A0A5K4F8D0_SCHMA Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F8D0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,085 aa.

						>A0A5K4F8D0_SCHMA|A0A5K4F8D0
MNYAMEPPAMSTFLSDNETAGESTNLLHLEGHSWNQLQDGTIEITDRLPKKEYYMSLRRFNGAGPNFGIAHRLGSISSGSAAGLVNGSSGLLGGNSPSPCPGGGTLRGSSHPSVIDFKPSGKLVDCTVVMLDGTTREFRLDKAAYGQQLFDAVCTHLGLLEVEFFGITYYDSTNNWFWLQIDQKIAKQIGKNEWQFEFQVKFYPCDIDSIKEDITRYYLCLQVRQDIVSGQLPCSFVTYCILASYIVQSEAGDHDPSQHIGIKYIQDHPFAPHMLQTPEMLGRIVELHKLHRGKTPEEADRLFLNNARKLALYGVDLHKVKTSQGQDITLGVYYGGILLYRNRIRLMRISWPRIISLSHRGRNFIIARRPGDDSLDRNMTFKCISPILAKRLYNVCVDHHNFFRLRGSSRQKKPSLFPSFATRKYHYPGTTMNLSSIDATVGVGEHNQTSRSLSKFRPMPAHPSETGWFTFANRGEMNHMNGAVASQYQYQPAMVSGDPACMNPAYFCSQSIINGLPIPTAQGVQRYYQSSSNDVTGLMNDHYSSKNNHINNMTVMITRIPFEPEHWRITGADCTPGLGIDARGLDVASTRGAGWQGCRANKGVKAPGAYYYEAVCLEEGLIRVGWSTNDADLELGADNYGFGYGSDAVGSAGINGTGRVIHRNIGYDYGIMVHQGDVIGCLLDLDKGSISWSCNGKIFQRAFTIPDQLRGEAFLPAASLKDSRILFNFGEERPLEFPPDGPFIPVAQSADDSQVSNRNPGWRMNQYDATNALDVAPDGSQVQSHFNQGWQGCRSNHGIRGLGRFYFEVTPIESTGLWRVGWSTDDGNLIVGTDQYGFGYGADNEGFGLNGQQGKRIHCDEIENYGEAFSEGDVIGCFLDTIEHTIKWSRNGLEFGDAYQIPSELLDSKKLTALYPTVSLLNSTVELNFGDKPFKYYPGPDWTPVCCAPPECTKRSRRKGPERKVKGWSYIDPTILEPSIGQTMQSIERSEPQIETETFHDENGEMIKRIVKRSEVTTTKTVSERITASTTGQIVHANGHSISSYDFDEDLNMALLTVTKLDPDISVLNNPVGQVEIRTKSEHVL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.6	Very low	32.6	Very low	239 Å²	239	157.3 Å²	157.3	100%	1.177	87%	0.868	S	S	*	*				0	118.7	0	-78.7	-178.8	-179.5	0	0	107.4
2	N	34.9	Very low	32.1	Very low	166 Å²	166	154 Å²	154	89%	0.888	86%	0.856	S	S	*	*			trans	-65.2	124.6	-176.8	-69	-17.7	0	0	0	111
3	Y	36.1	Very low	31.6	Very low	227 Å²	227	157.8 Å²	157.8	89%	0.89	86%	0.859	S	S	*	*			trans	-119.8	114.8	150.6	-98.4	-84.2	0	0	0	108.1
4	A	32.6	Very low	31.4	Very low	90 Å²	90	159 Å²	159	74%	0.744	86%	0.863	S	S	*	*			trans	-68.1	125.2	174	0	0	0	0	0	109.8
5	M	33.3	Very low	30.9	Very low	187 Å²	187	154.1 Å²	154.1	92%	0.921	85%	0.845	S	S	*	*			trans	-120.8	95.7	148.1	-77	-160.1	178.9	0	0	106.3	P7	M5-P7 WeakPolarHBondContact O-CD 3.43Å
6	E	29.2	Very low	30.6	Very low	183 Å²	183	153.2 Å²	153.2	86%	0.855	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-63	124.6	160.6	-95.2	176.9	150.5	0	0	108.6
7	P	34.4	Very low	30.3	Very low	112 Å²	112	153.3 Å²	153.3	73%	0.727	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-79.1	136.8	166.6	29.4	-28.6	0	0	0	109.9	M5 A9	M5-P7 WeakPolarHBondContact O-CD 3.43Å; P7-A9 PolarHBondContact O-N 2.81Å
8	P	32.2	Very low	30	Very low	129 Å²	129	155.2 Å²	155.2	84%	0.838	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-64.2	137.1	171.4	26.8	-30.6	0	0	0	109.8
9	A	30.3	Very low	29.9	Very low	97 Å²	97	154.9 Å²	154.9	80%	0.802	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-55.5	135.5	-166	0	0	0	0	0	114.8	P7 S11	P7-A9 PolarHBondContact O-N 2.81Å; A9-S11 PolarHBondContact O-N 3.1Å
10	M	25.9	Very low	29.8	Very low	190 Å²	190	153 Å²	153	94%	0.936	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-66.8	116.7	158.7	-70.1	-173.1	-81.6	0	0	109.3
11	S	28.3	Very low	29.6	Very low	110 Å²	110	148.5 Å²	148.5	77%	0.769	84%	0.838	S	S	*	*			trans	-110.4	95.1	157.2	70	0	0	0	0	109.1	A9	A9-S11 PolarHBondContact O-N 3.1Å
12	T	27	Very low	28.9	Very low	118 Å²	118	146.1 Å²	146.1	72%	0.724	83%	0.825	S	S	*	*			trans	5	119.7	147.2	51.8	0	0	0	0	118.4
13	F	25.5	Very low	28.5	Very low	204 Å²	204	143.5 Å²	143.5	90%	0.895	82%	0.819	S	S	*	*			trans	13.1	111.4	135.6	-72.6	-93	0	0	0	117.2
14	L	27.8	Very low	28.1	Very low	174 Å²	174	138.3 Å²	138.3	91%	0.911	81%	0.811	S	S	*	*			trans	-115.1	103.6	145	-74.9	171.9	0	0	0	107
15	S	24	Very low	27.8	Very low	85 Å²	85	140.1 Å²	140.1	59%	0.594	81%	0.808	S	S	*	*			trans	-75.3	154.7	156.1	58.7	0	0	0	0	108.9
16	D	26.6	Very low	27.7	Very low	140 Å²	140	138 Å²	138	75%	0.749	80%	0.8	S	S	*	*	S	Bend	trans	86.1	107.8	161.2	-49.2	-40	0	0	0	118.5
17	N	24.9	Very low	27.8	Very low	155 Å²	155	135.1 Å²	135.1	83%	0.829	79%	0.79	S	S	*	*			trans	71.1	57.8	137.4	-73.2	-11.7	0	0	0	120.3
18	E	25.1	Very low	27.4	Very low	187 Å²	187	138.4 Å²	138.4	87%	0.874	80%	0.795	S	S	*	*			trans	-144.9	97.1	153.5	-70	-167.6	168.8	0	0	111.3
19	T	29.2	Very low	27.3	Very low	151 Å²	151	138 Å²	138	93%	0.926	79%	0.786	S	S	*	*			trans	-176.2	54.9	144.9	21	0	0	0	0	110.8
20	A	27.1	Very low	27.2	Very low	116 Å²	116	141.6 Å²	141.6	96%	0.959	79%	0.785	S	S	*	*			trans	-96.8	77.8	151	0	0	0	0	0	106.4
21	G	26.2	Very low	27.3	Very low	58 Å²	58	135.5 Å²	135.5	60%	0.598	77%	0.772	S	S	*	*			trans	-167.7	32.4	-166	0	0	0	0	0	115.7
22	E	26.6	Very low	27.3	Very low	190 Å²	190	135.8 Å²	135.8	89%	0.888	76%	0.76	S	S	*	*			trans	-125.2	69.8	156.1	-73.6	-169.8	173.1	0	0	108.1	T24	E22-T24 PolarHBondContact O-N 2.94Å
23	S	27.3	Very low	27.2	Very low	111 Å²	111	135.8 Å²	135.8	78%	0.776	77%	0.765	S	S	*	*			trans	-62.4	95.2	155.1	42.6	0	0	0	0	107	N25	S23-N25 PolarHBondContact O-N 2.9Å
24	T	26.6	Very low	27.4	Very low	117 Å²	117	134.4 Å²	134.4	72%	0.718	75%	0.754	S	S	*	*			trans	-49.9	110.3	161.2	31.3	0	0	0	0	107.3	E22 L26	E22-T24 PolarHBondContact O-N 2.94Å; T24-L26 VanDerWaalsContact C-N 3.26Å; T24-L26 PolarHBondContact O-N 3.14Å
25	N	27.3	Very low	27.6	Very low	128 Å²	128	133.7 Å²	133.7	68%	0.684	75%	0.751	S	S	*	*			trans	-66.6	86.8	-179.1	-165.5	-17.1	0	0	0	107.8	S23 L27	S23-N25 PolarHBondContact O-N 2.9Å; N25-L27 PolarHBondContact O-N 3.35Å; N25-L27 WeakPolarHBondContact OD1-CB 3.37Å
26	L	30.8	Very low	27.9	Very low	144 Å²	144	137.2 Å²	137.2	75%	0.754	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-68.4	6.3	-177.4	-77	165.7	0	0	0	113.3	T24 H28	T24-L26 VanDerWaalsContact C-N 3.26Å; T24-L26 PolarHBondContact O-N 3.14Å; L26-H28 PolarHBondContact O-N 2.89Å; L26-H28 VanDerWaalsContact O-N 3.16Å
27	L	30.4	Very low	28.6	Very low	121 Å²	121	135 Å²	135	63%	0.634	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-75.1	6.7	178.2	-72.5	167	0	0	0	114.4	N25	N25-L27 PolarHBondContact O-N 3.35Å; N25-L27 WeakPolarHBondContact OD1-CB 3.37Å
28	H	27.3	Very low	29.3	Very low	181 Å²	181	137.7 Å²	137.7	84%	0.838	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-106.3	14.5	175.4	-144.5	71.6	0	0	0	115.2	L26	L26-H28 PolarHBondContact O-N 2.89Å; L26-H28 VanDerWaalsContact O-N 3.16Å
29	L	28.9	Very low	30.1	Very low	122 Å²	122	134.9 Å²	134.9	64%	0.639	75%	0.745	S	S	*	*			trans	-111.2	16.8	169.1	-109.4	92.1	0	0	0	114.3	G31	L29-G31 VanDerWaalsContact C-N 3.26Å; L29-G31 PolarHBondContact O-N 2.82Å
30	E	28.2	Very low	30.3	Very low	171 Å²	171	130 Å²	130	80%	0.799	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	80.4	166.5	-72	-173.3	173.9	0	0	110.3
31	G	27.5	Very low	30.5	Very low	63 Å²	63	127.4 Å²	127.4	65%	0.649	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-162.4	-4.4	173.8	0	0	0	0	0	114.9	L29	L29-G31 VanDerWaalsContact C-N 3.26Å; L29-G31 PolarHBondContact O-N 2.82Å
32	H	28.8	Very low	30.9	Very low	115 Å²	115	131.1 Å²	131.1	53%	0.532	70%	0.701	S	S	.	*	S	Bend	trans	-117.9	113	176.9	-64.4	-50.1	0	0	0	108.9	W34	H32-W34 VanDerWaalsContact C-N 3.3Å; H32-W34 PolarHBondContact O-N 3.44Å; H32-W34 PolarHBondContact O-NE1 3.25Å
33	S	25.8	Very low	31.4	Very low	118 Å²	118	128.9 Å²	128.9	83%	0.825	69%	0.691	S	S	*	*			trans	-62.6	89.7	172	54.4	0	0	0	0	109.2
34	W	29.8	Very low	32	Very low	176 Å²	176	126.3 Å²	126.3	67%	0.667	67%	0.668	S	S	*	*			trans	-80	121.9	164.7	-56.3	94.2	0	0	0	106.6	H32 Q36	H32-W34 VanDerWaalsContact C-N 3.3Å; H32-W34 PolarHBondContact O-N 3.44Å; H32-W34 PolarHBondContact O-NE1 3.25Å; W34-Q36 PolarHBondContact O-N 3.01Å
35	N	32	Very low	32.7	Very low	158 Å²	158	124.5 Å²	124.5	85%	0.845	66%	0.657	S	S	*	*			trans	-67.1	86.5	173.9	-73.9	-34.6	0	0	0	108.4	L37	N35-L37 PolarHBondContact O-N 2.92Å
36	Q	30.1	Very low	33.6	Very low	160 Å²	160	123.8 Å²	123.8	75%	0.748	65%	0.653	S	S	*	*			trans	-76.4	118.7	177.7	-162.5	173.2	26.5	0	0	108.6	W34	W34-Q36 PolarHBondContact O-N 3.01Å
37	L	40.1	Very low	34.8	Very low	94 Å²	94	128.3 Å²	128.3	49%	0.492	66%	0.66	S	S	.	*			trans	-71.5	152	168.5	-68	172.6	0	0	0	109.6	N35 D39 G40 E43	N35-L37 PolarHBondContact O-N 2.92Å; L37-D39 PolarHBondContact O-N 2.89Å; L37-G40 PolarHBondContact O-N 2.89Å; L37-G40 VanDerWaalsContact O-N 3.07Å; L37-E43 HydrophobicContact CD1-CB 4.2Å
38	Q	40.3	Very low	36.3	Very low	210 Å²	210	126.4 Å²	126.4	98%	0.981	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-7.7	-163	-86.8	-178.5	-16.1	0	0	116.6
39	D	41.3	Very low	38.5	Very low	129 Å²	129	121.5 Å²	121.5	69%	0.69	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	9.6	176.1	65.6	-0.5	0	0	0	114	L37 T41	L37-D39 PolarHBondContact O-N 2.89Å; D39-T41 VanDerWaalsContact C-N 3.32Å; D39-T41 PolarHBondContact OD1-N 3.37Å; D39-T41 PolarHBondContact OD1-OG1 3.28Å; D39-T41 PolarHBondContact OD2-OG1 2.91Å
40	G	34.2	Very low	40.9	Very low	49 Å²	49	116.8 Å²	116.8	51%	0.505	61%	0.609	S	S	.	*	S	Bend	trans	83.7	6.2	175.8	0	0	0	0	0	114.3	L37	L37-G40 PolarHBondContact O-N 2.89Å; L37-G40 VanDerWaalsContact O-N 3.07Å
41	T	31.4	Very low	43.3	Very low	60 Å²	60	110.8 Å²	110.8	37%	0.368	58%	0.58	S	S	.	*			trans	-89.3	137.4	177.8	-20.1	0	0	0	0	111.5	D39	D39-T41 VanDerWaalsContact C-N 3.32Å; D39-T41 PolarHBondContact OD1-N 3.37Å; D39-T41 PolarHBondContact OD1-OG1 3.28Å; D39-T41 PolarHBondContact OD2-OG1 2.91Å
42	I	35.1	Very low	45.7	Very low	136 Å²	136	112.5 Å²	112.5	70%	0.697	57%	0.571	S	S	*	*			trans	-81.1	127.4	175.4	-60.8	169.5	0	0	0	108.2	I44	I42-I44 HydrophobicContact CG2-CG1 4.4Å; I42-I44 PolarHBondContact O-N 2.89Å
43	E	36.5	Very low	48.2	Very low	143 Å²	143	108.2 Å²	108.2	67%	0.668	55%	0.55	S	S	*	*			trans	-73.7	94.8	169.7	-166.1	178.4	-167.2	0	0	108.5	L37 T45	L37-E43 HydrophobicContact CD1-CB 4.2Å; E43-T45 PolarHBondContact O-N 3.35Å
44	I	40.4	Very low	50.9	Low	57 Å²	57	102.7 Å²	102.7	29%	0.292	51%	0.512	S	S	.	.			trans	-72.6	123.1	170.3	-59.2	175.9	0	0	0	106.6	I42 D46 T295	I42-I44 HydrophobicContact CG2-CG1 4.4Å; I42-I44 PolarHBondContact O-N 2.89Å; I44-D46 PolarHBondContact O-N 3.06Å; I44-T295 HydrophobicContact CD1-CG2 4.35Å
45	T	41	Very low	53.2	Low	79 Å²	79	97.9 Å²	97.9	49%	0.485	50%	0.497	S	S	.	.			trans	-70	67.4	178.2	51.7	0	0	0	0	111.1	E43 R47	E43-T45 PolarHBondContact O-N 3.35Å; T45-R47 PolarHBondContact O-N 2.68Å
46	D	45.7	Very low	55.4	Low	114 Å²	114	93.7 Å²	93.7	61%	0.61	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-6.5	175.7	175.8	32.4	0	0	0	113.2	I44	I44-D46 PolarHBondContact O-N 3.06Å
47	R	55.7	Low	57.5	Low	239 Å²	239	88.6 Å²	88.6	90%	0.902	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-15	-175.5	-59.3	-167.3	-176.1	-148.8	1.5	114.9	T45	T45-R47 PolarHBondContact O-N 2.68Å
48	L	63	Low	59.1	Low	80 Å²	80	87 Å²	87	42%	0.419	45%	0.445	S	S	.	.	S	Bend	trans	-89.4	141.7	-180	-70.5	176.5	0	0	0	110.8	K50 E52	L48-K50 PolarHBondContact O-N 3.01Å; L48-E52 HydrophobicContact CB-CB 4.41Å
49	P	73.7	Confident	59.7	Low	78 Å²	78	85.3 Å²	85.3	51%	0.506	43%	0.43	S	S	.	.			trans	-49.4	137.3	164.3	-25.2	33.2	0	0	0	110.9	K51 E52 Y53	P49-K51 VanDerWaalsContact C-N 3.28Å; P49-K51 PolarHBondContact O-N 2.79Å; P49-K51 VanDerWaalsContact O-N 3.12Å; P49-E52 HydrophobicContact CB-CG 4.34Å; P49-E52 WeakPolarHBondContact CD-OE2 3.22Å; P49-E52 WeakPolarHBondContact O-CA 3.19Å; P49-E52 WeakPolarHBondContact O-CB 3.45Å; P49-E52 PolarHBondContact O-N 3.16Å; P49-Y53 PolarHBondContact O-N 2.84Å
50	K	78.1	Confident	60.1	Low	24 Å²	24	87.9 Å²	87.9	10%	0.104	44%	0.436	C	S	.	.	H	α-helix	trans	-53.9	-39.9	-170.7	-171.3	162.7	-179	167.7	0	114.8	L48 E52 Y53 Y54 Y217 S249 E250	L48-K50 PolarHBondContact O-N 3.01Å; K50-E52 VanDerWaalsContact C-N 3.29Å; K50-E52 PolarHBondContact O-N 2.91Å; K50-Y53 WeakPolarHBondContact O-CB 3.45Å; K50-Y53 PolarHBondContact O-N 2.76Å; K50-Y54 HydrophobicContact CD-CE2 4.2Å; K50-Y54 HydrophobicContact CG-CD2 3.79Å; K50-Y54 HydrophobicContact CG-CE2 3.6Å; K50-Y54 WeakPolarHBondContact O-CD2 3.37Å; K50-Y54 PolarHBondContact O-N 2.9Å; K50-Y217 HydrophobicContact CB-CE2 4.48Å; K50-Y217 HydrophobicContact CD-CD2 4.13Å; K50-Y217 HydrophobicContact CD-CE2 3.48Å; K50-Y217 VanDerWaalsContact CD-CE2 3.48Å; K50-Y217 VanDerWaalsContact CE-CE2 3.45Å; K50-Y217 HydrophobicContact CG-CD2 4.18Å; K50-Y217 HydrophobicContact CG-CE2 3.69Å; K50-S249 WeakPolarHBondContact CE-O 3.43Å; K50-S249 WeakPolarHBondContact CE-OG 3.37Å; K50-S249 PolarHBondContact NZ-O 3.11Å; K50-S249 PolarHBondContact NZ-OG 2.84Å; K50-E250 WeakPolarHBondContact CD-OE1 3.49Å; K50-E250 WeakPolarHBondContact CD-OE2 3.31Å; K50-E250 IonicContact NZ-OE1 2.72Å; K50-E250 PolarHBondContact NZ-OE1 2.79Å; K50-E250 IonicContact NZ-OE2 3.18Å
51	K	78.2	Confident	60.1	Low	44 Å²	44	93.1 Å²	93.1	19%	0.191	45%	0.452	C	S	.	.	H	α-helix	trans	-55.2	-45.9	172.6	-177.9	-174.5	176.2	-173.9	0	111.4	P49 Y54 M55 H156 Y217 Y218	P49-K51 VanDerWaalsContact C-N 3.28Å; P49-K51 PolarHBondContact O-N 2.79Å; P49-K51 VanDerWaalsContact O-N 3.12Å; K51-Y54 PolarHBondContact O-N 2.81Å; K51-M55 HydrophobicContact CG-SD 4.33Å; K51-M55 VanDerWaalsContact O-CG 3.27Å; K51-M55 WeakPolarHBondContact O-CG 3.28Å; K51-M55 PolarHBondContact O-N 2.91Å; K51-H156 PolarHBondContact NZ-O 2.8Å; K51-Y217 HydrophobicContact CB-CE1 4.45Å; K51-Y218 WeakPolarHBondContact CD-OH 3.39Å; K51-Y218 WeakPolarHBondContact CE-OH 3.43Å
52	E	78.6	Confident	60.1	Low	99 Å²	99	94.1 Å²	94.1	46%	0.463	47%	0.474	S	S	.	.	H	α-helix	trans	-69.4	-38.8	179.8	-61.9	178.2	-175.4	0	0	111.7	L48 P49 K50 Y54 M55 S56	L48-E52 HydrophobicContact CB-CB 4.41Å; P49-E52 HydrophobicContact CB-CG 4.34Å; P49-E52 WeakPolarHBondContact CD-OE2 3.22Å; P49-E52 WeakPolarHBondContact O-CA 3.19Å; P49-E52 WeakPolarHBondContact O-CB 3.45Å; P49-E52 PolarHBondContact O-N 3.16Å; K50-E52 VanDerWaalsContact C-N 3.29Å; K50-E52 PolarHBondContact O-N 2.91Å; E52-Y54 PolarHBondContact O-N 3.03Å; E52-M55 PolarHBondContact O-N 3.33Å; E52-S56 WeakPolarHBondContact O-CB 3.42Å; E52-S56 PolarHBondContact O-N 3.04Å
53	Y	81.3	Confident	59.9	Low	25 Å²	25	92 Å²	92	10%	0.098	48%	0.477	C	S	.	.	H	α-helix	trans	-54.4	-52.5	170.6	169	-97	0	0	0	111.1	P49 K50 M55 S56 L57 P296	P49-Y53 PolarHBondContact O-N 2.84Å; K50-Y53 WeakPolarHBondContact O-CB 3.45Å; K50-Y53 PolarHBondContact O-N 2.76Å; Y53-M55 VanDerWaalsContact C-N 3.33Å; Y53-M55 PolarHBondContact O-N 3.04Å; Y53-S56 WeakPolarHBondContact O-CB 3.26Å; Y53-S56 PolarHBondContact O-N 3.25Å; Y53-S56 PolarHBondContact O-OG 3.07Å; Y53-L57 HydrophobicContact CD1-CD1 4.43Å; Y53-L57 HydrophobicContact CE1-CD1 3.75Å; Y53-L57 HydrophobicContact CE1-CG 4.35Å; Y53-L57 HydrophobicContact CE2-CD2 4.47Å; Y53-L57 PolarHBondContact O-N 2.82Å; Y53-P296 HydrophobicContact CD1-CB 4.47Å; Y53-P296 HydrophobicContact CE1-CB 3.87Å; Y53-P296 HydrophobicContact CE1-CG 4Å
54	Y	81.6	Confident	59.5	Low	3 Å²	3	87.9 Å²	87.9	1%	0.012	47%	0.473	C	S	.	.	H	α-helix	trans	-64.5	-34	178.4	-80.3	-65.8	0	0	0	113.9	K50 K51 E52 S56 L57 D213 Y217 P296 E297 D300	K50-Y54 HydrophobicContact CD-CE2 4.2Å; K50-Y54 HydrophobicContact CG-CD2 3.79Å; K50-Y54 HydrophobicContact CG-CE2 3.6Å; K50-Y54 WeakPolarHBondContact O-CD2 3.37Å; K50-Y54 PolarHBondContact O-N 2.9Å; K51-Y54 PolarHBondContact O-N 2.81Å; E52-Y54 PolarHBondContact O-N 3.03Å; Y54-S56 VanDerWaalsContact C-N 3.3Å; Y54-L57 HydrophobicContact CD1-CD1 3.99Å; Y54-L57 HydrophobicContact CE1-CD1 4.33Å; Y54-D213 HydrophobicContact CD1-CB 3.53Å; Y54-D213 WeakPolarHBondContact CD1-O 3.19Å; Y54-D213 HydrophobicContact CE1-CB 3.9Å; Y54-Y217 AromaticContact CD2-CD1 3.86Å; Y54-Y217 HydrophobicContact CD2-CD1 3.86Å; Y54-Y217 AromaticContact CD2-CD2 3.81Å; Y54-Y217 HydrophobicContact CD2-CD2 3.81Å; Y54-Y217 AromaticContact CD2-CG 3.43Å; Y54-Y217 HydrophobicContact CD2-CG 3.43Å; Y54-Y217 VanDerWaalsContact CD2-CG 3.43Å; Y54-Y217 HydrophobicContact CE2-CD1 4.35Å; Y54-Y217 AromaticContact CE2-CD2 3.43Å; Y54-Y217 HydrophobicContact CE2-CD2 3.43Å; Y54-Y217 VanDerWaalsContact CE2-CD2 3.43Å; Y54-Y217 HydrophobicContact CE2-CE2 4.24Å; Y54-Y217 AromaticContact CE2-CG 3.5Å; Y54-Y217 HydrophobicContact CE2-CG 3.5Å; Y54-Y217 VanDerWaalsContact CE2-CG 3.5Å; Y54-Y217 HydrophobicContact CG-CG 4.25Å; Y54-P296 VanDerWaalsContact OH-C 3.3Å; Y54-P296 PolarHBondContact OH-O 2.83Å; Y54-P296 VanDerWaalsContact OH-O 3.11Å; Y54-E297 HydrophobicContact CE1-CB 4.35Å; Y54-D300 PolarHBondContact OH-OD2 3.02Å
55	M	80	Confident	59	Low	74 Å²	74	91.3 Å²	91.3	37%	0.365	50%	0.499	S	S	.	.	H	α-helix	trans	-65.7	-34.3	171.7	-70.9	-178.9	68.2	0	0	112	K51 E52 Y53 R58 I214	K51-M55 HydrophobicContact CG-SD 4.33Å; K51-M55 VanDerWaalsContact O-CG 3.27Å; K51-M55 WeakPolarHBondContact O-CG 3.28Å; K51-M55 PolarHBondContact O-N 2.91Å; E52-M55 PolarHBondContact O-N 3.33Å; Y53-M55 VanDerWaalsContact C-N 3.33Å; Y53-M55 PolarHBondContact O-N 3.04Å; M55-R58 WeakPolarHBondContact O-CB 3.49Å; M55-R58 WeakPolarHBondContact O-CG 3.41Å; M55-R58 PolarHBondContact O-N 2.99Å; M55-I214 HydrophobicContact CG-CD1 3.39Å; M55-I214 HydrophobicContact SD-CD1 4.32Å
56	S	77.7	Confident	58.4	Low	70 Å²	70	94.4 Å²	94.4	49%	0.49	51%	0.513	S	S	.	.	H	α-helix	trans	-73.3	-24.7	-178.6	79.9	0	0	0	0	113.7	E52 Y53 Y54 R58	E52-S56 WeakPolarHBondContact O-CB 3.42Å; E52-S56 PolarHBondContact O-N 3.04Å; Y53-S56 WeakPolarHBondContact O-CB 3.26Å; Y53-S56 PolarHBondContact O-N 3.25Å; Y53-S56 PolarHBondContact O-OG 3.07Å; Y54-S56 VanDerWaalsContact C-N 3.3Å; S56-R58 PolarHBondContact O-N 2.87Å; S56-R58 VanDerWaalsContact O-N 3.14Å
57	L	74.3	Confident	57.5	Low	54 Å²	54	99 Å²	99	28%	0.283	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-13.1	174.4	-68.5	177.1	0	0	0	113	Y53 Y54 R59 D213 E297	Y53-L57 HydrophobicContact CD1-CD1 4.43Å; Y53-L57 HydrophobicContact CE1-CD1 3.75Å; Y53-L57 HydrophobicContact CE1-CG 4.35Å; Y53-L57 HydrophobicContact CE2-CD2 4.47Å; Y53-L57 PolarHBondContact O-N 2.82Å; Y54-L57 HydrophobicContact CD1-CD1 3.99Å; Y54-L57 HydrophobicContact CE1-CD1 4.33Å; L57-R59 PolarHBondContact O-N 3.47Å; L57-D213 HydrophobicContact CD1-CB 4.03Å; L57-E297 HydrophobicContact CD1-CB 4.41Å
58	R	72.7	Confident	56	Low	60 Å²	60	91 Å²	91	23%	0.226	52%	0.519	C	S	.	.			trans	-63.7	106.9	173	-72.2	-177.2	167.1	154.8	5	110.9	M55 S56 F60 G158 E212	M55-R58 WeakPolarHBondContact O-CB 3.49Å; M55-R58 WeakPolarHBondContact O-CG 3.41Å; M55-R58 PolarHBondContact O-N 2.99Å; S56-R58 PolarHBondContact O-N 2.87Å; S56-R58 VanDerWaalsContact O-N 3.14Å; R58-F60 PolarHBondContact O-N 3.27Å; R58-F60 VanDerWaalsContact O-N 3.08Å; R58-G158 PolarHBondContact NH1-O 3.41Å; R58-G158 PolarHBondContact NH2-O 2.84Å; R58-E212 IonicContact CZ-OE1 3.89Å; R58-E212 IonicContact NE-OE1 3Å; R58-E212 PolarHBondContact NE-OE1 2.9Å; R58-E212 VanDerWaalsContact NH2-CD 3.29Å; R58-E212 IonicContact NH2-OE1 2.86Å; R58-E212 PolarHBondContact NH2-OE1 2.76Å; R58-E212 IonicContact NH2-OE2 3.32Å; R58-E212 PolarHBondContact NH2-OE2 3.34Å
59	R	52.6	Low	54.2	Low	175 Å²	175	93.9 Å²	93.9	66%	0.66	53%	0.533	S	S	*	.			trans	-72.8	98.6	162.2	-60.5	-170.2	-174.4	-147.9	3	108.3	L57 N61	L57-R59 PolarHBondContact O-N 3.47Å; R59-N61 PolarHBondContact O-N 3.18Å; R59-N61 VanDerWaalsContact O-N 3.15Å
60	F	49.1	Very low	51.7	Low	183 Å²	183	94.7 Å²	94.7	80%	0.803	55%	0.547	S	S	*	.			trans	-62.1	115.8	157.4	-73.9	-83	0	0	0	106.4	R58 G62	R58-F60 PolarHBondContact O-N 3.27Å; R58-F60 VanDerWaalsContact O-N 3.08Å; F60-G62 PolarHBondContact O-N 2.8Å
61	N	36.2	Very low	49.1	Very low	158 Å²	158	101 Å²	101	85%	0.845	58%	0.576	S	S	*	*			trans	-51.2	113.2	168.3	-88.5	-13.1	0	0	0	107.1	R59 A63	R59-N61 PolarHBondContact O-N 3.18Å; R59-N61 VanDerWaalsContact O-N 3.15Å; N61-A63 VanDerWaalsContact C-N 3.31Å; N61-A63 PolarHBondContact O-N 3.05Å
62	G	29.6	Very low	46.5	Very low	81 Å²	81	108.9 Å²	108.9	84%	0.835	61%	0.605	S	S	*	*			trans	-61.1	91.1	-177.5	0	0	0	0	0	110.5	F60	F60-G62 PolarHBondContact O-N 2.8Å
63	A	32.1	Very low	43.9	Very low	92 Å²	92	112.8 Å²	112.8	76%	0.76	63%	0.628	S	S	*	*			trans	-80.1	125.7	144.7	0	0	0	0	0	105.6	N61	N61-A63 VanDerWaalsContact C-N 3.31Å; N61-A63 PolarHBondContact O-N 3.05Å
64	G	27.2	Very low	41	Very low	57 Å²	57	115.1 Å²	115.1	59%	0.588	66%	0.659	S	S	*	*			trans	-52.9	174.5	-169.7	0	0	0	0	0	115.8	N66	G64-N66 VanDerWaalsContact C-N 3.32Å; G64-N66 PolarHBondContact O-N 3.28Å
65	P	29.4	Very low	38.2	Very low	129 Å²	129	120.7 Å²	120.7	84%	0.838	70%	0.699	S	S	*	*	S	Bend	trans	-72	85.5	-168.3	31.6	-33.6	0	0	0	109.6
66	N	28.9	Very low	35.5	Very low	144 Å²	144	125.3 Å²	125.3	77%	0.77	72%	0.723	S	S	*	*			trans	-177.3	57.9	166.1	-100.5	-10	0	0	0	111.9	G64	G64-N66 VanDerWaalsContact C-N 3.32Å; G64-N66 PolarHBondContact O-N 3.28Å
67	F	26.8	Very low	32.9	Very low	211 Å²	211	127 Å²	127	93%	0.925	74%	0.735	S	S	*	*			trans	-143.6	112.1	149.4	-85.8	-72	0	0	0	109.6
68	G	24	Very low	30.4	Very low	69 Å²	69	130.3 Å²	130.3	71%	0.711	76%	0.762	S	S	*	*			trans	-50.6	140.4	165.2	0	0	0	0	0	109.7	A70	G68-A70 PolarHBondContact O-N 3.32Å
69	I	25.2	Very low	28.1	Very low	141 Å²	141	131 Å²	131	72%	0.723	79%	0.788	S	S	*	*			trans	-5.5	103.2	156.7	-57.8	171.3	0	0	0	109.8	H71	I69-H71 PolarHBondContact O-CD2 3.11Å; I69-H71 PolarHBondContact O-N 3.41Å
70	A	23	Very low	26.6	Very low	96 Å²	96	128.6 Å²	128.6	79%	0.793	80%	0.798	S	S	*	*			trans	-59.9	89.5	165.9	0	0	0	0	0	106.3	G68 R72	G68-A70 PolarHBondContact O-N 3.32Å; A70-R72 PolarHBondContact O-N 2.82Å
71	H	23.2	Very low	25.5	Very low	157 Å²	157	124.4 Å²	124.4	73%	0.727	80%	0.797	S	S	*	*			trans	-53.1	106.9	167.2	-84.8	-93	0	0	0	105.6	I69 L73	I69-H71 PolarHBondContact O-CD2 3.11Å; I69-H71 PolarHBondContact O-N 3.41Å; H71-L73 VanDerWaalsContact C-N 3.25Å; H71-L73 PolarHBondContact O-N 3.27Å
72	R	23.2	Very low	24.8	Very low	209 Å²	209	122.1 Å²	122.1	79%	0.789	80%	0.8	S	S	*	*			trans	-57	101.5	157.3	-74.1	-171.1	176.7	-163.9	2.4	105.4	A70 G74	A70-R72 PolarHBondContact O-N 2.82Å; R72-G74 PolarHBondContact O-N 3.47Å
73	L	22.8	Very low	24.6	Very low	181 Å²	181	122 Å²	122	95%	0.948	80%	0.799	S	S	*	*	S	Bend	trans	-55.9	110.8	170	-85.1	158	0	0	0	107.8	H71	H71-L73 VanDerWaalsContact C-N 3.25Å; H71-L73 PolarHBondContact O-N 3.27Å
74	G	22.2	Very low	24.1	Very low	73 Å²	73	125.8 Å²	125.8	75%	0.753	81%	0.806	S	S	*	*			trans	177.7	33.1	-179.6	0	0	0	0	0	111.7	R72	R72-G74 PolarHBondContact O-N 3.47Å
75	S	21.3	Very low	24.1	Very low	121 Å²	121	129.9 Å²	129.9	85%	0.846	82%	0.819	S	S	*	*			trans	-123	96.7	166.1	-157.1	0	0	0	0	106.9
76	I	23.5	Very low	23.8	Very low	171 Å²	171	131.7 Å²	131.7	88%	0.877	82%	0.822	S	S	*	*			trans	-102.8	104.2	162.5	30.9	171.3	0	0	0	106.7
77	S	24	Very low	23.7	Very low	105 Å²	105	128.6 Å²	128.6	73%	0.734	82%	0.824	S	S	*	*			trans	-51.8	134.9	164.9	46.1	0	0	0	0	111.6	G79	S77-G79 PolarHBondContact O-N 3.12Å
78	S	22.6	Very low	23.5	Very low	123 Å²	123	123.7 Å²	123.7	86%	0.86	82%	0.816	S	S	*	*			trans	-42.5	125.2	150.2	47.2	0	0	0	0	111.8
79	G	23.9	Very low	23.5	Very low	74 Å²	74	126.3 Å²	126.3	76%	0.763	82%	0.824	S	S	*	*			trans	179.9	98.5	175.7	0	0	0	0	0	111.6	S77	S77-G79 PolarHBondContact O-N 3.12Å
80	S	21	Very low	23.6	Very low	125 Å²	125	123 Å²	123	87%	0.874	82%	0.824	S	S	*	*			trans	-62.1	169.1	-178.7	-53.5	0	0	0	0	114.9
81	A	25.3	Very low	23.6	Very low	95 Å²	95	126.6 Å²	126.6	79%	0.785	83%	0.829	S	S	*	*			trans	98.3	99	153.7	0	0	0	0	0	118.1
82	A	21.8	Very low	23.8	Very low	110 Å²	110	127.6 Å²	127.6	91%	0.909	84%	0.839	S	S	*	*				37.9	109.9	126.9	0	0	0	0	0	118.9
83	G	26.1	Very low	23.7	Very low	79 Å²	79	121.7 Å²	121.7	81%	0.814	84%	0.843	S	S	*	*			trans	-157.8	83.5	162.3	0	0	0	0	0	110.2
84	L	20.6	Very low	23.8	Very low	172 Å²	172	116.5 Å²	116.5	90%	0.901	83%	0.833	S	S	*	*			trans	-57.6	125.9	162.2	-79.2	147.2	0	0	0	109.4
85	V	28.6	Very low	24	Very low	143 Å²	143	121.1 Å²	121.1	87%	0.867	84%	0.841	S	S	*	*			trans	-158.1	125.5	138.4	176.8	0	0	0	0	109.3
86	N	22.4	Very low	24.1	Very low	166 Å²	166	121 Å²	121	89%	0.888	84%	0.84	S	S	*	*			trans	-59	131.4	167.1	-80.6	-31.9	0	0	0	111.9
87	G	27.1	Very low	24.3	Very low	80 Å²	80	118.7 Å²	118.7	83%	0.825	84%	0.836	S	S	*	*			trans	-150.2	92.4	174.4	0	0	0	0	0	111.1
88	S	23	Very low	24.2	Very low	108 Å²	108	119.2 Å²	119.2	76%	0.755	84%	0.84	S	S	*	*			trans	-71.2	150.2	177.5	53.3	0	0	0	0	113.7
89	S	23.5	Very low	24.4	Very low	124 Å²	124	119.3 Å²	119.3	87%	0.867	84%	0.838	S	S	*	*			trans	77.8	131.9	142.2	-49.9	0	0	0	0	120.5
90	G	26.1	Very low	24.4	Very low	71 Å²	71	121.6 Å²	121.6	73%	0.732	84%	0.84	S	S	*	*			trans	125.7	86	162.5	0	0	0	0	0	112
91	L	22.7	Very low	24.5	Very low	171 Å²	171	122.1 Å²	122.1	90%	0.895	84%	0.841	S	S	*	*				43.2	83.1	73	-78.3	172.6	0	0	0	114.4
92	L	28.1	Very low	24.5	Very low	179 Å²	179	120.8 Å²	120.8	94%	0.937	84%	0.836	S	S	*	*			trans	-159.1	116.5	144.3	-71.1	-177.3	0	0	0	104.7
93	G	22	Very low	24.6	Very low	85 Å²	85	119.1 Å²	119.1	88%	0.876	83%	0.83	S	S	*	*			cis	89.1	91.6	43.7	0	0	0	0	0	108.2
94	G	24.5	Very low	24.4	Very low	72 Å²	72	119 Å²	119	74%	0.742	83%	0.829	S	S	*	*			trans	159.1	99.1	170.8	0	0	0	0	0	117.1
95	N	26.3	Very low	24.6	Very low	170 Å²	170	116.3 Å²	116.3	91%	0.909	82%	0.82	S	S	*	*			trans	72.4	109.6	146.5	-68	6.3	0	0	0	120.7
96	S	23.1	Very low	24.7	Very low	119 Å²	119	117.3 Å²	117.3	83%	0.832	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-57.6	155.9	172.7	-56.4	0	0	0	0	114.9
97	P	27	Very low	25	Very low	121 Å²	121	120.5 Å²	120.5	79%	0.786	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-96.6	151.4	-171.6	28.6	-13.9	0	0	0	113.2
98	S	23.4	Very low	25.4	Very low	117 Å²	117	119.8 Å²	119.8	82%	0.818	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-91	127.5	168.5	-61.4	0	0	0	0	109.9
99	P	26.1	Very low	26.1	Very low	125 Å²	125	120 Å²	120	81%	0.812	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-96.7	125.4	-177.8	33.6	-28	0	0	0	112.2
100	C	23.6	Very low	27.1	Very low	122 Å²	122	116.7 Å²	116.7	82%	0.824	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-80.5	140	171.5	-59.7	0	0	0	0	111.2	G102	C100-G102 PolarHBondContact O-N 3.12Å; C100-G102 VanDerWaalsContact O-N 3.1Å
101	P	23.4	Very low	28.1	Very low	135 Å²	135	118.3 Å²	118.3	88%	0.877	78%	0.778	S	S	*	*			trans	-83.1	87	175.7	33	-29.6	0	0	0	109.7
102	G	25.5	Very low	29.6	Very low	67 Å²	67	114.6 Å²	114.6	69%	0.691	77%	0.765	S	S	*	*			trans	-76.1	129.5	168.9	0	0	0	0	0	110.6	C100 G104	C100-G102 PolarHBondContact O-N 3.12Å; C100-G102 VanDerWaalsContact O-N 3.1Å; G102-G104 PolarHBondContact O-N 2.96Å
103	G	22.6	Very low	31.1	Very low	76 Å²	76	109 Å²	109	78%	0.784	74%	0.74	S	S	*	*			trans	-49.3	121.1	172.5	0	0	0	0	0	110.9	T105	G103-T105 VanDerWaalsContact C-N 3.34Å; G103-T105 PolarHBondContact O-N 3.5Å
104	G	22.1	Very low	33.2	Very low	77 Å²	77	105.1 Å²	105.1	79%	0.794	70%	0.699	S	S	*	*			trans	-71.6	85.3	-176.7	0	0	0	0	0	111.4	G102 L106	G102-G104 PolarHBondContact O-N 2.96Å; G104-L106 PolarHBondContact O-N 3.45Å
105	T	26.4	Very low	35.2	Very low	115 Å²	115	106.8 Å²	106.8	71%	0.706	69%	0.69	S	S	*	*			trans	-64.1	117.5	139.6	44.1	0	0	0	0	105.3	G103 R107	G103-T105 VanDerWaalsContact C-N 3.34Å; G103-T105 PolarHBondContact O-N 3.5Å; T105-R107 PolarHBondContact O-N 2.98Å
106	L	29.6	Very low	37.2	Very low	164 Å²	164	105.2 Å²	105.2	86%	0.859	68%	0.682	S	S	*	*			trans	-59.3	95.6	172.4	-72.8	167.1	0	0	0	106.4	G104 G108	G104-L106 PolarHBondContact O-N 3.45Å; L106-G108 PolarHBondContact O-N 3.44Å
