PolarHBondContact O-SG 3.43Å; V402-C429 VanDerWaalsContact O-SG 3.37Å
403	T	80.3	Confident	79.9	Confident	55 Å²	55	51.3 Å²	51.3	34%	0.337	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	125.5	168.8	-59.2	0	0	0	0	110.1	P395 P428 C429	P395-T403 HydrophobicContact CB-CG2 4.08Å; T403-P428 HydrophobicContact CG2-CB 3.74Å; T403-C429 PolarHBondContact OG1-N 2.64Å
404	Y	83.1	Confident	80.5	Confident	13 Å²	13	43.5 Å²	43.5	5%	0.051	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	147.6	168.4	-61.9	-84.3	0	0	0	109.5	P395 V396 D400 V402 S406 E409 L410 M413 I421	P395-Y404 CarbonylContact C-O 3.56Å; P395-Y404 WeakPolarHBondContact CA-O 3.39Å; V396-Y404 PolarHBondContact N-O 3.36Å; V396-Y404 PolarHBondContact O-N 3.25Å; D400-Y404 PolarHBondContact OD2-OH 2.9Å; V402-Y404 HydrophobicContact CB-CE2 3.92Å; V402-Y404 HydrophobicContact CG1-CE1 4.32Å; V402-Y404 HydrophobicContact CG1-CE2 4.07Å; V402-Y404 WeakPolarHBondContact O-CD2 2.99Å; V402-Y404 WeakPolarHBondContact O-CE2 3.35Å; Y404-S406 PolarHBondContact O-N 3.18Å; Y404-E409 HydrophobicContact CD1-CB 4.36Å; Y404-L410 HydrophobicContact CD1-CB 4.12Å; Y404-L410 HydrophobicContact CD2-CB 3.65Å; Y404-L410 HydrophobicContact CD2-CD1 3.72Å; Y404-L410 HydrophobicContact CD2-CG 3.65Å; Y404-L410 HydrophobicContact CE2-CB 4.17Å; Y404-L410 HydrophobicContact CE2-CD1 4.07Å; Y404-L410 HydrophobicContact CE2-CG 3.79Å; Y404-L410 HydrophobicContact CG-CB 3.6Å; Y404-L410 HydrophobicContact CG-CD1 4.47Å; Y404-L410 HydrophobicContact CG-CG 4.14Å; Y404-M413 HydrophobicContact CD1-CB 4.34Å; Y404-M413 HydrophobicContact CE1-CB 3.52Å; Y404-M413 HydrophobicContact CE1-CG 3.79Å; Y404-I421 HydrophobicContact CE2-CG2 4.34Å; Y404-I421 WeakPolarHBondContact OH-CD1 3.18Å
405	G	76.4	Confident	80.8	Confident	5 Å²	5	38.4 Å²	38.4	5%	0.052	23%	0.231	C	C	.	.	S	Bend	trans	-72.1	-17.1	179.6	0	0	0	0	0	114.2	D394 E409	D394-G405 CarbonylContact C-O 3.5Å; D394-G405 VanDerWaalsContact C-O 3.29Å; D394-G405 PolarHBondContact N-O 3.39Å; G405-E409 VanDerWaalsContact CA-OE2 3.3Å; G405-E409 WeakPolarHBondContact CA-OE2 3.41Å; G405-E409 PolarHBondContact N-OE2 3.11Å
406	S	83.6	Confident	80.8	Confident	14 Å²	14	40.5 Å²	40.5	10%	0.098	24%	0.244	C	C	.	.	S	Bend	trans	-158	168.5	171.5	63.9	0	0	0	0	111.1	Y404 C408 E409 L410	Y404-S406 PolarHBondContact O-N 3.18Å; S406-C408 PolarHBondContact O-N 3.06Å; S406-E409 PolarHBondContact O-N 3.44Å; S406-E409 PolarHBondContact OG-N 2.04Å; S406-L410 PolarHBondContact O-N 3.4Å
407	V	81.4	Confident	80.5	Confident	51 Å²	51	44.8 Å²	44.8	31%	0.309	27%	0.266	S	S	.	.	H	α-helix	trans	-59	-38.4	170.9	-179.3	0	0	0	0	111.3	V396 E409 L410 E411 V423	V396-V407 HydrophobicContact CG1-CG2 3.79Å; V396-V407 HydrophobicContact CG2-CG2 4.29Å; V407-E409 VanDerWaalsContact C-N 3.33Å; V407-E409 PolarHBondContact O-N 3.1Å; V407-L410 WeakPolarHBondContact O-CB 3.04Å; V407-L410 PolarHBondContact O-N 3.44Å; V407-E411 HydrophobicContact CG1-CG 4.42Å; V407-E411 WeakPolarHBondContact O-CG 3.11Å; V407-E411 PolarHBondContact O-N 3.44Å; V407-V423 HydrophobicContact CG1-CG2 4.19Å; V407-V423 HydrophobicContact CG2-CG2 4.16Å
408	C	81.2	Confident	80.2	Confident	38 Å²	38	45.7 Å²	45.7	26%	0.257	28%	0.278	S	S	.	.	H	α-helix	trans	-61.6	-38.5	176.2	175.5	0	0	0	0	112.3	C389 S406 E411 S412	C389-C408 WeakPolarHBondContact CA-SG 3.3Å; C389-C408 HydrophobicContact CB-CB 3.71Å; C389-C408 WeakPolarHBondContact CB-SG 3.47Å; C389-C408 WeakPolarHBondContact SG-CB 3.49Å; C389-C408 PolarHBondContact SG-O 3.09Å; C389-C408 VanDerWaalsContact SG-O 3.38Å; C389-C408 CovalentContact SG-SG 2.04Å; C389-C408 PolarHBondContact SG-SG 2.91Å; S406-C408 PolarHBondContact O-N 3.06Å; C408-E411 PolarHBondContact O-N 3.34Å; C408-S412 VanDerWaalsContact O-CB 3.26Å; C408-S412 WeakPolarHBondContact O-CB 3.45Å; C408-S412 PolarHBondContact O-N 3.45Å
409	E	81.2	Confident	80	Confident	88 Å²	88	53.6 Å²	53.6	41%	0.411	31%	0.308	S	S	.	.	H	α-helix	trans	-66.3	-37.7	175.7	-77.1	175.7	-145.2	0	0	112.3	C389 Y404 G405 S406 V407 M413	C389-E409 HydrophobicContact CB-CG 4.37Å; C389-E409 PolarHBondContact SG-N 3.13Å; Y404-E409 HydrophobicContact CD1-CB 4.36Å; G405-E409 VanDerWaalsContact CA-OE2 3.3Å; G405-E409 WeakPolarHBondContact CA-OE2 3.41Å; G405-E409 PolarHBondContact N-OE2 3.11Å; S406-E409 PolarHBondContact O-N 3.44Å; S406-E409 PolarHBondContact OG-N 2.04Å; V407-E409 VanDerWaalsContact C-N 3.33Å; V407-E409 PolarHBondContact O-N 3.1Å; E409-M413 WeakPolarHBondContact O-CB 3.48Å; E409-M413 PolarHBondContact O-N 2.93Å
410	L	85.9	Confident	79.7	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.01	31%	0.312	C	S	.	.	H	α-helix	trans	-62.5	-48.4	174.8	-175.2	161.1	0	0	0	110.6	V396 Y404 S406 V407 M413 A414 I421 V423	V396-L410 HydrophobicContact CG2-CB 4.33Å; V396-L410 HydrophobicContact CG2-CD1 3.95Å; Y404-L410 HydrophobicContact CD1-CB 4.12Å; Y404-L410 HydrophobicContact CD2-CB 3.65Å; Y404-L410 HydrophobicContact CD2-CD1 3.72Å; Y404-L410 HydrophobicContact CD2-CG 3.65Å; Y404-L410 HydrophobicContact CE2-CB 4.17Å; Y404-L410 HydrophobicContact CE2-CD1 4.07Å; Y404-L410 HydrophobicContact CE2-CG 3.79Å; Y404-L410 HydrophobicContact CG-CB 3.6Å; Y404-L410 HydrophobicContact CG-CD1 4.47Å; Y404-L410 HydrophobicContact CG-CG 4.14Å; S406-L410 PolarHBondContact O-N 3.4Å; V407-L410 WeakPolarHBondContact O-CB 3.04Å; V407-L410 PolarHBondContact O-N 3.44Å; L410-M413 PolarHBondContact O-N 3.47Å; L410-A414 WeakPolarHBondContact O-CB 3.24Å; L410-A414 PolarHBondContact O-N 3.17Å; L410-I421 HydrophobicContact CD1-CG2 4.45Å; L410-I421 HydrophobicContact CD2-CB 4.11Å; L410-I421 HydrophobicContact CD2-CG2 4.01Å; L410-I421 WeakPolarHBondContact CD2-O 3.04Å; L410-I421 HydrophobicContact CG-CG2 4.06Å; L410-V423 HydrophobicContact CD1-CG2 3.9Å
411	E	78.7	Confident	79.7	Confident	108 Å²	108	53.5 Å²	53.5	51%	0.505	30%	0.297	S	S	.	.	H	α-helix	trans	-67.1	-39.4	179	-69.4	171.2	168	0	0	111.9	V407 C408 M413 A414 C415	V407-E411 HydrophobicContact CG1-CG 4.42Å; V407-E411 WeakPolarHBondContact O-CG 3.11Å; V407-E411 PolarHBondContact O-N 3.44Å; C408-E411 PolarHBondContact O-N 3.34Å; E411-M413 VanDerWaalsContact C-N 3.34Å; E411-M413 PolarHBondContact O-N 3.09Å; E411-A414 PolarHBondContact O-N 2.88Å; E411-C415 WeakPolarHBondContact O-CB 3.07Å; E411-C415 PolarHBondContact O-N 3.2Å
412	S	78.6	Confident	79.9	Confident	24 Å²	24	58.5 Å²	58.5	17%	0.168	30%	0.3	C	S	.	.	H	α-helix	trans	-63	-38.2	172.6	178.8	0	0	0	0	112.3	Q386 C408 T416	Q386-S412 WeakPolarHBondContact O-CB 3.24Å; Q386-S412 PolarHBondContact O-OG 3.11Å; Q386-S412 VanDerWaalsContact O-OG 3.05Å; C408-S412 VanDerWaalsContact O-CB 3.26Å; C408-S412 WeakPolarHBondContact O-CB 3.45Å; C408-S412 PolarHBondContact O-N 3.45Å; S412-T416 WeakPolarHBondContact O-CG2 3.22Å; S412-T416 PolarHBondContact O-N 2.94Å; S412-T416 PolarHBondContact O-OG1 3.27Å
413	M	80.4	Confident	79.9	Confident	77 Å²	77	58.5 Å²	58.5	38%	0.379	30%	0.3	S	S	.	.	H	α-helix	trans	-72.4	-42.1	176.2	-166.1	63.4	61.3	0	0	111.8	Y404 E409 L410 E411 C415 T416 L417	Y404-M413 HydrophobicContact CD1-CB 4.34Å; Y404-M413 HydrophobicContact CE1-CB 3.52Å; Y404-M413 HydrophobicContact CE1-CG 3.79Å; E409-M413 WeakPolarHBondContact O-CB 3.48Å; E409-M413 PolarHBondContact O-N 2.93Å; L410-M413 PolarHBondContact O-N 3.47Å; E411-M413 VanDerWaalsContact C-N 3.34Å; E411-M413 PolarHBondContact O-N 3.09Å; M413-C415 VanDerWaalsContact C-N 3.29Å; M413-C415 PolarHBondContact O-N 2.95Å; M413-T416 PolarHBondContact O-N 3.16Å; M413-T416 PolarHBondContact O-OG1 2.86Å; M413-L417 HydrophobicContact CG-CD1 3.7Å; M413-L417 HydrophobicContact CG-CG 4.11Å; M413-L417 VanDerWaalsContact O-CB 3.3Å; M413-L417 WeakPolarHBondContact O-CB 3.24Å; M413-L417 VanDerWaalsContact O-CG 3.3Å; M413-L417 WeakPolarHBondContact O-CG 3.39Å; M413-L417 PolarHBondContact O-N 3.43Å; M413-L417 HydrophobicContact SD-CD1 4Å; M413-L417 HydrophobicContact SD-CD2 4.48Å; M413-L417 HydrophobicContact SD-CG 3.99Å
414	A	81.2	Confident	79.7	Confident	5 Å²	5	59.1 Å²	59.1	4%	0.041	31%	0.311	C	S	.	.	H	α-helix	trans	-53.5	-48	172.3	0	0	0	0	0	111.2	L410 E411 G418 R419 I421	L410-A414 WeakPolarHBondContact O-CB 3.24Å; L410-A414 PolarHBondContact O-N 3.17Å; E411-A414 PolarHBondContact O-N 2.88Å; A414-G418 PolarHBondContact O-N 2.98Å; A414-R419 CarbonylContact C-O 3.2Å; A414-R419 WeakPolarHBondContact CA-O 2.98Å; A414-R419 VanDerWaalsContact CB-O 3.31Å; A414-R419 WeakPolarHBondContact CB-O 3.48Å; A414-R419 PolarHBondContact O-N 3.46Å; A414-I421 HydrophobicContact CB-CB 4.08Å; A414-I421 HydrophobicContact CB-CD1 4.42Å; A414-I421 HydrophobicContact CB-CG1 4.15Å
415	C	81.8	Confident	79.2	Confident	12 Å²	12	63 Å²	63	8%	0.081	33%	0.326	C	S	.	.	H	α-helix	trans	-61.1	-53.2	177.2	-170.8	0	0	0	0	112.4	F370 A372 C385 E411 M413 L417 G418	F370-C415 WeakPolarHBondContact O-CA 3.24Å; F370-C415 VanDerWaalsContact O-CB 3.23Å; F370-C415 WeakPolarHBondContact O-CB 3.3Å; F370-C415 PolarHBondContact O-N 3.03Å; F370-C415 VanDerWaalsContact O-N 3.13Å; A372-C415 WeakPolarHBondContact CA-SG 3.39Å; A372-C415 WeakPolarHBondContact CB-SG 3.15Å; A372-C415 PolarHBondContact N-SG 3.32Å; A372-C415 VanDerWaalsContact N-SG 3.42Å; C385-C415 WeakPolarHBondContact CA-SG 3.43Å; C385-C415 HydrophobicContact CB-CB 3.8Å; C385-C415 WeakPolarHBondContact CB-SG 3.36Å; C385-C415 WeakPolarHBondContact SG-CB 3.32Å; C385-C415 CovalentContact SG-SG 2.03Å; C385-C415 PolarHBondContact SG-SG 2.93Å; E411-C415 WeakPolarHBondContact O-CB 3.07Å; E411-C415 PolarHBondContact O-N 3.2Å; M413-C415 VanDerWaalsContact C-N 3.29Å; M413-C415 PolarHBondContact O-N 2.95Å; C415-L417 VanDerWaalsContact C-N 3.32Å; C415-L417 PolarHBondContact O-N 3.47Å; C415-G418 PolarHBondContact O-N 3.38Å; C415-G418 VanDerWaalsContact O-N 3.14Å
416	T	79.8	Confident	78.7	Confident	68 Å²	68	73 Å²	73	42%	0.417	36%	0.362	S	S	.	.	H	α-helix	trans	-70.9	-23.9	-176.1	50.5	0	0	0	0	114.2	C385 S412 M413	C385-T416 HydrophobicContact CB-CG2 3.9Å; S412-T416 WeakPolarHBondContact O-CG2 3.22Å; S412-T416 PolarHBondContact O-N 2.94Å; S412-T416 PolarHBondContact O-OG1 3.27Å; M413-T416 PolarHBondContact O-N 3.16Å; M413-T416 PolarHBondContact O-OG1 2.86Å
417	L	77.8	Confident	78	Confident	94 Å²	94	73.4 Å²	73.4	49%	0.492	37%	0.369	S	S	.	.	H	α-helix	trans	-87.9	-11.1	172.2	-65.1	-180	0	0	0	113.5	M413 C415 R419 I421	M413-L417 HydrophobicContact CG-CD1 3.7Å; M413-L417 HydrophobicContact CG-CG 4.11Å; M413-L417 VanDerWaalsContact O-CB 3.3Å; M413-L417 WeakPolarHBondContact O-CB 3.24Å; M413-L417 VanDerWaalsContact O-CG 3.3Å; M413-L417 WeakPolarHBondContact O-CG 3.39Å; M413-L417 PolarHBondContact O-N 3.43Å; M413-L417 HydrophobicContact SD-CD1 4Å; M413-L417 HydrophobicContact SD-CD2 4.48Å; M413-L417 HydrophobicContact SD-CG 3.99Å; C415-L417 VanDerWaalsContact C-N 3.32Å; C415-L417 PolarHBondContact O-N 3.47Å; L417-R419 HydrophobicContact CB-CB 4.5Å; L417-R419 HydrophobicContact CB-CG 4.42Å; L417-I421 HydrophobicContact CD1-CD1 4.43Å
418	G	76.5	Confident	77.6	Confident	36 Å²	36	74 Å²	74	37%	0.371	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	42.2	-174.9	0	0	0	0	0	112.8	F370 A414 C415	F370-G418 WeakPolarHBondContact CZ-O 3.33Å; A414-G418 PolarHBondContact O-N 2.98Å; C415-G418 PolarHBondContact O-N 3.38Å; C415-G418 VanDerWaalsContact O-N 3.14Å
419	R	77.8	Confident	77.1	Confident	169 Å²	169	73.5 Å²	73.5	64%	0.638	37%	0.37	S	S	*	.	S	Bend	trans	-137	146.2	-174.8	-69.2	-179.5	-177.5	-161.9	-1.4	111.1	F370 A414 L417 I421	F370-R419 VanDerWaalsContact CD1-C 3.44Å; A414-R419 CarbonylContact C-O 3.2Å; A414-R419 WeakPolarHBondContact CA-O 2.98Å; A414-R419 VanDerWaalsContact CB-O 3.31Å; A414-R419 WeakPolarHBondContact CB-O 3.48Å; A414-R419 PolarHBondContact O-N 3.46Å; L417-R419 HydrophobicContact CB-CB 4.5Å; L417-R419 HydrophobicContact CB-CG 4.42Å; R419-I421 PolarHBondContact O-N 2.89Å
420	E	73.1	Confident	76.4	Confident	129 Å²	129	73.2 Å²	73.2	60%	0.603	37%	0.371	S	S	*	.			trans	-77.5	114.1	169.6	-173.2	169.6	-150.6	0	0	110	R422	E420-R422 VanDerWaalsContact CD-NH2 3.31Å; E420-R422 HydrophobicContact CG-CG 4.19Å; E420-R422 IonicContact OE1-CZ 2.8Å; E420-R422 IonicContact OE1-NE 3.88Å; E420-R422 PolarHBondContact OE1-NE 3.37Å; E420-R422 IonicContact OE1-NH2 3.65Å; E420-R422 PolarHBondContact OE1-NH2 3.34Å; E420-R422 IonicContact OE2-NE 3.62Å; E420-R422 IonicContact OE2-NH2 3.89Å; E420-R422 PolarHBondContact OE2-NH2 2.01Å
421	I	78.7	Confident	75	Confident	19 Å²	19	85.4 Å²	85.4	10%	0.097	42%	0.417	C	S	.	.			trans	-122.1	132.4	170.4	-47.8	178.9	0	0	0	105.6	Y404 L410 A414 L417 R419	Y404-I421 HydrophobicContact CE2-CG2 4.34Å; Y404-I421 WeakPolarHBondContact OH-CD1 3.18Å; L410-I421 HydrophobicContact CD1-CG2 4.45Å; L410-I421 HydrophobicContact CD2-CB 4.11Å; L410-I421 HydrophobicContact CD2-CG2 4.01Å; L410-I421 WeakPolarHBondContact CD2-O 3.04Å; L410-I421 HydrophobicContact CG-CG2 4.06Å; A414-I421 HydrophobicContact CB-CB 4.08Å; A414-I421 HydrophobicContact CB-CD1 4.42Å; A414-I421 HydrophobicContact CB-CG1 4.15Å; L417-I421 HydrophobicContact CD1-CD1 4.43Å; R419-I421 PolarHBondContact O-N 2.89Å
422	R	80	Confident	73.9	Confident	156 Å²	156	81.4 Å²	81.4	59%	0.589	40%	0.401	S	S	*	.			trans	-121.1	155.8	-179.9	-60.3	-176.2	-176	170.5	3.5	109.9	G398 S399 E420 A424	G398-R422 CarbonylContact C-O 3.6Å; G398-R422 WeakPolarHBondContact CA-O 3.04Å; S399-R422 WeakPolarHBondContact CB-O 3.03Å; S399-R422 PolarHBondContact N-O 2.96Å; S399-R422 PolarHBondContact OG-N 3.47Å; S399-R422 PolarHBondContact OG-O 2.88Å; E420-R422 VanDerWaalsContact CD-NH2 3.31Å; E420-R422 HydrophobicContact CG-CG 4.19Å; E420-R422 IonicContact OE1-CZ 2.8Å; E420-R422 IonicContact OE1-NE 3.88Å; E420-R422 PolarHBondContact OE1-NE 3.37Å; E420-R422 IonicContact OE1-NH2 3.65Å; E420-R422 PolarHBondContact OE1-NH2 3.34Å; E420-R422 IonicContact OE2-NE 3.62Å; E420-R422 IonicContact OE2-NH2 3.89Å; E420-R422 PolarHBondContact OE2-NH2 2.01Å; R422-A424 PolarHBondContact O-N 3.13Å
423	V	79.6	Confident	72.7	Confident	65 Å²	65	83.7 Å²	83.7	39%	0.394	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	119.2	171.9	177.4	0	0	0	0	109.3	V396 V407 L410	V396-V423 HydrophobicContact CB-CG1 4.26Å; V396-V423 HydrophobicContact CB-CG2 4.47Å; V396-V423 HydrophobicContact CG1-CG1 4.45Å; V396-V423 HydrophobicContact CG2-CG2 4.34Å; V407-V423 HydrophobicContact CG1-CG2 4.19Å; V407-V423 HydrophobicContact CG2-CG2 4.16Å; L410-V423 HydrophobicContact CD1-CG2 3.9Å
424	A	75.9	Confident	71.5	Confident	69 Å²	69	86.4 Å²	86.4	57%	0.57	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	-31	173.6	0	0	0	0	0	112.4	C397 R422	C397-A424 PolarHBondContact O-N 3.01Å; R422-A424 PolarHBondContact O-N 3.13Å
425	R	73	Confident	70.5	Confident	95 Å²	95	87.9 Å²	87.9	36%	0.358	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	147.6	178.4	166.2	174.9	-57.6	158.9	11.5	110.9	C397 D430	C397-R425 HydrophobicContact CB-CB 4.06Å; C397-R425 PolarHBondContact N-O 2.03Å; C397-R425 PolarHBondContact O-N 3.42Å; R425-D430 IonicContact CZ-OD2 3.71Å; R425-D430 IonicContact NH1-OD2 3.46Å; R425-D430 PolarHBondContact NH1-OD2 3.13Å
426	R	65.7	Low	69.4	Low	213 Å²	213	95.7 Å²	95.7	80%	0.804	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	138.1	163.6	-67	-180	-178.8	-99.9	2.9	109.5
427	G	69.3	Low	68.6	Low	24 Å²	24	95.8 Å²	95.8	25%	0.247	47%	0.472	C	S	.	.	B	Isolated β-bridge	trans	96.9	163.6	-161.4	0	0	0	0	0	111.7	P395 V396 C397	P395-G427 CarbonylContact O-C 3.26Å; P395-G427 WeakPolarHBondContact O-CA 3.36Å; P395-G427 PolarHBondContact O-N 3.1Å; V396-G427 CarbonylContact C-O 3.59Å; V396-G427 WeakPolarHBondContact CA-O 3.07Å; C397-G427 PolarHBondContact N-O 2.91Å
428	P	73.1	Confident	67.6	Low	62 Å²	62	93.6 Å²	93.6	40%	0.403	47%	0.472	S	S	.	.			trans	-64.5	159.5	177.5	30.7	-36.6	0	0	0	111.8	P395 T403 D430	P395-P428 HydrophobicContact CB-CB 4.46Å; T403-P428 HydrophobicContact CG2-CB 3.74Å; P428-D430 PolarHBondContact O-N 3.05Å
429	C	71.7	Confident	67.2	Low	28 Å²	28	92.8 Å²	92.8	19%	0.189	46%	0.461	C	S	.	.			trans	-67	115.1	168.1	-62.4	0	0	0	0	110.3	C397 G401 V402 T403	C397-C429 WeakPolarHBondContact CA-SG 3.23Å; C397-C429 HydrophobicContact CB-CB 3.97Å; C397-C429 WeakPolarHBondContact CB-SG 3.49Å; C397-C429 WeakPolarHBondContact SG-CA 3.13Å; C397-C429 WeakPolarHBondContact SG-CB 3.04Å; C397-C429 CovalentContact SG-SG 2.03Å; C397-C429 PolarHBondContact SG-SG 3.03Å; G401-C429 PolarHBondContact O-SG 3.23Å; G401-C429 VanDerWaalsContact O-SG 3.32Å; V402-C429 PolarHBondContact O-SG 3.43Å; V402-C429 VanDerWaalsContact O-SG 3.37Å; T403-C429 PolarHBondContact OG1-N 2.64Å
430	D	65.8	Low	66.4	Low	83 Å²	83	90 Å²	90	44%	0.444	46%	0.458	S	S	.	.			trans	-60.7	141.8	174.2	-56.8	-69.4	0	0	0	111.3	R425 P428 C432	R425-D430 IonicContact CZ-OD2 3.71Å; R425-D430 IonicContact NH1-OD2 3.46Å; R425-D430 PolarHBondContact NH1-OD2 3.13Å; P428-D430 PolarHBondContact O-N 3.05Å; D430-C432 PolarHBondContact O-N 3.48Å
431	R	57.5	Low	65.9	Low	258 Å²	258	86 Å²	86	97%	0.974	44%	0.444	S	S	*	.	S	Bend	trans	-72.9	-5	170.9	-76	-172.3	172	-169.1	-1.4	113.7
432	C	54.8	Low	65.4	Low	24 Å²	24	88.7 Å²	88.7	16%	0.162	46%	0.456	C	S	.	.	S	Bend	trans	-111.9	133.3	178.2	-63.3	0	0	0	0	110.8	D430 C441 G446	D430-C432 PolarHBondContact O-N 3.48Å; C432-C441 PolarHBondContact SG-SG 3.33Å; C432-G446 WeakPolarHBondContact SG-CA 3.19Å; C432-G446 PolarHBondContact SG-O 2.89Å; C432-G446 VanDerWaalsContact SG-O 3.36Å
433	G	54.2	Low	63.9	Low	71 Å²	71	87.8 Å²	87.8	73%	0.732	47%	0.467	S	S	*	.			trans	-63.1	145.4	168.8	0	0	0	0	0	111.3	C435	G433-C435 PolarHBondContact O-N 2.95Å
434	Q	53.7	Low	62.7	Low	135 Å²	135	93.8 Å²	93.8	63%	0.631	49%	0.491	S	S	*	.			trans	-22.1	93.6	-177.1	-161.4	84.8	-2	0	0	115.6
435	C	60.7	Low	61.9	Low	36 Å²	36	94.7 Å²	94.7	24%	0.243	49%	0.49	C	S	.	.			trans	-58.5	141	167.7	-69.1	0	0	0	0	109.9	G433 S439 C448	G433-C435 PolarHBondContact O-N 2.95Å; C435-S439 WeakPolarHBondContact CB-O 2.99Å; C435-S439 WeakPolarHBondContact CB-OG 3.38Å; C435-C448 WeakPolarHBondContact CA-SG 3.39Å; C435-C448 HydrophobicContact CB-CB 3.86Å; C435-C448 WeakPolarHBondContact CB-SG 3.49Å; C435-C448 WeakPolarHBondContact SG-CB 3.43Å; C435-C448 CovalentContact SG-SG 2.05Å; C435-C448 PolarHBondContact SG-SG 3.23Å
436	R	58.6	Low	61.2	Low	176 Å²	176	92.3 Å²	92.3	66%	0.664	50%	0.495	S	S	*	.			trans	-112.4	164.8	-171.9	-64.8	-171.9	177.1	-161.9	-2.2	111.9	G438 S439	R436-G438 PolarHBondContact O-N 2.87Å; R436-G438 VanDerWaalsContact O-N 3.12Å; R436-S439 PolarHBondContact O-N 3.4Å; R436-S439 VanDerWaalsContact O-N 3.11Å; R436-S439 PolarHBondContact O-OG 3.05Å
437	F	63.5	Low	61.2	Low	69 Å²	69	89.4 Å²	89.4	30%	0.303	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	31.8	171.4	-43.2	-72.7	0	0	0	114.8	S439 C480 Q483	F437-S439 PolarHBondContact O-N 3.21Å; F437-C480 WeakPolarHBondContact O-CA 3.4Å; F437-C480 WeakPolarHBondContact O-CB 3.43Å; F437-C480 PolarHBondContact O-N 2.93Å; F437-Q483 HydrophobicContact CD2-CB 4.22Å; F437-Q483 HydrophobicContact CE2-CB 4.24Å
438	G	57.3	Low	61.2	Low	49 Å²	49	91 Å²	91	51%	0.505	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	6	179.1	0	0	0	0	0	116	R436	R436-G438 PolarHBondContact O-N 2.87Å; R436-G438 VanDerWaalsContact O-N 3.12Å
439	S	67.9	Low	61.2	Low	18 Å²	18	89.7 Å²	89.7	13%	0.126	48%	0.481	C	S	.	.			trans	-66.8	135	174.8	57.9	0	0	0	0	112.4	C435 R436 F437 C448 V449 C480	C435-S439 WeakPolarHBondContact CB-O 2.99Å; C435-S439 WeakPolarHBondContact CB-OG 3.38Å; R436-S439 PolarHBondContact O-N 3.4Å; R436-S439 VanDerWaalsContact O-N 3.11Å; R436-S439 PolarHBondContact O-OG 3.05Å; F437-S439 PolarHBondContact O-N 3.21Å; S439-C448 WeakPolarHBondContact OG-CB 3.2Å; S439-V449 CarbonylContact C-O 3.57Å; S439-V449 WeakPolarHBondContact CA-O 3.47Å; S439-C480 WeakPolarHBondContact CA-SG 3.31Å; S439-C480 WeakPolarHBondContact CB-SG 3.3Å; S439-C480 PolarHBondContact N-SG 3.34Å; S439-C480 VanDerWaalsContact N-SG 3.45Å
440	L	61	Low	61.4	Low	112 Å²	112	90.5 Å²	90.5	59%	0.586	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	150.1	177	-63.6	170.1	0	0	0	110.6	C448 V449 P451	L440-C448 CarbonylContact O-C 3.54Å; L440-C448 WeakPolarHBondContact O-CA 3.05Å; L440-V449 PolarHBondContact N-O 3.31Å; L440-V449 PolarHBondContact O-N 2.93Å; L440-P451 HydrophobicContact CD1-CG 4.36Å
441	C	61.2	Low	61.7	Low	45 Å²	45	88.8 Å²	88.8	30%	0.304	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	114.1	178.9	177	0	0	0	0	111.4	C432 V443	C432-C441 PolarHBondContact SG-SG 3.33Å; C441-V443 PolarHBondContact O-N 3.28Å
442	E	68.4	Low	62.1	Low	74 Å²	74	81.3 Å²	81.3	35%	0.346	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	105.3	173.2	-173	172.2	-109.3	0	0	110.1	E444 T445 G446 R447 V449	E442-E444 VanDerWaalsContact C-N 3.28Å; E442-E444 PolarHBondContact O-N 3.15Å; E442-T445 WeakPolarHBondContact CB-OG1 3.47Å; E442-T445 HydrophobicContact CG-CG2 4.19Å; E442-T445 WeakPolarHBondContact CG-OG1 3.5Å; E442-T445 PolarHBondContact O-N 3.36Å; E442-T445 WeakPolarHBondContact OE2-CB 3.43Å; E442-T445 WeakPolarHBondContact OE2-CG2 3.4Å; E442-T445 PolarHBondContact OE2-OG1 2.9Å; E442-G446 PolarHBondContact O-N 3.2Å; E442-R447 WeakPolarHBondContact CB-O 3.48Å; E442-R447 PolarHBondContact N-O 2.97Å; E442-V449 HydrophobicContact CB-CG2 4.02Å
443	V	49.3	Very low	62.6	Low	137 Å²	137	88.2 Å²	88.2	83%	0.83	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-29.8	-165.8	-176.3	0	0	0	0	113.6	C441	C441-V443 PolarHBondContact O-N 3.28Å
444	E	53.6	Low	63.5	Low	192 Å²	192	86.4 Å²	86.4	90%	0.897	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-34.7	-179.6	-60.1	-168.2	158.7	0	0	113.6	E442	E442-E444 VanDerWaalsContact C-N 3.28Å; E442-E444 PolarHBondContact O-N 3.15Å
445	T	59.3	Low	64.5	Low	87 Å²	87	86.3 Å²	86.3	53%	0.534	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-17.4	-172.6	66.6	0	0	0	0	113.4	E442 R447	E442-T445 WeakPolarHBondContact CB-OG1 3.47Å; E442-T445 HydrophobicContact CG-CG2 4.19Å; E442-T445 WeakPolarHBondContact CG-OG1 3.5Å; E442-T445 PolarHBondContact O-N 3.36Å; E442-T445 WeakPolarHBondContact OE2-CB 3.43Å; E442-T445 WeakPolarHBondContact OE2-CG2 3.4Å; E442-T445 PolarHBondContact OE2-OG1 2.9Å; T445-R447 VanDerWaalsContact C-N 3.28Å; T445-R447 WeakPolarHBondContact OG1-CB 3.33Å; T445-R447 PolarHBondContact OG1-N 3.32Å
446	G	59.8	Low	64.6	Low	45 Å²	45	94 Å²	94	46%	0.464	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	24.5	-173.7	0	0	0	0	0	113.3	C432 E442	C432-G446 WeakPolarHBondContact SG-CA 3.19Å; C432-G446 PolarHBondContact SG-O 2.89Å; C432-G446 VanDerWaalsContact SG-O 3.36Å; E442-G446 PolarHBondContact O-N 3.2Å
447	R	64.9	Low	64.5	Low	152 Å²	152	88 Å²	88	57%	0.574	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.5	131.4	-175.8	-166.1	173.3	65.5	141.6	2.5	111.3	E442 T445 V449	E442-R447 WeakPolarHBondContact CB-O 3.48Å; E442-R447 PolarHBondContact N-O 2.97Å; T445-R447 VanDerWaalsContact C-N 3.28Å; T445-R447 WeakPolarHBondContact OG1-CB 3.33Å; T445-R447 PolarHBondContact OG1-N 3.32Å; R447-V449 HydrophobicContact CG-CG1 4.32Å; R447-V449 PolarHBondContact O-N 2.03Å
448	C	68.3	Low	64.6	Low	57 Å²	57	89.7 Å²	89.7	39%	0.385	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	123.8	165.7	-53.7	0	0	0	0	109.1	C435 S439 L440	C435-C448 WeakPolarHBondContact CA-SG 3.39Å; C435-C448 HydrophobicContact CB-CB 3.86Å; C435-C448 WeakPolarHBondContact CB-SG 3.49Å; C435-C448 WeakPolarHBondContact SG-CB 3.43Å; C435-C448 CovalentContact SG-SG 2.05Å; C435-C448 PolarHBondContact SG-SG 3.23Å; S439-C448 WeakPolarHBondContact OG-CB 3.2Å; L440-C448 CarbonylContact O-C 3.54Å; L440-C448 WeakPolarHBondContact O-CA 3.05Å
449	V	74.1	Confident	65.1	Low	36 Å²	36	94.4 Å²	94.4	22%	0.218	53%	0.534	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	143.2	-178.9	-73.3	0	0	0	0	110.6	S439 L440 E442 R447	S439-V449 CarbonylContact C-O 3.57Å; S439-V449 WeakPolarHBondContact CA-O 3.47Å; L440-V449 PolarHBondContact N-O 3.31Å; L440-V449 PolarHBondContact O-N 2.93Å; E442-V449 HydrophobicContact CB-CG2 4.02Å; R447-V449 HydrophobicContact CG-CG1 4.32Å; R447-V449 PolarHBondContact O-N 2.03Å
450	C	76.1	Confident	65.7	Low	44 Å²	44	94.9 Å²	94.9	30%	0.297	54%	0.537	S	S	.	.			trans	-85.4	135.8	174.8	-61.3	0	0	0	0	110.2	C480 T481	C450-C480 WeakPolarHBondContact CA-SG 3.3Å; C450-C480 HydrophobicContact CB-CB 3.76Å; C450-C480 WeakPolarHBondContact CB-SG 3.4Å; C450-C480 WeakPolarHBondContact SG-CB 3.38Å; C450-C480 PolarHBondContact SG-O 2.9Å; C450-C480 VanDerWaalsContact SG-O 3.34Å; C450-C480 CovalentContact SG-SG 2.03Å; C450-C480 PolarHBondContact SG-SG 2.84Å; C450-T481 HydrophobicContact CB-CG2 4.06Å
451	P	71.7	Confident	66.8	Low	47 Å²	47	90.1 Å²	90.1	31%	0.305	51%	0.512	S	S	.	.			trans	-58.4	138.6	163.3	22.4	-27.3	0	0	0	109.4	L440 V477	L440-P451 HydrophobicContact CD1-CG 4.36Å; P451-V477 HydrophobicContact CB-CG2 4.43Å; P451-V477 HydrophobicContact CG-CG2 4.09Å; P451-V477 WeakPolarHBondContact O-CG1 3.47Å
452	S	66.6	Low	67.8	Low	101 Å²	101	88.1 Å²	88.1	71%	0.706	50%	0.499	S	S	*	.			trans	-102.3	-15	-173.4	53.9	0	0	0	0	114.3
453	E	65.4	Low	68.3	Low	169 Å²	169	84.6 Å²	84.6	79%	0.79	48%	0.482	S	S	*	.			trans	-137.3	142	-174.8	-64.9	179.7	-175	0	0	109.2
454	C	72.4	Confident	69.6	Low	33 Å²	33	80.1 Å²	80.1	22%	0.223	46%	0.457	C	S	.	.			trans	-114.4	147.4	172.7	-73.9	0	0	0	0	109.3	E456 C473 E474 V477	C454-E456 PolarHBondContact O-N 2.84Å; C454-C473 HydrophobicContact CB-CB 3.82Å; C454-C473 WeakPolarHBondContact CB-SG 3.29Å; C454-C473 WeakPolarHBondContact SG-CB 3.48Å; C454-C473 CovalentContact SG-SG 2.04Å; C454-C473 PolarHBondContact SG-SG 3.12Å; C454-E474 HydrophobicContact CB-CG 4.36Å; C454-E474 PolarHBondContact SG-N 2.04Å; C454-V477 VanDerWaalsContact SG-CG2 3.57Å
455	V	73.8	Confident	70.6	Confident	134 Å²	134	73.7 Å²	73.7	81%	0.812	43%	0.429	S	S	*	.			trans	-67.4	127.8	168.2	-178.6	0	0	0	0	108	S457	V455-S457 PolarHBondContact O-N 2.86Å
456	E	63.9	Low	71.2	Confident	197 Å²	197	70.1 Å²	70.1	92%	0.921	41%	0.41	S	S	*	.			trans	-56.2	112.6	-178.9	-70.4	-168.5	155.6	0	0	110.8	C454	C454-E456 PolarHBondContact O-N 2.84Å
457	S	57.2	Low	72	Confident	51 Å²	51	73.9 Å²	73.9	36%	0.357	42%	0.415	S	S	.	.			trans	-125.1	123.4	-179.4	175.9	0	0	0	0	108.8	V455 Q459	V455-S457 PolarHBondContact O-N 2.86Å; S457-Q459 PolarHBondContact O-N 3.41Å
458	A	64.9	Low	72.9	Confident	103 Å²	103	69.4 Å²	69.4	85%	0.851	41%	0.405	S	S	*	.			trans	-83.5	39.5	-178.8	0	0	0	0	0	112.6	P460	A458-P460 WeakPolarHBondContact O-CD 3.3Å
459	Q	67	Low	73.6	Confident	148 Å²	148	67.8 Å²	67.8	69%	0.692	39%	0.391	S	S	*	.			trans	-121.9	76.3	-177	-65.2	-168	5.4	0	0	110.5	S457 A470	S457-Q459 PolarHBondContact O-N 3.41Å; Q459-A470 CarbonylContact C-O 3.44Å; Q459-A470 PolarHBondContact N-O 3.15Å
460	P	80.4	Confident	73.8	Confident	28 Å²	28	68.3 Å²	68.3	18%	0.182	40%	0.399	C	S	.	.			trans	-65.1	146.9	-176	24.2	-32.6	0	0	0	112.1	A458 T468 Y469 A470 G492 H493	A458-P460 WeakPolarHBondContact O-CD 3.3Å; P460-T468 HydrophobicContact CB-CG2 3.8Å; P460-Y469 CarbonylContact C-O 3.56Å; P460-Y469 WeakPolarHBondContact CA-O 2.99Å; P460-Y469 WeakPolarHBondContact CB-O 2.98Å; P460-A470 VanDerWaalsContact CA-O 3.28Å; P460-A470 WeakPolarHBondContact CA-O 3.44Å; P460-G492 CarbonylContact O-C 3.56Å; P460-G492 WeakPolarHBondContact O-CA 3.44Å; P460-G492 PolarHBondContact O-N 2.79Å; P460-H493 VanDerWaalsContact CG-CE1 3.45Å; P460-H493 WeakPolarHBondContact CG-CE1 3.48Å
461	V	84	Confident	74.1	Confident	12 Å²	12	66.5 Å²	66.5	7%	0.073	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	147.6	177.9	-62	0	0	0	0	110.8	T468 Y469 E472 L475 V488 G492	V461-T468 WeakPolarHBondContact O-CA 2.96Å; V461-Y469 PolarHBondContact N-O 2.85Å; V461-Y469 PolarHBondContact O-N 2.87Å; V461-E472 HydrophobicContact CG1-CB 4.22Å; V461-E472 HydrophobicContact CG2-CB 4.28Å; V461-L475 HydrophobicContact CG2-CB 4.27Å; V461-L475 HydrophobicContact CG2-CD1 3.87Å; V461-V488 HydrophobicContact CB-CG1 4.17Å; V461-V488 HydrophobicContact CB-CG2 4.21Å; V461-V488 HydrophobicContact CG1-CG1 4.4Å; V461-V488 HydrophobicContact CG1-CG2 4.41Å; V461-V488 HydrophobicContact CG2-CG2 4.14Å; V461-G492 CarbonylContact C-O 3.46Å; V461-G492 VanDerWaalsContact C-O 3.25Å; V461-G492 WeakPolarHBondContact CA-O 3.01Å
462	C	82.8	Confident	74.7	Confident	3 Å²	3	69.3 Å²	69.3	2%	0.02	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	123.6	172.2	-172.5	0	0	0	0	109.7	A489 S490 G492 C494	C462-A489 PolarHBondContact O-N 3.42Å; C462-S490 VanDerWaalsContact CB-OG 3.3Å; C462-S490 WeakPolarHBondContact CB-OG 3.04Å; C462-S490 PolarHBondContact N-O 2.85Å; C462-S490 PolarHBondContact O-N 2.95Å; C462-G492 PolarHBondContact N-O 2.78Å; C462-C494 WeakPolarHBondContact CA-SG 3.44Å; C462-C494 HydrophobicContact CB-CB 3.96Å; C462-C494 WeakPolarHBondContact CB-SG 3.4Å; C462-C494 WeakPolarHBondContact SG-CA 3.45Å; C462-C494 WeakPolarHBondContact SG-CB 3.09Å; C462-C494 CovalentContact SG-SG 2.03Å; C462-C494 PolarHBondContact SG-SG 3.37Å
463	G	79.3	Confident	75.4	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	160.2	173.6	0	0	0	0	0	113.1	D465 G466 H467 Y487	G463-D465 WeakPolarHBondContact CA-OD1 3.49Å; G463-D465 PolarHBondContact O-N 3.17Å; G463-D465 VanDerWaalsContact O-N 3.12Å; G463-G466 PolarHBondContact O-N 2.84Å; G463-H467 PolarHBondContact N-O 2.92Å; G463-Y487 CarbonylContact C-O 3.46Å; G463-Y487 WeakPolarHBondContact CA-O 3.47Å
464	S	75.7	Confident	76.3	Confident	43 Å²	43	62.8 Å²	62.8	30%	0.301	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-9.2	173.2	58.6	0	0	0	0	114.7	L486 Y487	S464-L486 WeakPolarHBondContact OG-CA 3.17Å; S464-Y487 VanDerWaalsContact CB-CZ 3.45Å; S464-Y487 PolarHBondContact N-O 2.95Å; S464-Y487 WeakPolarHBondContact OG-CD1 3.41Å; S464-Y487 PolarHBondContact OG-N 3.38Å; S464-Y487 VanDerWaalsContact OG-N 3.15Å
465	D	75.8	Confident	76.9	Confident	57 Å²	57	61.2 Å²	61.2	31%	0.305	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-9.1	170.7	58.3	-4.4	0	0	0	113.7	G463 H467 Y469 L486	G463-D465 WeakPolarHBondContact CA-OD1 3.49Å; G463-D465 PolarHBondContact O-N 3.17Å; G463-D465 VanDerWaalsContact O-N 3.12Å; D465-H467 PolarHBondContact OD1-N 3.4Å; D465-H467 IonicContact OD2-CD2 3.73Å; D465-H467 PolarHBondContact OD2-CD2 3.34Å; D465-H467 IonicContact OD2-CG 2.69Å; D465-Y469 PolarHBondContact OD2-OH 3.3Å; D465-L486 HydrophobicContact CB-CD2 3.63Å; D465-L486 VanDerWaalsContact CG-CD2 3.49Å; D465-L486 WeakPolarHBondContact OD2-CD2 3.3Å
466	G	71.7	Confident	77.2	Confident	13 Å²	13	58.4 Å²	58.4	13%	0.134	33%	0.327	C	S	.	.	S	Bend	trans	84.6	8.1	-173.7	0	0	0	0	0	115.1	G463 C494	G463-G466 PolarHBondContact O-N 2.84Å; G466-C494 PolarHBondContact O-SG 2.03Å
467	H	76.9	Confident	78	Confident	123 Å²	123	50 Å²	50	57%	0.569	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-94.2	143.2	174	-68.9	-53.5	0	0	0	111.6	G463 D465 Y469 C494	G463-H467 PolarHBondContact N-O 2.92Å; D465-H467 PolarHBondContact OD1-N 3.4Å; D465-H467 IonicContact OD2-CD2 3.73Å; D465-H467 PolarHBondContact OD2-CD2 3.34Å; D465-H467 IonicContact OD2-CG 2.69Å; H467-Y469 HydrophobicContact CB-CE2 4.03Å; H467-Y469 WeakPolarHBondContact O-CD2 3.37Å; H467-Y469 WeakPolarHBondContact O-CE2 3.39Å; H467-C494 PolarHBondContact O-SG 3.09Å
468	T	82.2	Confident	79.3	Confident	59 Å²	59	50.5 Å²	50.5	36%	0.362	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	126	174.1	-55.5	0	0	0	0	109.6	P460 V461 H493 C494	P460-T468 HydrophobicContact CB-CG2 3.8Å; V461-T468 WeakPolarHBondContact O-CA 2.96Å; T468-H493 HydrophobicContact CG2-CB 4.12Å; T468-C494 WeakPolarHBondContact OG1-CB 3.39Å; T468-C494 PolarHBondContact OG1-N 2.6Å
469	Y	83.6	Confident	80.1	Confident	22 Å²	22	45.8 Å²	45.8	9%	0.086	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	144.4	171.7	-61.4	-88.4	0	0	0	108	P460 V461 D465 H467 S471 E474 L475 H478 L486	P460-Y469 CarbonylContact C-O 3.56Å; P460-Y469 WeakPolarHBondContact CA-O 2.99Å; P460-Y469 WeakPolarHBondContact CB-O 2.98Å; V461-Y469 PolarHBondContact N-O 2.85Å; V461-Y469 PolarHBondContact O-N 2.87Å; D465-Y469 PolarHBondContact OD2-OH 3.3Å; H467-Y469 HydrophobicContact CB-CE2 4.03Å; H467-Y469 WeakPolarHBondContact O-CD2 3.37Å; H467-Y469 WeakPolarHBondContact O-CE2 3.39Å; Y469-S471 PolarHBondContact O-N 3.21Å; Y469-E474 HydrophobicContact CD1-CB 4.49Å; Y469-L475 HydrophobicContact CD1-CB 4.22Å; Y469-L475 HydrophobicContact CD2-CB 3.81Å; Y469-L475 HydrophobicContact CD2-CD1 3.84Å; Y469-L475 HydrophobicContact CD2-CG 3.83Å; Y469-L475 HydrophobicContact CE2-CB 4.44Å; Y469-L475 HydrophobicContact CE2-CD1 4.29Å; Y469-L475 HydrophobicContact CE2-CG 4.1Å; Y469-L475 HydrophobicContact CG-CB 3.69Å; Y469-L475 HydrophobicContact CG-CG 4.24Å; Y469-H478 HydrophobicContact CD1-CB 4.3Å; Y469-H478 HydrophobicContact CE1-CB 3.65Å; Y469-H478 AromaticContact CE1-CG 3.63Å; Y469-H478 AromaticContact CE1-ND1 3.54Å; Y469-H478 AromaticContact CZ-ND1 3.65Å; Y469-H478 PolarHBondContact OH-CE1 2.82Å; Y469-H478 PolarHBondContact OH-ND1 2.85Å; Y469-L486 HydrophobicContact CE2-CD1 4.43Å; Y469-L486 VanDerWaalsContact OH-CD1 3.29Å; Y469-L486 WeakPolarHBondContact OH-CD1 3.49Å
470	A	79.6	Confident	80.8	Confident	48 Å²	48	38.9 Å²	38.9	40%	0.397	22%	0.215	S	C	.	.	S	Bend	trans	-71.9	-19.3	-176.6	0	0	0	0	0	112.1	Q459 P460 E474	Q459-A470 CarbonylContact C-O 3.44Å; Q459-A470 PolarHBondContact N-O 3.15Å; P460-A470 VanDerWaalsContact CA-O 3.28Å; P460-A470 WeakPolarHBondContact CA-O 3.44Å; A470-E474 WeakPolarHBondContact CA-OE2 3.48Å; A470-E474 VanDerWaalsContact CB-OE2 3.24Å; A470-E474 WeakPolarHBondContact CB-OE2 3.46Å; A470-E474 PolarHBondContact N-OE2 3.41Å
471	S	81.6	Confident	80.8	Confident	5 Å²	5	41 Å²	41	4%	0.035	23%	0.228	C	C	.	.	S	Bend	trans	-147	163.4	166.5	68.2	0	0	0	0	112.6	Y469 C473 E474 L475	Y469-S471 PolarHBondContact O-N 3.21Å; S471-C473 PolarHBondContact O-N 2.8Å; S471-C473 PolarHBondContact OG-N 3.26Å; S471-E474 PolarHBondContact O-N 3.4Å; S471-E474 VanDerWaalsContact O-N 3.15Å; S471-E474 PolarHBondContact OG-N 2.95Å; S471-L475 PolarHBondContact O-N 3.19Å
472	E	83.3	Confident	80.6	Confident	106 Å²	106	45.9 Å²	45.9	50%	0.495	25%	0.249	S	C	.	.	H	α-helix	trans	-61.6	-27.9	170.1	-178.6	169	-163.7	0	0	112.8	V461 L475 H476 V488	V461-E472 HydrophobicContact CG1-CB 4.22Å; V461-E472 HydrophobicContact CG2-CB 4.28Å; E472-L475 PolarHBondContact O-N 2.99Å; E472-H476 PolarHBondContact O-N 3.35Å; E472-H476 VanDerWaalsContact O-N 3.17Å; E472-H476 PolarHBondContact O-ND1 3.28Å; E472-H476 IonicContact OE1-CE1 3.29Å; E472-V488 HydrophobicContact CB-CG2 4.41Å; E472-V488 HydrophobicContact CG-CG2 3.81Å
473	C	83	Confident	80.3	Confident	57 Å²	57	50.8 Å²	50.8	39%	0.385	27%	0.272	S	S	.	.	H	α-helix	trans	-62.3	-46.5	171.8	179.3	0	0	0	0	110.9	C454 S471 L475 H476 V477	C454-C473 HydrophobicContact CB-CB 3.82Å; C454-C473 WeakPolarHBondContact CB-SG 3.29Å; C454-C473 WeakPolarHBondContact SG-CB 3.48Å; C454-C473 CovalentContact SG-SG 2.04Å; C454-C473 PolarHBondContact SG-SG 3.12Å; S471-C473 PolarHBondContact O-N 2.8Å; S471-C473 PolarHBondContact OG-N 3.26Å; C473-L475 VanDerWaalsContact C-N 3.34Å; C473-L475 PolarHBondContact O-N 3Å; C473-H476 PolarHBondContact O-N 2.72Å; C473-V477 WeakPolarHBondContact O-CG2 3.48Å; C473-V477 PolarHBondContact O-N 3.43Å
474	E	83.3	Confident	80.1	Confident	76 Å²	76	54 Å²	54	36%	0.355	29%	0.289	S	S	.	.	H	α-helix	trans	-63.3	-38.6	178.6	-74	174.1	-164.4	0	0	112.6	C454 Y469 A470 S471 H476 V477 H478	C454-E474 HydrophobicContact CB-CG 4.36Å; C454-E474 PolarHBondContact SG-N 2.04Å; Y469-E474 HydrophobicContact CD1-CB 4.49Å; A470-E474 WeakPolarHBondContact CA-OE2 3.48Å; A470-E474 VanDerWaalsContact CB-OE2 3.24Å; A470-E474 WeakPolarHBondContact CB-OE2 3.46Å; A470-E474 PolarHBondContact N-OE2 3.41Å; S471-E474 PolarHBondContact O-N 3.4Å; S471-E474 VanDerWaalsContact O-N 3.15Å; S471-E474 PolarHBondContact OG-N 2.95Å; E474-H476 VanDerWaalsContact C-N 3.33Å; E474-H476 PolarHBondContact O-N 3.16Å; E474-V477 PolarHBondContact O-N 2.81Å; E474-H478 VanDerWaalsContact O-CB 3.24Å; E474-H478 WeakPolarHBondContact O-CB 3.48Å; E474-H478 PolarHBondContact O-N 3.48Å
475	L	84.2	Confident	79.9	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-57.2	-47.5	173.7	-176.4	159.6	0	0	0	110.7	V461 Y469 S471 E472 C473 H478 A479 L486 V488	V461-L475 HydrophobicContact CG2-CB 4.27Å; V461-L475 HydrophobicContact CG2-CD1 3.87Å; Y469-L475 HydrophobicContact CD1-CB 4.22Å; Y469-L475 HydrophobicContact CD2-CB 3.81Å; Y469-L475 HydrophobicContact CD2-CD1 3.84Å; Y469-L475 HydrophobicContact CD2-CG 3.83Å; Y469-L475 HydrophobicContact CE2-CB 4.44Å; Y469-L475 HydrophobicContact CE2-CD1 4.29Å; Y469-L475 HydrophobicContact CE2-CG 4.1Å; Y469-L475 HydrophobicContact CG-CB 3.69Å; Y469-L475 HydrophobicContact CG-CG 4.24Å; S471-L475 PolarHBondContact O-N 3.19Å; E472-L475 PolarHBondContact O-N 2.99Å; C473-L475 VanDerWaalsContact C-N 3.34Å; C473-L475 PolarHBondContact O-N 3Å; L475-H478 PolarHBondContact O-N 3.4Å; L475-A479 VanDerWaalsContact O-CB 3.32Å; L475-A479 WeakPolarHBondContact O-CB 3.48Å; L475-A479 PolarHBondContact O-N 2.71Å; L475-L486 HydrophobicContact CD2-CB 3.8Å; L475-L486 HydrophobicContact CG-CB 4.29Å; L475-V488 HydrophobicContact CD1-CG2 3.97Å
476	H	80	Confident	79.8	Confident	75 Å²	75	55 Å²	55	35%	0.347	30%	0.298	S	S	.	.	H	α-helix	trans	-71.7	-35.5	179.6	-72.6	94.5	0	0	0	113.1	E472 C473 E474 A479 C480	E472-H476 PolarHBondContact O-N 3.35Å; E472-H476 VanDerWaalsContact O-N 3.17Å; E472-H476 PolarHBondContact O-ND1 3.28Å; E472-H476 IonicContact OE1-CE1 3.29Å; C473-H476 PolarHBondContact O-N 2.72Å; E474-H476 VanDerWaalsContact C-N 3.33Å; E474-H476 PolarHBondContact O-N 3.16Å; H476-A479 PolarHBondContact O-N 3.29Å; H476-C480 VanDerWaalsContact O-CB 3.27Å; H476-C480 WeakPolarHBondContact O-CB 3.07Å; H476-C480 PolarHBondContact O-N 3.03Å
477	V	82.7	Confident	79.9	Confident	22 Å²	22	61.2 Å²	61.2	13%	0.133	32%	0.318	C	S	.	.	H	α-helix	trans	-63.4	-43	171.2	167.6	0	0	0	0	110.7	P451 C454 C473 E474 C480 T481	P451-V477 HydrophobicContact CB-CG2 4.43Å; P451-V477 HydrophobicContact CG-CG2 4.09Å; P451-V477 WeakPolarHBondContact O-CG1 3.47Å; C454-V477 VanDerWaalsContact SG-CG2 3.57Å; C473-V477 WeakPolarHBondContact O-CG2 3.48Å; C473-V477 PolarHBondContact O-N 3.43Å; E474-V477 PolarHBondContact O-N 2.81Å; V477-C480 PolarHBondContact O-N 3.4Å; V477-T481 HydrophobicContact CG1-CG2 4.28Å; V477-T481 WeakPolarHBondContact O-CB 3Å; V477-T481 VanDerWaalsContact O-CG2 3.31Å; V477-T481 WeakPolarHBondContact O-CG2 3.44Å; V477-T481 PolarHBondContact O-N 3.03Å; V477-T481 PolarHBondContact O-OG1 2.81Å
478	H	82.8	Confident	80	Confident	61 Å²	61	57.6 Å²	57.6	28%	0.282	31%	0.305	S	S	.	.	H	α-helix	trans	-64.3	-46.6	176.5	-172.1	-109.9	0	0	0	111.5	Y469 E474 L475 C480 T481 H482 L486	Y469-H478 HydrophobicContact CD1-CB 4.3Å; Y469-H478 HydrophobicContact CE1-CB 3.65Å; Y469-H478 AromaticContact CE1-CG 3.63Å; Y469-H478 AromaticContact CE1-ND1 3.54Å; Y469-H478 AromaticContact CZ-ND1 3.65Å; Y469-H478 PolarHBondContact OH-CE1 2.82Å; Y469-H478 PolarHBondContact OH-ND1 2.85Å; E474-H478 VanDerWaalsContact O-CB 3.24Å; E474-H478 WeakPolarHBondContact O-CB 3.48Å; E474-H478 PolarHBondContact O-N 3.48Å; L475-H478 PolarHBondContact O-N 3.4Å; H478-C480 VanDerWaalsContact C-N 3.33Å; H478-C480 PolarHBondContact O-N 3.37Å; H478-T481 WeakPolarHBondContact CA-OG1 3.33Å; H478-T481 PolarHBondContact O-N 3.46Å; H478-T481 PolarHBondContact O-OG1 2.9Å; H478-H482 AromaticContact CD2-CE1 3.45Å; H478-H482 PolarHBondContact CD2-CE1 3.48Å; H478-H482 VanDerWaalsContact CD2-CE1 3.45Å; H478-H482 AromaticContact CD2-ND1 3.38Å; H478-H482 PolarHBondContact CD2-ND1 3.28Å; H478-H482 AromaticContact CG-ND1 3.97Å; H478-H482 AromaticContact NE2-CE1 3.62Å; H478-H482 AromaticContact NE2-ND1 3.63Å; H478-H482 WeakPolarHBondContact O-CB 3.09Å; H478-H482 PolarHBondContact O-N 3.14Å; H478-H482 PolarHBondContact O-ND1 2.04Å; H478-H482 VanDerWaalsContact O-ND1 3.14Å; H478-L486 WeakPolarHBondContact ND1-CD1 3.18Å