107	R	28.4	Very low	39.8	Very low	232 Å²	232	101.5 Å²	101.5	88%	0.875	65%	0.651	S	S	*	*			trans	-50.4	116.8	166.6	-77	-177.4	-172.5	-115.9	0.5	105.4	T105 S109	T105-R107 PolarHBondContact O-N 2.98Å; R107-S109 PolarHBondContact O-N 3.38Å; R107-S109 VanDerWaalsContact O-N 3.14Å
108	G	36.1	Very low	42.3	Very low	65 Å²	65	104.6 Å²	104.6	67%	0.67	65%	0.652	S	S	*	*			trans	-45	126.2	177.9	0	0	0	0	0	108.3	L106 S110	L106-G108 PolarHBondContact O-N 3.44Å; G108-S110 PolarHBondContact O-N 3.08Å
109	S	36.7	Very low	45.1	Very low	114 Å²	114	103.1 Å²	103.1	80%	0.797	64%	0.639	S	S	*	*			trans	-64.4	81.5	176.5	168	0	0	0	0	108	R107 H111	R107-S109 PolarHBondContact O-N 3.38Å; R107-S109 VanDerWaalsContact O-N 3.14Å; S109-H111 PolarHBondContact O-N 3.25Å; S109-H111 VanDerWaalsContact O-N 3.11Å
110	S	45.1	Very low	47.9	Very low	54 Å²	54	100.1 Å²	100.1	38%	0.378	62%	0.622	S	S	.	*			trans	-63	113.9	170.2	51.2	0	0	0	0	107	G108 I115	G108-S110 PolarHBondContact O-N 3.08Å; S110-I115 WeakPolarHBondContact OG-CD1 3.33Å
111	H	47.9	Very low	50.8	Low	104 Å²	104	97.7 Å²	97.7	48%	0.481	62%	0.617	S	S	.	*			trans	-53.3	132.3	171.6	-100.2	-89.5	0	0	0	108.5	S109 S113 V114	S109-H111 PolarHBondContact O-N 3.25Å; S109-H111 VanDerWaalsContact O-N 3.11Å; H111-S113 PolarHBondContact O-N 3.04Å; H111-V114 HydrophobicContact CB-CG2 3.81Å; H111-V114 WeakPolarHBondContact O-CA 3.01Å; H111-V114 VanDerWaalsContact O-CB 3.26Å; H111-V114 WeakPolarHBondContact O-CB 3.46Å; H111-V114 PolarHBondContact O-N 2.71Å
112	P	52.9	Low	53.9	Low	94 Å²	94	97.9 Å²	97.9	61%	0.61	60%	0.604	S	S	*	*	H	α-helix	trans	-56.8	-29.5	-176.6	17.2	-29	0	0	0	112.6	V114 I115 D116	P112-V114 PolarHBondContact O-N 2.87Å; P112-I115 PolarHBondContact O-N 3.33Å; P112-D116 PolarHBondContact O-N 3.26Å
113	S	59.5	Low	57	Low	60 Å²	60	100.2 Å²	100.2	42%	0.42	60%	0.6	S	S	.	*	H	α-helix	trans	-64.7	-20.9	173.3	57.4	0	0	0	0	115	H111	H111-S113 PolarHBondContact O-N 3.04Å
114	V	67.7	Low	60.2	Low	4 Å²	4	98.2 Å²	98.2	2%	0.024	57%	0.572	C	S	.	*	H	α-helix	trans	-81	-36.7	178.4	178.5	0	0	0	0	110.5	H111 P112 F117 Y145 Q147 Q148	H111-V114 HydrophobicContact CB-CG2 3.81Å; H111-V114 WeakPolarHBondContact O-CA 3.01Å; H111-V114 VanDerWaalsContact O-CB 3.26Å; H111-V114 WeakPolarHBondContact O-CB 3.46Å; H111-V114 PolarHBondContact O-N 2.71Å; P112-V114 PolarHBondContact O-N 2.87Å; V114-F117 WeakPolarHBondContact O-CD1 3.48Å; V114-Y145 HydrophobicContact CG1-CG 4.43Å; V114-Y145 HydrophobicContact CG2-CD1 3.92Å; V114-Y145 HydrophobicContact CG2-CE1 4.31Å; V114-Y145 HydrophobicContact CG2-CG 4.34Å; V114-Q147 HydrophobicContact CG1-CB 3.47Å; V114-Q147 VanDerWaalsContact CG1-CB 3.47Å; V114-Q147 HydrophobicContact CG1-CG 3.85Å; V114-Q148 PolarHBondContact O-NE2 3.49Å
115	I	66.4	Low	63.4	Low	108 Å²	108	98.9 Å²	98.9	55%	0.554	56%	0.558	S	S	*	*	H	α-helix	trans	-77.1	-48.9	178.2	-59.4	164.4	0	0	0	109.9	S110 P112 F117	S110-I115 WeakPolarHBondContact OG-CD1 3.33Å; P112-I115 PolarHBondContact O-N 3.33Å; I115-F117 PolarHBondContact O-N 3.49Å
116	D	68.5	Low	66.4	Low	136 Å²	136	93.5 Å²	93.5	73%	0.727	53%	0.525	S	S	*	.	S	Bend	trans	-96.7	40.7	-173.7	-63.9	-34.3	0	0	0	112.7	P112	P112-D116 PolarHBondContact O-N 3.26Å
117	F	76.4	Confident	69.3	Low	41 Å²	41	87.7 Å²	87.7	18%	0.18	50%	0.496	C	S	.	.			trans	-75.7	139	176.9	82.7	-84.9	0	0	0	110.9	V114 I115 P119 D141 A143 A144 Y145 Q148	V114-F117 WeakPolarHBondContact O-CD1 3.48Å; I115-F117 PolarHBondContact O-N 3.49Å; F117-P119 WeakPolarHBondContact O-CD 3.4Å; F117-D141 HydrophobicContact CE2-CB 4.25Å; F117-D141 HydrophobicContact CZ-CB 4.35Å; F117-A143 HydrophobicContact CD2-CB 3.95Å; F117-A143 HydrophobicContact CE2-CB 4.01Å; F117-A144 HydrophobicContact CZ-CB 4.48Å; F117-Y145 HydrophobicContact CB-CD2 4.25Å; F117-Y145 HydrophobicContact CB-CE2 3.79Å; F117-Y145 HydrophobicContact CG-CD2 4.33Å; F117-Y145 HydrophobicContact CG-CE2 4.31Å; F117-Q148 HydrophobicContact CE1-CG 4.14Å
118	K	80.7	Confident	72.4	Confident	187 Å²	187	76.7 Å²	76.7	81%	0.813	46%	0.455	S	S	*	.			trans	-70.6	114.7	173.5	-171.5	174.5	-178.7	176.9	0	109.3
119	P	82.2	Confident	74.9	Confident	85 Å²	85	76.3 Å²	76.3	55%	0.552	44%	0.44	S	S	*	.			trans	-61.5	143.3	177.9	-20.3	33.3	0	0	0	110.7	F117	F117-P119 WeakPolarHBondContact O-CD 3.4Å
120	S	85.3	Confident	77.4	Confident	63 Å²	63	71.1 Å²	71.1	44%	0.441	40%	0.402	S	S	.	.			trans	-73.3	-21.3	172.5	-177.6	0	0	0	0	112.1	K122 D141	S120-K122 PolarHBondContact O-N 3.05Å; S120-D141 WeakPolarHBondContact CB-OD1 3.5Å; S120-D141 VanDerWaalsContact N-CG 3.3Å; S120-D141 PolarHBondContact N-OD1 3.17Å; S120-D141 PolarHBondContact N-OD2 3.36Å
121	G	84.1	Confident	79.6	Confident	70 Å²	70	69 Å²	69	72%	0.722	39%	0.387	S	S	*	.	S	Bend	trans	74	7.6	-171.5	0	0	0	0	0	113.4	D141	G121-D141 PolarHBondContact N-OD2 3.46Å
122	K	88.4	Confident	81.4	Confident	139 Å²	139	66.8 Å²	66.8	60%	0.604	38%	0.379	S	S	*	.			trans	-116.7	118.7	176.3	-68.4	-172.9	178.5	-174.8	0	108	S120 K142	S120-K122 PolarHBondContact O-N 3.05Å; K122-K142 HydrophobicContact CB-CB 4.41Å; K122-K142 WeakPolarHBondContact O-CB 3.47Å; K122-K142 PolarHBondContact O-N 3.35Å
123	L	90.4	Very high	82.7	Confident	117 Å²	117	64.9 Å²	64.9	61%	0.613	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	149.4	173.9	-63.1	174.1	0	0	0	110.2	L140	L123-L140 CarbonylContact C-O 3.49Å; L123-L140 VanDerWaalsContact CA-O 3.28Å; L123-L140 WeakPolarHBondContact CA-O 3.41Å
124	V	89.9	Confident	83.9	Confident	33 Å²	33	64.5 Å²	64.5	20%	0.2	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	131.2	173.3	-176.7	0	0	0	0	106.7	L140 K142 W194	V124-L140 PolarHBondContact N-O 3.31Å; V124-L140 PolarHBondContact O-N 2.99Å; V124-L140 VanDerWaalsContact O-N 3.07Å; V124-K142 HydrophobicContact CG2-CB 3.88Å; V124-K142 HydrophobicContact CG2-CD 4.38Å; V124-K142 HydrophobicContact CG2-CG 4.04Å; V124-W194 HydrophobicContact CB-CD2 4.44Å; V124-W194 HydrophobicContact CG1-CD2 3.83Å; V124-W194 HydrophobicContact CG1-CE3 4.42Å; V124-W194 HydrophobicContact CG1-CG 3.86Å; V124-W194 HydrophobicContact CG1-CZ2 4.49Å; V124-W194 HydrophobicContact CG2-CZ2 4.48Å
125	D	88.7	Confident	84.9	Confident	92 Å²	92	68.2 Å²	68.2	49%	0.492	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	132.6	171.2	-60.8	-50.9	0	0	0	108.4	R139	D125-R139 VanDerWaalsContact OD1-CG 3.26Å; D125-R139 WeakPolarHBondContact OD1-CG 3.45Å; D125-R139 IonicContact OD1-CZ 3.84Å; D125-R139 IonicContact OD1-NE 2.91Å; D125-R139 PolarHBondContact OD1-NE 2.91Å; D125-R139 IonicContact OD1-NH2 3.93Å
126	C	90.2	Very high	85.9	Confident	1 Å²	1	68 Å²	68	1%	0.007	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	139.9	177.7	61.9	0	0	0	0	111.1	E137 F138 W194 F196	C126-E137 CarbonylContact O-C 3.59Å; C126-E137 WeakPolarHBondContact O-CA 3.34Å; C126-F138 PolarHBondContact N-O 2.87Å; C126-F138 PolarHBondContact O-N 2.85Å; C126-F138 VanDerWaalsContact SG-CB 3.6Å; C126-F138 PolarHBondContact SG-O 2.91Å; C126-W194 CarbonylContact C-O 3.58Å; C126-W194 WeakPolarHBondContact CA-O 3.21Å; C126-W194 HydrophobicContact CB-CB 3.56Å; C126-W194 HydrophobicContact CB-CD2 4.43Å; C126-W194 HydrophobicContact CB-CE3 3.89Å; C126-W194 HydrophobicContact CB-CG 4.37Å; C126-W194 WeakPolarHBondContact CB-O 3.26Å; C126-F196 HydrophobicContact CB-CD2 4.35Å; C126-F196 HydrophobicContact CB-CE2 4.1Å
127	T	90.7	Very high	87.1	Confident	43 Å²	43	68.8 Å²	68.8	26%	0.264	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	132.5	-177.5	9.6	0	0	0	0	110.1	T135 R136 E137 W194 F196	T127-T135 HydrophobicContact CG2-CG2 3.52Å; T127-R136 WeakPolarHBondContact CA-O 3.47Å; T127-E137 HydrophobicContact CG2-CG 3.82Å; T127-W194 PolarHBondContact N-O 2.97Å; T127-F196 PolarHBondContact O-N 2.94Å
128	V	92.4	Very high	87.9	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	121.4	177.5	-174.5	0	0	0	0	109.1	M130 T135 R136 F138 L149 V153 F196 F198	V128-M130 HydrophobicContact CB-CE 3.99Å; V128-M130 HydrophobicContact CG1-CE 3.93Å; V128-M130 HydrophobicContact CG1-SD 4.2Å; V128-T135 WeakPolarHBondContact O-CA 3.24Å; V128-R136 PolarHBondContact N-O 2.83Å; V128-R136 PolarHBondContact O-N 3.3Å; V128-F138 HydrophobicContact CB-CD2 4.3Å; V128-F138 HydrophobicContact CB-CE2 3.98Å; V128-F138 HydrophobicContact CG2-CD2 3.69Å; V128-F138 HydrophobicContact CG2-CE2 3.78Å; V128-L149 HydrophobicContact CG2-CD1 3.86Å; V128-V153 HydrophobicContact CG1-CG2 4.26Å; V128-V153 HydrophobicContact CG2-CG2 4.07Å; V128-F196 CarbonylContact C-O 3.6Å; V128-F196 VanDerWaalsContact CA-O 3.3Å; V128-F196 WeakPolarHBondContact CA-O 3.48Å; V128-F196 HydrophobicContact CG2-CB 4.14Å; V128-F198 HydrophobicContact CG1-CB 4.03Å
129	V	88.7	Confident	88.5	Confident	58 Å²	58	68 Å²	68	35%	0.352	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	124.7	168.2	-177.6	0	0	0	0	108.5	F196 E197 F198	V129-F196 PolarHBondContact N-O 3.33Å; V129-E197 HydrophobicContact CB-CG 4.24Å; V129-E197 WeakPolarHBondContact O-CA 3.29Å; V129-F198 PolarHBondContact O-N 3.13Å
130	M	90	Very high	89	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.02	36%	0.355	C	S	.	.			trans	-91.1	164.4	-178.9	-60.5	-64.1	171.2	0	0	111.3	V128 D132 G133 T134 R136 F138 V153 L157 F198	V128-M130 HydrophobicContact CB-CE 3.99Å; V128-M130 HydrophobicContact CG1-CE 3.93Å; V128-M130 HydrophobicContact CG1-SD 4.2Å; M130-D132 VanDerWaalsContact CB-OD1 3.29Å; M130-D132 WeakPolarHBondContact CB-OD1 3.38Å; M130-D132 PolarHBondContact O-N 3.31Å; M130-G133 WeakPolarHBondContact O-CA 3.17Å; M130-G133 PolarHBondContact O-N 3.09Å; M130-T134 VanDerWaalsContact CB-O 3.31Å; M130-T134 WeakPolarHBondContact CB-O 3.43Å; M130-T134 WeakPolarHBondContact CG-O 3.48Å; M130-T134 PolarHBondContact N-O 2.88Å; M130-R136 HydrophobicContact CE-CB 3.61Å; M130-R136 HydrophobicContact CE-CG 3.66Å; M130-R136 HydrophobicContact CG-CG 3.85Å; M130-F138 HydrophobicContact CE-CE2 3.52Å; M130-F138 HydrophobicContact CE-CZ 3.63Å; M130-V153 HydrophobicContact CE-CG1 4.01Å; M130-V153 HydrophobicContact CE-CG2 4.33Å; M130-V153 HydrophobicContact SD-CG1 4.02Å; M130-L157 HydrophobicContact SD-CD1 4.27Å; M130-L157 HydrophobicContact SD-CD2 4.05Å; M130-L157 HydrophobicContact SD-CG 4.49Å; M130-F198 HydrophobicContact SD-CB 4.21Å
131	L	91	Very high	89.3	Confident	10 Å²	10	62.7 Å²	62.7	5%	0.052	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-18.8	178.5	-73.1	170.4	0	0	0	114.5	F165 F198 V200 Y218 L221 Q222	L131-F165 HydrophobicContact CD1-CD1 4.43Å; L131-F165 HydrophobicContact CD1-CE1 4.22Å; L131-F198 HydrophobicContact CD1-CD1 3.93Å; L131-F198 HydrophobicContact CD1-CE1 3.98Å; L131-F198 WeakPolarHBondContact CD2-O 3.25Å; L131-F198 HydrophobicContact CG-CD1 4.07Å; L131-F198 WeakPolarHBondContact CG-O 3.28Å; L131-V200 HydrophobicContact CD1-CG2 4.32Å; L131-Y218 HydrophobicContact CB-CD1 4.05Å; L131-Y218 HydrophobicContact CD1-CD1 3.93Å; L131-Y218 HydrophobicContact CD1-CG 4.37Å; L131-L221 HydrophobicContact CB-CB 4.01Å; L131-L221 HydrophobicContact CB-CD1 4.18Å; L131-Q222 HydrophobicContact CD2-CB 3.9Å; L131-Q222 HydrophobicContact CD2-CG 4.49Å; L131-Q222 VanDerWaalsContact CD2-OE1 3.26Å
132	D	84.7	Confident	89.6	Confident	58 Å²	58	64.6 Å²	64.6	31%	0.31	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	4.6	172.1	62.6	9.2	0	0	0	112.6	M130 T134 L221	M130-D132 VanDerWaalsContact CB-OD1 3.29Å; M130-D132 WeakPolarHBondContact CB-OD1 3.38Å; M130-D132 PolarHBondContact O-N 3.31Å; D132-T134 PolarHBondContact O-N 2.96Å; D132-T134 VanDerWaalsContact OD1-CB 3.3Å; D132-T134 WeakPolarHBondContact OD1-CB 3.28Å; D132-T134 WeakPolarHBondContact OD1-CG2 3.31Å; D132-T134 PolarHBondContact OD1-N 3.04Å; D132-T134 PolarHBondContact OD1-OG1 3.22Å; D132-T134 PolarHBondContact OD2-OG1 3.29Å; D132-L221 HydrophobicContact CB-CD1 4.13Å
133	G	80.9	Confident	89.8	Confident	54 Å²	54	58.6 Å²	58.6	56%	0.557	30%	0.304	S	S	*	.	S	Bend	trans	80.5	-3.7	-177.1	0	0	0	0	0	114.3	M130	M130-G133 WeakPolarHBondContact O-CA 3.17Å; M130-G133 PolarHBondContact O-N 3.09Å
134	T	85.1	Confident	89.9	Confident	51 Å²	51	53.1 Å²	53.1	31%	0.313	28%	0.275	S	S	.	.			trans	-79.3	140.3	178.7	68.2	0	0	0	0	111.4	M130 D132	M130-T134 VanDerWaalsContact CB-O 3.31Å; M130-T134 WeakPolarHBondContact CB-O 3.43Å; M130-T134 WeakPolarHBondContact CG-O 3.48Å; M130-T134 PolarHBondContact N-O 2.88Å; D132-T134 PolarHBondContact O-N 2.96Å; D132-T134 VanDerWaalsContact OD1-CB 3.3Å; D132-T134 WeakPolarHBondContact OD1-CB 3.28Å; D132-T134 WeakPolarHBondContact OD1-CG2 3.31Å; D132-T134 PolarHBondContact OD1-N 3.04Å; D132-T134 PolarHBondContact OD1-OG1 3.22Å; D132-T134 PolarHBondContact OD2-OG1 3.29Å
135	T	87.6	Confident	90.2	Very high	83 Å²	83	53.1 Å²	53.1	51%	0.509	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	130.7	172.9	-56.3	0	0	0	0	109.8	T127 V128	T127-T135 HydrophobicContact CG2-CG2 3.52Å; V128-T135 WeakPolarHBondContact O-CA 3.24Å
136	R	88.2	Confident	90.4	Very high	104 Å²	104	48.8 Å²	48.8	39%	0.392	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	140.8	177.1	-58.7	-64.9	-177.6	166.9	0.9	111.1	T127 V128 M130 F138	T127-R136 WeakPolarHBondContact CA-O 3.47Å; V128-R136 PolarHBondContact N-O 2.83Å; V128-R136 PolarHBondContact O-N 3.3Å; M130-R136 HydrophobicContact CE-CB 3.61Å; M130-R136 HydrophobicContact CE-CG 3.66Å; M130-R136 HydrophobicContact CG-CG 3.85Å; R136-F138 HydrophobicContact CB-CE2 3.82Å; R136-F138 HydrophobicContact CB-CZ 4.27Å
137	E	92.7	Very high	90.7	Very high	152 Å²	152	50.3 Å²	50.3	71%	0.71	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	136.2	176.5	-66.3	-179.4	177.8	0	0	110.8	C126 T127	C126-E137 CarbonylContact O-C 3.59Å; C126-E137 WeakPolarHBondContact O-CA 3.34Å; T127-E137 HydrophobicContact CG2-CG 3.82Å
138	F	93.5	Very high	90.8	Very high	26 Å²	26	50.2 Å²	50.2	11%	0.114	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	151.1	173.4	-60.6	-94.9	0	0	0	109.8	C126 V128 M130 R136 L149 A152 V153 H156	C126-F138 PolarHBondContact N-O 2.87Å; C126-F138 PolarHBondContact O-N 2.85Å; C126-F138 VanDerWaalsContact SG-CB 3.6Å; C126-F138 PolarHBondContact SG-O 2.91Å; V128-F138 HydrophobicContact CB-CD2 4.3Å; V128-F138 HydrophobicContact CB-CE2 3.98Å; V128-F138 HydrophobicContact CG2-CD2 3.69Å; V128-F138 HydrophobicContact CG2-CE2 3.78Å; M130-F138 HydrophobicContact CE-CE2 3.52Å; M130-F138 HydrophobicContact CE-CZ 3.63Å; R136-F138 HydrophobicContact CB-CE2 3.82Å; R136-F138 HydrophobicContact CB-CZ 4.27Å; F138-L149 HydrophobicContact CB-CD1 4.32Å; F138-L149 HydrophobicContact CD2-CD1 4.32Å; F138-L149 HydrophobicContact CG-CD1 4.36Å; F138-A152 HydrophobicContact CD1-CB 3.9Å; F138-A152 HydrophobicContact CE1-CB 4.18Å; F138-V153 HydrophobicContact CD2-CG2 4.35Å; F138-V153 HydrophobicContact CE1-CG2 4.26Å; F138-V153 HydrophobicContact CE2-CG2 3.72Å; F138-V153 HydrophobicContact CZ-CB 4.31Å; F138-V153 HydrophobicContact CZ-CG2 3.67Å; F138-H156 HydrophobicContact CE1-CB 4.09Å; F138-H156 HydrophobicContact CZ-CB 4.27Å
139	R	93.1	Very high	91.1	Very high	184 Å²	184	50.2 Å²	50.2	69%	0.694	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	116.1	175.3	-70.7	-167.5	167.2	161.4	5	110	D125	D125-R139 VanDerWaalsContact OD1-CG 3.26Å; D125-R139 WeakPolarHBondContact OD1-CG 3.45Å; D125-R139 IonicContact OD1-CZ 3.84Å; D125-R139 IonicContact OD1-NE 2.91Å; D125-R139 PolarHBondContact OD1-NE 2.91Å; D125-R139 IonicContact OD1-NH2 3.93Å
140	L	92.7	Very high	91.5	Very high	16 Å²	16	48.3 Å²	48.3	8%	0.084	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	150	-177.7	-64.2	177.6	0	0	0	111.3	L123 V124 A144 Q148 L149 I185 W194	L123-L140 CarbonylContact C-O 3.49Å; L123-L140 VanDerWaalsContact CA-O 3.28Å; L123-L140 WeakPolarHBondContact CA-O 3.41Å; V124-L140 PolarHBondContact N-O 3.31Å; V124-L140 PolarHBondContact O-N 2.99Å; V124-L140 VanDerWaalsContact O-N 3.07Å; L140-A144 HydrophobicContact CB-CB 4.23Å; L140-Q148 HydrophobicContact CD2-CB 4.31Å; L140-L149 HydrophobicContact CD1-CB 3.52Å; L140-L149 HydrophobicContact CD1-CD1 3.63Å; L140-L149 HydrophobicContact CD1-CG 4.05Å; L140-I185 HydrophobicContact CD1-CD1 3.99Å; L140-W194 HydrophobicContact CB-CZ3 4.3Å; L140-W194 HydrophobicContact CD1-CZ3 4.32Å
141	D	92.8	Very high	91.7	Very high	21 Å²	21	51.6 Å²	51.6	11%	0.112	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	141.1	170.4	-174.4	-84.3	0	0	0	109.9	F117 S120 G121 A143 A144	F117-D141 HydrophobicContact CE2-CB 4.25Å; F117-D141 HydrophobicContact CZ-CB 4.35Å; S120-D141 WeakPolarHBondContact CB-OD1 3.5Å; S120-D141 VanDerWaalsContact N-CG 3.3Å; S120-D141 PolarHBondContact N-OD1 3.17Å; S120-D141 PolarHBondContact N-OD2 3.36Å; G121-D141 PolarHBondContact N-OD2 3.46Å; D141-A143 PolarHBondContact O-N 2.75Å; D141-A143 WeakPolarHBondContact OD1-CA 3.3Å; D141-A143 VanDerWaalsContact OD1-CB 3.22Å; D141-A143 WeakPolarHBondContact OD1-CB 3.29Å; D141-A143 PolarHBondContact OD1-N 2.93Å; D141-A144 WeakPolarHBondContact O-CB 3.4Å; D141-A144 PolarHBondContact O-N 3.37Å
142	K	90.5	Very high	91.8	Very high	111 Å²	111	52.7 Å²	52.7	48%	0.483	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-23.1	179.9	-169.8	169.6	-177.3	169.7	0	113.4	K122 V124	K122-K142 HydrophobicContact CB-CB 4.41Å; K122-K142 WeakPolarHBondContact O-CB 3.47Å; K122-K142 PolarHBondContact O-N 3.35Å; V124-K142 HydrophobicContact CG2-CB 3.88Å; V124-K142 HydrophobicContact CG2-CD 4.38Å; V124-K142 HydrophobicContact CG2-CG 4.04Å
143	A	91.9	Very high	92.4	Very high	13 Å²	13	49.9 Å²	49.9	11%	0.107	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	2.5	175.2	0	0	0	0	0	114.1	F117 D141	F117-A143 HydrophobicContact CD2-CB 3.95Å; F117-A143 HydrophobicContact CE2-CB 4.01Å; D141-A143 PolarHBondContact O-N 2.75Å; D141-A143 WeakPolarHBondContact OD1-CA 3.3Å; D141-A143 VanDerWaalsContact OD1-CB 3.22Å; D141-A143 WeakPolarHBondContact OD1-CB 3.29Å; D141-A143 PolarHBondContact OD1-N 2.93Å
144	A	92.8	Very high	93.1	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.008	23%	0.228	C	C	.	.			trans	-60.3	148.4	-179.2	0	0	0	0	0	112.8	F117 L140 D141 Q148 K184 I185	F117-A144 HydrophobicContact CZ-CB 4.48Å; L140-A144 HydrophobicContact CB-CB 4.23Å; D141-A144 WeakPolarHBondContact O-CB 3.4Å; D141-A144 PolarHBondContact O-N 3.37Å; A144-Q148 HydrophobicContact CB-CB 4.29Å; A144-K184 WeakPolarHBondContact O-CA 3.4Å; A144-I185 PolarHBondContact O-N 3.11Å
145	Y	95.1	Very high	93.4	Very high	34 Å²	34	49 Å²	49	13%	0.133	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-92.6	163.4	172.9	-70.3	-114.9	0	0	0	109.9	V114 F117 Q147 Q148 D182 Q183 K184 I185	V114-Y145 HydrophobicContact CG1-CG 4.43Å; V114-Y145 HydrophobicContact CG2-CD1 3.92Å; V114-Y145 HydrophobicContact CG2-CE1 4.31Å; V114-Y145 HydrophobicContact CG2-CG 4.34Å; F117-Y145 HydrophobicContact CB-CD2 4.25Å; F117-Y145 HydrophobicContact CB-CE2 3.79Å; F117-Y145 HydrophobicContact CG-CD2 4.33Å; F117-Y145 HydrophobicContact CG-CE2 4.31Å; Y145-Q147 PolarHBondContact O-N 2.91Å; Y145-Q147 VanDerWaalsContact O-N 3.12Å; Y145-Q148 VanDerWaalsContact CA-OE1 3.3Å; Y145-Q148 VanDerWaalsContact CB-OE1 3.22Å; Y145-Q148 PolarHBondContact O-N 2.9Å; Y145-Q148 VanDerWaalsContact O-N 3.11Å; Y145-Q148 PolarHBondContact O-OE1 3.28Å; Y145-Q148 VanDerWaalsContact O-OE1 3.12Å; Y145-D182 VanDerWaalsContact CD1-C 3.48Å; Y145-D182 VanDerWaalsContact CD1-O 3.24Å; Y145-D182 WeakPolarHBondContact CD1-O 3.36Å; Y145-D182 VanDerWaalsContact CE1-O 3.29Å; Y145-D182 WeakPolarHBondContact CE1-O 3.33Å; Y145-Q183 VanDerWaalsContact CA-O 3.28Å; Y145-Q183 WeakPolarHBondContact CA-O 3.31Å; Y145-K184 HydrophobicContact CD1-CG 4.3Å; Y145-K184 HydrophobicContact CD2-CG 3.98Å; Y145-K184 HydrophobicContact CE1-CG 3.98Å; Y145-K184 HydrophobicContact CE2-CD 4.25Å; Y145-K184 HydrophobicContact CE2-CG 3.6Å; Y145-K184 HydrophobicContact CG-CG 4.29Å; Y145-K184 WeakPolarHBondContact OH-CE 3.34Å; Y145-I185 WeakPolarHBondContact O-CD1 3.27Å
146	G	94.6	Very high	93.6	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-55.1	-30.8	176.3	0	0	0	0	0	112.3	Q148 L149 F150 I181 Q183	G146-Q148 PolarHBondContact O-N 3.27Å; G146-L149 PolarHBondContact O-N 3.08Å; G146-F150 WeakPolarHBondContact O-CB 3.43Å; G146-F150 PolarHBondContact O-N 2.64Å; G146-I181 PolarHBondContact N-O 2.72Å; G146-Q183 PolarHBondContact N-O 2.78Å
147	Q	95.4	Very high	93.8	Very high	34 Å²	34	43.9 Å²	43.9	16%	0.159	21%	0.211	C	C	.	.	H	α-helix	trans	-56.2	-44	175.8	-169.1	67	57.5	0	0	113.4	V114 Y145 L149 F150 D151 I181	V114-Q147 HydrophobicContact CG1-CB 3.47Å; V114-Q147 VanDerWaalsContact CG1-CB 3.47Å; V114-Q147 HydrophobicContact CG1-CG 3.85Å; Y145-Q147 PolarHBondContact O-N 2.91Å; Y145-Q147 VanDerWaalsContact O-N 3.12Å; Q147-L149 PolarHBondContact O-N 2.75Å; Q147-F150 PolarHBondContact O-N 3.35Å; Q147-D151 PolarHBondContact NE2-OD1 3.41Å; Q147-D151 WeakPolarHBondContact O-CB 3.33Å; Q147-D151 VanDerWaalsContact O-CG 3.23Å; Q147-D151 PolarHBondContact O-N 3.34Å; Q147-I181 HydrophobicContact CB-CB 4.44Å; Q147-I181 WeakPolarHBondContact CB-O 3.48Å; Q147-I181 PolarHBondContact N-O 3.15Å
148	Q	94.2	Very high	93.7	Very high	41 Å²	41	37.4 Å²	37.4	19%	0.192	19%	0.185	C	C	.	.	H	α-helix	trans	-66.6	-38.8	-178.1	-75.8	77.4	25.8	0	0	112.2	V114 F117 L140 A144 Y145 G146 A152	V114-Q148 PolarHBondContact O-NE2 3.49Å; F117-Q148 HydrophobicContact CE1-CG 4.14Å; L140-Q148 HydrophobicContact CD2-CB 4.31Å; A144-Q148 HydrophobicContact CB-CB 4.29Å; Y145-Q148 VanDerWaalsContact CA-OE1 3.3Å; Y145-Q148 VanDerWaalsContact CB-OE1 3.22Å; Y145-Q148 PolarHBondContact O-N 2.9Å; Y145-Q148 VanDerWaalsContact O-N 3.11Å; Y145-Q148 PolarHBondContact O-OE1 3.28Å; Y145-Q148 VanDerWaalsContact O-OE1 3.12Å; G146-Q148 PolarHBondContact O-N 3.27Å; Q148-A152 VanDerWaalsContact O-CB 3.28Å; Q148-A152 WeakPolarHBondContact O-CB 3.37Å; Q148-A152 PolarHBondContact O-N 3.21Å
149	L	96.8	Very high	93.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64	-47.6	173.5	-178.5	59	0	0	0	110.4	V128 F138 L140 G146 Q147 D151 A152 V153 I167 L179 I185 F196	V128-L149 HydrophobicContact CG2-CD1 3.86Å; F138-L149 HydrophobicContact CB-CD1 4.32Å; F138-L149 HydrophobicContact CD2-CD1 4.32Å; F138-L149 HydrophobicContact CG-CD1 4.36Å; L140-L149 HydrophobicContact CD1-CB 3.52Å; L140-L149 HydrophobicContact CD1-CD1 3.63Å; L140-L149 HydrophobicContact CD1-CG 4.05Å; G146-L149 PolarHBondContact O-N 3.08Å; Q147-L149 PolarHBondContact O-N 2.75Å; L149-D151 PolarHBondContact O-N 2.89Å; L149-A152 PolarHBondContact O-N 2.88Å; L149-V153 HydrophobicContact CD1-CG2 4.2Å; L149-V153 HydrophobicContact CG-CG2 4.48Å; L149-V153 VanDerWaalsContact O-CG2 3.31Å; L149-V153 WeakPolarHBondContact O-CG2 3.42Å; L149-V153 PolarHBondContact O-N 2.76Å; L149-I167 HydrophobicContact CB-CD1 4.41Å; L149-I167 HydrophobicContact CD2-CD1 4.04Å; L149-I167 HydrophobicContact CD2-CG2 4.42Å; L149-I167 HydrophobicContact CG-CD1 3.79Å; L149-L179 HydrophobicContact CD2-CD2 4.01Å; L149-I185 HydrophobicContact CB-CD1 3.87Å; L149-I185 HydrophobicContact CD2-CD1 4.33Å; L149-F196 HydrophobicContact CD2-CB 4.42Å; L149-F196 HydrophobicContact CD2-CD1 4.14Å; L149-F196 HydrophobicContact CD2-CD2 3.56Å; L149-F196 HydrophobicContact CD2-CE1 4.38Å; L149-F196 HydrophobicContact CD2-CE2 3.78Å; L149-F196 HydrophobicContact CD2-CG 3.77Å; L149-F196 HydrophobicContact CD2-CZ 4.23Å
150	F	97.2	Very high	93.4	Very high	18 Å²	18	33.6 Å²	33.6	8%	0.079	18%	0.179	C	C	.	.	H	α-helix	trans	-59.6	-46.1	-179.9	-173.7	-102.1	0	0	0	112.5	G146 Q147 A152 V153 C154 V162 F165 I167 I181 F198	G146-F150 WeakPolarHBondContact O-CB 3.43Å; G146-F150 PolarHBondContact O-N 2.64Å; Q147-F150 PolarHBondContact O-N 3.35Å; F150-A152 PolarHBondContact O-N 3.38Å; F150-V153 PolarHBondContact O-N 3.01Å; F150-C154 WeakPolarHBondContact O-CB 3.35Å; F150-C154 PolarHBondContact O-N 3.09Å; F150-C154 PolarHBondContact O-SG 3.38Å; F150-V162 HydrophobicContact CE1-CB 3.97Å; F150-V162 HydrophobicContact CE1-CG2 4.2Å; F150-V162 HydrophobicContact CZ-CB 4.18Å; F150-V162 WeakPolarHBondContact CZ-O 3.45Å; F150-F165 HydrophobicContact CE2-CB 4.2Å; F150-F165 HydrophobicContact CZ-CB 4.31Å; F150-I167 HydrophobicContact CB-CD1 4.06Å; F150-I167 HydrophobicContact CD2-CD1 3.99Å; F150-I167 HydrophobicContact CD2-CG1 4.13Å; F150-I181 HydrophobicContact CB-CG2 4.45Å; F150-F198 HydrophobicContact CE2-CE2 4.14Å
151	D	95	Very high	93.4	Very high	73 Å²	73	33.9 Å²	33.9	39%	0.39	18%	0.18	S	C	.	.	H	α-helix	trans	-64.7	-39	177.5	-70.9	-14.5	0	0	0	111.9	Q147 L149 T155	Q147-D151 PolarHBondContact NE2-OD1 3.41Å; Q147-D151 WeakPolarHBondContact O-CB 3.33Å; Q147-D151 VanDerWaalsContact O-CG 3.23Å; Q147-D151 PolarHBondContact O-N 3.34Å; L149-D151 PolarHBondContact O-N 2.89Å; D151-T155 WeakPolarHBondContact O-CB 3.38Å; D151-T155 PolarHBondContact O-N 2.9Å; D151-T155 PolarHBondContact O-OG1 3.5Å
152	A	94.1	Very high	93.5	Very high	32 Å²	32	35 Å²	35	26%	0.264	19%	0.187	S	C	.	.	H	α-helix	trans	-64.7	-45.5	176.8	0	0	0	0	0	111.4	F138 Q148 L149 F150 T155 H156	F138-A152 HydrophobicContact CD1-CB 3.9Å; F138-A152 HydrophobicContact CE1-CB 4.18Å; Q148-A152 VanDerWaalsContact O-CB 3.28Å; Q148-A152 WeakPolarHBondContact O-CB 3.37Å; Q148-A152 PolarHBondContact O-N 3.21Å; L149-A152 PolarHBondContact O-N 2.88Å; F150-A152 PolarHBondContact O-N 3.38Å; A152-T155 PolarHBondContact O-N 2.97Å; A152-H156 WeakPolarHBondContact O-CB 3.37Å; A152-H156 PolarHBondContact O-N 3.26Å
153	V	96.4	Very high	93.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.2	-51.7	175.5	173.9	0	0	0	0	110.4	V128 M130 F138 L149 F150 T155 H156 L157 I167 F198	V128-V153 HydrophobicContact CG1-CG2 4.26Å; V128-V153 HydrophobicContact CG2-CG2 4.07Å; M130-V153 HydrophobicContact CE-CG1 4.01Å; M130-V153 HydrophobicContact CE-CG2 4.33Å; M130-V153 HydrophobicContact SD-CG1 4.02Å; F138-V153 HydrophobicContact CD2-CG2 4.35Å; F138-V153 HydrophobicContact CE1-CG2 4.26Å; F138-V153 HydrophobicContact CE2-CG2 3.72Å; F138-V153 HydrophobicContact CZ-CB 4.31Å; F138-V153 HydrophobicContact CZ-CG2 3.67Å; L149-V153 HydrophobicContact CD1-CG2 4.2Å; L149-V153 HydrophobicContact CG-CG2 4.48Å; L149-V153 VanDerWaalsContact O-CG2 3.31Å; L149-V153 WeakPolarHBondContact O-CG2 3.42Å; L149-V153 PolarHBondContact O-N 2.76Å; F150-V153 PolarHBondContact O-N 3.01Å; V153-T155 VanDerWaalsContact C-N 3.31Å; V153-T155 PolarHBondContact O-N 3.15Å; V153-H156 WeakPolarHBondContact O-CB 3.42Å; V153-H156 PolarHBondContact O-N 3.39Å; V153-H156 VanDerWaalsContact O-N 3.09Å; V153-L157 HydrophobicContact CG1-CD1 3.87Å; V153-L157 HydrophobicContact CG1-CG 4.32Å; V153-L157 WeakPolarHBondContact O-CG 3.29Å; V153-L157 PolarHBondContact O-N 2.98Å; V153-I167 HydrophobicContact CG2-CD1 4.29Å; V153-F198 HydrophobicContact CG1-CB 4.31Å; V153-F198 HydrophobicContact CG1-CD2 3.55Å; V153-F198 HydrophobicContact CG1-CE2 3.9Å; V153-F198 HydrophobicContact CG1-CG 3.89Å
154	C	95	Very high	93.8	Very high	5 Å²	5	32.5 Å²	32.5	3%	0.034	18%	0.175	C	C	.	.	H	α-helix	trans	-61.1	-39.5	-179.9	-67.7	0	0	0	0	112.4	F150 L157 G158 L159 V162	F150-C154 WeakPolarHBondContact O-CB 3.35Å; F150-C154 PolarHBondContact O-N 3.09Å; F150-C154 PolarHBondContact O-SG 3.38Å; C154-L157 PolarHBondContact O-N 3.01Å; C154-G158 PolarHBondContact O-N 2.88Å; C154-L159 PolarHBondContact O-N 2.87Å; C154-V162 HydrophobicContact CB-CB 4.49Å; C154-V162 HydrophobicContact CB-CG1 3.62Å
155	T	92.5	Very high	94	Very high	80 Å²	80	32.8 Å²	32.8	49%	0.491	18%	0.176	S	C	.	.	H	α-helix	trans	-64.8	-40.3	175.3	-60.4	0	0	0	0	111.3	D151 A152 V153 G158	D151-T155 WeakPolarHBondContact O-CB 3.38Å; D151-T155 PolarHBondContact O-N 2.9Å; D151-T155 PolarHBondContact O-OG1 3.5Å; A152-T155 PolarHBondContact O-N 2.97Å; V153-T155 VanDerWaalsContact C-N 3.31Å; V153-T155 PolarHBondContact O-N 3.15Å; T155-G158 PolarHBondContact O-N 2.9Å
156	H	92.1	Very high	94.1	Very high	79 Å²	79	31.6 Å²	31.6	37%	0.366	17%	0.174	S	C	.	.	H	α-helix	trans	-67.3	-36.8	176.5	175.8	77.5	0	0	0	113.2	K51 F138 A152 V153	K51-H156 PolarHBondContact NZ-O 2.8Å; F138-H156 HydrophobicContact CE1-CB 4.09Å; F138-H156 HydrophobicContact CZ-CB 4.27Å; A152-H156 WeakPolarHBondContact O-CB 3.37Å; A152-H156 PolarHBondContact O-N 3.26Å; V153-H156 WeakPolarHBondContact O-CB 3.42Å; V153-H156 PolarHBondContact O-N 3.39Å; V153-H156 VanDerWaalsContact O-N 3.09Å
157	L	91.7	Very high	94.2	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-78	-15.3	174.4	-59.1	178.6	0	0	0	112.2	M130 V153 C154 L159 F198 Y218	M130-L157 HydrophobicContact SD-CD1 4.27Å; M130-L157 HydrophobicContact SD-CD2 4.05Å; M130-L157 HydrophobicContact SD-CG 4.49Å; V153-L157 HydrophobicContact CG1-CD1 3.87Å; V153-L157 HydrophobicContact CG1-CG 4.32Å; V153-L157 WeakPolarHBondContact O-CG 3.29Å; V153-L157 PolarHBondContact O-N 2.98Å; C154-L157 PolarHBondContact O-N 3.01Å; L157-L159 VanDerWaalsContact C-N 3.3Å; L157-L159 HydrophobicContact CB-CD1 4.02Å; L157-L159 HydrophobicContact CB-CG 4Å; L157-L159 HydrophobicContact CD1-CD1 3.93Å; L157-F198 HydrophobicContact CD1-CD1 3.7Å; L157-F198 HydrophobicContact CD1-CE1 3.37Å; L157-F198 HydrophobicContact CD1-CE2 4.46Å; L157-F198 HydrophobicContact CD1-CG 4.37Å; L157-F198 HydrophobicContact CD1-CZ 3.79Å; L157-Y218 HydrophobicContact CB-CE2 4.2Å; L157-Y218 HydrophobicContact CD1-CE1 4.47Å; L157-Y218 HydrophobicContact CD2-CE1 4.31Å; L157-Y218 WeakPolarHBondContact CD2-OH 3.48Å
158	G	89.4	Confident	94.2	Very high	16 Å²	16	30.2 Å²	30.2	17%	0.165	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.2	19.1	-177	0	0	0	0	0	113.3	R58 C154 T155	R58-G158 PolarHBondContact NH1-O 3.41Å; R58-G158 PolarHBondContact NH2-O 2.84Å; C154-G158 PolarHBondContact O-N 2.88Å; T155-G158 PolarHBondContact O-N 2.9Å
159	L	92.2	Very high	94.1	Very high	9 Å²	9	29.3 Å²	29.3	5%	0.047	16%	0.163	C	C	.	.			trans	-71.1	135.1	-177.8	-73.3	168.6	0	0	0	112.2	C154 L157 V162 F165 F198 I214 Y218	C154-L159 PolarHBondContact O-N 2.87Å; L157-L159 VanDerWaalsContact C-N 3.3Å; L157-L159 HydrophobicContact CB-CD1 4.02Å; L157-L159 HydrophobicContact CB-CG 4Å; L157-L159 HydrophobicContact CD1-CD1 3.93Å; L159-V162 HydrophobicContact CB-CG1 4.13Å; L159-V162 WeakPolarHBondContact O-CG1 3.31Å; L159-F165 HydrophobicContact CD1-CD2 3.94Å; L159-F165 HydrophobicContact CD1-CE1 4.49Å; L159-F165 HydrophobicContact CD1-CE2 3.79Å; L159-F165 HydrophobicContact CD1-CG 4.35Å; L159-F165 HydrophobicContact CD1-CZ 4.09Å; L159-F165 HydrophobicContact CD2-CE2 3.94Å; L159-F165 HydrophobicContact CD2-CZ 4.11Å; L159-F165 HydrophobicContact CG-CE2 4.42Å; L159-F198 HydrophobicContact CD1-CE1 4.05Å; L159-F198 HydrophobicContact CD1-CZ 3.68Å; L159-I214 HydrophobicContact CD2-CG1 4.44Å; L159-I214 HydrophobicContact CD2-CG2 4.28Å; L159-Y218 HydrophobicContact CD1-CD2 4.34Å; L159-Y218 HydrophobicContact CD2-CD2 3.67Å; L159-Y218 HydrophobicContact CD2-CE2 4.14Å; L159-Y218 HydrophobicContact CG-CD2 4.24Å; L159-Y218 HydrophobicContact CG-CE2 4.36Å
160	L	90	Very high	93.4	Very high	121 Å²	121	32.5 Å²	32.5	63%	0.634	18%	0.175	S	C	*	.	S	Bend	trans	-101.7	-40.4	170	-54.5	-178.8	0	0	0	112.1	V162 E212	L160-V162 PolarHBondContact O-N 2.88Å; L160-E212 WeakPolarHBondContact CA-OE2 3.4Å; L160-E212 VanDerWaalsContact CB-OE2 3.24Å; L160-E212 WeakPolarHBondContact CB-OE2 3.5Å; L160-E212 WeakPolarHBondContact CD1-OE1 3.42Å; L160-E212 VanDerWaalsContact CG-OE1 3.29Å; L160-E212 WeakPolarHBondContact CG-OE1 3.49Å; L160-E212 PolarHBondContact N-OE2 3.02Å
161	E	92.5	Very high	92.6	Very high	22 Å²	22	33.3 Å²	33.3	10%	0.103	18%	0.18	C	C	.	.			trans	-80.3	59.8	174.8	-62.1	179.4	121.9	0	0	111.2	E163 F164 I210 K211 E212 T215	E161-E163 VanDerWaalsContact C-OE2 3.3Å; E161-E163 WeakPolarHBondContact CA-OE2 3.2Å; E161-E163 PolarHBondContact O-N 3.44Å; E161-F164 HydrophobicContact CB-CD2 4.08Å; E161-F164 HydrophobicContact CB-CE2 4.05Å; E161-I210 WeakPolarHBondContact OE2-CG2 3.09Å; E161-K211 WeakPolarHBondContact OE1-CB 3.28Å; E161-K211 PolarHBondContact OE1-N 2.97Å; E161-K211 PolarHBondContact OE2-N 3.43Å; E161-K211 VanDerWaalsContact OE2-N 3.15Å; E161-E212 HydrophobicContact CG-CG 4.09Å; E161-E212 PolarHBondContact N-OE2 2.78Å; E161-E212 WeakPolarHBondContact OE2-CB 3.35Å; E161-E212 PolarHBondContact OE2-N 3.4Å; E161-T215 HydrophobicContact CB-CG2 4.15Å; E161-T215 PolarHBondContact OE2-OG1 2.71Å
162	V	94.6	Very high	91.8	Very high	44 Å²	44	34.7 Å²	34.7	27%	0.267	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-67.1	-17.6	-173.5	-58.8	0	0	0	0	113	F150 C154 L159 L160 F164 F165	F150-V162 HydrophobicContact CE1-CB 3.97Å; F150-V162 HydrophobicContact CE1-CG2 4.2Å; F150-V162 HydrophobicContact CZ-CB 4.18Å; F150-V162 WeakPolarHBondContact CZ-O 3.45Å; C154-V162 HydrophobicContact CB-CB 4.49Å; C154-V162 HydrophobicContact CB-CG1 3.62Å; L159-V162 HydrophobicContact CB-CG1 4.13Å; L159-V162 WeakPolarHBondContact O-CG1 3.31Å; L160-V162 PolarHBondContact O-N 2.88Å; V162-F164 PolarHBondContact O-N 3.15Å; V162-F164 VanDerWaalsContact O-N 3.11Å; V162-F165 PolarHBondContact O-N 3.12Å; V162-F165 VanDerWaalsContact O-N 3.14Å
163	E	91.8	Very high	90.8	Very high	66 Å²	66	37.3 Å²	37.3	31%	0.308	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-64.3	-19.1	-172.7	68	-97.1	-144.4	0	0	114.7	E161 F165 F202 F402 R406	E161-E163 VanDerWaalsContact C-OE2 3.3Å; E161-E163 WeakPolarHBondContact CA-OE2 3.2Å; E161-E163 PolarHBondContact O-N 3.44Å; E163-F165 VanDerWaalsContact C-N 3.3Å; E163-F202 WeakPolarHBondContact O-CD2 3.3Å; E163-F402 HydrophobicContact CB-CE2 4.03Å; E163-F402 HydrophobicContact CG-CE2 3.75Å; E163-F402 HydrophobicContact CG-CZ 4.23Å; E163-R406 IonicContact OE1-CZ 3.87Å; E163-R406 IonicContact OE1-NH2 3.21Å; E163-R406 PolarHBondContact OE1-NH2 2.82Å
164	F	95.4	Very high	89.7	Confident	6 Å²	6	39.5 Å²	39.5	3%	0.026	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-78.5	-14.7	179	-64.8	-76.1	0	0	0	113.4	E161 V162 K201 F202 P204 I210 T215 F402	E161-F164 HydrophobicContact CB-CD2 4.08Å; E161-F164 HydrophobicContact CB-CE2 4.05Å; V162-F164 PolarHBondContact O-N 3.15Å; V162-F164 VanDerWaalsContact O-N 3.11Å; F164-K201 PolarHBondContact O-N 2.97Å; F164-F202 WeakPolarHBondContact CD1-O 3.43Å; F164-F202 PolarHBondContact O-N 3.27Å; F164-P204 HydrophobicContact CD1-CG 4.39Å; F164-P204 HydrophobicContact CE1-CB 4.09Å; F164-P204 HydrophobicContact CE1-CG 4Å; F164-I210 HydrophobicContact CZ-CG1 4.4Å; F164-T215 HydrophobicContact CD2-CG2 3.84Å; F164-T215 HydrophobicContact CE2-CG2 4.32Å; F164-F402 HydrophobicContact CD1-CE1 4.43Å; F164-F402 AromaticContact CD1-CZ 3.81Å; F164-F402 HydrophobicContact CD1-CZ 3.81Å; F164-F402 HydrophobicContact CE1-CE1 4.3Å; F164-F402 AromaticContact CE1-CZ 3.77Å; F164-F402 HydrophobicContact CE1-CZ 3.77Å
165	F	97.5	Very high	88.9	Confident	8 Å²	8	41.3 Å²	41.3	4%	0.035	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	164.1	-168.3	-56.5	-84.4	0	0	0	112.6	L131 F150 L159 V162 E163 F198 Q199 V200 T215	L131-F165 HydrophobicContact CD1-CD1 4.43Å; L131-F165 HydrophobicContact CD1-CE1 4.22Å; F150-F165 HydrophobicContact CE2-CB 4.2Å; F150-F165 HydrophobicContact CZ-CB 4.31Å; L159-F165 HydrophobicContact CD1-CD2 3.94Å; L159-F165 HydrophobicContact CD1-CE1 4.49Å; L159-F165 HydrophobicContact CD1-CE2 3.79Å; L159-F165 HydrophobicContact CD1-CG 4.35Å; L159-F165 HydrophobicContact CD1-CZ 4.09Å; L159-F165 HydrophobicContact CD2-CE2 3.94Å; L159-F165 HydrophobicContact CD2-CZ 4.11Å; L159-F165 HydrophobicContact CG-CE2 4.42Å; V162-F165 PolarHBondContact O-N 3.12Å; V162-F165 VanDerWaalsContact O-N 3.14Å; E163-F165 VanDerWaalsContact C-N 3.3Å; F165-F198 HydrophobicContact CB-CE1 4.28Å; F165-F198 HydrophobicContact CB-CE2 3.62Å; F165-F198 HydrophobicContact CB-CZ 3.38Å; F165-F198 AromaticContact CD1-CE1 3.6Å; F165-F198 HydrophobicContact CD1-CE1 3.6Å; F165-F198 HydrophobicContact CD1-CE2 4.48Å; F165-F198 AromaticContact CD1-CZ 3.51Å; F165-F198 HydrophobicContact CD1-CZ 3.51Å; F165-F198 HydrophobicContact CD2-CZ 4.25Å; F165-F198 HydrophobicContact CE1-CE1 4.18Å; F165-F198 HydrophobicContact CE1-CZ 4.35Å; F165-F198 HydrophobicContact CG-CE1 4.05Å; F165-F198 HydrophobicContact CG-CE2 4.21Å; F165-F198 AromaticContact CG-CZ 3.44Å; F165-F198 HydrophobicContact CG-CZ 3.44Å; F165-F198 VanDerWaalsContact CG-CZ 3.44Å; F165-Q199 WeakPolarHBondContact CA-O 3.24Å; F165-V200 HydrophobicContact CD1-CG2 3.98Å; F165-V200 HydrophobicContact CE1-CG2 3.76Å; F165-T215 HydrophobicContact CE2-CG2 3.9Å; F165-T215 HydrophobicContact CZ-CG2 3.98Å
166	G	96.7	Very high	88.5	Confident	8 Å²	8	39.3 Å²	39.3	8%	0.082	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	177.3	173.8	0	0	0	0	0	111.3	F198 Q199	G166-F198 WeakPolarHBondContact O-CD2 3.21Å; G166-Q199 PolarHBondContact N-O 2.63Å; G166-Q199 PolarHBondContact O-N 2.65Å; G166-Q199 VanDerWaalsContact O-O 3.14Å
167	I	97.7	Very high	88.4	Confident	5 Å²	5	36.6 Å²	36.6	3%	0.026	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	136.4	173.9	-69.7	167.3	0	0	0	108	L149 F150 V153 L179 F196 E197 F198	L149-I167 HydrophobicContact CB-CD1 4.41Å; L149-I167 HydrophobicContact CD2-CD1 4.04Å; L149-I167 HydrophobicContact CD2-CG2 4.42Å; L149-I167 HydrophobicContact CG-CD1 3.79Å; F150-I167 HydrophobicContact CB-CD1 4.06Å; F150-I167 HydrophobicContact CD2-CD1 3.99Å; F150-I167 HydrophobicContact CD2-CG1 4.13Å; V153-I167 HydrophobicContact CG2-CD1 4.29Å; I167-L179 HydrophobicContact CB-CB 4.11Å; I167-L179 HydrophobicContact CB-CD2 4.14Å; I167-L179 HydrophobicContact CD1-CD2 4.49Å; I167-L179 HydrophobicContact CG2-CB 4.09Å; I167-L179 HydrophobicContact CG2-CD2 3.89Å; I167-L179 VanDerWaalsContact O-CB 3.31Å; I167-L179 WeakPolarHBondContact O-CB 3.24Å; I167-L179 PolarHBondContact O-N 2.93Å; I167-F196 HydrophobicContact CG2-CB 3.7Å; I167-F196 HydrophobicContact CG2-CD1 3.78Å; I167-F196 HydrophobicContact CG2-CG 4.03Å; I167-E197 CarbonylContact C-O 3.57Å; I167-E197 WeakPolarHBondContact CA-O 3.45Å; I167-F198 HydrophobicContact CG1-CD2 4.11Å
168	T	95.7	Very high	88.6	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	158.6	172.8	61.1	0	0	0	0	110.9	W176 F177 W178 F196 E197	T168-W176 HydrophobicContact CG2-CE3 3.81Å; T168-W176 HydrophobicContact CG2-CZ3 3.89Å; T168-F177 CarbonylContact C-O 3.58Å; T168-F177 VanDerWaalsContact CA-O 3.23Å; T168-F177 WeakPolarHBondContact CA-O 3.48Å; T168-W178 HydrophobicContact CG2-CD2 3.88Å; T168-W178 HydrophobicContact CG2-CE3 3.48Å; T168-W178 VanDerWaalsContact CG2-CE3 3.48Å; T168-W178 HydrophobicContact CG2-CH2 3.93Å; T168-W178 HydrophobicContact CG2-CZ2 4.3Å; T168-W178 HydrophobicContact CG2-CZ3 3.51Å; T168-F196 WeakPolarHBondContact O-CA 3.36Å; T168-E197 PolarHBondContact N-O 2.68Å; T168-E197 PolarHBondContact O-N 3.41Å; T168-E197 PolarHBondContact OG1-O 2.83Å
169	Y	91.3	Very high	88.9	Confident	22 Å²	22	37.1 Å²	37.1	9%	0.086	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	159.6	171.7	72.1	-84.3	0	0	0	110	W176 F177 L179 Q188 I189 F196	Y169-W176 CarbonylContact O-C 3.56Å; Y169-W176 VanDerWaalsContact O-CA 3.27Å; Y169-W176 WeakPolarHBondContact O-CA 3.43Å; Y169-F177 HydrophobicContact CD1-CB 4.37Å; Y169-F177 WeakPolarHBondContact CD1-O 3.42Å; Y169-F177 HydrophobicContact CE1-CB 3.81Å; Y169-F177 PolarHBondContact N-O 3.19Å; Y169-F177 PolarHBondContact O-N 2.95Å; Y169-L179 HydrophobicContact CD1-CB 4.3Å; Y169-L179 HydrophobicContact CD1-CD1 4.13Å; Y169-L179 HydrophobicContact CE1-CD1 4.25Å; Y169-Q188 HydrophobicContact CE1-CB 4.27Å; Y169-Q188 PolarHBondContact OH-O 3.04Å; Y169-Q188 VanDerWaalsContact OH-O 3.09Å; Y169-I189 HydrophobicContact CD2-CG2 3.78Å; Y169-I189 HydrophobicContact CE2-CG2 4.01Å; Y169-I189 HydrophobicContact CG-CG2 4.13Å; Y169-F196 HydrophobicContact CG-CE1 4.35Å
170	Y	83	Confident	89	Confident	67 Å²	67	39.1 Å²	39.1	26%	0.263	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	135.7	174.4	-66.4	-93.4	0	0	0	110.9	N175 W176 N481 G482	Y170-N175 WeakPolarHBondContact CA-O 3.5Å; Y170-W176 HydrophobicContact CD1-CB 3.9Å; Y170-W176 HydrophobicContact CE1-CB 3.62Å; Y170-W176 HydrophobicContact CG-CB 4.5Å; Y170-N481 HydrophobicContact CD1-CB 4.28Å; Y170-N481 VanDerWaalsContact CE1-C 3.44Å; Y170-N481 HydrophobicContact CE1-CB 3.65Å; Y170-N481 PolarHBondContact OH-O 3.08Å; Y170-G482 PolarHBondContact OH-N 3Å
171	D	80.3	Confident	89.2	Confident	34 Å²	34	37.1 Å²	37.1	18%	0.182	20%	0.196	C	C	.	.			trans	-82.9	179.2	172.9	81.8	-5.3	0	0	0	112.2	T173 N174 N175 F177	D171-T173 PolarHBondContact O-N 3.16Å; D171-T173 VanDerWaalsContact O-N 3.15Å; D171-T173 VanDerWaalsContact OD1-C 3.24Å; D171-T173 VanDerWaalsContact OD1-CA 3.25Å; D171-T173 WeakPolarHBondContact OD1-CA 3.43Å; D171-T173 WeakPolarHBondContact OD1-CB 3.21Å; D171-T173 PolarHBondContact OD1-N 2.98Å; D171-T173 PolarHBondContact OD1-OG1 3.1Å; D171-T173 PolarHBondContact OD2-OG1 2.89Å; D171-N174 PolarHBondContact O-N 2.78Å; D171-N174 PolarHBondContact OD1-N 3.06Å; D171-N174 VanDerWaalsContact OD1-N 3.09Å; D171-N175 PolarHBondContact N-O 3.42Å; D171-N175 PolarHBondContact OD1-N 3.14Å; D171-F177 HydrophobicContact CB-CD2 4.15Å; D171-F177 HydrophobicContact CB-CE2 3.87Å; D171-F177 WeakPolarHBondContact OD2-CE2 3.23Å
172	S	77.3	Confident	89.1	Confident	103 Å²	103	39.4 Å²	39.4	72%	0.72	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-11.9	178.9	60.2	0	0	0	0	114.2	N174 N192	S172-N174 VanDerWaalsContact C-N 3.33Å; S172-N192 PolarHBondContact N-ND2 2.99Å; S172-N192 VanDerWaalsContact N-ND2 3.15Å
173	T	74.7	Confident	89	Confident	86 Å²	86	41.6 Å²	41.6	53%	0.528	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	12.2	173.5	67.8	0	0	0	0	111.9	D171 N175	D171-T173 PolarHBondContact O-N 3.16Å; D171-T173 VanDerWaalsContact O-N 3.15Å; D171-T173 VanDerWaalsContact OD1-C 3.24Å; D171-T173 VanDerWaalsContact OD1-CA 3.25Å; D171-T173 WeakPolarHBondContact OD1-CA 3.43Å; D171-T173 WeakPolarHBondContact OD1-CB 3.21Å; D171-T173 PolarHBondContact OD1-N 2.98Å; D171-T173 PolarHBondContact OD1-OG1 3.1Å; D171-T173 PolarHBondContact OD2-OG1 2.89Å; T173-N175 PolarHBondContact O-N 2.98Å; T173-N175 PolarHBondContact OG1-ND2 3.2Å
174	N	72.3	Confident	89.2	Confident	46 Å²	46	41.5 Å²	41.5	25%	0.246	22%	0.215	C	C	.	.	S	Bend	trans	60.7	22.2	-177.9	-145.9	10.6	0	0	0	113.1	D171 S172 M480 N481	D171-N174 PolarHBondContact O-N 2.78Å; D171-N174 PolarHBondContact OD1-N 3.06Å; D171-N174 VanDerWaalsContact OD1-N 3.09Å; S172-N174 VanDerWaalsContact C-N 3.33Å; N174-M480 WeakPolarHBondContact ND2-CB 3.38Å; N174-M480 PolarHBondContact ND2-O 2.83Å; N174-M480 PolarHBondContact OD1-O 3.14Å; N174-N481 WeakPolarHBondContact O-CB 3.48Å; N174-N481 PolarHBondContact O-ND2 2.75Å
175	N	78.8	Confident	89.1	Confident	44 Å²	44	41.2 Å²	41.2	24%	0.235	21%	0.213	C	C	.	.			trans	-89.1	133.1	172.4	-76.1	-70.5	0	0	0	109.1	Y170 D171 T173 F177	Y170-N175 WeakPolarHBondContact CA-O 3.5Å; D171-N175 PolarHBondContact N-O 3.42Å; D171-N175 PolarHBondContact OD1-N 3.14Å; T173-N175 PolarHBondContact O-N 2.98Å; T173-N175 PolarHBondContact OG1-ND2 3.2Å; N175-F177 HydrophobicContact CB-CE2 3.59Å; N175-F177 HydrophobicContact CB-CZ 3.98Å; N175-F177 WeakPolarHBondContact O-CD2 3.33Å; N175-F177 VanDerWaalsContact O-CE2 3.24Å; N175-F177 WeakPolarHBondContact O-CE2 3.27Å
176	W	83.2	Confident	88.8	Confident	37 Å²	37	42.4 Å²	42.4	14%	0.14	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	147.1	175.9	76	-94.4	0	0	0	111.8	T168 Y169 Y170 W178 R391	T168-W176 HydrophobicContact CG2-CE3 3.81Å; T168-W176 HydrophobicContact CG2-CZ3 3.89Å; Y169-W176 CarbonylContact O-C 3.56Å; Y169-W176 VanDerWaalsContact O-CA 3.27Å; Y169-W176 WeakPolarHBondContact O-CA 3.43Å; Y170-W176 HydrophobicContact CD1-CB 3.9Å; Y170-W176 HydrophobicContact CE1-CB 3.62Å; Y170-W176 HydrophobicContact CG-CB 4.5Å; W176-W178 HydrophobicContact CH2-CZ2 4.5Å; W176-W178 AromaticContact CH2-NE1 3.57Å; W176-W178 AromaticContact CZ3-CD1 3.68Å; W176-W178 HydrophobicContact CZ3-CD2 4.16Å; W176-W178 AromaticContact CZ3-CE2 3.74Å; W176-W178 HydrophobicContact CZ3-CG 4.12Å; W176-W178 HydrophobicContact CZ3-CZ2 4.3Å; W176-W178 AromaticContact CZ3-NE1 3.44Å; W176-R391 WeakPolarHBondContact O-CD 3.48Å; W176-R391 PolarHBondContact O-NH1 3.06Å
177	F	90.5	Very high	88.6	Confident	23 Å²	23	49.8 Å²	49.8	10%	0.101	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	145.3	177.6	-64.3	-90.3	0	0	0	111.4	T168 Y169 D171 N175 L179 I387 L388 R391	T168-F177 CarbonylContact C-O 3.58Å; T168-F177 VanDerWaalsContact CA-O 3.23Å; T168-F177 WeakPolarHBondContact CA-O 3.48Å; Y169-F177 HydrophobicContact CD1-CB 4.37Å; Y169-F177 WeakPolarHBondContact CD1-O 3.42Å; Y169-F177 HydrophobicContact CE1-CB 3.81Å; Y169-F177 PolarHBondContact N-O 3.19Å; Y169-F177 PolarHBondContact O-N 2.95Å; D171-F177 HydrophobicContact CB-CD2 4.15Å; D171-F177 HydrophobicContact CB-CE2 3.87Å; D171-F177 WeakPolarHBondContact OD2-CE2 3.23Å; N175-F177 HydrophobicContact CB-CE2 3.59Å; N175-F177 HydrophobicContact CB-CZ 3.98Å; N175-F177 WeakPolarHBondContact O-CD2 3.33Å; N175-F177 VanDerWaalsContact O-CE2 3.24Å; N175-F177 WeakPolarHBondContact O-CE2 3.27Å; F177-L179 PolarHBondContact O-N 3.02Å; F177-I387 HydrophobicContact CE1-CG2 3.62Å; F177-I387 HydrophobicContact CZ-CG2 3.54Å; F177-L388 HydrophobicContact CZ-CD2 4.27Å; F177-R391 HydrophobicContact CD1-CB 4.14Å; F177-R391 HydrophobicContact CD1-CG 3.92Å; F177-R391 HydrophobicContact CE1-CB 3.98Å; F177-R391 HydrophobicContact CE1-CG 4.17Å
178	W	95	Very high	88.4	Confident	19 Å²	19	51 Å²	51	7%	0.072	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	125.6	164.2	-69.6	108.2	0	0	0	110.3	T168 W176 Q180 Q199 K201	T168-W178 HydrophobicContact CG2-CD2 3.88Å; T168-W178 HydrophobicContact CG2-CE3 3.48Å; T168-W178 VanDerWaalsContact CG2-CE3 3.48Å; T168-W178 HydrophobicContact CG2-CH2 3.93Å; T168-W178 HydrophobicContact CG2-CZ2 4.3Å; T168-W178 HydrophobicContact CG2-CZ3 3.51Å; W176-W178 HydrophobicContact CH2-CZ2 4.5Å; W176-W178 AromaticContact CH2-NE1 3.57Å; W176-W178 AromaticContact CZ3-CD1 3.68Å; W176-W178 HydrophobicContact CZ3-CD2 4.16Å; W176-W178 AromaticContact CZ3-CE2 3.74Å; W176-W178 HydrophobicContact CZ3-CG 4.12Å; W176-W178 HydrophobicContact CZ3-CZ2 4.3Å; W176-W178 AromaticContact CZ3-NE1 3.44Å; W178-Q180 PolarHBondContact O-N 2.99Å; W178-Q180 PolarHBondContact O-NE2 3.18Å; W178-Q199 HydrophobicContact CH2-CB 3.94Å; W178-Q199 HydrophobicContact CZ3-CB 4.18Å; W178-K201 HydrophobicContact CD2-CD 4.02Å; W178-K201 HydrophobicContact CD2-CG 4.15Å; W178-K201 HydrophobicContact CE3-CB 4.44Å; W178-K201 HydrophobicContact CE3-CD 4.01Å; W178-K201 HydrophobicContact CE3-CG 4.22Å; W178-K201 HydrophobicContact CH2-CB 3.67Å; W178-K201 HydrophobicContact CH2-CG 3.93Å; W178-K201 HydrophobicContact CZ2-CB 4.04Å; W178-K201 HydrophobicContact CZ2-CG 3.82Å; W178-K201 HydrophobicContact CZ3-CB 3.89Å; W178-K201 HydrophobicContact CZ3-CD 4.3Å; W178-K201 HydrophobicContact CZ3-CG 4.12Å
179	L	96	Very high	88	Confident	9 Å²	9	51.5 Å²	51.5	5%	0.047	26%	0.263	C	S	.	.			trans	-61.4	121.4	172.2	-173.8	68.2	0	0	0	109.4	L149 I167 Y169 F177 I181 I185 F196	L149-L179 HydrophobicContact CD2-CD2 4.01Å; I167-L179 HydrophobicContact CB-CB 4.11Å; I167-L179 HydrophobicContact CB-CD2 4.14Å; I167-L179 HydrophobicContact CD1-CD2 4.49Å; I167-L179 HydrophobicContact CG2-CB 4.09Å; I167-L179 HydrophobicContact CG2-CD2 3.89Å; I167-L179 VanDerWaalsContact O-CB 3.31Å; I167-L179 WeakPolarHBondContact O-CB 3.24Å; I167-L179 PolarHBondContact O-N 2.93Å; Y169-L179 HydrophobicContact CD1-CB 4.3Å; Y169-L179 HydrophobicContact CD1-CD1 4.13Å; Y169-L179 HydrophobicContact CE1-CD1 4.25Å; F177-L179 PolarHBondContact O-N 3.02Å; L179-I181 PolarHBondContact O-N 3.31Å; L179-I185 HydrophobicContact CD1-CG1 4.35Å; L179-I185 HydrophobicContact CD2-CG1 4.49Å; L179-F196 HydrophobicContact CD1-CE1 4.1Å; L179-F196 HydrophobicContact CD2-CD1 4.45Å; L179-F196 HydrophobicContact CD2-CE1 4.33Å
180	Q	94.9	Very high	87.7	Confident	51 Å²	51	52.8 Å²	52.8	24%	0.238	28%	0.283	C	S	.	.			trans	-77.6	114	176.4	-55.1	-60	-52.4	0	0	108.7	W178 D182 Q183 Q188	W178-Q180 PolarHBondContact O-N 2.99Å; W178-Q180 PolarHBondContact O-NE2 3.18Å; Q180-D182 VanDerWaalsContact C-N 3.26Å; Q180-D182 PolarHBondContact O-N 2.92Å; Q180-Q183 HydrophobicContact CB-CB 3.94Å; Q180-Q183 HydrophobicContact CB-CG 3.72Å; Q180-Q183 PolarHBondContact O-N 2.72Å; Q180-Q188 VanDerWaalsContact CB-OE1 3.27Å; Q180-Q188 PolarHBondContact O-NE2 3.37Å
181	I	93.3	Very high	87.7	Confident	79 Å²	79	60 Å²	60	41%	0.405	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-29.2	-175.1	56.3	175.1	0	0	0	112.9	G146 Q147 F150 L179 Q183	G146-I181 PolarHBondContact N-O 2.72Å; Q147-I181 HydrophobicContact CB-CB 4.44Å; Q147-I181 WeakPolarHBondContact CB-O 3.48Å; Q147-I181 PolarHBondContact N-O 3.15Å; F150-I181 HydrophobicContact CB-CG2 4.45Å; L179-I181 PolarHBondContact O-N 3.31Å; I181-Q183 VanDerWaalsContact C-N 3.34Å
182	D	91.1	Very high	87.8	Confident	69 Å²	69	61 Å²	61	37%	0.369	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	2.4	-178.7	70.1	-37.5	0	0	0	113.6	Y145 Q180	Y145-D182 VanDerWaalsContact CD1-C 3.48Å; Y145-D182 VanDerWaalsContact CD1-O 3.24Å; Y145-D182 WeakPolarHBondContact CD1-O 3.36Å; Y145-D182 VanDerWaalsContact CE1-O 3.29Å; Y145-D182 WeakPolarHBondContact CE1-O 3.33Å; Q180-D182 VanDerWaalsContact C-N 3.26Å; Q180-D182 PolarHBondContact O-N 2.92Å
183	Q	93.6	Very high	88.1	Confident	90 Å²	90	63 Å²	63	42%	0.421	32%	0.319	S	S	.	.	S	Bend	trans	-117.3	151.6	-179.5	-62.4	-91.6	-2.6	0	0	111.4	Y145 G146 Q180 I181 I185 Q188	Y145-Q183 VanDerWaalsContact CA-O 3.28Å; Y145-Q183 WeakPolarHBondContact CA-O 3.31Å; G146-Q183 PolarHBondContact N-O 2.78Å; Q180-Q183 HydrophobicContact CB-CB 3.94Å; Q180-Q183 HydrophobicContact CB-CG 3.72Å; Q180-Q183 PolarHBondContact O-N 2.72Å; I181-Q183 VanDerWaalsContact C-N 3.34Å; Q183-I185 PolarHBondContact O-N 2.78Å; Q183-Q188 HydrophobicContact CB-CG 4.15Å; Q183-Q188 PolarHBondContact O-NE2 2.98Å
184	K	94	Very high	88.9	Confident	64 Å²	64	60.2 Å²	60.2	28%	0.278	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-64.5	130.6	174.4	-69.3	-171.2	173.6	-172.3	0	111	A144 Y145 A186 K187 Q188	A144-K184 WeakPolarHBondContact O-CA 3.4Å; Y145-K184 HydrophobicContact CD1-CG 4.3Å; Y145-K184 HydrophobicContact CD2-CG 3.98Å; Y145-K184 HydrophobicContact CE1-CG 3.98Å; Y145-K184 HydrophobicContact CE2-CD 4.25Å; Y145-K184 HydrophobicContact CE2-CG 3.6Å; Y145-K184 HydrophobicContact CG-CG 4.29Å; Y145-K184 WeakPolarHBondContact OH-CE 3.34Å; K184-A186 VanDerWaalsContact C-N 3.33Å; K184-A186 PolarHBondContact O-N 3.14Å; K184-K187 HydrophobicContact CB-CB 4.42Å; K184-K187 HydrophobicContact CB-CD 4.4Å; K184-K187 HydrophobicContact CB-CG 4.19Å; K184-K187 PolarHBondContact O-N 3.11Å; K184-K187 VanDerWaalsContact O-N 3.08Å; K184-Q188 PolarHBondContact O-N 2.85Å
185	I	94.4	Very high	89.6	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-58.4	-47.7	-178.6	-63.5	171.3	0	0	0	110.4	L140 A144 Y145 L149 L179 Q183 K187 Q188 I189 W194 F196	L140-I185 HydrophobicContact CD1-CD1 3.99Å; A144-I185 PolarHBondContact O-N 3.11Å; Y145-I185 WeakPolarHBondContact O-CD1 3.27Å; L149-I185 HydrophobicContact CB-CD1 3.87Å; L149-I185 HydrophobicContact CD2-CD1 4.33Å; L179-I185 HydrophobicContact CD1-CG1 4.35Å; L179-I185 HydrophobicContact CD2-CG1 4.49Å; Q183-I185 PolarHBondContact O-N 2.78Å; I185-K187 PolarHBondContact O-N 3.22Å; I185-Q188 WeakPolarHBondContact O-CB 3.19Å; I185-Q188 PolarHBondContact O-N 3.42Å; I185-I189 HydrophobicContact CG2-CD1 4.26Å; I185-I189 HydrophobicContact CG2-CG2 4.31Å; I185-I189 PolarHBondContact O-N 3.14Å; I185-I189 VanDerWaalsContact O-N 3.13Å; I185-W194 HydrophobicContact CB-CE3 4.42Å; I185-W194 HydrophobicContact CB-CH2 3.67Å; I185-W194 HydrophobicContact CB-CZ2 4.26Å; I185-W194 HydrophobicContact CB-CZ3 3.77Å; I185-W194 HydrophobicContact CD1-CE3 4.41Å; I185-W194 HydrophobicContact CD1-CH2 4.33Å; I185-W194 HydrophobicContact CD1-CZ3 3.71Å; I185-W194 HydrophobicContact CG1-CZ3 4.34Å; I185-W194 HydrophobicContact CG2-CD2 4Å; I185-W194 HydrophobicContact CG2-CE3 3.67Å; I185-W194 HydrophobicContact CG2-CH2 3.69Å; I185-W194 HydrophobicContact CG2-CZ2 3.98Å; I185-W194 HydrophobicContact CG2-CZ3 3.52Å; I185-F196 HydrophobicContact CG2-CE1 4.26Å; I185-F196 HydrophobicContact CG2-CE2 4.39Å; I185-F196 HydrophobicContact CG2-CZ 3.53Å
186	A	92	Very high	90.3	Very high	33 Å²	33	60.5 Å²	60.5	27%	0.273	30%	0.297	S	S	.	.	H	α-helix	trans	-56.1	-26.9	179	0	0	0	0	0	114.2	K184 G190 W194	K184-A186 VanDerWaalsContact C-N 3.33Å; K184-A186 PolarHBondContact O-N 3.14Å; A186-G190 PolarHBondContact O-N 3.45Å; A186-W194 HydrophobicContact CB-CZ2 4.14Å
187	K	91.8	Very high	90.8	Very high	163 Å²	163	60.1 Å²	60.1	71%	0.709	30%	0.297	S	S	*	.	H	α-helix	trans	-80.8	-25.6	176.2	-72.3	-171.7	175.3	-174.2	0	113	K184 I185	K184-K187 HydrophobicContact CB-CB 4.42Å; K184-K187 HydrophobicContact CB-CD 4.4Å; K184-K187 HydrophobicContact CB-CG 4.19Å; K184-K187 PolarHBondContact O-N 3.11Å; K184-K187 VanDerWaalsContact O-N 3.08Å; I185-K187 PolarHBondContact O-N 3.22Å
188	Q	92.3	Very high	91.1	Very high	32 Å²	32	59 Å²	59	15%	0.15	29%	0.292	C	S	.	.	H	α-helix	trans	-83.8	-41.8	-176.7	-65.8	-176	75.5	0	0	111.7	Y169 Q180 Q183 K184 I185	Y169-Q188 HydrophobicContact CE1-CB 4.27Å; Y169-Q188 PolarHBondContact OH-O 3.04Å; Y169-Q188 VanDerWaalsContact OH-O 3.09Å; Q180-Q188 VanDerWaalsContact CB-OE1 3.27Å; Q180-Q188 PolarHBondContact O-NE2 3.37Å; Q183-Q188 HydrophobicContact CB-CG 4.15Å; Q183-Q188 PolarHBondContact O-NE2 2.98Å; K184-Q188 PolarHBondContact O-N 2.85Å; I185-Q188 WeakPolarHBondContact O-CB 3.19Å; I185-Q188 PolarHBondContact O-N 3.42Å
189	I	87.3	Confident	91.2	Very high	11 Å²	11	59.6 Å²	59.6	6%	0.056	30%	0.295	C	S	.	.	H	α-helix	trans	-92.4	-17.8	-177.6	72.1	169.6	0	0	0	113.5	Y169 I185 K191 N192 W194 F196	Y169-I189 HydrophobicContact CD2-CG2 3.78Å; Y169-I189 HydrophobicContact CE2-CG2 4.01Å; Y169-I189 HydrophobicContact CG-CG2 4.13Å; I185-I189 HydrophobicContact CG2-CD1 4.26Å; I185-I189 HydrophobicContact CG2-CG2 4.31Å; I185-I189 PolarHBondContact O-N 3.14Å; I185-I189 VanDerWaalsContact O-N 3.13Å; I189-K191 PolarHBondContact O-N 2.98Å; I189-N192 WeakPolarHBondContact O-CB 3.49Å; I189-N192 PolarHBondContact O-N 2.84Å; I189-W194 HydrophobicContact CD1-CB 4.39Å; I189-W194 HydrophobicContact CD1-CD2 3.91Å; I189-W194 HydrophobicContact CD1-CG 3.57Å; I189-F196 HydrophobicContact CG2-CE1 4.04Å; I189-F196 HydrophobicContact CG2-CZ 4.1Å