479	A	82.4	Confident	79.2	Confident	4 Å²	4	57.4 Å²	57.4	3%	0.033	31%	0.309	C	S	.	.	H	α-helix	trans	-54.2	-47.5	173.8	0	0	0	0	0	112.1	L475 H476 Q483 I484 L486	L475-A479 VanDerWaalsContact O-CB 3.32Å; L475-A479 WeakPolarHBondContact O-CB 3.48Å; L475-A479 PolarHBondContact O-N 2.71Å; H476-A479 PolarHBondContact O-N 3.29Å; A479-Q483 WeakPolarHBondContact O-CA 3.46Å; A479-Q483 PolarHBondContact O-N 3.39Å; A479-I484 WeakPolarHBondContact CB-O 3.36Å; A479-I484 PolarHBondContact O-N 2.86Å; A479-L486 HydrophobicContact CB-CB 4.04Å; A479-L486 HydrophobicContact CB-CD1 4.32Å; A479-L486 HydrophobicContact CB-CG 4.4Å
480	C	82.1	Confident	78.5	Confident	2 Å²	2	59 Å²	59	1%	0.014	32%	0.323	C	S	.	.	H	α-helix	trans	-66.2	-53.7	179.8	-167.3	0	0	0	0	112	F437 S439 C450 H476 V477 H478 H482 Q483	F437-C480 WeakPolarHBondContact O-CA 3.4Å; F437-C480 WeakPolarHBondContact O-CB 3.43Å; F437-C480 PolarHBondContact O-N 2.93Å; S439-C480 WeakPolarHBondContact CA-SG 3.31Å; S439-C480 WeakPolarHBondContact CB-SG 3.3Å; S439-C480 PolarHBondContact N-SG 3.34Å; S439-C480 VanDerWaalsContact N-SG 3.45Å; C450-C480 WeakPolarHBondContact CA-SG 3.3Å; C450-C480 HydrophobicContact CB-CB 3.76Å; C450-C480 WeakPolarHBondContact CB-SG 3.4Å; C450-C480 WeakPolarHBondContact SG-CB 3.38Å; C450-C480 PolarHBondContact SG-O 2.9Å; C450-C480 VanDerWaalsContact SG-O 3.34Å; C450-C480 CovalentContact SG-SG 2.03Å; C450-C480 PolarHBondContact SG-SG 2.84Å; H476-C480 VanDerWaalsContact O-CB 3.27Å; H476-C480 WeakPolarHBondContact O-CB 3.07Å; H476-C480 PolarHBondContact O-N 3.03Å; V477-C480 PolarHBondContact O-N 3.4Å; H478-C480 VanDerWaalsContact C-N 3.33Å; H478-C480 PolarHBondContact O-N 3.37Å; C480-H482 VanDerWaalsContact C-N 3.29Å; C480-H482 PolarHBondContact O-N 3.39Å; C480-Q483 PolarHBondContact O-N 2.67Å; C480-Q483 PolarHBondContact O-NE2 3.02Å
481	T	80.3	Confident	77.9	Confident	74 Å²	74	61.2 Å²	61.2	45%	0.454	34%	0.341	S	S	.	.	H	α-helix	trans	-64.2	-33.2	-174.9	48.7	0	0	0	0	112.8	C450 V477 H478	C450-T481 HydrophobicContact CB-CG2 4.06Å; V477-T481 HydrophobicContact CG1-CG2 4.28Å; V477-T481 WeakPolarHBondContact O-CB 3Å; V477-T481 VanDerWaalsContact O-CG2 3.31Å; V477-T481 WeakPolarHBondContact O-CG2 3.44Å; V477-T481 PolarHBondContact O-N 3.03Å; V477-T481 PolarHBondContact O-OG1 2.81Å; H478-T481 WeakPolarHBondContact CA-OG1 3.33Å; H478-T481 PolarHBondContact O-N 3.46Å; H478-T481 PolarHBondContact O-OG1 2.9Å
482	H	79.6	Confident	77.3	Confident	114 Å²	114	62.3 Å²	62.3	53%	0.528	35%	0.354	S	S	.	.	H	α-helix	trans	-96.7	-1.7	178.4	-62.3	78	0	0	0	113.6	H478 C480 I484	H478-H482 AromaticContact CD2-CE1 3.45Å; H478-H482 PolarHBondContact CD2-CE1 3.48Å; H478-H482 VanDerWaalsContact CD2-CE1 3.45Å; H478-H482 AromaticContact CD2-ND1 3.38Å; H478-H482 PolarHBondContact CD2-ND1 3.28Å; H478-H482 AromaticContact CG-ND1 3.97Å; H478-H482 AromaticContact NE2-CE1 3.62Å; H478-H482 AromaticContact NE2-ND1 3.63Å; H478-H482 WeakPolarHBondContact O-CB 3.09Å; H478-H482 PolarHBondContact O-N 3.14Å; H478-H482 PolarHBondContact O-ND1 2.04Å; H478-H482 VanDerWaalsContact O-ND1 3.14Å; C480-H482 VanDerWaalsContact C-N 3.29Å; C480-H482 PolarHBondContact O-N 3.39Å; H482-I484 VanDerWaalsContact C-N 3.3Å; H482-I484 HydrophobicContact CB-CD1 4Å; H482-I484 HydrophobicContact CB-CG1 3.98Å; H482-I484 PolarHBondContact O-N 2.65Å
483	Q	75.8	Confident	76.7	Confident	106 Å²	106	63.6 Å²	63.6	50%	0.495	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	40.8	-178.4	-62.6	-74.5	-74.3	0	0	113.5	F437 A479 C480	F437-Q483 HydrophobicContact CD2-CB 4.22Å; F437-Q483 HydrophobicContact CE2-CB 4.24Å; A479-Q483 WeakPolarHBondContact O-CA 3.46Å; A479-Q483 PolarHBondContact O-N 3.39Å; C480-Q483 PolarHBondContact O-N 2.67Å; C480-Q483 PolarHBondContact O-NE2 3.02Å
484	I	75.8	Confident	76	Confident	68 Å²	68	61.7 Å²	61.7	35%	0.349	35%	0.347	S	S	.	.			trans	-114.5	148.3	-179.1	55.1	179.2	0	0	0	111.3	A479 H482 L486	A479-I484 WeakPolarHBondContact CB-O 3.36Å; A479-I484 PolarHBondContact O-N 2.86Å; H482-I484 VanDerWaalsContact C-N 3.3Å; H482-I484 HydrophobicContact CB-CD1 4Å; H482-I484 HydrophobicContact CB-CG1 3.98Å; H482-I484 PolarHBondContact O-N 2.65Å; I484-L486 HydrophobicContact CD1-CD1 3.74Å; I484-L486 HydrophobicContact CD1-CD2 4.43Å; I484-L486 HydrophobicContact CD1-CG 4.02Å; I484-L486 HydrophobicContact CG1-CD1 4.07Å; I484-L486 HydrophobicContact CG1-CG 4.04Å; I484-L486 PolarHBondContact O-N 3.47Å
485	S	71.1	Confident	74.9	Confident	99 Å²	99	65.9 Å²	65.9	69%	0.692	37%	0.366	S	S	*	.			trans	-86	88.9	179.9	-173.5	0	0	0	0	110.5
486	L	73.9	Confident	73.6	Confident	20 Å²	20	70.9 Å²	70.9	11%	0.105	40%	0.397	C	S	.	.			trans	-104.3	145.9	171.3	-60.3	172	0	0	0	110.9	S464 D465 Y469 L475 H478 A479 I484	S464-L486 WeakPolarHBondContact OG-CA 3.17Å; D465-L486 HydrophobicContact CB-CD2 3.63Å; D465-L486 VanDerWaalsContact CG-CD2 3.49Å; D465-L486 WeakPolarHBondContact OD2-CD2 3.3Å; Y469-L486 HydrophobicContact CE2-CD1 4.43Å; Y469-L486 VanDerWaalsContact OH-CD1 3.29Å; Y469-L486 WeakPolarHBondContact OH-CD1 3.49Å; L475-L486 HydrophobicContact CD2-CB 3.8Å; L475-L486 HydrophobicContact CG-CB 4.29Å; H478-L486 WeakPolarHBondContact ND1-CD1 3.18Å; A479-L486 HydrophobicContact CB-CB 4.04Å; A479-L486 HydrophobicContact CB-CD1 4.32Å; A479-L486 HydrophobicContact CB-CG 4.4Å; I484-L486 HydrophobicContact CD1-CD1 3.74Å; I484-L486 HydrophobicContact CD1-CD2 4.43Å; I484-L486 HydrophobicContact CD1-CG 4.02Å; I484-L486 HydrophobicContact CG1-CD1 4.07Å; I484-L486 HydrophobicContact CG1-CG 4.04Å; I484-L486 PolarHBondContact O-N 3.47Å
487	Y	74.6	Confident	72.6	Confident	145 Å²	145	67.3 Å²	67.3	57%	0.569	38%	0.381	S	S	*	.			trans	-140.3	163.1	170	58.8	-87.8	0	0	0	110	G463 S464 A489	G463-Y487 CarbonylContact C-O 3.46Å; G463-Y487 WeakPolarHBondContact CA-O 3.47Å; S464-Y487 VanDerWaalsContact CB-CZ 3.45Å; S464-Y487 PolarHBondContact N-O 2.95Å; S464-Y487 WeakPolarHBondContact OG-CD1 3.41Å; S464-Y487 PolarHBondContact OG-N 3.38Å; S464-Y487 VanDerWaalsContact OG-N 3.15Å; Y487-A489 PolarHBondContact O-N 3.02Å
488	V	78.1	Confident	71.8	Confident	47 Å²	47	69 Å²	69	29%	0.285	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	116.8	175.2	177	0	0	0	0	109.5	V461 E472 L475	V461-V488 HydrophobicContact CB-CG1 4.17Å; V461-V488 HydrophobicContact CB-CG2 4.21Å; V461-V488 HydrophobicContact CG1-CG1 4.4Å; V461-V488 HydrophobicContact CG1-CG2 4.41Å; V461-V488 HydrophobicContact CG2-CG2 4.14Å; E472-V488 HydrophobicContact CB-CG2 4.41Å; E472-V488 HydrophobicContact CG-CG2 3.81Å; L475-V488 HydrophobicContact CD1-CG2 3.97Å
489	A	66.1	Low	70.5	Confident	54 Å²	54	75.9 Å²	75.9	45%	0.446	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-33.4	173.8	0	0	0	0	0	112.2	C462 Y487	C462-A489 PolarHBondContact O-N 3.42Å; Y487-A489 PolarHBondContact O-N 3.02Å
490	S	68.1	Low	69.3	Low	56 Å²	56	79.5 Å²	79.5	39%	0.392	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	150.2	170.6	64.7	0	0	0	0	112	C462	C462-S490 VanDerWaalsContact CB-OG 3.3Å; C462-S490 WeakPolarHBondContact CB-OG 3.04Å; C462-S490 PolarHBondContact N-O 2.85Å; C462-S490 PolarHBondContact O-N 2.95Å
491	A	66.6	Low	68.2	Low	94 Å²	94	82.3 Å²	82.3	78%	0.777	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	141.4	167.7	0	0	0	0	0	111
492	G	70.6	Confident	67.4	Low	29 Å²	29	80.3 Å²	80.3	30%	0.299	46%	0.462	S	S	.	.	S	Bend	trans	92.8	178.8	-172	0	0	0	0	0	113.5	P460 V461 C462	P460-G492 CarbonylContact O-C 3.56Å; P460-G492 WeakPolarHBondContact O-CA 3.44Å; P460-G492 PolarHBondContact O-N 2.79Å; V461-G492 CarbonylContact C-O 3.46Å; V461-G492 VanDerWaalsContact C-O 3.25Å; V461-G492 WeakPolarHBondContact CA-O 3.01Å; C462-G492 PolarHBondContact N-O 2.78Å
493	H	69.2	Low	66.7	Low	132 Å²	132	78 Å²	78	61%	0.611	46%	0.456	S	S	*	.	S	Bend	trans	-66	143.9	176.9	-62.2	81.2	0	0	0	111.5	P460 T468 Q495	P460-H493 VanDerWaalsContact CG-CE1 3.45Å; P460-H493 WeakPolarHBondContact CG-CE1 3.48Å; T468-H493 HydrophobicContact CG2-CB 4.12Å; H493-Q495 PolarHBondContact O-N 3.42Å
494	C	68.1	Low	66.4	Low	17 Å²	17	77 Å²	77	12%	0.115	45%	0.451	C	S	.	.			trans	-59.6	118.9	171	-64.4	0	0	0	0	110.9	C462 G466 H467 T468 T496	C462-C494 WeakPolarHBondContact CA-SG 3.44Å; C462-C494 HydrophobicContact CB-CB 3.96Å; C462-C494 WeakPolarHBondContact CB-SG 3.4Å; C462-C494 WeakPolarHBondContact SG-CA 3.45Å; C462-C494 WeakPolarHBondContact SG-CB 3.09Å; C462-C494 CovalentContact SG-SG 2.03Å; C462-C494 PolarHBondContact SG-SG 3.37Å; G466-C494 PolarHBondContact O-SG 2.03Å; H467-C494 PolarHBondContact O-SG 3.09Å; T468-C494 WeakPolarHBondContact OG1-CB 3.39Å; T468-C494 PolarHBondContact OG1-N 2.6Å; C494-T496 PolarHBondContact O-N 3.38Å
495	Q	60.6	Low	65.7	Low	164 Å²	164	75.9 Å²	75.9	77%	0.766	46%	0.456	S	S	*	.			trans	-85.1	96.1	173.3	-62.6	-176.8	11.3	0	0	109	H493 C497	H493-Q495 PolarHBondContact O-N 3.42Å; Q495-C497 PolarHBondContact O-N 2.95Å
496	T	57.3	Low	65.6	Low	106 Å²	106	72 Å²	72	65%	0.65	43%	0.429	S	S	*	.			trans	-68.2	114.6	-179.6	42.4	0	0	0	0	111.3	C494 G498	C494-T496 PolarHBondContact O-N 3.38Å; T496-G498 PolarHBondContact O-N 2.99Å
497	C	58.8	Low	65.2	Low	0 Å²	0	74.8 Å²	74.8	0%	0	45%	0.447	C	S	.	.	B	Isolated β-bridge	trans	-95.7	82.8	176.3	-156.2	0	0	0	0	109.4	Q495 E499 T500 C502 C508 G511 Q512	Q495-C497 PolarHBondContact O-N 2.95Å; C497-E499 PolarHBondContact O-N 3.1Å; C497-T500 CarbonylContact C-O 3.43Å; C497-T500 WeakPolarHBondContact CA-O 3.48Å; C497-T500 WeakPolarHBondContact CB-O 3.36Å; C497-T500 PolarHBondContact N-O 2.68Å; C497-T500 PolarHBondContact O-N 2.88Å; C497-T500 PolarHBondContact O-OG1 3.39Å; C497-C502 VanDerWaalsContact CB-SG 3.53Å; C497-C508 WeakPolarHBondContact CA-SG 3.29Å; C497-C508 HydrophobicContact CB-CB 3.62Å; C497-C508 WeakPolarHBondContact CB-SG 3.45Å; C497-C508 WeakPolarHBondContact SG-CA 3.2Å; C497-C508 WeakPolarHBondContact SG-CB 3.49Å; C497-C508 CovalentContact SG-SG 2.04Å; C497-C508 PolarHBondContact SG-SG 3.49Å; C497-G511 VanDerWaalsContact SG-C 3.54Å; C497-Q512 PolarHBondContact SG-N 3.2Å
498	G	66.1	Low	64.8	Low	57 Å²	57	70.4 Å²	70.4	59%	0.588	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	-125.1	-166.6	0	0	0	0	0	110.4	T496	T496-G498 PolarHBondContact O-N 2.99Å
499	E	56	Low	64.3	Low	205 Å²	205	70.9 Å²	70.9	96%	0.958	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	7.3	177.7	-59.2	-172.1	158.7	0	0	113.3	C497	C497-E499 PolarHBondContact O-N 3.1Å
500	T	55.6	Low	64.2	Low	81 Å²	81	73.9 Å²	73.9	50%	0.497	47%	0.467	S	S	.	.	B	Isolated β-bridge	trans	-125.6	144.3	-174.9	49.9	0	0	0	0	113.6	C497	C497-T500 CarbonylContact C-O 3.43Å; C497-T500 WeakPolarHBondContact CA-O 3.48Å; C497-T500 WeakPolarHBondContact CB-O 3.36Å; C497-T500 PolarHBondContact N-O 2.68Å; C497-T500 PolarHBondContact O-N 2.88Å; C497-T500 PolarHBondContact O-OG1 3.39Å
501	V	59.5	Low	63.9	Low	61 Å²	61	73.4 Å²	73.4	37%	0.37	47%	0.471	S	S	.	.			trans	-92.6	133.3	171	-174.6	0	0	0	0	108.6	T503	V501-T503 PolarHBondContact O-N 2.97Å
502	C	64.3	Low	63.8	Low	31 Å²	31	75.4 Å²	75.4	21%	0.209	47%	0.465	C	S	.	.			trans	-82.7	111.4	-178.3	-55.9	0	0	0	0	111.2	C497 A506 C513	C497-C502 VanDerWaalsContact CB-SG 3.53Å; C502-A506 HydrophobicContact CB-CB 3.9Å; C502-A506 VanDerWaalsContact CB-O 3.26Å; C502-A506 WeakPolarHBondContact CB-O 3.44Å; C502-C513 WeakPolarHBondContact CA-SG 3.32Å; C502-C513 HydrophobicContact CB-CB 3.79Å; C502-C513 WeakPolarHBondContact CB-SG 3.43Å; C502-C513 VanDerWaalsContact SG-CA 3.55Å; C502-C513 WeakPolarHBondContact SG-CB 3.33Å; C502-C513 CovalentContact SG-SG 2.04Å; C502-C513 PolarHBondContact SG-SG 2.87Å
503	T	64.1	Low	63.8	Low	67 Å²	67	75.9 Å²	75.9	41%	0.411	46%	0.463	S	S	.	.			trans	-91	169.4	-179.9	49.3	0	0	0	0	112.5	V501 G505 A506 Q548	V501-T503 PolarHBondContact O-N 2.97Å; T503-G505 PolarHBondContact O-N 2.87Å; T503-A506 WeakPolarHBondContact O-CB 3.49Å; T503-A506 PolarHBondContact O-N 3.4Å; T503-Q548 PolarHBondContact OG1-OE1 3.47Å
504	F	69.2	Low	64.3	Low	85 Å²	85	72.1 Å²	72.1	37%	0.373	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	24.4	170.9	-49.9	-71.8	0	0	0	116.2	C545 Q548 Q550	F504-C545 VanDerWaalsContact O-CA 3.31Å; F504-C545 WeakPolarHBondContact O-CA 3.04Å; F504-C545 VanDerWaalsContact O-CB 3.3Å; F504-C545 WeakPolarHBondContact O-CB 3.43Å; F504-C545 PolarHBondContact O-N 3.31Å; F504-Q548 HydrophobicContact CD2-CB 4.07Å; F504-Q548 HydrophobicContact CD2-CG 4.46Å; F504-Q548 HydrophobicContact CE2-CB 4.05Å; F504-Q550 HydrophobicContact CE1-CB 4.33Å
505	G	62.4	Low	64.8	Low	44 Å²	44	73.1 Å²	73.1	45%	0.454	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.6	8.1	-179.7	0	0	0	0	0	115.4	T503 P516	T503-G505 PolarHBondContact O-N 2.87Å; G505-P516 WeakPolarHBondContact O-CD 3.45Å
506	A	68.1	Low	65.3	Low	16 Å²	16	68.2 Å²	68.2	13%	0.132	44%	0.438	C	S	.	.			trans	-62.5	143.1	170	0	0	0	0	0	111.7	C502 T503 C513 C545	C502-A506 HydrophobicContact CB-CB 3.9Å; C502-A506 VanDerWaalsContact CB-O 3.26Å; C502-A506 WeakPolarHBondContact CB-O 3.44Å; T503-A506 WeakPolarHBondContact O-CB 3.49Å; T503-A506 PolarHBondContact O-N 3.4Å; A506-C513 HydrophobicContact CB-CB 4.14Å; A506-C545 VanDerWaalsContact CA-SG 3.54Å; A506-C545 VanDerWaalsContact CB-SG 3.57Å
507	V	65.4	Low	66.1	Low	80 Å²	80	72.2 Å²	72.2	49%	0.485	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	141.6	177.6	176.3	0	0	0	0	109	S509 V514 P516	V507-S509 PolarHBondContact O-N 3.06Å; V507-V514 PolarHBondContact N-O 2.78Å; V507-V514 WeakPolarHBondContact O-CG2 2.99Å; V507-V514 PolarHBondContact O-N 2.91Å; V507-V514 VanDerWaalsContact O-O 3.12Å; V507-P516 HydrophobicContact CG2-CB 4.17Å; V507-P516 HydrophobicContact CG2-CG 3.87Å
508	C	67	Low	66.8	Low	52 Å²	52	73.5 Å²	73.5	35%	0.351	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	123.9	176.2	-172.9	0	0	0	0	111.3	C497	C497-C508 WeakPolarHBondContact CA-SG 3.29Å; C497-C508 HydrophobicContact CB-CB 3.62Å; C497-C508 WeakPolarHBondContact CB-SG 3.45Å; C497-C508 WeakPolarHBondContact SG-CA 3.2Å; C497-C508 WeakPolarHBondContact SG-CB 3.49Å; C497-C508 CovalentContact SG-SG 2.04Å; C497-C508 PolarHBondContact SG-SG 3.49Å
509	S	67.6	Low	66.6	Low	57 Å²	57	78.4 Å²	78.4	40%	0.399	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	131.1	168.2	86.4	0	0	0	0	110.5	V507 G511 Q512 V514	V507-S509 PolarHBondContact O-N 3.06Å; S509-G511 PolarHBondContact O-N 2.86Å; S509-Q512 PolarHBondContact N-O 2.97Å; S509-Q512 PolarHBondContact O-N 3.12Å; S509-V514 VanDerWaalsContact OG-CG2 3.26Å; S509-V514 WeakPolarHBondContact OG-CG2 3.44Å
510	A	63	Low	66.8	Low	117 Å²	117	77.2 Å²	77.2	97%	0.967	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	25.4	178.5	0	0	0	0	0	116.2
511	G	61.4	Low	67	Low	47 Å²	47	75.2 Å²	75.2	49%	0.485	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	86	10.8	-177.2	0	0	0	0	0	115	C497 S509	C497-G511 VanDerWaalsContact SG-C 3.54Å; S509-G511 PolarHBondContact O-N 2.86Å
512	Q	65.1	Low	66.9	Low	136 Å²	136	77.4 Å²	77.4	64%	0.636	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.2	134.8	173.5	-173.2	171.8	-1.4	0	0	110.2	C497 S509 V514	C497-Q512 PolarHBondContact SG-N 3.2Å; S509-Q512 PolarHBondContact N-O 2.97Å; S509-Q512 PolarHBondContact O-N 3.12Å; Q512-V514 HydrophobicContact CG-CG1 4.42Å; Q512-V514 PolarHBondContact O-N 2.73Å
513	C	70.9	Confident	66.6	Low	38 Å²	38	82.2 Å²	82.2	26%	0.257	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	122.3	170.4	-63.1	0	0	0	0	109.4	C502 A506	C502-C513 WeakPolarHBondContact CA-SG 3.32Å; C502-C513 HydrophobicContact CB-CB 3.79Å; C502-C513 WeakPolarHBondContact CB-SG 3.43Å; C502-C513 VanDerWaalsContact SG-CA 3.55Å; C502-C513 WeakPolarHBondContact SG-CB 3.33Å; C502-C513 CovalentContact SG-SG 2.04Å; C502-C513 PolarHBondContact SG-SG 2.87Å; A506-C513 HydrophobicContact CB-CB 4.14Å
514	V	78.9	Confident	66.8	Low	54 Å²	54	80.7 Å²	80.7	33%	0.327	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	144	178.9	-62.6	0	0	0	0	110	V507 S509 Q512	V507-V514 PolarHBondContact N-O 2.78Å; V507-V514 WeakPolarHBondContact O-CG2 2.99Å; V507-V514 PolarHBondContact O-N 2.91Å; V507-V514 VanDerWaalsContact O-O 3.12Å; S509-V514 VanDerWaalsContact OG-CG2 3.26Å; S509-V514 WeakPolarHBondContact OG-CG2 3.44Å; Q512-V514 HydrophobicContact CG-CG1 4.42Å; Q512-V514 PolarHBondContact O-N 2.73Å
515	C	78.4	Confident	67.3	Low	38 Å²	38	79.4 Å²	79.4	26%	0.257	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-71.4	124.6	172.8	-60	0	0	0	0	109.5	C545 Q546	C515-C545 WeakPolarHBondContact CA-SG 3.35Å; C515-C545 HydrophobicContact CB-CB 3.81Å; C515-C545 WeakPolarHBondContact CB-SG 3.32Å; C515-C545 WeakPolarHBondContact SG-CB 3.08Å; C515-C545 CovalentContact SG-SG 2.04Å; C515-C545 PolarHBondContact SG-SG 3.32Å; C515-Q546 HydrophobicContact CB-CG 4.11Å; C515-Q546 PolarHBondContact SG-N 3.37Å; C515-Q546 VanDerWaalsContact SG-N 3.41Å
516	P	72.6	Confident	68.3	Low	60 Å²	60	77.7 Å²	77.7	39%	0.39	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-64.8	137.1	172.8	29.6	-34.5	0	0	0	108.8	G505 V507	G505-P516 WeakPolarHBondContact O-CD 3.45Å; V507-P516 HydrophobicContact CG2-CB 4.17Å; V507-P516 HydrophobicContact CG2-CG 3.87Å
517	R	74.2	Confident	69.1	Low	191 Å²	191	77.8 Å²	77.8	72%	0.721	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-91.9	134.6	179.9	-53.9	-168.3	75.1	-167.9	2.4	110.5	E519 E542	R517-E519 VanDerWaalsContact C-N 3.33Å; R517-E519 PolarHBondContact O-N 3.32Å; R517-E542 WeakPolarHBondContact CA-OE2 3.28Å; R517-E542 IonicContact NE-OE1 2.71Å
518	C	72.8	Confident	69.8	Low	26 Å²	26	74 Å²	74	18%	0.176	44%	0.441	C	S	.	.			trans	-79	76.4	-178	-67.5	0	0	0	0	111.9	H520 P521 C538 E539 E542	C518-H520 PolarHBondContact O-N 2.85Å; C518-P521 HydrophobicContact CB-CG 4.46Å; C518-P521 WeakPolarHBondContact O-CD 3.48Å; C518-C538 HydrophobicContact CB-CB 3.92Å; C518-C538 WeakPolarHBondContact CB-SG 3.33Å; C518-C538 VanDerWaalsContact SG-CA 3.57Å; C518-C538 WeakPolarHBondContact SG-CB 3.24Å; C518-C538 PolarHBondContact SG-O 2.03Å; C518-C538 CovalentContact SG-SG 2.04Å; C518-C538 PolarHBondContact SG-SG 3.37Å; C518-E539 HydrophobicContact CB-CG 4.4Å; C518-E542 PolarHBondContact N-OE2 3.45Å
519	E	62.5	Low	70.3	Confident	160 Å²	160	75 Å²	75	75%	0.748	45%	0.448	S	S	*	.	S	Bend	trans	-77.7	103.5	172.7	-65.6	-167.2	171.5	0	0	110.9	R517	R517-E519 VanDerWaalsContact C-N 3.33Å; R517-E519 PolarHBondContact O-N 3.32Å
520	H	59.8	Low	70.9	Confident	180 Å²	180	75.5 Å²	75.5	83%	0.833	45%	0.447	S	S	*	.	S	Bend	trans	64.1	61.6	179	-48.6	88.7	0	0	0	115.2	C518	C518-H520 PolarHBondContact O-N 2.85Å
521	P	59.8	Low	71.3	Confident	40 Å²	40	72.4 Å²	72.4	26%	0.26	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-66.8	156.6	173.4	31.4	-36.3	0	0	0	112.1	C518 S536 C538	C518-P521 HydrophobicContact CB-CG 4.46Å; C518-P521 WeakPolarHBondContact O-CD 3.48Å; P521-S536 WeakPolarHBondContact CB-OG 3.35Å; P521-C538 HydrophobicContact CB-CB 3.87Å
522	P	56.4	Low	72.2	Confident	107 Å²	107	73.4 Å²	73.4	70%	0.695	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-64.5	136.8	168.6	28.6	-33.9	0	0	0	110.1
523	P	59.8	Low	73.1	Confident	132 Å²	132	69.7 Å²	69.7	86%	0.857	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-74.5	131.1	-175.8	29.6	-34.7	0	0	0	111.6
524	G	68	Low	73.6	Confident	34 Å²	34	69 Å²	69	35%	0.351	40%	0.402	S	S	.	.			trans	169.9	104	175.3	0	0	0	0	0	109.9	L535 S536	G524-L535 CarbonylContact C-O 3.52Å; G524-L535 VanDerWaalsContact C-O 3.31Å; G524-L535 PolarHBondContact N-O 2.88Å; G524-S536 WeakPolarHBondContact O-CA 3.28Å
525	P	78.6	Confident	73.5	Confident	58 Å²	58	72 Å²	72	38%	0.377	42%	0.415	S	S	.	.			trans	-63.3	148.1	-177.3	26.8	-34.4	0	0	0	110.9	T533 Y534 G557	P525-T533 HydrophobicContact CB-CG2 3.94Å; P525-Y534 CarbonylContact C-O 3.6Å; P525-Y534 WeakPolarHBondContact CA-O 3.44Å; P525-G557 CarbonylContact O-C 3.51Å; P525-G557 VanDerWaalsContact O-CA 3.23Å; P525-G557 WeakPolarHBondContact O-CA 3.26Å; P525-G557 PolarHBondContact O-N 2.87Å
526	V	83.9	Confident	73.5	Confident	9 Å²	9	70.4 Å²	70.4	6%	0.055	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	143.2	176.3	-64.4	0	0	0	0	110.5	Y534 A537 L540 E553 G557	V526-Y534 PolarHBondContact N-O 3.05Å; V526-Y534 PolarHBondContact O-N 2.04Å; V526-A537 HydrophobicContact CG1-CB 4.24Å; V526-A537 HydrophobicContact CG2-CB 4.41Å; V526-L540 HydrophobicContact CG2-CB 4.06Å; V526-L540 HydrophobicContact CG2-CD1 3.68Å; V526-E553 HydrophobicContact CB-CG 4.15Å; V526-E553 HydrophobicContact CG1-CG 4.32Å; V526-G557 CarbonylContact C-O 3.47Å; V526-G557 VanDerWaalsContact CA-O 3.26Å; V526-G557 WeakPolarHBondContact CA-O 3.11Å
527	C	86	Confident	73.9	Confident	18 Å²	18	69.5 Å²	69.5	12%	0.122	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	119	176.8	-178.5	0	0	0	0	109.5	A554 R555 G557 C559	C527-A554 PolarHBondContact O-N 3.23Å; C527-R555 HydrophobicContact CB-CB 4.2Å; C527-R555 PolarHBondContact N-O 3.25Å; C527-R555 PolarHBondContact O-N 3.2Å; C527-G557 PolarHBondContact N-O 3.46Å; C527-C559 WeakPolarHBondContact CA-SG 3.05Å; C527-C559 HydrophobicContact CB-CB 3.99Å; C527-C559 WeakPolarHBondContact CB-SG 3.02Å; C527-C559 WeakPolarHBondContact SG-CA 3.48Å; C527-C559 WeakPolarHBondContact SG-CB 3.48Å; C527-C559 CovalentContact SG-SG 2.04Å; C527-C559 PolarHBondContact SG-SG 3.47Å
528	G	79.4	Confident	74.3	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.01	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	157.4	173.6	0	0	0	0	0	112.8	D530 G531 V532 E552	G528-D530 VanDerWaalsContact C-OD1 3.27Å; G528-D530 VanDerWaalsContact CA-OD1 3.28Å; G528-D530 WeakPolarHBondContact CA-OD1 3.36Å; G528-D530 PolarHBondContact O-N 2.92Å; G528-D530 VanDerWaalsContact O-N 3.12Å; G528-G531 PolarHBondContact O-N 3.14Å; G528-V532 PolarHBondContact N-O 2.92Å; G528-E552 CarbonylContact C-O 3.49Å; G528-E552 WeakPolarHBondContact CA-O 3.36Å
529	S	77.4	Confident	74.7	Confident	71 Å²	71	64.4 Å²	64.4	50%	0.497	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-9	172.2	60.7	0	0	0	0	114.1	E552	S529-E552 PolarHBondContact N-O 3.4Å; S529-E552 PolarHBondContact OG-N 2.82Å
530	D	79.2	Confident	75.8	Confident	69 Å²	69	57.1 Å²	57.1	37%	0.369	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-6.6	170.9	59	-5.3	0	0	0	113.5	G528 V532 Y534	G528-D530 VanDerWaalsContact C-OD1 3.27Å; G528-D530 VanDerWaalsContact CA-OD1 3.28Å; G528-D530 WeakPolarHBondContact CA-OD1 3.36Å; G528-D530 PolarHBondContact O-N 2.92Å; G528-D530 VanDerWaalsContact O-N 3.12Å; D530-V532 HydrophobicContact CB-CG2 4.39Å; D530-V532 WeakPolarHBondContact OD1-CB 3.31Å; D530-V532 PolarHBondContact OD1-N 3.21Å; D530-Y534 PolarHBondContact OD2-OH 3.1Å
531	G	73.2	Confident	76.7	Confident	52 Å²	52	56.8 Å²	56.8	54%	0.536	35%	0.347	S	S	.	.	S	Bend	trans	80.5	13.2	-174.1	0	0	0	0	0	114.1	G528 C559	G528-G531 PolarHBondContact O-N 3.14Å; G531-C559 PolarHBondContact O-SG 3.17Å; G531-C559 VanDerWaalsContact O-SG 3.4Å
532	V	80.2	Confident	77.7	Confident	68 Å²	68	56.2 Å²	56.2	41%	0.412	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-100.7	135.5	179.7	-178.4	0	0	0	0	110.8	G528 D530 Y534 C559	G528-V532 PolarHBondContact N-O 2.92Å; D530-V532 HydrophobicContact CB-CG2 4.39Å; D530-V532 WeakPolarHBondContact OD1-CB 3.31Å; D530-V532 PolarHBondContact OD1-N 3.21Å; V532-Y534 HydrophobicContact CB-CE2 3.76Å; V532-Y534 HydrophobicContact CG1-CD2 4.5Å; V532-Y534 HydrophobicContact CG1-CE1 4.33Å; V532-Y534 HydrophobicContact CG1-CE2 3.95Å; V532-Y534 VanDerWaalsContact O-CD2 3.31Å; V532-Y534 WeakPolarHBondContact O-CD2 3.07Å; V532-Y534 WeakPolarHBondContact O-CE2 3.42Å; V532-C559 VanDerWaalsContact C-SG 3.53Å; V532-C559 PolarHBondContact O-SG 3.48Å
533	T	82.3	Confident	78.9	Confident	57 Å²	57	51.9 Å²	51.9	35%	0.35	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	122.4	170.7	-61.4	0	0	0	0	110.5	P525 P558 C559	P525-T533 HydrophobicContact CB-CG2 3.94Å; T533-P558 HydrophobicContact CG2-CB 3.81Å; T533-P558 WeakPolarHBondContact OG1-CA 3Å; T533-C559 PolarHBondContact OG1-N 3.38Å
534	Y	82.3	Confident	79.9	Confident	24 Å²	24	45.9 Å²	45.9	9%	0.094	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	145.6	170.9	-62.9	-85.8	0	0	0	109.6	P525 V526 D530 V532 S536 L540 A543 I551	P525-Y534 CarbonylContact C-O 3.6Å; P525-Y534 WeakPolarHBondContact CA-O 3.44Å; V526-Y534 PolarHBondContact N-O 3.05Å; V526-Y534 PolarHBondContact O-N 2.04Å; D530-Y534 PolarHBondContact OD2-OH 3.1Å; V532-Y534 HydrophobicContact CB-CE2 3.76Å; V532-Y534 HydrophobicContact CG1-CD2 4.5Å; V532-Y534 HydrophobicContact CG1-CE1 4.33Å; V532-Y534 HydrophobicContact CG1-CE2 3.95Å; V532-Y534 VanDerWaalsContact O-CD2 3.31Å; V532-Y534 WeakPolarHBondContact O-CD2 3.07Å; V532-Y534 WeakPolarHBondContact O-CE2 3.42Å; Y534-S536 PolarHBondContact O-N 3.42Å; Y534-L540 HydrophobicContact CD1-CB 4.36Å; Y534-L540 HydrophobicContact CD2-CB 3.9Å; Y534-L540 HydrophobicContact CD2-CD1 3.89Å; Y534-L540 HydrophobicContact CD2-CG 3.82Å; Y534-L540 HydrophobicContact CE2-CD1 4.48Å; Y534-L540 HydrophobicContact CE2-CG 4.22Å; Y534-L540 HydrophobicContact CG-CB 3.75Å; Y534-L540 HydrophobicContact CG-CG 4.21Å; Y534-A543 HydrophobicContact CD1-CB 4.04Å; Y534-A543 HydrophobicContact CE1-CB 3.38Å; Y534-I551 HydrophobicContact CE2-CG2 4.15Å
535	L	76.3	Confident	80.6	Confident	118 Å²	118	44.4 Å²	44.4	62%	0.618	26%	0.259	S	S	*	.	S	Bend	trans	-74.2	-15.1	-173.4	-48.1	172.6	0	0	0	113	G524 E539	G524-L535 CarbonylContact C-O 3.52Å; G524-L535 VanDerWaalsContact C-O 3.31Å; G524-L535 PolarHBondContact N-O 2.88Å; L535-E539 WeakPolarHBondContact CB-OE2 3.24Å; L535-E539 VanDerWaalsContact CG-OE2 3.29Å; L535-E539 WeakPolarHBondContact CG-OE2 3.45Å; L535-E539 PolarHBondContact N-OE2 2.86Å
536	S	79.8	Confident	80.8	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.021	27%	0.269	C	S	.	.	S	Bend	trans	-156.2	159.7	170.6	65.9	0	0	0	0	111.7	P521 G524 Y534 C538 E539 L540	P521-S536 WeakPolarHBondContact CB-OG 3.35Å; G524-S536 WeakPolarHBondContact O-CA 3.28Å; Y534-S536 PolarHBondContact O-N 3.42Å; S536-C538 PolarHBondContact O-N 3.46Å; S536-C538 VanDerWaalsContact O-N 3.11Å; S536-C538 WeakPolarHBondContact OG-CB 3.49Å; S536-C538 PolarHBondContact OG-N 3.28Å; S536-E539 PolarHBondContact O-N 2.88Å; S536-E539 PolarHBondContact OG-N 2.89Å; S536-L540 PolarHBondContact O-N 3.5Å; S536-L540 VanDerWaalsContact O-N 3.09Å
537	A	79.9	Confident	80.5	Confident	41 Å²	41	52.6 Å²	52.6	34%	0.339	29%	0.292	S	S	.	.	H	α-helix	trans	-61.8	-12.4	168.2	0	0	0	0	0	113.8	V526 R541	V526-A537 HydrophobicContact CG1-CB 4.24Å; V526-A537 HydrophobicContact CG2-CB 4.41Å; A537-R541 WeakPolarHBondContact O-CD 3.38Å; A537-R541 VanDerWaalsContact O-CG 3.25Å; A537-R541 WeakPolarHBondContact O-CG 3.15Å
538	C	82.1	Confident	79.9	Confident	52 Å²	52	56.5 Å²	56.5	35%	0.351	31%	0.309	S	S	.	.	H	α-helix	trans	-74	-52.2	167.9	-167.8	0	0	0	0	110.1	C518 P521 S536 L540 R541 E542	C518-C538 HydrophobicContact CB-CB 3.92Å; C518-C538 WeakPolarHBondContact CB-SG 3.33Å; C518-C538 VanDerWaalsContact SG-CA 3.57Å; C518-C538 WeakPolarHBondContact SG-CB 3.24Å; C518-C538 PolarHBondContact SG-O 2.03Å; C518-C538 CovalentContact SG-SG 2.04Å; C518-C538 PolarHBondContact SG-SG 3.37Å; P521-C538 HydrophobicContact CB-CB 3.87Å; S536-C538 PolarHBondContact O-N 3.46Å; S536-C538 VanDerWaalsContact O-N 3.11Å; S536-C538 WeakPolarHBondContact OG-CB 3.49Å; S536-C538 PolarHBondContact OG-N 3.28Å; C538-L540 VanDerWaalsContact C-N 3.33Å; C538-L540 PolarHBondContact O-N 2.96Å; C538-R541 CarbonylContact O-C 3.53Å; C538-R541 WeakPolarHBondContact O-CA 3.28Å; C538-R541 PolarHBondContact O-N 2.04Å; C538-E542 PolarHBondContact O-N 3.02Å
539	E	82.1	Confident	79.7	Confident	59 Å²	59	59.9 Å²	59.9	28%	0.276	33%	0.329	S	S	.	.	H	α-helix	trans	-62.8	-36.8	-178.8	-72.9	175.5	-158.9	0	0	112.9	C518 L535 S536 R541 E542 A543	C518-E539 HydrophobicContact CB-CG 4.4Å; L535-E539 WeakPolarHBondContact CB-OE2 3.24Å; L535-E539 VanDerWaalsContact CG-OE2 3.29Å; L535-E539 WeakPolarHBondContact CG-OE2 3.45Å; L535-E539 PolarHBondContact N-OE2 2.86Å; S536-E539 PolarHBondContact O-N 2.88Å; S536-E539 PolarHBondContact OG-N 2.89Å; E539-R541 PolarHBondContact O-N 2.84Å; E539-E542 PolarHBondContact O-N 3.24Å; E539-A543 VanDerWaalsContact O-CB 3.24Å; E539-A543 WeakPolarHBondContact O-CB 3.37Å; E539-A543 PolarHBondContact O-N 3.37Å
540	L	84.9	Confident	79.2	Confident	7 Å²	7	62.7 Å²	62.7	4%	0.037	33%	0.334	C	S	.	.	H	α-helix	trans	-55.1	-41	171.7	-175.3	155.7	0	0	0	111.2	V526 Y534 S536 C538 A544 I551 E553	V526-L540 HydrophobicContact CG2-CB 4.06Å; V526-L540 HydrophobicContact CG2-CD1 3.68Å; Y534-L540 HydrophobicContact CD1-CB 4.36Å; Y534-L540 HydrophobicContact CD2-CB 3.9Å; Y534-L540 HydrophobicContact CD2-CD1 3.89Å; Y534-L540 HydrophobicContact CD2-CG 3.82Å; Y534-L540 HydrophobicContact CE2-CD1 4.48Å; Y534-L540 HydrophobicContact CE2-CG 4.22Å; Y534-L540 HydrophobicContact CG-CB 3.75Å; Y534-L540 HydrophobicContact CG-CG 4.21Å; S536-L540 PolarHBondContact O-N 3.5Å; S536-L540 VanDerWaalsContact O-N 3.09Å; C538-L540 VanDerWaalsContact C-N 3.33Å; C538-L540 PolarHBondContact O-N 2.96Å; L540-A544 WeakPolarHBondContact O-CB 3.24Å; L540-A544 PolarHBondContact O-N 2.84Å; L540-I551 HydrophobicContact CD1-CG2 4.47Å; L540-I551 HydrophobicContact CD2-CB 4.41Å; L540-I551 HydrophobicContact CD2-CG2 4.19Å; L540-I551 WeakPolarHBondContact CD2-O 3.06Å; L540-I551 HydrophobicContact CG-CG2 4.1Å; L540-E553 HydrophobicContact CD1-CB 4.47Å
541	R	78.3	Confident	79	Confident	173 Å²	173	60.1 Å²	60.1	65%	0.653	32%	0.32	S	S	*	.	H	α-helix	trans	-80.6	-33.5	-178.7	-63.8	170.4	75.7	172.1	6.2	112.5	A537 C538 E539 A543 C545	A537-R541 WeakPolarHBondContact O-CD 3.38Å; A537-R541 VanDerWaalsContact O-CG 3.25Å; A537-R541 WeakPolarHBondContact O-CG 3.15Å; C538-R541 CarbonylContact O-C 3.53Å; C538-R541 WeakPolarHBondContact O-CA 3.28Å; C538-R541 PolarHBondContact O-N 2.04Å; E539-R541 PolarHBondContact O-N 2.84Å; R541-A543 VanDerWaalsContact C-N 3.34Å; R541-C545 VanDerWaalsContact O-CB 3.27Å; R541-C545 WeakPolarHBondContact O-CB 3.34Å; R541-C545 PolarHBondContact O-N 3.5Å
542	E	82.8	Confident	79.2	Confident	27 Å²	27	63 Å²	63	13%	0.126	32%	0.319	C	S	.	.	H	α-helix	trans	-63.4	-41.8	168.5	-179.4	168.1	-173.8	0	0	110.6	R517 C518 C538 E539 C545 Q546	R517-E542 WeakPolarHBondContact CA-OE2 3.28Å; R517-E542 IonicContact NE-OE1 2.71Å; C518-E542 PolarHBondContact N-OE2 3.45Å; C538-E542 PolarHBondContact O-N 3.02Å; E539-E542 PolarHBondContact O-N 3.24Å; E542-C545 PolarHBondContact O-N 3.07Å; E542-Q546 HydrophobicContact CG-CG 4.36Å; E542-Q546 VanDerWaalsContact CG-NE2 3.3Å; E542-Q546 WeakPolarHBondContact O-CB 3.26Å; E542-Q546 VanDerWaalsContact O-CG 3.29Å; E542-Q546 WeakPolarHBondContact O-CG 3Å; E542-Q546 PolarHBondContact O-N 2.83Å; E542-Q546 PolarHBondContact OE1-NE2 2.94Å
543	A	80.1	Confident	79.2	Confident	16 Å²	16	64.6 Å²	64.6	13%	0.132	32%	0.322	C	S	.	.	H	α-helix	trans	-66.9	-47.2	176.8	0	0	0	0	0	112.8	Y534 E539 R541 C545 Q546 Q547	Y534-A543 HydrophobicContact CD1-CB 4.04Å; Y534-A543 HydrophobicContact CE1-CB 3.38Å; E539-A543 VanDerWaalsContact O-CB 3.24Å; E539-A543 WeakPolarHBondContact O-CB 3.37Å; E539-A543 PolarHBondContact O-N 3.37Å; R541-A543 VanDerWaalsContact C-N 3.34Å; A543-C545 VanDerWaalsContact C-N 3.26Å; A543-C545 PolarHBondContact O-N 3.05Å; A543-Q546 PolarHBondContact O-N 3.19Å; A543-Q547 VanDerWaalsContact O-CB 3.31Å; A543-Q547 WeakPolarHBondContact O-CB 3.32Å; A543-Q547 VanDerWaalsContact O-CG 3.32Å; A543-Q547 WeakPolarHBondContact O-CG 3.01Å; A543-Q547 PolarHBondContact O-N 3.45Å
544	A	82.3	Confident	78.7	Confident	7 Å²	7	65 Å²	65	6%	0.058	33%	0.332	C	S	.	.	H	α-helix	trans	-54.1	-44.9	173.3	0	0	0	0	0	111.5	L540 Q548 V549 I551	L540-A544 WeakPolarHBondContact O-CB 3.24Å; L540-A544 PolarHBondContact O-N 2.84Å; A544-Q548 WeakPolarHBondContact O-CA 3.4Å; A544-Q548 PolarHBondContact O-N 3.38Å; A544-V549 WeakPolarHBondContact CA-O 3.3Å; A544-V549 WeakPolarHBondContact CB-O 3.47Å; A544-V549 PolarHBondContact O-N 3.22Å; A544-V549 VanDerWaalsContact O-N 3.15Å; A544-I551 HydrophobicContact CB-CB 4.12Å; A544-I551 HydrophobicContact CB-CD1 4.34Å; A544-I551 HydrophobicContact CB-CG1 4.27Å
545	C	82.3	Confident	78.4	Confident	2 Å²	2	71.2 Å²	71.2	1%	0.014	36%	0.355	C	S	.	.	H	α-helix	trans	-63.3	-51.4	175.8	-177.5	0	0	0	0	112.7	F504 A506 C515 R541 E542 A543 Q547 Q548	F504-C545 VanDerWaalsContact O-CA 3.31Å; F504-C545 WeakPolarHBondContact O-CA 3.04Å; F504-C545 VanDerWaalsContact O-CB 3.3Å; F504-C545 WeakPolarHBondContact O-CB 3.43Å; F504-C545 PolarHBondContact O-N 3.31Å; A506-C545 VanDerWaalsContact CA-SG 3.54Å; A506-C545 VanDerWaalsContact CB-SG 3.57Å; C515-C545 WeakPolarHBondContact CA-SG 3.35Å; C515-C545 HydrophobicContact CB-CB 3.81Å; C515-C545 WeakPolarHBondContact CB-SG 3.32Å; C515-C545 WeakPolarHBondContact SG-CB 3.08Å; C515-C545 CovalentContact SG-SG 2.04Å; C515-C545 PolarHBondContact SG-SG 3.32Å; R541-C545 VanDerWaalsContact O-CB 3.27Å; R541-C545 WeakPolarHBondContact O-CB 3.34Å; R541-C545 PolarHBondContact O-N 3.5Å; E542-C545 PolarHBondContact O-N 3.07Å; A543-C545 VanDerWaalsContact C-N 3.26Å; A543-C545 PolarHBondContact O-N 3.05Å; C545-Q547 VanDerWaalsContact C-N 3.32Å; C545-Q547 PolarHBondContact O-N 3.5Å; C545-Q548 PolarHBondContact O-N 2.83Å; C545-Q548 PolarHBondContact O-NE2 3.43Å
546	Q	81.7	Confident	78.1	Confident	124 Å²	124	69.1 Å²	69.1	58%	0.579	36%	0.355	S	S	*	.	H	α-helix	trans	-65.9	-34.7	-176.8	-74.1	-177	22.5	0	0	112.5	C515 E542 A543	C515-Q546 HydrophobicContact CB-CG 4.11Å; C515-Q546 PolarHBondContact SG-N 3.37Å; C515-Q546 VanDerWaalsContact SG-N 3.41Å; E542-Q546 HydrophobicContact CG-CG 4.36Å; E542-Q546 VanDerWaalsContact CG-NE2 3.3Å; E542-Q546 WeakPolarHBondContact O-CB 3.26Å; E542-Q546 VanDerWaalsContact O-CG 3.29Å; E542-Q546 WeakPolarHBondContact O-CG 3Å; E542-Q546 PolarHBondContact O-N 2.83Å; E542-Q546 PolarHBondContact OE1-NE2 2.94Å; A543-Q546 PolarHBondContact O-N 3.19Å
547	Q	78.9	Confident	77.7	Confident	116 Å²	116	70 Å²	70	54%	0.542	37%	0.365	S	S	.	.	H	α-helix	trans	-85.1	-14.6	179.2	-64	-177.2	67.5	0	0	113.3	A543 C545 V549	A543-Q547 VanDerWaalsContact O-CB 3.31Å; A543-Q547 WeakPolarHBondContact O-CB 3.32Å; A543-Q547 VanDerWaalsContact O-CG 3.32Å; A543-Q547 WeakPolarHBondContact O-CG 3.01Å; A543-Q547 PolarHBondContact O-N 3.45Å; C545-Q547 VanDerWaalsContact C-N 3.32Å; C545-Q547 PolarHBondContact O-N 3.5Å; Q547-V549 VanDerWaalsContact C-N 3.31Å; Q547-V549 HydrophobicContact CB-CB 4.44Å; Q547-V549 HydrophobicContact CB-CG2 4.19Å
548	Q	72.3	Confident	77.4	Confident	100 Å²	100	71.4 Å²	71.4	47%	0.467	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	41	-171.8	-61.6	-74.8	-74.7	0	0	112.7	T503 F504 A544 C545	T503-Q548 PolarHBondContact OG1-OE1 3.47Å; F504-Q548 HydrophobicContact CD2-CB 4.07Å; F504-Q548 HydrophobicContact CD2-CG 4.46Å; F504-Q548 HydrophobicContact CE2-CB 4.05Å; A544-Q548 WeakPolarHBondContact O-CA 3.4Å; A544-Q548 PolarHBondContact O-N 3.38Å; C545-Q548 PolarHBondContact O-N 2.83Å; C545-Q548 PolarHBondContact O-NE2 3.43Å
549	V	74.8	Confident	77	Confident	71 Å²	71	70 Å²	70	43%	0.43	36%	0.361	S	S	.	.			trans	-124.2	140.3	-179.7	178.1	0	0	0	0	109.2	A544 Q547 I551	A544-V549 WeakPolarHBondContact CA-O 3.3Å; A544-V549 WeakPolarHBondContact CB-O 3.47Å; A544-V549 PolarHBondContact O-N 3.22Å; A544-V549 VanDerWaalsContact O-N 3.15Å; Q547-V549 VanDerWaalsContact C-N 3.31Å; Q547-V549 HydrophobicContact CB-CB 4.44Å; Q547-V549 HydrophobicContact CB-CG2 4.19Å; V549-I551 HydrophobicContact CB-CG1 4.29Å; V549-I551 HydrophobicContact CG1-CG1 3.99Å; V549-I551 PolarHBondContact O-N 3.37Å
550	Q	67.8	Low	76.1	Confident	130 Å²	130	74.3 Å²	74.3	61%	0.607	38%	0.381	S	S	*	.			trans	-75.5	102.1	170.7	-177.3	168.2	-9.6	0	0	109.1	F504 E552	F504-Q550 HydrophobicContact CE1-CB 4.33Å; Q550-E552 HydrophobicContact CG-CG 4.24Å; Q550-E552 PolarHBondContact NE2-OE1 3.46Å
551	I	75.8	Confident	74.4	Confident	15 Å²	15	79.7 Å²	79.7	8%	0.077	42%	0.417	C	S	.	.			trans	-111.8	122.8	173.5	-50.3	172.5	0	0	0	106.3	Y534 L540 A544 V549	Y534-I551 HydrophobicContact CE2-CG2 4.15Å; L540-I551 HydrophobicContact CD1-CG2 4.47Å; L540-I551 HydrophobicContact CD2-CB 4.41Å; L540-I551 HydrophobicContact CD2-CG2 4.19Å; L540-I551 WeakPolarHBondContact CD2-O 3.06Å; L540-I551 HydrophobicContact CG-CG2 4.1Å; A544-I551 HydrophobicContact CB-CB 4.12Å; A544-I551 HydrophobicContact CB-CD1 4.34Å; A544-I551 HydrophobicContact CB-CG1 4.27Å; V549-I551 HydrophobicContact CB-CG1 4.29Å; V549-I551 HydrophobicContact CG1-CG1 3.99Å; V549-I551 PolarHBondContact O-N 3.37Å
552	E	77	Confident	72.7	Confident	112 Å²	112	76.2 Å²	76.2	52%	0.523	43%	0.425	S	S	.	.			trans	-110.7	156.8	-179	-63.9	-175.8	173.3	0	0	110.4	G528 S529 Q550 A554	G528-E552 CarbonylContact C-O 3.49Å; G528-E552 WeakPolarHBondContact CA-O 3.36Å; S529-E552 PolarHBondContact N-O 3.4Å; S529-E552 PolarHBondContact OG-N 2.82Å; Q550-E552 HydrophobicContact CG-CG 4.24Å; Q550-E552 PolarHBondContact NE2-OE1 3.46Å; E552-A554 PolarHBondContact O-N 3.15Å
553	E	80.2	Confident	70.7	Confident	102 Å²	102	83.8 Å²	83.8	48%	0.477	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	105	174.9	-175.5	175.4	151.7	0	0	109.7	V526 L540	V526-E553 HydrophobicContact CB-CG 4.15Å; V526-E553 HydrophobicContact CG1-CG 4.32Å; L540-E553 HydrophobicContact CD1-CB 4.47Å
554	A	72.4	Confident	69.3	Low	67 Å²	67	88.5 Å²	88.5	55%	0.554	49%	0.491	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	-29.6	177.9	0	0	0	0	0	112.2	C527 E552	C527-A554 PolarHBondContact O-N 3.23Å; E552-A554 PolarHBondContact O-N 3.15Å
555	R	75.6	Confident	66.9	Low	153 Å²	153	90.7 Å²	90.7	58%	0.577	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-162.8	144.1	174.7	-160.1	-176.4	-70.1	177.2	-1.1	111.3	C527	C527-R555 HydrophobicContact CB-CB 4.2Å; C527-R555 PolarHBondContact N-O 3.25Å; C527-R555 PolarHBondContact O-N 3.2Å
556	A	68.8	Low	64.7	Low	74 Å²	74	97 Å²	97	61%	0.612	56%	0.558	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73.3	133.9	162.4	0	0	0	0	0	110.6
557	G	73.1	Confident	62.6	Low	23 Å²	23	95 Å²	95	24%	0.237	57%	0.571	C	S	.	*	S	Bend	trans	105.1	167.9	-164.4	0	0	0	0	0	112.1	P525 V526 C527	P525-G557 CarbonylContact O-C 3.51Å; P525-G557 VanDerWaalsContact O-CA 3.23Å; P525-G557 WeakPolarHBondContact O-CA 3.26Å; P525-G557 PolarHBondContact O-N 2.87Å; V526-G557 CarbonylContact C-O 3.47Å; V526-G557 VanDerWaalsContact CA-O 3.26Å; V526-G557 WeakPolarHBondContact CA-O 3.11Å; C527-G557 PolarHBondContact N-O 3.46Å
558	P	73	Confident	60.5	Low	70 Å²	70	92.9 Å²	92.9	46%	0.455	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-65.1	157.2	174.8	30.9	-35.8	0	0	0	111.6	T533 E560	T533-P558 HydrophobicContact CG2-CB 3.81Å; T533-P558 WeakPolarHBondContact OG1-CA 3Å; P558-E560 PolarHBondContact O-N 3.33Å
559	C	72.6	Confident	59	Low	21 Å²	21	94 Å²	94	14%	0.142	60%	0.599	C	S	.	*	P	Polyproline II helix	trans	-66.7	131.3	163.6	-60.7	0	0	0	0	109.6	C527 G531 V532 T533	C527-C559 WeakPolarHBondContact CA-SG 3.05Å; C527-C559 HydrophobicContact CB-CB 3.99Å; C527-C559 WeakPolarHBondContact CB-SG 3.02Å; C527-C559 WeakPolarHBondContact SG-CA 3.48Å; C527-C559 WeakPolarHBondContact SG-CB 3.48Å; C527-C559 CovalentContact SG-SG 2.04Å; C527-C559 PolarHBondContact SG-SG 3.47Å; G531-C559 PolarHBondContact O-SG 3.17Å; G531-C559 VanDerWaalsContact O-SG 3.4Å; V532-C559 VanDerWaalsContact C-SG 3.53Å; V532-C559 PolarHBondContact O-SG 3.48Å; T533-C559 PolarHBondContact OG1-N 3.38Å
560	E	64.1	Low	57.1	Low	151 Å²	151	94.1 Å²	94.1	71%	0.706	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-63.9	122.9	176.4	-55.5	-99.5	123.7	0	0	109	P558 A562	P558-E560 PolarHBondContact O-N 3.33Å; E560-A562 PolarHBondContact O-N 3.17Å
561	P	49.3	Very low	56.2	Low	120 Å²	120	94.3 Å²	94.3	78%	0.779	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-65.7	131.1	170.9	28.3	-32.8	0	0	0	108.8	E563	P561-E563 PolarHBondContact O-N 2.83Å
562	A	42.8	Very low	54.4	Low	100 Å²	100	96.6 Å²	96.6	83%	0.826	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-59.3	125.4	-175.3	0	0	0	0	0	111.5	E560 C564	E560-A562 PolarHBondContact O-N 3.17Å; A562-C564 PolarHBondContact O-N 2.84Å