190	G	86.3	Confident	91.3	Very high	49 Å²	49	59.4 Å²	59.4	51%	0.505	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	-119.4	-177.6	0	0	0	0	0	113.2	A186	A186-G190 PolarHBondContact O-N 3.45Å
191	K	83.6	Confident	91.3	Very high	217 Å²	217	58.3 Å²	58.3	94%	0.943	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-0	-179.9	-67	-176	-179.3	178.8	0	113.3	I189	I189-K191 PolarHBondContact O-N 2.98Å
192	N	81.6	Confident	91.4	Very high	55 Å²	55	55.3 Å²	55.3	29%	0.294	27%	0.273	S	S	.	.	S	Bend	trans	-67.8	159	-179.8	-65.8	-1.2	0	0	0	111.1	S172 I189	S172-N192 PolarHBondContact N-ND2 2.99Å; S172-N192 VanDerWaalsContact N-ND2 3.15Å; I189-N192 WeakPolarHBondContact O-CB 3.49Å; I189-N192 PolarHBondContact O-N 2.84Å
193	E	83.8	Confident	91.6	Very high	147 Å²	147	53.2 Å²	53.2	69%	0.687	26%	0.26	S	S	*	.			trans	-63.3	149.1	170.7	-63.2	-172	171.1	0	0	111	Q195	E193-Q195 HydrophobicContact CB-CG 4.12Å; E193-Q195 PolarHBondContact O-N 2.86Å; E193-Q195 PolarHBondContact OE2-NE2 2.97Å
194	W	90.1	Very high	91.4	Very high	27 Å²	27	49.2 Å²	49.2	10%	0.102	24%	0.242	C	C	.	.			trans	-81.6	67.3	-177.2	-76.4	53.6	0	0	0	110.2	V124 C126 T127 L140 I185 A186 I189 F196	V124-W194 HydrophobicContact CB-CD2 4.44Å; V124-W194 HydrophobicContact CG1-CD2 3.83Å; V124-W194 HydrophobicContact CG1-CE3 4.42Å; V124-W194 HydrophobicContact CG1-CG 3.86Å; V124-W194 HydrophobicContact CG1-CZ2 4.49Å; V124-W194 HydrophobicContact CG2-CZ2 4.48Å; C126-W194 CarbonylContact C-O 3.58Å; C126-W194 WeakPolarHBondContact CA-O 3.21Å; C126-W194 HydrophobicContact CB-CB 3.56Å; C126-W194 HydrophobicContact CB-CD2 4.43Å; C126-W194 HydrophobicContact CB-CE3 3.89Å; C126-W194 HydrophobicContact CB-CG 4.37Å; C126-W194 WeakPolarHBondContact CB-O 3.26Å; T127-W194 PolarHBondContact N-O 2.97Å; L140-W194 HydrophobicContact CB-CZ3 4.3Å; L140-W194 HydrophobicContact CD1-CZ3 4.32Å; I185-W194 HydrophobicContact CB-CE3 4.42Å; I185-W194 HydrophobicContact CB-CH2 3.67Å; I185-W194 HydrophobicContact CB-CZ2 4.26Å; I185-W194 HydrophobicContact CB-CZ3 3.77Å; I185-W194 HydrophobicContact CD1-CE3 4.41Å; I185-W194 HydrophobicContact CD1-CH2 4.33Å; I185-W194 HydrophobicContact CD1-CZ3 3.71Å; I185-W194 HydrophobicContact CG1-CZ3 4.34Å; I185-W194 HydrophobicContact CG2-CD2 4Å; I185-W194 HydrophobicContact CG2-CE3 3.67Å; I185-W194 HydrophobicContact CG2-CH2 3.69Å; I185-W194 HydrophobicContact CG2-CZ2 3.98Å; I185-W194 HydrophobicContact CG2-CZ3 3.52Å; A186-W194 HydrophobicContact CB-CZ2 4.14Å; I189-W194 HydrophobicContact CD1-CB 4.39Å; I189-W194 HydrophobicContact CD1-CD2 3.91Å; I189-W194 HydrophobicContact CD1-CG 3.57Å; W194-F196 HydrophobicContact CB-CE2 3.83Å; W194-F196 HydrophobicContact CB-CZ 4.46Å; W194-F196 HydrophobicContact CD2-CE2 4.48Å; W194-F196 HydrophobicContact CE3-CE2 4.17Å; W194-F196 HydrophobicContact CE3-CZ 4.45Å; W194-F196 HydrophobicContact CG-CE2 4.4Å
195	Q	87.4	Confident	91.1	Very high	87 Å²	87	48.3 Å²	48.3	41%	0.407	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	129	178.3	-61.4	-174.2	-2.7	0	0	110.5	E193	E193-Q195 HydrophobicContact CB-CG 4.12Å; E193-Q195 PolarHBondContact O-N 2.86Å; E193-Q195 PolarHBondContact OE2-NE2 2.97Å
196	F	95.1	Very high	90.7	Very high	8 Å²	8	52.2 Å²	52.2	4%	0.035	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	161.6	-171.7	-60.5	-77.7	0	0	0	111.5	C126 T127 V128 V129 L149 I167 T168 Y169 L179 I185 I189 W194	C126-F196 HydrophobicContact CB-CD2 4.35Å; C126-F196 HydrophobicContact CB-CE2 4.1Å; T127-F196 PolarHBondContact O-N 2.94Å; V128-F196 CarbonylContact C-O 3.6Å; V128-F196 VanDerWaalsContact CA-O 3.3Å; V128-F196 WeakPolarHBondContact CA-O 3.48Å; V128-F196 HydrophobicContact CG2-CB 4.14Å; V129-F196 PolarHBondContact N-O 3.33Å; L149-F196 HydrophobicContact CD2-CB 4.42Å; L149-F196 HydrophobicContact CD2-CD1 4.14Å; L149-F196 HydrophobicContact CD2-CD2 3.56Å; L149-F196 HydrophobicContact CD2-CE1 4.38Å; L149-F196 HydrophobicContact CD2-CE2 3.78Å; L149-F196 HydrophobicContact CD2-CG 3.77Å; L149-F196 HydrophobicContact CD2-CZ 4.23Å; I167-F196 HydrophobicContact CG2-CB 3.7Å; I167-F196 HydrophobicContact CG2-CD1 3.78Å; I167-F196 HydrophobicContact CG2-CG 4.03Å; T168-F196 WeakPolarHBondContact O-CA 3.36Å; Y169-F196 HydrophobicContact CG-CE1 4.35Å; L179-F196 HydrophobicContact CD1-CE1 4.1Å; L179-F196 HydrophobicContact CD2-CD1 4.45Å; L179-F196 HydrophobicContact CD2-CE1 4.33Å; I185-F196 HydrophobicContact CG2-CE1 4.26Å; I185-F196 HydrophobicContact CG2-CE2 4.39Å; I185-F196 HydrophobicContact CG2-CZ 3.53Å; I189-F196 HydrophobicContact CG2-CE1 4.04Å; I189-F196 HydrophobicContact CG2-CZ 4.1Å; W194-F196 HydrophobicContact CB-CE2 3.83Å; W194-F196 HydrophobicContact CB-CZ 4.46Å; W194-F196 HydrophobicContact CD2-CE2 4.48Å; W194-F196 HydrophobicContact CE3-CE2 4.17Å; W194-F196 HydrophobicContact CE3-CZ 4.45Å; W194-F196 HydrophobicContact CG-CE2 4.4Å
197	E	92.9	Very high	90.5	Very high	30 Å²	30	50.7 Å²	50.7	14%	0.14	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	131.2	173.9	-170.5	-178.8	164.4	0	0	109.5	V129 I167 T168 Q199 Q225	V129-E197 HydrophobicContact CB-CG 4.24Å; V129-E197 WeakPolarHBondContact O-CA 3.29Å; I167-E197 CarbonylContact C-O 3.57Å; I167-E197 WeakPolarHBondContact CA-O 3.45Å; T168-E197 PolarHBondContact N-O 2.68Å; T168-E197 PolarHBondContact O-N 3.41Å; T168-E197 PolarHBondContact OG1-O 2.83Å; E197-Q199 HydrophobicContact CG-CG 4.01Å; E197-Q199 PolarHBondContact OE1-NE2 3.09Å; E197-Q199 PolarHBondContact OE2-NE2 2.87Å; E197-Q225 PolarHBondContact OE1-NE2 2.8Å; E197-Q225 VanDerWaalsContact OE1-NE2 3.16Å
198	F	96.8	Very high	90.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	124.2	176.1	-178.3	-105	0	0	0	109.4	V128 V129 M130 L131 F150 V153 L157 L159 F165 G166 I167	V128-F198 HydrophobicContact CG1-CB 4.03Å; V129-F198 PolarHBondContact O-N 3.13Å; M130-F198 HydrophobicContact SD-CB 4.21Å; L131-F198 HydrophobicContact CD1-CD1 3.93Å; L131-F198 HydrophobicContact CD1-CE1 3.98Å; L131-F198 WeakPolarHBondContact CD2-O 3.25Å; L131-F198 HydrophobicContact CG-CD1 4.07Å; L131-F198 WeakPolarHBondContact CG-O 3.28Å; F150-F198 HydrophobicContact CE2-CE2 4.14Å; V153-F198 HydrophobicContact CG1-CB 4.31Å; V153-F198 HydrophobicContact CG1-CD2 3.55Å; V153-F198 HydrophobicContact CG1-CE2 3.9Å; V153-F198 HydrophobicContact CG1-CG 3.89Å; L157-F198 HydrophobicContact CD1-CD1 3.7Å; L157-F198 HydrophobicContact CD1-CE1 3.37Å; L157-F198 HydrophobicContact CD1-CE2 4.46Å; L157-F198 HydrophobicContact CD1-CG 4.37Å; L157-F198 HydrophobicContact CD1-CZ 3.79Å; L159-F198 HydrophobicContact CD1-CE1 4.05Å; L159-F198 HydrophobicContact CD1-CZ 3.68Å; F165-F198 HydrophobicContact CB-CE1 4.28Å; F165-F198 HydrophobicContact CB-CE2 3.62Å; F165-F198 HydrophobicContact CB-CZ 3.38Å; F165-F198 AromaticContact CD1-CE1 3.6Å; F165-F198 HydrophobicContact CD1-CE1 3.6Å; F165-F198 HydrophobicContact CD1-CE2 4.48Å; F165-F198 AromaticContact CD1-CZ 3.51Å; F165-F198 HydrophobicContact CD1-CZ 3.51Å; F165-F198 HydrophobicContact CD2-CZ 4.25Å; F165-F198 HydrophobicContact CE1-CE1 4.18Å; F165-F198 HydrophobicContact CE1-CZ 4.35Å; F165-F198 HydrophobicContact CG-CE1 4.05Å; F165-F198 HydrophobicContact CG-CE2 4.21Å; F165-F198 AromaticContact CG-CZ 3.44Å; F165-F198 HydrophobicContact CG-CZ 3.44Å; F165-F198 VanDerWaalsContact CG-CZ 3.44Å; G166-F198 WeakPolarHBondContact O-CD2 3.21Å; I167-F198 HydrophobicContact CG1-CD2 4.11Å
199	Q	97.2	Very high	89.9	Confident	30 Å²	30	48.3 Å²	48.3	14%	0.14	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	158	-173.2	-68.7	-171.5	-8.9	0	0	112	F165 G166 W178 E197 K201	F165-Q199 WeakPolarHBondContact CA-O 3.24Å; G166-Q199 PolarHBondContact N-O 2.63Å; G166-Q199 PolarHBondContact O-N 2.65Å; G166-Q199 VanDerWaalsContact O-O 3.14Å; W178-Q199 HydrophobicContact CH2-CB 3.94Å; W178-Q199 HydrophobicContact CZ3-CB 4.18Å; E197-Q199 HydrophobicContact CG-CG 4.01Å; E197-Q199 PolarHBondContact OE1-NE2 3.09Å; E197-Q199 PolarHBondContact OE2-NE2 2.87Å; Q199-K201 PolarHBondContact O-N 3.37Å
200	V	97.1	Very high	90	Very high	5 Å²	5	48 Å²	48	3%	0.03	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	125.7	164.9	179.4	0	0	0	0	108.3	L131 F165 Y203 L219 Q222	L131-V200 HydrophobicContact CD1-CG2 4.32Å; F165-V200 HydrophobicContact CD1-CG2 3.98Å; F165-V200 HydrophobicContact CE1-CG2 3.76Å; V200-Y203 HydrophobicContact CB-CE2 4.18Å; V200-Y203 HydrophobicContact CG1-CD2 4.02Å; V200-Y203 HydrophobicContact CG1-CE2 3.92Å; V200-Y203 HydrophobicContact CG1-CG 4.36Å; V200-L219 HydrophobicContact CB-CD1 4.37Å; V200-L219 HydrophobicContact CG1-CD1 3.77Å; V200-L219 HydrophobicContact CG2-CD1 4Å; V200-Q222 HydrophobicContact CB-CB 4.1Å; V200-Q222 HydrophobicContact CB-CG 3.83Å; V200-Q222 HydrophobicContact CG2-CB 3.5Å; V200-Q222 VanDerWaalsContact CG2-CB 3.5Å; V200-Q222 HydrophobicContact CG2-CG 3.83Å
201	K	95.2	Very high	90	Very high	29 Å²	29	54 Å²	54	13%	0.126	26%	0.262	C	S	.	.			trans	-94.4	-36	178.9	-174.1	171.4	-178.9	-178.8	0	112.6	F164 W178 Q199 D398 H399	F164-K201 PolarHBondContact O-N 2.97Å; W178-K201 HydrophobicContact CD2-CD 4.02Å; W178-K201 HydrophobicContact CD2-CG 4.15Å; W178-K201 HydrophobicContact CE3-CB 4.44Å; W178-K201 HydrophobicContact CE3-CD 4.01Å; W178-K201 HydrophobicContact CE3-CG 4.22Å; W178-K201 HydrophobicContact CH2-CB 3.67Å; W178-K201 HydrophobicContact CH2-CG 3.93Å; W178-K201 HydrophobicContact CZ2-CB 4.04Å; W178-K201 HydrophobicContact CZ2-CG 3.82Å; W178-K201 HydrophobicContact CZ3-CB 3.89Å; W178-K201 HydrophobicContact CZ3-CD 4.3Å; W178-K201 HydrophobicContact CZ3-CG 4.12Å; Q199-K201 PolarHBondContact O-N 3.37Å; K201-D398 WeakPolarHBondContact CE-OD2 3.42Å; K201-D398 IonicContact NZ-OD2 3.27Å; K201-D398 PolarHBondContact NZ-OD2 2.75Å; K201-H399 PolarHBondContact O-NE2 3Å
202	F	95.6	Very high	90.3	Very high	16 Å²	16	44.9 Å²	44.9	7%	0.07	22%	0.222	C	C	.	.			trans	-126.4	117.8	-177.4	-53.8	-69.3	0	0	0	111	E163 F164 P204 D398 H399 F402 F403	E163-F202 WeakPolarHBondContact O-CD2 3.3Å; F164-F202 WeakPolarHBondContact CD1-O 3.43Å; F164-F202 PolarHBondContact O-N 3.27Å; F202-P204 WeakPolarHBondContact O-CD 3.45Å; F202-D398 HydrophobicContact CE1-CB 4.15Å; F202-D398 HydrophobicContact CZ-CB 4.05Å; F202-H399 AromaticContact CD1-CD2 3.98Å; F202-H399 AromaticContact CD1-CE1 3.99Å; F202-H399 AromaticContact CD1-NE2 3.91Å; F202-H399 AromaticContact CE1-ND1 3.8Å; F202-F402 HydrophobicContact CB-CD1 3.82Å; F202-F402 HydrophobicContact CB-CE1 3.63Å; F202-F402 HydrophobicContact CB-CE2 4.38Å; F202-F402 HydrophobicContact CB-CG 4.3Å; F202-F402 HydrophobicContact CB-CZ 3.93Å; F202-F402 HydrophobicContact CD1-CB 4.07Å; F202-F402 HydrophobicContact CD1-CD1 4.1Å; F202-F402 AromaticContact CD1-CG 4Å; F202-F402 HydrophobicContact CD1-CG 4Å; F202-F402 HydrophobicContact CD2-CD1 4.3Å; F202-F402 AromaticContact CD2-CD2 3.65Å; F202-F402 HydrophobicContact CD2-CD2 3.65Å; F202-F402 HydrophobicContact CD2-CE1 4.44Å; F202-F402 AromaticContact CD2-CE2 3.8Å; F202-F402 HydrophobicContact CD2-CE2 3.8Å; F202-F402 AromaticContact CD2-CG 3.91Å; F202-F402 HydrophobicContact CD2-CG 3.91Å; F202-F402 HydrophobicContact CD2-CZ 4.21Å; F202-F402 HydrophobicContact CE1-CB 3.92Å; F202-F402 HydrophobicContact CE1-CG 4.25Å; F202-F402 HydrophobicContact CE2-CB 4.39Å; F202-F402 AromaticContact CE2-CD2 3.83Å; F202-F402 HydrophobicContact CE2-CD2 3.83Å; F202-F402 HydrophobicContact CE2-CE2 4.34Å; F202-F402 HydrophobicContact CE2-CG 4.16Å; F202-F402 HydrophobicContact CG-CB 4.36Å; F202-F402 AromaticContact CG-CD1 3.82Å; F202-F402 HydrophobicContact CG-CD1 3.82Å; F202-F402 HydrophobicContact CG-CD2 4.02Å; F202-F402 HydrophobicContact CG-CE1 4.06Å; F202-F402 HydrophobicContact CG-CE2 4.23Å; F202-F402 AromaticContact CG-CG 3.8Å; F202-F402 HydrophobicContact CG-CG 3.8Å; F202-F402 HydrophobicContact CG-CZ 4.26Å; F202-F402 HydrophobicContact CZ-CB 4.07Å; F202-F402 HydrophobicContact CZ-CD2 4.35Å; F202-F402 HydrophobicContact CZ-CG 4.31Å; F202-F403 HydrophobicContact CB-CE2 4.22Å; F202-F403 HydrophobicContact CB-CZ 3.96Å; F202-F403 HydrophobicContact CD1-CE2 4.05Å
203	Y	95.9	Very high	90.6	Very high	24 Å²	24	43.5 Å²	43.5	9%	0.094	22%	0.215	C	C	.	.			trans	-93.7	112.5	-178.9	-68.5	-113.4	0	0	0	109.2	V200 L219 Q222 V223 D226 Y313 Y334 F403	V200-Y203 HydrophobicContact CB-CE2 4.18Å; V200-Y203 HydrophobicContact CG1-CD2 4.02Å; V200-Y203 HydrophobicContact CG1-CE2 3.92Å; V200-Y203 HydrophobicContact CG1-CG 4.36Å; Y203-L219 HydrophobicContact CD1-CD1 3.91Å; Y203-L219 HydrophobicContact CE1-CD1 4.2Å; Y203-Q222 HydrophobicContact CE1-CG 4.07Å; Y203-Q222 WeakPolarHBondContact OH-CG 3.47Å; Y203-V223 HydrophobicContact CD1-CG2 4.38Å; Y203-V223 HydrophobicContact CE1-CG2 4.05Å; Y203-D226 PolarHBondContact OH-OD2 3.29Å; Y203-Y313 HydrophobicContact CD1-CD2 4.45Å; Y203-Y313 HydrophobicContact CD1-CE1 4.49Å; Y203-Y313 AromaticContact CD1-CE2 3.96Å; Y203-Y313 HydrophobicContact CD1-CE2 3.96Å; Y203-Y313 AromaticContact CD1-CZ 3.99Å; Y203-Y334 WeakPolarHBondContact O-CB 3.45Å; Y203-F403 WeakPolarHBondContact O-CZ 3.31Å
204	P	89.6	Confident	91	Very high	6 Å²	6	36.5 Å²	36.5	4%	0.039	18%	0.183	C	C	.	.			trans	-70.7	140.5	177.7	27.6	-31.6	0	0	0	110.8	F164 F202 I210 L219 Y313	F164-P204 HydrophobicContact CD1-CG 4.39Å; F164-P204 HydrophobicContact CE1-CB 4.09Å; F164-P204 HydrophobicContact CE1-CG 4Å; F202-P204 WeakPolarHBondContact O-CD 3.45Å; P204-I210 HydrophobicContact CG-CD1 3.7Å; P204-I210 HydrophobicContact CG-CG1 3.89Å; P204-L219 HydrophobicContact CG-CD2 3.98Å; P204-Y313 WeakPolarHBondContact O-CE1 3.32Å; P204-Y313 PolarHBondContact O-OH 2.85Å; P204-Y313 VanDerWaalsContact O-OH 3.1Å
205	C	86.4	Confident	91.2	Very high	46 Å²	46	35.3 Å²	35.3	31%	0.311	18%	0.178	S	C	.	.	S	Bend	trans	-75.4	-36.6	169.8	-178.3	0	0	0	0	111.8	R308 Y334	C205-R308 VanDerWaalsContact O-CD 3.23Å; C205-R308 WeakPolarHBondContact O-CD 3.18Å; C205-R308 PolarHBondContact O-NH1 3.16Å; C205-Y334 HydrophobicContact CB-CD1 3.93Å; C205-Y334 HydrophobicContact CB-CD2 3.47Å; C205-Y334 VanDerWaalsContact CB-CD2 3.47Å; C205-Y334 HydrophobicContact CB-CE1 3.86Å; C205-Y334 HydrophobicContact CB-CE2 3.43Å; C205-Y334 VanDerWaalsContact CB-CE2 3.43Å; C205-Y334 HydrophobicContact CB-CG 3.76Å; C205-Y334 VanDerWaalsContact SG-CE2 3.54Å
206	D	86.4	Confident	91.5	Very high	82 Å²	82	32 Å²	32	44%	0.439	16%	0.162	S	C	.	.			trans	-94.2	101.2	176.9	-176.1	13.7	0	0	0	109	D208 S209	D206-D208 PolarHBondContact O-N 3.23Å; D206-D208 PolarHBondContact OD1-N 3.03Å; D206-S209 VanDerWaalsContact O-CB 3.31Å; D206-S209 WeakPolarHBondContact O-CB 3.49Å; D206-S209 PolarHBondContact O-N 2.75Å; D206-S209 PolarHBondContact O-OG 3.01Å
207	I	87.6	Confident	91.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-67.1	-32.6	-177.5	-55.3	-53.3	0	0	0	110.6	S209 I210 L304	I207-S209 PolarHBondContact O-N 2.9Å; I207-I210 WeakPolarHBondContact O-CB 3.44Å; I207-I210 PolarHBondContact O-N 3.23Å; I207-I210 VanDerWaalsContact O-N 3.15Å; I207-L304 HydrophobicContact CD1-CB 3.9Å; I207-L304 HydrophobicContact CG1-CB 3.94Å; I207-L304 HydrophobicContact CG2-CB 3.84Å; I207-L304 HydrophobicContact CG2-CD1 3.85Å
208	D	86.6	Confident	91.6	Very high	100 Å²	100	31.1 Å²	31.1	54%	0.535	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-73.1	-8.2	179.9	-56.1	-45.6	0	0	0	111.8	D206 I210	D206-D208 PolarHBondContact O-N 3.23Å; D206-D208 PolarHBondContact OD1-N 3.03Å; D208-I210 VanDerWaalsContact C-N 3.28Å
209	S	85.5	Confident	91.6	Very high	46 Å²	46	31.3 Å²	31.3	32%	0.322	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-74.1	-16.5	170.5	77.3	0	0	0	0	113.9	D206 I207	D206-S209 VanDerWaalsContact O-CB 3.31Å; D206-S209 WeakPolarHBondContact O-CB 3.49Å; D206-S209 PolarHBondContact O-N 2.75Å; D206-S209 PolarHBondContact O-OG 3.01Å; I207-S209 PolarHBondContact O-N 2.9Å
210	I	88.8	Confident	91.6	Very high	5 Å²	5	29.9 Å²	29.9	3%	0.026	15%	0.152	C	C	.	.			trans	-80.8	116.2	175.4	-55.2	171.9	0	0	0	108.4	E161 F164 P204 I207 D208 E212 T215 R216 L219	E161-I210 WeakPolarHBondContact OE2-CG2 3.09Å; F164-I210 HydrophobicContact CZ-CG1 4.4Å; P204-I210 HydrophobicContact CG-CD1 3.7Å; P204-I210 HydrophobicContact CG-CG1 3.89Å; I207-I210 WeakPolarHBondContact O-CB 3.44Å; I207-I210 PolarHBondContact O-N 3.23Å; I207-I210 VanDerWaalsContact O-N 3.15Å; D208-I210 VanDerWaalsContact C-N 3.28Å; I210-E212 WeakPolarHBondContact CG2-O 3.48Å; I210-T215 HydrophobicContact CG2-CG2 3.56Å; I210-R216 HydrophobicContact CG2-CB 4.36Å; I210-L219 HydrophobicContact CD1-CD2 3.48Å; I210-L219 VanDerWaalsContact CD1-CD2 3.48Å
211	K	87.6	Confident	91.5	Very high	174 Å²	174	30.4 Å²	30.4	76%	0.757	15%	0.154	S	C	*	.			trans	-83.9	-30.9	-174.6	-60.9	179.7	-179.6	180	0	112.9	E161	E161-K211 WeakPolarHBondContact OE1-CB 3.28Å; E161-K211 PolarHBondContact OE1-N 2.97Å; E161-K211 PolarHBondContact OE2-N 3.43Å; E161-K211 VanDerWaalsContact OE2-N 3.15Å
212	E	89.3	Confident	91.6	Very high	25 Å²	25	29.2 Å²	29.2	12%	0.117	15%	0.149	C	C	.	.			trans	-97.9	129.2	-177.8	-60.4	-161	113.6	0	0	112.4	R58 L160 E161 I210 I214 T215 R216	R58-E212 IonicContact CZ-OE1 3.89Å; R58-E212 IonicContact NE-OE1 3Å; R58-E212 PolarHBondContact NE-OE1 2.9Å; R58-E212 VanDerWaalsContact NH2-CD 3.29Å; R58-E212 IonicContact NH2-OE1 2.86Å; R58-E212 PolarHBondContact NH2-OE1 2.76Å; R58-E212 IonicContact NH2-OE2 3.32Å; R58-E212 PolarHBondContact NH2-OE2 3.34Å; L160-E212 WeakPolarHBondContact CA-OE2 3.4Å; L160-E212 VanDerWaalsContact CB-OE2 3.24Å; L160-E212 WeakPolarHBondContact CB-OE2 3.5Å; L160-E212 WeakPolarHBondContact CD1-OE1 3.42Å; L160-E212 VanDerWaalsContact CG-OE1 3.29Å; L160-E212 WeakPolarHBondContact CG-OE1 3.49Å; L160-E212 PolarHBondContact N-OE2 3.02Å; E161-E212 HydrophobicContact CG-CG 4.09Å; E161-E212 PolarHBondContact N-OE2 2.78Å; E161-E212 WeakPolarHBondContact OE2-CB 3.35Å; E161-E212 PolarHBondContact OE2-N 3.4Å; I210-E212 WeakPolarHBondContact CG2-O 3.48Å; E212-I214 HydrophobicContact CB-CG2 4.05Å; E212-I214 PolarHBondContact O-N 3.2Å; E212-T215 WeakPolarHBondContact O-CB 3.48Å; E212-T215 PolarHBondContact O-N 2.91Å; E212-T215 VanDerWaalsContact O-N 3.09Å; E212-R216 PolarHBondContact O-N 3.21Å; E212-R216 VanDerWaalsContact O-N 3.09Å
213	D	88.8	Confident	91.7	Very high	26 Å²	26	28.5 Å²	28.5	14%	0.139	15%	0.146	C	C	.	.	H	α-helix	trans	-64.8	-30.7	176.9	-53.4	-60.6	0	0	0	112.1	Y54 L57 R216 Y217 E297	Y54-D213 HydrophobicContact CD1-CB 3.53Å; Y54-D213 WeakPolarHBondContact CD1-O 3.19Å; Y54-D213 HydrophobicContact CE1-CB 3.9Å; L57-D213 HydrophobicContact CD1-CB 4.03Å; D213-R216 WeakPolarHBondContact O-CB 3.44Å; D213-R216 PolarHBondContact O-N 3.12Å; D213-R216 IonicContact OD1-CZ 2.69Å; D213-R216 IonicContact OD1-NH1 3.38Å; D213-R216 PolarHBondContact OD1-NH1 3.28Å; D213-R216 IonicContact OD1-NH2 3.05Å; D213-R216 PolarHBondContact OD1-NH2 3.29Å; D213-Y217 WeakPolarHBondContact O-CB 3.32Å; D213-Y217 PolarHBondContact O-N 3.09Å; D213-E297 HydrophobicContact CB-CG 4.15Å; D213-E297 VanDerWaalsContact OD1-CG 3.25Å; D213-E297 WeakPolarHBondContact OD1-CG 3.4Å; D213-E297 VanDerWaalsContact OD1-OE1 3.06Å
214	I	92	Very high	91.6	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-65.8	-36.8	173.1	-168.6	162.1	0	0	0	112.6	M55 L159 E212 R216 Y217 Y218	M55-I214 HydrophobicContact CG-CD1 3.39Å; M55-I214 HydrophobicContact SD-CD1 4.32Å; L159-I214 HydrophobicContact CD2-CG1 4.44Å; L159-I214 HydrophobicContact CD2-CG2 4.28Å; E212-I214 HydrophobicContact CB-CG2 4.05Å; E212-I214 PolarHBondContact O-N 3.2Å; I214-R216 VanDerWaalsContact C-N 3.34Å; I214-Y217 WeakPolarHBondContact O-CB 3.47Å; I214-Y217 PolarHBondContact O-N 3.49Å; I214-Y218 HydrophobicContact CD1-CE2 4.03Å; I214-Y218 HydrophobicContact CG1-CD2 3.87Å; I214-Y218 HydrophobicContact CG1-CE2 3.63Å; I214-Y218 WeakPolarHBondContact O-CD2 3.46Å; I214-Y218 PolarHBondContact O-N 3.37Å
215	T	94.4	Very high	91.6	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-65.7	-42.2	174.4	-61.1	0	0	0	0	110.1	E161 F164 F165 I210 E212 Y217 Y218 L219	E161-T215 HydrophobicContact CB-CG2 4.15Å; E161-T215 PolarHBondContact OE2-OG1 2.71Å; F164-T215 HydrophobicContact CD2-CG2 3.84Å; F164-T215 HydrophobicContact CE2-CG2 4.32Å; F165-T215 HydrophobicContact CE2-CG2 3.9Å; F165-T215 HydrophobicContact CZ-CG2 3.98Å; I210-T215 HydrophobicContact CG2-CG2 3.56Å; E212-T215 WeakPolarHBondContact O-CB 3.48Å; E212-T215 PolarHBondContact O-N 2.91Å; E212-T215 VanDerWaalsContact O-N 3.09Å; T215-Y217 VanDerWaalsContact C-N 3.34Å; T215-Y217 PolarHBondContact O-N 3.27Å; T215-Y218 PolarHBondContact O-N 2.81Å; T215-L219 PolarHBondContact O-N 2.98Å
216	R	93.5	Very high	91.8	Very high	17 Å²	17	29.7 Å²	29.7	6%	0.064	15%	0.146	C	C	.	.	H	α-helix	trans	-60.7	-43.7	174.8	-163.6	-176.5	-51.2	137.7	18.1	111.7	I210 E212 D213 I214 L219 C220 E297 L304	I210-R216 HydrophobicContact CG2-CB 4.36Å; E212-R216 PolarHBondContact O-N 3.21Å; E212-R216 VanDerWaalsContact O-N 3.09Å; D213-R216 WeakPolarHBondContact O-CB 3.44Å; D213-R216 PolarHBondContact O-N 3.12Å; D213-R216 IonicContact OD1-CZ 2.69Å; D213-R216 IonicContact OD1-NH1 3.38Å; D213-R216 PolarHBondContact OD1-NH1 3.28Å; D213-R216 IonicContact OD1-NH2 3.05Å; D213-R216 PolarHBondContact OD1-NH2 3.29Å; I214-R216 VanDerWaalsContact C-N 3.34Å; R216-L219 WeakPolarHBondContact O-CB 3.35Å; R216-L219 PolarHBondContact O-N 3.38Å; R216-C220 PolarHBondContact O-N 2.93Å; R216-C220 PolarHBondContact O-SG 3.5Å; R216-C220 VanDerWaalsContact O-SG 3.33Å; R216-E297 IonicContact CZ-OE1 2.97Å; R216-E297 IonicContact NH1-OE1 2.87Å; R216-E297 PolarHBondContact NH1-OE1 2.91Å; R216-E297 IonicContact NH2-OE1 2.63Å; R216-L304 HydrophobicContact CG-CD1 3.38Å
217	Y	94.3	Very high	92.1	Very high	19 Å²	19	25.9 Å²	25.9	8%	0.075	13%	0.126	C	C	.	.	H	α-helix	trans	-59.1	-48.6	175.8	169.2	-118.5	0	0	0	112.4	K50 K51 Y54 D213 I214 T215 L219 C220 L221	K50-Y217 HydrophobicContact CB-CE2 4.48Å; K50-Y217 HydrophobicContact CD-CD2 4.13Å; K50-Y217 HydrophobicContact CD-CE2 3.48Å; K50-Y217 VanDerWaalsContact CD-CE2 3.48Å; K50-Y217 VanDerWaalsContact CE-CE2 3.45Å; K50-Y217 HydrophobicContact CG-CD2 4.18Å; K50-Y217 HydrophobicContact CG-CE2 3.69Å; K51-Y217 HydrophobicContact CB-CE1 4.45Å; Y54-Y217 AromaticContact CD2-CD1 3.86Å; Y54-Y217 HydrophobicContact CD2-CD1 3.86Å; Y54-Y217 AromaticContact CD2-CD2 3.81Å; Y54-Y217 HydrophobicContact CD2-CD2 3.81Å; Y54-Y217 AromaticContact CD2-CG 3.43Å; Y54-Y217 HydrophobicContact CD2-CG 3.43Å; Y54-Y217 VanDerWaalsContact CD2-CG 3.43Å; Y54-Y217 HydrophobicContact CE2-CD1 4.35Å; Y54-Y217 AromaticContact CE2-CD2 3.43Å; Y54-Y217 HydrophobicContact CE2-CD2 3.43Å; Y54-Y217 VanDerWaalsContact CE2-CD2 3.43Å; Y54-Y217 HydrophobicContact CE2-CE2 4.24Å; Y54-Y217 AromaticContact CE2-CG 3.5Å; Y54-Y217 HydrophobicContact CE2-CG 3.5Å; Y54-Y217 VanDerWaalsContact CE2-CG 3.5Å; Y54-Y217 HydrophobicContact CG-CG 4.25Å; D213-Y217 WeakPolarHBondContact O-CB 3.32Å; D213-Y217 PolarHBondContact O-N 3.09Å; I214-Y217 WeakPolarHBondContact O-CB 3.47Å; I214-Y217 PolarHBondContact O-N 3.49Å; T215-Y217 VanDerWaalsContact C-N 3.34Å; T215-Y217 PolarHBondContact O-N 3.27Å; Y217-L219 VanDerWaalsContact C-N 3.3Å; Y217-L219 PolarHBondContact O-N 2.87Å; Y217-C220 WeakPolarHBondContact O-CA 3.37Å; Y217-C220 VanDerWaalsContact O-CB 3.28Å; Y217-C220 WeakPolarHBondContact O-CB 3.27Å; Y217-C220 PolarHBondContact O-N 3.41Å; Y217-C220 VanDerWaalsContact O-N 3.1Å; Y217-L221 HydrophobicContact CD2-CG 4.44Å; Y217-L221 HydrophobicContact CE1-CD1 3.87Å; Y217-L221 HydrophobicContact CE1-CG 4.5Å; Y217-L221 HydrophobicContact CE2-CD1 4.16Å; Y217-L221 HydrophobicContact CE2-CD2 3.97Å; Y217-L221 HydrophobicContact CE2-CG 3.97Å; Y217-L221 PolarHBondContact O-N 3.26Å
218	Y	95.7	Very high	92	Very high	1 Å²	1	28.2 Å²	28.2	0%	0.004	14%	0.14	C	C	.	.	H	α-helix	trans	-65.4	-33.5	176.5	-78.9	-66.3	0	0	0	112.6	K51 L131 L157 L159 I214 T215 L221 Q222	K51-Y218 WeakPolarHBondContact CD-OH 3.39Å; K51-Y218 WeakPolarHBondContact CE-OH 3.43Å; L131-Y218 HydrophobicContact CB-CD1 4.05Å; L131-Y218 HydrophobicContact CD1-CD1 3.93Å; L131-Y218 HydrophobicContact CD1-CG 4.37Å; L157-Y218 HydrophobicContact CB-CE2 4.2Å; L157-Y218 HydrophobicContact CD1-CE1 4.47Å; L157-Y218 HydrophobicContact CD2-CE1 4.31Å; L157-Y218 WeakPolarHBondContact CD2-OH 3.48Å; L159-Y218 HydrophobicContact CD1-CD2 4.34Å; L159-Y218 HydrophobicContact CD2-CD2 3.67Å; L159-Y218 HydrophobicContact CD2-CE2 4.14Å; L159-Y218 HydrophobicContact CG-CD2 4.24Å; L159-Y218 HydrophobicContact CG-CE2 4.36Å; I214-Y218 HydrophobicContact CD1-CE2 4.03Å; I214-Y218 HydrophobicContact CG1-CD2 3.87Å; I214-Y218 HydrophobicContact CG1-CE2 3.63Å; I214-Y218 WeakPolarHBondContact O-CD2 3.46Å; I214-Y218 PolarHBondContact O-N 3.37Å; T215-Y218 PolarHBondContact O-N 2.81Å; Y218-L221 HydrophobicContact CD1-CD1 3.91Å; Y218-L221 HydrophobicContact CE1-CD1 4.16Å; Y218-L221 PolarHBondContact O-N 2.93Å; Y218-Q222 PolarHBondContact O-N 2.89Å; Y218-Q222 VanDerWaalsContact O-N 3.08Å
219	L	96.4	Very high	91.9	Very high	5 Å²	5	25.2 Å²	25.2	3%	0.026	13%	0.127	C	C	.	.	H	α-helix	trans	-63.7	-40.4	170.5	-178.4	61.4	0	0	0	111.8	V200 Y203 P204 I210 T215 R216 Y217 L221 Q222 V223 L304	V200-L219 HydrophobicContact CB-CD1 4.37Å; V200-L219 HydrophobicContact CG1-CD1 3.77Å; V200-L219 HydrophobicContact CG2-CD1 4Å; Y203-L219 HydrophobicContact CD1-CD1 3.91Å; Y203-L219 HydrophobicContact CE1-CD1 4.2Å; P204-L219 HydrophobicContact CG-CD2 3.98Å; I210-L219 HydrophobicContact CD1-CD2 3.48Å; I210-L219 VanDerWaalsContact CD1-CD2 3.48Å; T215-L219 PolarHBondContact O-N 2.98Å; R216-L219 WeakPolarHBondContact O-CB 3.35Å; R216-L219 PolarHBondContact O-N 3.38Å; Y217-L219 VanDerWaalsContact C-N 3.3Å; Y217-L219 PolarHBondContact O-N 2.87Å; L219-L221 PolarHBondContact O-N 3.35Å; L219-Q222 PolarHBondContact O-N 3.38Å; L219-V223 HydrophobicContact CD1-CG2 4.35Å; L219-V223 VanDerWaalsContact O-CG2 3.29Å; L219-V223 WeakPolarHBondContact O-CG2 3.49Å; L219-V223 PolarHBondContact O-N 2.88Å; L219-L304 HydrophobicContact CB-CD1 4.39Å; L219-L304 HydrophobicContact CD2-CD1 3.88Å; L219-L304 HydrophobicContact CD2-CD2 4.15Å; L219-L304 HydrophobicContact CG-CD1 4.16Å; L219-L304 HydrophobicContact CG-CD2 3.84Å
220	C	96.7	Very high	91.5	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-59	-46.2	172.4	-69.4	0	0	0	0	111.4	R216 Y217 Q222 V223 R224 D300 F303 L304	R216-C220 PolarHBondContact O-N 2.93Å; R216-C220 PolarHBondContact O-SG 3.5Å; R216-C220 VanDerWaalsContact O-SG 3.33Å; Y217-C220 WeakPolarHBondContact O-CA 3.37Å; Y217-C220 VanDerWaalsContact O-CB 3.28Å; Y217-C220 WeakPolarHBondContact O-CB 3.27Å; Y217-C220 PolarHBondContact O-N 3.41Å; Y217-C220 VanDerWaalsContact O-N 3.1Å; C220-Q222 VanDerWaalsContact C-N 3.34Å; C220-Q222 PolarHBondContact O-N 3.05Å; C220-V223 PolarHBondContact O-N 3.15Å; C220-R224 WeakPolarHBondContact O-CG 3.47Å; C220-R224 PolarHBondContact O-N 3.13Å; C220-D300 VanDerWaalsContact SG-CB 3.52Å; C220-F303 HydrophobicContact CB-CD1 4.14Å; C220-F303 HydrophobicContact CB-CE1 4.19Å; C220-L304 VanDerWaalsContact SG-CG 3.55Å
221	L	95.8	Very high	91.1	Very high	16 Å²	16	25.8 Å²	25.8	8%	0.084	13%	0.125	C	C	.	.	H	α-helix	trans	-58.4	-45.4	178.6	-69.1	-177.6	0	0	0	112.3	L131 D132 Y217 Y218 L219 R224 Q225	L131-L221 HydrophobicContact CB-CB 4.01Å; L131-L221 HydrophobicContact CB-CD1 4.18Å; D132-L221 HydrophobicContact CB-CD1 4.13Å; Y217-L221 HydrophobicContact CD2-CG 4.44Å; Y217-L221 HydrophobicContact CE1-CD1 3.87Å; Y217-L221 HydrophobicContact CE1-CG 4.5Å; Y217-L221 HydrophobicContact CE2-CD1 4.16Å; Y217-L221 HydrophobicContact CE2-CD2 3.97Å; Y217-L221 HydrophobicContact CE2-CG 3.97Å; Y217-L221 PolarHBondContact O-N 3.26Å; Y218-L221 HydrophobicContact CD1-CD1 3.91Å; Y218-L221 HydrophobicContact CE1-CD1 4.16Å; Y218-L221 PolarHBondContact O-N 2.93Å; L219-L221 PolarHBondContact O-N 3.35Å; L221-R224 WeakPolarHBondContact O-CB 3.25Å; L221-R224 PolarHBondContact O-N 3.43Å; L221-Q225 PolarHBondContact O-N 3.23Å
222	Q	96.8	Very high	91.1	Very high	4 Å²	4	17.5 Å²	17.5	2%	0.019	9%	0.089	C	C	.	.	H	α-helix	trans	-60.6	-49.6	175.3	178.1	74.9	63.9	0	0	111.8	L131 V200 Y203 Y218 L219 C220 R224 Q225 D226	L131-Q222 HydrophobicContact CD2-CB 3.9Å; L131-Q222 HydrophobicContact CD2-CG 4.49Å; L131-Q222 VanDerWaalsContact CD2-OE1 3.26Å; V200-Q222 HydrophobicContact CB-CB 4.1Å; V200-Q222 HydrophobicContact CB-CG 3.83Å; V200-Q222 HydrophobicContact CG2-CB 3.5Å; V200-Q222 VanDerWaalsContact CG2-CB 3.5Å; V200-Q222 HydrophobicContact CG2-CG 3.83Å; Y203-Q222 HydrophobicContact CE1-CG 4.07Å; Y203-Q222 WeakPolarHBondContact OH-CG 3.47Å; Y218-Q222 PolarHBondContact O-N 2.89Å; Y218-Q222 VanDerWaalsContact O-N 3.08Å; L219-Q222 PolarHBondContact O-N 3.38Å; C220-Q222 VanDerWaalsContact C-N 3.34Å; C220-Q222 PolarHBondContact O-N 3.05Å; Q222-R224 PolarHBondContact O-N 3.26Å; Q222-Q225 WeakPolarHBondContact O-CA 3.39Å; Q222-Q225 WeakPolarHBondContact O-CB 3.47Å; Q222-Q225 PolarHBondContact O-N 3.47Å; Q222-D226 PolarHBondContact NE2-OD1 2.9Å; Q222-D226 VanDerWaalsContact O-CG 3.27Å; Q222-D226 PolarHBondContact O-N 3.45Å
223	V	97.1	Very high	90.6	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.6	-33.9	-179.5	170.8	0	0	0	0	110.9	Y203 L219 C220 D226 I227 L232 F303 L304 A307 Y313	Y203-V223 HydrophobicContact CD1-CG2 4.38Å; Y203-V223 HydrophobicContact CE1-CG2 4.05Å; L219-V223 HydrophobicContact CD1-CG2 4.35Å; L219-V223 VanDerWaalsContact O-CG2 3.29Å; L219-V223 WeakPolarHBondContact O-CG2 3.49Å; L219-V223 PolarHBondContact O-N 2.88Å; C220-V223 PolarHBondContact O-N 3.15Å; V223-D226 PolarHBondContact O-N 2.77Å; V223-I227 HydrophobicContact CG1-CD1 4.01Å; V223-I227 WeakPolarHBondContact O-CD1 3.28Å; V223-I227 WeakPolarHBondContact O-CG1 3.43Å; V223-I227 PolarHBondContact O-N 2.89Å; V223-L232 HydrophobicContact CG1-CD2 3.75Å; V223-F303 HydrophobicContact CB-CE1 3.84Å; V223-F303 HydrophobicContact CB-CZ 4.25Å; V223-F303 HydrophobicContact CG1-CE1 3.54Å; V223-F303 HydrophobicContact CG1-CZ 3.7Å; V223-L304 HydrophobicContact CB-CD2 4.48Å; V223-L304 HydrophobicContact CG2-CD2 4.01Å; V223-A307 HydrophobicContact CG1-CB 3.75Å; V223-Y313 HydrophobicContact CG2-CD2 4.37Å; V223-Y313 HydrophobicContact CG2-CE2 3.82Å
224	R	95	Very high	90.2	Very high	22 Å²	22	17.1 Å²	17.1	8%	0.083	9%	0.09	C	C	.	.	H	α-helix	trans	-63.2	-45.7	171.8	-69	169.2	-170.6	-165.2	-2	111.7	C220 L221 Q222 D226 I227 V228 I246 E250 D300 F303	C220-R224 WeakPolarHBondContact O-CG 3.47Å; C220-R224 PolarHBondContact O-N 3.13Å; L221-R224 WeakPolarHBondContact O-CB 3.25Å; L221-R224 PolarHBondContact O-N 3.43Å; Q222-R224 PolarHBondContact O-N 3.26Å; R224-D226 VanDerWaalsContact C-N 3.26Å; R224-D226 PolarHBondContact O-N 3.46Å; R224-I227 PolarHBondContact O-N 2.76Å; R224-V228 WeakPolarHBondContact O-CG2 3.4Å; R224-V228 PolarHBondContact O-N 2.95Å; R224-I246 HydrophobicContact CG-CD1 3.7Å; R224-I246 HydrophobicContact CG-CG1 4.2Å; R224-E250 IonicContact CZ-OE1 2.83Å; R224-E250 IonicContact NH1-OE1 2.73Å; R224-E250 PolarHBondContact NH1-OE1 2.77Å; R224-E250 IonicContact NH2-OE1 2.86Å; R224-E250 PolarHBondContact NH2-OE1 3.08Å; R224-D300 IonicContact NH2-OD1 2.98Å; R224-F303 HydrophobicContact CG-CE1 4.38Å; R224-F303 HydrophobicContact CG-CE2 4.32Å; R224-F303 HydrophobicContact CG-CZ 3.75Å
225	Q	89	Confident	89.7	Confident	70 Å²	70	19 Å²	19	33%	0.327	10%	0.103	S	C	.	.	H	α-helix	trans	-59.3	-40.6	174.9	-173.9	178.2	-4.2	0	0	110.8	E197 L221 Q222 V228 S229	E197-Q225 PolarHBondContact OE1-NE2 2.8Å; E197-Q225 VanDerWaalsContact OE1-NE2 3.16Å; L221-Q225 PolarHBondContact O-N 3.23Å; Q222-Q225 WeakPolarHBondContact O-CA 3.39Å; Q222-Q225 WeakPolarHBondContact O-CB 3.47Å; Q222-Q225 PolarHBondContact O-N 3.47Å; Q225-V228 PolarHBondContact O-N 3.32Å; Q225-S229 WeakPolarHBondContact O-CB 3.34Å; Q225-S229 PolarHBondContact O-N 3.42Å; Q225-S229 PolarHBondContact O-OG 3.02Å
226	D	91.4	Very high	89.2	Confident	9 Å²	9	20.1 Å²	20.1	5%	0.048	11%	0.108	C	C	.	.	H	α-helix	trans	-65.2	-39.9	177.1	-59.2	-14.4	0	0	0	111.8	Y203 Q222 V223 R224 S229 G230 Q231 L232	Y203-D226 PolarHBondContact OH-OD2 3.29Å; Q222-D226 PolarHBondContact NE2-OD1 2.9Å; Q222-D226 VanDerWaalsContact O-CG 3.27Å; Q222-D226 PolarHBondContact O-N 3.45Å; V223-D226 PolarHBondContact O-N 2.77Å; R224-D226 VanDerWaalsContact C-N 3.26Å; R224-D226 PolarHBondContact O-N 3.46Å; D226-S229 WeakPolarHBondContact CA-OG 3.39Å; D226-S229 PolarHBondContact O-OG 3.24Å; D226-G230 CarbonylContact O-C 3.58Å; D226-G230 PolarHBondContact O-N 3.29Å; D226-G230 VanDerWaalsContact O-N 3.13Å; D226-Q231 HydrophobicContact CB-CB 4.01Å; D226-Q231 WeakPolarHBondContact O-CA 3.4Å; D226-Q231 WeakPolarHBondContact O-CB 3.31Å; D226-Q231 PolarHBondContact O-N 3.21Å; D226-L232 HydrophobicContact CB-CB 3.8Å; D226-L232 PolarHBondContact O-N 3.45Å
227	I	91	Very high	88.6	Confident	3 Å²	3	23.7 Å²	23.7	2%	0.015	13%	0.132	C	C	.	.	H	α-helix	trans	-65.1	-50.8	175.6	-70.5	166.3	0	0	0	110.7	V223 R224 S229 G230 L232 Y239 L242 F270 P272 F303	V223-I227 HydrophobicContact CG1-CD1 4.01Å; V223-I227 WeakPolarHBondContact O-CD1 3.28Å; V223-I227 WeakPolarHBondContact O-CG1 3.43Å; V223-I227 PolarHBondContact O-N 2.89Å; R224-I227 PolarHBondContact O-N 2.76Å; I227-S229 PolarHBondContact O-N 2.84Å; I227-G230 WeakPolarHBondContact O-CA 2.94Å; I227-G230 PolarHBondContact O-N 3.09Å; I227-L232 HydrophobicContact CG1-CB 4.12Å; I227-L232 HydrophobicContact CG1-CD2 4.07Å; I227-L232 HydrophobicContact CG1-CG 4.28Å; I227-Y239 HydrophobicContact CG2-CD1 3.71Å; I227-Y239 HydrophobicContact CG2-CE1 3.44Å; I227-Y239 VanDerWaalsContact CG2-CE1 3.44Å; I227-L242 HydrophobicContact CD1-CD1 3.69Å; I227-F270 WeakPolarHBondContact CG2-O 3.41Å; I227-P272 WeakPolarHBondContact O-CD 3.44Å; I227-F303 HydrophobicContact CD1-CE2 4.09Å; I227-F303 HydrophobicContact CD1-CZ 3.82Å
228	V	87.3	Confident	87.9	Confident	48 Å²	48	24.3 Å²	24.3	29%	0.291	14%	0.137	S	C	.	.	H	α-helix	trans	-68.1	-37.1	-176.4	173.1	0	0	0	0	111.8	R224 Q225 G230 P269 P272	R224-V228 WeakPolarHBondContact O-CG2 3.4Å; R224-V228 PolarHBondContact O-N 2.95Å; Q225-V228 PolarHBondContact O-N 3.32Å; V228-G230 PolarHBondContact O-N 3.37Å; V228-P269 HydrophobicContact CG1-CB 4.01Å; V228-P269 HydrophobicContact CG2-CB 4.09Å; V228-P272 WeakPolarHBondContact O-CA 3.14Å
229	S	82.5	Confident	87.7	Confident	38 Å²	38	24.3 Å²	24.3	27%	0.266	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-8.6	173.1	63	0	0	0	0	113.4	Q225 D226 I227 Q231 A485 S486	Q225-S229 WeakPolarHBondContact O-CB 3.34Å; Q225-S229 PolarHBondContact O-N 3.42Å; Q225-S229 PolarHBondContact O-OG 3.02Å; D226-S229 WeakPolarHBondContact CA-OG 3.39Å; D226-S229 PolarHBondContact O-OG 3.24Å; I227-S229 PolarHBondContact O-N 2.84Å; S229-Q231 VanDerWaalsContact C-N 3.3Å; S229-Q231 WeakPolarHBondContact OG-CG 3.26Å; S229-Q231 PolarHBondContact OG-NE2 3.5Å; S229-A485 CarbonylContact O-C 3.53Å; S229-A485 PolarHBondContact O-N 3.29Å; S229-S486 PolarHBondContact O-N 3.09Å
230	G	79	Confident	87.4	Confident	2 Å²	2	24.3 Å²	24.3	2%	0.021	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	5.6	-178.7	0	0	0	0	0	114.9	D226 I227 V228 L232 A485 Y488	D226-G230 CarbonylContact O-C 3.58Å; D226-G230 PolarHBondContact O-N 3.29Å; D226-G230 VanDerWaalsContact O-N 3.13Å; I227-G230 WeakPolarHBondContact O-CA 2.94Å; I227-G230 PolarHBondContact O-N 3.09Å; V228-G230 PolarHBondContact O-N 3.37Å; G230-L232 PolarHBondContact O-N 2.96Å; G230-A485 CarbonylContact C-O 3.57Å; G230-A485 WeakPolarHBondContact CA-O 3.27Å; G230-A485 VanDerWaalsContact O-CB 3.23Å; G230-A485 WeakPolarHBondContact O-CB 3.49Å; G230-Y488 WeakPolarHBondContact O-CD2 3.48Å
231	Q	80.1	Confident	87.2	Confident	60 Å²	60	26.7 Å²	26.7	28%	0.28	15%	0.15	S	C	.	.	S	Bend	trans	-60.5	-32.4	174.6	-71.9	178.7	77.3	0	0	112.1	D226 S229 P233 A483 A485	D226-Q231 HydrophobicContact CB-CB 4.01Å; D226-Q231 WeakPolarHBondContact O-CA 3.4Å; D226-Q231 WeakPolarHBondContact O-CB 3.31Å; D226-Q231 PolarHBondContact O-N 3.21Å; S229-Q231 VanDerWaalsContact C-N 3.3Å; S229-Q231 WeakPolarHBondContact OG-CG 3.26Å; S229-Q231 PolarHBondContact OG-NE2 3.5Å; Q231-P233 VanDerWaalsContact C-CD 3.45Å; Q231-P233 WeakPolarHBondContact O-CD 3.4Å; Q231-A483 VanDerWaalsContact CD-O 3.31Å; Q231-A483 HydrophobicContact CG-CB 4.13Å; Q231-A483 WeakPolarHBondContact CG-O 3.46Å; Q231-A485 HydrophobicContact CB-CB 4.18Å; Q231-A485 HydrophobicContact CG-CB 3.84Å; Q231-A485 VanDerWaalsContact N-CB 3.26Å
232	L	87	Confident	87.1	Confident	1 Å²	1	26 Å²	26	1%	0.005	15%	0.147	C	C	.	.	S	Bend	trans	-113.5	81.2	176.8	-171.8	57.7	0	0	0	110.7	V223 D226 I227 G230 L310 L312 Y313	V223-L232 HydrophobicContact CG1-CD2 3.75Å; D226-L232 HydrophobicContact CB-CB 3.8Å; D226-L232 PolarHBondContact O-N 3.45Å; I227-L232 HydrophobicContact CG1-CB 4.12Å; I227-L232 HydrophobicContact CG1-CD2 4.07Å; I227-L232 HydrophobicContact CG1-CG 4.28Å; G230-L232 PolarHBondContact O-N 2.96Å; L232-L310 HydrophobicContact CD1-CB 3.68Å; L232-L310 HydrophobicContact CD1-CD1 3.95Å; L232-L310 HydrophobicContact CD1-CG 4.48Å; L232-L310 HydrophobicContact CD2-CD1 3.88Å; L232-L310 HydrophobicContact CG-CB 4.35Å; L232-L310 HydrophobicContact CG-CD1 3.65Å; L232-L312 VanDerWaalsContact CD1-C 3.43Å; L232-L312 HydrophobicContact CD1-CB 4.18Å; L232-Y313 VanDerWaalsContact CD1-N 3.3Å; L232-Y313 HydrophobicContact CD2-CD2 4.38Å
233	P	79.2	Confident	87.1	Confident	30 Å²	30	25.9 Å²	25.9	20%	0.195	15%	0.146	C	C	.	.			trans	-74.9	145.4	-179.6	32	-37.4	0	0	0	113	Q231 L312 Y488	Q231-P233 VanDerWaalsContact C-CD 3.45Å; Q231-P233 WeakPolarHBondContact O-CD 3.4Å; P233-L312 HydrophobicContact CG-CD1 3.87Å; P233-Y488 HydrophobicContact CB-CD1 4.41Å; P233-Y488 HydrophobicContact CB-CD2 4.05Å; P233-Y488 HydrophobicContact CB-CG 3.67Å; P233-Y488 HydrophobicContact CG-CD1 4.07Å; P233-Y488 HydrophobicContact CG-CD2 3.78Å; P233-Y488 HydrophobicContact CG-CE2 4.36Å; P233-Y488 HydrophobicContact CG-CG 3.61Å
234	C	80	Confident	87.1	Confident	12 Å²	12	25.9 Å²	25.9	8%	0.081	15%	0.146	C	C	.	.			trans	-147.7	171.5	176.3	61.9	0	0	0	0	111.8	T238 Y239 L310	C234-T238 HydrophobicContact CB-CG2 3.69Å; C234-Y239 WeakPolarHBondContact O-CE2 3.24Å; C234-Y239 VanDerWaalsContact SG-CD1 3.57Å; C234-Y239 VanDerWaalsContact SG-CG 3.53Å; C234-L310 HydrophobicContact CB-CD1 3.82Å; C234-L310 HydrophobicContact CB-CD2 3.53Å; C234-L310 HydrophobicContact CB-CG 4.35Å
235	S	81.9	Confident	87.2	Confident	40 Å²	40	26.2 Å²	26.2	28%	0.28	15%	0.147	S	C	.	.			trans	-69.7	159.3	176.7	65.5	0	0	0	0	111.6	V237 T238 Y239	S235-V237 PolarHBondContact O-N 3.4Å; S235-T238 CarbonylContact O-C 3.58Å; S235-T238 WeakPolarHBondContact O-CA 3.4Å; S235-T238 WeakPolarHBondContact O-CB 3.48Å; S235-T238 PolarHBondContact O-N 2.8Å; S235-T238 PolarHBondContact OG-N 2.56Å; S235-T238 PolarHBondContact OG-OG1 3.1Å; S235-Y239 WeakPolarHBondContact O-CD2 3.44Å; S235-Y239 PolarHBondContact O-N 2.97Å
236	F	82.7	Confident	87.5	Confident	26 Å²	26	23.1 Å²	23.1	11%	0.114	13%	0.133	C	C	.	.	H	α-helix	trans	-48.9	-46.1	174.2	177.3	-91.4	0	0	0	112.7	T238 Y239 C240 E279 M280 R283 Y490 P492	F236-T238 VanDerWaalsContact C-N 3.3Å; F236-T238 PolarHBondContact O-N 3.11Å; F236-Y239 PolarHBondContact O-N 3.33Å; F236-C240 PolarHBondContact O-N 3.08Å; F236-C240 PolarHBondContact O-SG 3.23Å; F236-E279 HydrophobicContact CZ-CG 4.44Å; F236-M280 HydrophobicContact CD2-CE 3.77Å; F236-M280 HydrophobicContact CE2-CB 3.71Å; F236-M280 HydrophobicContact CE2-CE 3.93Å; F236-M280 HydrophobicContact CE2-CG 4.23Å; F236-M280 HydrophobicContact CZ-CB 4.01Å; F236-R283 HydrophobicContact CE1-CG 4.35Å; F236-Y490 HydrophobicContact CB-CD1 4.23Å; F236-P492 HydrophobicContact CB-CG 4.47Å; F236-P492 HydrophobicContact CD2-CG 3.84Å; F236-P492 HydrophobicContact CE2-CG 4.21Å; F236-P492 HydrophobicContact CG-CG 4.11Å
237	V	82.2	Confident	87.6	Confident	91 Å²	91	23 Å²	23	55%	0.552	13%	0.133	S	C	*	.	H	α-helix	trans	-61.4	-40.9	177.3	177.5	0	0	0	0	111	S235 C240 I241	S235-V237 PolarHBondContact O-N 3.4Å; V237-C240 PolarHBondContact O-N 2.92Å; V237-I241 HydrophobicContact CG1-CD1 3.85Å; V237-I241 HydrophobicContact CG1-CG1 4.46Å; V237-I241 VanDerWaalsContact O-CG1 3.32Å; V237-I241 WeakPolarHBondContact O-CG1 3.47Å; V237-I241 PolarHBondContact O-N 3.4Å
238	T	80.1	Confident	87.8	Confident	32 Å²	32	22.8 Å²	22.8	20%	0.196	13%	0.132	C	C	.	.	H	α-helix	trans	-69.9	-39	179.5	-51.9	0	0	0	0	111.9	C234 S235 F236 C240 I241 L242 L310	C234-T238 HydrophobicContact CB-CG2 3.69Å; S235-T238 CarbonylContact O-C 3.58Å; S235-T238 WeakPolarHBondContact O-CA 3.4Å; S235-T238 WeakPolarHBondContact O-CB 3.48Å; S235-T238 PolarHBondContact O-N 2.8Å; S235-T238 PolarHBondContact OG-N 2.56Å; S235-T238 PolarHBondContact OG-OG1 3.1Å; F236-T238 VanDerWaalsContact C-N 3.3Å; F236-T238 PolarHBondContact O-N 3.11Å; T238-C240 VanDerWaalsContact C-N 3.31Å; T238-C240 PolarHBondContact O-N 3.43Å; T238-I241 PolarHBondContact O-N 3.31Å; T238-L242 HydrophobicContact CG2-CD1 3.87Å; T238-L242 HydrophobicContact CG2-CG 4.1Å; T238-L242 WeakPolarHBondContact O-CB 3.28Å; T238-L242 VanDerWaalsContact O-CG 3.31Å; T238-L242 WeakPolarHBondContact O-CG 3.39Å; T238-L242 PolarHBondContact O-N 3.5Å; T238-L310 HydrophobicContact CG2-CD2 4.09Å
239	Y	90.3	Very high	88	Confident	2 Å²	2	20.8 Å²	20.8	1%	0.008	12%	0.12	C	C	.	.	H	α-helix	trans	-55.5	-49	170.2	-79.4	-70.2	0	0	0	110.3	I227 C234 S235 F236 I241 L242 A243 A271 L275 M280	I227-Y239 HydrophobicContact CG2-CD1 3.71Å; I227-Y239 HydrophobicContact CG2-CE1 3.44Å; I227-Y239 VanDerWaalsContact CG2-CE1 3.44Å; C234-Y239 WeakPolarHBondContact O-CE2 3.24Å; C234-Y239 VanDerWaalsContact SG-CD1 3.57Å; C234-Y239 VanDerWaalsContact SG-CG 3.53Å; S235-Y239 WeakPolarHBondContact O-CD2 3.44Å; S235-Y239 PolarHBondContact O-N 2.97Å; F236-Y239 PolarHBondContact O-N 3.33Å; Y239-I241 PolarHBondContact O-N 2.87Å; Y239-L242 PolarHBondContact O-N 2.99Å; Y239-A243 WeakPolarHBondContact O-CB 3.38Å; Y239-A243 PolarHBondContact O-N 2.68Å; Y239-A271 HydrophobicContact CD1-CB 3.62Å; Y239-A271 HydrophobicContact CE1-CB 3.77Å; Y239-A271 HydrophobicContact CG-CB 4.16Å; Y239-L275 HydrophobicContact CE2-CD1 4.11Å; Y239-M280 HydrophobicContact CD2-CE 4.37Å; Y239-M280 HydrophobicContact CG-CE 4.25Å
240	C	90.7	Very high	88.3	Confident	4 Å²	4	21.3 Å²	21.3	3%	0.027	12%	0.118	C	C	.	.	H	α-helix	trans	-60.1	-44.1	179.1	-63.3	0	0	0	0	112.2	F236 V237 T238 S244 R283 I284 L287	F236-C240 PolarHBondContact O-N 3.08Å; F236-C240 PolarHBondContact O-SG 3.23Å; V237-C240 PolarHBondContact O-N 2.92Å; T238-C240 VanDerWaalsContact C-N 3.31Å; T238-C240 PolarHBondContact O-N 3.43Å; C240-S244 WeakPolarHBondContact O-CB 3.28Å; C240-S244 PolarHBondContact O-N 3.37Å; C240-S244 PolarHBondContact O-OG 3.29Å; C240-R283 HydrophobicContact CB-CB 4.36Å; C240-I284 HydrophobicContact CB-CG1 4.29Å; C240-L287 HydrophobicContact CB-CD1 3.83Å
241	I	91.6	Very high	88.7	Confident	51 Å²	51	22.6 Å²	22.6	26%	0.262	13%	0.128	S	C	.	.	H	α-helix	trans	-63.2	-51.6	178.1	-70.2	167.8	0	0	0	110.8	V237 T238 Y239 A243 S244 Y245 L287	V237-I241 HydrophobicContact CG1-CD1 3.85Å; V237-I241 HydrophobicContact CG1-CG1 4.46Å; V237-I241 VanDerWaalsContact O-CG1 3.32Å; V237-I241 WeakPolarHBondContact O-CG1 3.47Å; V237-I241 PolarHBondContact O-N 3.4Å; T238-I241 PolarHBondContact O-N 3.31Å; Y239-I241 PolarHBondContact O-N 2.87Å; I241-A243 VanDerWaalsContact C-N 3.35Å; I241-A243 PolarHBondContact O-N 2.71Å; I241-S244 PolarHBondContact O-N 2.7Å; I241-S244 PolarHBondContact O-OG 3.01Å; I241-Y245 HydrophobicContact CG2-CD2 4.17Å; I241-Y245 HydrophobicContact CG2-CE2 3.51Å; I241-Y245 VanDerWaalsContact O-CD2 3.24Å; I241-Y245 WeakPolarHBondContact O-CD2 3.33Å; I241-Y245 PolarHBondContact O-N 2.75Å; I241-L287 HydrophobicContact CG1-CD1 4.12Å
242	L	95.1	Very high	89.1	Confident	2 Å²	2	20.6 Å²	20.6	1%	0.01	12%	0.124	C	C	.	.	H	α-helix	trans	-61.8	-44.9	180	-68.9	178.6	0	0	0	111.1	I227 T238 Y239 S244 Y245 I246 F303 N306 A307 L310	I227-L242 HydrophobicContact CD1-CD1 3.69Å; T238-L242 HydrophobicContact CG2-CD1 3.87Å; T238-L242 HydrophobicContact CG2-CG 4.1Å; T238-L242 WeakPolarHBondContact O-CB 3.28Å; T238-L242 VanDerWaalsContact O-CG 3.31Å; T238-L242 WeakPolarHBondContact O-CG 3.39Å; T238-L242 PolarHBondContact O-N 3.5Å; Y239-L242 PolarHBondContact O-N 2.99Å; L242-S244 VanDerWaalsContact C-N 3.33Å; L242-S244 PolarHBondContact O-N 3.49Å; L242-Y245 PolarHBondContact O-N 3.05Å; L242-I246 WeakPolarHBondContact O-CG1 3.38Å; L242-I246 PolarHBondContact O-N 2.83Å; L242-F303 HydrophobicContact CB-CD2 3.96Å; L242-F303 HydrophobicContact CB-CE2 3.79Å; L242-F303 HydrophobicContact CD2-CD2 3.78Å; L242-F303 HydrophobicContact CD2-CE2 4.07Å; L242-F303 HydrophobicContact CD2-CG 4.35Å; L242-F303 WeakPolarHBondContact CD2-O 3.17Å; L242-F303 HydrophobicContact CG-CD2 4.44Å; L242-F303 HydrophobicContact CG-CE2 4.38Å; L242-F303 WeakPolarHBondContact O-CD2 3.48Å; L242-N306 HydrophobicContact CD2-CB 3.74Å; L242-A307 HydrophobicContact CD2-CB 4.3Å; L242-L310 HydrophobicContact CD1-CD1 4.13Å
243	A	96.7	Very high	89.2	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.008	14%	0.136	C	C	.	.	H	α-helix	trans	-61.4	-38.2	175.6	0	0	0	0	0	112.9	Y239 I241 Y245 I246 V247 F270 I284	Y239-A243 WeakPolarHBondContact O-CB 3.38Å; Y239-A243 PolarHBondContact O-N 2.68Å; I241-A243 VanDerWaalsContact C-N 3.35Å; I241-A243 PolarHBondContact O-N 2.71Å; A243-Y245 VanDerWaalsContact C-N 3.28Å; A243-Y245 PolarHBondContact O-N 3.13Å; A243-I246 WeakPolarHBondContact O-CA 3.32Å; A243-I246 WeakPolarHBondContact O-CB 3.38Å; A243-I246 PolarHBondContact O-N 3.16Å; A243-I246 VanDerWaalsContact O-N 3.08Å; A243-V247 WeakPolarHBondContact O-CG2 3.32Å; A243-V247 PolarHBondContact O-N 2.87Å; A243-F270 HydrophobicContact CB-CB 3.69Å; A243-F270 HydrophobicContact CB-CD1 3.53Å; A243-F270 HydrophobicContact CB-CE1 4.31Å; A243-F270 HydrophobicContact CB-CG 3.67Å; A243-I284 HydrophobicContact CB-CD1 3.39Å; A243-I284 HydrophobicContact CB-CG1 3.67Å; A243-I284 HydrophobicContact CB-CG2 4.27Å
244	S	96.1	Very high	89.7	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.6	-33.6	176.1	71.7	0	0	0	0	113	C240 I241 L242 Q248 L287 H291	C240-S244 WeakPolarHBondContact O-CB 3.28Å; C240-S244 PolarHBondContact O-N 3.37Å; C240-S244 PolarHBondContact O-OG 3.29Å; I241-S244 PolarHBondContact O-N 2.7Å; I241-S244 PolarHBondContact O-OG 3.01Å; L242-S244 VanDerWaalsContact C-N 3.33Å; L242-S244 PolarHBondContact O-N 3.49Å; S244-Q248 WeakPolarHBondContact O-CB 3.41Å; S244-Q248 PolarHBondContact O-N 3.12Å; S244-L287 VanDerWaalsContact CB-CB 3.42Å; S244-H291 PolarHBondContact OG-NE2 3.04Å
245	Y	96.8	Very high	90.1	Very high	28 Å²	28	24.8 Å²	24.8	11%	0.11	14%	0.143	C	C	.	.	H	α-helix	trans	-71.8	-35.2	171.2	-64.1	-54	0	0	0	112.3	I241 L242 A243 S249 H291 L302 F303 N306	I241-Y245 HydrophobicContact CG2-CD2 4.17Å; I241-Y245 HydrophobicContact CG2-CE2 3.51Å; I241-Y245 VanDerWaalsContact O-CD2 3.24Å; I241-Y245 WeakPolarHBondContact O-CD2 3.33Å; I241-Y245 PolarHBondContact O-N 2.75Å; L242-Y245 PolarHBondContact O-N 3.05Å; A243-Y245 VanDerWaalsContact C-N 3.28Å; A243-Y245 PolarHBondContact O-N 3.13Å; Y245-S249 WeakPolarHBondContact O-CB 3.42Å; Y245-S249 PolarHBondContact O-N 2.76Å; Y245-H291 AromaticContact CD1-CE1 3.93Å; Y245-H291 AromaticContact CD1-NE2 3.83Å; Y245-H291 AromaticContact CE1-CE1 3.31Å; Y245-H291 WeakPolarHBondContact CE1-CE1 3.18Å; Y245-H291 AromaticContact CE1-ND1 3.73Å; Y245-H291 AromaticContact CE1-NE2 3.65Å; Y245-H291 AromaticContact CZ-CE1 3.87Å; Y245-L302 HydrophobicContact CD1-CB 3.95Å; Y245-L302 HydrophobicContact CD1-CD1 4.34Å; Y245-L302 HydrophobicContact CD2-CB 4.37Å; Y245-L302 HydrophobicContact CE1-CB 3.62Å; Y245-L302 HydrophobicContact CE1-CD1 3.66Å; Y245-L302 HydrophobicContact CE1-CG 4.26Å; Y245-L302 HydrophobicContact CE2-CB 4.08Å; Y245-L302 HydrophobicContact CG-CB 4.32Å; Y245-F303 HydrophobicContact CD2-CB 4.32Å; Y245-F303 HydrophobicContact CG-CB 4.39Å; Y245-N306 WeakPolarHBondContact CE2-ND2 3.35Å
246	I	95.4	Very high	90.4	Very high	5 Å²	5	27.6 Å²	27.6	3%	0.026	16%	0.16	C	C	.	.	H	α-helix	trans	-59.4	-50.9	172.2	-63	171.2	0	0	0	109.3	R224 L242 A243 S249 E250 F270 F303	R224-I246 HydrophobicContact CG-CD1 3.7Å; R224-I246 HydrophobicContact CG-CG1 4.2Å; L242-I246 WeakPolarHBondContact O-CG1 3.38Å; L242-I246 PolarHBondContact O-N 2.83Å; A243-I246 WeakPolarHBondContact O-CA 3.32Å; A243-I246 WeakPolarHBondContact O-CB 3.38Å; A243-I246 PolarHBondContact O-N 3.16Å; A243-I246 VanDerWaalsContact O-N 3.08Å; I246-S249 CarbonylContact O-C 3.58Å; I246-S249 PolarHBondContact O-N 2.81Å; I246-S249 VanDerWaalsContact O-N 3.13Å; I246-E250 HydrophobicContact CG2-CG 4.11Å; I246-E250 WeakPolarHBondContact O-CB 3.32Å; I246-E250 VanDerWaalsContact O-CG 3.31Å; I246-E250 WeakPolarHBondContact O-CG 3.37Å; I246-E250 PolarHBondContact O-N 3.42Å; I246-F270 HydrophobicContact CB-CD1 4.36Å; I246-F270 HydrophobicContact CB-CE1 4.14Å; I246-F270 HydrophobicContact CD1-CD1 4.17Å; I246-F270 HydrophobicContact CG2-CD1 4.29Å; I246-F270 HydrophobicContact CG2-CE1 3.85Å; I246-F303 HydrophobicContact CD1-CE2 3.84Å; I246-F303 HydrophobicContact CG1-CD2 4.02Å; I246-F303 HydrophobicContact CG1-CE2 3.79Å
247	V	94.8	Very high	90.6	Very high	6 Å²	6	30.3 Å²	30.3	4%	0.036	18%	0.183	C	C	.	.	H	α-helix	trans	-60.5	-49.2	179.4	178.6	0	0	0	0	110.9	A243 S249 E250 A251 Y264 I265 F270 I284 H288	A243-V247 WeakPolarHBondContact O-CG2 3.32Å; A243-V247 PolarHBondContact O-N 2.87Å; V247-S249 PolarHBondContact O-N 2.9Å; V247-E250 PolarHBondContact O-N 2.69Å; V247-E250 VanDerWaalsContact O-N 3.16Å; V247-A251 HydrophobicContact CG1-CB 4.22Å; V247-A251 WeakPolarHBondContact O-CA 3.32Å; V247-A251 WeakPolarHBondContact O-CB 3.16Å; V247-A251 PolarHBondContact O-N 3.05Å; V247-Y264 HydrophobicContact CG1-CE2 3.85Å; V247-I265 HydrophobicContact CG1-CG2 3.98Å; V247-I265 HydrophobicContact CG2-CG2 3.81Å; V247-F270 HydrophobicContact CG2-CE1 3.66Å; V247-F270 HydrophobicContact CG2-CE2 4.48Å; V247-F270 HydrophobicContact CG2-CZ 3.48Å; V247-F270 VanDerWaalsContact CG2-CZ 3.48Å; V247-I284 HydrophobicContact CG2-CG2 3.72Å; V247-H288 HydrophobicContact CG1-CB 4.24Å; V247-H288 VanDerWaalsContact CG1-ND1 3.35Å; V247-H288 WeakPolarHBondContact CG1-ND1 3.35Å
248	Q	93.6	Very high	90.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-56.7	-38.3	175.9	-179.4	67.8	30.1	0	0	111.9	S244 G252 D253 H288 H291 K294 A299	S244-Q248 WeakPolarHBondContact O-CB 3.41Å; S244-Q248 PolarHBondContact O-N 3.12Å; Q248-G252 VanDerWaalsContact O-CA 3.27Å; Q248-G252 WeakPolarHBondContact O-CA 3Å; Q248-G252 PolarHBondContact O-N 2.94Å; Q248-G252 VanDerWaalsContact O-N 3.13Å; Q248-G252 PolarHBondContact OE1-O 2.96Å; Q248-D253 PolarHBondContact NE2-OD1 2.91Å; Q248-H288 PolarHBondContact OE1-CD2 3.1Å; Q248-H291 HydrophobicContact CB-CB 4.07Å; Q248-H291 HydrophobicContact CG-CB 3.8Å; Q248-H291 PolarHBondContact NE2-O 2.96Å; Q248-K294 HydrophobicContact CG-CB 4.18Å; Q248-K294 PolarHBondContact NE2-O 3.25Å; Q248-A299 HydrophobicContact CB-CB 4.22Å; Q248-A299 HydrophobicContact CG-CB 3.99Å
249	S	91.6	Very high	91.2	Very high	5 Å²	5	32.4 Å²	32.4	4%	0.035	18%	0.184	C	C	.	.	H	α-helix	trans	-78.3	-23.7	-177.6	-170.7	0	0	0	0	113.3	K50 Y245 I246 V247 P296 D300	K50-S249 WeakPolarHBondContact CE-O 3.43Å; K50-S249 WeakPolarHBondContact CE-OG 3.37Å; K50-S249 PolarHBondContact NZ-O 3.11Å; K50-S249 PolarHBondContact NZ-OG 2.84Å; Y245-S249 WeakPolarHBondContact O-CB 3.42Å; Y245-S249 PolarHBondContact O-N 2.76Å; I246-S249 CarbonylContact O-C 3.58Å; I246-S249 PolarHBondContact O-N 2.81Å; I246-S249 VanDerWaalsContact O-N 3.13Å; V247-S249 PolarHBondContact O-N 2.9Å; S249-P296 PolarHBondContact OG-O 3.15Å; S249-D300 WeakPolarHBondContact CB-OD1 3.19Å; S249-D300 PolarHBondContact OG-OD1 2.89Å
250	E	88.8	Confident	90.9	Very high	49 Å²	49	37.9 Å²	37.9	23%	0.229	21%	0.212	C	C	.	.	H	α-helix	trans	-100.2	-37.7	179.5	-64.3	-61.1	153	0	0	113.3	K50 R224 I246 V247	K50-E250 WeakPolarHBondContact CD-OE1 3.49Å; K50-E250 WeakPolarHBondContact CD-OE2 3.31Å; K50-E250 IonicContact NZ-OE1 2.72Å; K50-E250 PolarHBondContact NZ-OE1 2.79Å; K50-E250 IonicContact NZ-OE2 3.18Å; R224-E250 IonicContact CZ-OE1 2.83Å; R224-E250 IonicContact NH1-OE1 2.73Å; R224-E250 PolarHBondContact NH1-OE1 2.77Å; R224-E250 IonicContact NH2-OE1 2.86Å; R224-E250 PolarHBondContact NH2-OE1 3.08Å; I246-E250 HydrophobicContact CG2-CG 4.11Å; I246-E250 WeakPolarHBondContact O-CB 3.32Å; I246-E250 VanDerWaalsContact O-CG 3.31Å; I246-E250 WeakPolarHBondContact O-CG 3.37Å; I246-E250 PolarHBondContact O-N 3.42Å; V247-E250 PolarHBondContact O-N 2.69Å; V247-E250 VanDerWaalsContact O-N 3.16Å
251	A	87.7	Confident	90.8	Very high	29 Å²	29	39.9 Å²	39.9	24%	0.24	23%	0.233	C	C	.	.	H	α-helix	trans	-105.8	-4.6	-174.7	0	0	0	0	0	113.5	V247	V247-A251 HydrophobicContact CG1-CB 4.22Å; V247-A251 WeakPolarHBondContact O-CA 3.32Å; V247-A251 WeakPolarHBondContact O-CB 3.16Å; V247-A251 PolarHBondContact O-N 3.05Å
252	G	88.6	Confident	90.9	Very high	18 Å²	18	39.9 Å²	39.9	19%	0.186	23%	0.233	C	C	.	.			trans	71.2	-147.7	-177.8	0	0	0	0	0	112.7	Q248 H288	Q248-G252 VanDerWaalsContact O-CA 3.27Å; Q248-G252 WeakPolarHBondContact O-CA 3Å; Q248-G252 PolarHBondContact O-N 2.94Å; Q248-G252 VanDerWaalsContact O-N 3.13Å; Q248-G252 PolarHBondContact OE1-O 2.96Å; G252-H288 PolarHBondContact O-NE2 2.88Å
253	D	89.7	Confident	90.6	Very high	49 Å²	49	47.3 Å²	47.3	26%	0.262	27%	0.265	S	S	.	.	S	Bend	trans	-74	142	-179.9	-83.8	-4.7	0	0	0	112.4	Q248 D255 H259 R292 G293	Q248-D253 PolarHBondContact NE2-OD1 2.91Å; D253-D255 PolarHBondContact O-N 3.16Å; D253-H259 PolarHBondContact O-CE1 3.41Å; D253-R292 HydrophobicContact CB-CG 4.36Å; D253-R292 WeakPolarHBondContact OD1-CA 3.33Å; D253-R292 WeakPolarHBondContact OD2-CG 3.34Å; D253-G293 VanDerWaalsContact CG-N 3.33Å; D253-G293 PolarHBondContact OD1-N 2.98Å; D253-G293 PolarHBondContact OD2-N 2.73Å; D253-G293 VanDerWaalsContact OD2-N 3.12Å
254	H	90.3	Very high	90.4	Very high	30 Å²	30	50.2 Å²	50.2	14%	0.139	28%	0.277	C	S	.	.			trans	-63.2	102.1	177	179.9	-71.8	0	0	0	112.8	P256 H288 K289	H254-P256 WeakPolarHBondContact O-CD 3.21Å; H254-H288 AromaticContact CD2-ND1 3.85Å; H254-H288 PolarHBondContact N-NE2 2.88Å; H254-K289 HydrophobicContact CB-CG 4.31Å