563	E	40.5	Very low	53.3	Low	186 Å²	186	100.8 Å²	100.8	87%	0.869	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-56.4	129.3	173.7	-70.8	-171.4	115.1	0	0	110.3	P561 G565	P561-E563 PolarHBondContact O-N 2.83Å; E563-G565 PolarHBondContact O-N 2.03Å
564	C	49.9	Very low	51.9	Low	114 Å²	114	101.7 Å²	101.7	77%	0.77	69%	0.685	S	S	*	*	S	Bend	trans	-75.8	66.1	175.5	-174.9	0	0	0	0	110.7	A562	A562-C564 PolarHBondContact O-N 2.84Å
565	G	32.5	Very low	51	Low	54 Å²	54	103.4 Å²	103.4	56%	0.557	69%	0.685	S	S	*	*	S	Bend	trans	-160.3	121	-175.4	0	0	0	0	0	115	E563	E563-G565 PolarHBondContact O-N 2.03Å
566	S	36.5	Very low	50.2	Low	134 Å²	134	98.7 Å²	98.7	94%	0.937	68%	0.679	S	S	*	*			trans	71.6	29.3	157.3	-54.8	0	0	0	0	119.7	G568	S566-G568 PolarHBondContact O-N 3Å
567	G	37.2	Very low	49.7	Very low	82 Å²	82	98.3 Å²	98.3	85%	0.845	67%	0.671	S	S	*	*			trans	-86.7	78.5	153	0	0	0	0	0	111.4	S569	G567-S569 PolarHBondContact O-N 3.29Å
568	G	34.9	Very low	49	Very low	72 Å²	72	102.8 Å²	102.8	74%	0.742	69%	0.686	S	S	*	*			trans	-76.8	109.6	-161.2	0	0	0	0	0	117.3	S566	S566-G568 PolarHBondContact O-N 3Å
569	S	39.7	Very low	48.5	Very low	123 Å²	123	102.3 Å²	102.3	86%	0.86	68%	0.677	S	S	*	*			trans	-169	112.4	147.2	-84.3	0	0	0	0	114.2	G567	G567-S569 PolarHBondContact O-N 3.29Å
570	G	36.4	Very low	48.1	Very low	73 Å²	73	105.8 Å²	105.8	75%	0.753	69%	0.691	S	S	*	*			trans	83.2	99.5	144.7	0	0	0	0	0	120.4
571	S	48.2	Very low	48.1	Very low	135 Å²	135	102.7 Å²	102.7	94%	0.944	68%	0.68	S	S	*	*			trans	59.6	91.9	139.3	-58.6	0	0	0	0	120.1
572	G	37.9	Very low	49.2	Very low	62 Å²	62	97.3 Å²	97.3	64%	0.639	64%	0.644	S	S	*	*			trans	-160.1	137.7	158.6	0	0	0	0	0	111
573	E	54.6	Low	50.5	Low	201 Å²	201	98.8 Å²	98.8	94%	0.939	63%	0.629	S	S	*	*			trans	-94.4	81.5	171.7	-72.7	179.1	122	0	0	108.7
574	D	49.7	Very low	51.6	Low	121 Å²	121	95.8 Å²	95.8	65%	0.647	61%	0.614	S	S	*	*			trans	-125.8	75.6	-169.6	-74.4	-71.9	0	0	0	113.3	A576	D574-A576 PolarHBondContact O-N 3.23Å
575	N	53.8	Low	52.5	Low	102 Å²	102	91.3 Å²	91.3	55%	0.545	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.3	-5.6	164.3	-68.8	-4.1	0	0	0	112.9	C577 E578 Q579	N575-C577 PolarHBondContact O-N 3.14Å; N575-E578 PolarHBondContact O-N 2.04Å; N575-Q579 PolarHBondContact O-N 3.33Å; N575-Q579 VanDerWaalsContact O-N 3.09Å
576	A	58.7	Low	54.2	Low	54 Å²	54	90 Å²	90	45%	0.446	57%	0.569	S	S	.	*	H	α-helix	trans	-53.3	-33.5	179.3	0	0	0	0	0	113.7	D574 E580	D574-A576 PolarHBondContact O-N 3.23Å; A576-E580 WeakPolarHBondContact O-CB 3.4Å; A576-E580 PolarHBondContact O-N 3.01Å
577	C	59.1	Low	55.9	Low	67 Å²	67	83.9 Å²	83.9	45%	0.453	53%	0.527	S	S	.	.	H	α-helix	trans	-66.7	-45.4	179	-168.5	0	0	0	0	112.2	N575 L581	N575-C577 PolarHBondContact O-N 3.14Å; C577-L581 WeakPolarHBondContact O-CB 3.31Å; C577-L581 PolarHBondContact O-N 3.19Å
578	E	58.3	Low	57.7	Low	116 Å²	116	84.8 Å²	84.8	54%	0.542	52%	0.516	S	S	.	.	H	α-helix	trans	-70.6	-37.2	177.7	-60.9	-163.3	162.8	0	0	111.8	N575 L581 C582 W589	N575-E578 PolarHBondContact O-N 2.04Å; E578-L581 PolarHBondContact O-N 2.71Å; E578-C582 WeakPolarHBondContact O-CB 3.31Å; E578-C582 PolarHBondContact O-N 2.88Å; E578-W589 HydrophobicContact CB-CH2 3.49Å; E578-W589 VanDerWaalsContact CB-CH2 3.49Å; E578-W589 HydrophobicContact CB-CZ2 4.44Å; E578-W589 HydrophobicContact CB-CZ3 3.82Å; E578-W589 WeakPolarHBondContact O-CZ3 2.99Å
579	Q	62.7	Low	59.5	Low	60 Å²	60	83 Å²	83	28%	0.28	49%	0.487	S	S	.	.	H	α-helix	trans	-61.6	-43.4	175.6	177.6	171.3	99.8	0	0	112.3	N575 R583 W589	N575-Q579 PolarHBondContact O-N 3.33Å; N575-Q579 VanDerWaalsContact O-N 3.09Å; Q579-R583 WeakPolarHBondContact O-CG 3.44Å; Q579-R583 PolarHBondContact O-N 3.4Å; Q579-W589 HydrophobicContact CB-CD2 3.92Å; Q579-W589 HydrophobicContact CB-CE3 4.28Å; Q579-W589 HydrophobicContact CB-CG 4.1Å; Q579-W589 HydrophobicContact CG-CB 3.93Å; Q579-W589 HydrophobicContact CG-CD2 4.18Å; Q579-W589 HydrophobicContact CG-CG 3.81Å
580	E	63.6	Low	61.1	Low	94 Å²	94	80.8 Å²	80.8	44%	0.439	47%	0.466	S	S	.	.	H	α-helix	trans	-76.2	-34.4	-179.4	-158.2	64.3	-171.2	0	0	111.8	A576 R583 Q584	A576-E580 WeakPolarHBondContact O-CB 3.4Å; A576-E580 PolarHBondContact O-N 3.01Å; E580-R583 WeakPolarHBondContact O-CB 3.41Å; E580-R583 PolarHBondContact O-N 3.34Å; E580-R583 WeakPolarHBondContact OE2-CD 3.32Å; E580-R583 IonicContact OE2-NH1 3.09Å; E580-R583 PolarHBondContact OE2-NH1 2.84Å; E580-R583 VanDerWaalsContact OE2-NH1 3.09Å; E580-Q584 WeakPolarHBondContact O-CG 3.48Å; E580-Q584 PolarHBondContact O-N 3.19Å
581	L	64.4	Low	62.3	Low	87 Å²	87	83.9 Å²	83.9	46%	0.455	46%	0.46	S	S	.	.	H	α-helix	trans	-63.7	-41.9	172	-172.6	65.5	0	0	0	111.9	C577 E578 R583 Q584 H585	C577-L581 WeakPolarHBondContact O-CB 3.31Å; C577-L581 PolarHBondContact O-N 3.19Å; E578-L581 PolarHBondContact O-N 2.71Å; L581-R583 VanDerWaalsContact C-N 3.31Å; L581-R583 PolarHBondContact O-N 2.92Å; L581-Q584 PolarHBondContact O-N 3.28Å; L581-H585 WeakPolarHBondContact CD1-NE2 3.33Å; L581-H585 PolarHBondContact O-CD2 3.44Å; L581-H585 PolarHBondContact O-N 2.65Å; L581-H585 VanDerWaalsContact O-N 3.08Å
582	C	71.8	Confident	62.8	Low	6 Å²	6	84.8 Å²	84.8	4%	0.041	46%	0.455	C	S	.	.	H	α-helix	trans	-55	-47.1	171.9	177.7	0	0	0	0	111.5	E578 H585 G586 G587 W589 C598	E578-C582 WeakPolarHBondContact O-CB 3.31Å; E578-C582 PolarHBondContact O-N 2.88Å; C582-H585 PolarHBondContact O-N 2.92Å; C582-G586 PolarHBondContact O-N 3.32Å; C582-G587 PolarHBondContact O-N 3.04Å; C582-W589 HydrophobicContact CB-CE3 3.69Å; C582-W589 HydrophobicContact CB-CZ3 4.17Å; C582-C598 HydrophobicContact CB-CB 3.85Å; C582-C598 WeakPolarHBondContact CB-SG 3.36Å; C582-C598 VanDerWaalsContact SG-CA 3.54Å; C582-C598 WeakPolarHBondContact SG-CB 3.27Å; C582-C598 CovalentContact SG-SG 2.03Å; C582-C598 PolarHBondContact SG-SG 3.4Å
583	R	69.7	Low	64.3	Low	132 Å²	132	83.5 Å²	83.5	50%	0.498	44%	0.436	S	S	.	.	H	α-helix	trans	-64	-38.5	176.5	-76	173.8	169.7	152.9	4.2	113.3	Q579 E580 L581 G586	Q579-R583 WeakPolarHBondContact O-CG 3.44Å; Q579-R583 PolarHBondContact O-N 3.4Å; E580-R583 WeakPolarHBondContact O-CB 3.41Å; E580-R583 PolarHBondContact O-N 3.34Å; E580-R583 WeakPolarHBondContact OE2-CD 3.32Å; E580-R583 IonicContact OE2-NH1 3.09Å; E580-R583 PolarHBondContact OE2-NH1 2.84Å; E580-R583 VanDerWaalsContact OE2-NH1 3.09Å; L581-R583 VanDerWaalsContact C-N 3.31Å; L581-R583 PolarHBondContact O-N 2.92Å; R583-G586 VanDerWaalsContact O-CA 3.32Å; R583-G586 WeakPolarHBondContact O-CA 3.18Å; R583-G586 PolarHBondContact O-N 3.49Å; R583-G586 VanDerWaalsContact O-N 3.15Å
584	Q	65.1	Low	64.4	Low	122 Å²	122	83.6 Å²	83.6	57%	0.57	44%	0.436	S	S	*	.	H	α-helix	trans	-64.1	-45.3	177.8	-75.4	-177.9	6.7	0	0	112	E580 L581 G586 R630	E580-Q584 WeakPolarHBondContact O-CG 3.48Å; E580-Q584 PolarHBondContact O-N 3.19Å; L581-Q584 PolarHBondContact O-N 3.28Å; Q584-G586 PolarHBondContact O-N 3Å; Q584-R630 PolarHBondContact O-NH2 2.84Å
585	H	68.3	Low	64.7	Low	20 Å²	20	86.1 Å²	86.1	9%	0.093	45%	0.45	C	S	.	.	H	α-helix	trans	-67.9	-26.1	172.4	-61.5	-55.3	0	0	0	112.3	L581 C582 R630	L581-H585 WeakPolarHBondContact CD1-NE2 3.33Å; L581-H585 PolarHBondContact O-CD2 3.44Å; L581-H585 PolarHBondContact O-N 2.65Å; L581-H585 VanDerWaalsContact O-N 3.08Å; C582-H585 PolarHBondContact O-N 2.92Å; H585-R630 VanDerWaalsContact C-NH2 3.26Å; H585-R630 VanDerWaalsContact O-CZ 3.24Å; H585-R630 PolarHBondContact O-NE 3.25Å; H585-R630 PolarHBondContact O-NH2 2.93Å
586	G	67.3	Low	65	Low	27 Å²	27	82.4 Å²	82.4	28%	0.278	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	119.6	7.2	165.6	0	0	0	0	0	115.1	C582 R583 Q584 F602	C582-G586 PolarHBondContact O-N 3.32Å; R583-G586 VanDerWaalsContact O-CA 3.32Å; R583-G586 WeakPolarHBondContact O-CA 3.18Å; R583-G586 PolarHBondContact O-N 3.49Å; R583-G586 VanDerWaalsContact O-N 3.15Å; Q584-G586 PolarHBondContact O-N 3Å; G586-F602 WeakPolarHBondContact O-CZ 3.43Å
587	G	73.3	Confident	65.4	Low	6 Å²	6	82 Å²	82	6%	0.062	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-75.8	163.8	177.8	0	0	0	0	0	113.1	C582 V599 C631	C582-G587 PolarHBondContact O-N 3.04Å; G587-V599 WeakPolarHBondContact CA-O 3.06Å; G587-C631 WeakPolarHBondContact CA-SG 3.32Å; G587-C631 PolarHBondContact N-SG 3.33Å; G587-C631 VanDerWaalsContact N-SG 3.38Å
588	V	73.9	Confident	66	Low	101 Å²	101	80 Å²	80	61%	0.612	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	128.8	168	-178	0	0	0	0	107.7	V599	V588-V599 PolarHBondContact N-O 2.03Å; V588-V599 PolarHBondContact O-N 3.2Å
589	W	72.9	Confident	66.9	Low	34 Å²	34	76.8 Å²	76.8	13%	0.129	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	127.2	173.7	-168.6	-92	0	0	0	109.8	E578 Q579 C582 E591 P597 C598	E578-W589 HydrophobicContact CB-CH2 3.49Å; E578-W589 VanDerWaalsContact CB-CH2 3.49Å; E578-W589 HydrophobicContact CB-CZ2 4.44Å; E578-W589 HydrophobicContact CB-CZ3 3.82Å; E578-W589 WeakPolarHBondContact O-CZ3 2.99Å; Q579-W589 HydrophobicContact CB-CD2 3.92Å; Q579-W589 HydrophobicContact CB-CE3 4.28Å; Q579-W589 HydrophobicContact CB-CG 4.1Å; Q579-W589 HydrophobicContact CG-CB 3.93Å; Q579-W589 HydrophobicContact CG-CD2 4.18Å; Q579-W589 HydrophobicContact CG-CG 3.81Å; C582-W589 HydrophobicContact CB-CE3 3.69Å; C582-W589 HydrophobicContact CB-CZ3 4.17Å; W589-E591 VanDerWaalsContact NE1-CG 3.32Å; W589-P597 VanDerWaalsContact CA-O 3.3Å; W589-P597 WeakPolarHBondContact CA-O 3.47Å; W589-P597 HydrophobicContact CD2-CB 4.26Å; W589-P597 VanDerWaalsContact CD2-O 3.28Å; W589-P597 HydrophobicContact CE3-CB 4.37Å; W589-P597 VanDerWaalsContact CE3-O 3.3Å; W589-P597 HydrophobicContact CH2-CB 3.89Å; W589-P597 HydrophobicContact CH2-CG 3.68Å; W589-P597 HydrophobicContact CZ2-CB 3.72Å; W589-P597 HydrophobicContact CZ2-CG 3.94Å; W589-P597 HydrophobicContact CZ3-CB 4.21Å; W589-P597 HydrophobicContact CZ3-CG 4.11Å; W589-C598 HydrophobicContact CE3-CB 4.19Å; W589-C598 HydrophobicContact CZ3-CB 4.34Å
590	D	73.1	Confident	67.5	Low	77 Å²	77	75.1 Å²	75.1	41%	0.412	40%	0.398	S	S	.	.			trans	-141.6	111.9	179.9	-169	-17.6	0	0	0	109.1	D592 S593 P597 V599	D590-D592 VanDerWaalsContact C-N 3.3Å; D590-D592 PolarHBondContact O-N 2.95Å; D590-D592 PolarHBondContact OD1-N 2.75Å; D590-S593 WeakPolarHBondContact O-CB 3.39Å; D590-P597 PolarHBondContact N-O 2.86Å; D590-P597 VanDerWaalsContact O-CA 3.28Å; D590-P597 WeakPolarHBondContact O-CA 3.49Å; D590-V599 HydrophobicContact CB-CG2 4Å
591	E	61.3	Low	67.7	Low	137 Å²	137	77.2 Å²	77.2	64%	0.64	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-13.7	-172.1	-61.3	-173.6	122.4	0	0	113.2	W589	W589-E591 VanDerWaalsContact NE1-CG 3.32Å
592	D	60.1	Low	67.9	Low	155 Å²	155	75.7 Å²	75.7	83%	0.829	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	8.3	179.6	-71.1	-40.9	0	0	0	113	D590	D590-D592 VanDerWaalsContact C-N 3.3Å; D590-D592 PolarHBondContact O-N 2.95Å; D590-D592 PolarHBondContact OD1-N 2.75Å
593	S	68	Low	67.6	Low	34 Å²	34	79.7 Å²	79.7	24%	0.238	43%	0.43	C	S	.	.			trans	-79.1	118.8	-176.2	171	0	0	0	0	113.9	D590 D595 G596	D590-S593 WeakPolarHBondContact O-CB 3.39Å; S593-D595 VanDerWaalsContact C-N 3.28Å; S593-D595 PolarHBondContact O-N 2.94Å; S593-G596 VanDerWaalsContact CB-O 3.25Å; S593-G596 WeakPolarHBondContact CB-O 3.44Å; S593-G596 PolarHBondContact O-N 2.95Å; S593-G596 VanDerWaalsContact O-N 3.11Å; S593-G596 PolarHBondContact OG-O 3.18Å
594	E	57.8	Low	67.7	Low	204 Å²	204	73.7 Å²	73.7	95%	0.953	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-23.5	179.2	-64.8	-167	131.3	0	0	114.1
595	D	56.1	Low	67.7	Low	173 Å²	173	76.9 Å²	76.9	93%	0.925	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	0.9	175.9	-72.5	-55.5	0	0	0	113.1	S593	S593-D595 VanDerWaalsContact C-N 3.28Å; S593-D595 PolarHBondContact O-N 2.94Å
596	G	60.1	Low	67.3	Low	24 Å²	24	81.1 Å²	81.1	25%	0.247	46%	0.455	C	S	.	.			trans	109.5	163.3	178.5	0	0	0	0	0	114.2	S593 C598	S593-G596 VanDerWaalsContact CB-O 3.25Å; S593-G596 WeakPolarHBondContact CB-O 3.44Å; S593-G596 PolarHBondContact O-N 2.95Å; S593-G596 VanDerWaalsContact O-N 3.11Å; S593-G596 PolarHBondContact OG-O 3.18Å; G596-C598 VanDerWaalsContact C-N 3.3Å; G596-C598 PolarHBondContact O-N 2.8Å; G596-C598 VanDerWaalsContact O-N 3.08Å
597	P	67.3	Low	67.1	Low	46 Å²	46	83 Å²	83	30%	0.299	46%	0.461	S	S	.	.	S	Bend	trans	-79.5	3.5	-155.5	30	-37.7	0	0	0	116.9	W589 D590	W589-P597 VanDerWaalsContact CA-O 3.3Å; W589-P597 WeakPolarHBondContact CA-O 3.47Å; W589-P597 HydrophobicContact CD2-CB 4.26Å; W589-P597 VanDerWaalsContact CD2-O 3.28Å; W589-P597 HydrophobicContact CE3-CB 4.37Å; W589-P597 VanDerWaalsContact CE3-O 3.3Å; W589-P597 HydrophobicContact CH2-CB 3.89Å; W589-P597 HydrophobicContact CH2-CG 3.68Å; W589-P597 HydrophobicContact CZ2-CB 3.72Å; W589-P597 HydrophobicContact CZ2-CG 3.94Å; W589-P597 HydrophobicContact CZ3-CB 4.21Å; W589-P597 HydrophobicContact CZ3-CG 4.11Å; D590-P597 PolarHBondContact N-O 2.86Å; D590-P597 VanDerWaalsContact O-CA 3.28Å; D590-P597 WeakPolarHBondContact O-CA 3.49Å
598	C	71.1	Confident	66.4	Low	24 Å²	24	90.3 Å²	90.3	16%	0.162	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	107.8	179.4	-176.4	0	0	0	0	110.5	C582 W589 G596	C582-C598 HydrophobicContact CB-CB 3.85Å; C582-C598 WeakPolarHBondContact CB-SG 3.36Å; C582-C598 VanDerWaalsContact SG-CA 3.54Å; C582-C598 WeakPolarHBondContact SG-CB 3.27Å; C582-C598 CovalentContact SG-SG 2.03Å; C582-C598 PolarHBondContact SG-SG 3.4Å; W589-C598 HydrophobicContact CE3-CB 4.19Å; W589-C598 HydrophobicContact CZ3-CB 4.34Å; G596-C598 VanDerWaalsContact C-N 3.3Å; G596-C598 PolarHBondContact O-N 2.8Å; G596-C598 VanDerWaalsContact O-N 3.08Å
599	V	76.3	Confident	66.2	Low	50 Å²	50	94.2 Å²	94.2	30%	0.303	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	120.8	-169.5	-176.4	0	0	0	0	111	G587 V588 D590 D601	G587-V599 WeakPolarHBondContact CA-O 3.06Å; V588-V599 PolarHBondContact N-O 2.03Å; V588-V599 PolarHBondContact O-N 3.2Å; D590-V599 HydrophobicContact CB-CG2 4Å; V599-D601 HydrophobicContact CG1-CB 4.42Å
600	C	75.3	Confident	66.2	Low	24 Å²	24	95.7 Å²	95.7	16%	0.162	52%	0.522	C	S	.	.			trans	-101.9	47.1	-173.6	-60.8	0	0	0	0	113.8	F602 K628 C631 E632	C600-F602 VanDerWaalsContact C-N 3.34Å; C600-F602 HydrophobicContact CB-CD2 4.47Å; C600-F602 HydrophobicContact CB-CE2 4.48Å; C600-F602 WeakPolarHBondContact O-CD2 3.12Å; C600-F602 PolarHBondContact O-N 3.34Å; C600-K628 PolarHBondContact O-NZ 3.45Å; C600-C631 VanDerWaalsContact CA-SG 3.6Å; C600-C631 HydrophobicContact CB-CB 3.76Å; C600-C631 WeakPolarHBondContact CB-SG 3.46Å; C600-C631 WeakPolarHBondContact SG-CB 3.14Å; C600-C631 CovalentContact SG-SG 2.04Å; C600-C631 PolarHBondContact SG-SG 3.04Å; C600-E632 HydrophobicContact CB-CG 3.89Å
601	D	69	Low	66.6	Low	138 Å²	138	94.6 Å²	94.6	74%	0.738	52%	0.519	S	S	*	.			trans	-79.3	73	-174.6	-167.7	22	0	0	0	114.5	V599	V599-D601 HydrophobicContact CG1-CB 4.42Å
602	F	67.8	Low	67.6	Low	56 Å²	56	88.1 Å²	88.1	25%	0.246	49%	0.488	C	S	.	.			trans	-90.2	108.7	172.6	-65	-90.3	0	0	0	112.5	G586 C600 C604 K628 C631	G586-F602 WeakPolarHBondContact O-CZ 3.43Å; C600-F602 VanDerWaalsContact C-N 3.34Å; C600-F602 HydrophobicContact CB-CD2 4.47Å; C600-F602 HydrophobicContact CB-CE2 4.48Å; C600-F602 WeakPolarHBondContact O-CD2 3.12Å; C600-F602 PolarHBondContact O-N 3.34Å; F602-C604 PolarHBondContact O-N 3.49Å; F602-K628 HydrophobicContact CB-CB 3.86Å; F602-K628 HydrophobicContact CB-CD 4.01Å; F602-K628 HydrophobicContact CB-CG 3.95Å; F602-K628 HydrophobicContact CD2-CB 3.93Å; F602-K628 HydrophobicContact CD2-CG 3.94Å; F602-K628 HydrophobicContact CG-CB 4.07Å; F602-K628 HydrophobicContact CG-CG 4.33Å; F602-C631 HydrophobicContact CE2-CB 3.77Å
603	S	66.2	Low	68.7	Low	90 Å²	90	81.3 Å²	81.3	63%	0.629	45%	0.453	S	S	*	.			trans	-86.1	77.2	173.3	-168.4	0	0	0	0	112.6	Q605	S603-Q605 PolarHBondContact O-N 3.11Å
604	C	72.3	Confident	69.2	Low	6 Å²	6	79.8 Å²	79.8	4%	0.041	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-75.3	0.6	-175.3	-58.5	0	0	0	0	115.8	F602 S606 V607 C624	F602-C604 PolarHBondContact O-N 3.49Å; C604-S606 VanDerWaalsContact C-N 3.27Å; C604-S606 PolarHBondContact O-N 2.86Å; C604-V607 PolarHBondContact O-N 3.09Å; C604-C624 WeakPolarHBondContact CA-SG 3.48Å; C604-C624 HydrophobicContact CB-CB 3.75Å; C604-C624 WeakPolarHBondContact CB-SG 3.48Å; C604-C624 WeakPolarHBondContact SG-CB 3.3Å; C604-C624 PolarHBondContact SG-O 2.97Å; C604-C624 VanDerWaalsContact SG-O 3.35Å; C604-C624 CovalentContact SG-SG 2.04Å; C604-C624 PolarHBondContact SG-SG 2.91Å
605	Q	64.4	Low	70.2	Confident	188 Å²	188	72.2 Å²	72.2	88%	0.879	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-69.3	-19.8	-172.1	-62.4	-173	8.6	0	0	114.4	S603	S603-Q605 PolarHBondContact O-N 3.11Å
606	S	60.8	Low	71.4	Confident	110 Å²	110	67.3 Å²	67.3	77%	0.769	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-86.6	-8	179.2	55.2	0	0	0	0	114	C604	C604-S606 VanDerWaalsContact C-N 3.27Å; C604-S606 PolarHBondContact O-N 2.86Å
607	V	61.4	Low	72.1	Confident	66 Å²	66	68.5 Å²	68.5	40%	0.4	40%	0.398	S	S	.	.	S	Bend	trans	-89.3	132.7	-173.4	-172.9	0	0	0	0	110.7	C604 T622 C624	C604-V607 PolarHBondContact O-N 3.09Å; V607-T622 HydrophobicContact CB-CG2 4.28Å; V607-T622 HydrophobicContact CG1-CG2 4.04Å; V607-C624 HydrophobicContact CG2-CB 4.28Å
608	L	59.8	Low	72.7	Confident	159 Å²	159	69.8 Å²	69.8	83%	0.832	41%	0.405	S	S	*	.			trans	-59.1	138.9	174.1	-79.3	162.1	0	0	0	110.9	S610 T622	L608-S610 PolarHBondContact O-N 2.85Å; L608-T622 WeakPolarHBondContact O-CG2 3.1Å
609	K	69.6	Low	73.4	Confident	184 Å²	184	71.8 Å²	71.8	80%	0.8	42%	0.417	S	S	*	.			trans	-72.1	82.4	-174.9	-70.1	-173.3	176.5	-176.7	0	112.8	P611	K609-P611 WeakPolarHBondContact O-CD 3.08Å
610	S	72.8	Confident	73.7	Confident	64 Å²	64	71.1 Å²	71.1	45%	0.448	41%	0.409	S	S	.	.			trans	-100.8	94	166.3	56.2	0	0	0	0	109.5	L608 S621 T622	L608-S610 PolarHBondContact O-N 2.85Å; S610-S621 CarbonylContact C-O 3.25Å; S610-T622 WeakPolarHBondContact O-CA 3.43Å
611	P	80.9	Confident	73.9	Confident	54 Å²	54	72.5 Å²	72.5	35%	0.351	42%	0.419	S	S	.	.			trans	-66.6	148.5	-176.7	27.9	-34.9	0	0	0	111.6	K609 T619 Y620 G643	K609-P611 WeakPolarHBondContact O-CD 3.08Å; P611-T619 HydrophobicContact CB-CG2 4.2Å; P611-Y620 CarbonylContact C-O 3.55Å; P611-Y620 WeakPolarHBondContact CA-O 3.39Å; P611-Y620 WeakPolarHBondContact CB-O 3.41Å; P611-G643 CarbonylContact O-C 3.55Å; P611-G643 WeakPolarHBondContact O-CA 3.41Å; P611-G643 PolarHBondContact O-N 3Å
612	V	82.6	Confident	74.5	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.006	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	149.6	179.9	-62.4	0	0	0	0	110.6	T619 Y620 E623 L626 V639 G643	V612-T619 WeakPolarHBondContact O-CA 3.42Å; V612-Y620 PolarHBondContact N-O 2.95Å; V612-Y620 PolarHBondContact O-N 3.38Å; V612-E623 HydrophobicContact CG1-CB 4.37Å; V612-E623 HydrophobicContact CG2-CB 4.47Å; V612-L626 HydrophobicContact CG2-CB 4.22Å; V612-L626 HydrophobicContact CG2-CD1 3.89Å; V612-V639 HydrophobicContact CB-CG1 4.04Å; V612-V639 HydrophobicContact CB-CG2 4.09Å; V612-V639 HydrophobicContact CG1-CG1 4.28Å; V612-V639 HydrophobicContact CG1-CG2 4.31Å; V612-V639 HydrophobicContact CG2-CG2 4.09Å; V612-G643 CarbonylContact C-O 3.54Å; V612-G643 VanDerWaalsContact CA-O 3.28Å; V612-G643 WeakPolarHBondContact CA-O 3.36Å
613	C	84.4	Confident	75.1	Confident	13 Å²	13	66.8 Å²	66.8	9%	0.088	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	126.1	174.3	-172.8	0	0	0	0	109.7	V639 A640 A641 G643 C645	C613-V639 CarbonylContact O-C 3.53Å; C613-V639 WeakPolarHBondContact O-CA 3.4Å; C613-A640 PolarHBondContact O-N 3.29Å; C613-A641 HydrophobicContact CB-CB 3.99Å; C613-A641 PolarHBondContact N-O 3Å; C613-A641 PolarHBondContact O-N 3.05Å; C613-G643 PolarHBondContact N-O 2.96Å; C613-C645 WeakPolarHBondContact CA-SG 3.45Å; C613-C645 HydrophobicContact CB-CB 3.99Å; C613-C645 WeakPolarHBondContact CB-SG 3.48Å; C613-C645 WeakPolarHBondContact SG-CA 3.44Å; C613-C645 WeakPolarHBondContact SG-CB 3.2Å; C613-C645 CovalentContact SG-SG 2.03Å; C613-C645 PolarHBondContact SG-SG 3.07Å
614	G	78	Confident	75.8	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.01	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	163.4	173.8	0	0	0	0	0	113.2	D616 G617 V618 Y638	G614-D616 VanDerWaalsContact CA-OD1 3.32Å; G614-D616 WeakPolarHBondContact CA-OD1 3.11Å; G614-D616 PolarHBondContact O-N 2.05Å; G614-G617 PolarHBondContact O-N 3.27Å; G614-V618 PolarHBondContact N-O 2.88Å; G614-Y638 CarbonylContact C-O 3.27Å; G614-Y638 WeakPolarHBondContact CA-O 3.36Å
615	S	79.3	Confident	76.3	Confident	45 Å²	45	67 Å²	67	32%	0.315	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-17.8	171.2	45.1	0	0	0	0	113.6	G617 Y638	S615-G617 VanDerWaalsContact C-N 3.31Å; S615-Y638 PolarHBondContact N-O 3.14Å; S615-Y638 PolarHBondContact OG-N 3.32Å; S615-Y638 VanDerWaalsContact OG-N 3.12Å
616	D	80.3	Confident	77.2	Confident	71 Å²	71	58.2 Å²	58.2	38%	0.38	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-4.3	170.2	64.1	-13.4	0	0	0	114.1	G614 V618 Y620 L637	G614-D616 VanDerWaalsContact CA-OD1 3.32Å; G614-D616 WeakPolarHBondContact CA-OD1 3.11Å; G614-D616 PolarHBondContact O-N 2.05Å; D616-V618 VanDerWaalsContact C-N 3.29Å; D616-V618 HydrophobicContact CB-CG2 4.39Å; D616-V618 PolarHBondContact O-N 3.21Å; D616-V618 WeakPolarHBondContact OD1-CB 3.41Å; D616-V618 PolarHBondContact OD1-N 2.69Å; D616-V618 VanDerWaalsContact OD2-CB 3.29Å; D616-V618 WeakPolarHBondContact OD2-CB 3.45Å; D616-V618 WeakPolarHBondContact OD2-CG2 3.18Å; D616-Y620 PolarHBondContact OD2-OH 2.9Å; D616-Y620 VanDerWaalsContact OD2-OH 3.05Å; D616-L637 HydrophobicContact CB-CD2 3.88Å
617	G	75.3	Confident	78	Confident	49 Å²	49	56.9 Å²	56.9	51%	0.505	32%	0.321	S	S	.	.	S	Bend	trans	76.6	10.3	-174.4	0	0	0	0	0	114.5	G614 S615 C645	G614-G617 PolarHBondContact O-N 3.27Å; S615-G617 VanDerWaalsContact C-N 3.31Å; G617-C645 PolarHBondContact O-SG 3.27Å
618	V	80.4	Confident	79.1	Confident	73 Å²	73	55.9 Å²	55.9	44%	0.442	31%	0.312	S	S	.	.			trans	-91.4	140.8	177.6	-179	0	0	0	0	110.5	G614 D616 Y620 C645	G614-V618 PolarHBondContact N-O 2.88Å; D616-V618 VanDerWaalsContact C-N 3.29Å; D616-V618 HydrophobicContact CB-CG2 4.39Å; D616-V618 PolarHBondContact O-N 3.21Å; D616-V618 WeakPolarHBondContact OD1-CB 3.41Å; D616-V618 PolarHBondContact OD1-N 2.69Å; D616-V618 VanDerWaalsContact OD2-CB 3.29Å; D616-V618 WeakPolarHBondContact OD2-CB 3.45Å; D616-V618 WeakPolarHBondContact OD2-CG2 3.18Å; V618-Y620 HydrophobicContact CB-CE2 3.99Å; V618-Y620 HydrophobicContact CG1-CE2 4.21Å; V618-Y620 WeakPolarHBondContact O-CD2 3.5Å; V618-C645 VanDerWaalsContact C-SG 3.52Å; V618-C645 PolarHBondContact O-SG 3.37Å; V618-C645 VanDerWaalsContact O-SG 3.42Å
619	T	85.3	Confident	80	Confident	66 Å²	66	49.3 Å²	49.3	41%	0.405	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	112.5	174.8	-63.7	0	0	0	0	111.1	P611 V612 A644 C645	P611-T619 HydrophobicContact CB-CG2 4.2Å; V612-T619 WeakPolarHBondContact O-CA 3.42Å; T619-A644 HydrophobicContact CG2-CB 3.65Å; T619-C645 PolarHBondContact OG1-N 3.06Å; T619-C645 PolarHBondContact OG1-SG 3.03Å
620	Y	82.8	Confident	80.7	Confident	35 Å²	35	43 Å²	43	14%	0.137	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	144.2	173	-65.9	-90.1	0	0	0	110.7	P611 V612 D616 V618 T622 H625 L626 A629	P611-Y620 CarbonylContact C-O 3.55Å; P611-Y620 WeakPolarHBondContact CA-O 3.39Å; P611-Y620 WeakPolarHBondContact CB-O 3.41Å; V612-Y620 PolarHBondContact N-O 2.95Å; V612-Y620 PolarHBondContact O-N 3.38Å; D616-Y620 PolarHBondContact OD2-OH 2.9Å; D616-Y620 VanDerWaalsContact OD2-OH 3.05Å; V618-Y620 HydrophobicContact CB-CE2 3.99Å; V618-Y620 HydrophobicContact CG1-CE2 4.21Å; V618-Y620 WeakPolarHBondContact O-CD2 3.5Å; Y620-T622 PolarHBondContact O-N 2.94Å; Y620-H625 HydrophobicContact CD1-CB 4.46Å; Y620-L626 HydrophobicContact CD1-CB 4.08Å; Y620-L626 HydrophobicContact CD2-CB 3.89Å; Y620-L626 HydrophobicContact CD2-CD1 3.77Å; Y620-L626 HydrophobicContact CD2-CG 3.87Å; Y620-L626 HydrophobicContact CE2-CB 4.44Å; Y620-L626 HydrophobicContact CE2-CD1 4.2Å; Y620-L626 HydrophobicContact CE2-CG 4.08Å; Y620-L626 HydrophobicContact CG-CB 3.67Å; Y620-L626 HydrophobicContact CG-CD1 4.38Å; Y620-L626 HydrophobicContact CG-CG 4.19Å; Y620-A629 HydrophobicContact CE1-CB 3.57Å
621	S	78.6	Confident	81	Confident	54 Å²	54	40.1 Å²	40.1	38%	0.378	23%	0.231	S	C	.	.	S	Bend	trans	-73.9	-24.9	-174.3	56.1	0	0	0	0	114.2	S610 H625	S610-S621 CarbonylContact C-O 3.25Å; S621-H625 PolarHBondContact OG-CD2 2.8Å
622	T	80.9	Confident	80.9	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.018	24%	0.241	C	C	.	.	S	Bend	trans	-148.3	161.4	165.9	63.5	0	0	0	0	109.6	V607 L608 S610 Y620 C624 H625 L626	V607-T622 HydrophobicContact CB-CG2 4.28Å; V607-T622 HydrophobicContact CG1-CG2 4.04Å; L608-T622 WeakPolarHBondContact O-CG2 3.1Å; S610-T622 WeakPolarHBondContact O-CA 3.43Å; Y620-T622 PolarHBondContact O-N 2.94Å; T622-C624 PolarHBondContact O-N 3.19Å; T622-C624 PolarHBondContact OG1-N 2.78Å; T622-H625 PolarHBondContact O-N 2.9Å; T622-H625 PolarHBondContact OG1-CD2 3.2Å; T622-H625 PolarHBondContact OG1-N 3.41Å; T622-L626 PolarHBondContact O-N 3.22Å
623	E	80.4	Confident	80.5	Confident	71 Å²	71	45.7 Å²	45.7	33%	0.332	26%	0.261	S	S	.	.	H	α-helix	trans	-58.6	-28.7	170.8	-166	-173.3	124.1	0	0	112.8	V612 L626 K627 V639	V612-E623 HydrophobicContact CG1-CB 4.37Å; V612-E623 HydrophobicContact CG2-CB 4.47Å; E623-L626 PolarHBondContact O-N 2.86Å; E623-K627 HydrophobicContact CG-CD 4.42Å; E623-K627 WeakPolarHBondContact O-CG 3.36Å; E623-K627 PolarHBondContact O-N 2.88Å; E623-K627 WeakPolarHBondContact OE1-CE 3.3Å; E623-K627 IonicContact OE1-NZ 2.8Å; E623-K627 PolarHBondContact OE1-NZ 3.04Å; E623-V639 HydrophobicContact CG-CG2 3.97Å
624	C	81.9	Confident	79.8	Confident	29 Å²	29	52.5 Å²	52.5	20%	0.196	29%	0.285	C	S	.	.	H	α-helix	trans	-62.9	-42.1	171.9	-178.1	0	0	0	0	111.7	C604 V607 T622 L626 K627 K628	C604-C624 WeakPolarHBondContact CA-SG 3.48Å; C604-C624 HydrophobicContact CB-CB 3.75Å; C604-C624 WeakPolarHBondContact CB-SG 3.48Å; C604-C624 WeakPolarHBondContact SG-CB 3.3Å; C604-C624 PolarHBondContact SG-O 2.97Å; C604-C624 VanDerWaalsContact SG-O 3.35Å; C604-C624 CovalentContact SG-SG 2.04Å; C604-C624 PolarHBondContact SG-SG 2.91Å; V607-C624 HydrophobicContact CG2-CB 4.28Å; T622-C624 PolarHBondContact O-N 3.19Å; T622-C624 PolarHBondContact OG1-N 2.78Å; C624-L626 PolarHBondContact O-N 3.17Å; C624-K627 PolarHBondContact O-N 2.95Å; C624-K628 PolarHBondContact O-N 3.46Å
625	H	82.6	Confident	79.4	Confident	72 Å²	72	58.2 Å²	58.2	33%	0.333	31%	0.311	S	S	.	.	H	α-helix	trans	-67.9	-33.3	177	-81	-72.3	0	0	0	112.9	Y620 S621 T622 A629	Y620-H625 HydrophobicContact CD1-CB 4.46Å; S621-H625 PolarHBondContact OG-CD2 2.8Å; T622-H625 PolarHBondContact O-N 2.9Å; T622-H625 PolarHBondContact OG1-CD2 3.2Å; T622-H625 PolarHBondContact OG1-N 3.41Å; H625-A629 PolarHBondContact O-N 2.75Å; H625-A629 VanDerWaalsContact O-N 3.07Å
626	L	84.3	Confident	78.9	Confident	3 Å²	3	62.2 Å²	62.2	2%	0.016	33%	0.325	C	S	.	.	H	α-helix	trans	-64.2	-47.9	171.1	-174.3	157.2	0	0	0	110.7	V612 Y620 T622 E623 C624 K628 A629 R630 L637 V639	V612-L626 HydrophobicContact CG2-CB 4.22Å; V612-L626 HydrophobicContact CG2-CD1 3.89Å; Y620-L626 HydrophobicContact CD1-CB 4.08Å; Y620-L626 HydrophobicContact CD2-CB 3.89Å; Y620-L626 HydrophobicContact CD2-CD1 3.77Å; Y620-L626 HydrophobicContact CD2-CG 3.87Å; Y620-L626 HydrophobicContact CE2-CB 4.44Å; Y620-L626 HydrophobicContact CE2-CD1 4.2Å; Y620-L626 HydrophobicContact CE2-CG 4.08Å; Y620-L626 HydrophobicContact CG-CB 3.67Å; Y620-L626 HydrophobicContact CG-CD1 4.38Å; Y620-L626 HydrophobicContact CG-CG 4.19Å; T622-L626 PolarHBondContact O-N 3.22Å; E623-L626 PolarHBondContact O-N 2.86Å; C624-L626 PolarHBondContact O-N 3.17Å; L626-K628 VanDerWaalsContact C-N 3.3Å; L626-K628 PolarHBondContact O-N 2.87Å; L626-A629 PolarHBondContact O-N 3.46Å; L626-R630 WeakPolarHBondContact O-CB 3.31Å; L626-R630 PolarHBondContact O-N 2.83Å; L626-L637 HydrophobicContact CD2-CB 4.29Å; L626-V639 HydrophobicContact CD1-CG2 3.94Å
627	K	77.6	Confident	78.5	Confident	82 Å²	82	59.6 Å²	59.6	36%	0.357	31%	0.311	S	S	.	.	H	α-helix	trans	-64.1	-32.3	177.6	-75.3	170.4	171.6	171	0	113.1	E623 C624 R630 C631	E623-K627 HydrophobicContact CG-CD 4.42Å; E623-K627 WeakPolarHBondContact O-CG 3.36Å; E623-K627 PolarHBondContact O-N 2.88Å; E623-K627 WeakPolarHBondContact OE1-CE 3.3Å; E623-K627 IonicContact OE1-NZ 2.8Å; E623-K627 PolarHBondContact OE1-NZ 3.04Å; C624-K627 PolarHBondContact O-N 2.95Å; K627-R630 WeakPolarHBondContact O-CB 3.39Å; K627-C631 PolarHBondContact O-N 2.81Å
628	K	82.9	Confident	78.6	Confident	45 Å²	45	64.1 Å²	64.1	20%	0.196	31%	0.313	C	S	.	.	H	α-helix	trans	-63.9	-52.4	170.7	-173	173.9	177.5	120.7	0	111.3	C600 F602 C624 L626 R630 C631 E632	C600-K628 PolarHBondContact O-NZ 3.45Å; F602-K628 HydrophobicContact CB-CB 3.86Å; F602-K628 HydrophobicContact CB-CD 4.01Å; F602-K628 HydrophobicContact CB-CG 3.95Å; F602-K628 HydrophobicContact CD2-CB 3.93Å; F602-K628 HydrophobicContact CD2-CG 3.94Å; F602-K628 HydrophobicContact CG-CB 4.07Å; F602-K628 HydrophobicContact CG-CG 4.33Å; C624-K628 PolarHBondContact O-N 3.46Å; L626-K628 VanDerWaalsContact C-N 3.3Å; L626-K628 PolarHBondContact O-N 2.87Å; K628-R630 VanDerWaalsContact C-N 3.29Å; K628-R630 PolarHBondContact O-N 2.83Å; K628-C631 WeakPolarHBondContact O-CB 3.4Å; K628-C631 PolarHBondContact O-N 2.99Å; K628-C631 VanDerWaalsContact O-N 3.1Å; K628-E632 WeakPolarHBondContact CE-OE1 3.37Å; K628-E632 HydrophobicContact CG-CG 4.29Å; K628-E632 IonicContact NZ-OE1 3.58Å; K628-E632 WeakPolarHBondContact O-CG 3.31Å; K628-E632 PolarHBondContact O-N 3.49Å
629	A	79.9	Confident	78.2	Confident	20 Å²	20	62.8 Å²	62.8	17%	0.165	31%	0.305	C	S	.	.	H	α-helix	trans	-60.2	-38	178.7	0	0	0	0	0	112.6	Y620 H625 L626 C631 E632 A633 L637	Y620-A629 HydrophobicContact CE1-CB 3.57Å; H625-A629 PolarHBondContact O-N 2.75Å; H625-A629 VanDerWaalsContact O-N 3.07Å; L626-A629 PolarHBondContact O-N 3.46Å; A629-C631 VanDerWaalsContact C-N 3.29Å; A629-C631 PolarHBondContact O-N 2.88Å; A629-E632 PolarHBondContact O-N 3.1Å; A629-A633 WeakPolarHBondContact O-CB 3.48Å; A629-A633 PolarHBondContact O-N 3.31Å; A629-L637 HydrophobicContact CB-CD1 4.38Å
630	R	82.8	Confident	77.7	Confident	53 Å²	53	62.4 Å²	62.4	20%	0.2	31%	0.309	C	S	.	.	H	α-helix	trans	-54.3	-43.5	173.2	-166	179.5	74.5	150.1	2.1	112.9	Q584 H585 L626 K627 K628 R634 Q635 L637	Q584-R630 PolarHBondContact O-NH2 2.84Å; H585-R630 VanDerWaalsContact C-NH2 3.26Å; H585-R630 VanDerWaalsContact O-CZ 3.24Å; H585-R630 PolarHBondContact O-NE 3.25Å; H585-R630 PolarHBondContact O-NH2 2.93Å; L626-R630 WeakPolarHBondContact O-CB 3.31Å; L626-R630 PolarHBondContact O-N 2.83Å; K627-R630 WeakPolarHBondContact O-CB 3.39Å; K628-R630 VanDerWaalsContact C-N 3.29Å; K628-R630 PolarHBondContact O-N 2.83Å; R630-R634 PolarHBondContact O-N 2.89Å; R630-Q635 WeakPolarHBondContact CG-O 3.41Å; R630-Q635 PolarHBondContact O-N 3.07Å; R630-L637 HydrophobicContact CB-CB 4.11Å; R630-L637 WeakPolarHBondContact CD-O 3.15Å; R630-L637 HydrophobicContact CG-CB 4.06Å
631	C	79.3	Confident	77.1	Confident	3 Å²	3	63 Å²	63	2%	0.02	32%	0.321	C	S	.	.	H	α-helix	trans	-71.9	-51.5	176.8	-172.7	0	0	0	0	111.5	G587 C600 F602 K627 K628 A629 A633 R634	G587-C631 WeakPolarHBondContact CA-SG 3.32Å; G587-C631 PolarHBondContact N-SG 3.33Å; G587-C631 VanDerWaalsContact N-SG 3.38Å; C600-C631 VanDerWaalsContact CA-SG 3.6Å; C600-C631 HydrophobicContact CB-CB 3.76Å; C600-C631 WeakPolarHBondContact CB-SG 3.46Å; C600-C631 WeakPolarHBondContact SG-CB 3.14Å; C600-C631 CovalentContact SG-SG 2.04Å; C600-C631 PolarHBondContact SG-SG 3.04Å; F602-C631 HydrophobicContact CE2-CB 3.77Å; K627-C631 PolarHBondContact O-N 2.81Å; K628-C631 WeakPolarHBondContact O-CB 3.4Å; K628-C631 PolarHBondContact O-N 2.99Å; K628-C631 VanDerWaalsContact O-N 3.1Å; A629-C631 VanDerWaalsContact C-N 3.29Å; A629-C631 PolarHBondContact O-N 2.88Å; C631-A633 VanDerWaalsContact C-N 3.29Å; C631-A633 PolarHBondContact O-N 3.04Å; C631-R634 PolarHBondContact O-N 2.85Å
632	E	78.8	Confident	77	Confident	121 Å²	121	66.9 Å²	66.9	57%	0.565	33%	0.333	S	S	*	.	H	α-helix	trans	-62.3	-33.2	-177.2	-69	177.5	141.3	0	0	112.9	C600 K628 A629	C600-E632 HydrophobicContact CB-CG 3.89Å; K628-E632 WeakPolarHBondContact CE-OE1 3.37Å; K628-E632 HydrophobicContact CG-CG 4.29Å; K628-E632 IonicContact NZ-OE1 3.58Å; K628-E632 WeakPolarHBondContact O-CG 3.31Å; K628-E632 PolarHBondContact O-N 3.49Å; A629-E632 PolarHBondContact O-N 3.1Å
633	A	74.9	Confident	76.6	Confident	51 Å²	51	68 Å²	68	42%	0.421	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-11	178.9	0	0	0	0	0	114.6	A629 C631 Q635	A629-A633 WeakPolarHBondContact O-CB 3.48Å; A629-A633 PolarHBondContact O-N 3.31Å; C631-A633 VanDerWaalsContact C-N 3.29Å; C631-A633 PolarHBondContact O-N 3.04Å; A633-Q635 VanDerWaalsContact C-N 3.31Å; A633-Q635 HydrophobicContact CB-CB 4.44Å; A633-Q635 PolarHBondContact O-N 2.91Å
634	R	69.4	Low	76.3	Confident	156 Å²	156	67.2 Å²	67.2	59%	0.589	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	46.7	-170.6	-57.2	-173.8	-179.2	-161.4	0.3	113.3	R630 C631	R630-R634 PolarHBondContact O-N 2.89Å; C631-R634 PolarHBondContact O-N 2.85Å
635	Q	70.4	Confident	75.7	Confident	121 Å²	121	67.7 Å²	67.7	57%	0.565	35%	0.354	S	S	*	.	S	Bend	trans	-132.6	153	-177.3	-75.5	178.1	6.3	0	0	111.9	R630 A633 L637	R630-Q635 WeakPolarHBondContact CG-O 3.41Å; R630-Q635 PolarHBondContact O-N 3.07Å; A633-Q635 VanDerWaalsContact C-N 3.31Å; A633-Q635 HydrophobicContact CB-CB 4.44Å; A633-Q635 PolarHBondContact O-N 2.91Å; Q635-L637 PolarHBondContact O-N 2.88Å
636	E	67.4	Low	75	Confident	129 Å²	129	76 Å²	76	60%	0.603	38%	0.383	S	S	*	.			trans	-74.6	83.1	177	-92.5	-70.5	99.4	0	0	112.2
637	L	72.1	Confident	73.3	Confident	15 Å²	15	78.8 Å²	78.8	8%	0.079	41%	0.413	C	S	.	.			trans	-100.5	126.4	172.7	-64.3	174.6	0	0	0	111.2	D616 L626 A629 R630 Q635	D616-L637 HydrophobicContact CB-CD2 3.88Å; L626-L637 HydrophobicContact CD2-CB 4.29Å; A629-L637 HydrophobicContact CB-CD1 4.38Å; R630-L637 HydrophobicContact CB-CB 4.11Å; R630-L637 WeakPolarHBondContact CD-O 3.15Å; R630-L637 HydrophobicContact CG-CB 4.06Å; Q635-L637 PolarHBondContact O-N 2.88Å
638	Y	77.1	Confident	71.8	Confident	144 Å²	144	81.1 Å²	81.1	57%	0.565	44%	0.436	S	S	*	.			trans	-133.2	165.4	176.9	58.9	-95	0	0	0	111.8	G614 S615 A640	G614-Y638 CarbonylContact C-O 3.27Å; G614-Y638 WeakPolarHBondContact CA-O 3.36Å; S615-Y638 PolarHBondContact N-O 3.14Å; S615-Y638 PolarHBondContact OG-N 3.32Å; S615-Y638 VanDerWaalsContact OG-N 3.12Å; Y638-A640 PolarHBondContact O-N 3.11Å; Y638-A640 VanDerWaalsContact O-N 3.14Å
639	V	73.8	Confident	69.3	Low	45 Å²	45	85 Å²	85	27%	0.273	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	102.8	177	177.2	0	0	0	0	109.2	V612 C613 E623 L626 A641	V612-V639 HydrophobicContact CB-CG1 4.04Å; V612-V639 HydrophobicContact CB-CG2 4.09Å; V612-V639 HydrophobicContact CG1-CG1 4.28Å; V612-V639 HydrophobicContact CG1-CG2 4.31Å; V612-V639 HydrophobicContact CG2-CG2 4.09Å; C613-V639 CarbonylContact O-C 3.53Å; C613-V639 WeakPolarHBondContact O-CA 3.4Å; E623-V639 HydrophobicContact CG-CG2 3.97Å; L626-V639 HydrophobicContact CD1-CG2 3.94Å; V639-A641 WeakPolarHBondContact CG1-O 3.29Å
640	A	73	Confident	67.3	Low	59 Å²	59	92.1 Å²	92.1	49%	0.488	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	-30.8	173.2	0	0	0	0	0	112.2	C613 Y638	C613-A640 PolarHBondContact O-N 3.29Å; Y638-A640 PolarHBondContact O-N 3.11Å; Y638-A640 VanDerWaalsContact O-N 3.14Å
641	A	72	Confident	64.5	Low	46 Å²	46	93.9 Å²	93.9	38%	0.38	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	146.3	172.1	0	0	0	0	0	112.7	C613 V639	C613-A641 HydrophobicContact CB-CB 3.99Å; C613-A641 PolarHBondContact N-O 3Å; C613-A641 PolarHBondContact O-N 3.05Å; V639-A641 WeakPolarHBondContact CG1-O 3.29Å
642	Q	74.7	Confident	62.7	Low	136 Å²	136	99.1 Å²	99.1	64%	0.636	56%	0.558	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-76	131.7	168.7	-70.9	-70.3	-14.7	0	0	110
643	G	73.2	Confident	60.5	Low	27 Å²	27	101 Å²	101	28%	0.278	57%	0.571	S	S	.	*	S	Bend	trans	93.2	177.6	-167.9	0	0	0	0	0	113.2	P611 V612 C613	P611-G643 CarbonylContact O-C 3.55Å; P611-G643 WeakPolarHBondContact O-CA 3.41Å; P611-G643 PolarHBondContact O-N 3Å; V612-G643 CarbonylContact C-O 3.54Å; V612-G643 VanDerWaalsContact CA-O 3.28Å; V612-G643 WeakPolarHBondContact CA-O 3.36Å; C613-G643 PolarHBondContact N-O 2.96Å
644	A	74.1	Confident	58.1	Low	54 Å²	54	106.1 Å²	106.1	45%	0.446	59%	0.591	S	S	.	*	S	Bend	trans	-68.1	147	176.4	0	0	0	0	0	112.2	T619 R646	T619-A644 HydrophobicContact CG2-CB 3.65Å; A644-R646 PolarHBondContact O-N 3.09Å
645	C	70.3	Confident	56.9	Low	39 Å²	39	103.7 Å²	103.7	26%	0.264	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-56.8	121.9	174.6	-56.9	0	0	0	0	110.3	C613 G617 V618 T619	C613-C645 WeakPolarHBondContact CA-SG 3.45Å; C613-C645 HydrophobicContact CB-CB 3.99Å; C613-C645 WeakPolarHBondContact CB-SG 3.48Å; C613-C645 WeakPolarHBondContact SG-CA 3.44Å; C613-C645 WeakPolarHBondContact SG-CB 3.2Å; C613-C645 CovalentContact SG-SG 2.03Å; C613-C645 PolarHBondContact SG-SG 3.07Å; G617-C645 PolarHBondContact O-SG 3.27Å; V618-C645 VanDerWaalsContact C-SG 3.52Å; V618-C645 PolarHBondContact O-SG 3.37Å; V618-C645 VanDerWaalsContact O-SG 3.42Å; T619-C645 PolarHBondContact OG1-N 3.06Å; T619-C645 PolarHBondContact OG1-SG 3.03Å
646	R	67.3	Low	55	Low	246 Å²	246	106.5 Å²	106.5	93%	0.928	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-89.1	118.7	-177.8	-73.6	-175.2	172.1	-177	-1.9	110.9	A644	A644-R646 PolarHBondContact O-N 3.09Å
647	G	49.6	Very low	53.4	Low	63 Å²	63	104.9 Å²	104.9	65%	0.649	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-60	152.4	163.8	0	0	0	0	0	111.8	T649	G647-T649 PolarHBondContact O-N 3.02Å
648	P	44.6	Very low	52	Low	131 Å²	131	109.3 Å²	109.3	85%	0.851	65%	0.651	S	S	*	*			trans	-83.3	112.2	-163.2	30.8	-35.5	0	0	0	113.8
649	T	30.4	Very low	50.7	Low	127 Å²	127	106.9 Å²	106.9	78%	0.779	65%	0.653	S	S	*	*			trans	-153.2	106.9	155	-34.2	0	0	0	0	113.5	G647	G647-T649 PolarHBondContact O-N 3.02Å
650	L	37.8	Very low	50	Low	168 Å²	168	109.3 Å²	109.3	88%	0.88	66%	0.661	S	S	*	*			trans	41.9	135.6	148.2	-75.6	157.1	0	0	0	123.5
651	A	25.4	Very low	49.5	Very low	91 Å²	91	106.6 Å²	106.6	75%	0.752	64%	0.639	S	S	*	*			trans	-138.4	143.6	146.4	0	0	0	0	0	110.3
652	P	41.2	Very low	49	Very low	112 Å²	112	107.8 Å²	107.8	73%	0.727	65%	0.648	S	S	*	*			trans	-106	176.1	-179.5	41.3	-36	0	0	0	112.6
653	L	31.8	Very low	48.3	Very low	161 Å²	161	108.4 Å²	108.4	84%	0.843	65%	0.651	S	S	*	*			cis	-171.6	156.1	-23.1	-103.5	172.6	0	0	0	106.7
654	L	25.7	Very low	47.7	Very low	159 Å²	159	109.1 Å²	109.1	83%	0.832	65%	0.65	S	S	*	*			trans	-169.1	166.5	150.6	-110	177.9	0	0	0	110.7
655	P	42.8	Very low	47.2	Very low	104 Å²	104	112.2 Å²	112.2	68%	0.675	67%	0.666	S	S	*	*	S	Bend		-101.9	162.9	-105.5	40	-31	0	0	0	114.5
656	M	30.4	Very low	46.9	Very low	181 Å²	181	116.1 Å²	116.1	89%	0.892	68%	0.676	S	S	*	*			cis	-150.5	108.1	-15.7	-111.8	178.2	81.4	0	0	106.4
657	A	34.4	Very low	47.1	Very low	94 Å²	94	105.3 Å²	105.3	78%	0.777	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-77.3	156	165.1	0	0	0	0	0	109.8
658	S	42.4	Very low	48.1	Very low	108 Å²	108	103.6 Å²	103.6	76%	0.755	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-57.3	142.6	172	49	0	0	0	0	111.3	H660	S658-H660 PolarHBondContact O-N 2.6Å
659	P	50.6	Low	49.1	Very low	93 Å²	93	97.7 Å²	97.7	60%	0.604	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-61	135	-179.5	26	-34.4	0	0	0	111.1	Q663	P659-Q663 HydrophobicContact CB-CB 4.45Å
660	H	58	Low	50.8	Low	96 Å²	96	100.2 Å²	100.2	44%	0.444	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-60	145.2	176.5	-160.5	-93.2	0	0	0	110.4	S658 A662 Q663 N672	S658-H660 PolarHBondContact O-N 2.6Å; H660-A662 PolarHBondContact O-N 3.35Å; H660-Q663 WeakPolarHBondContact O-CB 3.36Å; H660-Q663 PolarHBondContact O-N 2.04Å; H660-N672 PolarHBondContact CE1-O 2.54Å; H660-N672 PolarHBondContact NE2-O 3.49Å