255	D	87.6	Confident	90.3	Very high	52 Å²	52	50.5 Å²	50.5	28%	0.278	28%	0.278	S	S	.	.			trans	-85.8	113.5	165.2	-179.1	-5.9	0	0	0	111.9	D253 S257 Q258 H259	D253-D255 PolarHBondContact O-N 3.16Å; D255-S257 PolarHBondContact O-N 3.26Å; D255-S257 VanDerWaalsContact O-N 3.08Å; D255-S257 WeakPolarHBondContact OD1-CB 3.46Å; D255-S257 PolarHBondContact OD1-N 3.32Å; D255-S257 PolarHBondContact OD1-OG 3.18Å; D255-S257 PolarHBondContact OD2-OG 2.79Å; D255-Q258 HydrophobicContact CB-CB 4.32Å; D255-Q258 PolarHBondContact O-N 3.36Å; D255-Q258 VanDerWaalsContact O-N 3.14Å; D255-Q258 WeakPolarHBondContact OD2-CG 3.48Å; D255-Q258 PolarHBondContact OD2-NE2 3.1Å; D255-H259 PolarHBondContact N-ND1 3.14Å; D255-H259 WeakPolarHBondContact O-CB 3.35Å; D255-H259 PolarHBondContact O-N 2.79Å
256	P	87.3	Confident	89.9	Confident	99 Å²	99	53.3 Å²	53.3	64%	0.643	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-21.7	177.9	-23.2	34.1	0	0	0	115.3	H254	H254-P256 WeakPolarHBondContact O-CD 3.21Å
257	S	87.1	Confident	89.4	Confident	84 Å²	84	59.2 Å²	59.2	59%	0.587	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-26.6	179.5	72.9	0	0	0	0	113.3	D255	D255-S257 PolarHBondContact O-N 3.26Å; D255-S257 VanDerWaalsContact O-N 3.08Å; D255-S257 WeakPolarHBondContact OD1-CB 3.46Å; D255-S257 PolarHBondContact OD1-N 3.32Å; D255-S257 PolarHBondContact OD1-OG 3.18Å; D255-S257 PolarHBondContact OD2-OG 2.79Å
258	Q	85	Confident	89.1	Confident	142 Å²	142	60.7 Å²	60.7	66%	0.664	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	-40.2	-179.3	-64.5	-177.6	53.8	0	0	112.1	D255 I260	D255-Q258 HydrophobicContact CB-CB 4.32Å; D255-Q258 PolarHBondContact O-N 3.36Å; D255-Q258 VanDerWaalsContact O-N 3.14Å; D255-Q258 WeakPolarHBondContact OD2-CG 3.48Å; D255-Q258 PolarHBondContact OD2-NE2 3.1Å; Q258-I260 PolarHBondContact O-N 2.75Å; Q258-I260 VanDerWaalsContact O-N 3.16Å
259	H	91.3	Very high	88.9	Confident	24 Å²	24	62.8 Å²	62.8	11%	0.111	34%	0.344	C	S	.	.			trans	-91.9	64	-175	-60	138.6	0	0	0	112	D253 D255 Y264 H288	D253-H259 PolarHBondContact O-CE1 3.41Å; D255-H259 PolarHBondContact N-ND1 3.14Å; D255-H259 WeakPolarHBondContact O-CB 3.35Å; D255-H259 PolarHBondContact O-N 2.79Å; H259-Y264 HydrophobicContact CB-CD1 3.96Å; H259-Y264 HydrophobicContact CB-CD2 4.3Å; H259-Y264 HydrophobicContact CB-CE1 3.68Å; H259-Y264 HydrophobicContact CB-CE2 4.03Å; H259-Y264 HydrophobicContact CB-CG 4.28Å; H259-Y264 AromaticContact CD2-CD2 3.28Å; H259-Y264 WeakPolarHBondContact CD2-CD2 3.31Å; H259-Y264 AromaticContact CD2-CE2 3.5Å; H259-Y264 AromaticContact CD2-CG 3.73Å; H259-Y264 AromaticContact CG-CD2 3.98Å; H259-Y264 AromaticContact CG-CE2 3.79Å; H259-H288 AromaticContact ND1-CE1 3.9Å
260	I	83.8	Confident	89	Confident	118 Å²	118	62.8 Å²	62.8	61%	0.605	34%	0.343	S	S	*	.			trans	-89.1	116.4	-176.4	-56.6	173.6	0	0	0	111.2	Q258	Q258-I260 PolarHBondContact O-N 2.75Å; Q258-I260 VanDerWaalsContact O-N 3.16Å
261	G	88.8	Confident	88.9	Confident	45 Å²	45	60.5 Å²	60.5	46%	0.464	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	-150.6	178.1	0	0	0	0	0	112.1	Y264	G261-Y264 WeakPolarHBondContact O-CD1 3.46Å; G261-Y264 WeakPolarHBondContact O-CE1 3.31Å
262	I	92.2	Very high	88.6	Confident	51 Å²	51	59.8 Å²	59.8	26%	0.262	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-7.2	-178.1	63.9	173.6	0	0	0	113.9	Y264 I265 Q266 P278 L281 V285	I262-Y264 VanDerWaalsContact C-N 3.32Å; I262-Y264 PolarHBondContact O-N 2.8Å; I262-I265 VanDerWaalsContact O-CG1 3.29Å; I262-I265 WeakPolarHBondContact O-CG1 3.45Å; I262-I265 PolarHBondContact O-N 3.41Å; I262-I265 VanDerWaalsContact O-N 3.12Å; I262-Q266 PolarHBondContact O-N 3.21Å; I262-P278 HydrophobicContact CD1-CB 4.06Å; I262-L281 HydrophobicContact CB-CB 3.88Å; I262-L281 HydrophobicContact CB-CD1 4.45Å; I262-L281 HydrophobicContact CD1-CB 4.4Å; I262-L281 HydrophobicContact CD1-CD1 4.14Å; I262-L281 HydrophobicContact CG2-CB 3.7Å; I262-V285 HydrophobicContact CG2-CG2 4.31Å
263	K	89.6	Confident	88.2	Confident	159 Å²	159	67.3 Å²	67.3	69%	0.691	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-35.9	-168.1	-71.6	-176.1	178.2	-179.9	0	113.8	I265 Q266	K263-I265 PolarHBondContact O-N 3.28Å; K263-Q266 WeakPolarHBondContact O-CG 3.46Å
264	Y	91.5	Very high	87.4	Confident	62 Å²	62	67.7 Å²	67.7	24%	0.243	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-13.5	-178.1	76	-79.6	0	0	0	113.5	V247 H259 G261 I262 V285 H288	V247-Y264 HydrophobicContact CG1-CE2 3.85Å; H259-Y264 HydrophobicContact CB-CD1 3.96Å; H259-Y264 HydrophobicContact CB-CD2 4.3Å; H259-Y264 HydrophobicContact CB-CE1 3.68Å; H259-Y264 HydrophobicContact CB-CE2 4.03Å; H259-Y264 HydrophobicContact CB-CG 4.28Å; H259-Y264 AromaticContact CD2-CD2 3.28Å; H259-Y264 WeakPolarHBondContact CD2-CD2 3.31Å; H259-Y264 AromaticContact CD2-CE2 3.5Å; H259-Y264 AromaticContact CD2-CG 3.73Å; H259-Y264 AromaticContact CG-CD2 3.98Å; H259-Y264 AromaticContact CG-CE2 3.79Å; G261-Y264 WeakPolarHBondContact O-CD1 3.46Å; G261-Y264 WeakPolarHBondContact O-CE1 3.31Å; I262-Y264 VanDerWaalsContact C-N 3.32Å; I262-Y264 PolarHBondContact O-N 2.8Å; Y264-V285 HydrophobicContact CE1-CG2 3.85Å; Y264-H288 AromaticContact CE2-ND1 3.9Å; Y264-H288 AromaticContact CZ-ND1 3.76Å; Y264-H288 PolarHBondContact OH-ND1 3.36Å
265	I	94.1	Very high	86.8	Confident	6 Å²	6	66.6 Å²	66.6	3%	0.031	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	-6.7	179	64.2	167.7	0	0	0	113.6	V247 I262 K263 D267 H268 F270 L281 I284 V285	V247-I265 HydrophobicContact CG1-CG2 3.98Å; V247-I265 HydrophobicContact CG2-CG2 3.81Å; I262-I265 VanDerWaalsContact O-CG1 3.29Å; I262-I265 WeakPolarHBondContact O-CG1 3.45Å; I262-I265 PolarHBondContact O-N 3.41Å; I262-I265 VanDerWaalsContact O-N 3.12Å; K263-I265 PolarHBondContact O-N 3.28Å; I265-D267 PolarHBondContact O-N 3.32Å; I265-H268 PolarHBondContact O-N 2.74Å; I265-H268 VanDerWaalsContact O-N 3.11Å; I265-F270 HydrophobicContact CB-CE2 3.86Å; I265-F270 HydrophobicContact CB-CZ 4Å; I265-F270 HydrophobicContact CD1-CE2 4.31Å; I265-F270 HydrophobicContact CG1-CE2 4.43Å; I265-F270 HydrophobicContact CG2-CZ 4.43Å; I265-F270 WeakPolarHBondContact O-CE2 3.26Å; I265-L281 HydrophobicContact CD1-CB 4.13Å; I265-L281 HydrophobicContact CD1-CD2 3.97Å; I265-L281 HydrophobicContact CG1-CD2 4.18Å; I265-I284 HydrophobicContact CD1-CB 4.02Å; I265-I284 HydrophobicContact CD1-CG2 3.76Å; I265-V285 HydrophobicContact CD1-CG2 3.69Å; I265-V285 HydrophobicContact CG1-CG2 4.33Å
266	Q	88.8	Confident	86.6	Confident	86 Å²	86	65.9 Å²	65.9	40%	0.402	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-32.6	-168.6	73.7	-172	6.6	0	0	113.5	I262 K263 Q276 L281	I262-Q266 PolarHBondContact O-N 3.21Å; K263-Q266 WeakPolarHBondContact O-CG 3.46Å; Q266-Q276 PolarHBondContact O-NE2 3.36Å; Q266-L281 HydrophobicContact CB-CD1 4.21Å
267	D	85.8	Confident	86.6	Confident	130 Å²	130	63 Å²	63	70%	0.695	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-5.7	-176.1	-59.2	-45.3	0	0	0	112.6	I265	I265-D267 PolarHBondContact O-N 3.32Å
268	H	88.3	Confident	86.4	Confident	36 Å²	36	63.4 Å²	63.4	17%	0.167	33%	0.328	C	S	.	.	S	Bend	trans	-88.5	127	178.3	-168.9	-60	0	0	0	110.4	I265 F270 Q276	I265-H268 PolarHBondContact O-N 2.74Å; I265-H268 VanDerWaalsContact O-N 3.11Å; H268-F270 HydrophobicContact CB-CE1 4.25Å; H268-F270 HydrophobicContact CB-CE2 3.84Å; H268-F270 HydrophobicContact CB-CZ 3.62Å; H268-F270 AromaticContact CE1-CE1 3.97Å; H268-F270 AromaticContact CG-CE1 3.82Å; H268-F270 AromaticContact CG-CZ 3.7Å; H268-F270 AromaticContact ND1-CD1 3.7Å; H268-F270 AromaticContact ND1-CE1 3.4Å; H268-F270 WeakPolarHBondContact ND1-CE1 3.36Å; H268-F270 AromaticContact ND1-CZ 3.72Å; H268-F270 VanDerWaalsContact O-CD2 3.24Å; H268-F270 WeakPolarHBondContact O-CD2 3.48Å; H268-F270 WeakPolarHBondContact O-CE2 3.44Å; H268-F270 PolarHBondContact O-N 2.83Å; H268-Q276 PolarHBondContact O-NE2 2.95Å; H268-Q276 PolarHBondContact O-OE1 3.36Å
269	P	89.3	Confident	86.4	Confident	44 Å²	44	61.5 Å²	61.5	29%	0.286	32%	0.319	S	S	.	.			trans	-76.6	117.5	177.2	30.1	-33	0	0	0	110.8	V228	V228-P269 HydrophobicContact CG1-CB 4.01Å; V228-P269 HydrophobicContact CG2-CB 4.09Å
270	F	92.6	Very high	86.3	Confident	5 Å²	5	60.5 Å²	60.5	2%	0.022	31%	0.314	C	S	.	.			trans	-110.2	-22.7	177.6	-63.5	-65.7	0	0	0	113.5	I227 A243 I246 V247 I265 H268 L281 I284	I227-F270 WeakPolarHBondContact CG2-O 3.41Å; A243-F270 HydrophobicContact CB-CB 3.69Å; A243-F270 HydrophobicContact CB-CD1 3.53Å; A243-F270 HydrophobicContact CB-CE1 4.31Å; A243-F270 HydrophobicContact CB-CG 3.67Å; I246-F270 HydrophobicContact CB-CD1 4.36Å; I246-F270 HydrophobicContact CB-CE1 4.14Å; I246-F270 HydrophobicContact CD1-CD1 4.17Å; I246-F270 HydrophobicContact CG2-CD1 4.29Å; I246-F270 HydrophobicContact CG2-CE1 3.85Å; V247-F270 HydrophobicContact CG2-CE1 3.66Å; V247-F270 HydrophobicContact CG2-CE2 4.48Å; V247-F270 HydrophobicContact CG2-CZ 3.48Å; V247-F270 VanDerWaalsContact CG2-CZ 3.48Å; I265-F270 HydrophobicContact CB-CE2 3.86Å; I265-F270 HydrophobicContact CB-CZ 4Å; I265-F270 HydrophobicContact CD1-CE2 4.31Å; I265-F270 HydrophobicContact CG1-CE2 4.43Å; I265-F270 HydrophobicContact CG2-CZ 4.43Å; I265-F270 WeakPolarHBondContact O-CE2 3.26Å; H268-F270 HydrophobicContact CB-CE1 4.25Å; H268-F270 HydrophobicContact CB-CE2 3.84Å; H268-F270 HydrophobicContact CB-CZ 3.62Å; H268-F270 AromaticContact CE1-CE1 3.97Å; H268-F270 AromaticContact CG-CE1 3.82Å; H268-F270 AromaticContact CG-CZ 3.7Å; H268-F270 AromaticContact ND1-CD1 3.7Å; H268-F270 AromaticContact ND1-CE1 3.4Å; H268-F270 WeakPolarHBondContact ND1-CE1 3.36Å; H268-F270 AromaticContact ND1-CZ 3.72Å; H268-F270 VanDerWaalsContact O-CD2 3.24Å; H268-F270 WeakPolarHBondContact O-CD2 3.48Å; H268-F270 WeakPolarHBondContact O-CE2 3.44Å; H268-F270 PolarHBondContact O-N 2.83Å; F270-L281 HydrophobicContact CD2-CD2 3.88Å; F270-L281 HydrophobicContact CE2-CD2 4.03Å; F270-I284 HydrophobicContact CB-CD1 4.32Å; F270-I284 HydrophobicContact CD2-CD1 3.95Å; F270-I284 HydrophobicContact CG-CD1 4.14Å
271	A	88.3	Confident	86.7	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.008	29%	0.288	C	S	.	.	S	Bend	trans	-143	169.5	-179.5	0	0	0	0	0	108	Y239 H273 L275 M280	Y239-A271 HydrophobicContact CD1-CB 3.62Å; Y239-A271 HydrophobicContact CE1-CB 3.77Å; Y239-A271 HydrophobicContact CG-CB 4.16Å; A271-H273 PolarHBondContact O-N 2.83Å; A271-L275 HydrophobicContact CB-CB 4.26Å; A271-M280 HydrophobicContact CB-CE 4.13Å; A271-M280 HydrophobicContact CB-SD 3.87Å
272	P	81.5	Confident	86.7	Confident	15 Å²	15	54.4 Å²	54.4	10%	0.097	28%	0.279	C	S	.	.			trans	-49.6	137.1	167.7	-26.6	35.1	0	0	0	110.5	I227 V228 M274 L275 Q276	I227-P272 WeakPolarHBondContact O-CD 3.44Å; V228-P272 WeakPolarHBondContact O-CA 3.14Å; P272-M274 PolarHBondContact O-N 3.41Å; P272-L275 HydrophobicContact CB-CG 4.42Å; P272-L275 HydrophobicContact CG-CD1 4.26Å; P272-L275 PolarHBondContact O-N 3.31Å; P272-Q276 PolarHBondContact O-N 3.29Å
273	H	78.6	Confident	86.6	Confident	176 Å²	176	58.9 Å²	58.9	82%	0.815	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-49.4	-38	-167.7	179.3	62.1	0	0	0	113.9	A271 L275 Q276	A271-H273 PolarHBondContact O-N 2.83Å; H273-L275 VanDerWaalsContact C-N 3.31Å; H273-L275 PolarHBondContact O-N 3.17Å; H273-Q276 PolarHBondContact O-N 3Å
274	M	72.5	Confident	86.9	Confident	56 Å²	56	51.3 Å²	51.3	28%	0.276	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-68.6	-24.1	178.8	-56	-175.1	-75.8	0	0	115.2	P272 Q489 R724	P272-M274 PolarHBondContact O-N 3.41Å; M274-Q489 HydrophobicContact CE-CG 4.22Å; M274-Q489 PolarHBondContact SD-NE2 2.83Å; M274-R724 PolarHBondContact SD-NH1 2.85Å; M274-R724 PolarHBondContact SD-NH2 2.77Å
275	L	77.8	Confident	87	Confident	7 Å²	7	48.7 Å²	48.7	4%	0.037	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-92.2	-13.8	-178.6	-60	-171.8	0	0	0	112.4	Y239 A271 P272 H273 T277 M280 Q489 Y490	Y239-L275 HydrophobicContact CE2-CD1 4.11Å; A271-L275 HydrophobicContact CB-CB 4.26Å; P272-L275 HydrophobicContact CB-CG 4.42Å; P272-L275 HydrophobicContact CG-CD1 4.26Å; P272-L275 PolarHBondContact O-N 3.31Å; H273-L275 VanDerWaalsContact C-N 3.31Å; H273-L275 PolarHBondContact O-N 3.17Å; L275-T277 PolarHBondContact O-N 3.03Å; L275-M280 VanDerWaalsContact O-CE 3.29Å; L275-M280 WeakPolarHBondContact O-CE 2.9Å; L275-Q489 HydrophobicContact CD2-CB 4.46Å; L275-Q489 HydrophobicContact CD2-CG 3.58Å; L275-Q489 HydrophobicContact CG-CG 4.33Å; L275-Y490 VanDerWaalsContact CD2-O 3.29Å; L275-Y490 WeakPolarHBondContact CD2-O 3.44Å
276	Q	85.1	Confident	86.9	Confident	38 Å²	38	53.2 Å²	53.2	18%	0.178	27%	0.271	C	S	.	.			trans	-79.9	84.8	-178	-175.1	160	-41.8	0	0	110.6	Q266 H268 P272 H273 L281	Q266-Q276 PolarHBondContact O-NE2 3.36Å; H268-Q276 PolarHBondContact O-NE2 2.95Å; H268-Q276 PolarHBondContact O-OE1 3.36Å; P272-Q276 PolarHBondContact O-N 3.29Å; H273-Q276 PolarHBondContact O-N 3Å; Q276-L281 HydrophobicContact CG-CD2 4.05Å; Q276-L281 HydrophobicContact CG-CG 4.35Å
277	T	85.7	Confident	87	Confident	37 Å²	37	51.3 Å²	51.3	23%	0.227	26%	0.263	C	S	.	.			trans	-88.9	158	178.6	66.5	0	0	0	0	112.1	L275 E279 M280 L281	L275-T277 PolarHBondContact O-N 3.03Å; T277-E279 PolarHBondContact O-N 2.91Å; T277-M280 WeakPolarHBondContact O-CB 3.24Å; T277-M280 PolarHBondContact O-N 3.07Å; T277-M280 VanDerWaalsContact O-N 3.08Å; T277-M280 PolarHBondContact OG1-N 2.86Å; T277-L281 PolarHBondContact O-N 3.39Å; T277-L281 VanDerWaalsContact O-N 3.08Å
278	P	84.7	Confident	87.5	Confident	93 Å²	93	45.1 Å²	45.1	60%	0.604	23%	0.23	S	C	*	.	H	α-helix	trans	-56.6	-31.2	171.5	-26.3	35.3	0	0	0	113.6	I262 L281 G282	I262-P278 HydrophobicContact CD1-CB 4.06Å; P278-L281 PolarHBondContact O-N 2.87Å; P278-G282 PolarHBondContact O-N 2.99Å
279	E	84.4	Confident	87.6	Confident	103 Å²	103	47.5 Å²	47.5	48%	0.481	24%	0.24	S	C	.	.	H	α-helix	trans	-65.4	-46	174	-172.2	-167.1	168.6	0	0	111.6	F236 T277 L281 G282 R283	F236-E279 HydrophobicContact CZ-CG 4.44Å; T277-E279 PolarHBondContact O-N 2.91Å; E279-L281 VanDerWaalsContact C-N 3.29Å; E279-L281 PolarHBondContact O-N 2.83Å; E279-G282 PolarHBondContact O-N 3.25Å; E279-G282 VanDerWaalsContact O-N 3.13Å; E279-R283 WeakPolarHBondContact O-CG 3.5Å; E279-R283 PolarHBondContact O-N 2.61Å
280	M	89.2	Confident	87.7	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-55.2	-48.9	174.3	-177.7	-178.5	-76.3	0	0	110.2	F236 Y239 A271 L275 T277 G282 R283 I284	F236-M280 HydrophobicContact CD2-CE 3.77Å; F236-M280 HydrophobicContact CE2-CB 3.71Å; F236-M280 HydrophobicContact CE2-CE 3.93Å; F236-M280 HydrophobicContact CE2-CG 4.23Å; F236-M280 HydrophobicContact CZ-CB 4.01Å; Y239-M280 HydrophobicContact CD2-CE 4.37Å; Y239-M280 HydrophobicContact CG-CE 4.25Å; A271-M280 HydrophobicContact CB-CE 4.13Å; A271-M280 HydrophobicContact CB-SD 3.87Å; L275-M280 VanDerWaalsContact O-CE 3.29Å; L275-M280 WeakPolarHBondContact O-CE 2.9Å; T277-M280 WeakPolarHBondContact O-CB 3.24Å; T277-M280 PolarHBondContact O-N 3.07Å; T277-M280 VanDerWaalsContact O-N 3.08Å; T277-M280 PolarHBondContact OG1-N 2.86Å; M280-G282 VanDerWaalsContact C-N 3.32Å; M280-G282 PolarHBondContact O-N 3.34Å; M280-R283 PolarHBondContact O-N 3.41Å; M280-I284 HydrophobicContact CG-CD1 3.82Å; M280-I284 HydrophobicContact CG-CG1 4.47Å; M280-I284 WeakPolarHBondContact O-CD1 3.44Å; M280-I284 WeakPolarHBondContact O-CG1 3.41Å; M280-I284 PolarHBondContact O-N 3Å
281	L	91	Very high	87.6	Confident	10 Å²	10	52.3 Å²	52.3	5%	0.052	26%	0.262	C	S	.	.	H	α-helix	trans	-60.2	-42.7	177.4	-61.9	177.9	0	0	0	111.5	I262 I265 Q266 F270 Q276 T277 P278 E279 R283 I284 V285	I262-L281 HydrophobicContact CB-CB 3.88Å; I262-L281 HydrophobicContact CB-CD1 4.45Å; I262-L281 HydrophobicContact CD1-CB 4.4Å; I262-L281 HydrophobicContact CD1-CD1 4.14Å; I262-L281 HydrophobicContact CG2-CB 3.7Å; I265-L281 HydrophobicContact CD1-CB 4.13Å; I265-L281 HydrophobicContact CD1-CD2 3.97Å; I265-L281 HydrophobicContact CG1-CD2 4.18Å; Q266-L281 HydrophobicContact CB-CD1 4.21Å; F270-L281 HydrophobicContact CD2-CD2 3.88Å; F270-L281 HydrophobicContact CE2-CD2 4.03Å; Q276-L281 HydrophobicContact CG-CD2 4.05Å; Q276-L281 HydrophobicContact CG-CG 4.35Å; T277-L281 PolarHBondContact O-N 3.39Å; T277-L281 VanDerWaalsContact O-N 3.08Å; P278-L281 PolarHBondContact O-N 2.87Å; E279-L281 VanDerWaalsContact C-N 3.29Å; E279-L281 PolarHBondContact O-N 2.83Å; L281-R283 PolarHBondContact O-N 2.83Å; L281-I284 HydrophobicContact CD2-CD1 4.31Å; L281-I284 WeakPolarHBondContact O-CB 3.4Å; L281-I284 PolarHBondContact O-N 3.47Å; L281-V285 WeakPolarHBondContact O-CG2 3.45Å; L281-V285 PolarHBondContact O-N 3.27Å
282	G	90.1	Very high	87.5	Confident	26 Å²	26	60.9 Å²	60.9	27%	0.268	29%	0.294	S	S	.	.	H	α-helix	trans	-58.6	-45	174.4	0	0	0	0	0	112.8	P278 E279 M280 V285 E286	P278-G282 PolarHBondContact O-N 2.99Å; E279-G282 PolarHBondContact O-N 3.25Å; E279-G282 VanDerWaalsContact O-N 3.13Å; M280-G282 VanDerWaalsContact C-N 3.32Å; M280-G282 PolarHBondContact O-N 3.34Å; G282-V285 PolarHBondContact O-N 2.95Å; G282-E286 PolarHBondContact O-N 2.98Å
283	R	90.6	Very high	87.8	Confident	145 Å²	145	62.8 Å²	62.8	55%	0.547	32%	0.316	S	S	.	.	H	α-helix	trans	-65.2	-38	176.1	-67.6	-61.2	-171.8	162.8	1	112.6	F236 C240 E279 M280 L281 V285 E286 L287	F236-R283 HydrophobicContact CE1-CG 4.35Å; C240-R283 HydrophobicContact CB-CB 4.36Å; E279-R283 WeakPolarHBondContact O-CG 3.5Å; E279-R283 PolarHBondContact O-N 2.61Å; M280-R283 PolarHBondContact O-N 3.41Å; L281-R283 PolarHBondContact O-N 2.83Å; R283-V285 VanDerWaalsContact C-N 3.32Å; R283-E286 PolarHBondContact O-N 2.84Å; R283-L287 WeakPolarHBondContact O-CG 3.29Å; R283-L287 PolarHBondContact O-N 2.81Å
284	I	95.4	Very high	88.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-60.9	-43.4	174.2	-68.6	163.4	0	0	0	110.4	C240 A243 V247 I265 F270 M280 L281 L287 H288	C240-I284 HydrophobicContact CB-CG1 4.29Å; A243-I284 HydrophobicContact CB-CD1 3.39Å; A243-I284 HydrophobicContact CB-CG1 3.67Å; A243-I284 HydrophobicContact CB-CG2 4.27Å; V247-I284 HydrophobicContact CG2-CG2 3.72Å; I265-I284 HydrophobicContact CD1-CB 4.02Å; I265-I284 HydrophobicContact CD1-CG2 3.76Å; F270-I284 HydrophobicContact CB-CD1 4.32Å; F270-I284 HydrophobicContact CD2-CD1 3.95Å; F270-I284 HydrophobicContact CG-CD1 4.14Å; M280-I284 HydrophobicContact CG-CD1 3.82Å; M280-I284 HydrophobicContact CG-CG1 4.47Å; M280-I284 WeakPolarHBondContact O-CD1 3.44Å; M280-I284 WeakPolarHBondContact O-CG1 3.41Å; M280-I284 PolarHBondContact O-N 3Å; L281-I284 HydrophobicContact CD2-CD1 4.31Å; L281-I284 WeakPolarHBondContact O-CB 3.4Å; L281-I284 PolarHBondContact O-N 3.47Å; I284-L287 PolarHBondContact O-N 2.91Å; I284-H288 WeakPolarHBondContact O-CB 3.18Å; I284-H288 PolarHBondContact O-N 3.5Å
285	V	93.1	Very high	89.2	Confident	7 Å²	7	56.6 Å²	56.6	4%	0.042	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-44.7	176.5	173.8	0	0	0	0	111.3	I262 Y264 I265 L281 G282 R283 L287 H288 K289	I262-V285 HydrophobicContact CG2-CG2 4.31Å; Y264-V285 HydrophobicContact CE1-CG2 3.85Å; I265-V285 HydrophobicContact CD1-CG2 3.69Å; I265-V285 HydrophobicContact CG1-CG2 4.33Å; L281-V285 WeakPolarHBondContact O-CG2 3.45Å; L281-V285 PolarHBondContact O-N 3.27Å; G282-V285 PolarHBondContact O-N 2.95Å; R283-V285 VanDerWaalsContact C-N 3.32Å; V285-L287 VanDerWaalsContact C-N 3.35Å; V285-L287 PolarHBondContact O-N 3.22Å; V285-H288 PolarHBondContact O-N 2.85Å; V285-K289 WeakPolarHBondContact O-CG 3.47Å; V285-K289 PolarHBondContact O-N 3.12Å
286	E	91.8	Very high	89.7	Confident	100 Å²	100	56.9 Å²	56.9	47%	0.467	29%	0.291	S	S	.	.	H	α-helix	trans	-63.5	-39.2	176.7	-65.1	-50	136.3	0	0	112.6	G282 R283 K289	G282-E286 PolarHBondContact O-N 2.98Å; R283-E286 PolarHBondContact O-N 2.84Å; E286-K289 IonicContact OE1-NZ 3.85Å; E286-K289 PolarHBondContact OE1-NZ 3.41Å; E286-K289 IonicContact OE2-NZ 2.81Å; E286-K289 PolarHBondContact OE2-NZ 2.87Å
287	L	91.4	Very high	89.8	Confident	47 Å²	47	57.8 Å²	57.8	25%	0.246	30%	0.295	C	S	.	.	H	α-helix	trans	-69.8	-37.2	175.6	-71.9	173.8	0	0	0	112.5	C240 I241 S244 R283 I284 V285 K289 L290 H291	C240-L287 HydrophobicContact CB-CD1 3.83Å; I241-L287 HydrophobicContact CG1-CD1 4.12Å; S244-L287 VanDerWaalsContact CB-CB 3.42Å; R283-L287 WeakPolarHBondContact O-CG 3.29Å; R283-L287 PolarHBondContact O-N 2.81Å; I284-L287 PolarHBondContact O-N 2.91Å; V285-L287 VanDerWaalsContact C-N 3.35Å; V285-L287 PolarHBondContact O-N 3.22Å; L287-K289 VanDerWaalsContact C-N 3.27Å; L287-K289 PolarHBondContact O-N 3.21Å; L287-L290 HydrophobicContact CD2-CD1 4.24Å; L287-L290 WeakPolarHBondContact O-CB 3.46Å; L287-L290 PolarHBondContact O-N 3.15Å; L287-H291 PolarHBondContact O-CD2 2.93Å; L287-H291 VanDerWaalsContact O-CD2 3.28Å
288	H	95.2	Very high	89.9	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-57.4	-41	176.1	175.6	-153.2	0	0	0	111.3	V247 Q248 G252 H254 H259 Y264 I284 V285 L290 H291	V247-H288 HydrophobicContact CG1-CB 4.24Å; V247-H288 VanDerWaalsContact CG1-ND1 3.35Å; V247-H288 WeakPolarHBondContact CG1-ND1 3.35Å; Q248-H288 PolarHBondContact OE1-CD2 3.1Å; G252-H288 PolarHBondContact O-NE2 2.88Å; H254-H288 AromaticContact CD2-ND1 3.85Å; H254-H288 PolarHBondContact N-NE2 2.88Å; H259-H288 AromaticContact ND1-CE1 3.9Å; Y264-H288 AromaticContact CE2-ND1 3.9Å; Y264-H288 AromaticContact CZ-ND1 3.76Å; Y264-H288 PolarHBondContact OH-ND1 3.36Å; I284-H288 WeakPolarHBondContact O-CB 3.18Å; I284-H288 PolarHBondContact O-N 3.5Å; V285-H288 PolarHBondContact O-N 2.85Å; H288-L290 PolarHBondContact O-N 3.08Å; H288-L290 VanDerWaalsContact O-N 3.15Å; H288-H291 PolarHBondContact O-N 3Å; H288-H291 VanDerWaalsContact O-N 3.08Å
289	K	91.3	Very high	90.3	Very high	85 Å²	85	55.1 Å²	55.1	37%	0.37	27%	0.272	S	S	.	.	H	α-helix	trans	-57.4	-30.2	174.8	-64.4	170.8	-164.9	170.5	0	113.4	H254 V285 E286 L287 H291	H254-K289 HydrophobicContact CB-CG 4.31Å; V285-K289 WeakPolarHBondContact O-CG 3.47Å; V285-K289 PolarHBondContact O-N 3.12Å; E286-K289 IonicContact OE1-NZ 3.85Å; E286-K289 PolarHBondContact OE1-NZ 3.41Å; E286-K289 IonicContact OE2-NZ 2.81Å; E286-K289 PolarHBondContact OE2-NZ 2.87Å; L287-K289 VanDerWaalsContact C-N 3.27Å; L287-K289 PolarHBondContact O-N 3.21Å; K289-H291 VanDerWaalsContact C-N 3.35Å
290	L	91.3	Very high	90.7	Very high	133 Å²	133	50.3 Å²	50.3	70%	0.696	25%	0.249	S	C	*	.	H	α-helix	trans	-80.7	-15.3	-178.6	-57.5	179.5	0	0	0	113.2	L287 H288 R292	L287-L290 HydrophobicContact CD2-CD1 4.24Å; L287-L290 WeakPolarHBondContact O-CB 3.46Å; L287-L290 PolarHBondContact O-N 3.15Å; H288-L290 PolarHBondContact O-N 3.08Å; H288-L290 VanDerWaalsContact O-N 3.15Å; L290-R292 VanDerWaalsContact C-N 3.34Å
291	H	90.4	Very high	90.8	Very high	17 Å²	17	54 Å²	54	8%	0.079	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	4.4	-177.7	-64	-41.8	0	0	0	114	S244 Y245 Q248 L287 H288 K289 G293 K294	S244-H291 PolarHBondContact OG-NE2 3.04Å; Y245-H291 AromaticContact CD1-CE1 3.93Å; Y245-H291 AromaticContact CD1-NE2 3.83Å; Y245-H291 AromaticContact CE1-CE1 3.31Å; Y245-H291 WeakPolarHBondContact CE1-CE1 3.18Å; Y245-H291 AromaticContact CE1-ND1 3.73Å; Y245-H291 AromaticContact CE1-NE2 3.65Å; Y245-H291 AromaticContact CZ-CE1 3.87Å; Q248-H291 HydrophobicContact CB-CB 4.07Å; Q248-H291 HydrophobicContact CG-CB 3.8Å; Q248-H291 PolarHBondContact NE2-O 2.96Å; L287-H291 PolarHBondContact O-CD2 2.93Å; L287-H291 VanDerWaalsContact O-CD2 3.28Å; H288-H291 PolarHBondContact O-N 3Å; H288-H291 VanDerWaalsContact O-N 3.08Å; K289-H291 VanDerWaalsContact C-N 3.35Å; H291-G293 PolarHBondContact O-N 2.93Å; H291-K294 HydrophobicContact CB-CD 4.17Å; H291-K294 VanDerWaalsContact O-CB 3.24Å; H291-K294 WeakPolarHBondContact O-CB 2.95Å; H291-K294 WeakPolarHBondContact O-CG 3.5Å; H291-K294 PolarHBondContact O-N 3.4Å; H291-K294 VanDerWaalsContact O-N 3.07Å
292	R	87.2	Confident	90.9	Very high	182 Å²	182	55.3 Å²	55.3	69%	0.687	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	134.2	179.5	-173.1	-179	177.3	-171.7	-2.1	112.2	D253 L290 K294	D253-R292 HydrophobicContact CB-CG 4.36Å; D253-R292 WeakPolarHBondContact OD1-CA 3.33Å; D253-R292 WeakPolarHBondContact OD2-CG 3.34Å; L290-R292 VanDerWaalsContact C-N 3.34Å; R292-K294 VanDerWaalsContact C-N 3.33Å
293	G	87.7	Confident	91.3	Very high	54 Å²	54	54.1 Å²	54.1	56%	0.557	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.4	-0.4	-179	0	0	0	0	0	114.2	D253 H291	D253-G293 VanDerWaalsContact CG-N 3.33Å; D253-G293 PolarHBondContact OD1-N 2.98Å; D253-G293 PolarHBondContact OD2-N 2.73Å; D253-G293 VanDerWaalsContact OD2-N 3.12Å; H291-G293 PolarHBondContact O-N 2.93Å
294	K	90	Very high	91.5	Very high	68 Å²	68	47.2 Å²	47.2	30%	0.296	23%	0.231	S	C	.	.			trans	-84.3	129.8	173.2	-66.6	-173.8	-170.5	-38.4	0	110.5	Q248 H291 R292 L302	Q248-K294 HydrophobicContact CG-CB 4.18Å; Q248-K294 PolarHBondContact NE2-O 3.25Å; H291-K294 HydrophobicContact CB-CD 4.17Å; H291-K294 VanDerWaalsContact O-CB 3.24Å; H291-K294 WeakPolarHBondContact O-CB 2.95Å; H291-K294 WeakPolarHBondContact O-CG 3.5Å; H291-K294 PolarHBondContact O-N 3.4Å; H291-K294 VanDerWaalsContact O-N 3.07Å; R292-K294 VanDerWaalsContact C-N 3.33Å; K294-L302 HydrophobicContact CD-CD1 3.71Å
295	T	89.4	Confident	91.3	Very high	34 Å²	34	48.2 Å²	48.2	21%	0.209	24%	0.237	C	C	.	.			trans	-68.8	156.9	172.4	62.2	0	0	0	0	111	I44 E297 E298 A299	I44-T295 HydrophobicContact CD1-CG2 4.35Å; T295-E297 PolarHBondContact O-N 3.19Å; T295-E298 PolarHBondContact N-OE2 3.41Å; T295-E298 PolarHBondContact O-N 3.37Å; T295-E298 VanDerWaalsContact O-N 3.15Å; T295-E298 WeakPolarHBondContact OG1-CB 3.49Å; T295-E298 VanDerWaalsContact OG1-CG 3.24Å; T295-E298 WeakPolarHBondContact OG1-CG 3.04Å; T295-E298 PolarHBondContact OG1-N 3.5Å; T295-E298 PolarHBondContact OG1-OE2 2.89Å; T295-E298 VanDerWaalsContact OG1-OE2 3.04Å; T295-A299 WeakPolarHBondContact O-CB 3.49Å; T295-A299 PolarHBondContact O-N 3.31Å
296	P	88.7	Confident	91.1	Very high	14 Å²	14	49.7 Å²	49.7	9%	0.091	24%	0.244	C	C	.	.	H	α-helix	trans	-54	-36.6	173.9	-27.4	34.4	0	0	0	113.1	Y53 Y54 S249 A299 D300	Y53-P296 HydrophobicContact CD1-CB 4.47Å; Y53-P296 HydrophobicContact CE1-CB 3.87Å; Y53-P296 HydrophobicContact CE1-CG 4Å; Y54-P296 VanDerWaalsContact OH-C 3.3Å; Y54-P296 PolarHBondContact OH-O 2.83Å; Y54-P296 VanDerWaalsContact OH-O 3.11Å; S249-P296 PolarHBondContact OG-O 3.15Å; P296-A299 PolarHBondContact O-N 3.01Å; P296-D300 WeakPolarHBondContact O-CB 3.44Å; P296-D300 PolarHBondContact O-N 3.4Å
297	E	87	Confident	91.1	Very high	56 Å²	56	44.9 Å²	44.9	26%	0.262	22%	0.222	S	C	.	.	H	α-helix	trans	-63.4	-47.9	177.7	-170.6	-149.7	140.7	0	0	112.2	Y54 L57 D213 R216 T295 A299 D300 R301	Y54-E297 HydrophobicContact CE1-CB 4.35Å; L57-E297 HydrophobicContact CD1-CB 4.41Å; D213-E297 HydrophobicContact CB-CG 4.15Å; D213-E297 VanDerWaalsContact OD1-CG 3.25Å; D213-E297 WeakPolarHBondContact OD1-CG 3.4Å; D213-E297 VanDerWaalsContact OD1-OE1 3.06Å; R216-E297 IonicContact CZ-OE1 2.97Å; R216-E297 IonicContact NH1-OE1 2.87Å; R216-E297 PolarHBondContact NH1-OE1 2.91Å; R216-E297 IonicContact NH2-OE1 2.63Å; T295-E297 PolarHBondContact O-N 3.19Å; E297-A299 VanDerWaalsContact C-N 3.34Å; E297-D300 PolarHBondContact O-N 3.25Å; E297-R301 WeakPolarHBondContact O-CB 3.32Å; E297-R301 PolarHBondContact O-N 3.26Å