661	C	62	Low	51.8	Low	3 Å²	3	95.7 Å²	95.7	2%	0.02	56%	0.561	C	S	.	*	G	3₁₀ helix	trans	-51.8	-28.2	-175.4	50.4	0	0	0	0	115	Q663 T664 G667 C668 N672 V673 T674 A675	C661-Q663 PolarHBondContact O-N 3.33Å; C661-T664 PolarHBondContact O-N 3.08Å; C661-T664 VanDerWaalsContact O-N 3.11Å; C661-T664 PolarHBondContact O-OG1 3.39Å; C661-G667 CarbonylContact O-C 3.5Å; C661-G667 VanDerWaalsContact O-C 3.22Å; C661-G667 WeakPolarHBondContact O-CA 3.43Å; C661-C668 HydrophobicContact CB-CB 3.84Å; C661-C668 WeakPolarHBondContact CB-SG 3.39Å; C661-C668 WeakPolarHBondContact SG-CB 3.21Å; C661-C668 CovalentContact SG-SG 2.04Å; C661-C668 PolarHBondContact SG-SG 3.34Å; C661-N672 PolarHBondContact SG-O 2.95Å; C661-N672 VanDerWaalsContact SG-O 3.4Å; C661-V673 PolarHBondContact SG-O 2.94Å; C661-T674 VanDerWaalsContact CB-C 3.44Å; C661-T674 WeakPolarHBondContact CB-O 3.39Å; C661-A675 HydrophobicContact CB-CB 4.07Å
662	A	63.1	Low	53.4	Low	70 Å²	70	96.3 Å²	96.3	58%	0.579	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-64.4	-9.4	176.8	0	0	0	0	0	114.1	H660 C668	H660-A662 PolarHBondContact O-N 3.35Å; A662-C668 PolarHBondContact N-SG 2.93Å
663	Q	58.5	Low	54.4	Low	149 Å²	149	95.8 Å²	95.8	70%	0.696	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-99	-2.7	177.6	-57.6	-177.7	4.9	0	0	113.3	P659 H660 C661	P659-Q663 HydrophobicContact CB-CB 4.45Å; H660-Q663 WeakPolarHBondContact O-CB 3.36Å; H660-Q663 PolarHBondContact O-N 2.04Å; C661-Q663 PolarHBondContact O-N 3.33Å
664	T	62.3	Low	56	Low	42 Å²	42	89.7 Å²	89.7	26%	0.258	52%	0.515	S	S	.	.	S	Bend	trans	-84.1	160	175	75.4	0	0	0	0	111.4	C661 Y666 G667 A675	C661-T664 PolarHBondContact O-N 3.08Å; C661-T664 VanDerWaalsContact O-N 3.11Å; C661-T664 PolarHBondContact O-OG1 3.39Å; T664-Y666 PolarHBondContact O-N 2.04Å; T664-G667 PolarHBondContact O-N 3.43Å; T664-G667 PolarHBondContact OG1-N 3.38Å; T664-G667 PolarHBondContact OG1-O 2.9Å; T664-A675 HydrophobicContact CG2-CB 3.6Å
665	P	62	Low	57.9	Low	120 Å²	120	83.8 Å²	83.8	78%	0.779	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-12.2	-176.2	-25.9	36.1	0	0	0	116
666	Y	65.3	Low	59	Low	120 Å²	120	79 Å²	79	47%	0.471	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.8	0.1	-177.9	-50	-68.3	0	0	0	113.4	T664 Q677 V679	T664-Y666 PolarHBondContact O-N 2.04Å; Y666-Q677 WeakPolarHBondContact CD2-O 3.04Å; Y666-Q677 WeakPolarHBondContact CE2-O 3.47Å; Y666-V679 HydrophobicContact CD1-CG1 3.79Å; Y666-V679 HydrophobicContact CE1-CG1 3.84Å
667	G	69.9	Low	60.4	Low	20 Å²	20	76 Å²	76	21%	0.206	44%	0.442	C	S	.	.			trans	78.7	-162.8	175.5	0	0	0	0	0	115.2	C661 T664 A676	C661-G667 CarbonylContact O-C 3.5Å; C661-G667 VanDerWaalsContact O-C 3.22Å; C661-G667 WeakPolarHBondContact O-CA 3.43Å; T664-G667 PolarHBondContact O-N 3.43Å; T664-G667 PolarHBondContact OG1-N 3.38Å; T664-G667 PolarHBondContact OG1-O 2.9Å; G667-A676 WeakPolarHBondContact O-CB 3.48Å; G667-A676 PolarHBondContact O-N 2.83Å
668	C	70.8	Confident	61.7	Low	26 Å²	26	72.1 Å²	72.1	18%	0.176	41%	0.412	C	S	.	.	B	Isolated β-bridge	trans	-82.8	153	178.1	-63.9	0	0	0	0	113.3	C661 A662 N672 T674	C661-C668 HydrophobicContact CB-CB 3.84Å; C661-C668 WeakPolarHBondContact CB-SG 3.39Å; C661-C668 WeakPolarHBondContact SG-CB 3.21Å; C661-C668 CovalentContact SG-SG 2.04Å; C661-C668 PolarHBondContact SG-SG 3.34Å; A662-C668 PolarHBondContact N-SG 2.93Å; C668-N672 PolarHBondContact SG-OD1 3.33Å; C668-T674 WeakPolarHBondContact CA-O 3.31Å
669	C	65.3	Low	62.3	Low	8 Å²	8	72.9 Å²	72.9	5%	0.054	41%	0.411	C	S	.	.			trans	-70.1	173.3	160.8	-61	0	0	0	0	111.5	D671 N672 T674 C684	C669-D671 WeakPolarHBondContact CB-OD1 3.17Å; C669-D671 PolarHBondContact O-N 3.18Å; C669-D671 VanDerWaalsContact O-N 3.13Å; C669-N672 PolarHBondContact O-N 3.29Å; C669-T674 WeakPolarHBondContact CB-O 3.44Å; C669-T674 PolarHBondContact N-O 2.92Å; C669-T674 PolarHBondContact SG-O 3.4Å; C669-T674 VanDerWaalsContact SG-O 3.38Å; C669-C684 WeakPolarHBondContact CA-SG 3.39Å; C669-C684 HydrophobicContact CB-CB 3.63Å; C669-C684 WeakPolarHBondContact CB-SG 3.26Å; C669-C684 WeakPolarHBondContact SG-CA 3.16Å; C669-C684 WeakPolarHBondContact SG-CB 3.04Å; C669-C684 CovalentContact SG-SG 2.03Å; C669-C684 PolarHBondContact SG-SG 2.95Å
670	Q	67.3	Low	62.6	Low	179 Å²	179	72.2 Å²	72.2	84%	0.836	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-16.7	-178.5	-64.9	-178.7	7.5	0	0	113.8	N672 L681	Q670-N672 PolarHBondContact O-N 3.02Å; Q670-L681 HydrophobicContact CG-CD1 3.85Å
671	D	58.9	Low	62.6	Low	74 Å²	74	71.2 Å²	71.2	40%	0.396	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-9	171.4	64	6.6	0	0	0	113.7	C669 V673 T674	C669-D671 WeakPolarHBondContact CB-OD1 3.17Å; C669-D671 PolarHBondContact O-N 3.18Å; C669-D671 VanDerWaalsContact O-N 3.13Å; D671-V673 PolarHBondContact O-N 2.96Å; D671-V673 VanDerWaalsContact O-N 3.17Å; D671-V673 PolarHBondContact OD1-N 3.16Å; D671-T674 PolarHBondContact OD1-N 2.76Å; D671-T674 WeakPolarHBondContact OD2-CB 3.04Å; D671-T674 PolarHBondContact OD2-N 3.34Å; D671-T674 PolarHBondContact OD2-OG1 3.45Å
672	N	58.9	Low	61.9	Low	103 Å²	103	73.4 Å²	73.4	55%	0.551	44%	0.437	S	S	*	.	S	Bend	trans	55.3	22	-173.7	-159	30.4	0	0	0	114.7	H660 C661 C668 C669 Q670	H660-N672 PolarHBondContact CE1-O 2.54Å; H660-N672 PolarHBondContact NE2-O 3.49Å; C661-N672 PolarHBondContact SG-O 2.95Å; C661-N672 VanDerWaalsContact SG-O 3.4Å; C668-N672 PolarHBondContact SG-OD1 3.33Å; C669-N672 PolarHBondContact O-N 3.29Å; Q670-N672 PolarHBondContact O-N 3.02Å
673	V	63	Low	61.4	Low	101 Å²	101	71.6 Å²	71.6	61%	0.612	43%	0.425	S	S	*	.	S	Bend	trans	-130.8	-40.1	-178.5	175.5	0	0	0	0	111.7	C661 D671	C661-V673 PolarHBondContact SG-O 2.94Å; D671-V673 PolarHBondContact O-N 2.96Å; D671-V673 VanDerWaalsContact O-N 3.17Å; D671-V673 PolarHBondContact OD1-N 3.16Å
674	T	65.1	Low	61.5	Low	33 Å²	33	66 Å²	66	20%	0.202	40%	0.402	C	S	.	.	S	Bend	trans	-82.6	141.1	179.9	-57.1	0	0	0	0	111	C661 C668 C669 D671	C661-T674 VanDerWaalsContact CB-C 3.44Å; C661-T674 WeakPolarHBondContact CB-O 3.39Å; C668-T674 WeakPolarHBondContact CA-O 3.31Å; C669-T674 WeakPolarHBondContact CB-O 3.44Å; C669-T674 PolarHBondContact N-O 2.92Å; C669-T674 PolarHBondContact SG-O 3.4Å; C669-T674 VanDerWaalsContact SG-O 3.38Å; D671-T674 PolarHBondContact OD1-N 2.76Å; D671-T674 WeakPolarHBondContact OD2-CB 3.04Å; D671-T674 PolarHBondContact OD2-N 3.34Å; D671-T674 PolarHBondContact OD2-OG1 3.45Å
675	A	65.4	Low	61	Low	35 Å²	35	65.7 Å²	65.7	29%	0.289	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-81.6	124.4	177.1	0	0	0	0	0	112	C661 T664	C661-A675 HydrophobicContact CB-CB 4.07Å; T664-A675 HydrophobicContact CG2-CB 3.6Å
676	A	65.1	Low	60.7	Low	3 Å²	3	65.5 Å²	65.5	3%	0.025	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-65.8	139	168.8	0	0	0	0	0	110	G667	G667-A676 WeakPolarHBondContact O-CB 3.48Å; G667-A676 PolarHBondContact O-N 2.83Å
677	Q	59.5	Low	60.2	Low	119 Å²	119	64.5 Å²	64.5	56%	0.556	41%	0.409	S	S	*	.			trans	-102	-6.9	-178.2	-59.2	-173.5	4.4	0	0	112.9	Y666 A682	Y666-Q677 WeakPolarHBondContact CD2-O 3.04Å; Y666-Q677 WeakPolarHBondContact CE2-O 3.47Å; Q677-A682 CarbonylContact C-O 3.59Å; Q677-A682 PolarHBondContact N-O 2.91Å
678	G	62.2	Low	59.9	Low	13 Å²	13	65.1 Å²	65.1	13%	0.134	41%	0.41	C	S	.	.	B	Isolated β-bridge	trans	-159.7	170.1	173.2	0	0	0	0	0	113.3	A682	G678-A682 PolarHBondContact N-O 2.96Å; G678-A682 PolarHBondContact O-N 2.81Å
679	V	55.6	Low	60	Low	123 Å²	123	69.2 Å²	69.2	75%	0.745	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	139.8	179.3	-67.7	0	0	0	0	111.9	Y666	Y666-V679 HydrophobicContact CD1-CG1 3.79Å; Y666-V679 HydrophobicContact CE1-CG1 3.84Å
680	G	56.3	Low	60.7	Low	80 Å²	80	69.5 Å²	69.5	83%	0.825	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	38.6	178.6	0	0	0	0	0	114.4	A682	G680-A682 VanDerWaalsContact C-N 3.25Å; G680-A682 PolarHBondContact O-N 3.38Å
681	L	58.8	Low	61.3	Low	74 Å²	74	62.7 Å²	62.7	39%	0.387	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	22.1	179.6	-54.8	166.7	0	0	0	114.3	Q670 G683 C684	Q670-L681 HydrophobicContact CG-CD1 3.85Å; L681-G683 PolarHBondContact O-N 3.32Å; L681-C684 HydrophobicContact CB-CB 4.25Å; L681-C684 WeakPolarHBondContact O-CB 3.49Å; L681-C684 PolarHBondContact O-N 3.36Å; L681-C684 VanDerWaalsContact O-N 3.09Å; L681-C684 PolarHBondContact O-SG 3.23Å; L681-C684 VanDerWaalsContact O-SG 3.4Å
682	A	46.5	Very low	62.2	Low	49 Å²	49	63.8 Å²	63.8	41%	0.405	41%	0.409	S	S	.	.	B	Isolated β-bridge	trans	-64.7	132.9	176	0	0	0	0	0	110.9	Q677 G678 G680 C684	Q677-A682 CarbonylContact C-O 3.59Å; Q677-A682 PolarHBondContact N-O 2.91Å; G678-A682 PolarHBondContact N-O 2.96Å; G678-A682 PolarHBondContact O-N 2.81Å; G680-A682 VanDerWaalsContact C-N 3.25Å; G680-A682 PolarHBondContact O-N 3.38Å; A682-C684 VanDerWaalsContact C-N 3.32Å
683	G	53.8	Low	63	Low	32 Å²	32	63 Å²	63	33%	0.33	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	3.3	-172.7	0	0	0	0	0	114.9	L681 P702	L681-G683 PolarHBondContact O-N 3.32Å; G683-P702 WeakPolarHBondContact O-CB 3.48Å
684	C	60.3	Low	63.7	Low	31 Å²	31	58.2 Å²	58.2	21%	0.209	37%	0.373	C	S	.	.			trans	-82.9	132.1	169.1	-64.9	0	0	0	0	110.9	C669 L681 A682 S686	C669-C684 WeakPolarHBondContact CA-SG 3.39Å; C669-C684 HydrophobicContact CB-CB 3.63Å; C669-C684 WeakPolarHBondContact CB-SG 3.26Å; C669-C684 WeakPolarHBondContact SG-CA 3.16Å; C669-C684 WeakPolarHBondContact SG-CB 3.04Å; C669-C684 CovalentContact SG-SG 2.03Å; C669-C684 PolarHBondContact SG-SG 2.95Å; L681-C684 HydrophobicContact CB-CB 4.25Å; L681-C684 WeakPolarHBondContact O-CB 3.49Å; L681-C684 PolarHBondContact O-N 3.36Å; L681-C684 VanDerWaalsContact O-N 3.09Å; L681-C684 PolarHBondContact O-SG 3.23Å; L681-C684 VanDerWaalsContact O-SG 3.4Å; A682-C684 VanDerWaalsContact C-N 3.32Å; C684-S686 PolarHBondContact O-N 3.41Å
685	P	52	Low	64.5	Low	37 Å²	37	56.7 Å²	56.7	24%	0.24	36%	0.363	C	S	.	.			trans	-70.1	125.3	177.3	27.7	-32.7	0	0	0	110.6	T687 C688	P685-T687 VanDerWaalsContact C-N 3.27Å; P685-T687 PolarHBondContact O-N 2.98Å; P685-C688 VanDerWaalsContact CB-SG 3.58Å
686	S	54	Low	64.8	Low	115 Å²	115	62.1 Å²	62.1	80%	0.804	38%	0.377	S	S	*	.	S	Bend	trans	-71.7	83.9	169.1	55.4	0	0	0	0	109.7	C684	C684-S686 PolarHBondContact O-N 3.41Å
687	T	56.1	Low	64.9	Low	100 Å²	100	63.9 Å²	63.9	61%	0.613	39%	0.389	S	S	*	.			trans	56.9	91.1	178.7	48.6	0	0	0	0	115.9	P685 H689	P685-T687 VanDerWaalsContact C-N 3.27Å; P685-T687 PolarHBondContact O-N 2.98Å; T687-H689 VanDerWaalsContact CB-CE1 3.43Å; T687-H689 WeakPolarHBondContact CB-CE1 3.27Å; T687-H689 PolarHBondContact O-N 2.81Å; T687-H689 PolarHBondContact O-ND1 2.99Å; T687-H689 PolarHBondContact OG1-CE1 3.01Å; T687-H689 PolarHBondContact OG1-ND1 3.01Å
688	C	63.1	Low	65.3	Low	32 Å²	32	60.9 Å²	60.9	22%	0.216	39%	0.39	C	S	.	.			trans	-63.7	89.4	164.1	-65.5	0	0	0	0	110.9	P685 C690 G698 C700	P685-C688 VanDerWaalsContact CB-SG 3.58Å; C688-C690 PolarHBondContact O-N 2.82Å; C688-G698 WeakPolarHBondContact CB-O 3.29Å; C688-C700 HydrophobicContact CB-CB 3.68Å; C688-C700 WeakPolarHBondContact CB-SG 3.44Å; C688-C700 VanDerWaalsContact SG-CA 3.58Å; C688-C700 WeakPolarHBondContact SG-CB 3.48Å; C688-C700 PolarHBondContact SG-N 3.41Å; C688-C700 CovalentContact SG-SG 2.04Å; C688-C700 PolarHBondContact SG-SG 2.92Å
689	H	73.9	Confident	65.3	Low	113 Å²	113	63.7 Å²	63.7	52%	0.523	41%	0.405	S	S	.	.			trans	-79.2	47.1	-178.9	-68.2	97.8	0	0	0	113.3	T687 R717	T687-H689 VanDerWaalsContact CB-CE1 3.43Å; T687-H689 WeakPolarHBondContact CB-CE1 3.27Å; T687-H689 PolarHBondContact O-N 2.81Å; T687-H689 PolarHBondContact O-ND1 2.99Å; T687-H689 PolarHBondContact OG1-CE1 3.01Å; T687-H689 PolarHBondContact OG1-ND1 3.01Å; H689-R717 VanDerWaalsContact O-CZ 3.27Å; H689-R717 PolarHBondContact O-NE 2.91Å; H689-R717 PolarHBondContact O-NH2 2.91Å
690	C	79.3	Confident	66.1	Low	14 Å²	14	58.8 Å²	58.8	10%	0.095	38%	0.376	C	S	.	.			trans	-60.1	139.6	-176.5	-54.9	0	0	0	0	112.3	C688 P692 S697 C707	C688-C690 PolarHBondContact O-N 2.82Å; C690-P692 WeakPolarHBondContact O-CD 3.4Å; C690-S697 WeakPolarHBondContact CB-O 3.32Å; C690-C707 WeakPolarHBondContact CA-SG 3.35Å; C690-C707 HydrophobicContact CB-CB 3.69Å; C690-C707 WeakPolarHBondContact CB-SG 3.39Å; C690-C707 WeakPolarHBondContact SG-CB 3.42Å; C690-C707 CovalentContact SG-SG 2.03Å; C690-C707 PolarHBondContact SG-SG 3.46Å
691	N	80.5	Confident	66.7	Low	36 Å²	36	58 Å²	58	19%	0.193	35%	0.353	C	S	.	.			trans	-70.5	119.2	177.5	-176	-51.1	0	0	0	109.7	H693 G694 S695 R717 C718	N691-H693 PolarHBondContact O-N 2.77Å; N691-H693 PolarHBondContact OD1-N 2.75Å; N691-G694 PolarHBondContact O-N 3.22Å; N691-G694 PolarHBondContact OD1-N 3.25Å; N691-S695 WeakPolarHBondContact O-CB 3.39Å; N691-S695 PolarHBondContact O-N 2.91Å; N691-S695 PolarHBondContact O-OG 2.88Å; N691-R717 VanDerWaalsContact CB-O 3.29Å; N691-R717 WeakPolarHBondContact CB-O 3.31Å; N691-R717 PolarHBondContact N-O 2.85Å; N691-C718 WeakPolarHBondContact CB-O 3.49Å
692	P	77.2	Confident	66.4	Low	97 Å²	97	57.2 Å²	57.2	63%	0.63	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-20	-172.2	27.1	-35.3	0	0	0	113.9	C690	C690-P692 WeakPolarHBondContact O-CD 3.4Å
693	H	76.5	Confident	67.1	Low	87 Å²	87	60.5 Å²	60.5	40%	0.403	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-43.6	174.9	-57.5	-78.2	0	0	0	111.5	N691 R710 I731 V732	N691-H693 PolarHBondContact O-N 2.77Å; N691-H693 PolarHBondContact OD1-N 2.75Å; H693-R710 WeakPolarHBondContact O-CD 3.33Å; H693-R710 PolarHBondContact O-NE 3.21Å; H693-I731 HydrophobicContact CB-CG2 4.17Å; H693-I731 VanDerWaalsContact O-CG2 3.32Å; H693-I731 WeakPolarHBondContact O-CG2 3.47Å; H693-V732 HydrophobicContact CB-CG2 3.96Å
694	G	76.4	Confident	67.7	Low	0 Å²	0	63 Å²	63	0%	0	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-17.3	-177.8	0	0	0	0	0	115.4	N691 R710 V713 C718	N691-G694 PolarHBondContact O-N 3.22Å; N691-G694 PolarHBondContact OD1-N 3.25Å; G694-R710 WeakPolarHBondContact O-CB 3.39Å; G694-R710 WeakPolarHBondContact O-CG 3.39Å; G694-R710 PolarHBondContact O-N 2.84Å; G694-V713 WeakPolarHBondContact O-CG1 3.26Å; G694-C718 WeakPolarHBondContact CA-O 3.35Å; G694-C718 WeakPolarHBondContact O-CB 3.34Å
695	S	81.5	Confident	68.3	Low	1 Å²	1	63.1 Å²	63.1	1%	0.007	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	166.4	178.2	69	0	0	0	0	113	N691 S697 S708 R710	N691-S695 WeakPolarHBondContact O-CB 3.39Å; N691-S695 PolarHBondContact O-N 2.91Å; N691-S695 PolarHBondContact O-OG 2.88Å; S695-S697 PolarHBondContact OG-O 3.3Å; S695-S708 CarbonylContact C-O 3.38Å; S695-S708 VanDerWaalsContact CA-O 3.26Å; S695-S708 WeakPolarHBondContact CA-O 3.34Å; S695-S708 WeakPolarHBondContact CB-O 3.46Å; S695-R710 PolarHBondContact O-NE 2.86Å; S695-R710 PolarHBondContact O-NH2 2.84Å
696	Y	71.4	Confident	69.5	Low	148 Å²	148	64.7 Å²	64.7	58%	0.58	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	-20.3	169.1	-72.7	-74.4	0	0	0	113.1	S708 C709 R710 P711	Y696-S708 PolarHBondContact N-O 3.49Å; Y696-C709 WeakPolarHBondContact CD2-O 3.44Å; Y696-C709 VanDerWaalsContact CE2-O 3.26Å; Y696-C709 WeakPolarHBondContact CE2-O 3.48Å; Y696-R710 HydrophobicContact CD1-CG 4.39Å; Y696-R710 HydrophobicContact CD2-CG 4.25Å; Y696-R710 HydrophobicContact CE1-CG 4.29Å; Y696-R710 HydrophobicContact CE2-CG 4.15Å; Y696-R710 HydrophobicContact CG-CG 4.38Å; Y696-P711 WeakPolarHBondContact OH-CD 3.43Å
697	S	67.3	Low	70.9	Confident	40 Å²	40	59.4 Å²	59.4	28%	0.28	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	158.3	-175.1	60	0	0	0	0	112.1	C690 S695 T699	C690-S697 WeakPolarHBondContact CB-O 3.32Å; S695-S697 PolarHBondContact OG-O 3.3Å; S697-T699 WeakPolarHBondContact CB-OG1 3.39Å; S697-T699 PolarHBondContact O-N 2.96Å; S697-T699 VanDerWaalsContact O-N 3.1Å; S697-T699 PolarHBondContact OG-OG1 3.41Å
698	G	68.4	Low	72	Confident	56 Å²	56	57.6 Å²	57.6	58%	0.577	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	2.6	170.6	0	0	0	0	0	115	C688	C688-G698 WeakPolarHBondContact CB-O 3.29Å
699	T	62.1	Low	73	Confident	72 Å²	72	57.6 Å²	57.6	44%	0.442	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	138.6	-173.3	48.8	0	0	0	0	112.1	S697	S697-T699 WeakPolarHBondContact CB-OG1 3.39Å; S697-T699 PolarHBondContact O-N 2.96Å; S697-T699 VanDerWaalsContact O-N 3.1Å; S697-T699 PolarHBondContact OG-OG1 3.41Å
700	C	72.9	Confident	73.2	Confident	20 Å²	20	55.5 Å²	55.5	14%	0.135	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	157.3	175.5	73.6	0	0	0	0	111.1	C688 Q706 C707	C688-C700 HydrophobicContact CB-CB 3.68Å; C688-C700 WeakPolarHBondContact CB-SG 3.44Å; C688-C700 VanDerWaalsContact SG-CA 3.58Å; C688-C700 WeakPolarHBondContact SG-CB 3.48Å; C688-C700 PolarHBondContact SG-N 3.41Å; C688-C700 CovalentContact SG-SG 2.04Å; C688-C700 PolarHBondContact SG-SG 2.92Å; C700-Q706 VanDerWaalsContact CA-O 3.31Å; C700-Q706 WeakPolarHBondContact CA-O 3.36Å; C700-Q706 WeakPolarHBondContact CB-O 3.5Å; C700-C707 HydrophobicContact CB-CB 4.49Å
701	D	68.4	Low	73.2	Confident	65 Å²	65	58.3 Å²	58.3	35%	0.348	35%	0.347	S	S	.	.			trans	-60.6	124.2	172.9	168.4	2.8	0	0	0	110.2	V703 T704 G705 Q706	D701-V703 PolarHBondContact O-N 2.97Å; D701-V703 PolarHBondContact OD1-N 3.1Å; D701-T704 WeakPolarHBondContact CB-OG1 3.37Å; D701-T704 PolarHBondContact OD1-N 3.23Å; D701-T704 WeakPolarHBondContact OD2-CB 3.37Å; D701-T704 WeakPolarHBondContact OD2-CG2 3.4Å; D701-T704 PolarHBondContact OD2-OG1 2.78Å; D701-G705 VanDerWaalsContact O-CA 3.28Å; D701-G705 WeakPolarHBondContact O-CA 3.16Å; D701-G705 PolarHBondContact O-N 3.33Å; D701-Q706 PolarHBondContact N-O 2.85Å
702	P	53.3	Low	73.1	Confident	56 Å²	56	56.9 Å²	56.9	36%	0.364	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-12.1	-177.2	29	-36.5	0	0	0	114.5	G683	G683-P702 WeakPolarHBondContact O-CB 3.48Å
703	V	60.5	Low	73.5	Confident	118 Å²	118	52.5 Å²	52.5	72%	0.715	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-41.6	178.1	-177.2	0	0	0	0	111.9	D701	D701-V703 PolarHBondContact O-N 2.97Å; D701-V703 PolarHBondContact OD1-N 3.1Å
704	T	67.4	Low	73.8	Confident	84 Å²	84	48.6 Å²	48.6	52%	0.515	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-16.2	-176.9	65.8	0	0	0	0	114.5	D701 Q706 L716	D701-T704 WeakPolarHBondContact CB-OG1 3.37Å; D701-T704 PolarHBondContact OD1-N 3.23Å; D701-T704 WeakPolarHBondContact OD2-CB 3.37Å; D701-T704 WeakPolarHBondContact OD2-CG2 3.4Å; D701-T704 PolarHBondContact OD2-OG1 2.78Å; T704-Q706 PolarHBondContact O-N 2.85Å; T704-Q706 WeakPolarHBondContact OG1-CB 3.35Å; T704-Q706 PolarHBondContact OG1-N 3.04Å; T704-L716 WeakPolarHBondContact O-CD2 3.45Å
705	G	71.3	Confident	73.9	Confident	34 Å²	34	50.2 Å²	50.2	35%	0.351	31%	0.312	S	S	.	.			trans	71.7	5.6	-172.5	0	0	0	0	0	114.4	D701	D701-G705 VanDerWaalsContact O-CA 3.28Å; D701-G705 WeakPolarHBondContact O-CA 3.16Å; D701-G705 PolarHBondContact O-N 3.33Å
706	Q	78.1	Confident	73.8	Confident	70 Å²	70	55.1 Å²	55.1	33%	0.327	34%	0.338	S	S	.	.			trans	-78.6	122.9	-176.1	-178.1	56.2	63.6	0	0	111.6	C700 D701 T704 C709 G715 L716	C700-Q706 VanDerWaalsContact CA-O 3.31Å; C700-Q706 WeakPolarHBondContact CA-O 3.36Å; C700-Q706 WeakPolarHBondContact CB-O 3.5Å; D701-Q706 PolarHBondContact N-O 2.85Å; T704-Q706 PolarHBondContact O-N 2.85Å; T704-Q706 WeakPolarHBondContact OG1-CB 3.35Å; T704-Q706 PolarHBondContact OG1-N 3.04Å; Q706-C709 PolarHBondContact NE2-SG 2.85Å; Q706-C709 VanDerWaalsContact NE2-SG 3.38Å; Q706-G715 PolarHBondContact NE2-O 3.39Å; Q706-L716 HydrophobicContact CB-CD2 4.32Å
707	C	83.1	Confident	74.4	Confident	5 Å²	5	54.1 Å²	54.1	3%	0.034	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	154.2	172.5	-67.2	0	0	0	0	112.3	C690 C700 C709 L716 C718	C690-C707 WeakPolarHBondContact CA-SG 3.35Å; C690-C707 HydrophobicContact CB-CB 3.69Å; C690-C707 WeakPolarHBondContact CB-SG 3.39Å; C690-C707 WeakPolarHBondContact SG-CB 3.42Å; C690-C707 CovalentContact SG-SG 2.03Å; C690-C707 PolarHBondContact SG-SG 3.46Å; C700-C707 HydrophobicContact CB-CB 4.49Å; C707-C709 PolarHBondContact O-N 2.82Å; C707-C709 VanDerWaalsContact O-N 3.08Å; C707-C709 PolarHBondContact O-SG 3.42Å; C707-C709 VanDerWaalsContact O-SG 3.39Å; C707-L716 VanDerWaalsContact CB-O 3.3Å; C707-L716 WeakPolarHBondContact CB-O 3.23Å; C707-L716 PolarHBondContact N-O 3.18Å; C707-L716 PolarHBondContact SG-O 2.93Å; C707-C718 WeakPolarHBondContact CB-SG 2.97Å; C707-C718 PolarHBondContact O-SG 2.88Å
708	S	80.4	Confident	75.3	Confident	61 Å²	61	52.2 Å²	52.2	43%	0.427	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	90.2	180	-64.1	0	0	0	0	111.8	S695 Y696	S695-S708 CarbonylContact C-O 3.38Å; S695-S708 VanDerWaalsContact CA-O 3.26Å; S695-S708 WeakPolarHBondContact CA-O 3.34Å; S695-S708 WeakPolarHBondContact CB-O 3.46Å; Y696-S708 PolarHBondContact N-O 3.49Å
709	C	83.5	Confident	76.2	Confident	33 Å²	33	52.4 Å²	52.4	22%	0.223	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	152.6	-171.6	-52.9	0	0	0	0	114.8	Y696 Q706 C707 V713 C718	Y696-C709 WeakPolarHBondContact CD2-O 3.44Å; Y696-C709 VanDerWaalsContact CE2-O 3.26Å; Y696-C709 WeakPolarHBondContact CE2-O 3.48Å; Q706-C709 PolarHBondContact NE2-SG 2.85Å; Q706-C709 VanDerWaalsContact NE2-SG 3.38Å; C707-C709 PolarHBondContact O-N 2.82Å; C707-C709 VanDerWaalsContact O-N 3.08Å; C707-C709 PolarHBondContact O-SG 3.42Å; C707-C709 VanDerWaalsContact O-SG 3.39Å; C709-V713 HydrophobicContact CB-CB 4.32Å; C709-V713 HydrophobicContact CB-CG1 4.34Å; C709-V713 WeakPolarHBondContact CB-O 3.47Å; C709-C718 WeakPolarHBondContact CA-SG 3.5Å; C709-C718 HydrophobicContact CB-CB 3.75Å; C709-C718 WeakPolarHBondContact CB-SG 3.37Å; C709-C718 PolarHBondContact N-SG 2.92Å; C709-C718 WeakPolarHBondContact SG-CA 3.32Å; C709-C718 WeakPolarHBondContact SG-CB 3.19Å; C709-C718 CovalentContact SG-SG 2.04Å; C709-C718 PolarHBondContact SG-SG 3.01Å
710	R	77.6	Confident	77.3	Confident	69 Å²	69	55.1 Å²	55.1	26%	0.26	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-76.2	162.8	172.4	-71.8	-179.4	-169.7	-126.3	2.4	111.9	H693 G694 S695 Y696 G712 V713 S737	H693-R710 WeakPolarHBondContact O-CD 3.33Å; H693-R710 PolarHBondContact O-NE 3.21Å; G694-R710 WeakPolarHBondContact O-CB 3.39Å; G694-R710 WeakPolarHBondContact O-CG 3.39Å; G694-R710 PolarHBondContact O-N 2.84Å; S695-R710 PolarHBondContact O-NE 2.86Å; S695-R710 PolarHBondContact O-NH2 2.84Å; Y696-R710 HydrophobicContact CD1-CG 4.39Å; Y696-R710 HydrophobicContact CD2-CG 4.25Å; Y696-R710 HydrophobicContact CE1-CG 4.29Å; Y696-R710 HydrophobicContact CE2-CG 4.15Å; Y696-R710 HydrophobicContact CG-CG 4.38Å; R710-G712 PolarHBondContact O-N 2.05Å; R710-V713 HydrophobicContact CB-CB 4.38Å; R710-V713 HydrophobicContact CB-CG2 4.04Å; R710-V713 VanDerWaalsContact O-CB 3.31Å; R710-V713 WeakPolarHBondContact O-CB 3.28Å; R710-V713 PolarHBondContact O-N 2.96Å; R710-S737 WeakPolarHBondContact CB-O 3.39Å; R710-S737 WeakPolarHBondContact CD-O 3.34Å
711	P	79.8	Confident	78	Confident	73 Å²	73	54.4 Å²	54.4	47%	0.474	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	130.8	-177.3	-26.2	36.5	0	0	0	112.8	Y696 V713 S737 G738 C739	Y696-P711 WeakPolarHBondContact OH-CD 3.43Å; P711-V713 PolarHBondContact O-N 3.42Å; P711-S737 WeakPolarHBondContact CD-O 3.25Å; P711-G738 CarbonylContact O-C 3.22Å; P711-G738 VanDerWaalsContact O-CA 3.27Å; P711-G738 WeakPolarHBondContact O-CA 3.28Å; P711-C739 PolarHBondContact O-N 3.37Å
712	G	77.7	Confident	78.9	Confident	6 Å²	6	55.6 Å²	55.6	6%	0.062	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	3.9	-176.5	0	0	0	0	0	114.9	R710 C721 E722 C739	R710-G712 PolarHBondContact O-N 2.05Å; G712-C721 CarbonylContact O-C 3.23Å; G712-C721 VanDerWaalsContact O-CA 3.28Å; G712-C721 WeakPolarHBondContact O-CA 3.4Å; G712-E722 PolarHBondContact O-N 3.26Å; G712-C739 WeakPolarHBondContact O-CB 3.49Å
713	V	85.9	Confident	80.2	Confident	4 Å²	4	58 Å²	58	2%	0.024	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	137.2	171.7	-179.1	0	0	0	0	108.9	G694 C709 R710 P711 C718 R720 F728 I731 C739	G694-V713 WeakPolarHBondContact O-CG1 3.26Å; C709-V713 HydrophobicContact CB-CB 4.32Å; C709-V713 HydrophobicContact CB-CG1 4.34Å; C709-V713 WeakPolarHBondContact CB-O 3.47Å; R710-V713 HydrophobicContact CB-CB 4.38Å; R710-V713 HydrophobicContact CB-CG2 4.04Å; R710-V713 VanDerWaalsContact O-CB 3.31Å; R710-V713 WeakPolarHBondContact O-CB 3.28Å; R710-V713 PolarHBondContact O-N 2.96Å; P711-V713 PolarHBondContact O-N 3.42Å; V713-C718 HydrophobicContact CG1-CB 3.77Å; V713-C718 WeakPolarHBondContact CG1-O 3.34Å; V713-R720 WeakPolarHBondContact CA-O 3.43Å; V713-R720 WeakPolarHBondContact CG1-O 3.38Å; V713-F728 HydrophobicContact CG1-CD2 4.46Å; V713-F728 HydrophobicContact CG1-CE2 3.8Å; V713-F728 HydrophobicContact CG2-CD2 4.5Å; V713-F728 HydrophobicContact CG2-CE2 4.35Å; V713-I731 HydrophobicContact CG2-CD1 3.6Å; V713-C739 HydrophobicContact CG2-CB 4.46Å
714	G	82.1	Confident	81.1	Confident	6 Å²	6	53.4 Å²	53.4	6%	0.062	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	-167.9	-177.9	0	0	0	0	0	114.3	C718 D719 R720	G714-C718 CarbonylContact O-C 3.5Å; G714-C718 WeakPolarHBondContact O-CA 3.28Å; G714-D719 PolarHBondContact O-N 2.97Å; G714-R720 PolarHBondContact N-O 3.04Å
715	G	79.9	Confident	81.9	Confident	34 Å²	34	52.5 Å²	52.5	35%	0.351	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	157.7	-169.7	0	0	0	0	0	112.5	Q706 R717 C718	Q706-G715 PolarHBondContact NE2-O 3.39Å; G715-R717 PolarHBondContact O-N 2.95Å; G715-C718 PolarHBondContact O-N 2.93Å
716	L	78.7	Confident	82.6	Confident	103 Å²	103	53.5 Å²	53.5	54%	0.539	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-34.4	-175.4	-79.8	165.9	0	0	0	113.8	T704 Q706 C707	T704-L716 WeakPolarHBondContact O-CD2 3.45Å; Q706-L716 HydrophobicContact CB-CD2 4.32Å; C707-L716 VanDerWaalsContact CB-O 3.3Å; C707-L716 WeakPolarHBondContact CB-O 3.23Å; C707-L716 PolarHBondContact N-O 3.18Å; C707-L716 PolarHBondContact SG-O 2.93Å
717	R	84.4	Confident	82.8	Confident	128 Å²	128	52 Å²	52	48%	0.483	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	4.3	-178.1	-64.3	179.7	60	-168.5	-6.4	114.3	H689 N691 G715 D719	H689-R717 VanDerWaalsContact O-CZ 3.27Å; H689-R717 PolarHBondContact O-NE 2.91Å; H689-R717 PolarHBondContact O-NH2 2.91Å; N691-R717 VanDerWaalsContact CB-O 3.29Å; N691-R717 WeakPolarHBondContact CB-O 3.31Å; N691-R717 PolarHBondContact N-O 2.85Å; G715-R717 PolarHBondContact O-N 2.95Å; R717-D719 VanDerWaalsContact C-N 3.34Å; R717-D719 HydrophobicContact CB-CB 4.28Å
718	C	86.6	Confident	82.7	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	44.5	-171.7	-46.7	0	0	0	0	112.8	N691 G694 C707 C709 V713 G714 G715	N691-C718 WeakPolarHBondContact CB-O 3.49Å; G694-C718 WeakPolarHBondContact CA-O 3.35Å; G694-C718 WeakPolarHBondContact O-CB 3.34Å; C707-C718 WeakPolarHBondContact CB-SG 2.97Å; C707-C718 PolarHBondContact O-SG 2.88Å; C709-C718 WeakPolarHBondContact CA-SG 3.5Å; C709-C718 HydrophobicContact CB-CB 3.75Å; C709-C718 WeakPolarHBondContact CB-SG 3.37Å; C709-C718 PolarHBondContact N-SG 2.92Å; C709-C718 WeakPolarHBondContact SG-CA 3.32Å; C709-C718 WeakPolarHBondContact SG-CB 3.19Å; C709-C718 CovalentContact SG-SG 2.04Å; C709-C718 PolarHBondContact SG-SG 3.01Å; V713-C718 HydrophobicContact CG1-CB 3.77Å; V713-C718 WeakPolarHBondContact CG1-O 3.34Å; G714-C718 CarbonylContact O-C 3.5Å; G714-C718 WeakPolarHBondContact O-CA 3.28Å; G715-C718 PolarHBondContact O-N 2.93Å
719	D	85.7	Confident	82.3	Confident	59 Å²	59	59 Å²	59	32%	0.316	29%	0.293	S	S	.	.			trans	-103.4	-0.7	-166.4	67.4	-25.1	0	0	0	114.5	G714 R717	G714-D719 PolarHBondContact O-N 2.97Å; R717-D719 VanDerWaalsContact C-N 3.34Å; R717-D719 HydrophobicContact CB-CB 4.28Å
720	R	86.9	Confident	81.4	Confident	130 Å²	130	57.4 Å²	57.4	49%	0.491	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	162.5	-175.4	65.9	-162.3	72	-151.7	-5.2	111.1	V713 G714	V713-R720 WeakPolarHBondContact CA-O 3.43Å; V713-R720 WeakPolarHBondContact CG1-O 3.38Å; G714-R720 PolarHBondContact N-O 3.04Å
721	C	86.6	Confident	80.9	Confident	4 Å²	4	54.7 Å²	54.7	3%	0.027	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	151.4	168.4	-57.7	0	0	0	0	111.3	G712 F725 C739	G712-C721 CarbonylContact O-C 3.23Å; G712-C721 VanDerWaalsContact O-CA 3.28Å; G712-C721 WeakPolarHBondContact O-CA 3.4Å; C721-F725 HydrophobicContact CB-CB 3.97Å; C721-F725 WeakPolarHBondContact CB-O 3.42Å; C721-C739 WeakPolarHBondContact CA-SG 3.36Å; C721-C739 HydrophobicContact CB-CB 3.77Å; C721-C739 WeakPolarHBondContact CB-SG 3.27Å; C721-C739 WeakPolarHBondContact SG-CB 3.37Å; C721-C739 CovalentContact SG-SG 2.05Å; C721-C739 PolarHBondContact SG-SG 3.44Å
722	E	86.8	Confident	79.8	Confident	90 Å²	90	54.9 Å²	54.9	42%	0.421	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-69.5	156	171.2	-65.6	-168.9	114.6	0	0	111.4	G712 G724 F725	G712-E722 PolarHBondContact O-N 3.26Å; E722-G724 PolarHBondContact O-N 2.82Å; E722-F725 HydrophobicContact CB-CD2 4.1Å; E722-F725 WeakPolarHBondContact O-CB 3.39Å; E722-F725 PolarHBondContact O-N 3.47Å
723	P	81.8	Confident	78.4	Confident	108 Å²	108	59.5 Å²	59.5	70%	0.701	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	127.3	172.4	-23.8	34.6	0	0	0	111.1
724	G	79.4	Confident	76.8	Confident	20 Å²	20	63.7 Å²	63.7	21%	0.206	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	4.4	-170.5	0	0	0	0	0	114.6	E722 C742	E722-G724 PolarHBondContact O-N 2.82Å; G724-C742 VanDerWaalsContact O-CB 3.3Å; G724-C742 WeakPolarHBondContact O-CB 3.49Å; G724-C742 PolarHBondContact O-N 2.92Å; G724-C742 PolarHBondContact O-SG 2.04Å
725	F	83.8	Confident	75.4	Confident	65 Å²	65	66.8 Å²	66.8	29%	0.285	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	156.7	172.3	-65	-99	0	0	0	112.1	C721 E722 C739 T740 P741	C721-F725 HydrophobicContact CB-CB 3.97Å; C721-F725 WeakPolarHBondContact CB-O 3.42Å; E722-F725 HydrophobicContact CB-CD2 4.1Å; E722-F725 WeakPolarHBondContact O-CB 3.39Å; E722-F725 PolarHBondContact O-N 3.47Å; F725-C739 HydrophobicContact CB-CB 3.87Å; F725-T740 CarbonylContact C-O 3.55Å; F725-T740 VanDerWaalsContact CA-O 3.27Å; F725-T740 WeakPolarHBondContact CA-O 3.16Å; F725-P741 HydrophobicContact CD1-CB 4.07Å; F725-P741 HydrophobicContact CE1-CB 3.9Å
726	W	86.2	Confident	74.3	Confident	56 Å²	56	70 Å²	70	21%	0.212	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	179.5	-175.9	69.7	-72.8	0	0	0	111.4	C739 T740 P741 Q756 T758 G759	W726-C739 WeakPolarHBondContact O-CB 3.47Å; W726-T740 HydrophobicContact CZ2-CG2 4.05Å; W726-T740 PolarHBondContact N-O 2.8Å; W726-T740 PolarHBondContact O-N 3.19Å; W726-P741 PolarHBondContact NE1-O 2.82Å; W726-Q756 CarbonylContact C-O 3.52Å; W726-Q756 VanDerWaalsContact CA-O 3.24Å; W726-Q756 WeakPolarHBondContact CA-O 3.24Å; W726-Q756 VanDerWaalsContact CB-O 3.32Å; W726-Q756 WeakPolarHBondContact CB-O 3.23Å; W726-T758 VanDerWaalsContact CE3-C 3.48Å; W726-G759 VanDerWaalsContact CE3-CA 3.47Å; W726-G759 VanDerWaalsContact CG-CA 3.49Å
727	N	81.8	Confident	73.3	Confident	39 Å²	39	69.1 Å²	69.1	21%	0.209	36%	0.362	C	S	.	.			trans	64.3	56.3	-179.6	-166	17.2	0	0	0	114.8	R729 G730 Q756	N727-R729 PolarHBondContact O-N 3.27Å; N727-G730 PolarHBondContact O-N 3.21Å; N727-G730 PolarHBondContact OD1-N 2.97Å; N727-Q756 PolarHBondContact N-O 2.59Å
728	F	80.4	Confident	73	Confident	34 Å²	34	63.5 Å²	63.5	15%	0.149	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-24.2	171.3	-167.1	-92.5	0	0	0	112.9	V713 I731	V713-F728 HydrophobicContact CG1-CD2 4.46Å; V713-F728 HydrophobicContact CG1-CE2 3.8Å; V713-F728 HydrophobicContact CG2-CD2 4.5Å; V713-F728 HydrophobicContact CG2-CE2 4.35Å; F728-I731 HydrophobicContact CD2-CD1 4.03Å; F728-I731 HydrophobicContact CE2-CD1 4.3Å; F728-I731 HydrophobicContact CG-CD1 4.47Å; F728-I731 WeakPolarHBondContact O-CB 3.36Å
729	R	73.6	Confident	72.9	Confident	177 Å²	177	64 Å²	64	67%	0.668	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-33.8	179.3	-75.5	-169.7	175	-150.2	-0.4	113.8	N727 I731 V732 T733 M757	N727-R729 PolarHBondContact O-N 3.27Å; R729-I731 PolarHBondContact O-N 2.61Å; R729-I731 VanDerWaalsContact O-N 3.16Å; R729-V732 WeakPolarHBondContact O-CA 3.09Å; R729-V732 WeakPolarHBondContact O-CB 3.49Å; R729-V732 PolarHBondContact O-N 2.81Å; R729-T733 PolarHBondContact O-N 3.04Å; R729-T733 PolarHBondContact O-OG1 2.86Å; R729-M757 HydrophobicContact CG-CE 4.2Å
730	G	63.5	Low	72.8	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.01	35%	0.346	C	S	.	.	H	α-helix	trans	-60.7	-22.8	177.2	0	0	0	0	0	114.2	N727 V732 D734 H736	N727-G730 PolarHBondContact O-N 3.21Å; N727-G730 PolarHBondContact OD1-N 2.97Å; G730-V732 PolarHBondContact O-N 2.96Å; G730-D734 WeakPolarHBondContact CA-OD2 3.03Å; G730-D734 WeakPolarHBondContact O-CA 3.4Å; G730-D734 WeakPolarHBondContact O-CB 3.06Å; G730-D734 PolarHBondContact O-N 2.92Å; G730-H736 PolarHBondContact O-N 2.92Å
731	I	68	Low	72.6	Confident	12 Å²	12	60.3 Å²	60.3	6%	0.062	34%	0.343	C	S	.	.	H	α-helix	trans	-62.3	-32.1	170.6	-54	176	0	0	0	111.1	H693 V713 F728 R729	H693-I731 HydrophobicContact CB-CG2 4.17Å; H693-I731 VanDerWaalsContact O-CG2 3.32Å; H693-I731 WeakPolarHBondContact O-CG2 3.47Å; V713-I731 HydrophobicContact CG2-CD1 3.6Å; F728-I731 HydrophobicContact CD2-CD1 4.03Å; F728-I731 HydrophobicContact CE2-CD1 4.3Å; F728-I731 HydrophobicContact CG-CD1 4.47Å; F728-I731 WeakPolarHBondContact O-CB 3.36Å; R729-I731 PolarHBondContact O-N 2.61Å; R729-I731 VanDerWaalsContact O-N 3.16Å
732	V	56.4	Low	72.4	Confident	77 Å²	77	60.2 Å²	60.2	47%	0.467	34%	0.342	S	S	.	.	H	α-helix	trans	-94	-39.3	-176.1	-169.2	0	0	0	0	111.8	H693 R729 G730	H693-V732 HydrophobicContact CB-CG2 3.96Å; R729-V732 WeakPolarHBondContact O-CA 3.09Å; R729-V732 WeakPolarHBondContact O-CB 3.49Å; R729-V732 PolarHBondContact O-N 2.81Å; G730-V732 PolarHBondContact O-N 2.96Å
733	T	49.1	Very low	72.2	Confident	103 Å²	103	60.1 Å²	60.1	63%	0.632	35%	0.352	S	S	*	.	H	α-helix	trans	-88.7	-37.7	-176.2	55.2	0	0	0	0	113.5	R729	R729-T733 PolarHBondContact O-N 3.04Å; R729-T733 PolarHBondContact O-OG1 2.86Å
734	D	52.3	Low	72.4	Confident	92 Å²	92	55.7 Å²	55.7	49%	0.492	32%	0.323	S	S	.	.	S	Bend	trans	-112.9	10.6	-164.1	-43.2	-23.9	0	0	0	111.8	G730 H736	G730-D734 WeakPolarHBondContact CA-OD2 3.03Å; G730-D734 WeakPolarHBondContact O-CA 3.4Å; G730-D734 WeakPolarHBondContact O-CB 3.06Å; G730-D734 PolarHBondContact O-N 2.92Å; D734-H736 WeakPolarHBondContact CB-ND1 3.33Å; D734-H736 PolarHBondContact O-N 3.37Å; D734-H736 VanDerWaalsContact O-N 3.09Å; D734-H736 PolarHBondContact O-ND1 3.32Å
735	G	51.3	Low	72.5	Confident	70 Å²	70	56.3 Å²	56.3	72%	0.722	32%	0.322	S	S	*	.			trans	63.8	11.5	-179.3	0	0	0	0	0	115.4
736	H	57.8	Low	72.3	Confident	102 Å²	102	57.4 Å²	57.4	47%	0.472	34%	0.336	S	S	.	.			trans	-68.2	142	-172.2	-80.5	52.2	0	0	0	112.4	G730 D734 G738	G730-H736 PolarHBondContact O-N 2.92Å; D734-H736 WeakPolarHBondContact CB-ND1 3.33Å; D734-H736 PolarHBondContact O-N 3.37Å; D734-H736 VanDerWaalsContact O-N 3.09Å; D734-H736 PolarHBondContact O-ND1 3.32Å; H736-G738 VanDerWaalsContact C-N 3.25Å; H736-G738 PolarHBondContact O-N 2.98Å
737	S	57.8	Low	71.9	Confident	84 Å²	84	59.7 Å²	59.7	59%	0.587	34%	0.344	S	S	*	.	S	Bend	trans	-78.1	2.9	-170.9	57.4	0	0	0	0	115.5	R710 P711	R710-S737 WeakPolarHBondContact CB-O 3.39Å; R710-S737 WeakPolarHBondContact CD-O 3.34Å; P711-S737 WeakPolarHBondContact CD-O 3.25Å
738	G	76.5	Confident	71.7	Confident	10 Å²	10	57.9 Å²	57.9	10%	0.103	33%	0.334	C	S	.	.	S	Bend	trans	175.4	-177.3	-177.6	0	0	0	0	0	112.7	P711 H736	P711-G738 CarbonylContact O-C 3.22Å; P711-G738 VanDerWaalsContact O-CA 3.27Å; P711-G738 WeakPolarHBondContact O-CA 3.28Å; H736-G738 VanDerWaalsContact C-N 3.25Å; H736-G738 PolarHBondContact O-N 2.98Å
739	C	84.5	Confident	71.9	Confident	11 Å²	11	56.3 Å²	56.3	7%	0.074	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-73.5	153.4	176.4	-71.7	0	0	0	0	112	P711 G712 V713 C721 F725 W726	P711-C739 PolarHBondContact O-N 3.37Å; G712-C739 WeakPolarHBondContact O-CB 3.49Å; V713-C739 HydrophobicContact CG2-CB 4.46Å; C721-C739 WeakPolarHBondContact CA-SG 3.36Å; C721-C739 HydrophobicContact CB-CB 3.77Å; C721-C739 WeakPolarHBondContact CB-SG 3.27Å; C721-C739 WeakPolarHBondContact SG-CB 3.37Å; C721-C739 CovalentContact SG-SG 2.05Å; C721-C739 PolarHBondContact SG-SG 3.44Å; F725-C739 HydrophobicContact CB-CB 3.87Å; W726-C739 WeakPolarHBondContact O-CB 3.47Å
740	T	84.6	Confident	72.4	Confident	46 Å²	46	52 Å²	52	28%	0.282	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	137.5	178.5	-54.8	0	0	0	0	110.7	F725 W726	F725-T740 CarbonylContact C-O 3.55Å; F725-T740 VanDerWaalsContact CA-O 3.27Å; F725-T740 WeakPolarHBondContact CA-O 3.16Å; W726-T740 HydrophobicContact CZ2-CG2 4.05Å; W726-T740 PolarHBondContact N-O 2.8Å; W726-T740 PolarHBondContact O-N 3.19Å
741	P	82.8	Confident	73.1	Confident	65 Å²	65	59 Å²	59	42%	0.422	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	148.2	176.2	26	-34.1	0	0	0	112.8	F725 W726	F725-P741 HydrophobicContact CD1-CB 4.07Å; F725-P741 HydrophobicContact CE1-CB 3.9Å; W726-P741 PolarHBondContact NE1-O 2.82Å
742	C	82.6	Confident	73.3	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.014	37%	0.372	C	S	.	.			trans	-65.3	-41.8	-178.2	-80.5	0	0	0	0	113.1	G724 C744 C754 K771	G724-C742 VanDerWaalsContact O-CB 3.3Å; G724-C742 WeakPolarHBondContact O-CB 3.49Å; G724-C742 PolarHBondContact O-N 2.92Å; G724-C742 PolarHBondContact O-SG 2.04Å; C742-C744 VanDerWaalsContact C-N 3.31Å; C742-C744 PolarHBondContact O-N 3.38Å; C742-C754 WeakPolarHBondContact CA-SG 3.03Å; C742-C754 HydrophobicContact CB-CB 3.66Å; C742-C754 WeakPolarHBondContact CB-SG 3.08Å; C742-C754 WeakPolarHBondContact SG-CB 3.35Å; C742-C754 PolarHBondContact SG-N 2.96Å; C742-C754 CovalentContact SG-SG 2.03Å; C742-C754 PolarHBondContact SG-SG 3.06Å; C742-K771 VanDerWaalsContact O-CD 3.3Å; C742-K771 WeakPolarHBondContact O-CD 3.14Å; C742-K771 VanDerWaalsContact O-CE 3.3Å; C742-K771 WeakPolarHBondContact O-CE 3.25Å; C742-K771 PolarHBondContact O-NZ 2.87Å
743	S	83.1	Confident	74.4	Confident	88 Å²	88	62.4 Å²	62.4	62%	0.615	36%	0.363	S	S	*	.			trans	52.4	44	177.4	-55.1	0	0	0	0	114
744	C	85.4	Confident	76.1	Confident	16 Å²	16	58.1 Å²	58.1	11%	0.108	34%	0.337	C	S	.	.			trans	-71.3	144.3	170.2	-53.1	0	0	0	0	110.4	C742 P746 A749 C761	C742-C744 VanDerWaalsContact C-N 3.31Å; C742-C744 PolarHBondContact O-N 3.38Å; C744-P746 WeakPolarHBondContact O-CD 3.4Å; C744-A749 HydrophobicContact CB-CB 3.89Å; C744-C761 WeakPolarHBondContact CA-SG 3.42Å; C744-C761 HydrophobicContact CB-CB 3.76Å; C744-C761 WeakPolarHBondContact CB-SG 3.33Å; C744-C761 WeakPolarHBondContact SG-CB 3.21Å; C744-C761 CovalentContact SG-SG 2.03Å; C744-C761 PolarHBondContact SG-SG 2.85Å
745	D	81.6	Confident	77.8	Confident	33 Å²	33	58.8 Å²	58.8	18%	0.176	34%	0.337	C	S	.	.			trans	-74.5	118.8	171.3	-168	-55.7	0	0	0	109.9	R747 G748 A749 K771 L781	D745-R747 PolarHBondContact O-N 3.13Å; D745-R747 VanDerWaalsContact O-N 3.12Å; D745-R747 VanDerWaalsContact OD1-CB 3.23Å; D745-R747 WeakPolarHBondContact OD1-CB 3.2Å; D745-R747 WeakPolarHBondContact OD1-CG 3.43Å; D745-R747 IonicContact OD1-CZ 3.4Å; D745-R747 PolarHBondContact OD1-N 2.75Å; D745-R747 IonicContact OD1-NE 2.67Å; D745-R747 PolarHBondContact OD1-NE 2.77Å; D745-R747 IonicContact OD1-NH2 2.72Å; D745-R747 IonicContact OD2-CZ 3.78Å; D745-R747 IonicContact OD2-NE 2.65Å; D745-R747 PolarHBondContact OD2-NE 3.43Å; D745-R747 IonicContact OD2-NH2 2.71Å; D745-R747 PolarHBondContact OD2-NH2 3.26Å; D745-G748 PolarHBondContact O-N 3.38Å; D745-A749 VanDerWaalsContact O-CB 3.3Å; D745-A749 WeakPolarHBondContact O-CB 3.48Å; D745-A749 PolarHBondContact O-N 2.59Å; D745-K771 PolarHBondContact N-O 3.45Å; D745-L781 HydrophobicContact CB-CD2 4.08Å; D745-L781 VanDerWaalsContact CG-CD2 3.45Å
746	P	78.3	Confident	79.2	Confident	88 Å²	88	59 Å²	59	57%	0.571	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-13.5	-173.6	28.3	-36.3	0	0	0	113.8	C744	C744-P746 WeakPolarHBondContact O-CD 3.4Å