298	E	88.6	Confident	91.1	Very high	75 Å²	75	46.9 Å²	46.9	35%	0.35	23%	0.226	S	C	.	.	H	α-helix	trans	-65.8	-39.3	177.1	-71.8	169.3	137.9	0	0	111.6	T295 R301 L302	T295-E298 PolarHBondContact N-OE2 3.41Å; T295-E298 PolarHBondContact O-N 3.37Å; T295-E298 VanDerWaalsContact O-N 3.15Å; T295-E298 WeakPolarHBondContact OG1-CB 3.49Å; T295-E298 VanDerWaalsContact OG1-CG 3.24Å; T295-E298 WeakPolarHBondContact OG1-CG 3.04Å; T295-E298 PolarHBondContact OG1-N 3.5Å; T295-E298 PolarHBondContact OG1-OE2 2.89Å; T295-E298 VanDerWaalsContact OG1-OE2 3.04Å; E298-R301 PolarHBondContact O-N 2.96Å; E298-L302 WeakPolarHBondContact O-CB 3.2Å; E298-L302 VanDerWaalsContact O-CG 3.27Å; E298-L302 WeakPolarHBondContact O-CG 3.5Å; E298-L302 PolarHBondContact O-N 3Å
299	A	92.5	Very high	90.6	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.9	-45.7	175.4	0	0	0	0	0	111.2	Q248 T295 P296 E297 R301 L302 F303	Q248-A299 HydrophobicContact CB-CB 4.22Å; Q248-A299 HydrophobicContact CG-CB 3.99Å; T295-A299 WeakPolarHBondContact O-CB 3.49Å; T295-A299 PolarHBondContact O-N 3.31Å; P296-A299 PolarHBondContact O-N 3.01Å; E297-A299 VanDerWaalsContact C-N 3.34Å; A299-R301 PolarHBondContact O-N 2.98Å; A299-L302 PolarHBondContact O-N 2.9Å; A299-F303 WeakPolarHBondContact O-CB 3.42Å; A299-F303 PolarHBondContact O-N 3.48Å
300	D	93.9	Very high	90.4	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-65.2	-38.5	176.1	-82.6	1.6	0	0	0	112	Y54 C220 R224 S249 P296 E297 F303 L304	Y54-D300 PolarHBondContact OH-OD2 3.02Å; C220-D300 VanDerWaalsContact SG-CB 3.52Å; R224-D300 IonicContact NH2-OD1 2.98Å; S249-D300 WeakPolarHBondContact CB-OD1 3.19Å; S249-D300 PolarHBondContact OG-OD1 2.89Å; P296-D300 WeakPolarHBondContact O-CB 3.44Å; P296-D300 PolarHBondContact O-N 3.4Å; E297-D300 PolarHBondContact O-N 3.25Å; D300-F303 WeakPolarHBondContact O-CB 3.48Å; D300-F303 PolarHBondContact O-N 3.01Å; D300-L304 WeakPolarHBondContact O-CG 3.43Å; D300-L304 PolarHBondContact O-N 2.87Å
301	R	91	Very high	90	Very high	79 Å²	79	47.6 Å²	47.6	30%	0.298	24%	0.235	S	C	.	.	H	α-helix	trans	-64	-40.5	173.2	-172.3	-178.9	61.8	79.1	3.9	112.1	E297 E298 A299 N305	E297-R301 WeakPolarHBondContact O-CB 3.32Å; E297-R301 PolarHBondContact O-N 3.26Å; E298-R301 PolarHBondContact O-N 2.96Å; A299-R301 PolarHBondContact O-N 2.98Å; R301-N305 VanDerWaalsContact O-CB 3.3Å; R301-N305 WeakPolarHBondContact O-CB 3.38Å; R301-N305 PolarHBondContact O-N 3.26Å; R301-N305 PolarHBondContact O-ND2 3.4Å
302	L	92.8	Very high	89.9	Confident	39 Å²	39	47.9 Å²	47.9	20%	0.204	24%	0.237	C	C	.	.	H	α-helix	trans	-69.5	-39.4	176.1	-73.9	170.7	0	0	0	111.9	Y245 K294 E298 A299 N305 N306	Y245-L302 HydrophobicContact CD1-CB 3.95Å; Y245-L302 HydrophobicContact CD1-CD1 4.34Å; Y245-L302 HydrophobicContact CD2-CB 4.37Å; Y245-L302 HydrophobicContact CE1-CB 3.62Å; Y245-L302 HydrophobicContact CE1-CD1 3.66Å; Y245-L302 HydrophobicContact CE1-CG 4.26Å; Y245-L302 HydrophobicContact CE2-CB 4.08Å; Y245-L302 HydrophobicContact CG-CB 4.32Å; K294-L302 HydrophobicContact CD-CD1 3.71Å; E298-L302 WeakPolarHBondContact O-CB 3.2Å; E298-L302 VanDerWaalsContact O-CG 3.27Å; E298-L302 WeakPolarHBondContact O-CG 3.5Å; E298-L302 PolarHBondContact O-N 3Å; A299-L302 PolarHBondContact O-N 2.9Å; L302-N305 PolarHBondContact O-N 3.13Å; L302-N306 PolarHBondContact O-N 2.62Å; L302-N306 PolarHBondContact O-ND2 2.91Å
303	F	97.2	Very high	90.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-54.9	-54.6	172.7	173.1	-93.1	0	0	0	110.5	C220 V223 R224 I227 L242 Y245 I246 A299 D300 N305 N306 A307	C220-F303 HydrophobicContact CB-CD1 4.14Å; C220-F303 HydrophobicContact CB-CE1 4.19Å; V223-F303 HydrophobicContact CB-CE1 3.84Å; V223-F303 HydrophobicContact CB-CZ 4.25Å; V223-F303 HydrophobicContact CG1-CE1 3.54Å; V223-F303 HydrophobicContact CG1-CZ 3.7Å; R224-F303 HydrophobicContact CG-CE1 4.38Å; R224-F303 HydrophobicContact CG-CE2 4.32Å; R224-F303 HydrophobicContact CG-CZ 3.75Å; I227-F303 HydrophobicContact CD1-CE2 4.09Å; I227-F303 HydrophobicContact CD1-CZ 3.82Å; L242-F303 HydrophobicContact CB-CD2 3.96Å; L242-F303 HydrophobicContact CB-CE2 3.79Å; L242-F303 HydrophobicContact CD2-CD2 3.78Å; L242-F303 HydrophobicContact CD2-CE2 4.07Å; L242-F303 HydrophobicContact CD2-CG 4.35Å; L242-F303 WeakPolarHBondContact CD2-O 3.17Å; L242-F303 HydrophobicContact CG-CD2 4.44Å; L242-F303 HydrophobicContact CG-CE2 4.38Å; L242-F303 WeakPolarHBondContact O-CD2 3.48Å; Y245-F303 HydrophobicContact CD2-CB 4.32Å; Y245-F303 HydrophobicContact CG-CB 4.39Å; I246-F303 HydrophobicContact CD1-CE2 3.84Å; I246-F303 HydrophobicContact CG1-CD2 4.02Å; I246-F303 HydrophobicContact CG1-CE2 3.79Å; A299-F303 WeakPolarHBondContact O-CB 3.42Å; A299-F303 PolarHBondContact O-N 3.48Å; D300-F303 WeakPolarHBondContact O-CB 3.48Å; D300-F303 PolarHBondContact O-N 3.01Å; F303-N305 PolarHBondContact O-N 3.26Å; F303-N306 PolarHBondContact O-N 2.89Å; F303-A307 WeakPolarHBondContact O-CB 3.17Å; F303-A307 PolarHBondContact O-N 3.21Å
304	L	95.3	Very high	90.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65.7	-37.6	179.6	-67.6	175.3	0	0	0	113.1	I207 R216 L219 C220 V223 D300 N306 A307 R308	I207-L304 HydrophobicContact CD1-CB 3.9Å; I207-L304 HydrophobicContact CG1-CB 3.94Å; I207-L304 HydrophobicContact CG2-CB 3.84Å; I207-L304 HydrophobicContact CG2-CD1 3.85Å; R216-L304 HydrophobicContact CG-CD1 3.38Å; L219-L304 HydrophobicContact CB-CD1 4.39Å; L219-L304 HydrophobicContact CD2-CD1 3.88Å; L219-L304 HydrophobicContact CD2-CD2 4.15Å; L219-L304 HydrophobicContact CG-CD1 4.16Å; L219-L304 HydrophobicContact CG-CD2 3.84Å; C220-L304 VanDerWaalsContact SG-CG 3.55Å; V223-L304 HydrophobicContact CB-CD2 4.48Å; V223-L304 HydrophobicContact CG2-CD2 4.01Å; D300-L304 WeakPolarHBondContact O-CG 3.43Å; D300-L304 PolarHBondContact O-N 2.87Å; L304-N306 PolarHBondContact O-N 2.93Å; L304-A307 PolarHBondContact O-N 2.95Å; L304-R308 WeakPolarHBondContact O-CB 3.48Å; L304-R308 PolarHBondContact O-N 2.75Å
305	N	90.7	Very high	90.5	Very high	21 Å²	21	35.2 Å²	35.2	11%	0.112	18%	0.177	C	C	.	.	H	α-helix	trans	-64.9	-28.1	176.6	-90.9	-56.7	0	0	0	113.4	R301 L302 F303 R308 K309	R301-N305 VanDerWaalsContact O-CB 3.3Å; R301-N305 WeakPolarHBondContact O-CB 3.38Å; R301-N305 PolarHBondContact O-N 3.26Å; R301-N305 PolarHBondContact O-ND2 3.4Å; L302-N305 PolarHBondContact O-N 3.13Å; F303-N305 PolarHBondContact O-N 3.26Å; N305-R308 WeakPolarHBondContact O-CG 3.43Å; N305-R308 PolarHBondContact OD1-NE 2.66Å; N305-R308 PolarHBondContact OD1-NH2 2.87Å; N305-K309 WeakPolarHBondContact O-CE 3.39Å
306	N	90.6	Very high	90.7	Very high	38 Å²	38	35 Å²	35	20%	0.203	18%	0.175	C	C	.	.	H	α-helix	trans	-82.5	-42.5	171.5	-75.7	-71.9	0	0	0	111.2	L242 Y245 L302 F303 L304 R308 K309	L242-N306 HydrophobicContact CD2-CB 3.74Å; Y245-N306 WeakPolarHBondContact CE2-ND2 3.35Å; L302-N306 PolarHBondContact O-N 2.62Å; L302-N306 PolarHBondContact O-ND2 2.91Å; F303-N306 PolarHBondContact O-N 2.89Å; L304-N306 PolarHBondContact O-N 2.93Å; N306-R308 PolarHBondContact O-N 3.32Å; N306-K309 WeakPolarHBondContact O-CB 3.43Å; N306-K309 PolarHBondContact O-N 3.37Å
307	A	91.4	Very high	90.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.2	-38.5	179.1	0	0	0	0	0	112.9	V223 L242 F303 L304 K309 L310 Y313	V223-A307 HydrophobicContact CG1-CB 3.75Å; L242-A307 HydrophobicContact CD2-CB 4.3Å; F303-A307 WeakPolarHBondContact O-CB 3.17Å; F303-A307 PolarHBondContact O-N 3.21Å; L304-A307 PolarHBondContact O-N 2.95Å; A307-K309 PolarHBondContact O-N 3.04Å; A307-L310 WeakPolarHBondContact O-CB 3.35Å; A307-L310 WeakPolarHBondContact O-CG 3.42Å; A307-L310 PolarHBondContact O-N 3.36Å; A307-Y313 HydrophobicContact CB-CD2 4.34Å
308	R	90.3	Very high	91.1	Very high	88 Å²	88	35.3 Å²	35.3	33%	0.332	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.8	179.1	73.5	168.1	-176.4	175.3	-3.1	114.4	C205 L304 N305 N306 L310 Y313	C205-R308 VanDerWaalsContact O-CD 3.23Å; C205-R308 WeakPolarHBondContact O-CD 3.18Å; C205-R308 PolarHBondContact O-NH1 3.16Å; L304-R308 WeakPolarHBondContact O-CB 3.48Å; L304-R308 PolarHBondContact O-N 2.75Å; N305-R308 WeakPolarHBondContact O-CG 3.43Å; N305-R308 PolarHBondContact OD1-NE 2.66Å; N305-R308 PolarHBondContact OD1-NH2 2.87Å; N306-R308 PolarHBondContact O-N 3.32Å; R308-L310 VanDerWaalsContact C-N 3.27Å; R308-Y313 HydrophobicContact CB-CD1 4.12Å; R308-Y313 HydrophobicContact CB-CE1 4.03Å; R308-Y313 HydrophobicContact CB-CG 4.45Å
309	K	85.3	Confident	91.1	Very high	150 Å²	150	35.7 Å²	35.7	65%	0.652	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-14.7	177.6	-58.8	173.1	-175.4	170	0	111.6	N305 N306 A307	N305-K309 WeakPolarHBondContact O-CE 3.39Å; N306-K309 WeakPolarHBondContact O-CB 3.43Å; N306-K309 PolarHBondContact O-N 3.37Å; A307-K309 PolarHBondContact O-N 3.04Å
310	L	86.6	Confident	91.1	Very high	27 Å²	27	35.9 Å²	35.9	14%	0.141	18%	0.178	C	C	.	.	S	Bend	trans	-73.1	140.4	179	-62	176.9	0	0	0	111.1	L232 C234 T238 L242 A307 R308 L312 Y313	L232-L310 HydrophobicContact CD1-CB 3.68Å; L232-L310 HydrophobicContact CD1-CD1 3.95Å; L232-L310 HydrophobicContact CD1-CG 4.48Å; L232-L310 HydrophobicContact CD2-CD1 3.88Å; L232-L310 HydrophobicContact CG-CB 4.35Å; L232-L310 HydrophobicContact CG-CD1 3.65Å; C234-L310 HydrophobicContact CB-CD1 3.82Å; C234-L310 HydrophobicContact CB-CD2 3.53Å; C234-L310 HydrophobicContact CB-CG 4.35Å; T238-L310 HydrophobicContact CG2-CD2 4.09Å; L242-L310 HydrophobicContact CD1-CD1 4.13Å; A307-L310 WeakPolarHBondContact O-CB 3.35Å; A307-L310 WeakPolarHBondContact O-CG 3.42Å; A307-L310 PolarHBondContact O-N 3.36Å; R308-L310 VanDerWaalsContact C-N 3.27Å; L310-L312 PolarHBondContact O-N 3.31Å; L310-Y313 WeakPolarHBondContact O-CB 3.32Å; L310-Y313 PolarHBondContact O-N 3.5Å
311	A	82.7	Confident	91	Very high	56 Å²	56	40.2 Å²	40.2	46%	0.463	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-27.6	-170.3	0	0	0	0	0	114.3
312	L	89	Confident	90.8	Very high	23 Å²	23	37.7 Å²	37.7	12%	0.12	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	12.5	-178.5	-65.4	-179.6	0	0	0	113.5	L232 P233 L310 G314 V315 Y340 Y488	L232-L312 VanDerWaalsContact CD1-C 3.43Å; L232-L312 HydrophobicContact CD1-CB 4.18Å; P233-L312 HydrophobicContact CG-CD1 3.87Å; L310-L312 PolarHBondContact O-N 3.31Å; L312-G314 PolarHBondContact O-N 3.43Å; L312-V315 HydrophobicContact CD2-CB 4.26Å; L312-V315 HydrophobicContact CD2-CG1 4.32Å; L312-V315 HydrophobicContact CD2-CG2 4.41Å; L312-V315 PolarHBondContact O-N 3.37Å; L312-V315 VanDerWaalsContact O-N 3.15Å; L312-Y340 HydrophobicContact CD2-CE1 4.34Å; L312-Y488 HydrophobicContact CD1-CE2 4.38Å
313	Y	93.4	Very high	90.4	Very high	5 Å²	5	41 Å²	41	2%	0.02	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	114.9	178.2	172.4	-98.7	0	0	0	111.2	Y203 P204 V223 L232 A307 R308 L310 V315	Y203-Y313 HydrophobicContact CD1-CD2 4.45Å; Y203-Y313 HydrophobicContact CD1-CE1 4.49Å; Y203-Y313 AromaticContact CD1-CE2 3.96Å; Y203-Y313 HydrophobicContact CD1-CE2 3.96Å; Y203-Y313 AromaticContact CD1-CZ 3.99Å; P204-Y313 WeakPolarHBondContact O-CE1 3.32Å; P204-Y313 PolarHBondContact O-OH 2.85Å; P204-Y313 VanDerWaalsContact O-OH 3.1Å; V223-Y313 HydrophobicContact CG2-CD2 4.37Å; V223-Y313 HydrophobicContact CG2-CE2 3.82Å; L232-Y313 VanDerWaalsContact CD1-N 3.3Å; L232-Y313 HydrophobicContact CD2-CD2 4.38Å; A307-Y313 HydrophobicContact CB-CD2 4.34Å; R308-Y313 HydrophobicContact CB-CD1 4.12Å; R308-Y313 HydrophobicContact CB-CE1 4.03Å; R308-Y313 HydrophobicContact CB-CG 4.45Å; L310-Y313 WeakPolarHBondContact O-CB 3.32Å; L310-Y313 PolarHBondContact O-N 3.5Å; Y313-V315 VanDerWaalsContact C-N 3.25Å; Y313-V315 PolarHBondContact O-N 3.12Å
314	G	92.6	Very high	89.6	Confident	11 Å²	11	48.4 Å²	48.4	11%	0.113	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	27	179.7	0	0	0	0	0	114.6	L312	L312-G314 PolarHBondContact O-N 3.43Å
315	V	92.6	Very high	89	Confident	23 Å²	23	50.4 Å²	50.4	14%	0.139	27%	0.272	C	S	.	.			trans	-93.3	111.9	178.8	-178	0	0	0	0	110.2	L312 Y313 L317 Y333 L338 Y340	L312-V315 HydrophobicContact CD2-CB 4.26Å; L312-V315 HydrophobicContact CD2-CG1 4.32Å; L312-V315 HydrophobicContact CD2-CG2 4.41Å; L312-V315 PolarHBondContact O-N 3.37Å; L312-V315 VanDerWaalsContact O-N 3.15Å; Y313-V315 VanDerWaalsContact C-N 3.25Å; Y313-V315 PolarHBondContact O-N 3.12Å; V315-L317 HydrophobicContact CG1-CD2 3.76Å; V315-L317 HydrophobicContact CG1-CG 4.18Å; V315-Y333 HydrophobicContact CG2-CG 4.37Å; V315-L338 HydrophobicContact CG1-CD1 4.29Å; V315-L338 HydrophobicContact CG2-CD1 4.1Å; V315-Y340 HydrophobicContact CG1-CE2 4.4Å
316	D	92.9	Very high	88.6	Confident	30 Å²	30	52.6 Å²	52.6	16%	0.16	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	112.4	174	-179.5	9	0	0	0	110.6	H318 G331 V332 V395	D316-H318 PolarHBondContact O-CD2 2.68Å; D316-H318 IonicContact OD1-CD2 2.76Å; D316-H318 IonicContact OD1-CE1 2.71Å; D316-H318 IonicContact OD1-NE2 2.81Å; D316-H318 PolarHBondContact OD1-NE2 2.99Å; D316-H318 VanDerWaalsContact OD1-NE2 3.08Å; D316-H318 IonicContact OD2-CD2 3.13Å; D316-H318 IonicContact OD2-CE1 3.92Å; D316-H318 IonicContact OD2-NE2 3.12Å; D316-H318 PolarHBondContact OD2-NE2 3.07Å; D316-G331 CarbonylContact O-C 3.52Å; D316-G331 WeakPolarHBondContact O-CA 3.24Å; D316-V332 HydrophobicContact CB-CB 4.46Å; D316-V332 PolarHBondContact N-O 2.86Å; D316-V332 PolarHBondContact O-N 2.95Å; D316-V395 VanDerWaalsContact OD2-CG1 3.26Å; D316-V395 WeakPolarHBondContact OD2-CG1 3.39Å
317	L	90.7	Very high	88.3	Confident	68 Å²	68	55.6 Å²	55.6	36%	0.356	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	126.5	-170.7	-67.6	172.4	0	0	0	112.9	V315 T329 L330 Y340	V315-L317 HydrophobicContact CG1-CD2 3.76Å; V315-L317 HydrophobicContact CG1-CG 4.18Å; L317-T329 HydrophobicContact CB-CG2 3.75Å; L317-T329 HydrophobicContact CD2-CG2 3.73Å; L317-T329 HydrophobicContact CG-CG2 4.25Å; L317-L330 CarbonylContact C-O 3.08Å; L317-L330 WeakPolarHBondContact CA-O 3.36Å; L317-Y340 HydrophobicContact CD2-CD2 4.01Å; L317-Y340 HydrophobicContact CD2-CE2 4.12Å
318	H	92.3	Very high	88	Confident	7 Å²	7	56.1 Å²	56.1	3%	0.032	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	119.9	-179.6	-61.7	-96.5	0	0	0	111.6	D316 T329 L330 L392	D316-H318 PolarHBondContact O-CD2 2.68Å; D316-H318 IonicContact OD1-CD2 2.76Å; D316-H318 IonicContact OD1-CE1 2.71Å; D316-H318 IonicContact OD1-NE2 2.81Å; D316-H318 PolarHBondContact OD1-NE2 2.99Å; D316-H318 VanDerWaalsContact OD1-NE2 3.08Å; D316-H318 IonicContact OD2-CD2 3.13Å; D316-H318 IonicContact OD2-CE1 3.92Å; D316-H318 IonicContact OD2-NE2 3.12Å; D316-H318 PolarHBondContact OD2-NE2 3.07Å; H318-T329 CarbonylContact O-C 3.57Å; H318-T329 WeakPolarHBondContact O-CA 3.19Å; H318-L330 PolarHBondContact N-O 3.32Å; H318-L330 PolarHBondContact O-N 3.34Å; H318-L392 HydrophobicContact CB-CD1 3.91Å; H318-L392 HydrophobicContact CB-CD2 4.26Å; H318-L392 HydrophobicContact CB-CG 4.49Å
319	K	88.6	Confident	87.9	Confident	84 Å²	84	53.6 Å²	53.6	37%	0.365	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	127.7	178.9	-66.8	173.3	179.7	157.1	0	111.2	R591 G592	K319-R591 PolarHBondContact NZ-O 3.21Å; K319-G592 WeakPolarHBondContact CD-O 3.32Å; K319-G592 VanDerWaalsContact NZ-C 3.32Å
320	V	93.8	Very high	88.3	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.018	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	163.2	-178.5	-55.4	0	0	0	0	111.4	I328 L330 F381 L392	V320-I328 HydrophobicContact CG2-CD1 3.92Å; V320-I328 HydrophobicContact CG2-CG1 3.62Å; V320-I328 PolarHBondContact N-O 2.66Å; V320-I328 CarbonylContact O-C 3.48Å; V320-I328 WeakPolarHBondContact O-CG1 3.38Å; V320-I328 PolarHBondContact O-N 2.89Å; V320-L330 HydrophobicContact CG1-CD1 4.19Å; V320-L330 HydrophobicContact CG2-CD1 3.82Å; V320-L330 HydrophobicContact CG2-CG 3.7Å; V320-F381 HydrophobicContact CB-CB 4.1Å; V320-F381 HydrophobicContact CG2-CB 3.83Å; V320-F381 HydrophobicContact CG2-CD1 4.06Å; V320-F381 HydrophobicContact CG2-CG 4.17Å; V320-L392 HydrophobicContact CG1-CD2 4.03Å
321	K	90.9	Very high	88.7	Confident	92 Å²	92	45.2 Å²	45.2	40%	0.4	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	144.4	171.9	-69.6	-175.2	171	-168.3	0	111.6	Q326 D327 F381 K382	K321-Q326 CarbonylContact C-O 3.59Å; K321-Q326 VanDerWaalsContact CA-O 3.23Å; K321-Q326 WeakPolarHBondContact CA-O 3.4Å; K321-D327 VanDerWaalsContact CE-CG 3.43Å; K321-D327 WeakPolarHBondContact CE-OD1 3.46Å; K321-D327 WeakPolarHBondContact CE-OD2 3.44Å; K321-D327 VanDerWaalsContact CG-OD1 3.25Å; K321-D327 WeakPolarHBondContact CG-OD1 3.39Å; K321-D327 IonicContact NZ-OD1 3.37Å; K321-D327 IonicContact NZ-OD2 3.5Å; K321-F381 CarbonylContact O-C 3.51Å; K321-F381 WeakPolarHBondContact O-CA 3.38Å; K321-K382 HydrophobicContact CB-CB 4.38Å; K321-K382 PolarHBondContact N-O 2.79Å; K321-K382 PolarHBondContact O-N 2.81Å
322	T	88	Confident	89.2	Confident	27 Å²	27	42.5 Å²	42.5	17%	0.166	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	172	172	65.9	0	0	0	0	111.6	Q324 G325 Q326 I328	T322-Q324 PolarHBondContact O-N 3.35Å; T322-Q324 PolarHBondContact OG1-N 3.12Å; T322-G325 PolarHBondContact O-N 2.82Å; T322-G325 PolarHBondContact OG1-N 2.82Å; T322-Q326 HydrophobicContact CG2-CB 4.27Å; T322-Q326 PolarHBondContact N-O 3.5Å; T322-Q326 WeakPolarHBondContact OG1-CB 3.35Å; T322-Q326 PolarHBondContact OG1-N 3.24Å; T322-Q326 VanDerWaalsContact OG1-N 3.11Å; T322-I328 HydrophobicContact CG2-CD1 3.7Å; T322-I328 HydrophobicContact CG2-CG1 3.98Å; T322-I328 HydrophobicContact CG2-CG2 3.98Å
323	S	82.5	Confident	89.5	Confident	109 Å²	109	42.1 Å²	42.1	76%	0.762	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-26.9	170.2	51.7	0	0	0	0	113	G325	S323-G325 VanDerWaalsContact C-N 3.3Å
324	Q	81.7	Confident	89.4	Confident	154 Å²	154	45.2 Å²	45.2	72%	0.72	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.5	0.9	175.2	-59.8	-179.5	1.6	0	0	113	T322	T322-Q324 PolarHBondContact O-N 3.35Å; T322-Q324 PolarHBondContact OG1-N 3.12Å
325	G	82.3	Confident	89.1	Confident	42 Å²	42	45.1 Å²	45.1	43%	0.433	24%	0.243	S	C	.	.			trans	85.2	6.3	177.5	0	0	0	0	0	115.8	T322 S323	T322-G325 PolarHBondContact O-N 2.82Å; T322-G325 PolarHBondContact OG1-N 2.82Å; S323-G325 VanDerWaalsContact C-N 3.3Å
326	Q	81.8	Confident	89.1	Confident	68 Å²	68	44 Å²	44	32%	0.318	24%	0.237	S	C	.	.			trans	-78.5	136.1	-179.4	-60.5	175.2	-8.6	0	0	111.6	K321 T322	K321-Q326 CarbonylContact C-O 3.59Å; K321-Q326 VanDerWaalsContact CA-O 3.23Å; K321-Q326 WeakPolarHBondContact CA-O 3.4Å; T322-Q326 HydrophobicContact CG2-CB 4.27Å; T322-Q326 PolarHBondContact N-O 3.5Å; T322-Q326 WeakPolarHBondContact OG1-CB 3.35Å; T322-Q326 PolarHBondContact OG1-N 3.24Å; T322-Q326 VanDerWaalsContact OG1-N 3.11Å
327	D	83.9	Confident	89.2	Confident	101 Å²	101	42.7 Å²	42.7	54%	0.54	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	124.7	175.5	-74.7	-61.8	0	0	0	111.9	K321	K321-D327 VanDerWaalsContact CE-CG 3.43Å; K321-D327 WeakPolarHBondContact CE-OD1 3.46Å; K321-D327 WeakPolarHBondContact CE-OD2 3.44Å; K321-D327 VanDerWaalsContact CG-OD1 3.25Å; K321-D327 WeakPolarHBondContact CG-OD1 3.39Å; K321-D327 IonicContact NZ-OD1 3.37Å; K321-D327 IonicContact NZ-OD2 3.5Å
328	I	87	Confident	89.1	Confident	11 Å²	11	39.6 Å²	39.6	6%	0.056	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	164.8	177.9	60.8	160.5	0	0	0	110	V320 T322 L330 Y340 R341 F381	V320-I328 HydrophobicContact CG2-CD1 3.92Å; V320-I328 HydrophobicContact CG2-CG1 3.62Å; V320-I328 PolarHBondContact N-O 2.66Å; V320-I328 CarbonylContact O-C 3.48Å; V320-I328 WeakPolarHBondContact O-CG1 3.38Å; V320-I328 PolarHBondContact O-N 2.89Å; T322-I328 HydrophobicContact CG2-CD1 3.7Å; T322-I328 HydrophobicContact CG2-CG1 3.98Å; T322-I328 HydrophobicContact CG2-CG2 3.98Å; I328-L330 HydrophobicContact CD1-CD2 4.35Å; I328-Y340 CarbonylContact C-O 3.59Å; I328-Y340 WeakPolarHBondContact CA-O 3.39Å; I328-Y340 WeakPolarHBondContact CB-O 3.35Å; I328-R341 HydrophobicContact CG2-CB 4.43Å; I328-F381 HydrophobicContact CD1-CD1 3.56Å; I328-F381 HydrophobicContact CD1-CE1 3.41Å; I328-F381 VanDerWaalsContact CD1-CE1 3.41Å
329	T	87.4	Confident	88.9	Confident	35 Å²	35	39.8 Å²	39.8	22%	0.215	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129.2	176.5	-54.4	0	0	0	0	109.7	L317 H318 Y340	L317-T329 HydrophobicContact CB-CG2 3.75Å; L317-T329 HydrophobicContact CD2-CG2 3.73Å; L317-T329 HydrophobicContact CG-CG2 4.25Å; H318-T329 CarbonylContact O-C 3.57Å; H318-T329 WeakPolarHBondContact O-CA 3.19Å; T329-Y340 PolarHBondContact N-O 3.18Å; T329-Y340 PolarHBondContact O-N 2.81Å
330	L	94	Very high	88.5	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	123.1	173	-63.6	179.3	0	0	0	109.7	L317 H318 V320 I328 I337 L338 L339 F364 F381 L392	L317-L330 CarbonylContact C-O 3.08Å; L317-L330 WeakPolarHBondContact CA-O 3.36Å; H318-L330 PolarHBondContact N-O 3.32Å; H318-L330 PolarHBondContact O-N 3.34Å; V320-L330 HydrophobicContact CG1-CD1 4.19Å; V320-L330 HydrophobicContact CG2-CD1 3.82Å; V320-L330 HydrophobicContact CG2-CG 3.7Å; I328-L330 HydrophobicContact CD1-CD2 4.35Å; L330-I337 HydrophobicContact CB-CG2 4.44Å; L330-I337 HydrophobicContact CD2-CG2 4.29Å; L330-L338 CarbonylContact C-O 3.51Å; L330-L338 VanDerWaalsContact CA-O 3.3Å; L330-L338 WeakPolarHBondContact CA-O 3.24Å; L330-L339 HydrophobicContact CD2-CD1 3.88Å; L330-L339 HydrophobicContact CD2-CG 3.64Å; L330-F364 HydrophobicContact CD1-CD1 4.05Å; L330-F364 HydrophobicContact CD1-CE1 4.19Å; L330-F381 HydrophobicContact CD1-CB 4.24Å; L330-F381 HydrophobicContact CD1-CD1 4.49Å; L330-F381 HydrophobicContact CD1-CD2 3.82Å; L330-F381 HydrophobicContact CD1-CE2 4.26Å; L330-F381 HydrophobicContact CD1-CG 3.92Å; L330-F381 HydrophobicContact CD2-CE1 4.28Å; L330-F381 HydrophobicContact CD2-CE2 4.33Å; L330-F381 HydrophobicContact CD2-CZ 4.13Å; L330-L392 HydrophobicContact CD1-CD2 3.91Å
331	G	93.7	Very high	87.8	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	123	173.6	0	0	0	0	0	111.4	D316 I337 L338	D316-G331 CarbonylContact O-C 3.52Å; D316-G331 WeakPolarHBondContact O-CA 3.24Å; G331-I337 CarbonylContact O-C 3.6Å; G331-I337 WeakPolarHBondContact O-CA 3.27Å; G331-L338 PolarHBondContact N-O 3.22Å; G331-L338 PolarHBondContact O-N 3.13Å
332	V	95	Very high	86.6	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	127.7	176	-173.6	0	0	0	0	109.1	D316 W351 L392 V395 C396 H399	D316-V332 HydrophobicContact CB-CB 4.46Å; D316-V332 PolarHBondContact N-O 2.86Å; D316-V332 PolarHBondContact O-N 2.95Å; V332-W351 HydrophobicContact CG1-CH2 3.7Å; V332-W351 HydrophobicContact CG1-CZ2 3.77Å; V332-L392 HydrophobicContact CG2-CD1 4.04Å; V332-V395 HydrophobicContact CB-CG1 3.99Å; V332-V395 HydrophobicContact CG1-CG1 3.98Å; V332-V395 HydrophobicContact CG2-CG1 4.1Å; V332-C396 WeakPolarHBondContact CG2-SG 3.36Å; V332-H399 HydrophobicContact CG1-CB 3.87Å
333	Y	94.1	Very high	85.4	Confident	15 Å²	15	41.8 Å²	41.8	6%	0.059	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	-179.2	-177.6	85.4	-60.6	0	0	0	112.1	V315 G335 G336 L338 R348 W351	V315-Y333 HydrophobicContact CG2-CG 4.37Å; Y333-G335 VanDerWaalsContact CZ-CA 3.41Å; Y333-G335 PolarHBondContact O-N 2.86Å; Y333-G336 WeakPolarHBondContact CD1-O 3.38Å; Y333-G336 VanDerWaalsContact CE1-N 3.3Å; Y333-G336 PolarHBondContact N-O 3.22Å; Y333-G336 PolarHBondContact O-N 2.89Å; Y333-L338 HydrophobicContact CD1-CD1 3.84Å; Y333-L338 HydrophobicContact CD1-CD2 4.13Å; Y333-L338 HydrophobicContact CD1-CG 3.7Å; Y333-L338 HydrophobicContact CE1-CD1 3.91Å; Y333-L338 HydrophobicContact CE1-CD2 3.47Å; Y333-L338 VanDerWaalsContact CE1-CD2 3.47Å; Y333-L338 HydrophobicContact CE1-CG 3.59Å; Y333-L338 HydrophobicContact CG-CD1 4.31Å; Y333-R348 WeakPolarHBondContact OH-CD 3.07Å; Y333-R348 VanDerWaalsContact OH-CZ 3.22Å; Y333-R348 PolarHBondContact OH-NE 2.97Å; Y333-R348 PolarHBondContact OH-NH2 3.42Å; Y333-W351 WeakPolarHBondContact O-CZ2 3.2Å; Y333-W351 PolarHBondContact O-NE1 3.25Å
334	Y	90.6	Very high	84.7	Confident	70 Å²	70	37.5 Å²	37.5	28%	0.275	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-33.5	-177.2	76	-100	0	0	0	113.9	Y203 C205 W351	Y203-Y334 WeakPolarHBondContact O-CB 3.45Å; C205-Y334 HydrophobicContact CB-CD1 3.93Å; C205-Y334 HydrophobicContact CB-CD2 3.47Å; C205-Y334 VanDerWaalsContact CB-CD2 3.47Å; C205-Y334 HydrophobicContact CB-CE1 3.86Å; C205-Y334 HydrophobicContact CB-CE2 3.43Å; C205-Y334 VanDerWaalsContact CB-CE2 3.43Å; C205-Y334 HydrophobicContact CB-CG 3.76Å; C205-Y334 VanDerWaalsContact SG-CE2 3.54Å; Y334-W351 PolarHBondContact O-NE1 3.08Å; Y334-W351 VanDerWaalsContact O-NE1 3.09Å
335	G	87.8	Confident	84.3	Confident	9 Å²	9	33.5 Å²	33.5	9%	0.093	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-7.1	-171.8	0	0	0	0	0	114.9	Y333 S350	Y333-G335 VanDerWaalsContact CZ-CA 3.41Å; Y333-G335 PolarHBondContact O-N 2.86Å; G335-S350 WeakPolarHBondContact O-CA 3.21Å
336	G	91.9	Very high	83.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	145	-150.1	-177.1	0	0	0	0	0	114.5	Y333 I349 W351	Y333-G336 WeakPolarHBondContact CD1-O 3.38Å; Y333-G336 VanDerWaalsContact CE1-N 3.3Å; Y333-G336 PolarHBondContact N-O 3.22Å; Y333-G336 PolarHBondContact O-N 2.89Å; G336-I349 CarbonylContact C-O 3.54Å; G336-I349 WeakPolarHBondContact CA-O 3.39Å; G336-W351 VanDerWaalsContact CA-CE2 3.41Å; G336-W351 VanDerWaalsContact N-NE1 3.15Å; G336-W351 WeakPolarHBondContact O-CZ2 3.49Å
337	I	94.3	Very high	83.9	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	129.8	172.6	-59.3	172.2	0	0	0	108.5	L330 G331 I349 W351 I354 L357 I366 C396	L330-I337 HydrophobicContact CB-CG2 4.44Å; L330-I337 HydrophobicContact CD2-CG2 4.29Å; G331-I337 CarbonylContact O-C 3.6Å; G331-I337 WeakPolarHBondContact O-CA 3.27Å; I337-I349 PolarHBondContact N-O 3.29Å; I337-I349 PolarHBondContact O-N 2.98Å; I337-W351 HydrophobicContact CD1-CH2 4.27Å; I337-W351 HydrophobicContact CD1-CZ3 3.99Å; I337-W351 HydrophobicContact CG1-CH2 3.73Å; I337-W351 HydrophobicContact CG1-CZ3 3.8Å; I337-I354 HydrophobicContact CD1-CD1 3.77Å; I337-I354 HydrophobicContact CG1-CD1 4.17Å; I337-L357 HydrophobicContact CD1-CD2 4.18Å; I337-I366 HydrophobicContact CD1-CD1 3.72Å; I337-I366 HydrophobicContact CD1-CG1 4.5Å; I337-I366 HydrophobicContact CG2-CD1 4.31Å; I337-C396 HydrophobicContact CD1-CB 4.39Å
338	L	89.5	Confident	83.8	Confident	3 Å²	3	35.8 Å²	35.8	2%	0.016	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	144.1	177.1	-56.3	179.7	0	0	0	108.9	V315 L330 G331 Y333 Y340 M347 R348	V315-L338 HydrophobicContact CG1-CD1 4.29Å; V315-L338 HydrophobicContact CG2-CD1 4.1Å; L330-L338 CarbonylContact C-O 3.51Å; L330-L338 VanDerWaalsContact CA-O 3.3Å; L330-L338 WeakPolarHBondContact CA-O 3.24Å; G331-L338 PolarHBondContact N-O 3.22Å; G331-L338 PolarHBondContact O-N 3.13Å; Y333-L338 HydrophobicContact CD1-CD1 3.84Å; Y333-L338 HydrophobicContact CD1-CD2 4.13Å; Y333-L338 HydrophobicContact CD1-CG 3.7Å; Y333-L338 HydrophobicContact CE1-CD1 3.91Å; Y333-L338 HydrophobicContact CE1-CD2 3.47Å; Y333-L338 VanDerWaalsContact CE1-CD2 3.47Å; Y333-L338 HydrophobicContact CE1-CG 3.59Å; Y333-L338 HydrophobicContact CG-CD1 4.31Å; L338-Y340 HydrophobicContact CB-CD2 4.05Å; L338-Y340 HydrophobicContact CB-CE2 3.44Å; L338-Y340 VanDerWaalsContact CB-CE2 3.44Å; L338-Y340 HydrophobicContact CD1-CE2 3.83Å; L338-Y340 VanDerWaalsContact CD1-OH 3.31Å; L338-Y340 WeakPolarHBondContact CD1-OH 3.44Å; L338-Y340 HydrophobicContact CG-CE2 4.27Å; L338-M347 CarbonylContact C-O 3.5Å; L338-M347 WeakPolarHBondContact CA-O 3.23Å; L338-R348 HydrophobicContact CD2-CB 3.75Å; L338-R348 HydrophobicContact CD2-CG 3.73Å