747	R	78.4	Confident	80	Confident	104 Å²	104	59.1 Å²	59.1	39%	0.392	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-38.3	173.2	-58.1	169.4	-69.1	176.3	-7.3	111.3	D745 R764 L781	D745-R747 PolarHBondContact O-N 3.13Å; D745-R747 VanDerWaalsContact O-N 3.12Å; D745-R747 VanDerWaalsContact OD1-CB 3.23Å; D745-R747 WeakPolarHBondContact OD1-CB 3.2Å; D745-R747 WeakPolarHBondContact OD1-CG 3.43Å; D745-R747 IonicContact OD1-CZ 3.4Å; D745-R747 PolarHBondContact OD1-N 2.75Å; D745-R747 IonicContact OD1-NE 2.67Å; D745-R747 PolarHBondContact OD1-NE 2.77Å; D745-R747 IonicContact OD1-NH2 2.72Å; D745-R747 IonicContact OD2-CZ 3.78Å; D745-R747 IonicContact OD2-NE 2.65Å; D745-R747 PolarHBondContact OD2-NE 3.43Å; D745-R747 IonicContact OD2-NH2 2.71Å; D745-R747 PolarHBondContact OD2-NH2 3.26Å; R747-R764 WeakPolarHBondContact O-CD 3.31Å; R747-R764 PolarHBondContact O-NE 2.82Å; R747-L781 HydrophobicContact CB-CD2 4Å; R747-L781 HydrophobicContact CB-CG 3.87Å; R747-L781 WeakPolarHBondContact CD-O 3.36Å; R747-L781 PolarHBondContact NH1-O 2.03Å
748	G	78.9	Confident	81	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-23.3	-174.4	0	0	0	0	0	115.3	D745 R764 C772	D745-G748 PolarHBondContact O-N 3.38Å; G748-R764 WeakPolarHBondContact O-CB 3.48Å; G748-R764 WeakPolarHBondContact O-CG 3.35Å; G748-R764 PolarHBondContact O-N 2.79Å; G748-C772 WeakPolarHBondContact CA-O 3.24Å
749	A	84.6	Confident	81.3	Confident	2 Å²	2	58.8 Å²	58.8	2%	0.017	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	151.9	177.4	0	0	0	0	0	112.3	C744 D745 R751 S762 R764 C772	C744-A749 HydrophobicContact CB-CB 3.89Å; D745-A749 VanDerWaalsContact O-CB 3.3Å; D745-A749 WeakPolarHBondContact O-CB 3.48Å; D745-A749 PolarHBondContact O-N 2.59Å; A749-R751 VanDerWaalsContact CB-O 3.3Å; A749-R751 WeakPolarHBondContact CB-O 3.5Å; A749-S762 CarbonylContact C-O 3.58Å; A749-S762 WeakPolarHBondContact CA-O 3.23Å; A749-R764 PolarHBondContact O-NE 3.38Å; A749-R764 PolarHBondContact O-NH2 3.32Å; A749-C772 HydrophobicContact CB-CB 4.21Å
750	V	82.7	Confident	81.4	Confident	85 Å²	85	62.8 Å²	62.8	52%	0.515	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-29	173.6	-177.4	0	0	0	0	110.7	S762 R764	V750-S762 PolarHBondContact N-O 3.41Å; V750-R764 HydrophobicContact CG2-CG 3.85Å
751	R	77.7	Confident	81.5	Confident	149 Å²	149	60.9 Å²	60.9	56%	0.562	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.5	159	179.9	-62.1	171.2	50.3	148.7	-5.8	109.5	A749 D753	A749-R751 VanDerWaalsContact CB-O 3.3Å; A749-R751 WeakPolarHBondContact CB-O 3.5Å; R751-D753 VanDerWaalsContact CB-OD1 3.22Å; R751-D753 WeakPolarHBondContact CB-OD1 3.23Å; R751-D753 IonicContact CZ-OD1 2.88Å; R751-D753 VanDerWaalsContact CZ-OD1 3.31Å; R751-D753 IonicContact CZ-OD2 2.66Å; R751-D753 IonicContact NE-OD1 3.7Å; R751-D753 PolarHBondContact NE-OD1 3.37Å; R751-D753 IonicContact NE-OD2 3.72Å; R751-D753 IonicContact NH2-OD1 2.64Å; R751-D753 PolarHBondContact NH2-OD1 3.07Å; R751-D753 IonicContact NH2-OD2 2.79Å; R751-D753 PolarHBondContact NH2-OD2 3.23Å
752	D	73.7	Confident	81.8	Confident	111 Å²	111	61.3 Å²	61.3	59%	0.594	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	-13	-178	-53.3	-53.2	0	0	0	113.8
753	D	79.8	Confident	82	Confident	50 Å²	50	63.2 Å²	63.2	27%	0.267	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	151.3	172.8	61.7	-48.7	0	0	0	113.3	R751	R751-D753 VanDerWaalsContact CB-OD1 3.22Å; R751-D753 WeakPolarHBondContact CB-OD1 3.23Å; R751-D753 IonicContact CZ-OD1 2.88Å; R751-D753 VanDerWaalsContact CZ-OD1 3.31Å; R751-D753 IonicContact CZ-OD2 2.66Å; R751-D753 IonicContact NE-OD1 3.7Å; R751-D753 PolarHBondContact NE-OD1 3.37Å; R751-D753 IonicContact NE-OD2 3.72Å; R751-D753 IonicContact NH2-OD1 2.64Å; R751-D753 PolarHBondContact NH2-OD1 3.07Å; R751-D753 IonicContact NH2-OD2 2.79Å; R751-D753 PolarHBondContact NH2-OD2 3.23Å
754	C	83.9	Confident	81.8	Confident	12 Å²	12	62.5 Å²	62.5	8%	0.081	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	166.4	-175.7	72.8	0	0	0	0	110.9	C742 Q756 L760	C742-C754 WeakPolarHBondContact CA-SG 3.03Å; C742-C754 HydrophobicContact CB-CB 3.66Å; C742-C754 WeakPolarHBondContact CB-SG 3.08Å; C742-C754 WeakPolarHBondContact SG-CB 3.35Å; C742-C754 PolarHBondContact SG-N 2.96Å; C742-C754 CovalentContact SG-SG 2.03Å; C742-C754 PolarHBondContact SG-SG 3.06Å; C754-Q756 PolarHBondContact O-N 3.41Å; C754-L760 WeakPolarHBondContact CA-O 3.31Å; C754-L760 WeakPolarHBondContact CB-O 3.22Å
755	E	87.3	Confident	81.4	Confident	106 Å²	106	67.9 Å²	67.9	50%	0.495	36%	0.358	S	S	.	.			trans	-59.9	121	178	-178.8	50	-104	0	0	111.3	M757 T758 G759 L760	E755-M757 PolarHBondContact O-N 3.49Å; E755-M757 VanDerWaalsContact O-N 3.11Å; E755-T758 WeakPolarHBondContact CB-OG1 3.43Å; E755-T758 HydrophobicContact CG-CG2 4.48Å; E755-T758 VanDerWaalsContact CG-OG1 3.29Å; E755-T758 WeakPolarHBondContact CG-OG1 3.41Å; E755-T758 PolarHBondContact O-N 3.42Å; E755-G759 WeakPolarHBondContact O-CA 3.3Å; E755-G759 PolarHBondContact O-N 3.33Å; E755-L760 HydrophobicContact CB-CB 4.28Å; E755-L760 PolarHBondContact N-O 3.02Å
756	Q	81.3	Confident	81	Confident	75 Å²	75	69 Å²	69	35%	0.35	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-22.9	-164.3	-63.8	-169.7	-2.9	0	0	113.4	W726 N727 C754	W726-Q756 CarbonylContact C-O 3.52Å; W726-Q756 VanDerWaalsContact CA-O 3.24Å; W726-Q756 WeakPolarHBondContact CA-O 3.24Å; W726-Q756 VanDerWaalsContact CB-O 3.32Å; W726-Q756 WeakPolarHBondContact CB-O 3.23Å; N727-Q756 PolarHBondContact N-O 2.59Å; C754-Q756 PolarHBondContact O-N 3.41Å
757	M	74.3	Confident	81.1	Confident	104 Å²	104	65.5 Å²	65.5	51%	0.512	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-24.5	179.8	-68.4	-60	-61.8	0	0	114.2	R729 E755	R729-M757 HydrophobicContact CG-CE 4.2Å; E755-M757 PolarHBondContact O-N 3.49Å; E755-M757 VanDerWaalsContact O-N 3.11Å
758	T	78.8	Confident	81.1	Confident	86 Å²	86	62.9 Å²	62.9	53%	0.528	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.3	-11.9	-170.5	64.2	0	0	0	0	114.2	W726 E755 L760	W726-T758 VanDerWaalsContact CE3-C 3.48Å; E755-T758 WeakPolarHBondContact CB-OG1 3.43Å; E755-T758 HydrophobicContact CG-CG2 4.48Å; E755-T758 VanDerWaalsContact CG-OG1 3.29Å; E755-T758 WeakPolarHBondContact CG-OG1 3.41Å; E755-T758 PolarHBondContact O-N 3.42Å; T758-L760 PolarHBondContact O-N 2.87Å
759	G	83.6	Confident	81	Confident	1 Å²	1	64 Å²	64	1%	0.01	37%	0.367	C	S	.	.			trans	73.3	9.9	-177.6	0	0	0	0	0	114.3	W726 E755 K771	W726-G759 VanDerWaalsContact CE3-CA 3.47Å; W726-G759 VanDerWaalsContact CG-CA 3.49Å; E755-G759 WeakPolarHBondContact O-CA 3.3Å; E755-G759 PolarHBondContact O-N 3.33Å; G759-K771 PolarHBondContact O-NZ 3.11Å
760	L	86.1	Confident	80.8	Confident	95 Å²	95	68 Å²	68	50%	0.497	39%	0.392	S	S	.	.			trans	-77.2	122.3	-173.9	-177.5	59.7	0	0	0	111.7	C754 E755 T758 P770	C754-L760 WeakPolarHBondContact CA-O 3.31Å; C754-L760 WeakPolarHBondContact CB-O 3.22Å; E755-L760 HydrophobicContact CB-CB 4.28Å; E755-L760 PolarHBondContact N-O 3.02Å; T758-L760 PolarHBondContact O-N 2.87Å; L760-P770 HydrophobicContact CD1-CB 4.3Å
761	C	87.9	Confident	80.9	Confident	6 Å²	6	66.9 Å²	66.9	4%	0.041	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	146	179.4	-62.6	0	0	0	0	112.1	C744 C763 P770 C772	C744-C761 WeakPolarHBondContact CA-SG 3.42Å; C744-C761 HydrophobicContact CB-CB 3.76Å; C744-C761 WeakPolarHBondContact CB-SG 3.33Å; C744-C761 WeakPolarHBondContact SG-CB 3.21Å; C744-C761 CovalentContact SG-SG 2.03Å; C744-C761 PolarHBondContact SG-SG 2.85Å; C761-C763 PolarHBondContact O-N 2.98Å; C761-P770 PolarHBondContact N-O 2.97Å; C761-C772 WeakPolarHBondContact CB-SG 3.15Å
762	S	87.4	Confident	81.2	Confident	74 Å²	74	59.8 Å²	59.8	52%	0.517	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	103.5	175.5	-71.4	0	0	0	0	111.1	A749 V750	A749-S762 CarbonylContact C-O 3.58Å; A749-S762 WeakPolarHBondContact CA-O 3.23Å; V750-S762 PolarHBondContact N-O 3.41Å
763	C	86.4	Confident	81.6	Confident	42 Å²	42	56.7 Å²	56.7	28%	0.284	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	149.7	-173.6	-50.9	0	0	0	0	114.4	C761 V767 C772	C761-C763 PolarHBondContact O-N 2.98Å; C763-V767 HydrophobicContact CB-CB 4.34Å; C763-C772 WeakPolarHBondContact CA-SG 3.35Å; C763-C772 HydrophobicContact CB-CB 3.72Å; C763-C772 WeakPolarHBondContact CB-SG 3.39Å; C763-C772 PolarHBondContact N-SG 3.32Å; C763-C772 VanDerWaalsContact N-SG 3.37Å; C763-C772 WeakPolarHBondContact SG-CA 3.31Å; C763-C772 WeakPolarHBondContact SG-CB 3.46Å; C763-C772 CovalentContact SG-SG 2.04Å; C763-C772 PolarHBondContact SG-SG 3.24Å
764	R	80.4	Confident	81.6	Confident	74 Å²	74	60.1 Å²	60.1	28%	0.279	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-70.4	152.6	173	-68.5	175.4	-174.2	-126.1	-2.1	110.7	R747 G748 A749 V750 G766 V767	R747-R764 WeakPolarHBondContact O-CD 3.31Å; R747-R764 PolarHBondContact O-NE 2.82Å; G748-R764 WeakPolarHBondContact O-CB 3.48Å; G748-R764 WeakPolarHBondContact O-CG 3.35Å; G748-R764 PolarHBondContact O-N 2.79Å; A749-R764 PolarHBondContact O-NE 3.38Å; A749-R764 PolarHBondContact O-NH2 3.32Å; V750-R764 HydrophobicContact CG2-CG 3.85Å; R764-G766 PolarHBondContact O-N 3.31Å; R764-V767 HydrophobicContact CB-CG2 4.06Å; R764-V767 WeakPolarHBondContact O-CB 3.35Å; R764-V767 PolarHBondContact O-N 3.49Å
765	P	77.2	Confident	81.4	Confident	129 Å²	129	61.1 Å²	61.1	84%	0.838	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	127.6	177.6	-26.5	35.4	0	0	0	112.4
766	G	72.6	Confident	80.8	Confident	56 Å²	56	59.2 Å²	59.2	58%	0.577	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	-15.4	-176.5	0	0	0	0	0	115.1	R764 P776 C786	R764-G766 PolarHBondContact O-N 3.31Å; G766-P776 WeakPolarHBondContact O-CD 3.38Å; G766-C786 PolarHBondContact O-SG 3.09Å; G766-C786 VanDerWaalsContact O-SG 3.35Å
767	V	81.3	Confident	80.1	Confident	15 Å²	15	64 Å²	64	9%	0.091	39%	0.394	C	S	.	.			trans	-94.3	140.5	177.9	-171.6	0	0	0	0	110.6	C763 R764 C772 L781	C763-V767 HydrophobicContact CB-CB 4.34Å; R764-V767 HydrophobicContact CB-CG2 4.06Å; R764-V767 WeakPolarHBondContact O-CB 3.35Å; R764-V767 PolarHBondContact O-N 3.49Å; V767-C772 HydrophobicContact CG1-CB 3.97Å; V767-C772 WeakPolarHBondContact CG1-O 3.24Å; V767-L781 HydrophobicContact CB-CD1 4.48Å; V767-L781 HydrophobicContact CG1-CD1 3.81Å; V767-L781 HydrophobicContact CG2-CD1 3.79Å
768	A	76.6	Confident	79.4	Confident	49 Å²	49	62.9 Å²	62.9	41%	0.405	41%	0.409	S	S	.	.	B	Isolated β-bridge	trans	-129.2	178.4	-175	0	0	0	0	0	113.3	C772 G773 Q774	A768-C772 CarbonylContact O-C 3.57Å; A768-C772 WeakPolarHBondContact O-CA 3.43Å; A768-G773 PolarHBondContact O-N 3.5Å; A768-Q774 HydrophobicContact CB-CB 4.37Å; A768-Q774 PolarHBondContact N-O 3.38Å; A768-Q774 PolarHBondContact O-N 2.61Å; A768-Q774 VanDerWaalsContact O-N 3.07Å
769	G	78.3	Confident	78.9	Confident	23 Å²	23	62.9 Å²	62.9	24%	0.237	40%	0.403	C	S	.	.	S	Bend	trans	84.5	155.8	-179.2	0	0	0	0	0	113.4	K771 C772 Q774	G769-K771 PolarHBondContact O-N 3.34Å; G769-C772 PolarHBondContact O-N 3.26Å; G769-Q774 VanDerWaalsContact CA-OE1 3.32Å
770	P	79.4	Confident	78.1	Confident	85 Å²	85	65.6 Å²	65.6	55%	0.552	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-19.1	-169.9	25.7	-35.4	0	0	0	114.5	L760 C761	L760-P770 HydrophobicContact CD1-CB 4.3Å; C761-P770 PolarHBondContact N-O 2.97Å
771	K	85.4	Confident	77.2	Confident	62 Å²	62	62.1 Å²	62.1	27%	0.27	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	11.4	177.5	-55.5	-58	-177.1	-179.8	0	113.4	C742 D745 G759 G769 G773	C742-K771 VanDerWaalsContact O-CD 3.3Å; C742-K771 WeakPolarHBondContact O-CD 3.14Å; C742-K771 VanDerWaalsContact O-CE 3.3Å; C742-K771 WeakPolarHBondContact O-CE 3.25Å; C742-K771 PolarHBondContact O-NZ 2.87Å; D745-K771 PolarHBondContact N-O 3.45Å; G759-K771 PolarHBondContact O-NZ 3.11Å; G769-K771 PolarHBondContact O-N 3.34Å; K771-G773 VanDerWaalsContact C-N 3.33Å; K771-G773 PolarHBondContact O-N 3.13Å
772	C	83.7	Confident	76.3	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	41%	0.414	C	S	.	.	S	Bend	trans	59	36.8	-179.4	-44.9	0	0	0	0	114.6	G748 A749 C761 C763 V767 A768 G769	G748-C772 WeakPolarHBondContact CA-O 3.24Å; A749-C772 HydrophobicContact CB-CB 4.21Å; C761-C772 WeakPolarHBondContact CB-SG 3.15Å; C763-C772 WeakPolarHBondContact CA-SG 3.35Å; C763-C772 HydrophobicContact CB-CB 3.72Å; C763-C772 WeakPolarHBondContact CB-SG 3.39Å; C763-C772 PolarHBondContact N-SG 3.32Å; C763-C772 VanDerWaalsContact N-SG 3.37Å; C763-C772 WeakPolarHBondContact SG-CA 3.31Å; C763-C772 WeakPolarHBondContact SG-CB 3.46Å; C763-C772 CovalentContact SG-SG 2.04Å; C763-C772 PolarHBondContact SG-SG 3.24Å; V767-C772 HydrophobicContact CG1-CB 3.97Å; V767-C772 WeakPolarHBondContact CG1-O 3.24Å; A768-C772 CarbonylContact O-C 3.57Å; A768-C772 WeakPolarHBondContact O-CA 3.43Å; G769-C772 PolarHBondContact O-N 3.26Å
773	G	81.3	Confident	75.1	Confident	47 Å²	47	67 Å²	67	49%	0.485	43%	0.426	S	S	.	.			trans	-103.2	-0.3	-178.2	0	0	0	0	0	115.2	A768 K771	A768-G773 PolarHBondContact O-N 3.5Å; K771-G773 VanDerWaalsContact C-N 3.33Å; K771-G773 PolarHBondContact O-N 3.13Å
774	Q	81.4	Confident	74	Confident	121 Å²	121	71.9 Å²	71.9	57%	0.565	45%	0.448	S	S	*	.	B	Isolated β-bridge	trans	-113.2	137.3	-172.8	-65.2	171	-22.4	0	0	111.3	A768 G769	A768-Q774 HydrophobicContact CB-CB 4.37Å; A768-Q774 PolarHBondContact N-O 3.38Å; A768-Q774 PolarHBondContact O-N 2.61Å; A768-Q774 VanDerWaalsContact O-N 3.07Å; G769-Q774 VanDerWaalsContact CA-OE1 3.32Å
775	C	79.7	Confident	73.4	Confident	34 Å²	34	68.5 Å²	68.5	23%	0.23	44%	0.437	C	S	.	.			trans	-116	157.3	172.9	-77	0	0	0	0	110.5	Q779 C786	C775-Q779 HydrophobicContact CB-CB 4.19Å; C775-Q779 WeakPolarHBondContact CB-O 3.47Å; C775-C786 WeakPolarHBondContact CA-SG 3.27Å; C775-C786 HydrophobicContact CB-CB 3.83Å; C775-C786 WeakPolarHBondContact CB-SG 3.32Å; C775-C786 WeakPolarHBondContact SG-CA 3.31Å; C775-C786 WeakPolarHBondContact SG-CB 3.07Å; C775-C786 CovalentContact SG-SG 2.04Å; C775-C786 PolarHBondContact SG-SG 2.78Å
776	P	74.3	Confident	73.1	Confident	66 Å²	66	63.6 Å²	63.6	43%	0.429	41%	0.405	S	S	.	.	S	Bend	trans	-63.5	155.2	171.1	28.9	-35.5	0	0	0	111.3	G766 G778 Q779	G766-P776 WeakPolarHBondContact O-CD 3.38Å; P776-G778 PolarHBondContact O-N 3.26Å; P776-Q779 PolarHBondContact O-N 3.01Å; P776-Q779 VanDerWaalsContact O-N 3.15Å
777	D	65.4	Low	72.8	Confident	175 Å²	175	63.9 Å²	63.9	94%	0.936	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	126.4	-171	-65.5	-61.2	0	0	0	113.5
778	G	61.1	Low	71.6	Confident	80 Å²	80	66.9 Å²	66.9	83%	0.825	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.7	8.8	179.2	0	0	0	0	0	115.8	P776	P776-G778 PolarHBondContact O-N 3.26Å
779	Q	67.9	Low	70.3	Confident	86 Å²	86	69.4 Å²	69.4	40%	0.402	43%	0.425	S	S	.	.			trans	-119.1	146.3	172.8	-61.6	-177.2	-4.5	0	0	111.7	C775 P776 C786 A788	C775-Q779 HydrophobicContact CB-CB 4.19Å; C775-Q779 WeakPolarHBondContact CB-O 3.47Å; P776-Q779 PolarHBondContact O-N 3.01Å; P776-Q779 VanDerWaalsContact O-N 3.15Å; Q779-C786 HydrophobicContact CB-CB 4.11Å; Q779-C786 VanDerWaalsContact OE1-CB 3.31Å; Q779-A788 HydrophobicContact CG-CB 4.43Å
780	A	66.1	Low	69.3	Low	58 Å²	58	73.9 Å²	73.9	48%	0.479	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	158.5	178.5	0	0	0	0	0	111.1	G782 C786 E787	A780-G782 PolarHBondContact O-N 3.25Å; A780-G782 VanDerWaalsContact O-N 3.14Å; A780-C786 WeakPolarHBondContact O-CA 3.36Å; A780-E787 PolarHBondContact N-O 3.21Å; A780-E787 PolarHBondContact O-N 3.31Å
781	L	68.4	Low	68.3	Low	23 Å²	23	75.6 Å²	75.6	12%	0.12	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	91.9	-178.1	-160.7	69.1	0	0	0	110.8	D745 R747 V767	D745-L781 HydrophobicContact CB-CD2 4.08Å; D745-L781 VanDerWaalsContact CG-CD2 3.45Å; R747-L781 HydrophobicContact CB-CD2 4Å; R747-L781 HydrophobicContact CB-CG 3.87Å; R747-L781 WeakPolarHBondContact CD-O 3.36Å; R747-L781 PolarHBondContact NH1-O 2.03Å; V767-L781 HydrophobicContact CB-CD1 4.48Å; V767-L781 HydrophobicContact CG1-CD1 3.81Å; V767-L781 HydrophobicContact CG2-CD1 3.79Å
782	G	67.2	Low	66.6	Low	17 Å²	17	77.2 Å²	77.2	18%	0.175	47%	0.473	C	S	.	.			trans	-90.1	-164.1	179.7	0	0	0	0	0	113.6	A780 L784 G785 E787	A780-G782 PolarHBondContact O-N 3.25Å; A780-G782 VanDerWaalsContact O-N 3.14Å; G782-L784 PolarHBondContact O-N 3.36Å; G782-G785 PolarHBondContact N-O 3.06Å; G782-E787 WeakPolarHBondContact CA-OE2 2.99Å
783	H	64	Low	65.1	Low	165 Å²	165	79.5 Å²	79.5	76%	0.764	49%	0.489	S	S	*	.	S	Bend	trans	-80.4	-17.1	-167.6	-113.9	-63.3	0	0	0	115	E787	H783-E787 PolarHBondContact N-OE1 2.84Å; H783-E787 PolarHBondContact N-OE2 3.21Å
784	L	61.4	Low	64.1	Low	144 Å²	144	81.5 Å²	81.5	75%	0.754	49%	0.491	S	S	*	.	S	Bend	trans	-110.2	-12.5	178.1	-62.5	171.3	0	0	0	113	G782 E787	G782-L784 PolarHBondContact O-N 3.36Å; L784-E787 WeakPolarHBondContact CB-OE1 3.22Å; L784-E787 PolarHBondContact N-OE1 3.32Å
785	G	67.8	Low	63.6	Low	4 Å²	4	77.9 Å²	77.9	4%	0.041	48%	0.477	C	S	.	.	S	Bend	trans	146.4	-140.1	-176.4	0	0	0	0	0	110.6	G782 E787	G782-G785 PolarHBondContact N-O 3.06Å; G785-E787 PolarHBondContact O-N 3.09Å
786	C	72.8	Confident	63.2	Low	25 Å²	25	77.7 Å²	77.7	17%	0.169	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	115.7	173	-61.1	0	0	0	0	110.8	G766 C775 Q779 A780	G766-C786 PolarHBondContact O-SG 3.09Å; G766-C786 VanDerWaalsContact O-SG 3.35Å; C775-C786 WeakPolarHBondContact CA-SG 3.27Å; C775-C786 HydrophobicContact CB-CB 3.83Å; C775-C786 WeakPolarHBondContact CB-SG 3.32Å; C775-C786 WeakPolarHBondContact SG-CA 3.31Å; C775-C786 WeakPolarHBondContact SG-CB 3.07Å; C775-C786 CovalentContact SG-SG 2.04Å; C775-C786 PolarHBondContact SG-SG 2.78Å; Q779-C786 HydrophobicContact CB-CB 4.11Å; Q779-C786 VanDerWaalsContact OE1-CB 3.31Å; A780-C786 WeakPolarHBondContact O-CA 3.36Å
787	E	64.6	Low	63	Low	62 Å²	62	80.8 Å²	80.8	29%	0.29	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	143	-177.7	-73.9	166.8	-155.5	0	0	109.5	A780 G782 H783 L784 G785	A780-E787 PolarHBondContact N-O 3.21Å; A780-E787 PolarHBondContact O-N 3.31Å; G782-E787 WeakPolarHBondContact CA-OE2 2.99Å; H783-E787 PolarHBondContact N-OE1 2.84Å; H783-E787 PolarHBondContact N-OE2 3.21Å; L784-E787 WeakPolarHBondContact CB-OE1 3.22Å; L784-E787 PolarHBondContact N-OE1 3.32Å; G785-E787 PolarHBondContact O-N 3.09Å
788	A	56.9	Low	62.9	Low	78 Å²	78	79.3 Å²	79.3	65%	0.645	48%	0.481	S	S	*	.			trans	-98.6	87.5	173.7	0	0	0	0	0	108.7	Q779	Q779-A788 HydrophobicContact CG-CB 4.43Å
789	D	49.5	Very low	62.9	Low	103 Å²	103	78.4 Å²	78.4	55%	0.551	46%	0.456	S	S	*	.			trans	-113.7	118.6	-173.2	-172	15.6	0	0	0	113.3
790	P	56.4	Low	62.9	Low	116 Å²	116	83.1 Å²	83.1	75%	0.753	48%	0.477	S	S	*	.			trans	-101.1	60.3	175.2	39.7	-34.2	0	0	0	113.7
791	T	58.6	Low	63.2	Low	122 Å²	122	82 Å²	82	75%	0.748	47%	0.466	S	S	*	.			trans	-164	85.4	153.7	23.3	0	0	0	0	113.7
792	T	49.5	Very low	63.1	Low	95 Å²	95	87.6 Å²	87.6	58%	0.583	49%	0.492	S	S	*	.			trans	-95	141.7	163.9	44.4	0	0	0	0	111.4
793	P	53.4	Low	63.4	Low	49 Å²	49	90.2 Å²	90.2	32%	0.318	50%	0.498	S	S	.	.			trans	-71.3	135.7	176.8	28.1	-32.6	0	0	0	111.2	M799 A814	P793-M799 HydrophobicContact CB-CG 4.36Å; P793-M799 HydrophobicContact CG-CE 4.24Å; P793-M799 HydrophobicContact CG-CG 3.93Å; P793-M799 HydrophobicContact CG-SD 3.62Å; P793-A814 PolarHBondContact O-N 2.92Å
794	V	60.7	Low	63.4	Low	88 Å²	88	85.4 Å²	85.4	53%	0.533	49%	0.493	S	S	.	.			trans	-83.6	-25	-167	177.5	0	0	0	0	112.7
795	T	70.7	Confident	63.9	Low	46 Å²	46	79.5 Å²	79.5	28%	0.282	47%	0.465	S	S	.	.			trans	-134.6	147.7	-172.4	69.6	0	0	0	0	113.9	V797 E798 E809	T795-V797 PolarHBondContact O-N 3.05Å; T795-V797 VanDerWaalsContact O-N 3.15Å; T795-E798 PolarHBondContact O-N 2.04Å; T795-E798 VanDerWaalsContact O-N 3.14Å; T795-E809 VanDerWaalsContact CA-OE1 3.25Å; T795-E809 WeakPolarHBondContact CA-OE1 3.03Å; T795-E809 WeakPolarHBondContact CB-OE1 3.49Å
796	C	71.3	Confident	64.1	Low	30 Å²	30	82.1 Å²	82.1	20%	0.203	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-5	176.8	-80.6	0	0	0	0	113.5	E798 C807 V808 E809 A814	C796-E798 VanDerWaalsContact C-N 3.34Å; C796-C807 WeakPolarHBondContact CA-SG 3.05Å; C796-C807 HydrophobicContact CB-CB 3.69Å; C796-C807 WeakPolarHBondContact CB-SG 3.48Å; C796-C807 WeakPolarHBondContact SG-CB 3.36Å; C796-C807 CovalentContact SG-SG 2.03Å; C796-C807 PolarHBondContact SG-SG 2.88Å; C796-V808 PolarHBondContact SG-N 2.96Å; C796-V808 VanDerWaalsContact SG-N 3.42Å; C796-E809 HydrophobicContact CB-CG 3.93Å; C796-E809 PolarHBondContact N-OE1 2.8Å; C796-E809 VanDerWaalsContact SG-CG 3.57Å; C796-A814 HydrophobicContact CB-CB 4.4Å
797	V	69.2	Low	64.2	Low	130 Å²	130	83 Å²	83	79%	0.788	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-27.8	171.4	-172.5	0	0	0	0	111.4	T795	T795-V797 PolarHBondContact O-N 3.05Å; T795-V797 VanDerWaalsContact O-N 3.15Å
798	E	63.8	Low	64.7	Low	145 Å²	145	82.8 Å²	82.8	68%	0.678	49%	0.491	S	S	*	.	S	Bend	trans	-94.4	-5.4	-179.2	-60.6	-177.7	138.7	0	0	112.9	T795 C796	T795-E798 PolarHBondContact O-N 2.04Å; T795-E798 VanDerWaalsContact O-N 3.14Å; C796-E798 VanDerWaalsContact C-N 3.34Å
799	M	61.6	Low	65.7	Low	60 Å²	60	84.2 Å²	84.2	30%	0.296	49%	0.485	S	S	.	.			trans	-111.5	150.6	-176.8	-71.6	-77.4	-91.1	0	0	111.6	P793 A814	P793-M799 HydrophobicContact CB-CG 4.36Å; P793-M799 HydrophobicContact CG-CE 4.24Å; P793-M799 HydrophobicContact CG-CG 3.93Å; P793-M799 HydrophobicContact CG-SD 3.62Å; M799-A814 HydrophobicContact CG-CB 4.07Å
800	H	66.5	Low	66.3	Low	185 Å²	185	86 Å²	86	86%	0.856	49%	0.49	S	S	*	.			trans	-131.5	132.3	169.7	-107.7	46.1	0	0	0	109.8
801	C	72.2	Confident	66.2	Low	35 Å²	35	85.5 Å²	85.5	24%	0.236	50%	0.495	C	S	.	.			trans	-107.2	123.1	-175.5	-57	0	0	0	0	110.2	A805 C807 C816	C801-A805 HydrophobicContact CB-CB 4Å; C801-A805 WeakPolarHBondContact CB-O 3.36Å; C801-C807 VanDerWaalsContact SG-CB 3.56Å; C801-C816 WeakPolarHBondContact CA-SG 3.34Å; C801-C816 HydrophobicContact CB-CB 3.79Å; C801-C816 WeakPolarHBondContact CB-SG 3.2Å; C801-C816 VanDerWaalsContact SG-CA 3.52Å; C801-C816 WeakPolarHBondContact SG-CB 3.39Å; C801-C816 CovalentContact SG-SG 2.04Å; C801-C816 PolarHBondContact SG-SG 2.81Å
802	E	66.9	Low	66.3	Low	141 Å²	141	82.2 Å²	82.2	66%	0.659	49%	0.485	S	S	*	.			trans	-91	174.4	178.4	-62.9	-177.5	150.5	0	0	111.3	G804 A805	E802-G804 PolarHBondContact O-N 3.18Å; E802-A805 PolarHBondContact O-N 2.92Å
803	F	73.5	Confident	66.6	Low	72 Å²	72	81.4 Å²	81.4	32%	0.316	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	17.2	173.9	-46.6	-77.9	0	0	0	116.4	C850 R853 D855	F803-C850 VanDerWaalsContact O-CA 3.26Å; F803-C850 WeakPolarHBondContact O-CA 3.1Å; F803-C850 WeakPolarHBondContact O-CB 3.23Å; F803-R853 HydrophobicContact CD2-CB 3.89Å; F803-R853 HydrophobicContact CD2-CG 4.19Å; F803-R853 WeakPolarHBondContact CE1-O 3.5Å; F803-R853 HydrophobicContact CE2-CB 3.92Å; F803-R853 HydrophobicContact CE2-CG 4.47Å; F803-R853 HydrophobicContact CG-CB 4.4Å; F803-R853 HydrophobicContact CZ-CB 4.43Å; F803-D855 HydrophobicContact CD1-CB 4.4Å; F803-D855 HydrophobicContact CE1-CB 4.17Å
804	G	63.7	Low	67.4	Low	63 Å²	63	79.4 Å²	79.4	65%	0.649	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.3	13.1	178.1	0	0	0	0	0	115.4	E802	E802-G804 PolarHBondContact O-N 3.18Å
805	A	73.1	Confident	68.1	Low	20 Å²	20	79.9 Å²	79.9	17%	0.165	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-71.3	142.3	170.7	0	0	0	0	0	111.7	C801 E802 C816 C850	C801-A805 HydrophobicContact CB-CB 4Å; C801-A805 WeakPolarHBondContact CB-O 3.36Å; E802-A805 PolarHBondContact O-N 2.92Å; A805-C816 HydrophobicContact CB-CB 4.16Å; A805-C850 VanDerWaalsContact CA-SG 3.58Å; A805-C850 PolarHBondContact N-SG 3.22Å; A805-C850 VanDerWaalsContact N-SG 3.36Å
806	S	71.7	Confident	68.4	Low	60 Å²	60	79.9 Å²	79.9	42%	0.42	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	135.1	171.7	46.5	0	0	0	0	110.3	V817	S806-V817 PolarHBondContact N-O 3.44Å; S806-V817 PolarHBondContact O-N 3Å; S806-V817 PolarHBondContact OG-O 3.4Å; S806-V817 VanDerWaalsContact OG-O 3.12Å
807	C	75.3	Confident	68.7	Low	44 Å²	44	81.4 Å²	81.4	30%	0.297	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	136.2	172.1	-162.3	0	0	0	0	110.5	C796 C801 Q815	C796-C807 WeakPolarHBondContact CA-SG 3.05Å; C796-C807 HydrophobicContact CB-CB 3.69Å; C796-C807 WeakPolarHBondContact CB-SG 3.48Å; C796-C807 WeakPolarHBondContact SG-CB 3.36Å; C796-C807 CovalentContact SG-SG 2.03Å; C796-C807 PolarHBondContact SG-SG 2.88Å; C801-C807 VanDerWaalsContact SG-CB 3.56Å; C807-Q815 WeakPolarHBondContact CA-O 3.31Å
808	V	74.1	Confident	69.1	Low	56 Å²	56	76.7 Å²	76.7	34%	0.339	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	138.2	177.2	-159.1	0	0	0	0	108.6	C796 E810 Q815 V817	C796-V808 PolarHBondContact SG-N 2.96Å; C796-V808 VanDerWaalsContact SG-N 3.42Å; V808-E810 HydrophobicContact CG1-CG 4.25Å; V808-Q815 PolarHBondContact N-O 3.35Å; V808-Q815 PolarHBondContact O-N 2.66Å; V808-V817 HydrophobicContact CB-CG2 4.45Å; V808-V817 HydrophobicContact CG2-CB 4.03Å; V808-V817 HydrophobicContact CG2-CG2 3.88Å
809	E	79.1	Confident	69.1	Low	108 Å²	108	72.7 Å²	72.7	51%	0.505	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	108.1	175.3	-61.8	-177.1	172.2	0	0	108.9	T795 C796	T795-E809 VanDerWaalsContact CA-OE1 3.25Å; T795-E809 WeakPolarHBondContact CA-OE1 3.03Å; T795-E809 WeakPolarHBondContact CB-OE1 3.49Å; C796-E809 HydrophobicContact CB-CG 3.93Å; C796-E809 PolarHBondContact N-OE1 2.8Å; C796-E809 VanDerWaalsContact SG-CG 3.57Å
810	E	60.8	Low	68.9	Low	142 Å²	142	74.7 Å²	74.7	66%	0.664	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.1	143.5	174.9	-69.9	-165.4	146.4	0	0	110	V808 G812 F813	V808-E810 HydrophobicContact CG1-CG 4.25Å; E810-G812 PolarHBondContact O-N 3.26Å; E810-F813 PolarHBondContact N-O 2.87Å; E810-F813 PolarHBondContact O-N 2.86Å; E810-F813 VanDerWaalsContact O-N 3.09Å; E810-F813 VanDerWaalsContact O-O 3.12Å
811	A	54.5	Low	68.5	Low	104 Å²	104	70.3 Å²	70.3	86%	0.86	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	20	175.8	0	0	0	0	0	117	F813	A811-F813 HydrophobicContact CB-CE1 3.96Å
812	G	60.4	Low	67.7	Low	53 Å²	53	74.5 Å²	74.5	55%	0.546	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.6	17.2	177.9	0	0	0	0	0	115.6	E810	E810-G812 PolarHBondContact O-N 3.26Å
813	F	56.6	Low	67.1	Low	79 Å²	79	69 Å²	69	35%	0.346	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	156	167.8	58.3	-89.1	0	0	0	111.4	E810 A811	E810-F813 PolarHBondContact N-O 2.87Å; E810-F813 PolarHBondContact O-N 2.86Å; E810-F813 VanDerWaalsContact O-N 3.09Å; E810-F813 VanDerWaalsContact O-O 3.12Å; A811-F813 HydrophobicContact CB-CE1 3.96Å
814	A	69.8	Low	66.3	Low	7 Å²	7	70.7 Å²	70.7	6%	0.058	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	125.6	-177.8	0	0	0	0	0	111.8	P793 C796 M799	P793-A814 PolarHBondContact O-N 2.92Å; C796-A814 HydrophobicContact CB-CB 4.4Å; M799-A814 HydrophobicContact CG-CB 4.07Å
815	Q	76.4	Confident	65.7	Low	97 Å²	97	76.1 Å²	76.1	45%	0.453	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	133.1	-178.3	-175.9	170.2	-23.6	0	0	112.1	C807 V808 V817	C807-Q815 WeakPolarHBondContact CA-O 3.31Å; V808-Q815 PolarHBondContact N-O 3.35Å; V808-Q815 PolarHBondContact O-N 2.66Å; Q815-V817 HydrophobicContact CG-CG2 4.24Å; Q815-V817 PolarHBondContact O-N 3.19Å
816	C	76.9	Confident	64.4	Low	46 Å²	46	79.6 Å²	79.6	31%	0.311	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	119.5	168.4	-63.6	0	0	0	0	110.3	C801 A805	C801-C816 WeakPolarHBondContact CA-SG 3.34Å; C801-C816 HydrophobicContact CB-CB 3.79Å; C801-C816 WeakPolarHBondContact CB-SG 3.2Å; C801-C816 VanDerWaalsContact SG-CA 3.52Å; C801-C816 WeakPolarHBondContact SG-CB 3.39Å; C801-C816 CovalentContact SG-SG 2.04Å; C801-C816 PolarHBondContact SG-SG 2.81Å; A805-C816 HydrophobicContact CB-CB 4.16Å
817	V	76.4	Confident	63.6	Low	62 Å²	62	82.6 Å²	82.6	38%	0.376	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	128.1	179.9	-176.9	0	0	0	0	109.3	S806 V808 Q815	S806-V817 PolarHBondContact N-O 3.44Å; S806-V817 PolarHBondContact O-N 3Å; S806-V817 PolarHBondContact OG-O 3.4Å; S806-V817 VanDerWaalsContact OG-O 3.12Å; V808-V817 HydrophobicContact CB-CG2 4.45Å; V808-V817 HydrophobicContact CG2-CB 4.03Å; V808-V817 HydrophobicContact CG2-CG2 3.88Å; Q815-V817 HydrophobicContact CG-CG2 4.24Å; Q815-V817 PolarHBondContact O-N 3.19Å
818	C	77.4	Confident	62.9	Low	31 Å²	31	85.2 Å²	85.2	21%	0.209	51%	0.512	C	S	.	.	P	Polyproline II helix	trans	-75.4	134.8	170.1	-71.2	0	0	0	0	110.1	C850 R851	C818-C850 VanDerWaalsContact CA-SG 3.51Å; C818-C850 HydrophobicContact CB-CB 3.93Å; C818-C850 WeakPolarHBondContact CB-SG 3.5Å; C818-C850 WeakPolarHBondContact SG-CB 3.23Å; C818-C850 PolarHBondContact SG-O 3.31Å; C818-C850 VanDerWaalsContact SG-O 3.38Å; C818-C850 CovalentContact SG-SG 2.04Å; C818-C850 PolarHBondContact SG-SG 3.46Å; C818-R851 HydrophobicContact CB-CG 4.1Å
819	P	65.1	Low	62.7	Low	61 Å²	61	86.2 Å²	86.2	40%	0.396	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-50.2	141.4	176.3	-29.8	36	0	0	0	113.6	T847	P819-T847 WeakPolarHBondContact O-CG2 3.34Å
820	T	57.1	Low	62.8	Low	103 Å²	103	87 Å²	87	63%	0.632	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-71.8	159.7	168.3	44.4	0	0	0	0	110.3	T822	T820-T822 PolarHBondContact O-N 3.11Å
821	L	56.9	Low	63.9	Low	93 Å²	93	80.3 Å²	80.3	49%	0.487	49%	0.489	S	S	.	.	S	Bend	trans	-79.9	65.3	-170.9	-83.3	142.5	0	0	0	112.5	Q844 T847	L821-Q844 HydrophobicContact CD2-CG 4.45Å; L821-T847 HydrophobicContact CD1-CG2 4.38Å; L821-T847 HydrophobicContact CD2-CG2 4.3Å; L821-T847 HydrophobicContact CG-CG2 3.98Å
822	T	55.1	Low	65.4	Low	123 Å²	123	75.4 Å²	75.4	76%	0.755	45%	0.448	S	S	*	.			trans	-99.7	54.2	163.9	45.2	0	0	0	0	110.3	T820 P824	T820-T822 PolarHBondContact O-N 3.11Å; T822-P824 VanDerWaalsContact O-CD 3.23Å; T822-P824 WeakPolarHBondContact O-CD 3.47Å
823	C	56.2	Low	66.5	Low	26 Å²	26	72.9 Å²	72.9	18%	0.176	42%	0.422	C	S	.	.			trans	-76.9	109.6	172.7	-65.2	0	0	0	0	109.4	C843	C823-C843 VanDerWaalsContact CA-SG 3.57Å; C823-C843 HydrophobicContact CB-CB 3.68Å; C823-C843 WeakPolarHBondContact CB-SG 3.27Å; C823-C843 WeakPolarHBondContact SG-CB 3.42Å; C823-C843 CovalentContact SG-SG 2.04Å; C823-C843 PolarHBondContact SG-SG 2.96Å
824	P	54.8	Low	67.6	Low	106 Å²	106	71.5 Å²	71.5	69%	0.688	42%	0.422	S	S	*	.			trans	-66.5	138.5	-178.9	27.6	-34.7	0	0	0	111.3	T822 A826	T822-P824 VanDerWaalsContact O-CD 3.23Å; T822-P824 WeakPolarHBondContact O-CD 3.47Å; P824-A826 PolarHBondContact O-N 3.28Å
825	E	51.6	Low	68.1	Low	178 Å²	178	74.8 Å²	74.8	83%	0.832	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-70.8	1.1	-168	-57.8	-171.6	125.7	0	0	115.2	N827	E825-N827 PolarHBondContact O-N 3.09Å
826	A	47	Very low	68.1	Low	93 Å²	93	72.2 Å²	72.2	77%	0.769	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-65.6	-4.2	-174	0	0	0	0	0	115.8	P824	P824-A826 PolarHBondContact O-N 3.28Å
827	N	54.3	Low	68.1	Low	123 Å²	123	73.5 Å²	73.5	66%	0.658	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-146.6	76.4	170.9	-94.5	-43.3	0	0	0	111.2	E825 T829 N841	E825-N827 PolarHBondContact O-N 3.09Å; N827-T829 PolarHBondContact O-N 2.69Å; N827-T829 VanDerWaalsContact O-N 3.09Å; N827-N841 WeakPolarHBondContact O-CB 3.32Å
828	S	59.4	Low	68.4	Low	99 Å²	99	73.3 Å²	73.3	69%	0.692	44%	0.444	S	S	*	.			trans	-78.6	28.9	177.5	54.8	0	0	0	0	114.4	K830	S828-K830 PolarHBondContact O-N 3.03Å
829	T	71.6	Confident	68.5	Low	76 Å²	76	72.5 Å²	72.5	47%	0.466	44%	0.436	S	S	.	.			trans	-74.5	111.1	175.3	53.3	0	0	0	0	110.2	N827 V831 G840 N841	N827-T829 PolarHBondContact O-N 2.69Å; N827-T829 VanDerWaalsContact O-N 3.09Å; T829-V831 WeakPolarHBondContact O-CG1 3.24Å; T829-G840 CarbonylContact C-O 3.59Å; T829-N841 WeakPolarHBondContact O-CA 3.23Å
830	K	79.9	Confident	68.8	Low	125 Å²	125	71 Å²	71	54%	0.543	43%	0.432	S	S	.	.			trans	-53.1	144.9	169.7	-63.6	-172.7	179	-176.7	0	110.6	S828 T838 Y839 G840 G862	S828-K830 PolarHBondContact O-N 3.03Å; K830-T838 HydrophobicContact CB-CG2 4.25Å; K830-T838 HydrophobicContact CD-CG2 4.35Å; K830-Y839 CarbonylContact C-O 3.22Å; K830-Y839 VanDerWaalsContact CA-O 3.24Å; K830-Y839 WeakPolarHBondContact CA-O 3.45Å; K830-G840 WeakPolarHBondContact CA-O 3.17Å; K830-G840 PolarHBondContact N-O 2.81Å; K830-G862 CarbonylContact O-C 3.58Å; K830-G862 VanDerWaalsContact O-CA 3.29Å; K830-G862 WeakPolarHBondContact O-CA 3.42Å; K830-G862 PolarHBondContact O-N 3.38Å
831	V	84.1	Confident	69.8	Low	1 Å²	1	67.5 Å²	67.5	1%	0.006	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	143.4	-179.8	-60	0	0	0	0	111.2	T829 Y839 L845 I858 L861 G862	T829-V831 WeakPolarHBondContact O-CG1 3.24Å; V831-Y839 PolarHBondContact N-O 2.7Å; V831-Y839 PolarHBondContact O-N 3.26Å; V831-L845 HydrophobicContact CG2-CB 4.22Å; V831-L845 HydrophobicContact CG2-CD1 3.72Å; V831-I858 HydrophobicContact CB-CD1 4.34Å; V831-I858 HydrophobicContact CB-CG1 4.19Å; V831-I858 HydrophobicContact CB-CG2 4.16Å; V831-I858 HydrophobicContact CG1-CD1 4.12Å; V831-I858 HydrophobicContact CG1-CG1 4.5Å; V831-I858 HydrophobicContact CG1-CG2 4.45Å; V831-I858 HydrophobicContact CG2-CD1 4.38Å; V831-I858 HydrophobicContact CG2-CG1 4.15Å; V831-L861 HydrophobicContact CG1-CD2 3.71Å; V831-G862 CarbonylContact C-O 3.57Å; V831-G862 VanDerWaalsContact C-O 3.26Å; V831-G862 WeakPolarHBondContact CA-O 3.37Å
832	C	86	Confident	70.9	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.014	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	125.7	173.2	-177.3	0	0	0	0	109.7	I858 Q859 S860 G862 C864	C832-I858 CarbonylContact O-C 3.33Å; C832-Q859 PolarHBondContact O-N 3.03Å; C832-S860 WeakPolarHBondContact CB-OG 3.34Å; C832-S860 PolarHBondContact N-O 2.85Å; C832-S860 PolarHBondContact O-N 2.89Å; C832-G862 PolarHBondContact N-O 2.9Å; C832-C864 WeakPolarHBondContact CA-SG 3.39Å; C832-C864 HydrophobicContact CB-CB 3.98Å; C832-C864 WeakPolarHBondContact CB-SG 3.34Å; C832-C864 WeakPolarHBondContact SG-CA 3.27Å; C832-C864 WeakPolarHBondContact SG-CB 3.49Å; C832-C864 CovalentContact SG-SG 2.03Å; C832-C864 PolarHBondContact SG-SG 2.85Å
833	G	83.5	Confident	72	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	161.7	173.8	0	0	0	0	0	113.1	D835 G836 V837 S857	G833-D835 VanDerWaalsContact C-OD1 3.28Å; G833-D835 VanDerWaalsContact CA-OD1 3.31Å; G833-D835 WeakPolarHBondContact CA-OD1 3.45Å; G833-D835 PolarHBondContact O-N 2.88Å; G833-G836 PolarHBondContact O-N 3.05Å; G833-V837 PolarHBondContact N-O 2.82Å; G833-S857 CarbonylContact C-O 3.53Å; G833-S857 WeakPolarHBondContact CA-O 3.45Å
834	S	80.2	Confident	73.1	Confident	50 Å²	50	66.2 Å²	66.2	35%	0.35	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-9.6	174.6	52.3	0	0	0	0	114.1	S857	S834-S857 WeakPolarHBondContact CB-OG 3.42Å; S834-S857 PolarHBondContact N-O 2.79Å; S834-S857 PolarHBondContact OG-N 3.28Å; S834-S857 PolarHBondContact OG-O 3.3Å; S834-S857 PolarHBondContact OG-OG 3.11Å
835	D	79.6	Confident	74.4	Confident	76 Å²	76	61.3 Å²	61.3	41%	0.406	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-8.7	170.2	64.9	-21.1	0	0	0	113.6	G833 V837 Y839	G833-D835 VanDerWaalsContact C-OD1 3.28Å; G833-D835 VanDerWaalsContact CA-OD1 3.31Å; G833-D835 WeakPolarHBondContact CA-OD1 3.45Å; G833-D835 PolarHBondContact O-N 2.88Å; D835-V837 PolarHBondContact OD1-N 2.97Å; D835-V837 WeakPolarHBondContact OD2-CB 3.37Å; D835-V837 WeakPolarHBondContact OD2-CG2 3.48Å; D835-Y839 PolarHBondContact OD2-OH 3.14Å; D835-Y839 VanDerWaalsContact OD2-OH 3.04Å
836	G	76.8	Confident	75.4	Confident	43 Å²	43	58.3 Å²	58.3	44%	0.443	35%	0.347	S	S	.	.	S	Bend	trans	84.9	10	-175.9	0	0	0	0	0	114.6	G833 C864	G833-G836 PolarHBondContact O-N 3.05Å; G836-C864 PolarHBondContact O-SG 2.86Å
837	V	77.4	Confident	76.6	Confident	72 Å²	72	54.3 Å²	54.3	44%	0.436	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-94.8	143	177.9	-179.6	0	0	0	0	110.8	G833 D835 Y839 C864	G833-V837 PolarHBondContact N-O 2.82Å; D835-V837 PolarHBondContact OD1-N 2.97Å; D835-V837 WeakPolarHBondContact OD2-CB 3.37Å; D835-V837 WeakPolarHBondContact OD2-CG2 3.48Å; V837-Y839 HydrophobicContact CB-CE2 3.88Å; V837-Y839 HydrophobicContact CG1-CE2 4.07Å; V837-Y839 WeakPolarHBondContact O-CD2 3.05Å; V837-Y839 WeakPolarHBondContact O-CE2 3.43Å; V837-C864 PolarHBondContact O-SG 3.47Å; V837-C864 VanDerWaalsContact O-SG 3.32Å
838	T	81.4	Confident	77.6	Confident	59 Å²	59	50.6 Å²	50.6	36%	0.362	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	123.7	175.2	-61.9	0	0	0	0	111.3	K830 P863 C864	K830-T838 HydrophobicContact CB-CG2 4.25Å; K830-T838 HydrophobicContact CD-CG2 4.35Å; T838-P863 HydrophobicContact CG2-CB 3.86Å; T838-C864 PolarHBondContact OG1-N 2.03Å
839	Y	79.7	Confident	78.5	Confident	14 Å²	14	46.1 Å²	46.1	6%	0.055	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	150.8	175.7	-63	-91.8	0	0	0	110.8	K830 V831 D835 V837 N841 L845 I848 I856	K830-Y839 CarbonylContact C-O 3.22Å; K830-Y839 VanDerWaalsContact CA-O 3.24Å; K830-Y839 WeakPolarHBondContact CA-O 3.45Å; V831-Y839 PolarHBondContact N-O 2.7Å; V831-Y839 PolarHBondContact O-N 3.26Å; D835-Y839 PolarHBondContact OD2-OH 3.14Å; D835-Y839 VanDerWaalsContact OD2-OH 3.04Å; V837-Y839 HydrophobicContact CB-CE2 3.88Å; V837-Y839 HydrophobicContact CG1-CE2 4.07Å; V837-Y839 WeakPolarHBondContact O-CD2 3.05Å; V837-Y839 WeakPolarHBondContact O-CE2 3.43Å; Y839-N841 PolarHBondContact O-N 3.24Å; Y839-L845 HydrophobicContact CD1-CB 3.96Å; Y839-L845 HydrophobicContact CD1-CG 4.29Å; Y839-L845 HydrophobicContact CD2-CB 4.04Å; Y839-L845 HydrophobicContact CD2-CD1 3.56Å; Y839-L845 HydrophobicContact CD2-CG 3.72Å; Y839-L845 HydrophobicContact CE2-CD1 4.03Å; Y839-L845 HydrophobicContact CE2-CG 3.97Å; Y839-L845 HydrophobicContact CG-CB 3.66Å; Y839-L845 HydrophobicContact CG-CD1 4.06Å; Y839-L845 HydrophobicContact CG-CG 3.89Å; Y839-I848 HydrophobicContact CD1-CD1 3.98Å; Y839-I848 HydrophobicContact CE1-CB 4.06Å; Y839-I848 HydrophobicContact CE1-CD1 3.88Å; Y839-I848 HydrophobicContact CE1-CG2 4Å; Y839-I856 HydrophobicContact CE2-CG2 4.25Å; Y839-I856 VanDerWaalsContact OH-CD1 3.23Å; Y839-I856 WeakPolarHBondContact OH-CD1 3.32Å
840	G	72.6	Confident	78.9	Confident	29 Å²	29	42.9 Å²	42.9	30%	0.299	24%	0.242	S	C	.	.	S	Bend	trans	-67.5	-32.7	-178.1	0	0	0	0	0	113.8	T829 K830	T829-G840 CarbonylContact C-O 3.59Å; K830-G840 WeakPolarHBondContact CA-O 3.17Å; K830-G840 PolarHBondContact N-O 2.81Å
841	N	78.3	Confident	78.7	Confident	29 Å²	29	43.3 Å²	43.3	16%	0.155	24%	0.24	C	C	.	.	S	Bend	trans	-159.6	172.9	167.7	61	51.6	0	0	0	111.6	N827 T829 Y839 C843 Q844 L845	N827-N841 WeakPolarHBondContact O-CB 3.32Å; T829-N841 WeakPolarHBondContact O-CA 3.23Å; Y839-N841 PolarHBondContact O-N 3.24Å; N841-C843 VanDerWaalsContact C-N 3.3Å; N841-C843 PolarHBondContact O-N 2.82Å; N841-C843 WeakPolarHBondContact OD1-CA 3.38Å; N841-C843 WeakPolarHBondContact OD1-CB 3.31Å; N841-C843 PolarHBondContact OD1-N 3.44Å; N841-Q844 PolarHBondContact O-N 3.37Å; N841-Q844 PolarHBondContact OD1-N 3.3Å; N841-L845 PolarHBondContact O-N 2.93Å; N841-L845 VanDerWaalsContact O-N 3.09Å
842	E	79.6	Confident	78.3	Confident	93 Å²	93	48.7 Å²	48.7	44%	0.435	27%	0.265	S	S	.	.	H	α-helix	trans	-58.2	-36.1	178.3	170.4	166.8	-163.8	0	0	113.8	K846 I858	E842-K846 HydrophobicContact CG-CD 4.21Å; E842-K846 WeakPolarHBondContact O-CG 3.31Å; E842-K846 PolarHBondContact O-N 3.4Å; E842-K846 VanDerWaalsContact O-N 3.09Å; E842-K846 WeakPolarHBondContact OE1-CE 3.29Å; E842-K846 IonicContact OE1-NZ 2.93Å; E842-K846 PolarHBondContact OE1-NZ 3.03Å; E842-I858 HydrophobicContact CB-CD1 3.77Å; E842-I858 HydrophobicContact CG-CD1 3.66Å
843	C	78.7	Confident	77.4	Confident	52 Å²	52	57.7 Å²	57.7	35%	0.351	30%	0.299	S	S	.	.	H	α-helix	trans	-67.8	-45.2	178.9	179.4	0	0	0	0	110.9	C823 N841 L845 K846 T847	C823-C843 VanDerWaalsContact CA-SG 3.57Å; C823-C843 HydrophobicContact CB-CB 3.68Å; C823-C843 WeakPolarHBondContact CB-SG 3.27Å; C823-C843 WeakPolarHBondContact SG-CB 3.42Å; C823-C843 CovalentContact SG-SG 2.04Å; C823-C843 PolarHBondContact SG-SG 2.96Å; N841-C843 VanDerWaalsContact C-N 3.3Å; N841-C843 PolarHBondContact O-N 2.82Å; N841-C843 WeakPolarHBondContact OD1-CA 3.38Å; N841-C843 WeakPolarHBondContact OD1-CB 3.31Å; N841-C843 PolarHBondContact OD1-N 3.44Å; C843-L845 PolarHBondContact O-N 3.38Å; C843-K846 PolarHBondContact O-N 2.86Å; C843-T847 PolarHBondContact O-N 3.49Å; C843-T847 PolarHBondContact O-OG1 2.85Å
844	Q	77.9	Confident	76.8	Confident	71 Å²	71	61.8 Å²	61.8	33%	0.332	32%	0.32	S	S	.	.	H	α-helix	trans	-61	-42.1	175.6	-168	-173.2	23.7	0	0	112.1	L821 N841 T847 I848	L821-Q844 HydrophobicContact CD2-CG 4.45Å; N841-Q844 PolarHBondContact O-N 3.37Å; N841-Q844 PolarHBondContact OD1-N 3.3Å; Q844-T847 PolarHBondContact O-N 3.41Å; Q844-I848 HydrophobicContact CG-CD1 3.89Å; Q844-I848 WeakPolarHBondContact O-CB 3.19Å; Q844-I848 WeakPolarHBondContact O-CG1 3.27Å; Q844-I848 PolarHBondContact O-N 2.77Å
845	L	82	Confident	76.6	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.01	34%	0.34	C	S	.	.	H	α-helix	trans	-56.7	-51.1	174	-174.7	160.1	0	0	0	110.5	V831 Y839 N841 C843 T847 I848 A849 I856 I858	V831-L845 HydrophobicContact CG2-CB 4.22Å; V831-L845 HydrophobicContact CG2-CD1 3.72Å; Y839-L845 HydrophobicContact CD1-CB 3.96Å; Y839-L845 HydrophobicContact CD1-CG 4.29Å; Y839-L845 HydrophobicContact CD2-CB 4.04Å; Y839-L845 HydrophobicContact CD2-CD1 3.56Å; Y839-L845 HydrophobicContact CD2-CG 3.72Å; Y839-L845 HydrophobicContact CE2-CD1 4.03Å; Y839-L845 HydrophobicContact CE2-CG 3.97Å; Y839-L845 HydrophobicContact CG-CB 3.66Å; Y839-L845 HydrophobicContact CG-CD1 4.06Å; Y839-L845 HydrophobicContact CG-CG 3.89Å; N841-L845 PolarHBondContact O-N 2.93Å; N841-L845 VanDerWaalsContact O-N 3.09Å; C843-L845 PolarHBondContact O-N 3.38Å; L845-T847 PolarHBondContact O-N 3.09Å; L845-I848 PolarHBondContact O-N 3.29Å; L845-A849 VanDerWaalsContact O-CB 3.23Å; L845-A849 WeakPolarHBondContact O-CB 3.22Å; L845-A849 PolarHBondContact O-N 3.05Å; L845-I856 HydrophobicContact CD1-CG2 4.36Å; L845-I856 HydrophobicContact CD2-CB 4.13Å; L845-I856 HydrophobicContact CD2-CG2 4.07Å; L845-I856 VanDerWaalsContact CD2-O 3.27Å; L845-I856 WeakPolarHBondContact CD2-O 3.01Å; L845-I856 HydrophobicContact CG-CG2 4.21Å; L845-I858 HydrophobicContact CD1-CG1 3.93Å
846	K	73.7	Confident	76.4	Confident	115 Å²	115	63.2 Å²	63.2	50%	0.5	32%	0.324	S	S	.	.	H	α-helix	trans	-63.6	-39.8	179.9	-70.9	174.1	-174.6	173.8	0	113.1	E842 C843 C850	E842-K846 HydrophobicContact CG-CD 4.21Å; E842-K846 WeakPolarHBondContact O-CG 3.31Å; E842-K846 PolarHBondContact O-N 3.4Å; E842-K846 VanDerWaalsContact O-N 3.09Å; E842-K846 WeakPolarHBondContact OE1-CE 3.29Å; E842-K846 IonicContact OE1-NZ 2.93Å; E842-K846 PolarHBondContact OE1-NZ 3.03Å; C843-K846 PolarHBondContact O-N 2.86Å; K846-C850 WeakPolarHBondContact O-CB 3.42Å; K846-C850 PolarHBondContact O-N 2.65Å
847	T	72.7	Confident	76.6	Confident	9 Å²	9	64.2 Å²	64.2	6%	0.055	32%	0.324	C	S	.	.	H	α-helix	trans	-67.9	-36.9	176.9	-54.4	0	0	0	0	112.3	P819 L821 C843 Q844 L845 R851	P819-T847 WeakPolarHBondContact O-CG2 3.34Å; L821-T847 HydrophobicContact CD1-CG2 4.38Å; L821-T847 HydrophobicContact CD2-CG2 4.3Å; L821-T847 HydrophobicContact CG-CG2 3.98Å; C843-T847 PolarHBondContact O-N 3.49Å; C843-T847 PolarHBondContact O-OG1 2.85Å; Q844-T847 PolarHBondContact O-N 3.41Å; L845-T847 PolarHBondContact O-N 3.09Å; T847-R851 VanDerWaalsContact O-CG 3.27Å; T847-R851 WeakPolarHBondContact O-CG 3.19Å; T847-R851 PolarHBondContact O-N 3.1Å; T847-R851 VanDerWaalsContact O-N 3.1Å
848	I	75.4	Confident	76.8	Confident	45 Å²	45	63.6 Å²	63.6	23%	0.231	32%	0.318	C	S	.	.	H	α-helix	trans	-71.5	-45.1	176.7	-67.6	171.2	0	0	0	110.6	Y839 Q844 L845 C850 R851 Q852	Y839-I848 HydrophobicContact CD1-CD1 3.98Å; Y839-I848 HydrophobicContact CE1-CB 4.06Å; Y839-I848 HydrophobicContact CE1-CD1 3.88Å; Y839-I848 HydrophobicContact CE1-CG2 4Å; Q844-I848 HydrophobicContact CG-CD1 3.89Å; Q844-I848 WeakPolarHBondContact O-CB 3.19Å; Q844-I848 WeakPolarHBondContact O-CG1 3.27Å; Q844-I848 PolarHBondContact O-N 2.77Å; L845-I848 PolarHBondContact O-N 3.29Å; I848-C850 VanDerWaalsContact C-N 3.32Å; I848-C850 PolarHBondContact O-N 2.65Å; I848-R851 PolarHBondContact O-N 3.23Å; I848-Q852 HydrophobicContact CG2-CG 4.24Å; I848-Q852 WeakPolarHBondContact O-CB 3.29Å; I848-Q852 WeakPolarHBondContact O-CG 3.38Å; I848-Q852 PolarHBondContact O-N 3.22Å
849	A	77.8	Confident	76.8	Confident	6 Å²	6	67 Å²	67	5%	0.05	33%	0.33	C	S	.	.	H	α-helix	trans	-51.8	-48.2	172.3	0	0	0	0	0	112	L845 Q852 R853 L854 I856	L845-A849 VanDerWaalsContact O-CB 3.23Å; L845-A849 WeakPolarHBondContact O-CB 3.22Å; L845-A849 PolarHBondContact O-N 3.05Å; A849-Q852 PolarHBondContact O-N 3.35Å; A849-R853 WeakPolarHBondContact O-CA 3.1Å; A849-R853 PolarHBondContact O-N 2.83Å; A849-L854 WeakPolarHBondContact CB-O 3.49Å; A849-L854 PolarHBondContact O-N 2.92Å; A849-I856 HydrophobicContact CB-CB 4.07Å; A849-I856 HydrophobicContact CB-CD1 4.45Å; A849-I856 HydrophobicContact CB-CG1 4.17Å
850	C	79.1	Confident	76.7	Confident	7 Å²	7	68.7 Å²	68.7	5%	0.047	34%	0.344	C	S	.	.	H	α-helix	trans	-57.6	-52.3	175	-170.2	0	0	0	0	112.4	F803 A805 C818 K846 I848 Q852 R853	F803-C850 VanDerWaalsContact O-CA 3.26Å; F803-C850 WeakPolarHBondContact O-CA 3.1Å; F803-C850 WeakPolarHBondContact O-CB 3.23Å; A805-C850 VanDerWaalsContact CA-SG 3.58Å; A805-C850 PolarHBondContact N-SG 3.22Å; A805-C850 VanDerWaalsContact N-SG 3.36Å; C818-C850 VanDerWaalsContact CA-SG 3.51Å; C818-C850 HydrophobicContact CB-CB 3.93Å; C818-C850 WeakPolarHBondContact CB-SG 3.5Å; C818-C850 WeakPolarHBondContact SG-CB 3.23Å; C818-C850 PolarHBondContact SG-O 3.31Å; C818-C850 VanDerWaalsContact SG-O 3.38Å; C818-C850 CovalentContact SG-SG 2.04Å; C818-C850 PolarHBondContact SG-SG 3.46Å; K846-C850 WeakPolarHBondContact O-CB 3.42Å; K846-C850 PolarHBondContact O-N 2.65Å; I848-C850 VanDerWaalsContact C-N 3.32Å; I848-C850 PolarHBondContact O-N 2.65Å; C850-Q852 VanDerWaalsContact C-N 3.34Å; C850-Q852 PolarHBondContact O-N 3.08Å; C850-R853 PolarHBondContact O-N 2.9Å
851	R	76.1	Confident	76.9	Confident	135 Å²	135	73.7 Å²	73.7	51%	0.509	36%	0.363	S	S	.	.	H	α-helix	trans	-65.9	-34.8	-176.4	-72.8	172.8	-179.5	-156.1	-2.5	113	C818 T847 I848	C818-R851 HydrophobicContact CB-CG 4.1Å; T847-R851 VanDerWaalsContact O-CG 3.27Å; T847-R851 WeakPolarHBondContact O-CG 3.19Å; T847-R851 PolarHBondContact O-N 3.1Å; T847-R851 VanDerWaalsContact O-N 3.1Å; I848-R851 PolarHBondContact O-N 3.23Å
852	Q	75	Confident	76.6	Confident	113 Å²	113	73.4 Å²	73.4	53%	0.528	37%	0.367	S	S	.	.	H	α-helix	trans	-88	-6.8	178.9	-65	-179.2	-8.8	0	0	113.3	I848 A849 C850 L854	I848-Q852 HydrophobicContact CG2-CG 4.24Å; I848-Q852 WeakPolarHBondContact O-CB 3.29Å; I848-Q852 WeakPolarHBondContact O-CG 3.38Å; I848-Q852 PolarHBondContact O-N 3.22Å; A849-Q852 PolarHBondContact O-N 3.35Å; C850-Q852 VanDerWaalsContact C-N 3.34Å; C850-Q852 PolarHBondContact O-N 3.08Å; Q852-L854 VanDerWaalsContact C-N 3.32Å; Q852-L854 HydrophobicContact CB-CD1 4.02Å; Q852-L854 HydrophobicContact CB-CG 4.04Å; Q852-L854 PolarHBondContact O-N 2.92Å
853	R	68.6	Low	76.2	Confident	191 Å²	191	72.9 Å²	72.9	72%	0.721	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	45.3	-171.6	-58.5	-171.8	-179.2	-149.2	4.2	113.2	F803 A849 C850	F803-R853 HydrophobicContact CD2-CB 3.89Å; F803-R853 HydrophobicContact CD2-CG 4.19Å; F803-R853 WeakPolarHBondContact CE1-O 3.5Å; F803-R853 HydrophobicContact CE2-CB 3.92Å; F803-R853 HydrophobicContact CE2-CG 4.47Å; F803-R853 HydrophobicContact CG-CB 4.4Å; F803-R853 HydrophobicContact CZ-CB 4.43Å; A849-R853 WeakPolarHBondContact O-CA 3.1Å; A849-R853 PolarHBondContact O-N 2.83Å; C850-R853 PolarHBondContact O-N 2.9Å
854	L	71.1	Confident	76.2	Confident	86 Å²	86	71.9 Å²	71.9	45%	0.45	37%	0.365	S	S	.	.			trans	-115.2	134.5	177.3	-63.9	177.5	0	0	0	109.5	A849 Q852 I856	A849-L854 WeakPolarHBondContact CB-O 3.49Å; A849-L854 PolarHBondContact O-N 2.92Å; Q852-L854 VanDerWaalsContact C-N 3.32Å; Q852-L854 HydrophobicContact CB-CD1 4.02Å; Q852-L854 HydrophobicContact CB-CG 4.04Å; Q852-L854 PolarHBondContact O-N 2.92Å; L854-I856 VanDerWaalsContact C-N 3.26Å; L854-I856 HydrophobicContact CB-CD1 3.94Å; L854-I856 HydrophobicContact CB-CG1 3.65Å; L854-I856 HydrophobicContact CD1-CD1 4.2Å; L854-I856 PolarHBondContact O-N 2.88Å
855	D	74.9	Confident	76	Confident	141 Å²	141	79.6 Å²	79.6	75%	0.754	39%	0.391	S	S	*	.			trans	-81.7	75.7	174.1	-169.8	23.1	0	0	0	109.8	F803	F803-D855 HydrophobicContact CD1-CB 4.4Å; F803-D855 HydrophobicContact CE1-CB 4.17Å
856	I	76.4	Confident	74.3	Confident	15 Å²	15	88.9 Å²	88.9	8%	0.077	43%	0.434	C	S	.	.			trans	-91.3	122.8	178.9	-45.1	-177.5	0	0	0	108.2	Y839 L845 A849 L854	Y839-I856 HydrophobicContact CE2-CG2 4.25Å; Y839-I856 VanDerWaalsContact OH-CD1 3.23Å; Y839-I856 WeakPolarHBondContact OH-CD1 3.32Å; L845-I856 HydrophobicContact CD1-CG2 4.36Å; L845-I856 HydrophobicContact CD2-CB 4.13Å; L845-I856 HydrophobicContact CD2-CG2 4.07Å; L845-I856 VanDerWaalsContact CD2-O 3.27Å; L845-I856 WeakPolarHBondContact CD2-O 3.01Å; L845-I856 HydrophobicContact CG-CG2 4.21Å; A849-I856 HydrophobicContact CB-CB 4.07Å; A849-I856 HydrophobicContact CB-CD1 4.45Å; A849-I856 HydrophobicContact CB-CG1 4.17Å; L854-I856 VanDerWaalsContact C-N 3.26Å; L854-I856 HydrophobicContact CB-CD1 3.94Å; L854-I856 HydrophobicContact CB-CG1 3.65Å; L854-I856 HydrophobicContact CD1-CD1 4.2Å; L854-I856 PolarHBondContact O-N 2.88Å
857	S	80.7	Confident	72.6	Confident	65 Å²	65	88.7 Å²	88.7	46%	0.455	45%	0.447	S	S	.	.			trans	-113.7	158.8	178.2	59.1	0	0	0	0	110.7	G833 S834 Q859	G833-S857 CarbonylContact C-O 3.53Å; G833-S857 WeakPolarHBondContact CA-O 3.45Å; S834-S857 WeakPolarHBondContact CB-OG 3.42Å; S834-S857 PolarHBondContact N-O 2.79Å; S834-S857 PolarHBondContact OG-N 3.28Å; S834-S857 PolarHBondContact OG-O 3.3Å; S834-S857 PolarHBondContact OG-OG 3.11Å; S857-Q859 PolarHBondContact O-N 2.78Å
858	I	81.7	Confident	70.8	Confident	59 Å²	59	95.1 Å²	95.1	30%	0.303	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	115.1	176.6	-64.4	169	0	0	0	109.1	V831 C832 E842 L845 S860 L861	V831-I858 HydrophobicContact CB-CD1 4.34Å; V831-I858 HydrophobicContact CB-CG1 4.19Å; V831-I858 HydrophobicContact CB-CG2 4.16Å; V831-I858 HydrophobicContact CG1-CD1 4.12Å; V831-I858 HydrophobicContact CG1-CG1 4.5Å; V831-I858 HydrophobicContact CG1-CG2 4.45Å; V831-I858 HydrophobicContact CG2-CD1 4.38Å; V831-I858 HydrophobicContact CG2-CG1 4.15Å; C832-I858 CarbonylContact O-C 3.33Å; E842-I858 HydrophobicContact CB-CD1 3.77Å; E842-I858 HydrophobicContact CG-CD1 3.66Å; L845-I858 HydrophobicContact CD1-CG1 3.93Å; I858-S860 WeakPolarHBondContact CG2-O 3.37Å; I858-L861 HydrophobicContact CG2-CD2 4.22Å
859	Q	80.4	Confident	68.7	Low	130 Å²	130	97.3 Å²	97.3	61%	0.607	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.6	-35.5	173.6	-170.3	179.9	95.3	0	0	111.8	C832 S857	C832-Q859 PolarHBondContact O-N 3.03Å; S857-Q859 PolarHBondContact O-N 2.78Å
860	S	78.8	Confident	66.7	Low	50 Å²	50	103 Å²	103	35%	0.35	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	157.1	170.4	60.8	0	0	0	0	113.1	C832 I858	C832-S860 WeakPolarHBondContact CB-OG 3.34Å; C832-S860 PolarHBondContact N-O 2.85Å; C832-S860 PolarHBondContact O-N 2.89Å; I858-S860 WeakPolarHBondContact CG2-O 3.37Å
861	L	76.6	Confident	64.6	Low	134 Å²	134	106.1 Å²	106.1	70%	0.702	58%	0.581	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.1	131.3	169.6	-60	177.4	0	0	0	108.9	V831 I858	V831-L861 HydrophobicContact CG1-CD2 3.71Å; I858-L861 HydrophobicContact CG2-CD2 4.22Å
862	G	71	Confident	62.4	Low	23 Å²	23	106.7 Å²	106.7	24%	0.237	60%	0.599	C	S	.	*	S	Bend	trans	104.1	175.2	-164.2	0	0	0	0	0	112.5	K830 V831 C832	K830-G862 CarbonylContact O-C 3.58Å; K830-G862 VanDerWaalsContact O-CA 3.29Å; K830-G862 WeakPolarHBondContact O-CA 3.42Å; K830-G862 PolarHBondContact O-N 3.38Å; V831-G862 CarbonylContact C-O 3.57Å; V831-G862 VanDerWaalsContact C-O 3.26Å; V831-G862 WeakPolarHBondContact CA-O 3.37Å; C832-G862 PolarHBondContact N-O 2.9Å
863	P	72.1	Confident	60.3	Low	82 Å²	82	106.4 Å²	106.4	53%	0.532	61%	0.61	S	S	.	*	S	Bend	trans	-68.7	151.2	173.1	31.1	-35.6	0	0	0	111.6	T838 R865	T838-P863 HydrophobicContact CG2-CB 3.86Å; P863-R865 PolarHBondContact O-N 3.07Å
864	C	77.8	Confident	58.7	Low	31 Å²	31	102.7 Å²	102.7	21%	0.209	61%	0.61	C	S	.	*	P	Polyproline II helix	trans	-58.9	131.3	170.8	-60.2	0	0	0	0	110.3	C832 G836 V837 T838	C832-C864 WeakPolarHBondContact CA-SG 3.39Å; C832-C864 HydrophobicContact CB-CB 3.98Å; C832-C864 WeakPolarHBondContact CB-SG 3.34Å; C832-C864 WeakPolarHBondContact SG-CA 3.27Å; C832-C864 WeakPolarHBondContact SG-CB 3.49Å; C832-C864 CovalentContact SG-SG 2.03Å; C832-C864 PolarHBondContact SG-SG 2.85Å; G836-C864 PolarHBondContact O-SG 2.86Å; V837-C864 PolarHBondContact O-SG 3.47Å; V837-C864 VanDerWaalsContact O-SG 3.32Å; T838-C864 PolarHBondContact OG1-N 2.03Å
865	R	74.7	Confident	56.5	Low	232 Å²	232	104.8 Å²	104.8	88%	0.875	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-82.5	129.6	172.9	-91.2	-177.7	163	179.9	-5.3	110.3	P863 S867	P863-R865 PolarHBondContact O-N 3.07Å; R865-S867 PolarHBondContact O-N 2.98Å; R865-S867 PolarHBondContact O-OG 2.91Å
866	E	45.7	Very low	54.3	Low	197 Å²	197	103.9 Å²	103.9	92%	0.921	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-55.2	121.2	167.3	-64.6	-174.6	149.7	0	0	109.9
867	S	38.1	Very low	51.9	Low	112 Å²	112	108 Å²	108	78%	0.783	67%	0.667	S	S	*	*			trans	-100.2	111.6	-179.9	-66.3	0	0	0	0	109	R865 A869	R865-S867 PolarHBondContact O-N 2.98Å; R865-S867 PolarHBondContact O-OG 2.91Å; S867-A869 PolarHBondContact O-N 2.82Å
868	V	35.2	Very low	49.3	Very low	143 Å²	143	110.3 Å²	110.3	87%	0.867	68%	0.684	S	S	*	*			trans	-56.3	124.4	173.5	177.6	0	0	0	0	109.1	P870	V868-P870 WeakPolarHBondContact O-CD 3.33Å
869	A	31.6	Very low	46.8	Very low	92 Å²	92	115.7 Å²	115.7	76%	0.76	71%	0.71	S	S	*	*			trans	-74.1	138.3	-176.6	0	0	0	0	0	112.8	S867	S867-A869 PolarHBondContact O-N 2.82Å
870	P	35.9	Very low	44.1	Very low	125 Å²	125	116.2 Å²	116.2	81%	0.812	72%	0.722	S	S	*	*			trans	-121.1	128.4	141.8	35	-26.6	0	0	0	110.3	V868	V868-P870 WeakPolarHBondContact O-CD 3.33Å
871	G	33.7	Very low	41.6	Very low	73 Å²	73	119.8 Å²	119.8	75%	0.753	74%	0.742	S	S	*	*			trans	-90.7	153.2	176	0	0	0	0	0	113.1
872	V	29.7	Very low	39.5	Very low	146 Å²	146	119.3 Å²	119.3	89%	0.885	75%	0.747	S	S	*	*			trans	173.3	129.5	145.7	147	0	0	0	0	108.3
873	S	31.7	Very low	37.2	Very low	107 Å²	107	127.9 Å²	127.9	75%	0.748	77%	0.772	S	S	*	*			trans	-76.4	159.2	177	-42	0	0	0	0	111.9
874	P	34.3	Very low	35	Very low	114 Å²	114	131.1 Å²	131.1	74%	0.74	78%	0.78	S	S	*	*				-150.9	141.4	92.3	37.5	-19.5	0	0	0	117.9
875	T	25.5	Very low	32.5	Very low	130 Å²	130	135.5 Å²	135.5	80%	0.798	80%	0.8	S	S	*	*			trans	36.1	116.4	147	55.1	0	0	0	0	123.3
876	S	29	Very low	30.1	Very low	121 Å²	121	132.1 Å²	132.1	85%	0.846	80%	0.798	S	S	*	*				61.9	120.9	119.8	-165.9	0	0	0	0	122.1
877	A	26.3	Very low	29.2	Very low	101 Å²	101	127.3 Å²	127.3	84%	0.835	79%	0.786	S	S	*	*			trans	-160.7	162.3	130.3	0	0	0	0	0	112.7
878	S	25.6	Very low	28.5	Very low	114 Å²	114	132.1 Å²	132.1	80%	0.797	79%	0.787	S	S	*	*			trans	-86.9	171.4	-169.1	-166.8	0	0	0	0	115.7
879	M	29.5	Very low	28	Very low	173 Å²	173	131.7 Å²	131.7	85%	0.852	79%	0.785	S	S	*	*			trans	-32.7	145.2	169.9	-63.7	176	152.3	0	0	116.9
880	T	23.8	Very low	27.8	Very low	140 Å²	140	135.2 Å²	135.2	86%	0.859	79%	0.791	S	S	*	*				-157.3	146.5	128.2	-10.9	0	0	0	0	111.9
881	T	25.3	Very low	27.2	Very low	125 Å²	125	134.4 Å²	134.4	77%	0.767	79%	0.794	S	S	*	*			trans	-88.5	159.2	161.5	55.7	0	0	0	0	109.3
882	P	32.3	Very low	26.7	Very low	124 Å²	124	136.2 Å²	136.2	81%	0.805	80%	0.795	S	S	*	*				-145.3	147.3	93.6	37	-20.9	0	0	0	116.8
883	R	23.8	Very low	27.7	Very low	203 Å²	203	133.5 Å²	133.5	77%	0.766	78%	0.781	S	S	*	*			trans	-21.3	147.5	154	-109.4	170.8	162.7	-158.8	-4.1	118.8
884	H	25.8	Very low	27.3	Very low	150 Å²	150	136.3 Å²	136.3	69%	0.694	78%	0.782	S	S	*	*				115.8	126	121.2	-88.2	-34.1	0	0	0	121.8
885	I	24.9	Very low	26.8	Very low	124 Å²	124	135.3 Å²	135.3	64%	0.636	78%	0.778	S	S	*	*			trans	91.7	111	130.2	-73.7	167.8	0	0	0	120
886	L	24.3	Very low	26.7	Very low	160 Å²	160	134.1 Å²	134.1	84%	0.838	77%	0.774	S	S	*	*			trans	59.1	145.9	146.9	-63.5	175.1	0	0	0	119
887	S	26.1	Very low	26.5	Very low	96 Å²	96	136.1 Å²	136.1	67%	0.671	78%	0.775	S	S	*	*			cis	-151.1	142.3	12.3	-119.6	0	0	0	0	114.3
888	R	23.9	Very low	27.3	Very low	214 Å²	214	136.1 Å²	136.1	81%	0.808	77%	0.766	S	S	*	*			trans	-25.4	131.1	147.3	175.4	-172.2	79.3	176.3	7.3	116.2
889	T	25.5	Very low	27.2	Very low	134 Å²	134	139 Å²	139	82%	0.822	77%	0.772	S	S	*	*				-167.4	151.8	123.9	12.3	0	0	0	0	113.5
890	L	26.2	Very low	27	Very low	166 Å²	166	135.7 Å²	135.7	87%	0.869	77%	0.766	S	S	*	*			trans	-78.9	150.6	174.5	-74.9	61	0	0	0	111.3
891	A	23.9	Very low	27.7	Very low	108 Å²	108	134.3 Å²	134.3	89%	0.893	76%	0.759	S	S	*	*			trans	-160	155	137.4	0	0	0	0	0	111.3
892	S	23.9	Very low	27.7	Very low	111 Å²	111	133.2 Å²	133.2	78%	0.776	76%	0.757	S	S	*	*			trans	-150.9	178.7	177.6	-161.4	0	0	0	0	106.6
893	P	49.6	Very low	27.3	Very low	88 Å²	88	133 Å²	133	57%	0.571	75%	0.753	S	S	*	*			cis	-122.3	-157.9	-29.3	12.8	13.3	0	0	0	111.4
894	H	24.5	Very low	27.3	Very low	166 Å²	166	129.4 Å²	129.4	77%	0.769	75%	0.754	S	S	*	*			trans	78.7	145.3	160.2	-55.2	-56.6	0	0	0	118.1
895	S	23.8	Very low	27.2	Very low	94 Å²	94	125.8 Å²	125.8	66%	0.657	75%	0.75	S	S	*	*			cis	-164.4	164.3	-11.6	-100.7	0	0	0	0	112
896	S	22.6	Very low	27.2	Very low	104 Å²	104	128.1 Å²	128.1	73%	0.727	76%	0.758	S	S	*	*			trans	57	114.5	153.9	56.9	0	0	0	0	122.6
897	L	24	Very low	27.1	Very low	163 Å²	163	127.5 Å²	127.5	85%	0.853	76%	0.755	S	S	*	*				24.2	160.7	114.6	-62.2	170.7	0	0	0	121
898	P	45	Very low	26.9	Very low	102 Å²	102	132.8 Å²	132.8	66%	0.662	76%	0.761	S	S	*	*			cis	-138.7	-175.7	-38.9	40.6	-24.5	0	0	0	112.5
899	L	22.6	Very low	27.5	Very low	173 Å²	173	128 Å²	128	91%	0.906	76%	0.758	S	S	*	*			trans	175.4	158.2	138.5	-97.7	158.2	0	0	0	114.3
900	S	24.9	Very low	27.4	Very low	105 Å²	105	126 Å²	126	73%	0.734	75%	0.745	S	S	*	*			trans	-104.8	-164.4	177.8	-43.2	0	0	0	0	110.4
901	P	39.8	Very low	27.9	Very low	111 Å²	111	124 Å²	124	72%	0.721	74%	0.742	S	S	*	*			cis	-144	-173.3	-2.1	44.7	-25.7	0	0	0	117.3
902	S	24.6	Very low	28.1	Very low	102 Å²	102	126.2 Å²	126.2	71%	0.713	74%	0.738	S	S	*	*			trans	71.4	162.5	150.1	-56.9	0	0	0	0	118.9
903	T	24.5	Very low	28.8	Very low	118 Å²	118	126.1 Å²	126.1	72%	0.724	74%	0.735	S	S	*	*			cis	-160	152.5	10.3	-13.4	0	0	0	0	112.2
904	T	23.4	Very low	27.6	Very low	128 Å²	128	128.1 Å²	128.1	79%	0.785	75%	0.746	S	S	*	*			trans	25.6	155.2	145.9	53.2	0	0	0	0	124.1
905	A	24	Very low	27.7	Very low	75 Å²	75	125.4 Å²	125.4	62%	0.62	75%	0.746	S	S	*	*			cis	177.6	-179.4	-15.5	0	0	0	0	0	111.5
906	H	24.9	Very low	28.6	Very low	172 Å²	172	125.3 Å²	125.3	80%	0.796	74%	0.743	S	S	*	*			trans	79.7	110.7	153.4	-72.1	-72	0	0	0	124.1
907	D	22.3	Very low	28.8	Very low	147 Å²	147	128.5 Å²	128.5	79%	0.786	75%	0.746	S	S	*	*				99	151.6	119.5	-83.6	-50.8	0	0	0	127.6
908	W	22	Very low	28.8	Very low	207 Å²	207	126.6 Å²	126.6	78%	0.784	74%	0.741	S	S	*	*			trans	-72.8	167.9	-178.6	-155.8	-116	0	0	0	111.9	T910	W908-T910 PolarHBondContact NE1-OG1 2.85Å
909	P	35.4	Very low	27.9	Very low	114 Å²	114	127.7 Å²	127.7	74%	0.74	75%	0.746	S	S	*	*			cis	-153.9	-179.3	42.6	45.2	-22.3	0	0	0	121.5
910	T	24.7	Very low	28	Very low	91 Å²	91	125 Å²	125	56%	0.558	74%	0.737	S	S	*	*			trans	-74.9	179	167.6	-1.4	0	0	0	0	112.7	W908	W908-T910 PolarHBondContact NE1-OG1 2.85Å
911	P	35.3	Very low	28	Very low	125 Å²	125	123 Å²	123	81%	0.812	73%	0.732	S	S	*	*				-154.5	-172.4	50.2	43.5	-19.5	0	0	0	119.8
912	L	29	Very low	27.3	Very low	155 Å²	155	124 Å²	124	81%	0.812	74%	0.736	S	S	*	*			trans	-66.2	177.4	164.9	-92.7	93.6	0	0	0	113.3
913	P	38.7	Very low	27.7	Very low	108 Å²	108	124.3 Å²	124.3	70%	0.701	74%	0.736	S	S	*	*			cis	-137.5	-157.3	35.4	32.9	-5.2	0	0	0	114.5
914	T	23.1	Very low	27.6	Very low	131 Å²	131	129.6 Å²	129.6	80%	0.804	74%	0.742	S	S	*	*			cis	-161.8	179.2	24.3	-24.7	0	0	0	0	113.1
915	S	27.5	Very low	27.6	Very low	109 Å²	109	128 Å²	128	76%	0.762	74%	0.737	S	S	*	*			trans	-139.5	-153.3	168.3	-143.8	0	0	0	0	107.9
916	P	42.1	Very low	27.7	Very low	91 Å²	91	131 Å²	131	59%	0.591	75%	0.747	S	S	*	*			cis	-141	-162.1	1.8	45.3	-25.2	0	0	0	115.7
917	Q	26.6	Very low	27.6	Very low	172 Å²	172	127.4 Å²	127.4	80%	0.804	75%	0.747	S	S	*	*			trans	73.6	151.5	154.3	-72.1	166.6	21.4	0	0	118.1
918	T	25.3	Very low	27.8	Very low	123 Å²	123	125.2 Å²	125.2	76%	0.755	75%	0.75	S	S	*	*			cis	-159.9	173.4	10.2	-4.6	0	0	0	0	109.1
919	V	25.7	Very low	27.8	Very low	124 Å²	124	121.7 Å²	121.7	75%	0.752	75%	0.752	S	S	*	*			cis	-159.6	-179.3	-1	76.2	0	0	0	0	111.9
920	V	23.8	Very low	27.8	Very low	118 Å²	118	121.6 Å²	121.6	72%	0.715	75%	0.751	S	S	*	*			trans	-24.3	151.7	165.1	173.1	0	0	0	0	119.5
921	G	24.9	Very low	27.7	Very low	61 Å²	61	122.2 Å²	122.2	63%	0.629	76%	0.759	S	S	*	*			cis	128.1	160.4	-7.1	0	0	0	0	0	117.4
922	T	25.1	Very low	27.3	Very low	132 Å²	132	123.6 Å²	123.6	81%	0.81	76%	0.759	S	S	*	*			trans	67.2	170.2	159.4	21.6	0	0	0	0	119.5
923	P	32.8	Very low	27.2	Very low	110 Å²	110	121.9 Å²	121.9	71%	0.714	76%	0.755	S	S	*	*			cis	-139.6	169.3	-7.8	39.5	-20.6	0	0	0	119.3
924	R	23.6	Very low	26.4	Very low	228 Å²	228	120.8 Å²	120.8	86%	0.86	76%	0.755	S	S	*	*			trans	62.7	127.2	137.6	-87.9	-169.1	136.7	123.2	-3.2	126.6
925	S	22.9	Very low	26.4	Very low	95 Å²	95	119.6 Å²	119.6	66%	0.664	75%	0.752	S	S	*	*				64.2	111	120.8	-61.5	0	0	0	0	124.1
926	T	26.4	Very low	26.3	Very low	137 Å²	137	122.4 Å²	122.4	84%	0.84	76%	0.758	S	S	*	*				-160.5	148	120.2	28.5	0	0	0	0	106.7
927	A	23.3	Very low	25.4	Very low	97 Å²	97	121.8 Å²	121.8	80%	0.802	76%	0.761	S	S	*	*			cis	74.6	84.3	6.2	0	0	0	0	0	117.7
928	A	25	Very low	25.3	Very low	102 Å²	102	120 Å²	120	84%	0.843	76%	0.761	S	S	*	*			trans	-167.5	139.8	144.5	0	0	0	0	0	112.4
929	T	22.6	Very low	25.3	Very low	133 Å²	133	118.4 Å²	118.4	82%	0.816	76%	0.761	S	S	*	*			trans	-92.6	-162.5	155.5	54.1	0	0	0	0	107.4
930	P	34.5	Very low	25.3	Very low	112 Å²	112	118.6 Å²	118.6	73%	0.727	76%	0.756	S	S	*	*			cis	-138.3	-160.3	-2.9	43.7	-23	0	0	0	114.8
931	S	24.3	Very low	25.5	Very low	104 Å²	104	120.6 Å²	120.6	73%	0.727	76%	0.756	S	S	*	*			trans	-36.6	166.2	164.6	-35.7	0	0	0	0	118.6
932	D	26.5	Very low	25.6	Very low	153 Å²	153	126.5 Å²	126.5	82%	0.818	76%	0.759	S	S	*	*			trans	-150	132.3	133.3	-111	-19.8	0	0	0	113
933	V	25.9	Very low	25.7	Very low	119 Å²	119	126.9 Å²	126.9	72%	0.721	75%	0.751	S	S	*	*			trans	55	116.4	130.9	172.8	0	0	0	0	118.9
934	A	23.2	Very low	25.5	Very low	85 Å²	85	126.7 Å²	126.7	70%	0.702	75%	0.753	S	S	*	*				68.5	148.3	53.8	0	0	0	0	0	113.3
935	S	23.3	Very low	25.6	Very low	106 Å²	106	119.7 Å²	119.7	74%	0.741	75%	0.751	S	S	*	*			cis	-155.7	148.4	5.4	-66.6	0	0	0	0	110.4
936	L	24.5	Very low	25.8	Very low	169 Å²	169	120.3 Å²	120.3	89%	0.885	76%	0.756	S	S	*	*			trans	176.1	119.8	137	-119.7	63.2	0	0	0	107.8
937	A	22.9	Very low	25.9	Very low	78 Å²	78	119.2 Å²	119.2	65%	0.645	75%	0.749	S	S	*	*			cis	92.1	131.7	29.4	0	0	0	0	0	115.1
938	T	25.2	Very low	26.3	Very low	133 Å²	133	122.5 Å²	122.5	82%	0.816	75%	0.753	S	S	*	*			trans	61.1	125	179.3	43.1	0	0	0	0	116.3
939	A	24.8	Very low	26.5	Very low	91 Å²	91	121.5 Å²	121.5	75%	0.752	75%	0.753	S	S	*	*			cis	73.4	152.3	45.7	0	0	0	0	0	112.8
940	I	26.7	Very low	26.8	Very low	127 Å²	127	121 Å²	121	65%	0.651	76%	0.755	S	S	*	*			cis	-154.7	173.2	30.5	-26.7	172.8	0	0	0	111.4
941	F	26.2	Very low	26.4	Very low	160 Å²	160	118.5 Å²	118.5	70%	0.702	75%	0.75	S	S	*	*			trans	91.6	141.7	151.9	-71.5	-52.7	0	0	0	119.3
942	R	27.7	Very low	26.6	Very low	186 Å²	186	120.4 Å²	120.4	70%	0.702	75%	0.752	S	S	*	*			cis	-158.1	153.6	4.8	-152.8	153.4	170.3	144.4	8.8	114.2
943	E	27.3	Very low	26.7	Very low	139 Å²	139	121 Å²	121	65%	0.65	75%	0.75	S	S	*	*			trans	14.9	163.4	150.5	-62.8	-177.3	74.5	0	0	123.4
944	S	29.2	Very low	26.6	Very low	106 Å²	106	121.9 Å²	121.9	74%	0.741	75%	0.746	S	S	*	*			cis	177.3	148.4	-20.5	-82.1	0	0	0	0	110.4
945	G	25.5	Very low	26.8	Very low	81 Å²	81	124.5 Å²	124.5	84%	0.835	75%	0.747	S	S	*	*			trans	84.3	165.9	159.8	0	0	0	0	0	118.7
946	S	27.8	Very low	26.8	Very low	108 Å²	108	124.3 Å²	124.3	76%	0.755	75%	0.746	S	S	*	*			cis	-167.4	161.6	-14.1	-150.9	0	0	0	0	113.7
947	T	27.9	Very low	26.9	Very low	115 Å²	115	119.3 Å²	119.3	71%	0.706	74%	0.736	S	S	*	*			trans	60.7	117.5	157.2	49.7	0	0	0	0	124.7
948	N	32.2	Very low	27.1	Very low	166 Å²	166	123.1 Å²	123.1	89%	0.888	75%	0.745	S	S	*	*				49.1	141.1	128.5	-58.2	11.9	0	0	0	124.8
949	G	27.7	Very low	27.2	Very low	81 Å²	81	125.1 Å²	125.1	84%	0.835	75%	0.745	S	S	*	*			trans	169.2	91.3	155.2	0	0	0	0	0	119
950	S	28.8	Very low	27.2	Very low	121 Å²	121	128.8 Å²	128.8	85%	0.846	75%	0.747	S	S	*	*			trans	-41	150.2	178.4	-154.9	0	0	0	0	122.3
951	G	26.3	Very low	27.2	Very low	61 Å²	61	126.3 Å²	126.3	63%	0.629	75%	0.745	S	S	*	*			trans	85.8	163.4	139.4	0	0	0	0	0	120.7
952	D	28.4	Very low	27.1	Very low	144 Å²	144	124.5 Å²	124.5	77%	0.77	75%	0.752	S	S	*	*			cis	-172.2	147.2	-15.1	-86.4	-39	0	0	0	109.4
953	E	28.6	Very low	27	Very low	165 Å²	165	119.7 Å²	119.7	77%	0.771	76%	0.761	S	S	*	*			trans	52.8	166.4	152.4	-53.8	-70.7	61	0	0	120.1
954	E	25.5	Very low	27	Very low	137 Å²	137	117.3 Å²	117.3	64%	0.64	77%	0.773	S	S	*	*			cis	-163	163.2	-17.6	-123	-161.7	133.1	0	0	109.9
955	L	26.1	Very low	26.9	Very low	140 Å²	140	115.8 Å²	115.8	73%	0.733	78%	0.775	S	S	*	*			trans	58	166.3	147.7	-65.5	171.3	0	0	0	120.5
956	S	24.5	Very low	27	Very low	102 Å²	102	118.3 Å²	118.3	71%	0.713	78%	0.78	S	S	*	*			cis	-170.1	149.6	-22.7	51.9	0	0	0	0	111.4
957	G	26.1	Very low	26.9	Very low	65 Å²	65	116.8 Å²	116.8	67%	0.67	78%	0.781	S	S	*	*			trans	73.1	170.9	160.5	0	0	0	0	0	117.9
958	D	26.9	Very low	26.6	Very low	157 Å²	157	114.8 Å²	114.8	84%	0.84	78%	0.783	S	S	*	*			cis	-163.2	161	-15.9	-96.3	-38.6	0	0	0	111.7
959	E	26.8	Very low	26.3	Very low	175 Å²	175	115.6 Å²	115.6	82%	0.818	79%	0.786	S	S	*	*			trans	50.5	128.6	153.2	-68.7	-163.8	131.4	0	0	125.6
960	E	25.1	Very low	26	Very low	168 Å²	168	120.1 Å²	120.1	79%	0.785	79%	0.786	S	S	*	*				75.4	139.8	126.2	-72.5	-76.9	86	0	0	126.1
961	A	25.9	Very low	26.4	Very low	75 Å²	75	119.3 Å²	119.3	62%	0.62	78%	0.778	S	S	*	*			trans	76.1	109.4	139.7	0	0	0	0	0	124.2
962	S	25.8	Very low	26.9	Very low	122 Å²	122	121.2 Å²	121.2	85%	0.853	78%	0.779	S	S	*	*				63.1	98.1	121.4	-59.2	0	0	0	0	122.7
963	G	25.9	Very low	26.7	Very low	85 Å²	85	121.5 Å²	121.5	88%	0.876	79%	0.785	S	S	*	*				84.5	149.8	98.7	0	0	0	0	0	121.6
964	G	25.8	Very low	26.5	Very low	89 Å²	89	117.1 Å²	117.1	92%	0.918	78%	0.784	S	S	*	*			trans	95.8	125.7	164.1	0	0	0	0	0	115.6
965	G	27.3	Very low	26.4	Very low	75 Å²	75	115.5 Å²	115.5	77%	0.773	79%	0.788	S	S	*	*			trans	-136.7	157.6	-179	0	0	0	0	0	114.6
966	S	27.3	Very low	26.3	Very low	134 Å²	134	115.5 Å²	115.5	94%	0.937	79%	0.794	S	S	*	*			trans	-175.9	148.9	166.5	-78	0	0	0	0	108.4
967	G	25.3	Very low	26.3	Very low	75 Å²	75	116.2 Å²	116.2	77%	0.773	79%	0.794	S	S	*	*			cis	166.3	132.5	-9.6	0	0	0	0	0	112.4
968	G	23.6	Very low	26.2	Very low	73 Å²	73	119.3 Å²	119.3	75%	0.753	80%	0.799	S	S	*	*			trans	79.1	124.7	161.6	0	0	0	0	0	119.2
969	L	25.9	Very low	25.9	Very low	184 Å²	184	118 Å²	118	96%	0.963	80%	0.797	S	S	*	*				-177.7	155.6	104.9	-92.2	165.9	0	0	0	112.3
970	E	20.5	Very low	25.9	Very low	176 Å²	176	118.4 Å²	118.4	82%	0.822	80%	0.799	S	S	*	*			trans	-98.1	-178.1	-175.7	-92.1	-171.8	86.5	0	0	112.8
971	P	36.9	Very low	26	Very low	104 Å²	104	113.5 Å²	113.5	68%	0.675	79%	0.793	S	S	*	*			cis	-129.8	-119.5	-38	35.9	-16	0	0	0	109.3
972	P	36.1	Very low	26.1	Very low	101 Å²	101	115.4 Å²	115.4	66%	0.656	80%	0.799	S	S	*	*				-127	177	-52.3	39.6	-24.3	0	0	0	115.3
973	V	25.4	Very low	26.4	Very low	149 Å²	149	115.8 Å²	115.8	90%	0.903	80%	0.799	S	S	*	*			trans	70.3	137.1	161.9	-170.5	0	0	0	0	117
974	G	24.7	Very low	26.6	Very low	73 Å²	73	119.5 Å²	119.5	75%	0.753	80%	0.797	S	S	*	*			cis	-170.2	-174.4	3.4	0	0	0	0	0	114.7
975	S	22.8	Very low	27	Very low	103 Å²	103	124.2 Å²	124.2	72%	0.72	80%	0.795	S	S	*	*			trans	-105.1	149.5	-166.6	-177.9	0	0	0	0	113.9
976	V	22.9	Very low	27.6	Very low	140 Å²	140	132.2 Å²	132.2	85%	0.848	80%	0.802	S	S	*	*			trans	-125.4	131.6	155.5	178.1	0	0	0	0	107.7
977	V	24.7	Very low	28.4	Very low	118 Å²	118	127.9 Å²	127.9	72%	0.715	77%	0.774	S	S	*	*			trans	-105.7	138.3	179.1	174.7	0	0	0	0	109.6
978	V	24	Very low	29.7	Very low	129 Å²	129	130.2 Å²	130.2	78%	0.782	78%	0.779	S	S	*	*			trans	-127.3	141.1	164.2	-179	0	0	0	0	108.4
979	T	21.9	Very low	31	Very low	130 Å²	130	127 Å²	127	80%	0.798	75%	0.745	S	S	*	*			trans	-84.6	138.1	-163.5	-37.1	0	0	0	0	113.1
980	H	27.3	Very low	32	Very low	183 Å²	183	126.9 Å²	126.9	85%	0.847	73%	0.733	S	S	*	*			trans	-74.4	144.8	167.6	-78	-93.3	0	0	0	112.1
981	G	26.1	Very low	33.3	Very low	65 Å²	65	126.5 Å²	126.5	67%	0.67	74%	0.736	S	S	*	*			trans	-79.4	174.2	167.1	0	0	0	0	0	113.1
982	P	28	Very low	33.8	Very low	116 Å²	116	123 Å²	123	75%	0.753	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-72.1	153.9	179.7	31.3	-35.7	0	0	0	112.4
983	P	32.5	Very low	34.2	Very low	130 Å²	130	124.8 Å²	124.8	84%	0.844	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-68.6	142.7	174.3	30.1	-34.9	0	0	0	111.4
984	I	30.2	Very low	35.4	Very low	163 Å²	163	122 Å²	122	84%	0.836	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-97.1	148.8	175.2	-65.3	175.9	0	0	0	109.3
985	E	33.4	Very low	36.9	Very low	187 Å²	187	119.7 Å²	119.7	87%	0.874	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-63.9	138.9	-173.4	-62.2	176.4	120.7	0	0	112.8
986	R	39.3	Very low	38.6	Very low	244 Å²	244	115.7 Å²	115.7	92%	0.921	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-68.1	136.5	169.4	-84.3	-177.4	159.6	87.8	-0.7	109.9
987	A	45.7	Very low	40.4	Very low	43 Å²	43	109.4 Å²	109.4	36%	0.355	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-82.2	155.5	-175.9	0	0	0	0	0	113.8	C989 G1000	A987-C989 PolarHBondContact O-N 3.5Å; A987-G1000 WeakPolarHBondContact CB-O 3.27Å
988	S	51.8	Low	41.9	Very low	123 Å²	123	105 Å²	105	86%	0.86	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-11.6	-155.9	-165.2	0	0	0	0	117
989	C	49.9	Very low	43.2	Very low	7 Å²	7	101.7 Å²	101.7	5%	0.047	57%	0.568	C	S	.	*	T	Hydrogen-bonded Turn	trans	-97.1	-3.6	-170.9	52.2	0	0	0	0	115	A987 N991 S992 C996 G1000 P1003	A987-C989 PolarHBondContact O-N 3.5Å; C989-N991 PolarHBondContact O-N 3.43Å; C989-S992 WeakPolarHBondContact O-CB 3.23Å; C989-S992 PolarHBondContact O-N 3.15Å; C989-S992 PolarHBondContact O-OG 3.29Å; C989-C996 HydrophobicContact CB-CB 4.19Å; C989-C996 WeakPolarHBondContact CB-SG 3.23Å; C989-C996 WeakPolarHBondContact SG-CB 3.47Å; C989-C996 CovalentContact SG-SG 2.04Å; C989-C996 PolarHBondContact SG-SG 3.49Å; C989-G1000 VanDerWaalsContact SG-C 3.5Å; C989-G1000 PolarHBondContact SG-O 2.9Å; C989-P1003 HydrophobicContact CB-CB 4.11Å
990	Y	47	Very low	44.6	Very low	181 Å²	181	96.8 Å²	96.8	71%	0.71	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-12	-169.5	-107.9	-85.8	0	0	0	116.4
991	N	47.9	Very low	46	Very low	167 Å²	167	95.6 Å²	95.6	89%	0.893	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	17.6	177.3	-60.2	-44.6	0	0	0	113	C989	C989-N991 PolarHBondContact O-N 3.43Å
992	S	48.3	Very low	47.7	Very low	32 Å²	32	94.8 Å²	94.8	22%	0.224	52%	0.518	C	S	.	.	S	Bend	trans	-82.6	143.6	177.8	54.4	0	0	0	0	111.6	C989 L994 G995	C989-S992 WeakPolarHBondContact O-CB 3.23Å; C989-S992 PolarHBondContact O-N 3.15Å; C989-S992 PolarHBondContact O-OG 3.29Å; S992-L994 PolarHBondContact O-N 3.33Å; S992-G995 PolarHBondContact O-N 3.27Å; S992-G995 VanDerWaalsContact O-N 3.09Å; S992-G995 PolarHBondContact OG-O 2.99Å
993	P	43.9	Very low	49.1	Very low	137 Å²	137	92.3 Å²	92.3	89%	0.89	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-17.3	-172.2	-25.6	35.4	0	0	0	116.2
994	L	50.6	Low	50.2	Low	91 Å²	91	86.9 Å²	86.9	48%	0.476	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-2.7	-178.9	-58.5	173.6	0	0	0	112.3	S992 S1004	S992-L994 PolarHBondContact O-N 3.33Å; L994-S1004 VanDerWaalsContact C-OG 3.22Å; L994-S1004 WeakPolarHBondContact CB-OG 3.43Å; L994-S1004 PolarHBondContact O-OG 2.96Å
995	G	55.6	Low	51.4	Low	24 Å²	24	85.6 Å²	85.6	25%	0.247	46%	0.461	C	S	.	.			trans	81.7	176.3	-178.3	0	0	0	0	0	114.9	S992 S1004	S992-G995 PolarHBondContact O-N 3.27Å; S992-G995 VanDerWaalsContact O-N 3.09Å; S992-G995 PolarHBondContact OG-O 2.99Å; G995-S1004 PolarHBondContact O-N 3.1Å; G995-S1004 PolarHBondContact O-OG 2.79Å
996	C	59.6	Low	52.5	Low	20 Å²	20	79.2 Å²	79.2	14%	0.135	43%	0.433	C	S	.	.	B	Isolated β-bridge	trans	-78.1	151.1	174.8	-60.8	0	0	0	0	112.1	C989 T1002	C989-C996 HydrophobicContact CB-CB 4.19Å; C989-C996 WeakPolarHBondContact CB-SG 3.23Å; C989-C996 WeakPolarHBondContact SG-CB 3.47Å; C989-C996 CovalentContact SG-SG 2.04Å; C989-C996 PolarHBondContact SG-SG 3.49Å; C996-T1002 WeakPolarHBondContact CA-O 3Å
997	C	59.6	Low	53.1	Low	7 Å²	7	73 Å²	73	5%	0.047	43%	0.427	C	S	.	.			trans	-61.9	165.9	155.7	-69	0	0	0	0	111.6	D999 G1000 T1002 C1012	C997-D999 PolarHBondContact O-N 3.47Å; C997-G1000 PolarHBondContact O-N 2.8Å; C997-T1002 WeakPolarHBondContact CB-O 3.3Å; C997-T1002 PolarHBondContact N-O 3.3Å; C997-C1012 WeakPolarHBondContact CA-SG 3.08Å; C997-C1012 HydrophobicContact CB-CB 3.65Å; C997-C1012 WeakPolarHBondContact CB-SG 3.38Å; C997-C1012 WeakPolarHBondContact SG-CA 3.29Å; C997-C1012 WeakPolarHBondContact SG-CB 2.96Å; C997-C1012 CovalentContact SG-SG 2.04Å; C997-C1012 PolarHBondContact SG-SG 2.04Å
998	S	56.3	Low	53.4	Low	27 Å²	27	79.7 Å²	79.7	19%	0.189	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-9	177	46.1	0	0	0	0	115.3	G1000 T1015	S998-G1000 VanDerWaalsContact C-N 3.3Å; S998-T1015 VanDerWaalsContact OG-CG2 3.31Å; S998-T1015 WeakPolarHBondContact OG-CG2 3.34Å
999	D	52.4	Low	53.6	Low	59 Å²	59	74.7 Å²	74.7	32%	0.316	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-8.5	171.1	77.5	-16.9	0	0	0	113.6	C997 K1001 T1002 P1013	C997-D999 PolarHBondContact O-N 3.47Å; D999-K1001 PolarHBondContact O-N 3.17Å; D999-K1001 VanDerWaalsContact O-N 3.16Å; D999-K1001 PolarHBondContact OD1-N 2.95Å; D999-T1002 WeakPolarHBondContact OD1-CB 3.48Å; D999-T1002 PolarHBondContact OD1-N 2.87Å; D999-T1002 WeakPolarHBondContact OD2-CB 3.3Å; D999-T1002 PolarHBondContact OD2-N 3.37Å; D999-T1002 PolarHBondContact OD2-OG1 3.04Å; D999-P1013 HydrophobicContact CB-CG 4.32Å
1000	G	51.8	Low	54	Low	26 Å²	26	78.7 Å²	78.7	27%	0.268	45%	0.446	S	S	.	.	S	Bend	trans	65.4	7.8	-177.3	0	0	0	0	0	115.1	A987 C989 C997 S998	A987-G1000 WeakPolarHBondContact CB-O 3.27Å; C989-G1000 VanDerWaalsContact SG-C 3.5Å; C989-G1000 PolarHBondContact SG-O 2.9Å; C997-G1000 PolarHBondContact O-N 2.8Å; S998-G1000 VanDerWaalsContact C-N 3.3Å
1001	K	55	Low	54.6	Low	158 Å²	158	72.5 Å²	72.5	69%	0.687	43%	0.426	S	S	*	.	S	Bend	trans	-126.4	-34	-172.5	-69.5	172.5	-174.6	168.2	0	113	D999	D999-K1001 PolarHBondContact O-N 3.17Å; D999-K1001 VanDerWaalsContact O-N 3.16Å; D999-K1001 PolarHBondContact OD1-N 2.95Å
1002	T	62.3	Low	55.2	Low	49 Å²	49	66.3 Å²	66.3	30%	0.301	40%	0.395	S	S	.	.	S	Bend	trans	-91.7	123.6	-179.1	-58.3	0	0	0	0	109.1	C996 C997 D999 N1011	C996-T1002 WeakPolarHBondContact CA-O 3Å; C997-T1002 WeakPolarHBondContact CB-O 3.3Å; C997-T1002 PolarHBondContact N-O 3.3Å; D999-T1002 WeakPolarHBondContact OD1-CB 3.48Å; D999-T1002 PolarHBondContact OD1-N 2.87Å; D999-T1002 WeakPolarHBondContact OD2-CB 3.3Å; D999-T1002 PolarHBondContact OD2-N 3.37Å; D999-T1002 PolarHBondContact OD2-OG1 3.04Å; T1002-N1011 WeakPolarHBondContact CG2-ND2 3.39Å
1003	P	57.2	Low	55.7	Low	63 Å²	63	67.5 Å²	67.5	41%	0.409	40%	0.402	S	S	.	.	B	Isolated β-bridge	trans	-69.5	142.8	168.9	30.5	-33.4	0	0	0	109.8	C989 N1011	C989-P1003 HydrophobicContact CB-CB 4.11Å; P1003-N1011 PolarHBondContact O-ND2 2.92Å
1004	S	56.7	Low	56.5	Low	17 Å²	17	64.7 Å²	64.7	12%	0.119	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-71.4	145.1	173.3	54.9	0	0	0	0	111.2	L994 G995 N1011	L994-S1004 VanDerWaalsContact C-OG 3.22Å; L994-S1004 WeakPolarHBondContact CB-OG 3.43Å; L994-S1004 PolarHBondContact O-OG 2.96Å; G995-S1004 PolarHBondContact O-N 3.1Å; G995-S1004 PolarHBondContact O-OG 2.79Å; S1004-N1011 WeakPolarHBondContact CA-OD1 3.4Å
1005	L	55.9	Low	57.4	Low	135 Å²	135	62.3 Å²	62.3	71%	0.707	38%	0.38	S	S	*	.	S	Bend	trans	-95.2	-19.9	178.6	-77.2	169.4	0	0	0	113.4	N1011	L1005-N1011 HydrophobicContact CD1-CB 3.97Å; L1005-N1011 PolarHBondContact N-OD1 2.98Å
1006	D	55.6	Low	58.4	Low	53 Å²	53	63.8 Å²	63.8	28%	0.283	38%	0.379	S	S	.	.	S	Bend	trans	-147.4	174.3	177.7	52.6	36.7	0	0	0	110.7	E1008 G1009 S1010	D1006-E1008 PolarHBondContact O-N 3.42Å; D1006-E1008 PolarHBondContact OD1-N 2.75Å; D1006-G1009 WeakPolarHBondContact OD1-CA 3.06Å; D1006-G1009 PolarHBondContact OD1-N 2.03Å; D1006-S1010 PolarHBondContact OD1-N 2.74Å; D1006-S1010 WeakPolarHBondContact OD2-CB 3.3Å; D1006-S1010 PolarHBondContact OD2-OG 3.21Å
1007	S	52	Low	59.4	Low	114 Å²	114	63.3 Å²	63.3	80%	0.797	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-14	179.5	49.9	0	0	0	0	114.4
1008	E	51.1	Low	60.6	Low	183 Å²	183	63 Å²	63	86%	0.855	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-14.6	-179.6	-61	-169.4	150	0	0	112.5	D1006	D1006-E1008 PolarHBondContact O-N 3.42Å; D1006-E1008 PolarHBondContact OD1-N 2.75Å
1009	G	57.5	Low	62.1	Low	18 Å²	18	63.9 Å²	63.9	19%	0.186	38%	0.376	C	S	.	.			trans	78.2	37.1	177.9	0	0	0	0	0	113.3	D1006 N1011 C1012	D1006-G1009 WeakPolarHBondContact OD1-CA 3.06Å; D1006-G1009 PolarHBondContact OD1-N 2.03Å; G1009-N1011 PolarHBondContact O-N 3.26Å; G1009-C1012 VanDerWaalsContact O-CB 3.27Å; G1009-C1012 WeakPolarHBondContact O-CB 3.36Å; G1009-C1012 PolarHBondContact O-N 3.27Å
1010	S	57.2	Low	63.7	Low	91 Å²	91	61.1 Å²	61.1	64%	0.636	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-19.5	-174.1	67.8	0	0	0	0	114.9	D1006	D1006-S1010 PolarHBondContact OD1-N 2.74Å; D1006-S1010 WeakPolarHBondContact OD2-CB 3.3Å; D1006-S1010 PolarHBondContact OD2-OG 3.21Å
1011	N	60.3	Low	65.4	Low	51 Å²	51	61.4 Å²	61.4	27%	0.273	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	3.7	175.6	71.3	-58.6	0	0	0	114.6	T1002 P1003 S1004 L1005 G1009	T1002-N1011 WeakPolarHBondContact CG2-ND2 3.39Å; P1003-N1011 PolarHBondContact O-ND2 2.92Å; S1004-N1011 WeakPolarHBondContact CA-OD1 3.4Å; L1005-N1011 HydrophobicContact CD1-CB 3.97Å; L1005-N1011 PolarHBondContact N-OD1 2.98Å; G1009-N1011 PolarHBondContact O-N 3.26Å
1012	C	60.9	Low	67	Low	37 Å²	37	53.9 Å²	53.9	25%	0.25	33%	0.325	C	S	.	.	S	Bend	trans	-87.9	148.2	-179	-57.6	0	0	0	0	112	C997 G1009	C997-C1012 WeakPolarHBondContact CA-SG 3.08Å; C997-C1012 HydrophobicContact CB-CB 3.65Å; C997-C1012 WeakPolarHBondContact CB-SG 3.38Å; C997-C1012 WeakPolarHBondContact SG-CA 3.29Å; C997-C1012 WeakPolarHBondContact SG-CB 2.96Å; C997-C1012 CovalentContact SG-SG 2.04Å; C997-C1012 PolarHBondContact SG-SG 2.04Å; G1009-C1012 VanDerWaalsContact O-CB 3.27Å; G1009-C1012 WeakPolarHBondContact O-CB 3.36Å; G1009-C1012 PolarHBondContact O-N 3.27Å
1013	P	58.7	Low	68.1	Low	57 Å²	57	54.4 Å²	54.4	37%	0.37	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-67.1	145.6	175.5	28.8	-34.5	0	0	0	111.2	D999 T1015 W1071	D999-P1013 HydrophobicContact CB-CG 4.32Å; P1013-T1015 PolarHBondContact O-N 3.26Å; P1013-W1071 HydrophobicContact CG-CZ3 4.24Å
1014	A	59.5	Low	69.4	Low	79 Å²	79	51.4 Å²	51.4	65%	0.653	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-58.3	137	175.3	0	0	0	0	0	111.1	P1094	A1014-P1094 WeakPolarHBondContact O-CD 3.44Å; A1014-P1094 WeakPolarHBondContact O-CG 3.39Å
1015	T	70.4	Confident	70.6	Confident	40 Å²	40	54.3 Å²	54.3	25%	0.245	32%	0.316	C	S	.	.			trans	-128.7	153.6	176.9	59.5	0	0	0	0	109.4	S998 P1013 W1071 H1091 F1092	S998-T1015 VanDerWaalsContact OG-CG2 3.31Å; S998-T1015 WeakPolarHBondContact OG-CG2 3.34Å; P1013-T1015 PolarHBondContact O-N 3.26Å; T1015-W1071 HydrophobicContact CG2-CE3 3.57Å; T1015-W1071 HydrophobicContact CG2-CZ3 3.61Å; T1015-H1091 HydrophobicContact CG2-CB 4.41Å; T1015-H1091 PolarHBondContact OG1-ND1 3.15Å; T1015-F1092 WeakPolarHBondContact CB-O 3.34Å
1016	K	75.8	Confident	71.7	Confident	55 Å²	55	48.1 Å²	48.1	24%	0.239	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	127.2	163.8	-166.7	-177.8	-175.6	-173.8	0	107.9	F1018 F1092 T1096 F1098	K1016-F1018 HydrophobicContact CD-CE1 4.26Å; K1016-F1018 HydrophobicContact CD-CE2 4.31Å; K1016-F1018 HydrophobicContact CD-CZ 3.65Å; K1016-F1018 HydrophobicContact CG-CE2 4.37Å; K1016-F1018 HydrophobicContact CG-CZ 4.06Å; K1016-F1092 PolarHBondContact N-O 3.16Å; K1016-F1092 PolarHBondContact O-N 2.71Å; K1016-T1096 HydrophobicContact CB-CG2 4.2Å; K1016-T1096 HydrophobicContact CD-CG2 3.57Å; K1016-T1096 HydrophobicContact CG-CG2 4.47Å; K1016-F1098 PolarHBondContact NZ-O 2.91Å
1017	A	81.6	Confident	73	Confident	10 Å²	10	45.9 Å²	45.9	8%	0.083	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	143.5	-178.8	0	0	0	0	0	111	V1090 F1134	A1017-V1090 WeakPolarHBondContact CA-O 3.3Å; A1017-F1134 HydrophobicContact CB-CB 4.41Å; A1017-F1134 WeakPolarHBondContact O-CB 3.19Å; A1017-F1134 PolarHBondContact O-N 3.36Å
1018	F	84.4	Confident	74	Confident	1 Å²	1	46.9 Å²	46.9	0%	0.004	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	127.7	169.2	-50.4	-87.4	0	0	0	108.4	K1016 V1090 F1092 T1096 F1098 A1100 V1103 F1131 L1132 D1133	K1016-F1018 HydrophobicContact CD-CE1 4.26Å; K1016-F1018 HydrophobicContact CD-CE2 4.31Å; K1016-F1018 HydrophobicContact CD-CZ 3.65Å; K1016-F1018 HydrophobicContact CG-CE2 4.37Å; K1016-F1018 HydrophobicContact CG-CZ 4.06Å; F1018-V1090 PolarHBondContact N-O 2.86Å; F1018-V1090 PolarHBondContact O-N 3.29Å; F1018-F1092 AromaticContact CD2-CD2 3.4Å; F1018-F1092 HydrophobicContact CD2-CD2 3.4Å; F1018-F1092 VanDerWaalsContact CD2-CD2 3.4Å; F1018-F1092 AromaticContact CD2-CE2 3.6Å; F1018-F1092 HydrophobicContact CD2-CE2 3.6Å; F1018-F1092 HydrophobicContact CD2-CG 4.34Å; F1018-F1092 HydrophobicContact CE2-CB 4.22Å; F1018-F1092 AromaticContact CE2-CD2 3.4Å; F1018-F1092 HydrophobicContact CE2-CD2 3.4Å; F1018-F1092 VanDerWaalsContact CE2-CD2 3.4Å; F1018-F1092 AromaticContact CE2-CE2 3.88Å; F1018-F1092 HydrophobicContact CE2-CE2 3.88Å; F1018-F1092 AromaticContact CE2-CG 3.9Å; F1018-F1092 HydrophobicContact CE2-CG 3.9Å; F1018-T1096 HydrophobicContact CE2-CG2 4.44Å; F1018-T1096 HydrophobicContact CZ-CG2 4.34Å; F1018-F1098 WeakPolarHBondContact CZ-O 3.4Å; F1018-A1100 HydrophobicContact CD1-CB 4.18Å; F1018-V1103 HydrophobicContact CD2-CG2 3.79Å; F1018-V1103 HydrophobicContact CE2-CG2 3.9Å; F1018-V1103 HydrophobicContact CG-CG2 4.1Å; F1018-V1103 HydrophobicContact CZ-CG2 4.32Å; F1018-F1131 HydrophobicContact CB-CD1 4.16Å; F1018-L1132 CarbonylContact C-O 3.55Å; F1018-L1132 WeakPolarHBondContact CA-O 3.17Å; F1018-D1133 VanDerWaalsContact CD1-OD1 3.31Å; F1018-D1133 WeakPolarHBondContact CD1-OD1 3.45Å; F1018-D1133 WeakPolarHBondContact CE1-OD1 3.07Å
1019	Q	87.8	Confident	74.6	Confident	46 Å²	46	41.1 Å²	41.1	22%	0.215	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	120.6	180	-175.3	160.3	93.2	0	0	110.2	I1087 V1088 D1089 F1131 L1132	Q1019-I1087 HydrophobicContact CG-CG2 3.81Å; Q1019-V1088 CarbonylContact C-O 3.51Å; Q1019-V1088 WeakPolarHBondContact CA-O 3.38Å; Q1019-D1089 PolarHBondContact NE2-OD1 2.97Å; Q1019-F1131 CarbonylContact O-C 3.53Å; Q1019-F1131 VanDerWaalsContact O-CA 3.31Å; Q1019-F1131 WeakPolarHBondContact O-CA 3.48Å; Q1019-L1132 PolarHBondContact N-O 2.77Å; Q1019-L1132 PolarHBondContact O-N 3.12Å
1020	G	86	Confident	75.1	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	142.2	175.6	0	0	0	0	0	112.4	I1087 V1088 R1130 F1131	G1020-I1087 WeakPolarHBondContact O-CA 3.32Å; G1020-V1088 PolarHBondContact N-O 2.97Å; G1020-V1088 PolarHBondContact O-N 2.8Å; G1020-R1130 CarbonylContact C-O 3.53Å; G1020-R1130 VanDerWaalsContact CA-O 3.28Å; G1020-R1130 WeakPolarHBondContact CA-O 3.49Å; G1020-F1131 VanDerWaalsContact CA-CD1 3.48Å
1021	V	87.7	Confident	75.9	Confident	33 Å²	33	49.7 Å²	49.7	20%	0.2	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	126.1	166.3	-178.1	0	0	0	0	108	R1085 R1130	V1021-R1085 HydrophobicContact CG1-CG 4.08Å; V1021-R1130 PolarHBondContact N-O 2.88Å; V1021-R1130 PolarHBondContact O-N 3.4Å
1022	L	87.6	Confident	76.7	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	130.5	-174	-60.7	168.1	0	0	0	109.7	L1024 L1057 R1085 A1086 V1088 L1107 H1128 V1129	L1022-L1024 HydrophobicContact CB-CD2 3.87Å; L1022-L1024 HydrophobicContact CB-CG 4.29Å; L1022-L1057 HydrophobicContact CD1-CD1 3.67Å; L1022-L1057 HydrophobicContact CD1-CD2 4.15Å; L1022-R1085 CarbonylContact O-C 3.57Å; L1022-R1085 WeakPolarHBondContact O-CA 3.16Å; L1022-A1086 HydrophobicContact CB-CB 4.31Å; L1022-A1086 PolarHBondContact N-O 2.88Å; L1022-A1086 PolarHBondContact O-N 2.66Å; L1022-V1088 HydrophobicContact CD1-CG1 4.36Å; L1022-V1088 HydrophobicContact CD1-CG2 3.97Å; L1022-L1107 HydrophobicContact CD2-CD2 4.12Å; L1022-H1128 WeakPolarHBondContact CA-O 3.49Å; L1022-V1129 HydrophobicContact CD2-CB 4.17Å; L1022-V1129 HydrophobicContact CD2-CG1 3.77Å; L1022-V1129 HydrophobicContact CD2-CG2 3.88Å
1023	E	85.4	Confident	77.5	Confident	59 Å²	59	53.7 Å²	53.7	28%	0.276	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	109.8	167.1	-71	-173.2	-156.4	0	0	110.4	L1083 H1128	E1023-L1083 HydrophobicContact CB-CB 4.4Å; E1023-H1128 HydrophobicContact CB-CB 4.27Å; E1023-H1128 PolarHBondContact N-O 2.93Å; E1023-H1128 IonicContact OE2-CD2 3.15Å
1024	L	84.9	Confident	78.4	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	128.1	-169.1	-55.4	-176	0	0	0	112	L1022 V1027 L1032 I1053 V1084 A1086 L1119 V1121	L1022-L1024 HydrophobicContact CB-CD2 3.87Å; L1022-L1024 HydrophobicContact CB-CG 4.29Å; L1024-V1027 HydrophobicContact CD1-CG2 4.25Å; L1024-L1032 HydrophobicContact CB-CD1 3.87Å; L1024-L1032 HydrophobicContact CD1-CD1 3.99Å; L1024-I1053 HydrophobicContact CD1-CD1 3.79Å; L1024-I1053 HydrophobicContact CD1-CG1 3.95Å; L1024-I1053 HydrophobicContact CD1-CG2 4.45Å; L1024-V1084 PolarHBondContact N-O 3.41Å; L1024-V1084 PolarHBondContact O-N 2.04Å; L1024-A1086 HydrophobicContact CD1-CB 3.94Å; L1024-A1086 HydrophobicContact CG-CB 4.38Å; L1024-L1119 HydrophobicContact CD1-CD1 4.33Å; L1024-L1119 HydrophobicContact CD2-CD1 3.77Å; L1024-L1119 HydrophobicContact CD2-CG 4.22Å; L1024-V1121 HydrophobicContact CD2-CG2 3.89Å
1025	E	81.6	Confident	79.2	Confident	79 Å²	79	53.1 Å²	53.1	37%	0.369	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-29.9	169.8	-63.8	177.9	157.3	0	0	110.9	L1032 L1083 A1120 R1122	E1025-L1032 PolarHBondContact O-N 2.66Å; E1025-L1083 HydrophobicContact CG-CD1 3.41Å; E1025-L1083 VanDerWaalsContact CG-CD1 3.41Å; E1025-L1083 HydrophobicContact CG-CD2 3.86Å; E1025-L1083 HydrophobicContact CG-CG 4.28Å; E1025-A1120 HydrophobicContact CB-CB 4Å; E1025-A1120 PolarHBondContact N-O 3.16Å; E1025-R1122 HydrophobicContact CG-CB 4.33Å; E1025-R1122 VanDerWaalsContact OE1-CA 3.31Å; E1025-R1122 WeakPolarHBondContact OE1-CA 3.39Å; E1025-R1122 WeakPolarHBondContact OE1-CB 3.06Å; E1025-R1122 WeakPolarHBondContact OE1-CG 3Å
1026	G	80.6	Confident	79.4	Confident	5 Å²	5	56.4 Å²	56.4	5%	0.052	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.2	166.9	-178.4	0	0	0	0	0	114	Q1030 A1120	G1026-Q1030 CarbonylContact C-O 3.48Å; G1026-Q1030 WeakPolarHBondContact CA-O 3.34Å; G1026-A1120 PolarHBondContact N-O 2.78Å; G1026-A1120 PolarHBondContact O-N 2.83Å
1027	V	81.3	Confident	79.2	Confident	6 Å²	6	60 Å²	60	4%	0.036	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	140.3	-179.4	179.3	0	0	0	0	108.9	L1024 G1029 Q1030 L1032 S1052 I1053 T1056 L1119	L1024-V1027 HydrophobicContact CD1-CG2 4.25Å; V1027-G1029 PolarHBondContact O-N 2.85Å; V1027-Q1030 PolarHBondContact N-O 3.39Å; V1027-Q1030 PolarHBondContact O-N 3.1Å; V1027-L1032 HydrophobicContact CB-CD1 4.43Å; V1027-L1032 HydrophobicContact CG2-CD1 3.6Å; V1027-L1032 HydrophobicContact CG2-CG 4.46Å; V1027-S1052 WeakPolarHBondContact CG1-OG 3.48Å; V1027-I1053 HydrophobicContact CG2-CG1 3.79Å; V1027-T1056 HydrophobicContact CG1-CG2 4.49Å; V1027-T1056 WeakPolarHBondContact CG1-OG1 3.48Å; V1027-L1119 HydrophobicContact CG2-CD1 3.83Å
1028	E	73.6	Confident	78.8	Confident	135 Å²	135	59.7 Å²	59.7	63%	0.631	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	20.5	178.8	-67.5	-176.6	99.9	0	0	115.7	S1052 W1117 A1118	E1028-S1052 PolarHBondContact OE2-OG 3.42Å; E1028-W1117 CarbonylContact C-O 3.42Å; E1028-W1117 VanDerWaalsContact C-O 3.22Å; E1028-W1117 VanDerWaalsContact CA-O 3.23Å; E1028-W1117 WeakPolarHBondContact CA-O 3.11Å; E1028-W1117 PolarHBondContact N-O 2.86Å; E1028-A1118 PolarHBondContact N-O 3.26Å
1029	G	64.1	Low	78.2	Confident	61 Å²	61	62.2 Å²	62.2	63%	0.629	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.8	8.5	-178.7	0	0	0	0	0	115	V1027 W1117	V1027-G1029 PolarHBondContact O-N 2.85Å; G1029-W1117 PolarHBondContact N-O 3.14Å
1030	Q	68.9	Low	77.4	Confident	150 Å²	150	63.8 Å²	63.8	70%	0.701	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.3	172.2	-171.7	173.2	-50.3	0	0	110.3	G1026 V1027	G1026-Q1030 CarbonylContact C-O 3.48Å; G1026-Q1030 WeakPolarHBondContact CA-O 3.34Å; V1027-Q1030 PolarHBondContact N-O 3.39Å; V1027-Q1030 PolarHBondContact O-N 3.1Å
1031	E	73.7	Confident	76.4	Confident	140 Å²	140	67.8 Å²	67.8	65%	0.654	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	138.1	174.4	-67.5	-179.5	159.6	0	0	110.7	F1033	E1031-F1033 HydrophobicContact CB-CD2 4.46Å; E1031-F1033 HydrophobicContact CB-CE2 3.66Å; E1031-F1033 HydrophobicContact CB-CZ 4.01Å; E1031-F1033 WeakPolarHBondContact OE2-CZ 3.16Å
1032	L	76.1	Confident	75.2	Confident	25 Å²	25	75.1 Å²	75.1	13%	0.131	39%	0.394	C	S	.	.			trans	-101.1	112.2	-179.1	-81.3	177.9	0	0	0	110.9	L1024 E1025 V1027 T1049 I1053 V1084	L1024-L1032 HydrophobicContact CB-CD1 3.87Å; L1024-L1032 HydrophobicContact CD1-CD1 3.99Å; E1025-L1032 PolarHBondContact O-N 2.66Å; V1027-L1032 HydrophobicContact CB-CD1 4.43Å; V1027-L1032 HydrophobicContact CG2-CD1 3.6Å; V1027-L1032 HydrophobicContact CG2-CG 4.46Å; L1032-T1049 HydrophobicContact CD2-CG2 3.74Å; L1032-I1053 HydrophobicContact CD1-CD1 4.41Å; L1032-V1084 HydrophobicContact CB-CB 4.22Å; L1032-V1084 HydrophobicContact CB-CG2 3.89Å
1033	F	77.3	Confident	74.6	Confident	146 Å²	146	76.4 Å²	76.4	64%	0.64	40%	0.402	S	S	*	.			trans	-104.7	130.2	172.3	-60.3	-80.6	0	0	0	109.7	E1031 T1035 M1038	E1031-F1033 HydrophobicContact CB-CD2 4.46Å; E1031-F1033 HydrophobicContact CB-CE2 3.66Å; E1031-F1033 HydrophobicContact CB-CZ 4.01Å; E1031-F1033 WeakPolarHBondContact OE2-CZ 3.16Å; F1033-T1035 PolarHBondContact O-N 3.32Å; F1033-M1038 VanDerWaalsContact O-SD 3.37Å
1034	Y	77.6	Confident	73.9	Confident	78 Å²	78	82 Å²	82	31%	0.306	43%	0.428	S	S	.	.			trans	-69	129.7	175.2	178.5	-93.8	0	0	0	110.4	L1078 G1079 P1080	Y1034-L1078 WeakPolarHBondContact CE2-O 3.18Å; Y1034-G1079 VanDerWaalsContact CE2-C 3.47Å; Y1034-P1080 HydrophobicContact CD1-CB 4.03Å; Y1034-P1080 HydrophobicContact CD2-CB 4.38Å; Y1034-P1080 HydrophobicContact CE1-CB 3.81Å; Y1034-P1080 HydrophobicContact CE1-CG 4.48Å; Y1034-P1080 HydrophobicContact CE2-CB 4.18Å; Y1034-P1080 HydrophobicContact CG-CB 4.3Å
1035	T	76.8	Confident	73.4	Confident	47 Å²	47	84.8 Å²	84.8	29%	0.288	44%	0.443	S	S	.	.			trans	-123.5	150.9	169	62.1	0	0	0	0	109.5	F1033 E1037 M1038 L1045	F1033-T1035 PolarHBondContact O-N 3.32Å; T1035-E1037 PolarHBondContact O-N 2.65Å; T1035-E1037 VanDerWaalsContact O-N 3.17Å; T1035-M1038 PolarHBondContact N-SD 3.26Å; T1035-M1038 WeakPolarHBondContact O-CB 3.2Å; T1035-M1038 PolarHBondContact O-N 2.97Å; T1035-M1038 WeakPolarHBondContact OG1-CG 3.26Å; T1035-M1038 PolarHBondContact OG1-SD 3.12Å; T1035-L1045 WeakPolarHBondContact OG1-CD2 3.47Å
1036	P	74.2	Confident	73.4	Confident	108 Å²	108	81.9 Å²	81.9	70%	0.701	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-58.3	-29.3	178.4	-25.2	35.4	0	0	0	113.4	M1038 A1039	P1036-M1038 PolarHBondContact O-N 3Å; P1036-A1039 VanDerWaalsContact O-CB 3.3Å; P1036-A1039 WeakPolarHBondContact O-CB 3.02Å; P1036-A1039 PolarHBondContact O-N 2.89Å
1037	E	72.7	Confident	73.1	Confident	130 Å²	130	82.3 Å²	82.3	61%	0.607	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-65	-13.5	175.4	-65.6	173.2	-170.3	0	0	113.6	T1035 S1043 L1045	T1035-E1037 PolarHBondContact O-N 2.65Å; T1035-E1037 VanDerWaalsContact O-N 3.17Å; E1037-S1043 WeakPolarHBondContact O-CB 3.38Å; E1037-S1043 PolarHBondContact O-OG 3.24Å; E1037-L1045 HydrophobicContact CB-CD2 4.05Å
1038	M	73	Confident	72.9	Confident	5 Å²	5	88.7 Å²	88.7	3%	0.025	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-88.5	-6.6	173.6	-63.3	161.1	68.9	0	0	112.8	F1033 T1035 P1036 L1045 F1046 T1049 L1078 V1084	F1033-M1038 VanDerWaalsContact O-SD 3.37Å; T1035-M1038 PolarHBondContact N-SD 3.26Å; T1035-M1038 WeakPolarHBondContact O-CB 3.2Å; T1035-M1038 PolarHBondContact O-N 2.97Å; T1035-M1038 WeakPolarHBondContact OG1-CG 3.26Å; T1035-M1038 PolarHBondContact OG1-SD 3.12Å; P1036-M1038 PolarHBondContact O-N 3Å; M1038-L1045 HydrophobicContact CG-CD2 3.93Å; M1038-L1045 HydrophobicContact CG-CG 3.99Å; M1038-L1045 HydrophobicContact SD-CD2 4.46Å; M1038-F1046 WeakPolarHBondContact O-CD2 3.1Å; M1038-T1049 HydrophobicContact CE-CG2 4.04Å; M1038-L1078 HydrophobicContact CB-CB 4.32Å; M1038-L1078 HydrophobicContact CB-CD1 4.34Å; M1038-L1078 HydrophobicContact CE-CD1 3.82Å; M1038-V1084 HydrophobicContact CE-CG1 4.27Å; M1038-V1084 HydrophobicContact CE-CG2 4.38Å
1039	A	71.4	Confident	73.3	Confident	53 Å²	53	83.2 Å²	83.2	44%	0.438	44%	0.439	S	S	.	.	S	Bend	trans	-81.9	-21.8	177.2	0	0	0	0	0	113.6	P1036 P1041	P1036-A1039 VanDerWaalsContact O-CB 3.3Å; P1036-A1039 WeakPolarHBondContact O-CB 3.02Å; P1036-A1039 PolarHBondContact O-N 2.89Å; A1039-P1041 WeakPolarHBondContact O-CD 3.42Å
1040	D	71.1	Confident	74.2	Confident	79 Å²	79	80.6 Å²	80.6	42%	0.422	41%	0.411	S	S	.	.	S	Bend	trans	-91.1	116.2	175.4	-177.9	1.5	0	0	0	110.5	K1042 S1043 F1046	D1040-K1042 PolarHBondContact O-N 3.2Å; D1040-K1042 WeakPolarHBondContact OD1-CB 3.03Å; D1040-K1042 PolarHBondContact OD1-N 3.36Å; D1040-S1043 VanDerWaalsContact O-CB 3.23Å; D1040-S1043 WeakPolarHBondContact O-CB 3.3Å; D1040-S1043 PolarHBondContact O-N 2.04Å; D1040-F1046 WeakPolarHBondContact O-CB 3.45Å
1041	P	64.3	Low	74.7	Confident	84 Å²	84	81 Å²	81	55%	0.545	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-12.7	176	-24.2	35.7	0	0	0	115.1	A1039 F1046	A1039-P1041 WeakPolarHBondContact O-CD 3.42Å; P1041-F1046 HydrophobicContact CB-CD1 4.29Å; P1041-F1046 HydrophobicContact CB-CE1 4Å; P1041-F1046 HydrophobicContact CB-CZ 4.31Å; P1041-F1046 WeakPolarHBondContact O-CD1 3.14Å
1042	K	63.1	Low	75.2	Confident	188 Å²	188	75.9 Å²	75.9	82%	0.817	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-9	177	-59.1	167.9	-175	165	0	113.5	D1040	D1040-K1042 PolarHBondContact O-N 3.2Å; D1040-K1042 WeakPolarHBondContact OD1-CB 3.03Å; D1040-K1042 PolarHBondContact OD1-N 3.36Å
1043	S	74.4	Confident	75.7	Confident	26 Å²	26	74.8 Å²	74.8	18%	0.182	38%	0.38	C	S	.	.	S	Bend	trans	-66.3	139.5	178.4	174.1	0	0	0	0	111.7	E1037 D1040 L1045 F1046 G1047	E1037-S1043 WeakPolarHBondContact O-CB 3.38Å; E1037-S1043 PolarHBondContact O-OG 3.24Å; D1040-S1043 VanDerWaalsContact O-CB 3.23Å; D1040-S1043 WeakPolarHBondContact O-CB 3.3Å; D1040-S1043 PolarHBondContact O-N 2.04Å; S1043-L1045 PolarHBondContact O-N 3.02Å; S1043-L1045 PolarHBondContact OG-N 3.5Å; S1043-F1046 PolarHBondContact O-N 3.49Å; S1043-G1047 PolarHBondContact O-N 2.97Å
1044	E	72.1	Confident	76.2	Confident	176 Å²	176	70 Å²	70	82%	0.822	36%	0.36	S	S	*	.	H	α-helix	trans	-61.3	-34.9	172	-65.1	-166.6	144.4	0	0	111.3	G1047 E1048	E1044-G1047 CarbonylContact O-C 3.55Å; E1044-G1047 PolarHBondContact O-N 3.42Å; E1044-E1048 PolarHBondContact O-N 2.83Å
1045	L	72.7	Confident	76.5	Confident	60 Å²	60	69.6 Å²	69.6	31%	0.314	37%	0.368	S	S	.	.	H	α-helix	trans	-70	-37.9	178.6	-173.5	64	0	0	0	112.4	T1035 E1037 M1038 S1043 T1049	T1035-L1045 WeakPolarHBondContact OG1-CD2 3.47Å; E1037-L1045 HydrophobicContact CB-CD2 4.05Å; M1038-L1045 HydrophobicContact CG-CD2 3.93Å; M1038-L1045 HydrophobicContact CG-CG 3.99Å; M1038-L1045 HydrophobicContact SD-CD2 4.46Å; S1043-L1045 PolarHBondContact O-N 3.02Å; S1043-L1045 PolarHBondContact OG-N 3.5Å; L1045-T1049 WeakPolarHBondContact O-CB 3.22Å; L1045-T1049 PolarHBondContact O-N 3.48Å; L1045-T1049 VanDerWaalsContact O-N 3.13Å; L1045-T1049 PolarHBondContact O-OG1 3.38Å
1046	F	81.8	Confident	76.9	Confident	18 Å²	18	67.9 Å²	67.9	8%	0.079	36%	0.358	C	S	.	.	H	α-helix	trans	-60.8	-49.6	166.6	175.5	-91.7	0	0	0	109.9	M1038 D1040 P1041 S1043 E1048 T1049 A1050 L1075 L1078	M1038-F1046 WeakPolarHBondContact O-CD2 3.1Å; D1040-F1046 WeakPolarHBondContact O-CB 3.45Å; P1041-F1046 HydrophobicContact CB-CD1 4.29Å; P1041-F1046 HydrophobicContact CB-CE1 4Å; P1041-F1046 HydrophobicContact CB-CZ 4.31Å; P1041-F1046 WeakPolarHBondContact O-CD1 3.14Å; S1043-F1046 PolarHBondContact O-N 3.49Å; F1046-E1048 PolarHBondContact O-N 3.03Å; F1046-T1049 PolarHBondContact O-N 3Å; F1046-A1050 HydrophobicContact CD1-CB 4.41Å; F1046-A1050 HydrophobicContact CE1-CB 4.18Å; F1046-A1050 HydrophobicContact CZ-CB 4.47Å; F1046-A1050 WeakPolarHBondContact O-CB 3.02Å; F1046-A1050 PolarHBondContact O-N 3.06Å; F1046-L1075 HydrophobicContact CE2-CD2 4.25Å; F1046-L1075 HydrophobicContact CZ-CD2 4.36Å; F1046-L1075 HydrophobicContact CZ-CG 4.49Å; F1046-L1078 HydrophobicContact CD2-CB 4.41Å; F1046-L1078 HydrophobicContact CD2-CD1 3.89Å; F1046-L1078 HydrophobicContact CD2-CG 4.11Å; F1046-L1078 HydrophobicContact CE2-CB 4.45Å; F1046-L1078 HydrophobicContact CE2-CD1 4.23Å; F1046-L1078 HydrophobicContact CE2-CG 4.02Å
1047	G	74.3	Confident	77.6	Confident	13 Å²	13	62.8 Å²	62.8	13%	0.134	32%	0.324	C	S	.	.	H	α-helix	trans	-62	-36.2	-178	0	0	0	0	0	114.9	S1043 E1044 R1051	S1043-G1047 PolarHBondContact O-N 2.97Å; E1044-G1047 CarbonylContact O-C 3.55Å; E1044-G1047 PolarHBondContact O-N 3.42Å; G1047-R1051 WeakPolarHBondContact O-CD 3.35Å; G1047-R1051 VanDerWaalsContact O-CG 3.22Å; G1047-R1051 WeakPolarHBondContact O-CG 3.09Å; G1047-R1051 VanDerWaalsContact O-CZ 3.26Å; G1047-R1051 PolarHBondContact O-N 2.93Å; G1047-R1051 PolarHBondContact O-NE 3.32Å; G1047-R1051 PolarHBondContact O-NH1 2.75Å
1048	E	77.9	Confident	78.2	Confident	140 Å²	140	58.4 Å²	58.4	65%	0.654	31%	0.305	S	S	*	.	H	α-helix	trans	-69.9	-48.5	172.6	-71.8	-159.8	150.3	0	0	111.4	E1044 F1046 A1050 R1051 S1052	E1044-E1048 PolarHBondContact O-N 2.83Å; F1046-E1048 PolarHBondContact O-N 3.03Å; E1048-A1050 VanDerWaalsContact C-N 3.34Å; E1048-A1050 PolarHBondContact O-N 3.06Å; E1048-R1051 PolarHBondContact O-N 2.83Å; E1048-S1052 PolarHBondContact O-N 2.68Å
1049	T	81.4	Confident	78.8	Confident	21 Å²	21	62.8 Å²	62.8	13%	0.129	33%	0.329	C	S	.	.	H	α-helix	trans	-64.4	-39.6	-178.7	-50.8	0	0	0	0	111.7	L1032 M1038 L1045 F1046 S1052 I1053 L1078	L1032-T1049 HydrophobicContact CD2-CG2 3.74Å; M1038-T1049 HydrophobicContact CE-CG2 4.04Å; L1045-T1049 WeakPolarHBondContact O-CB 3.22Å; L1045-T1049 PolarHBondContact O-N 3.48Å; L1045-T1049 VanDerWaalsContact O-N 3.13Å; L1045-T1049 PolarHBondContact O-OG1 3.38Å; F1046-T1049 PolarHBondContact O-N 3Å; T1049-S1052 PolarHBondContact O-N 3.41Å; T1049-I1053 HydrophobicContact CG2-CD1 3.84Å; T1049-I1053 WeakPolarHBondContact O-CG1 3.48Å; T1049-I1053 PolarHBondContact O-N 2.03Å; T1049-L1078 HydrophobicContact CG2-CD1 3.83Å
1050	A	82.4	Confident	79.5	Confident	5 Å²	5	60.9 Å²	60.9	4%	0.041	31%	0.311	C	S	.	.	H	α-helix	trans	-57.7	-50.4	177.1	0	0	0	0	0	111.8	F1046 E1048 S1052 I1053 E1054 L1075	F1046-A1050 HydrophobicContact CD1-CB 4.41Å; F1046-A1050 HydrophobicContact CE1-CB 4.18Å; F1046-A1050 HydrophobicContact CZ-CB 4.47Å; F1046-A1050 WeakPolarHBondContact O-CB 3.02Å; F1046-A1050 PolarHBondContact O-N 3.06Å; E1048-A1050 VanDerWaalsContact C-N 3.34Å; E1048-A1050 PolarHBondContact O-N 3.06Å; A1050-S1052 VanDerWaalsContact C-N 3.31Å; A1050-S1052 PolarHBondContact O-N 3.31Å; A1050-I1053 PolarHBondContact O-N 3.43Å; A1050-E1054 VanDerWaalsContact O-CB 3.31Å; A1050-E1054 WeakPolarHBondContact O-CB 3.35Å; A1050-E1054 VanDerWaalsContact O-CG 3.25Å; A1050-E1054 WeakPolarHBondContact O-CG 3.45Å; A1050-E1054 PolarHBondContact O-N 2.87Å; A1050-L1075 HydrophobicContact CB-CB 4.39Å; A1050-L1075 HydrophobicContact CB-CD2 3.68Å
1051	R	80.4	Confident	80.3	Confident	160 Å²	160	57.1 Å²	57.1	60%	0.604	29%	0.291	S	S	*	.	H	α-helix	trans	-62.7	-35.1	-178	-67.5	169.3	-161.2	122.4	-3.8	112.9	G1047 E1048 S1055	G1047-R1051 WeakPolarHBondContact O-CD 3.35Å; G1047-R1051 VanDerWaalsContact O-CG 3.22Å; G1047-R1051 WeakPolarHBondContact O-CG 3.09Å; G1047-R1051 VanDerWaalsContact O-CZ 3.26Å; G1047-R1051 PolarHBondContact O-N 2.93Å; G1047-R1051 PolarHBondContact O-NE 3.32Å; G1047-R1051 PolarHBondContact O-NH1 2.75Å; E1048-R1051 PolarHBondContact O-N 2.83Å; R1051-S1055 WeakPolarHBondContact O-CB 3.28Å; R1051-S1055 PolarHBondContact O-N 3.44Å
1052	S	85.1	Confident	81.3	Confident	32 Å²	32	58 Å²	58	22%	0.224	28%	0.284	C	S	.	.	H	α-helix	trans	-71.6	-42.8	176.5	178.8	0	0	0	0	111.7	V1027 E1028 E1048 T1049 A1050 T1056	V1027-S1052 WeakPolarHBondContact CG1-OG 3.48Å; E1028-S1052 PolarHBondContact OE2-OG 3.42Å; E1048-S1052 PolarHBondContact O-N 2.68Å; T1049-S1052 PolarHBondContact O-N 3.41Å; A1050-S1052 VanDerWaalsContact C-N 3.31Å; A1050-S1052 PolarHBondContact O-N 3.31Å; S1052-T1056 VanDerWaalsContact O-CB 3.27Å; S1052-T1056 WeakPolarHBondContact O-CB 3.33Å; S1052-T1056 PolarHBondContact O-N 3.18Å; S1052-T1056 PolarHBondContact O-OG1 2.97Å
1053	I	85.6	Confident	82.3	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-61.9	-49.8	173.1	-70.4	167.6	0	0	0	111.1	L1024 V1027 L1032 T1049 A1050 T1056 L1057 L1075 L1078	L1024-I1053 HydrophobicContact CD1-CD1 3.79Å; L1024-I1053 HydrophobicContact CD1-CG1 3.95Å; L1024-I1053 HydrophobicContact CD1-CG2 4.45Å; V1027-I1053 HydrophobicContact CG2-CG1 3.79Å; L1032-I1053 HydrophobicContact CD1-CD1 4.41Å; T1049-I1053 HydrophobicContact CG2-CD1 3.84Å; T1049-I1053 WeakPolarHBondContact O-CG1 3.48Å; T1049-I1053 PolarHBondContact O-N 2.03Å; A1050-I1053 PolarHBondContact O-N 3.43Å; I1053-T1056 PolarHBondContact O-N 3.38Å; I1053-L1057 HydrophobicContact CG2-CD1 3.64Å; I1053-L1057 WeakPolarHBondContact O-CB 3Å; I1053-L1057 WeakPolarHBondContact O-CG 3.49Å; I1053-L1057 PolarHBondContact O-N 3.17Å; I1053-L1075 HydrophobicContact CD1-CD2 4.15Å; I1053-L1075 HydrophobicContact CG2-CD1 4.31Å; I1053-L1078 HydrophobicContact CD1-CD2 3.77Å
1054	E	88.1	Confident	82.9	Confident	47 Å²	47	52.4 Å²	52.4	22%	0.22	26%	0.26	C	S	.	.	H	α-helix	trans	-60.4	-50.1	179.3	-73.6	174.7	157.1	0	0	111.3	A1050 T1056 L1057 D1058 I1073 R1074 L1075	A1050-E1054 VanDerWaalsContact O-CB 3.31Å; A1050-E1054 WeakPolarHBondContact O-CB 3.35Å; A1050-E1054 VanDerWaalsContact O-CG 3.25Å; A1050-E1054 WeakPolarHBondContact O-CG 3.45Å; A1050-E1054 PolarHBondContact O-N 2.87Å; E1054-T1056 VanDerWaalsContact C-N 3.33Å; E1054-T1056 PolarHBondContact O-N 3.47Å; E1054-L1057 PolarHBondContact O-N 3.05Å; E1054-D1058 VanDerWaalsContact O-CB 3.23Å; E1054-D1058 WeakPolarHBondContact O-CB 3.07Å; E1054-D1058 PolarHBondContact O-N 3.36Å; E1054-I1073 HydrophobicContact CB-CG2 4.47Å; E1054-I1073 WeakPolarHBondContact O-CG2 3.42Å; E1054-R1074 VanDerWaalsContact OE1-CA 3.3Å; E1054-R1074 WeakPolarHBondContact OE1-CA 3.5Å; E1054-L1075 HydrophobicContact CG-CB 4.05Å; E1054-L1075 PolarHBondContact OE1-N 2.89Å
1055	S	83.4	Confident	83.4	Confident	68 Å²	68	49.5 Å²	49.5	48%	0.476	25%	0.25	S	S	.	.	H	α-helix	trans	-61.8	-40.8	179.4	-167.9	0	0	0	0	112.1	R1051 D1059	R1051-S1055 WeakPolarHBondContact O-CB 3.28Å; R1051-S1055 PolarHBondContact O-N 3.44Å; S1055-D1059 PolarHBondContact O-N 3.49Å; S1055-D1059 VanDerWaalsContact O-N 3.1Å
1056	T	86.6	Confident	84.1	Confident	12 Å²	12	46.8 Å²	46.8	7%	0.074	24%	0.236	C	C	.	.	H	α-helix	trans	-65.6	-42.9	178.3	-61.3	0	0	0	0	111.7	V1027 S1052 I1053 E1054 L1060 A1118 L1119	V1027-T1056 HydrophobicContact CG1-CG2 4.49Å; V1027-T1056 WeakPolarHBondContact CG1-OG1 3.48Å; S1052-T1056 VanDerWaalsContact O-CB 3.27Å; S1052-T1056 WeakPolarHBondContact O-CB 3.33Å; S1052-T1056 PolarHBondContact O-N 3.18Å; S1052-T1056 PolarHBondContact O-OG1 2.97Å; I1053-T1056 PolarHBondContact O-N 3.38Å; E1054-T1056 VanDerWaalsContact C-N 3.33Å; E1054-T1056 PolarHBondContact O-N 3.47Å; T1056-L1060 HydrophobicContact CG2-CD1 4.24Å; T1056-L1060 VanDerWaalsContact O-CG 3.29Å; T1056-L1060 WeakPolarHBondContact O-CG 3.4Å; T1056-L1060 PolarHBondContact O-N 3.05Å; T1056-L1060 VanDerWaalsContact O-N 3.09Å; T1056-A1118 WeakPolarHBondContact CG2-O 3.35Å; T1056-L1119 HydrophobicContact CG2-CB 3.91Å; T1056-L1119 HydrophobicContact CG2-CD1 4.32Å
1057	L	86.8	Confident	84.1	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-73.7	-35	179.1	-72.7	168.3	0	0	0	112.5	L1022 I1053 E1054 L1060 F1061 I1073 V1088 L1107 L1119	L1022-L1057 HydrophobicContact CD1-CD1 3.67Å; L1022-L1057 HydrophobicContact CD1-CD2 4.15Å; I1053-L1057 HydrophobicContact CG2-CD1 3.64Å; I1053-L1057 WeakPolarHBondContact O-CB 3Å; I1053-L1057 WeakPolarHBondContact O-CG 3.49Å; I1053-L1057 PolarHBondContact O-N 3.17Å; E1054-L1057 PolarHBondContact O-N 3.05Å; L1057-L1060 HydrophobicContact CD2-CD1 4.31Å; L1057-L1060 PolarHBondContact O-N 3.18Å; L1057-F1061 VanDerWaalsContact O-CD2 3.24Å; L1057-F1061 WeakPolarHBondContact O-CD2 3.49Å; L1057-F1061 PolarHBondContact O-N 2.87Å; L1057-I1073 HydrophobicContact CB-CD1 3.47Å; L1057-I1073 VanDerWaalsContact CB-CD1 3.47Å; L1057-I1073 HydrophobicContact CB-CG2 4.33Å; L1057-I1073 HydrophobicContact CD1-CD1 3.58Å; L1057-I1073 HydrophobicContact CG-CD1 4.1Å; L1057-V1088 HydrophobicContact CD1-CG1 3.94Å; L1057-L1107 HydrophobicContact CD2-CD1 3.85Å; L1057-L1107 HydrophobicContact CD2-CD2 3.94Å; L1057-L1119 HydrophobicContact CD2-CD2 3.57Å; L1057-L1119 HydrophobicContact CG-CD2 4.37Å
1058	D	86.6	Confident	84.4	Confident	39 Å²	39	59 Å²	59	21%	0.209	29%	0.286	C	S	.	.	H	α-helix	trans	-60.7	-46.4	173.7	-167.3	74.5	0	0	0	110.8	E1054 F1061 R1062 F1070 I1073	E1054-D1058 VanDerWaalsContact O-CB 3.23Å; E1054-D1058 WeakPolarHBondContact O-CB 3.07Å; E1054-D1058 PolarHBondContact O-N 3.36Å; D1058-F1061 PolarHBondContact O-N 3.27Å; D1058-R1062 WeakPolarHBondContact O-CB 3.45Å; D1058-R1062 VanDerWaalsContact O-CG 3.29Å; D1058-R1062 WeakPolarHBondContact O-CG 3.02Å; D1058-R1062 PolarHBondContact O-N 2.87Å; D1058-R1062 IonicContact OD1-CZ 2.68Å; D1058-R1062 IonicContact OD1-NE 2.66Å; D1058-R1062 PolarHBondContact OD1-NE 2.87Å; D1058-R1062 IonicContact OD1-NH2 3.14Å; D1058-R1062 PolarHBondContact OD1-NH2 3.09Å; D1058-R1062 IonicContact OD2-CZ 3.34Å; D1058-R1062 IonicContact OD2-NE 3.99Å; D1058-R1062 PolarHBondContact OD2-NE 2.03Å; D1058-R1062 IonicContact OD2-NH2 2.74Å; D1058-R1062 PolarHBondContact OD2-NH2 2.86Å; D1058-F1070 VanDerWaalsContact OD1-CE1 3.31Å; D1058-F1070 WeakPolarHBondContact OD1-CE1 3.39Å; D1058-F1070 VanDerWaalsContact OD1-CZ 3.31Å; D1058-F1070 WeakPolarHBondContact OD1-CZ 3.41Å; D1058-I1073 HydrophobicContact CB-CG2 4.01Å
1059	D	84.4	Confident	84.6	Confident	97 Å²	97	54.1 Å²	54.1	52%	0.519	26%	0.264	S	S	.	.	H	α-helix	trans	-61.6	-42.7	173	-95.7	-23.8	0	0	0	112.3	S1055 R1062 N1063	S1055-D1059 PolarHBondContact O-N 3.49Å; S1055-D1059 VanDerWaalsContact O-N 3.1Å; D1059-R1062 PolarHBondContact O-N 3.42Å; D1059-N1063 PolarHBondContact O-N 3.38Å; D1059-N1063 VanDerWaalsContact O-N 3.12Å; D1059-N1063 PolarHBondContact O-ND2 2.7Å
1060	L	87.2	Confident	84.7	Confident	12 Å²	12	53.5 Å²	53.5	6%	0.063	26%	0.26	C	S	.	.	H	α-helix	trans	-62.6	-46.4	176.4	-73	166.7	0	0	0	111.5	T1056 L1057 N1063 S1064 L1107 Q1110 I1111 L1119	T1056-L1060 HydrophobicContact CG2-CD1 4.24Å; T1056-L1060 VanDerWaalsContact O-CG 3.29Å; T1056-L1060 WeakPolarHBondContact O-CG 3.4Å; T1056-L1060 PolarHBondContact O-N 3.05Å; T1056-L1060 VanDerWaalsContact O-N 3.09Å; L1057-L1060 HydrophobicContact CD2-CD1 4.31Å; L1057-L1060 PolarHBondContact O-N 3.18Å; L1060-N1063 PolarHBondContact O-N 2.04Å; L1060-S1064 PolarHBondContact O-N 3.41Å; L1060-L1107 HydrophobicContact CB-CD1 3.87Å; L1060-L1107 HydrophobicContact CD1-CD1 4.05Å; L1060-Q1110 HydrophobicContact CB-CB 4.44Å; L1060-Q1110 HydrophobicContact CD2-CB 3.9Å; L1060-I1111 HydrophobicContact CD1-CG1 4.25Å; L1060-L1119 HydrophobicContact CD1-CB 4.05Å; L1060-L1119 HydrophobicContact CD1-CD2 3.86Å
1061	F	87.9	Confident	84.6	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-68.3	-37.2	178.5	-80.4	-63	0	0	0	112.7	L1057 D1058 N1063 S1064 V1066 K1067 F1070 I1073 V1090 V1103 L1107 F1131	L1057-F1061 VanDerWaalsContact O-CD2 3.24Å; L1057-F1061 WeakPolarHBondContact O-CD2 3.49Å; L1057-F1061 PolarHBondContact O-N 2.87Å; D1058-F1061 PolarHBondContact O-N 3.27Å; F1061-N1063 VanDerWaalsContact C-N 3.26Å; F1061-N1063 PolarHBondContact O-N 2.91Å; F1061-S1064 WeakPolarHBondContact O-CB 3.3Å; F1061-S1064 PolarHBondContact O-N 2.95Å; F1061-S1064 PolarHBondContact O-OG 3.07Å; F1061-V1066 HydrophobicContact CD1-CG2 3.97Å; F1061-V1066 HydrophobicContact CE1-CG2 4.42Å; F1061-K1067 WeakPolarHBondContact O-CB 3.19Å; F1061-F1070 HydrophobicContact CB-CD1 3.76Å; F1061-F1070 HydrophobicContact CB-CD2 4Å; F1061-F1070 HydrophobicContact CB-CE1 3.71Å; F1061-F1070 HydrophobicContact CB-CE2 3.96Å; F1061-F1070 HydrophobicContact CB-CG 3.9Å; F1061-F1070 HydrophobicContact CB-CZ 3.81Å; F1061-F1070 HydrophobicContact CD2-CE2 4.32Å; F1061-F1070 HydrophobicContact CG-CD2 4.35Å; F1061-F1070 HydrophobicContact CG-CE2 4.26Å; F1061-F1070 HydrophobicContact CG-CZ 4.48Å; F1061-I1073 HydrophobicContact CD2-CD1 4.4Å; F1061-I1073 HydrophobicContact CE2-CD1 4.14Å; F1061-V1090 HydrophobicContact CD2-CG1 4Å; F1061-V1090 HydrophobicContact CE1-CG1 4.45Å; F1061-V1090 HydrophobicContact CE2-CB 4.49Å; F1061-V1090 HydrophobicContact CE2-CG1 3.82Å; F1061-V1090 HydrophobicContact CE2-CG2 3.76Å; F1061-V1090 HydrophobicContact CG-CG1 4.4Å; F1061-V1090 HydrophobicContact CZ-CG1 4.05Å; F1061-V1090 HydrophobicContact CZ-CG2 4.05Å; F1061-V1103 HydrophobicContact CE1-CG1 3.67Å; F1061-V1103 HydrophobicContact CZ-CG1 3.88Å; F1061-L1107 HydrophobicContact CE1-CB 3.95Å; F1061-L1107 HydrophobicContact CE1-CD1 4.49Å; F1061-L1107 HydrophobicContact CE2-CD1 4.16Å; F1061-L1107 HydrophobicContact CE2-CD2 4.24Å; F1061-L1107 HydrophobicContact CZ-CB 3.88Å; F1061-L1107 HydrophobicContact CZ-CD1 4.13Å; F1061-L1107 HydrophobicContact CZ-CD2 3.95Å; F1061-L1107 HydrophobicContact CZ-CG 4.19Å; F1061-F1131 AromaticContact CZ-CZ 3.99Å; F1061-F1131 HydrophobicContact CZ-CZ 3.99Å
1062	R	85.7	Confident	84.6	Confident	104 Å²	104	50.6 Å²	50.6	39%	0.392	25%	0.253	S	S	.	.	H	α-helix	trans	-68.3	-20.8	174.7	-71.5	-176.2	-160.3	-59.7	-14.3	114	D1058 D1059 K1067 F1070 W1071	D1058-R1062 WeakPolarHBondContact O-CB 3.45Å; D1058-R1062 VanDerWaalsContact O-CG 3.29Å; D1058-R1062 WeakPolarHBondContact O-CG 3.02Å; D1058-R1062 PolarHBondContact O-N 2.87Å; D1058-R1062 IonicContact OD1-CZ 2.68Å; D1058-R1062 IonicContact OD1-NE 2.66Å; D1058-R1062 PolarHBondContact OD1-NE 2.87Å; D1058-R1062 IonicContact OD1-NH2 3.14Å; D1058-R1062 PolarHBondContact OD1-NH2 3.09Å; D1058-R1062 IonicContact OD2-CZ 3.34Å; D1058-R1062 IonicContact OD2-NE 3.99Å; D1058-R1062 PolarHBondContact OD2-NE 2.03Å; D1058-R1062 IonicContact OD2-NH2 2.74Å; D1058-R1062 PolarHBondContact OD2-NH2 2.86Å; D1059-R1062 PolarHBondContact O-N 3.42Å; R1062-K1067 WeakPolarHBondContact O-CB 3.04Å; R1062-K1067 WeakPolarHBondContact O-CD 3.23Å; R1062-F1070 HydrophobicContact CG-CD1 3.87Å; R1062-F1070 HydrophobicContact CG-CE1 3.81Å; R1062-W1071 PolarHBondContact NH1-O 3.36Å; R1062-W1071 PolarHBondContact NH2-O 2.04Å
1063	N	83.1	Confident	84.6	Confident	94 Å²	94	49.9 Å²	49.9	50%	0.503	25%	0.246	S	C	.	.	H	α-helix	trans	-90.9	-21.1	172.7	-74.8	-70.9	0	0	0	113.5	D1059 L1060 F1061 K1067	D1059-N1063 PolarHBondContact O-N 3.38Å; D1059-N1063 VanDerWaalsContact O-N 3.12Å; D1059-N1063 PolarHBondContact O-ND2 2.7Å; L1060-N1063 PolarHBondContact O-N 2.04Å; F1061-N1063 VanDerWaalsContact C-N 3.26Å; F1061-N1063 PolarHBondContact O-N 2.91Å; N1063-K1067 PolarHBondContact O-NZ 3.23Å
1064	S	87.9	Confident	84.5	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.007	27%	0.27	C	S	.	.	S	Bend	trans	-63	177.6	179.6	82.9	0	0	0	0	115.7	L1060 F1061 V1066 K1067	L1060-S1064 PolarHBondContact O-N 3.41Å; F1061-S1064 WeakPolarHBondContact O-CB 3.3Å; F1061-S1064 PolarHBondContact O-N 2.95Å; F1061-S1064 PolarHBondContact O-OG 3.07Å; S1064-V1066 VanDerWaalsContact OG-CG2 3.24Å; S1064-V1066 WeakPolarHBondContact OG-CG2 3.04Å; S1064-V1066 PolarHBondContact OG-N 3.12Å; S1064-K1067 WeakPolarHBondContact O-CB 3.41Å; S1064-K1067 WeakPolarHBondContact O-CD 3.16Å; S1064-K1067 WeakPolarHBondContact O-CE 3.44Å; S1064-K1067 WeakPolarHBondContact O-CG 3.4Å; S1064-K1067 PolarHBondContact O-NZ 2.93Å; S1064-K1067 VanDerWaalsContact O-NZ 3.08Å
1065	D	82.3	Confident	84.4	Confident	115 Å²	115	54.4 Å²	54.4	62%	0.615	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-23.5	173.5	-72.3	-33.1	0	0	0	113.5	K1067	D1065-K1067 VanDerWaalsContact C-N 3.26Å; D1065-K1067 PolarHBondContact O-N 2.82Å
1066	V	86.8	Confident	84.3	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.018	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-0.5	178.7	-57.1	0	0	0	0	113.3	F1061 S1064 K1068 D1069 F1070 F1092 F1098 A1106	F1061-V1066 HydrophobicContact CD1-CG2 3.97Å; F1061-V1066 HydrophobicContact CE1-CG2 4.42Å; S1064-V1066 VanDerWaalsContact OG-CG2 3.24Å; S1064-V1066 WeakPolarHBondContact OG-CG2 3.04Å; S1064-V1066 PolarHBondContact OG-N 3.12Å; V1066-K1068 PolarHBondContact O-N 3.37Å; V1066-D1069 PolarHBondContact O-N 2.79Å; V1066-D1069 VanDerWaalsContact O-N 3.14Å; V1066-F1070 PolarHBondContact O-N 3.07Å; V1066-F1092 HydrophobicContact CB-CE1 3.81Å; V1066-F1092 HydrophobicContact CB-CZ 4.35Å; V1066-F1092 HydrophobicContact CG2-CE1 3.68Å; V1066-F1092 HydrophobicContact CG2-CZ 3.8Å; V1066-F1098 HydrophobicContact CB-CD2 3.99Å; V1066-F1098 HydrophobicContact CB-CE2 3.77Å; V1066-F1098 HydrophobicContact CB-CZ 4.14Å; V1066-F1098 HydrophobicContact CG1-CD1 3.99Å; V1066-F1098 HydrophobicContact CG1-CD2 3.92Å; V1066-F1098 HydrophobicContact CG1-CE1 3.89Å; V1066-F1098 HydrophobicContact CG1-CE2 3.84Å; V1066-F1098 HydrophobicContact CG1-CG 4.03Å; V1066-F1098 HydrophobicContact CG1-CZ 3.82Å; V1066-A1106 HydrophobicContact CG1-CB 3.83Å; V1066-A1106 HydrophobicContact CG2-CB 4.02Å
1067	K	83.4	Confident	84.2	Confident	103 Å²	103	61 Å²	61	45%	0.448	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-13.2	-176.7	70.9	-175.2	154.8	-135	0	117.3	F1061 R1062 N1063 S1064 D1065	F1061-K1067 WeakPolarHBondContact O-CB 3.19Å; R1062-K1067 WeakPolarHBondContact O-CB 3.04Å; R1062-K1067 WeakPolarHBondContact O-CD 3.23Å; N1063-K1067 PolarHBondContact O-NZ 3.23Å; S1064-K1067 WeakPolarHBondContact O-CB 3.41Å; S1064-K1067 WeakPolarHBondContact O-CD 3.16Å; S1064-K1067 WeakPolarHBondContact O-CE 3.44Å; S1064-K1067 WeakPolarHBondContact O-CG 3.4Å; S1064-K1067 PolarHBondContact O-NZ 2.93Å; S1064-K1067 VanDerWaalsContact O-NZ 3.08Å; D1065-K1067 VanDerWaalsContact C-N 3.26Å; D1065-K1067 PolarHBondContact O-N 2.82Å
1068	K	80	Confident	84	Confident	184 Å²	184	61 Å²	61	80%	0.8	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-35.8	177.4	-71.4	179.8	179.7	173.3	0	112	V1066	V1066-K1068 PolarHBondContact O-N 3.37Å
1069	D	82.1	Confident	83.7	Confident	39 Å²	39	59.3 Å²	59.3	21%	0.209	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-16.8	-171.1	-60.1	25.7	0	0	0	110.2	V1066 F1092 D1093 T1096 F1098	V1066-D1069 PolarHBondContact O-N 2.79Å; V1066-D1069 VanDerWaalsContact O-N 3.14Å; D1069-F1092 VanDerWaalsContact C-CD1 3.48Å; D1069-F1092 HydrophobicContact CB-CD1 3.96Å; D1069-F1092 CarbonylContact O-C 3.29Å; D1069-F1092 WeakPolarHBondContact O-CA 3.48Å; D1069-D1093 HydrophobicContact CB-CB 4.43Å; D1069-D1093 PolarHBondContact O-N 2.73Å; D1069-T1096 VanDerWaalsContact OD2-CB 3.23Å; D1069-T1096 WeakPolarHBondContact OD2-CB 3.48Å; D1069-T1096 PolarHBondContact OD2-OG1 3.49Å; D1069-F1098 HydrophobicContact CB-CD2 4.27Å; D1069-F1098 HydrophobicContact CB-CE2 4.09Å
1070	F	83.9	Confident	83.1	Confident	8 Å²	8	58.8 Å²	58.8	4%	0.035	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	126.5	177.6	174	-113	0	0	0	112.2	D1058 F1061 R1062 V1066 S1072 I1073 V1090 F1092	D1058-F1070 VanDerWaalsContact OD1-CE1 3.31Å; D1058-F1070 WeakPolarHBondContact OD1-CE1 3.39Å; D1058-F1070 VanDerWaalsContact OD1-CZ 3.31Å; D1058-F1070 WeakPolarHBondContact OD1-CZ 3.41Å; F1061-F1070 HydrophobicContact CB-CD1 3.76Å; F1061-F1070 HydrophobicContact CB-CD2 4Å; F1061-F1070 HydrophobicContact CB-CE1 3.71Å; F1061-F1070 HydrophobicContact CB-CE2 3.96Å; F1061-F1070 HydrophobicContact CB-CG 3.9Å; F1061-F1070 HydrophobicContact CB-CZ 3.81Å; F1061-F1070 HydrophobicContact CD2-CE2 4.32Å; F1061-F1070 HydrophobicContact CG-CD2 4.35Å; F1061-F1070 HydrophobicContact CG-CE2 4.26Å; F1061-F1070 HydrophobicContact CG-CZ 4.48Å; R1062-F1070 HydrophobicContact CG-CD1 3.87Å; R1062-F1070 HydrophobicContact CG-CE1 3.81Å; V1066-F1070 PolarHBondContact O-N 3.07Å; F1070-S1072 WeakPolarHBondContact CE2-O 3.41Å; F1070-I1073 HydrophobicContact CE2-CB 4.36Å; F1070-I1073 HydrophobicContact CZ-CB 4.32Å; F1070-V1090 HydrophobicContact CD2-CG1 3.77Å; F1070-V1090 HydrophobicContact CE2-CG1 3.55Å; F1070-F1092 VanDerWaalsContact CA-CD1 3.46Å; F1070-F1092 HydrophobicContact CB-CD1 4.03Å; F1070-F1092 HydrophobicContact CB-CE1 3.64Å; F1070-F1092 HydrophobicContact CB-CZ 4.24Å; F1070-F1092 HydrophobicContact CD2-CE1 4.27Å; F1070-F1092 HydrophobicContact CD2-CE2 4.35Å; F1070-F1092 HydrophobicContact CD2-CZ 4.06Å; F1070-F1092 HydrophobicContact CG-CE1 4.44Å
1071	W	78.6	Confident	82	Confident	74 Å²	74	60.6 Å²	60.6	28%	0.28	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-58.5	179.1	-68.5	7.2	0	0	0	111.4	P1013 T1015 R1062 H1091 D1093	P1013-W1071 HydrophobicContact CG-CZ3 4.24Å; T1015-W1071 HydrophobicContact CG2-CE3 3.57Å; T1015-W1071 HydrophobicContact CG2-CZ3 3.61Å; R1062-W1071 PolarHBondContact NH1-O 3.36Å; R1062-W1071 PolarHBondContact NH2-O 2.04Å; W1071-H1091 PolarHBondContact N-O 3.11Å; W1071-D1093 HydrophobicContact CZ2-CB 3.86Å; W1071-D1093 WeakPolarHBondContact CZ2-OD2 3.03Å
1072	S	81.8	Confident	80.8	Confident	30 Å²	30	69.6 Å²	69.6	21%	0.21	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	158.9	-174.9	60.3	0	0	0	0	112.6	F1070 H1091	F1070-S1072 WeakPolarHBondContact CE2-O 3.41Å; S1072-H1091 PolarHBondContact N-O 3.15Å; S1072-H1091 WeakPolarHBondContact O-CB 3Å; S1072-H1091 PolarHBondContact O-N 3.32Å
1073	I	84.9	Confident	80.2	Confident	17 Å²	17	66.2 Å²	66.2	9%	0.087	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	151.2	168.2	-171.3	170.9	0	0	0	110.8	E1054 L1057 D1058 F1061 F1070 V1088 D1089 V1090	E1054-I1073 HydrophobicContact CB-CG2 4.47Å; E1054-I1073 WeakPolarHBondContact O-CG2 3.42Å; L1057-I1073 HydrophobicContact CB-CD1 3.47Å; L1057-I1073 VanDerWaalsContact CB-CD1 3.47Å; L1057-I1073 HydrophobicContact CB-CG2 4.33Å; L1057-I1073 HydrophobicContact CD1-CD1 3.58Å; L1057-I1073 HydrophobicContact CG-CD1 4.1Å; D1058-I1073 HydrophobicContact CB-CG2 4.01Å; F1061-I1073 HydrophobicContact CD2-CD1 4.4Å; F1061-I1073 HydrophobicContact CE2-CD1 4.14Å; F1070-I1073 HydrophobicContact CE2-CB 4.36Å; F1070-I1073 HydrophobicContact CZ-CB 4.32Å; I1073-V1088 HydrophobicContact CD1-CB 3.95Å; I1073-V1088 HydrophobicContact CD1-CG1 4.17Å; I1073-V1088 HydrophobicContact CD1-CG2 4.18Å; I1073-V1088 HydrophobicContact CG1-CB 4.19Å; I1073-D1089 WeakPolarHBondContact CA-O 3.26Å; I1073-D1089 WeakPolarHBondContact CG1-O 3.48Å; I1073-V1090 HydrophobicContact CD1-CG2 3.78Å; I1073-V1090 HydrophobicContact CG1-CG2 3.94Å
1074	R	83.6	Confident	80.2	Confident	134 Å²	134	61.8 Å²	61.8	51%	0.506	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	141.9	170	-175.9	174.4	-67.9	-172.2	-0.2	110.7	E1054 V1088 D1089	E1054-R1074 VanDerWaalsContact OE1-CA 3.3Å; E1054-R1074 WeakPolarHBondContact OE1-CA 3.5Å; R1074-V1088 CarbonylContact O-C 3.59Å; R1074-V1088 WeakPolarHBondContact O-CA 3.44Å; R1074-D1089 PolarHBondContact N-O 3.19Å; R1074-D1089 PolarHBondContact O-N 3.37Å
1075	L	86.3	Confident	80.2	Confident	9 Å²	9	65.6 Å²	65.6	5%	0.047	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	127.4	169.5	-175	71	0	0	0	109.9	F1046 A1050 I1053 E1054 L1078 A1086 I1087 V1088	F1046-L1075 HydrophobicContact CE2-CD2 4.25Å; F1046-L1075 HydrophobicContact CZ-CD2 4.36Å; F1046-L1075 HydrophobicContact CZ-CG 4.49Å; A1050-L1075 HydrophobicContact CB-CB 4.39Å; A1050-L1075 HydrophobicContact CB-CD2 3.68Å; I1053-L1075 HydrophobicContact CD1-CD2 4.15Å; I1053-L1075 HydrophobicContact CG2-CD1 4.31Å; E1054-L1075 HydrophobicContact CG-CB 4.05Å; E1054-L1075 PolarHBondContact OE1-N 2.89Å; L1075-L1078 HydrophobicContact CD1-CD2 4.18Å; L1075-L1078 HydrophobicContact CD2-CD1 4.09Å; L1075-L1078 HydrophobicContact CD2-CD2 3.8Å; L1075-L1078 HydrophobicContact CD2-CG 3.81Å; L1075-A1086 HydrophobicContact CD1-CB 3.75Å; L1075-I1087 WeakPolarHBondContact CD1-O 3.04Å; L1075-V1088 HydrophobicContact CB-CG1 4.47Å; L1075-V1088 HydrophobicContact CD1-CG1 3.55Å
1076	R	80.9	Confident	80.4	Confident	126 Å²	126	60.1 Å²	60.1	48%	0.475	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	-47	174	-76.5	-164.4	-179.2	-120.9	-2.9	112.7	I1087 D1089	R1076-I1087 HydrophobicContact CB-CG2 4.45Å; R1076-I1087 PolarHBondContact N-O 2.82Å; R1076-D1089 WeakPolarHBondContact CD-OD1 3.01Å; R1076-D1089 IonicContact CZ-OD1 3.1Å; R1076-D1089 IonicContact CZ-OD2 2.74Å; R1076-D1089 IonicContact NE-OD1 3.46Å; R1076-D1089 PolarHBondContact NE-OD1 2.79Å; R1076-D1089 IonicContact NE-OD2 3.92Å; R1076-D1089 PolarHBondContact NE-OD2 2.81Å; R1076-D1089 IonicContact NH2-OD2 2.75Å; R1076-D1089 PolarHBondContact NH2-OD2 3.06Å
1077	E	83.8	Confident	80.4	Confident	91 Å²	91	60.7 Å²	60.7	43%	0.425	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	143.4	-163.3	-165.6	-171.6	142.2	0	0	110.9	I1087	E1077-I1087 HydrophobicContact CB-CB 4.22Å; E1077-I1087 HydrophobicContact CB-CD1 4.18Å; E1077-I1087 HydrophobicContact CB-CG1 4.31Å; E1077-I1087 PolarHBondContact N-O 3.4Å; E1077-I1087 PolarHBondContact O-N 3.1Å; E1077-I1087 WeakPolarHBondContact OE2-CD1 3.48Å
1078	L	83.9	Confident	80.6	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	104.6	165.7	-67.2	174	0	0	0	107.8	Y1034 M1038 F1046 T1049 I1053 L1075 V1084 A1086	Y1034-L1078 WeakPolarHBondContact CE2-O 3.18Å; M1038-L1078 HydrophobicContact CB-CB 4.32Å; M1038-L1078 HydrophobicContact CB-CD1 4.34Å; M1038-L1078 HydrophobicContact CE-CD1 3.82Å; F1046-L1078 HydrophobicContact CD2-CB 4.41Å; F1046-L1078 HydrophobicContact CD2-CD1 3.89Å; F1046-L1078 HydrophobicContact CD2-CG 4.11Å; F1046-L1078 HydrophobicContact CE2-CB 4.45Å; F1046-L1078 HydrophobicContact CE2-CD1 4.23Å; F1046-L1078 HydrophobicContact CE2-CG 4.02Å; T1049-L1078 HydrophobicContact CG2-CD1 3.83Å; I1053-L1078 HydrophobicContact CD1-CD2 3.77Å; L1075-L1078 HydrophobicContact CD1-CD2 4.18Å; L1075-L1078 HydrophobicContact CD2-CD1 4.09Å; L1075-L1078 HydrophobicContact CD2-CD2 3.8Å; L1075-L1078 HydrophobicContact CD2-CG 3.81Å; L1078-V1084 HydrophobicContact CD2-CG1 3.81Å; L1078-A1086 HydrophobicContact CD2-CB 3.85Å
1079	G	79.5	Confident	80.9	Confident	2 Å²	2	47.5 Å²	47.5	2%	0.021	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	160.6	-177.9	0	0	0	0	0	113.5	Y1034 R1085	Y1034-G1079 VanDerWaalsContact CE2-C 3.47Å; G1079-R1085 PolarHBondContact N-O 2.66Å; G1079-R1085 PolarHBondContact O-N 3.33Å
1080	P	71.8	Confident	81.1	Confident	86 Å²	86	45.7 Å²	45.7	56%	0.558	22%	0.22	S	C	*	.			trans	-70	151.7	174.1	29.5	-33.8	0	0	0	111.6	Y1034	Y1034-P1080 HydrophobicContact CD1-CB 4.03Å; Y1034-P1080 HydrophobicContact CD2-CB 4.38Å; Y1034-P1080 HydrophobicContact CE1-CB 3.81Å; Y1034-P1080 HydrophobicContact CE1-CG 4.48Å; Y1034-P1080 HydrophobicContact CE2-CB 4.18Å; Y1034-P1080 HydrophobicContact CG-CB 4.3Å
1081	G	63.2	Low	81.1	Confident	50 Å²	50	47 Å²	47	52%	0.515	23%	0.226	S	C	.	.	S	Bend	trans	-170.4	-168.9	176.1	0	0	0	0	0	110.7	L1083	G1081-L1083 CarbonylContact C-O 3.53Å; G1081-L1083 WeakPolarHBondContact CA-O 3.09Å; G1081-L1083 PolarHBondContact N-O 3.21Å; G1081-L1083 PolarHBondContact O-N 2.05Å
1082	K	62.8	Low	81.3	Confident	189 Å²	189	43.4 Å²	43.4	82%	0.822	21%	0.212	S	C	*	.	S	Bend	trans	-68.9	-11.2	167.2	-70.5	178.8	-179.2	171.1	0	112.5
1083	L	73.6	Confident	81.2	Confident	34 Å²	34	44.1 Å²	44.1	18%	0.178	21%	0.214	C	C	.	.	S	Bend	trans	-149	171.6	175.8	-70.2	177.8	0	0	0	107.2	E1023 E1025 G1081 R1085 R1122	E1023-L1083 HydrophobicContact CB-CB 4.4Å; E1025-L1083 HydrophobicContact CG-CD1 3.41Å; E1025-L1083 VanDerWaalsContact CG-CD1 3.41Å; E1025-L1083 HydrophobicContact CG-CD2 3.86Å; E1025-L1083 HydrophobicContact CG-CG 4.28Å; G1081-L1083 CarbonylContact C-O 3.53Å; G1081-L1083 WeakPolarHBondContact CA-O 3.09Å; G1081-L1083 PolarHBondContact N-O 3.21Å; G1081-L1083 PolarHBondContact O-N 2.05Å; L1083-R1085 PolarHBondContact O-N 2.83Å; L1083-R1122 HydrophobicContact CD1-CB 3.65Å; L1083-R1122 HydrophobicContact CD1-CG 4.23Å
1084	V	84	Confident	80.6	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	118.5	177.7	173.8	0	0	0	0	109.8	L1024 L1032 M1038 L1078	L1024-V1084 PolarHBondContact N-O 3.41Å; L1024-V1084 PolarHBondContact O-N 2.04Å; L1032-V1084 HydrophobicContact CB-CB 4.22Å; L1032-V1084 HydrophobicContact CB-CG2 3.89Å; M1038-V1084 HydrophobicContact CE-CG1 4.27Å; M1038-V1084 HydrophobicContact CE-CG2 4.38Å; L1078-V1084 HydrophobicContact CD2-CG1 3.81Å
1085	R	86.4	Confident	80.2	Confident	82 Å²	82	45.9 Å²	45.9	31%	0.309	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	103.3	-179.1	179.7	176.3	167.4	-90	-7.5	110.1	V1021 L1022 G1079 L1083	V1021-R1085 HydrophobicContact CG1-CG 4.08Å; L1022-R1085 CarbonylContact O-C 3.57Å; L1022-R1085 WeakPolarHBondContact O-CA 3.16Å; G1079-R1085 PolarHBondContact N-O 2.66Å; G1079-R1085 PolarHBondContact O-N 3.33Å; L1083-R1085 PolarHBondContact O-N 2.83Å
1086	A	86.9	Confident	80	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	131.6	176.7	0	0	0	0	0	111.6	L1022 L1024 L1075 L1078	L1022-A1086 HydrophobicContact CB-CB 4.31Å; L1022-A1086 PolarHBondContact N-O 2.88Å; L1022-A1086 PolarHBondContact O-N 2.66Å; L1024-A1086 HydrophobicContact CD1-CB 3.94Å; L1024-A1086 HydrophobicContact CG-CB 4.38Å; L1075-A1086 HydrophobicContact CD1-CB 3.75Å; L1078-A1086 HydrophobicContact CD2-CB 3.85Å
1087	I	86.6	Confident	79.9	Confident	14 Å²	14	44.3 Å²	44.3	7%	0.072	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118	169	-52.4	-177.4	0	0	0	108.6	Q1019 G1020 L1075 R1076 E1077	Q1019-I1087 HydrophobicContact CG-CG2 3.81Å; G1020-I1087 WeakPolarHBondContact O-CA 3.32Å; L1075-I1087 WeakPolarHBondContact CD1-O 3.04Å; R1076-I1087 HydrophobicContact CB-CG2 4.45Å; R1076-I1087 PolarHBondContact N-O 2.82Å; E1077-I1087 HydrophobicContact CB-CB 4.22Å; E1077-I1087 HydrophobicContact CB-CD1 4.18Å; E1077-I1087 HydrophobicContact CB-CG1 4.31Å; E1077-I1087 PolarHBondContact N-O 3.4Å; E1077-I1087 PolarHBondContact O-N 3.1Å; E1077-I1087 WeakPolarHBondContact OE2-CD1 3.48Å
1088	V	89.1	Confident	79.9	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.006	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	143.7	-176.9	-67.7	0	0	0	0	111.7	Q1019 G1020 L1022 L1057 I1073 R1074 L1075 V1090 F1131	Q1019-V1088 CarbonylContact C-O 3.51Å; Q1019-V1088 WeakPolarHBondContact CA-O 3.38Å; G1020-V1088 PolarHBondContact N-O 2.97Å; G1020-V1088 PolarHBondContact O-N 2.8Å; L1022-V1088 HydrophobicContact CD1-CG1 4.36Å; L1022-V1088 HydrophobicContact CD1-CG2 3.97Å; L1057-V1088 HydrophobicContact CD1-CG1 3.94Å; I1073-V1088 HydrophobicContact CD1-CB 3.95Å; I1073-V1088 HydrophobicContact CD1-CG1 4.17Å; I1073-V1088 HydrophobicContact CD1-CG2 4.18Å; I1073-V1088 HydrophobicContact CG1-CB 4.19Å; R1074-V1088 CarbonylContact O-C 3.59Å; R1074-V1088 WeakPolarHBondContact O-CA 3.44Å; L1075-V1088 HydrophobicContact CB-CG1 4.47Å; L1075-V1088 HydrophobicContact CD1-CG1 3.55Å; V1088-V1090 HydrophobicContact CG2-CG2 4.35Å; V1088-F1131 HydrophobicContact CG2-CZ 4.49Å
1089	D	86.3	Confident	79.9	Confident	10 Å²	10	48 Å²	48	5%	0.053	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	122.1	167.7	-77.2	20.1	0	0	0	108.7	Q1019 I1073 R1074 R1076	Q1019-D1089 PolarHBondContact NE2-OD1 2.97Å; I1073-D1089 WeakPolarHBondContact CA-O 3.26Å; I1073-D1089 WeakPolarHBondContact CG1-O 3.48Å; R1074-D1089 PolarHBondContact N-O 3.19Å; R1074-D1089 PolarHBondContact O-N 3.37Å; R1076-D1089 WeakPolarHBondContact CD-OD1 3.01Å; R1076-D1089 IonicContact CZ-OD1 3.1Å; R1076-D1089 IonicContact CZ-OD2 2.74Å; R1076-D1089 IonicContact NE-OD1 3.46Å; R1076-D1089 PolarHBondContact NE-OD1 2.79Å; R1076-D1089 IonicContact NE-OD2 3.92Å; R1076-D1089 PolarHBondContact NE-OD2 2.81Å; R1076-D1089 IonicContact NH2-OD2 2.75Å; R1076-D1089 PolarHBondContact NH2-OD2 3.06Å
1090	V	86.1	Confident	80	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	116	-179.9	-166.8	0	0	0	0	108.6	A1017 F1018 F1061 F1070 I1073 V1088 F1092 F1131	A1017-V1090 WeakPolarHBondContact CA-O 3.3Å; F1018-V1090 PolarHBondContact N-O 2.86Å; F1018-V1090 PolarHBondContact O-N 3.29Å; F1061-V1090 HydrophobicContact CD2-CG1 4Å; F1061-V1090 HydrophobicContact CE1-CG1 4.45Å; F1061-V1090 HydrophobicContact CE2-CB 4.49Å; F1061-V1090 HydrophobicContact CE2-CG1 3.82Å; F1061-V1090 HydrophobicContact CE2-CG2 3.76Å; F1061-V1090 HydrophobicContact CG-CG1 4.4Å; F1061-V1090 HydrophobicContact CZ-CG1 4.05Å; F1061-V1090 HydrophobicContact CZ-CG2 4.05Å; F1070-V1090 HydrophobicContact CD2-CG1 3.77Å; F1070-V1090 HydrophobicContact CE2-CG1 3.55Å; I1073-V1090 HydrophobicContact CD1-CG2 3.78Å; I1073-V1090 HydrophobicContact CG1-CG2 3.94Å; V1088-V1090 HydrophobicContact CG2-CG2 4.35Å; V1090-F1092 HydrophobicContact CB-CE2 3.99Å; V1090-F1092 HydrophobicContact CG1-CD2 4.2Å; V1090-F1092 HydrophobicContact CG1-CE2 3.36Å; V1090-F1092 HydrophobicContact CG1-CZ 3.92Å; V1090-F1131 HydrophobicContact CB-CE1 4.45Å; V1090-F1131 HydrophobicContact CG2-CE1 3.58Å; V1090-F1131 HydrophobicContact CG2-CZ 4.11Å
1091	H	83.6	Confident	80.5	Confident	35 Å²	35	48 Å²	48	16%	0.162	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	133.9	-173.7	-63.9	-95.1	0	0	0	112.1	T1015 W1071 S1072	T1015-H1091 HydrophobicContact CG2-CB 4.41Å; T1015-H1091 PolarHBondContact OG1-ND1 3.15Å; W1071-H1091 PolarHBondContact N-O 3.11Å; S1072-H1091 PolarHBondContact N-O 3.15Å; S1072-H1091 WeakPolarHBondContact O-CB 3Å; S1072-H1091 PolarHBondContact O-N 3.32Å
1092	F	82.4	Confident	81.5	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	165.5	179	-68.5	-102.4	0	0	0	111.2	T1015 K1016 F1018 V1066 D1069 F1070 V1090 T1096 V1103	T1015-F1092 WeakPolarHBondContact CB-O 3.34Å; K1016-F1092 PolarHBondContact N-O 3.16Å; K1016-F1092 PolarHBondContact O-N 2.71Å; F1018-F1092 AromaticContact CD2-CD2 3.4Å; F1018-F1092 HydrophobicContact CD2-CD2 3.4Å; F1018-F1092 VanDerWaalsContact CD2-CD2 3.4Å; F1018-F1092 AromaticContact CD2-CE2 3.6Å; F1018-F1092 HydrophobicContact CD2-CE2 3.6Å; F1018-F1092 HydrophobicContact CD2-CG 4.34Å; F1018-F1092 HydrophobicContact CE2-CB 4.22Å; F1018-F1092 AromaticContact CE2-CD2 3.4Å; F1018-F1092 HydrophobicContact CE2-CD2 3.4Å; F1018-F1092 VanDerWaalsContact CE2-CD2 3.4Å; F1018-F1092 AromaticContact CE2-CE2 3.88Å; F1018-F1092 HydrophobicContact CE2-CE2 3.88Å; F1018-F1092 AromaticContact CE2-CG 3.9Å; F1018-F1092 HydrophobicContact CE2-CG 3.9Å; V1066-F1092 HydrophobicContact CB-CE1 3.81Å; V1066-F1092 HydrophobicContact CB-CZ 4.35Å; V1066-F1092 HydrophobicContact CG2-CE1 3.68Å; V1066-F1092 HydrophobicContact CG2-CZ 3.8Å; D1069-F1092 VanDerWaalsContact C-CD1 3.48Å; D1069-F1092 HydrophobicContact CB-CD1 3.96Å; D1069-F1092 CarbonylContact O-C 3.29Å; D1069-F1092 WeakPolarHBondContact O-CA 3.48Å; F1070-F1092 VanDerWaalsContact CA-CD1 3.46Å; F1070-F1092 HydrophobicContact CB-CD1 4.03Å; F1070-F1092 HydrophobicContact CB-CE1 3.64Å; F1070-F1092 HydrophobicContact CB-CZ 4.24Å; F1070-F1092 HydrophobicContact CD2-CE1 4.27Å; F1070-F1092 HydrophobicContact CD2-CE2 4.35Å; F1070-F1092 HydrophobicContact CD2-CZ 4.06Å; F1070-F1092 HydrophobicContact CG-CE1 4.44Å; V1090-F1092 HydrophobicContact CB-CE2 3.99Å; V1090-F1092 HydrophobicContact CG1-CD2 4.2Å; V1090-F1092 HydrophobicContact CG1-CE2 3.36Å; V1090-F1092 HydrophobicContact CG1-CZ 3.92Å; F1092-T1096 HydrophobicContact CB-CG2 3.85Å; F1092-V1103 HydrophobicContact CE2-CG1 3.97Å; F1092-V1103 HydrophobicContact CE2-CG2 3.88Å; F1092-V1103 HydrophobicContact CZ-CG1 3.99Å; F1092-V1103 HydrophobicContact CZ-CG2 3.83Å
1093	D	79.4	Confident	82.5	Confident	45 Å²	45	40 Å²	40	24%	0.241	23%	0.226	C	C	.	.			trans	-48.6	130.4	169.1	-167.5	-64.4	0	0	0	111	D1069 W1071 T1095 T1096	D1069-D1093 HydrophobicContact CB-CB 4.43Å; D1069-D1093 PolarHBondContact O-N 2.73Å; W1071-D1093 HydrophobicContact CZ2-CB 3.86Å; W1071-D1093 WeakPolarHBondContact CZ2-OD2 3.03Å; D1093-T1095 PolarHBondContact O-N 3.03Å; D1093-T1095 WeakPolarHBondContact OD1-CA 3.36Å; D1093-T1095 WeakPolarHBondContact OD1-CB 3.35Å; D1093-T1095 PolarHBondContact OD1-N 2.84Å; D1093-T1095 PolarHBondContact OD1-OG1 3.27Å; D1093-T1096 VanDerWaalsContact O-CB 3.31Å; D1093-T1096 WeakPolarHBondContact O-CB 3.25Å; D1093-T1096 VanDerWaalsContact O-CG2 3.23Å; D1093-T1096 WeakPolarHBondContact O-CG2 3.49Å; D1093-T1096 PolarHBondContact O-N 3.14Å
1094	P	72.8	Confident	83.1	Confident	67 Å²	67	38.7 Å²	38.7	44%	0.435	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-14.2	-179	27.9	-37.1	0	0	0	113.8	A1014	A1014-P1094 WeakPolarHBondContact O-CD 3.44Å; A1014-P1094 WeakPolarHBondContact O-CG 3.39Å
1095	T	75.3	Confident	83.1	Confident	120 Å²	120	43.6 Å²	43.6	74%	0.736	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.9	1.2	174.8	68.8	0	0	0	0	114.1	D1093	D1093-T1095 PolarHBondContact O-N 3.03Å; D1093-T1095 WeakPolarHBondContact OD1-CA 3.36Å; D1093-T1095 WeakPolarHBondContact OD1-CB 3.35Å; D1093-T1095 PolarHBondContact OD1-N 2.84Å; D1093-T1095 PolarHBondContact OD1-OG1 3.27Å
1096	T	81.3	Confident	83	Confident	9 Å²	9	40 Å²	40	6%	0.055	23%	0.233	C	C	.	.			trans	-63.7	137.1	-175	-167.9	0	0	0	0	113.8	K1016 F1018 D1069 F1092 D1093 F1098	K1016-T1096 HydrophobicContact CB-CG2 4.2Å; K1016-T1096 HydrophobicContact CD-CG2 3.57Å; K1016-T1096 HydrophobicContact CG-CG2 4.47Å; F1018-T1096 HydrophobicContact CE2-CG2 4.44Å; F1018-T1096 HydrophobicContact CZ-CG2 4.34Å; D1069-T1096 VanDerWaalsContact OD2-CB 3.23Å; D1069-T1096 WeakPolarHBondContact OD2-CB 3.48Å; D1069-T1096 PolarHBondContact OD2-OG1 3.49Å; F1092-T1096 HydrophobicContact CB-CG2 3.85Å; D1093-T1096 VanDerWaalsContact O-CB 3.31Å; D1093-T1096 WeakPolarHBondContact O-CB 3.25Å; D1093-T1096 VanDerWaalsContact O-CG2 3.23Å; D1093-T1096 WeakPolarHBondContact O-CG2 3.49Å; D1093-T1096 PolarHBondContact O-N 3.14Å; T1096-F1098 WeakPolarHBondContact OG1-CD2 3Å; T1096-F1098 PolarHBondContact OG1-N 3.43Å
1097	A	79.8	Confident	83.1	Confident	94 Å²	94	40.1 Å²	40.1	78%	0.777	23%	0.233	S	C	*	.			trans	-82.3	-11.3	177.2	0	0	0	0	0	113.9
1098	F	83.3	Confident	83	Confident	56 Å²	56	40.3 Å²	40.3	25%	0.246	23%	0.234	C	C	.	.			trans	-67.2	151	-179.2	-61	-55.9	0	0	0	112.4	K1016 F1018 V1066 D1069 T1096 D1102 V1103	K1016-F1098 PolarHBondContact NZ-O 2.91Å; F1018-F1098 WeakPolarHBondContact CZ-O 3.4Å; V1066-F1098 HydrophobicContact CB-CD2 3.99Å; V1066-F1098 HydrophobicContact CB-CE2 3.77Å; V1066-F1098 HydrophobicContact CB-CZ 4.14Å; V1066-F1098 HydrophobicContact CG1-CD1 3.99Å; V1066-F1098 HydrophobicContact CG1-CD2 3.92Å; V1066-F1098 HydrophobicContact CG1-CE1 3.89Å; V1066-F1098 HydrophobicContact CG1-CE2 3.84Å; V1066-F1098 HydrophobicContact CG1-CG 4.03Å; V1066-F1098 HydrophobicContact CG1-CZ 3.82Å; D1069-F1098 HydrophobicContact CB-CD2 4.27Å; D1069-F1098 HydrophobicContact CB-CE2 4.09Å; T1096-F1098 WeakPolarHBondContact OG1-CD2 3Å; T1096-F1098 PolarHBondContact OG1-N 3.43Å; F1098-D1102 HydrophobicContact CB-CB 4.25Å; F1098-D1102 HydrophobicContact CD1-CB 3.98Å; F1098-D1102 HydrophobicContact CG-CB 4.5Å; F1098-V1103 HydrophobicContact CB-CG2 4.41Å
1099	Q	83.6	Confident	82.7	Confident	114 Å²	114	44.1 Å²	44.1	53%	0.533	25%	0.252	S	S	.	.			trans	-116.9	166.2	168.6	-61.6	-172.1	-13.7	0	0	110.6	P1101 D1102 V1103	Q1099-P1101 VanDerWaalsContact C-CD 3.43Å; Q1099-P1101 VanDerWaalsContact C-N 3.34Å; Q1099-P1101 HydrophobicContact CB-CG 4.21Å; Q1099-P1101 VanDerWaalsContact O-N 3.16Å; Q1099-D1102 PolarHBondContact N-OD2 3.37Å; Q1099-D1102 WeakPolarHBondContact O-CB 3.41Å; Q1099-D1102 PolarHBondContact O-N 2.04Å; Q1099-V1103 PolarHBondContact O-N 3.15Å
1100	A	82.1	Confident	82.7	Confident	2 Å²	2	45.5 Å²	45.5	2%	0.017	26%	0.258	C	S	.	.	H	α-helix	trans	-42.3	-45	175.8	0	0	0	0	0	116.2	F1018 D1102 V1103 G1104 F1131 D1133	F1018-A1100 HydrophobicContact CD1-CB 4.18Å; A1100-D1102 VanDerWaalsContact C-N 3.33Å; A1100-D1102 PolarHBondContact O-N 3.35Å; A1100-V1103 PolarHBondContact O-N 3.41Å; A1100-G1104 PolarHBondContact O-N 2.91Å; A1100-F1131 HydrophobicContact CB-CB 4.02Å; A1100-F1131 WeakPolarHBondContact O-CB 3.41Å; A1100-D1133 WeakPolarHBondContact CB-OD1 3.41Å; A1100-D1133 PolarHBondContact N-OD1 2.99Å
1101	P	81.3	Confident	82.5	Confident	86 Å²	86	46.2 Å²	46.2	56%	0.558	26%	0.262	S	S	*	.	H	α-helix	trans	-63.3	-32.6	176	23.5	-35.3	0	0	0	114.1	Q1099 Q1105	Q1099-P1101 VanDerWaalsContact C-CD 3.43Å; Q1099-P1101 VanDerWaalsContact C-N 3.34Å; Q1099-P1101 HydrophobicContact CB-CG 4.21Å; Q1099-P1101 VanDerWaalsContact O-N 3.16Å; P1101-Q1105 VanDerWaalsContact O-CB 3.25Å; P1101-Q1105 WeakPolarHBondContact O-CB 3.44Å; P1101-Q1105 PolarHBondContact O-N 3.31Å
1102	D	84.6	Confident	82.2	Confident	70 Å²	70	50.9 Å²	50.9	37%	0.374	28%	0.283	S	S	.	.	H	α-helix	trans	-68.8	-45.6	177.6	-55.8	-52.6	0	0	0	110.5	F1098 Q1099 A1100 Q1105 A1106	F1098-D1102 HydrophobicContact CB-CB 4.25Å; F1098-D1102 HydrophobicContact CD1-CB 3.98Å; F1098-D1102 HydrophobicContact CG-CB 4.5Å; Q1099-D1102 PolarHBondContact N-OD2 3.37Å; Q1099-D1102 WeakPolarHBondContact O-CB 3.41Å; Q1099-D1102 PolarHBondContact O-N 2.04Å; A1100-D1102 VanDerWaalsContact C-N 3.33Å; A1100-D1102 PolarHBondContact O-N 3.35Å; D1102-Q1105 PolarHBondContact O-N 2.97Å; D1102-A1106 VanDerWaalsContact O-CB 3.31Å; D1102-A1106 WeakPolarHBondContact O-CB 3.12Å; D1102-A1106 PolarHBondContact O-N 3.26Å
1103	V	85.4	Confident	82	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61.8	-46.9	177.8	178.2	0	0	0	0	110.5	F1018 F1061 F1092 F1098 Q1099 A1100 A1106 L1107 F1131	F1018-V1103 HydrophobicContact CD2-CG2 3.79Å; F1018-V1103 HydrophobicContact CE2-CG2 3.9Å; F1018-V1103 HydrophobicContact CG-CG2 4.1Å; F1018-V1103 HydrophobicContact CZ-CG2 4.32Å; F1061-V1103 HydrophobicContact CE1-CG1 3.67Å; F1061-V1103 HydrophobicContact CZ-CG1 3.88Å; F1092-V1103 HydrophobicContact CE2-CG1 3.97Å; F1092-V1103 HydrophobicContact CE2-CG2 3.88Å; F1092-V1103 HydrophobicContact CZ-CG1 3.99Å; F1092-V1103 HydrophobicContact CZ-CG2 3.83Å; F1098-V1103 HydrophobicContact CB-CG2 4.41Å; Q1099-V1103 PolarHBondContact O-N 3.15Å; A1100-V1103 PolarHBondContact O-N 3.41Å; V1103-A1106 PolarHBondContact O-N 3.45Å; V1103-L1107 PolarHBondContact O-N 2.82Å; V1103-F1131 HydrophobicContact CG1-CD1 4.06Å; V1103-F1131 HydrophobicContact CG1-CE1 4.06Å; V1103-F1131 HydrophobicContact CG1-CG 4.48Å; V1103-F1131 HydrophobicContact CG1-CZ 4.47Å
1104	G	84.4	Confident	81.7	Confident	8 Å²	8	55.9 Å²	55.9	8%	0.082	32%	0.317	C	S	.	.	H	α-helix	trans	-63.4	-41.1	175.7	0	0	0	0	0	113.2	A1100 L1107 L1108 F1131	A1100-G1104 PolarHBondContact O-N 2.91Å; G1104-L1107 PolarHBondContact O-N 3.16Å; G1104-L1108 WeakPolarHBondContact O-CB 3.41Å; G1104-L1108 VanDerWaalsContact O-CG 3.26Å; G1104-L1108 WeakPolarHBondContact O-CG 3.01Å; G1104-L1108 PolarHBondContact O-N 2.04Å; G1104-F1131 VanDerWaalsContact CA-CD2 3.46Å
1105	Q	84.5	Confident	81.5	Confident	103 Å²	103	62.4 Å²	62.4	48%	0.481	33%	0.333	S	S	.	.	H	α-helix	trans	-68.2	-39.6	177.2	-173.7	169.2	-87.2	0	0	112.2	P1101 D1102 L1108 Q1109	P1101-Q1105 VanDerWaalsContact O-CB 3.25Å; P1101-Q1105 WeakPolarHBondContact O-CB 3.44Å; P1101-Q1105 PolarHBondContact O-N 3.31Å; D1102-Q1105 PolarHBondContact O-N 2.97Å; Q1105-L1108 PolarHBondContact O-N 3.14Å; Q1105-Q1109 WeakPolarHBondContact O-CG 3.41Å; Q1105-Q1109 PolarHBondContact O-N 3.46Å
1106	A	85.5	Confident	80.6	Confident	7 Å²	7	61.5 Å²	61.5	6%	0.058	33%	0.329	C	S	.	.	H	α-helix	trans	-62.5	-42.4	176.5	0	0	0	0	0	111.6	V1066 D1102 V1103 Q1109 Q1110	V1066-A1106 HydrophobicContact CG1-CB 3.83Å; V1066-A1106 HydrophobicContact CG2-CB 4.02Å; D1102-A1106 VanDerWaalsContact O-CB 3.31Å; D1102-A1106 WeakPolarHBondContact O-CB 3.12Å; D1102-A1106 PolarHBondContact O-N 3.26Å; V1103-A1106 PolarHBondContact O-N 3.45Å; A1106-Q1109 PolarHBondContact O-N 2.76Å; A1106-Q1110 WeakPolarHBondContact O-CG 3.03Å; A1106-Q1110 PolarHBondContact O-N 3.44Å; A1106-Q1110 VanDerWaalsContact O-N 3.11Å
1107	L	87.1	Confident	79.3	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.005	36%	0.361	C	S	.	.	H	α-helix	trans	-65	-45.7	174.1	-174.9	62.2	0	0	0	111.7	L1022 L1057 L1060 F1061 V1103 G1104 Q1109 Q1110 I1111 V1129 F1131	L1022-L1107 HydrophobicContact CD2-CD2 4.12Å; L1057-L1107 HydrophobicContact CD2-CD1 3.85Å; L1057-L1107 HydrophobicContact CD2-CD2 3.94Å; L1060-L1107 HydrophobicContact CB-CD1 3.87Å; L1060-L1107 HydrophobicContact CD1-CD1 4.05Å; F1061-L1107 HydrophobicContact CE1-CB 3.95Å; F1061-L1107 HydrophobicContact CE1-CD1 4.49Å; F1061-L1107 HydrophobicContact CE2-CD1 4.16Å; F1061-L1107 HydrophobicContact CE2-CD2 4.24Å; F1061-L1107 HydrophobicContact CZ-CB 3.88Å; F1061-L1107 HydrophobicContact CZ-CD1 4.13Å; F1061-L1107 HydrophobicContact CZ-CD2 3.95Å; F1061-L1107 HydrophobicContact CZ-CG 4.19Å; V1103-L1107 PolarHBondContact O-N 2.82Å; G1104-L1107 PolarHBondContact O-N 3.16Å; L1107-Q1109 VanDerWaalsContact C-N 3.28Å; L1107-Q1109 PolarHBondContact O-N 3Å; L1107-Q1110 PolarHBondContact O-N 3.27Å; L1107-Q1110 VanDerWaalsContact O-N 3.13Å; L1107-I1111 HydrophobicContact CD1-CD1 4.33Å; L1107-I1111 HydrophobicContact CD1-CG1 4.37Å; L1107-I1111 HydrophobicContact CD2-CD1 4.42Å; L1107-I1111 HydrophobicContact CG-CD1 3.89Å; L1107-I1111 HydrophobicContact CG-CG1 4.37Å; L1107-I1111 WeakPolarHBondContact O-CG1 3.49Å; L1107-I1111 PolarHBondContact O-N 3.3Å; L1107-V1129 HydrophobicContact CD2-CG1 4.27Å; L1107-F1131 HydrophobicContact CD2-CE2 3.86Å; L1107-F1131 HydrophobicContact CD2-CZ 4.05Å
1108	L	85.8	Confident	78.6	Confident	19 Å²	19	67 Å²	67	10%	0.099	34%	0.335	C	S	.	.	H	α-helix	trans	-58.9	-36.7	178.2	-79.8	169.8	0	0	0	113.1	G1104 Q1105 Q1112 L1125 R1126 V1129	G1104-L1108 WeakPolarHBondContact O-CB 3.41Å; G1104-L1108 VanDerWaalsContact O-CG 3.26Å; G1104-L1108 WeakPolarHBondContact O-CG 3.01Å; G1104-L1108 PolarHBondContact O-N 2.04Å; Q1105-L1108 PolarHBondContact O-N 3.14Å; L1108-Q1112 VanDerWaalsContact O-CG 3.27Å; L1108-Q1112 WeakPolarHBondContact O-CG 3.49Å; L1108-Q1112 PolarHBondContact O-N 3.46Å; L1108-Q1112 PolarHBondContact O-NE2 3.06Å; L1108-L1125 HydrophobicContact CD2-CB 3.5Å; L1108-R1126 HydrophobicContact CD1-CG 4.08Å; L1108-V1129 HydrophobicContact CD2-CB 3.91Å; L1108-V1129 HydrophobicContact CD2-CG1 4.33Å; L1108-V1129 HydrophobicContact CD2-CG2 3.9Å; L1108-V1129 HydrophobicContact CG-CB 4.28Å; L1108-V1129 HydrophobicContact CG-CG1 4.22Å
1109	Q	83.4	Confident	78.3	Confident	80 Å²	80	64.6 Å²	64.6	37%	0.374	33%	0.325	S	S	.	.	H	α-helix	trans	-69.7	-43	174.4	-73.4	174.8	-4.5	0	0	111.7	Q1105 A1106 L1107 Q1112 V1113	Q1105-Q1109 WeakPolarHBondContact O-CG 3.41Å; Q1105-Q1109 PolarHBondContact O-N 3.46Å; A1106-Q1109 PolarHBondContact O-N 2.76Å; L1107-Q1109 VanDerWaalsContact C-N 3.28Å; L1107-Q1109 PolarHBondContact O-N 3Å; Q1109-Q1112 PolarHBondContact O-N 2.04Å; Q1109-V1113 WeakPolarHBondContact O-CG2 3.35Å; Q1109-V1113 PolarHBondContact O-N 2.64Å; Q1109-V1113 VanDerWaalsContact O-N 3.15Å
1110	Q	85	Confident	77.9	Confident	39 Å²	39	60.4 Å²	60.4	18%	0.182	31%	0.31	C	S	.	.	H	α-helix	trans	-66.8	-40	177.5	-70	-61	-44.9	0	0	112.5	L1060 A1106 L1107 Q1112 V1113 S1114	L1060-Q1110 HydrophobicContact CB-CB 4.44Å; L1060-Q1110 HydrophobicContact CD2-CB 3.9Å; A1106-Q1110 WeakPolarHBondContact O-CG 3.03Å; A1106-Q1110 PolarHBondContact O-N 3.44Å; A1106-Q1110 VanDerWaalsContact O-N 3.11Å; L1107-Q1110 PolarHBondContact O-N 3.27Å; L1107-Q1110 VanDerWaalsContact O-N 3.13Å; Q1110-Q1112 VanDerWaalsContact C-N 3.26Å; Q1110-Q1112 PolarHBondContact O-N 2.87Å; Q1110-V1113 PolarHBondContact O-N 2.83Å; Q1110-V1113 VanDerWaalsContact O-N 3.11Å; Q1110-S1114 VanDerWaalsContact O-CB 3.23Å; Q1110-S1114 WeakPolarHBondContact O-CB 3.43Å; Q1110-S1114 PolarHBondContact O-N 2.96Å
1111	I	82	Confident	77.5	Confident	16 Å²	16	60.8 Å²	60.8	8%	0.082	31%	0.311	C	S	.	.	H	α-helix	trans	-56	-42.6	172.9	-68.7	167.7	0	0	0	110.7	L1060 L1107 V1113 S1114 L1119 V1121 L1125 V1129	L1060-I1111 HydrophobicContact CD1-CG1 4.25Å; L1107-I1111 HydrophobicContact CD1-CD1 4.33Å; L1107-I1111 HydrophobicContact CD1-CG1 4.37Å; L1107-I1111 HydrophobicContact CD2-CD1 4.42Å; L1107-I1111 HydrophobicContact CG-CD1 3.89Å; L1107-I1111 HydrophobicContact CG-CG1 4.37Å; L1107-I1111 WeakPolarHBondContact O-CG1 3.49Å; L1107-I1111 PolarHBondContact O-N 3.3Å; I1111-V1113 VanDerWaalsContact C-N 3.34Å; I1111-V1113 PolarHBondContact O-N 3.06Å; I1111-S1114 PolarHBondContact O-N 2.92Å; I1111-S1114 PolarHBondContact O-OG 2.83Å; I1111-L1119 HydrophobicContact CD1-CD2 4.02Å; I1111-L1119 HydrophobicContact CG1-CD2 4.25Å; I1111-V1121 HydrophobicContact CD1-CG2 4.27Å; I1111-L1125 HydrophobicContact CG2-CD1 4.25Å; I1111-L1125 HydrophobicContact CG2-CD2 4.29Å; I1111-V1129 HydrophobicContact CD1-CG2 4.4Å
1112	Q	78.1	Confident	77	Confident	132 Å²	132	61.6 Å²	61.6	62%	0.617	30%	0.303	S	S	*	.	H	α-helix	trans	-70.1	-23.4	179.2	-71.3	170.2	39.9	0	0	114.7	L1108 Q1109 Q1110 L1125	L1108-Q1112 VanDerWaalsContact O-CG 3.27Å; L1108-Q1112 WeakPolarHBondContact O-CG 3.49Å; L1108-Q1112 PolarHBondContact O-N 3.46Å; L1108-Q1112 PolarHBondContact O-NE2 3.06Å; Q1109-Q1112 PolarHBondContact O-N 2.04Å; Q1110-Q1112 VanDerWaalsContact C-N 3.26Å; Q1110-Q1112 PolarHBondContact O-N 2.87Å; Q1112-L1125 HydrophobicContact CG-CD1 3.76Å
1113	V	78.3	Confident	76.1	Confident	116 Å²	116	68.3 Å²	68.3	70%	0.703	32%	0.324	S	S	*	.	H	α-helix	trans	-97.3	-21.3	178.7	175.1	0	0	0	0	112.1	Q1109 Q1110 I1111	Q1109-V1113 WeakPolarHBondContact O-CG2 3.35Å; Q1109-V1113 PolarHBondContact O-N 2.64Å; Q1109-V1113 VanDerWaalsContact O-N 3.15Å; Q1110-V1113 PolarHBondContact O-N 2.83Å; Q1110-V1113 VanDerWaalsContact O-N 3.11Å; I1111-V1113 VanDerWaalsContact C-N 3.34Å; I1111-V1113 PolarHBondContact O-N 3.06Å
1114	S	73.4	Confident	75.1	Confident	34 Å²	34	71.5 Å²	71.5	24%	0.238	34%	0.344	C	S	.	.	S	Bend	trans	-68	169.6	177.9	77	0	0	0	0	113	Q1110 I1111	Q1110-S1114 VanDerWaalsContact O-CB 3.23Å; Q1110-S1114 WeakPolarHBondContact O-CB 3.43Å; Q1110-S1114 PolarHBondContact O-N 2.96Å; I1111-S1114 PolarHBondContact O-N 2.92Å; I1111-S1114 PolarHBondContact O-OG 2.83Å
1115	R	66.5	Low	74.1	Confident	205 Å²	205	72.3 Å²	72.3	77%	0.774	35%	0.347	S	S	*	.			trans	-66.2	141.4	171.5	-66.1	-178	-179.9	178.9	1.4	109.5	W1117 A1118	R1115-W1117 PolarHBondContact O-N 3.08Å; R1115-A1118 PolarHBondContact O-N 3.03Å
1116	P	57.1	Low	73.1	Confident	101 Å²	101	76.8 Å²	76.8	66%	0.656	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	3.3	-175.8	28.9	-37.7	0	0	0	115.3
1117	W	54.7	Low	72.3	Confident	189 Å²	189	81.6 Å²	81.6	72%	0.716	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.3	5.1	178.5	-49.7	-45.4	0	0	0	112.9	E1028 G1029 R1115	E1028-W1117 CarbonylContact C-O 3.42Å; E1028-W1117 VanDerWaalsContact C-O 3.22Å; E1028-W1117 VanDerWaalsContact CA-O 3.23Å; E1028-W1117 WeakPolarHBondContact CA-O 3.11Å; E1028-W1117 PolarHBondContact N-O 2.86Å; G1029-W1117 PolarHBondContact N-O 3.14Å; R1115-W1117 PolarHBondContact O-N 3.08Å
1118	A	63.9	Low	71.7	Confident	29 Å²	29	82.9 Å²	82.9	24%	0.24	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-61.1	175.6	0	0	0	0	0	110.3	E1028 T1056 R1115	E1028-A1118 PolarHBondContact N-O 3.26Å; T1056-A1118 WeakPolarHBondContact CG2-O 3.35Å; R1115-A1118 PolarHBondContact O-N 3.03Å
1119	L	77.4	Confident	71.5	Confident	6 Å²	6	82.3 Å²	82.3	3%	0.031	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	110.1	173.9	-171.1	67.9	0	0	0	108.5	L1024 V1027 T1056 L1057 L1060 I1111 V1121	L1024-L1119 HydrophobicContact CD1-CD1 4.33Å; L1024-L1119 HydrophobicContact CD2-CD1 3.77Å; L1024-L1119 HydrophobicContact CD2-CG 4.22Å; V1027-L1119 HydrophobicContact CG2-CD1 3.83Å; T1056-L1119 HydrophobicContact CG2-CB 3.91Å; T1056-L1119 HydrophobicContact CG2-CD1 4.32Å; L1057-L1119 HydrophobicContact CD2-CD2 3.57Å; L1057-L1119 HydrophobicContact CG-CD2 4.37Å; L1060-L1119 HydrophobicContact CD1-CB 4.05Å; L1060-L1119 HydrophobicContact CD1-CD2 3.86Å; I1111-L1119 HydrophobicContact CD1-CD2 4.02Å; I1111-L1119 HydrophobicContact CG1-CD2 4.25Å; L1119-V1121 HydrophobicContact CD2-CG2 4.16Å; L1119-V1121 HydrophobicContact CG-CG2 3.93Å
1120	A	76.1	Confident	71.4	Confident	26 Å²	26	85.7 Å²	85.7	22%	0.215	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	118.8	178.3	0	0	0	0	0	109.6	E1025 G1026	E1025-A1120 HydrophobicContact CB-CB 4Å; E1025-A1120 PolarHBondContact N-O 3.16Å; G1026-A1120 PolarHBondContact N-O 2.78Å; G1026-A1120 PolarHBondContact O-N 2.83Å
1121	V	73.2	Confident	71.3	Confident	9 Å²	9	85 Å²	85	6%	0.055	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	135.5	-176.2	179.9	0	0	0	0	108.6	L1024 I1111 L1119 L1125 H1128 V1129	L1024-V1121 HydrophobicContact CD2-CG2 3.89Å; I1111-V1121 HydrophobicContact CD1-CG2 4.27Å; L1119-V1121 HydrophobicContact CD2-CG2 4.16Å; L1119-V1121 HydrophobicContact CG-CG2 3.93Å; V1121-L1125 HydrophobicContact CB-CD2 3.71Å; V1121-L1125 HydrophobicContact CG1-CD2 3.85Å; V1121-L1125 VanDerWaalsContact O-CD2 3.28Å; V1121-L1125 WeakPolarHBondContact O-CD2 3.31Å; V1121-H1128 HydrophobicContact CG1-CB 4.03Å; V1121-V1129 HydrophobicContact CG1-CG2 3.8Å
1122	R	70.4	Confident	71.2	Confident	103 Å²	103	89.4 Å²	89.4	39%	0.389	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-58.9	141.1	-174.4	-170.6	169.1	-174.2	138.7	5.9	112.9	E1025 L1083 P1124 H1128	E1025-R1122 HydrophobicContact CG-CB 4.33Å; E1025-R1122 VanDerWaalsContact OE1-CA 3.31Å; E1025-R1122 WeakPolarHBondContact OE1-CA 3.39Å; E1025-R1122 WeakPolarHBondContact OE1-CB 3.06Å; E1025-R1122 WeakPolarHBondContact OE1-CG 3Å; L1083-R1122 HydrophobicContact CD1-CB 3.65Å; L1083-R1122 HydrophobicContact CD1-CG 4.23Å; R1122-P1124 CarbonylContact O-C 3.5Å; R1122-H1128 PolarHBondContact O-ND1 3.43Å
1123	R	66.2	Low	70.9	Confident	212 Å²	212	87 Å²	87	80%	0.8	40%	0.404	S	S	*	.	S	Bend	trans	-89.1	138.3	174.5	-63.6	-174.1	179.5	-157.4	-1.4	110.7
1124	P	63.7	Low	69.9	Low	67 Å²	67	85.9 Å²	85.9	44%	0.435	39%	0.39	S	S	.	.	S	Bend	cis	-78.3	133.8	1.4	32.5	-36.1	0	0	0	113	R1122 R1126 E1127 H1128	R1122-P1124 CarbonylContact O-C 3.5Å; P1124-R1126 PolarHBondContact O-N 3.32Å; P1124-R1126 VanDerWaalsContact O-N 3.11Å; P1124-E1127 HydrophobicContact CG-CB 4.42Å; P1124-E1127 HydrophobicContact CG-CG 4.13Å; P1124-E1127 WeakPolarHBondContact CG-OE1 3.48Å; P1124-E1127 VanDerWaalsContact CG-OE2 3.28Å; P1124-E1127 WeakPolarHBondContact CG-OE2 2.93Å; P1124-E1127 PolarHBondContact O-N 3.08Å; P1124-E1127 VanDerWaalsContact O-N 3.14Å; P1124-H1128 PolarHBondContact O-ND1 2.91Å
1125	L	64.3	Low	68.3	Low	25 Å²	25	90.9 Å²	90.9	13%	0.131	41%	0.414	C	S	.	.	H	α-helix	trans	-58.6	-31	-171.9	-62.7	169.3	0	0	0	113.8	L1108 I1111 Q1112 V1121 E1127 H1128 V1129	L1108-L1125 HydrophobicContact CD2-CB 3.5Å; I1111-L1125 HydrophobicContact CG2-CD1 4.25Å; I1111-L1125 HydrophobicContact CG2-CD2 4.29Å; Q1112-L1125 HydrophobicContact CG-CD1 3.76Å; V1121-L1125 HydrophobicContact CB-CD2 3.71Å; V1121-L1125 HydrophobicContact CG1-CD2 3.85Å; V1121-L1125 VanDerWaalsContact O-CD2 3.28Å; V1121-L1125 WeakPolarHBondContact O-CD2 3.31Å; L1125-E1127 PolarHBondContact O-N 3.2Å; L1125-H1128 PolarHBondContact O-N 2.8Å; L1125-V1129 PolarHBondContact O-N 3.38Å; L1125-V1129 VanDerWaalsContact O-N 3.1Å
1126	R	62	Low	66.8	Low	196 Å²	196	86.7 Å²	86.7	74%	0.74	41%	0.413	S	S	*	.	H	α-helix	trans	-67.6	-17.7	-178.6	-76.4	-177.6	170.6	-177.9	-4.7	114.6	L1108 P1124	L1108-R1126 HydrophobicContact CD1-CG 4.08Å; P1124-R1126 PolarHBondContact O-N 3.32Å; P1124-R1126 VanDerWaalsContact O-N 3.11Å
1127	E	68.7	Low	65.2	Low	108 Å²	108	86 Å²	86	51%	0.505	42%	0.416	S	S	.	.	H	α-helix	trans	-90.7	-27.1	178	-73.2	163.3	-158.4	0	0	112	P1124 L1125 R1130	P1124-E1127 HydrophobicContact CG-CB 4.42Å; P1124-E1127 HydrophobicContact CG-CG 4.13Å; P1124-E1127 WeakPolarHBondContact CG-OE1 3.48Å; P1124-E1127 VanDerWaalsContact CG-OE2 3.28Å; P1124-E1127 WeakPolarHBondContact CG-OE2 2.93Å; P1124-E1127 PolarHBondContact O-N 3.08Å; P1124-E1127 VanDerWaalsContact O-N 3.14Å; L1125-E1127 PolarHBondContact O-N 3.2Å; E1127-R1130 PolarHBondContact O-NE 3.49Å; E1127-R1130 PolarHBondContact O-NH2 3.27Å
1128	H	76	Confident	64	Low	28 Å²	28	82.8 Å²	82.8	13%	0.13	42%	0.419	C	S	.	.	H	α-helix	trans	-106.6	-2.8	-169.4	-57	89	0	0	0	113.8	L1022 E1023 V1121 R1122 P1124 L1125	L1022-H1128 WeakPolarHBondContact CA-O 3.49Å; E1023-H1128 HydrophobicContact CB-CB 4.27Å; E1023-H1128 PolarHBondContact N-O 2.93Å; E1023-H1128 IonicContact OE2-CD2 3.15Å; V1121-H1128 HydrophobicContact CG1-CB 4.03Å; R1122-H1128 PolarHBondContact O-ND1 3.43Å; P1124-H1128 PolarHBondContact O-ND1 2.91Å; L1125-H1128 PolarHBondContact O-N 2.8Å
1129	V	81	Confident	62.6	Low	8 Å²	8	90.1 Å²	90.1	5%	0.048	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	114.8	170.1	179.5	0	0	0	0	107.9	L1022 L1107 L1108 I1111 V1121 L1125 F1131	L1022-V1129 HydrophobicContact CD2-CB 4.17Å; L1022-V1129 HydrophobicContact CD2-CG1 3.77Å; L1022-V1129 HydrophobicContact CD2-CG2 3.88Å; L1107-V1129 HydrophobicContact CD2-CG1 4.27Å; L1108-V1129 HydrophobicContact CD2-CB 3.91Å; L1108-V1129 HydrophobicContact CD2-CG1 4.33Å; L1108-V1129 HydrophobicContact CD2-CG2 3.9Å; L1108-V1129 HydrophobicContact CG-CB 4.28Å; L1108-V1129 HydrophobicContact CG-CG1 4.22Å; I1111-V1129 HydrophobicContact CD1-CG2 4.4Å; V1121-V1129 HydrophobicContact CG1-CG2 3.8Å; L1125-V1129 PolarHBondContact O-N 3.38Å; L1125-V1129 VanDerWaalsContact O-N 3.1Å; V1129-F1131 HydrophobicContact CG1-CD2 4.29Å; V1129-F1131 HydrophobicContact CG1-CE2 3.98Å
1130	R	80.8	Confident	60.3	Low	151 Å²	151	94.8 Å²	94.8	57%	0.57	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.5	144.3	178.9	-55.9	-174.7	-166.9	-164.5	3.3	110.1	G1020 V1021 E1127	G1020-R1130 CarbonylContact C-O 3.53Å; G1020-R1130 VanDerWaalsContact CA-O 3.28Å; G1020-R1130 WeakPolarHBondContact CA-O 3.49Å; V1021-R1130 PolarHBondContact N-O 2.88Å; V1021-R1130 PolarHBondContact O-N 3.4Å; E1127-R1130 PolarHBondContact O-NE 3.49Å; E1127-R1130 PolarHBondContact O-NH2 3.27Å
1131	F	83.1	Confident	57.9	Low	23 Å²	23	102.4 Å²	102.4	10%	0.101	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	148.9	176	-83.1	-91.8	0	0	0	110.7	F1018 Q1019 G1020 F1061 V1088 V1090 A1100 V1103 G1104 L1107 V1129	F1018-F1131 HydrophobicContact CB-CD1 4.16Å; Q1019-F1131 CarbonylContact O-C 3.53Å; Q1019-F1131 VanDerWaalsContact O-CA 3.31Å; Q1019-F1131 WeakPolarHBondContact O-CA 3.48Å; G1020-F1131 VanDerWaalsContact CA-CD1 3.48Å; F1061-F1131 AromaticContact CZ-CZ 3.99Å; F1061-F1131 HydrophobicContact CZ-CZ 3.99Å; V1088-F1131 HydrophobicContact CG2-CZ 4.49Å; V1090-F1131 HydrophobicContact CB-CE1 4.45Å; V1090-F1131 HydrophobicContact CG2-CE1 3.58Å; V1090-F1131 HydrophobicContact CG2-CZ 4.11Å; A1100-F1131 HydrophobicContact CB-CB 4.02Å; A1100-F1131 WeakPolarHBondContact O-CB 3.41Å; V1103-F1131 HydrophobicContact CG1-CD1 4.06Å; V1103-F1131 HydrophobicContact CG1-CE1 4.06Å; V1103-F1131 HydrophobicContact CG1-CG 4.48Å; V1103-F1131 HydrophobicContact CG1-CZ 4.47Å; G1104-F1131 VanDerWaalsContact CA-CD2 3.46Å; L1107-F1131 HydrophobicContact CD2-CE2 3.86Å; L1107-F1131 HydrophobicContact CD2-CZ 4.05Å; V1129-F1131 HydrophobicContact CG1-CD2 4.29Å; V1129-F1131 HydrophobicContact CG1-CE2 3.98Å
1132	L	79.4	Confident	55.8	Low	109 Å²	109	109.5 Å²	109.5	57%	0.571	56%	0.555	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-132.4	143.7	178	-61.6	172.5	0	0	0	109.4	F1018 Q1019	F1018-L1132 CarbonylContact C-O 3.55Å; F1018-L1132 WeakPolarHBondContact CA-O 3.17Å; Q1019-L1132 PolarHBondContact N-O 2.77Å; Q1019-L1132 PolarHBondContact O-N 3.12Å
1133	D	72.6	Confident	53.9	Low	83 Å²	83	110.5 Å²	110.5	44%	0.444	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.8	139.2	173.3	-55.9	-74.8	0	0	0	110	F1018 A1100	F1018-D1133 VanDerWaalsContact CD1-OD1 3.31Å; F1018-D1133 WeakPolarHBondContact CD1-OD1 3.45Å; F1018-D1133 WeakPolarHBondContact CE1-OD1 3.07Å; A1100-D1133 WeakPolarHBondContact CB-OD1 3.41Å; A1100-D1133 PolarHBondContact N-OD1 2.99Å
1134	F	56.4	Low	52.5	Low	91 Å²	91	107.7 Å²	107.7	40%	0.399	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.5	98.8	-179.1	-170.2	-86.3	0	0	0	111.1	A1017	A1017-F1134 HydrophobicContact CB-CB 4.41Å; A1017-F1134 WeakPolarHBondContact O-CB 3.19Å; A1017-F1134 PolarHBondContact O-N 3.36Å
1135	D	39.9	Very low	50.8	Low	139 Å²	139	112.7 Å²	112.7	74%	0.743	59%	0.592	S	S	*	*			trans	-96.4	125.5	173.7	-85.3	-35	0	0	0	111.2	A1137	D1135-A1137 PolarHBondContact O-N 3.32Å
1136	P	36.4	Very low	49.1	Very low	118 Å²	118	118.7 Å²	118.7	77%	0.766	62%	0.623	S	S	*	*			trans	-80.4	98.3	177	31.1	-33.2	0	0	0	111.7
1137	A	23.6	Very low	47.4	Very low	85 Å²	85	113.9 Å²	113.9	70%	0.702	62%	0.618	S	S	*	*			trans	-129.6	146.9	172.8	0	0	0	0	0	111.8	D1135	D1135-A1137 PolarHBondContact O-N 3.32Å
1138	P	27.9	Very low	45.8	Very low	122 Å²	122	115.2 Å²	115.2	79%	0.792	64%	0.636	S	S	*	*			trans	-78.2	160.8	-175	32.1	-36.3	0	0	0	113.9	S1140	P1138-S1140 PolarHBondContact O-N 3.43Å; P1138-S1140 VanDerWaalsContact O-N 3.17Å
1139	L	35.9	Very low	43.7	Very low	184 Å²	184	119 Å²	119	96%	0.963	67%	0.665	S	S	*	*	S	Bend	trans	-63.1	104.8	-176.7	-74.3	162.2	0	0	0	114.4
1140	S	28.2	Very low	41.5	Very low	104 Å²	104	126.4 Å²	126.4	73%	0.727	70%	0.704	S	S	*	*			trans	-165.2	129.3	154.2	57.9	0	0	0	0	113.5	P1138	P1138-S1140 PolarHBondContact O-N 3.43Å; P1138-S1140 VanDerWaalsContact O-N 3.17Å
1141	E	26.4	Very low	39.3	Very low	186 Å²	186	130.9 Å²	130.9	87%	0.869	74%	0.738	S	S	*	*			trans	65.8	103.5	161.9	-52.2	-157.2	151.9	0	0	121
1142	L	29.3	Very low	37.1	Very low	157 Å²	157	136.3 Å²	136.3	82%	0.822	77%	0.769	S	S	*	*				33.3	149.5	127.6	-70.8	166.9	0	0	0	121.9
1143	P	30.8	Very low	34.9	Very low	124 Å²	124	137.7 Å²	137.7	81%	0.805	78%	0.78	S	S	*	*			cis	-140.2	-174.9	31.2	42	-22.5	0	0	0	117.5
1144	L	36.7	Very low	32.8	Very low	153 Å²	153	140.7 Å²	140.7	80%	0.801	80%	0.799	S	S	*	*			trans	-76.1	154.9	173.2	-72	141.8	0	0	0	113.8
1145	E	27.9	Very low	31.4	Very low	172 Å²	172	143.6 Å²	143.6	80%	0.804	82%	0.822	S	S	*	*				175.7	164.1	128.6	-95.8	-79.5	102.5	0	0	111.9
1146	L	27.5	Very low	30.9	Very low	151 Å²	151	143.9 Å²	143.9	79%	0.791	83%	0.827	S	S	*	*			trans	75.2	153.7	172.8	-55.4	174.6	0	0	0	116.9
1147	P	27.1	Very low	30.5	Very low	96 Å²	96	145.7 Å²	145.7	62%	0.623	83%	0.831	S	S	*	*				-130	164	-85.3	26.8	-4.7	0	0	0	115.2	S1149	P1147-S1149 PolarHBondContact O-N 3.42Å
1148	P	35.5	Very low	31	Very low	136 Å²	136	150 Å²	150	88%	0.883	84%	0.84	S	S	*	*			trans	-81.1	86.7	-177.3	33.5	-35.6	0	0	0	112.8
1149	S	32.2	Very low	31.2	Very low	106 Å²	106	152.2 Å²	152.2	74%	0.741	84%	0.844	S	S	*	*			trans	-133.3	53.5	175.2	-62.3	0	0	0	0	112.7	P1147	P1147-S1149 PolarHBondContact O-N 3.42Å
1150	L	33.5	Very low	30.8	Very low	165 Å²	165	149.5 Å²	149.5	86%	0.864	83%	0.834	S	S	*	*			trans	-165.5	114.5	163.4	-107.4	160.6	0	0	0	109.5
1151	L	34.9	Very low	31.1	Very low	244 Å²	244	153.6 Å²	153.6	100%	1.277	84%	0.844	S	S	*	*			trans	-137.9	0	164.4	-112.2	172.2	0	0	0	106.5

Retrieved 1,151 of 1,151 residues in 215.7 ms (Link to these results)

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