339	L	87.2	Confident	83.8	Confident	11 Å²	11	35.4 Å²	35.4	6%	0.058	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	127	171.1	-79.2	69.5	0	0	0	107.9	L330 R345 L346 M347 I349 M379 F381	L330-L339 HydrophobicContact CD2-CD1 3.88Å; L330-L339 HydrophobicContact CD2-CG 3.64Å; L339-R345 CarbonylContact O-C 3.59Å; L339-R345 WeakPolarHBondContact O-CA 3.22Å; L339-L346 HydrophobicContact CB-CB 4.3Å; L339-L346 PolarHBondContact O-N 3.39Å; L339-M347 HydrophobicContact CB-CB 4.31Å; L339-M347 HydrophobicContact CD1-CE 3.81Å; L339-M347 HydrophobicContact CD2-CE 3.59Å; L339-M347 HydrophobicContact CG-CE 4.29Å; L339-M347 PolarHBondContact N-O 2.94Å; L339-M347 PolarHBondContact O-N 3.37Å; L339-I349 HydrophobicContact CD1-CD1 3.89Å; L339-I349 HydrophobicContact CD1-CG1 4.27Å; L339-M379 HydrophobicContact CD2-CE 4.02Å; L339-F381 HydrophobicContact CD2-CE1 4.23Å; L339-F381 HydrophobicContact CD2-CZ 4.03Å; L339-F381 HydrophobicContact CG-CZ 4.49Å
340	Y	81.2	Confident	83.9	Confident	19 Å²	19	35.2 Å²	35.2	8%	0.075	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	145.5	176.4	-69.1	-92.2	0	0	0	111	L312 V315 L317 I328 T329 L338 I344 R345	L312-Y340 HydrophobicContact CD2-CE1 4.34Å; V315-Y340 HydrophobicContact CG1-CE2 4.4Å; L317-Y340 HydrophobicContact CD2-CD2 4.01Å; L317-Y340 HydrophobicContact CD2-CE2 4.12Å; I328-Y340 CarbonylContact C-O 3.59Å; I328-Y340 WeakPolarHBondContact CA-O 3.39Å; I328-Y340 WeakPolarHBondContact CB-O 3.35Å; T329-Y340 PolarHBondContact N-O 3.18Å; T329-Y340 PolarHBondContact O-N 2.81Å; L338-Y340 HydrophobicContact CB-CD2 4.05Å; L338-Y340 HydrophobicContact CB-CE2 3.44Å; L338-Y340 VanDerWaalsContact CB-CE2 3.44Å; L338-Y340 HydrophobicContact CD1-CE2 3.83Å; L338-Y340 VanDerWaalsContact CD1-OH 3.31Å; L338-Y340 WeakPolarHBondContact CD1-OH 3.44Å; L338-Y340 HydrophobicContact CG-CE2 4.27Å; Y340-I344 CarbonylContact C-O 3.49Å; Y340-I344 WeakPolarHBondContact CA-O 3.1Å; Y340-R345 HydrophobicContact CD1-CB 3.99Å; Y340-R345 HydrophobicContact CE1-CB 3.65Å; Y340-R345 HydrophobicContact CE1-CG 4.16Å
341	R	77.8	Confident	83.7	Confident	46 Å²	46	35.6 Å²	35.6	17%	0.174	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	131.7	165.7	-178.6	179.7	-177.4	-175.7	-0.3	106.9	I328 R343 I344 L346 E951	I328-R341 HydrophobicContact CG2-CB 4.43Å; R341-R343 PolarHBondContact O-N 2.94Å; R341-R343 VanDerWaalsContact O-N 3.12Å; R341-I344 PolarHBondContact N-O 3.36Å; R341-I344 WeakPolarHBondContact O-CA 3.29Å; R341-I344 WeakPolarHBondContact O-CB 3.39Å; R341-I344 WeakPolarHBondContact O-CD1 3.17Å; R341-I344 PolarHBondContact O-N 3.49Å; R341-L346 HydrophobicContact CB-CD1 3.61Å; R341-L346 HydrophobicContact CB-CD2 4.19Å; R341-L346 HydrophobicContact CB-CG 3.95Å; R341-E951 IonicContact NH1-OE2 2.82Å
342	N	67.6	Low	83.3	Confident	74 Å²	74	39 Å²	39	40%	0.396	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	42.3	178.8	-52	-2.9	0	0	0	113.6	I344 P576	N342-I344 HydrophobicContact CB-CD1 4.24Å; N342-I344 PolarHBondContact O-N 2.86Å; N342-P576 HydrophobicContact CB-CB 3.85Å; N342-P576 WeakPolarHBondContact OD1-CB 3.36Å; N342-P576 WeakPolarHBondContact OD1-CG 3.33Å
343	R	62.1	Low	82.8	Confident	110 Å²	110	44 Å²	44	42%	0.415	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	-2.6	-176.8	-47.8	170.7	178	-145.1	-8.5	115.8	R341 Q487 Y488 L578	R341-R343 PolarHBondContact O-N 2.94Å; R341-R343 VanDerWaalsContact O-N 3.12Å; R343-Q487 VanDerWaalsContact CZ-O 3.31Å; R343-Q487 PolarHBondContact NH1-O 3.1Å; R343-Q487 PolarHBondContact NH2-O 2.93Å; R343-Y488 HydrophobicContact CG-CE1 4.24Å; R343-L578 PolarHBondContact NH2-O 3.47Å
344	I	66.5	Low	82.5	Confident	18 Å²	18	43.4 Å²	43.4	9%	0.092	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	134.5	178.1	-49.8	141.2	0	0	0	109.2	Y340 R341 N342 L346 T943 C947	Y340-I344 CarbonylContact C-O 3.49Å; Y340-I344 WeakPolarHBondContact CA-O 3.1Å; R341-I344 PolarHBondContact N-O 3.36Å; R341-I344 WeakPolarHBondContact O-CA 3.29Å; R341-I344 WeakPolarHBondContact O-CB 3.39Å; R341-I344 WeakPolarHBondContact O-CD1 3.17Å; R341-I344 PolarHBondContact O-N 3.49Å; N342-I344 HydrophobicContact CB-CD1 4.24Å; N342-I344 PolarHBondContact O-N 2.86Å; I344-L346 PolarHBondContact O-N 3.36Å; I344-T943 HydrophobicContact CG1-CG2 4.42Å; I344-T943 HydrophobicContact CG2-CG2 3.63Å; I344-C947 HydrophobicContact CD1-CB 3.16Å; I344-C947 WeakPolarHBondContact CD1-O 3.35Å; I344-C947 VanDerWaalsContact CD1-SG 3.57Å; I344-C947 HydrophobicContact CG1-CB 3.4Å; I344-C947 WeakPolarHBondContact CG1-SG 3.41Å
345	R	73.6	Confident	82.3	Confident	71 Å²	71	44 Å²	44	27%	0.268	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	107.4	174.1	-171.3	178.6	65.8	174.7	7.9	109.7	L339 Y340 P940 D941	L339-R345 CarbonylContact O-C 3.59Å; L339-R345 WeakPolarHBondContact O-CA 3.22Å; Y340-R345 HydrophobicContact CD1-CB 3.99Å; Y340-R345 HydrophobicContact CE1-CB 3.65Å; Y340-R345 HydrophobicContact CE1-CG 4.16Å; R345-P940 PolarHBondContact NH2-O 2.84Å; R345-D941 IonicContact NH2-OD1 3.7Å; R345-D941 PolarHBondContact NH2-OD1 3.27Å
346	L	75.4	Confident	82.3	Confident	80 Å²	80	46.6 Å²	46.6	42%	0.419	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	-42	178.7	-61	-178.1	0	0	0	112.8	L339 R341 I344	L339-L346 HydrophobicContact CB-CB 4.3Å; L339-L346 PolarHBondContact O-N 3.39Å; R341-L346 HydrophobicContact CB-CD1 3.61Å; R341-L346 HydrophobicContact CB-CD2 4.19Å; R341-L346 HydrophobicContact CB-CG 3.95Å; I344-L346 PolarHBondContact O-N 3.36Å
347	M	80.5	Confident	82.5	Confident	49 Å²	49	47.4 Å²	47.4	24%	0.241	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	151.8	-173.5	-176.3	176.6	55.5	0	0	111.3	L338 L339 I349 R368 M379	L338-M347 CarbonylContact C-O 3.5Å; L338-M347 WeakPolarHBondContact CA-O 3.23Å; L339-M347 HydrophobicContact CB-CB 4.31Å; L339-M347 HydrophobicContact CD1-CE 3.81Å; L339-M347 HydrophobicContact CD2-CE 3.59Å; L339-M347 HydrophobicContact CG-CE 4.29Å; L339-M347 PolarHBondContact N-O 2.94Å; L339-M347 PolarHBondContact O-N 3.37Å; M347-I349 HydrophobicContact CE-CD1 3.82Å; M347-I349 HydrophobicContact CE-CG1 3.8Å; M347-I349 HydrophobicContact SD-CG1 4.34Å; M347-R368 PolarHBondContact SD-NH1 2.95Å; M347-R368 VanDerWaalsContact SD-NH1 3.43Å; M347-M379 HydrophobicContact CE-CE 3.58Å; M347-M379 HydrophobicContact CE-SD 3.65Å
348	R	82.9	Confident	82.5	Confident	129 Å²	129	49.7 Å²	49.7	49%	0.487	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	129.1	168.1	172.2	-177.3	172.7	-162.8	4.7	110.7	Y333 L338	Y333-R348 WeakPolarHBondContact OH-CD 3.07Å; Y333-R348 VanDerWaalsContact OH-CZ 3.22Å; Y333-R348 PolarHBondContact OH-NE 2.97Å; Y333-R348 PolarHBondContact OH-NH2 3.42Å; L338-R348 HydrophobicContact CD2-CB 3.75Å; L338-R348 HydrophobicContact CD2-CG 3.73Å
349	I	86.9	Confident	82.8	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.021	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	103.9	173.4	-50.7	170	0	0	0	108	G336 I337 L339 M347 I354 I366 R368 M379	G336-I349 CarbonylContact C-O 3.54Å; G336-I349 WeakPolarHBondContact CA-O 3.39Å; I337-I349 PolarHBondContact N-O 3.29Å; I337-I349 PolarHBondContact O-N 2.98Å; L339-I349 HydrophobicContact CD1-CD1 3.89Å; L339-I349 HydrophobicContact CD1-CG1 4.27Å; M347-I349 HydrophobicContact CE-CD1 3.82Å; M347-I349 HydrophobicContact CE-CG1 3.8Å; M347-I349 HydrophobicContact SD-CG1 4.34Å; I349-I354 HydrophobicContact CG2-CD1 3.94Å; I349-I354 HydrophobicContact CG2-CG1 3.56Å; I349-I366 HydrophobicContact CD1-CD1 4.16Å; I349-R368 HydrophobicContact CG2-CG 4.18Å; I349-M379 HydrophobicContact CD1-SD 3.92Å
350	S	88.6	Confident	83.1	Confident	30 Å²	30	62.2 Å²	62.2	21%	0.21	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	146.7	179.7	64.9	0	0	0	0	112.4	G335 P352 R353	G335-S350 WeakPolarHBondContact O-CA 3.21Å; S350-P352 VanDerWaalsContact C-CD 3.41Å; S350-P352 VanDerWaalsContact C-N 3.3Å; S350-R353 PolarHBondContact O-N 3Å; S350-R353 WeakPolarHBondContact OG-CG 3.47Å
351	W	90.3	Very high	83.8	Confident	8 Å²	8	63.6 Å²	63.6	3%	0.03	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-49.6	-42.4	179.1	-63.9	125.9	0	0	0	114	V332 Y333 Y334 G336 I337 R353 I354 C396 H399 H400 R404	V332-W351 HydrophobicContact CG1-CH2 3.7Å; V332-W351 HydrophobicContact CG1-CZ2 3.77Å; Y333-W351 WeakPolarHBondContact O-CZ2 3.2Å; Y333-W351 PolarHBondContact O-NE1 3.25Å; Y334-W351 PolarHBondContact O-NE1 3.08Å; Y334-W351 VanDerWaalsContact O-NE1 3.09Å; G336-W351 VanDerWaalsContact CA-CE2 3.41Å; G336-W351 VanDerWaalsContact N-NE1 3.15Å; G336-W351 WeakPolarHBondContact O-CZ2 3.49Å; I337-W351 HydrophobicContact CD1-CH2 4.27Å; I337-W351 HydrophobicContact CD1-CZ3 3.99Å; I337-W351 HydrophobicContact CG1-CH2 3.73Å; I337-W351 HydrophobicContact CG1-CZ3 3.8Å; W351-R353 VanDerWaalsContact C-N 3.25Å; W351-R353 PolarHBondContact O-N 2.82Å; W351-I354 HydrophobicContact CE3-CD1 3.69Å; W351-I354 HydrophobicContact CZ3-CD1 3.86Å; W351-I354 PolarHBondContact O-N 2.88Å; W351-C396 HydrophobicContact CH2-CB 4.46Å; W351-H399 HydrophobicContact CH2-CB 3.89Å; W351-H399 HydrophobicContact CZ2-CB 3.46Å; W351-H399 VanDerWaalsContact CZ2-CB 3.46Å; W351-H400 HydrophobicContact CD2-CB 4.21Å; W351-H400 HydrophobicContact CE3-CB 3.64Å; W351-H400 AromaticContact CE3-CD2 3.67Å; W351-H400 HydrophobicContact CZ3-CB 3.81Å; W351-R404 PolarHBondContact O-NH1 2.86Å
352	P	84.2	Confident	84.6	Confident	73 Å²	73	67 Å²	67	47%	0.474	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-63.3	-24.9	178.7	-25.2	36.8	0	0	0	115.3	S350 R369	S350-P352 VanDerWaalsContact C-CD 3.41Å; S350-P352 VanDerWaalsContact C-N 3.3Å; P352-R369 PolarHBondContact O-NH1 2.81Å
353	R	84.9	Confident	85.9	Confident	104 Å²	104	66.4 Å²	66.4	39%	0.392	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-82.8	-16.6	179	-68.9	-175.5	76.2	167	4.3	113	S350 W351 R368 R369	S350-R353 PolarHBondContact O-N 3Å; S350-R353 WeakPolarHBondContact OG-CG 3.47Å; W351-R353 VanDerWaalsContact C-N 3.25Å; W351-R353 PolarHBondContact O-N 2.82Å; R353-R368 WeakPolarHBondContact O-CA 3.33Å; R353-R369 PolarHBondContact O-N 2.82Å
354	I	88.4	Confident	87.6	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.01	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	124.9	175.8	-61	171.3	0	0	0	108.6	I337 I349 W351 L357 I366 R404	I337-I354 HydrophobicContact CD1-CD1 3.77Å; I337-I354 HydrophobicContact CG1-CD1 4.17Å; I349-I354 HydrophobicContact CG2-CD1 3.94Å; I349-I354 HydrophobicContact CG2-CG1 3.56Å; W351-I354 HydrophobicContact CE3-CD1 3.69Å; W351-I354 HydrophobicContact CZ3-CD1 3.86Å; W351-I354 PolarHBondContact O-N 2.88Å; I354-L357 HydrophobicContact CG2-CD2 3.83Å; I354-L357 HydrophobicContact CG2-CG 3.83Å; I354-I366 HydrophobicContact CD1-CG2 4.37Å; I354-I366 HydrophobicContact CG1-CG2 4.1Å; I354-I366 HydrophobicContact CG2-CG2 4.24Å; I354-R404 PolarHBondContact O-NH1 3.28Å
355	I	86	Confident	88.9	Confident	84 Å²	84	62.2 Å²	62.2	43%	0.431	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-48.2	175.7	-66.7	-179.2	0	0	0	109.8	A367 R369	I355-A367 PolarHBondContact N-O 3.16Å; I355-R369 VanDerWaalsContact CD1-CA 3.49Å; I355-R369 HydrophobicContact CD1-CB 3.98Å; I355-R369 HydrophobicContact CD1-CG 4.38Å; I355-R369 HydrophobicContact CG1-CB 4.06Å
356	S	88.9	Confident	89.8	Confident	62 Å²	62	58.9 Å²	58.9	43%	0.434	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	147.1	-176.3	-175.1	0	0	0	0	110.3	A367	S356-A367 PolarHBondContact N-O 2.85Å; S356-A367 PolarHBondContact O-N 3.08Å
357	L	95	Very high	90.5	Very high	18 Å²	18	55.9 Å²	55.9	9%	0.094	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	140	171.3	-64.7	166.8	0	0	0	106.9	I337 I354 F364 I366 Y393 C396 V397 H400	I337-L357 HydrophobicContact CD1-CD2 4.18Å; I354-L357 HydrophobicContact CG2-CD2 3.83Å; I354-L357 HydrophobicContact CG2-CG 3.83Å; L357-F364 HydrophobicContact CD2-CE2 4.4Å; L357-F364 HydrophobicContact CD2-CZ 3.91Å; L357-I366 HydrophobicContact CD2-CB 4.45Å; L357-I366 HydrophobicContact CD2-CG1 4.09Å; L357-I366 HydrophobicContact CD2-CG2 4.16Å; L357-Y393 HydrophobicContact CB-CD2 4.16Å; L357-Y393 HydrophobicContact CB-CE2 3.95Å; L357-Y393 VanDerWaalsContact O-CE2 3.32Å; L357-Y393 WeakPolarHBondContact O-CE2 3.28Å; L357-C396 HydrophobicContact CD1-CB 3.7Å; L357-V397 HydrophobicContact CB-CG2 4.41Å; L357-V397 HydrophobicContact CD1-CG2 4.19Å; L357-H400 HydrophobicContact CD1-CB 4.43Å
358	S	95.4	Very high	90.7	Very high	49 Å²	49	54.5 Å²	54.5	34%	0.343	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	163.5	173	65.2	0	0	0	0	111.6	I365	S358-I365 PolarHBondContact N-O 2.82Å; S358-I365 PolarHBondContact O-N 2.83Å
359	H	94.9	Very high	90.5	Very high	68 Å²	68	54.3 Å²	54.3	32%	0.315	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	145.3	171.4	71	-77.5	0	0	0	110.3	N363 Y393	H359-N363 CarbonylContact C-O 3.54Å; H359-N363 WeakPolarHBondContact CA-O 3.21Å; H359-Y393 HydrophobicContact CB-CG 4.38Å; H359-Y393 AromaticContact CE1-CD1 3.67Å; H359-Y393 AromaticContact ND1-CD1 3.28Å; H359-Y393 VanDerWaalsContact ND1-CD1 3.28Å; H359-Y393 WeakPolarHBondContact ND1-CD1 3.3Å; H359-Y393 AromaticContact ND1-CD2 3.9Å; H359-Y393 AromaticContact ND1-CE1 3.84Å; H359-Y393 AromaticContact ND1-CG 3.31Å; H359-Y393 VanDerWaalsContact ND1-CG 3.31Å
360	R	94.4	Very high	89.4	Confident	209 Å²	209	58.5 Å²	58.5	79%	0.789	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.6	114.6	175.2	-173.2	178.8	-179.4	-173.1	0.1	109.9	R362 N363	R360-R362 PolarHBondContact O-N 3.12Å; R360-N363 PolarHBondContact N-O 3.01Å; R360-N363 WeakPolarHBondContact O-CB 3.3Å; R360-N363 PolarHBondContact O-N 3.3Å
361	G	95	Very high	88	Confident	47 Å²	47	58.9 Å²	58.9	49%	0.485	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	58	-124.1	-173.4	0	0	0	0	0	110.3	N363 P386	G361-N363 VanDerWaalsContact C-N 3.33Å; G361-P386 VanDerWaalsContact O-CA 3.27Å; G361-P386 WeakPolarHBondContact O-CA 3.49Å; G361-P386 WeakPolarHBondContact O-CB 3.33Å
362	R	94.7	Very high	86.3	Confident	117 Å²	117	67.1 Å²	67.1	44%	0.442	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-6.7	176.5	-69.7	-167	-71.7	178.1	-4.3	114.4	R360 K382 C383 I384	R360-R362 PolarHBondContact O-N 3.12Å; R362-K382 HydrophobicContact CB-CG 4.24Å; R362-C383 PolarHBondContact O-N 2.83Å; R362-I384 WeakPolarHBondContact CD-O 3.2Å
363	N	95.5	Very high	84.8	Confident	62 Å²	62	68.5 Å²	68.5	33%	0.332	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	129.8	-173.8	-62.5	-25.7	0	0	0	110.6	H359 R360 G361 T380 F381	H359-N363 CarbonylContact C-O 3.54Å; H359-N363 WeakPolarHBondContact CA-O 3.21Å; R360-N363 PolarHBondContact N-O 3.01Å; R360-N363 WeakPolarHBondContact O-CB 3.3Å; R360-N363 PolarHBondContact O-N 3.3Å; G361-N363 VanDerWaalsContact C-N 3.33Å; N363-T380 HydrophobicContact CB-CG2 3.93Å; N363-F381 CarbonylContact C-O 3.58Å; N363-F381 WeakPolarHBondContact CA-O 3.39Å
364	F	97	Very high	83.4	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130.6	167.6	175.1	-113.5	0	0	0	108.7	L330 L357 I366 F381 L392 Y393 C396	L330-F364 HydrophobicContact CD1-CD1 4.05Å; L330-F364 HydrophobicContact CD1-CE1 4.19Å; L357-F364 HydrophobicContact CD2-CE2 4.4Å; L357-F364 HydrophobicContact CD2-CZ 3.91Å; F364-I366 HydrophobicContact CD1-CG1 4.24Å; F364-I366 HydrophobicContact CE1-CD1 3.8Å; F364-I366 HydrophobicContact CE1-CG1 3.61Å; F364-I366 HydrophobicContact CZ-CD1 4.49Å; F364-I366 HydrophobicContact CZ-CG1 4.07Å; F364-F381 HydrophobicContact CD1-CD2 4.18Å; F364-F381 PolarHBondContact N-O 3.12Å; F364-F381 PolarHBondContact O-N 2.87Å; F364-L392 HydrophobicContact CB-CD2 4.16Å; F364-L392 HydrophobicContact CD1-CD2 3.52Å; F364-L392 HydrophobicContact CD1-CG 4.04Å; F364-L392 HydrophobicContact CD2-CD2 4.45Å; F364-L392 HydrophobicContact CD2-CG 4.34Å; F364-L392 HydrophobicContact CE1-CD2 3.94Å; F364-L392 HydrophobicContact CE1-CG 4.05Å; F364-L392 HydrophobicContact CE2-CG 4.38Å; F364-L392 HydrophobicContact CG-CD2 3.79Å; F364-L392 HydrophobicContact CG-CG 4.16Å; F364-L392 HydrophobicContact CZ-CG 4.22Å; F364-Y393 HydrophobicContact CE2-CD2 4.19Å; F364-C396 HydrophobicContact CZ-CB 4.09Å
365	I	94.1	Very high	81.9	Confident	41 Å²	41	74.6 Å²	74.6	21%	0.21	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	128.6	-169.2	-55.8	167.6	0	0	0	109.4	S358 M379 T380	S358-I365 PolarHBondContact N-O 2.82Å; S358-I365 PolarHBondContact O-N 2.83Å; I365-M379 CarbonylContact C-O 3.49Å; I365-M379 WeakPolarHBondContact CA-O 3.22Å; I365-T380 HydrophobicContact CG1-CG2 4.05Å
366	I	93	Very high	80.9	Confident	0 Å²	0	77 Å²	77	0%	0	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	114	175.5	-50.2	180	0	0	0	108.4	I337 I349 I354 L357 F364 R368 N378 M379 F381	I337-I366 HydrophobicContact CD1-CD1 3.72Å; I337-I366 HydrophobicContact CD1-CG1 4.5Å; I337-I366 HydrophobicContact CG2-CD1 4.31Å; I349-I366 HydrophobicContact CD1-CD1 4.16Å; I354-I366 HydrophobicContact CD1-CG2 4.37Å; I354-I366 HydrophobicContact CG1-CG2 4.1Å; I354-I366 HydrophobicContact CG2-CG2 4.24Å; L357-I366 HydrophobicContact CD2-CB 4.45Å; L357-I366 HydrophobicContact CD2-CG1 4.09Å; L357-I366 HydrophobicContact CD2-CG2 4.16Å; F364-I366 HydrophobicContact CD1-CG1 4.24Å; F364-I366 HydrophobicContact CE1-CD1 3.8Å; F364-I366 HydrophobicContact CE1-CG1 3.61Å; F364-I366 HydrophobicContact CZ-CD1 4.49Å; F364-I366 HydrophobicContact CZ-CG1 4.07Å; I366-R368 HydrophobicContact CG2-CG 4.19Å; I366-N378 WeakPolarHBondContact O-CA 3.12Å; I366-M379 PolarHBondContact N-O 3.35Å; I366-M379 PolarHBondContact O-N 2.91Å; I366-F381 HydrophobicContact CD1-CD2 4.25Å; I366-F381 HydrophobicContact CD1-CE2 3.68Å; I366-F381 HydrophobicContact CG1-CD2 4.4Å; I366-F381 HydrophobicContact CG1-CE2 4.11Å
367	A	89.1	Confident	80.1	Confident	17 Å²	17	81.3 Å²	81.3	14%	0.14	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	117.1	171.3	0	0	0	0	0	109.6	I355 S356 N378	I355-A367 PolarHBondContact N-O 3.16Å; S356-A367 PolarHBondContact N-O 2.85Å; S356-A367 PolarHBondContact O-N 3.08Å; A367-N378 WeakPolarHBondContact CB-OD1 3.31Å
368	R	84.9	Confident	79.6	Confident	20 Å²	20	84.7 Å²	84.7	8%	0.075	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	155	-179.9	-62	-174.9	-62.5	170.5	0.2	111.1	M347 I349 R353 I366 D376 R377 M379	M347-R368 PolarHBondContact SD-NH1 2.95Å; M347-R368 VanDerWaalsContact SD-NH1 3.43Å; I349-R368 HydrophobicContact CG2-CG 4.18Å; R353-R368 WeakPolarHBondContact O-CA 3.33Å; I366-R368 HydrophobicContact CG2-CG 4.19Å; R368-D376 PolarHBondContact NH2-O 3.09Å; R368-R377 PolarHBondContact N-O 2.87Å; R368-M379 VanDerWaalsContact CZ-SD 3.55Å
369	R	78.7	Confident	79.3	Confident	125 Å²	125	84 Å²	84	47%	0.472	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-66.3	131.4	167.9	-168.5	175	-76.1	114.9	4.4	108.6	P352 R353 I355 G371	P352-R369 PolarHBondContact O-NH1 2.81Å; R353-R369 PolarHBondContact O-N 2.82Å; I355-R369 VanDerWaalsContact CD1-CA 3.49Å; I355-R369 HydrophobicContact CD1-CB 3.98Å; I355-R369 HydrophobicContact CD1-CG 4.38Å; I355-R369 HydrophobicContact CG1-CB 4.06Å; R369-G371 PolarHBondContact O-N 3.46Å
370	P	65.1	Low	79.2	Confident	92 Å²	92	83.2 Å²	83.2	60%	0.597	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-55.8	127.6	172.2	20.6	-29.2	0	0	0	108.7
371	G	59.4	Low	79.2	Confident	38 Å²	38	73.5 Å²	73.5	39%	0.392	40%	0.4	S	S	.	.			trans	-97	178.7	164.9	0	0	0	0	0	109.6	R369 D373	R369-G371 PolarHBondContact O-N 3.46Å; G371-D373 PolarHBondContact O-N 2.53Å
372	D	53.6	Low	79.2	Confident	182 Å²	182	75.7 Å²	75.7	97%	0.973	40%	0.396	S	S	*	.	S	Bend	trans	-62	-22.2	165.7	-88.1	-24.5	0	0	0	111.6	S374	D372-S374 PolarHBondContact O-N 3.13Å
373	D	53.8	Low	79.1	Confident	101 Å²	101	70.4 Å²	70.4	54%	0.54	38%	0.376	S	S	.	.	S	Bend	trans	-68.8	122.9	173.8	-56	-39.7	0	0	0	110.5	G371 L375	G371-D373 PolarHBondContact O-N 2.53Å; D373-L375 HydrophobicContact CB-CD1 4.24Å; D373-L375 HydrophobicContact CB-CG 4.23Å; D373-L375 PolarHBondContact O-N 3Å
374	S	54.7	Low	78.9	Confident	131 Å²	131	73.9 Å²	73.9	92%	0.916	39%	0.394	S	S	*	.			trans	-62.5	33.2	174.8	-176.7	0	0	0	0	114.3	D372	D372-S374 PolarHBondContact O-N 3.13Å
375	L	57.7	Low	78.4	Confident	104 Å²	104	75.6 Å²	75.6	55%	0.545	41%	0.406	S	S	.	.			trans	-83.7	144.4	176.2	-67.7	171.9	0	0	0	110.8	D373 R377	D373-L375 HydrophobicContact CB-CD1 4.24Å; D373-L375 HydrophobicContact CB-CG 4.23Å; D373-L375 PolarHBondContact O-N 3Å; L375-R377 PolarHBondContact O-N 3.21Å
376	D	63.6	Low	78.4	Confident	133 Å²	133	76.8 Å²	76.8	71%	0.711	42%	0.416	S	S	*	.			trans	-52.3	129.4	177.8	-113.5	-29	0	0	0	111.9	R368 N378	R368-D376 PolarHBondContact NH2-O 3.09Å; D376-N378 VanDerWaalsContact C-N 3.27Å; D376-N378 PolarHBondContact O-N 2.77Å
377	R	73	Confident	78.3	Confident	154 Å²	154	81.5 Å²	81.5	58%	0.581	44%	0.44	S	S	*	.	S	Bend	trans	-63.1	-35.9	-177.4	-175.1	-180	176.5	-172.6	-0.8	111.7	R368 L375	R368-R377 PolarHBondContact N-O 2.87Å; L375-R377 PolarHBondContact O-N 3.21Å
378	N	84.8	Confident	78.4	Confident	88 Å²	88	82 Å²	82	47%	0.471	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	122.3	-177.5	-66.7	-19.2	0	0	0	109.9	I366 A367 D376	I366-N378 WeakPolarHBondContact O-CA 3.12Å; A367-N378 WeakPolarHBondContact CB-OD1 3.31Å; D376-N378 VanDerWaalsContact C-N 3.27Å; D376-N378 PolarHBondContact O-N 2.77Å
379	M	88.6	Confident	78.9	Confident	36 Å²	36	81.1 Å²	81.1	18%	0.177	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	130.3	173.8	-59.4	-174.5	77.4	0	0	109.3	L339 M347 I349 I365 I366 R368 F381	L339-M379 HydrophobicContact CD2-CE 4.02Å; M347-M379 HydrophobicContact CE-CE 3.58Å; M347-M379 HydrophobicContact CE-SD 3.65Å; I349-M379 HydrophobicContact CD1-SD 3.92Å; I365-M379 CarbonylContact C-O 3.49Å; I365-M379 WeakPolarHBondContact CA-O 3.22Å; I366-M379 PolarHBondContact N-O 3.35Å; I366-M379 PolarHBondContact O-N 2.91Å; R368-M379 VanDerWaalsContact CZ-SD 3.55Å; M379-F381 HydrophobicContact CB-CE2 3.75Å; M379-F381 HydrophobicContact CB-CZ 3.92Å; M379-F381 HydrophobicContact CE-CE1 4.34Å; M379-F381 HydrophobicContact CE-CZ 3.68Å; M379-F381 HydrophobicContact SD-CZ 4.31Å
380	T	92.2	Very high	79.7	Confident	51 Å²	51	80.7 Å²	80.7	31%	0.313	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	128.4	179.4	-56.7	0	0	0	0	110.1	N363 I365	N363-T380 HydrophobicContact CB-CG2 3.93Å; I365-T380 HydrophobicContact CG1-CG2 4.05Å
381	F	95.1	Very high	81.1	Confident	5 Å²	5	77.7 Å²	77.7	2%	0.022	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	137.2	179.9	-56.8	-72.2	0	0	0	110.1	V320 K321 I328 L330 L339 N363 F364 I366 M379	V320-F381 HydrophobicContact CB-CB 4.1Å; V320-F381 HydrophobicContact CG2-CB 3.83Å; V320-F381 HydrophobicContact CG2-CD1 4.06Å; V320-F381 HydrophobicContact CG2-CG 4.17Å; K321-F381 CarbonylContact O-C 3.51Å; K321-F381 WeakPolarHBondContact O-CA 3.38Å; I328-F381 HydrophobicContact CD1-CD1 3.56Å; I328-F381 HydrophobicContact CD1-CE1 3.41Å; I328-F381 VanDerWaalsContact CD1-CE1 3.41Å; L330-F381 HydrophobicContact CD1-CB 4.24Å; L330-F381 HydrophobicContact CD1-CD1 4.49Å; L330-F381 HydrophobicContact CD1-CD2 3.82Å; L330-F381 HydrophobicContact CD1-CE2 4.26Å; L330-F381 HydrophobicContact CD1-CG 3.92Å; L330-F381 HydrophobicContact CD2-CE1 4.28Å; L330-F381 HydrophobicContact CD2-CE2 4.33Å; L330-F381 HydrophobicContact CD2-CZ 4.13Å; L339-F381 HydrophobicContact CD2-CE1 4.23Å; L339-F381 HydrophobicContact CD2-CZ 4.03Å; L339-F381 HydrophobicContact CG-CZ 4.49Å; N363-F381 CarbonylContact C-O 3.58Å; N363-F381 WeakPolarHBondContact CA-O 3.39Å; F364-F381 HydrophobicContact CD1-CD2 4.18Å; F364-F381 PolarHBondContact N-O 3.12Å; F364-F381 PolarHBondContact O-N 2.87Å; I366-F381 HydrophobicContact CD1-CD2 4.25Å; I366-F381 HydrophobicContact CD1-CE2 3.68Å; I366-F381 HydrophobicContact CG1-CD2 4.4Å; I366-F381 HydrophobicContact CG1-CE2 4.11Å; M379-F381 HydrophobicContact CB-CE2 3.75Å; M379-F381 HydrophobicContact CB-CZ 3.92Å; M379-F381 HydrophobicContact CE-CE1 4.34Å; M379-F381 HydrophobicContact CE-CZ 3.68Å; M379-F381 HydrophobicContact SD-CZ 4.31Å
382	K	95.5	Very high	82.9	Confident	93 Å²	93	76 Å²	76	40%	0.404	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	113.8	-176.3	-171.6	176.5	-177.9	-178.8	0	110	K321 R362	K321-K382 HydrophobicContact CB-CB 4.38Å; K321-K382 PolarHBondContact N-O 2.79Å; K321-K382 PolarHBondContact O-N 2.81Å; R362-K382 HydrophobicContact CB-CG 4.24Å
383	C	92.3	Very high	84.9	Confident	5 Å²	5	70.2 Å²	70.2	3%	0.034	36%	0.362	C	S	.	.			trans	-79.2	162.7	171.8	-57.6	0	0	0	0	110.4	R362 S385 L388 A389	R362-C383 PolarHBondContact O-N 2.83Å; C383-S385 VanDerWaalsContact C-N 3.3Å; C383-S385 PolarHBondContact O-N 3.5Å; C383-L388 HydrophobicContact CB-CB 4.45Å; C383-A389 HydrophobicContact CB-CB 3.95Å; C383-A389 VanDerWaalsContact SG-CA 3.56Å
384	I	89.9	Confident	86.9	Confident	136 Å²	136	67.4 Å²	67.4	70%	0.697	35%	0.347	S	S	*	.	S	Bend	trans	-63.7	-36.8	177.3	-160.2	168	0	0	0	112.3	R362 L388	R362-I384 WeakPolarHBondContact CD-O 3.2Å; I384-L388 HydrophobicContact CG2-CD1 3.61Å; I384-L388 HydrophobicContact CG2-CG 4.46Å
385	S	87.9	Confident	88.8	Confident	36 Å²	36	61.2 Å²	61.2	25%	0.252	30%	0.304	S	S	.	.	S	Bend	trans	-134	147.2	-175.2	165.5	0	0	0	0	111.1	C383 I387 L388 A389	C383-S385 VanDerWaalsContact C-N 3.3Å; C383-S385 PolarHBondContact O-N 3.5Å; S385-I387 PolarHBondContact O-N 3.21Å; S385-I387 PolarHBondContact OG-N 3.27Å; S385-L388 PolarHBondContact O-N 3.25Å; S385-A389 PolarHBondContact O-N 3Å; S385-A389 VanDerWaalsContact O-N 3.12Å
386	P	93	Very high	90.6	Very high	66 Å²	66	56.2 Å²	56.2	43%	0.429	28%	0.278	S	S	.	.	H	α-helix	trans	-61.6	-27.7	174.7	26.3	-35.2	0	0	0	112.9	G361 A389 K390	G361-P386 VanDerWaalsContact O-CA 3.27Å; G361-P386 WeakPolarHBondContact O-CA 3.49Å; G361-P386 WeakPolarHBondContact O-CB 3.33Å; P386-A389 PolarHBondContact O-N 3.1Å; P386-K390 PolarHBondContact O-N 3.06Å
387	I	91.7	Very high	92.1	Very high	98 Å²	98	51.4 Å²	51.4	50%	0.503	25%	0.253	S	S	.	.	H	α-helix	trans	-67.6	-43.7	177.5	-61.8	172	0	0	0	110.1	F177 S385 K390 R391	F177-I387 HydrophobicContact CE1-CG2 3.62Å; F177-I387 HydrophobicContact CZ-CG2 3.54Å; S385-I387 PolarHBondContact O-N 3.21Å; S385-I387 PolarHBondContact OG-N 3.27Å; I387-K390 WeakPolarHBondContact O-CB 3.37Å; I387-K390 PolarHBondContact O-N 3.36Å; I387-R391 PolarHBondContact O-N 3.01Å
388	L	92.1	Very high	93.1	Very high	29 Å²	29	46 Å²	46	15%	0.152	24%	0.236	C	C	.	.	H	α-helix	trans	-69.5	-33.9	176.8	-61.4	-167.1	0	0	0	112.3	F177 C383 I384 S385 K390 R391 L392	F177-L388 HydrophobicContact CZ-CD2 4.27Å; C383-L388 HydrophobicContact CB-CB 4.45Å; I384-L388 HydrophobicContact CG2-CD1 3.61Å; I384-L388 HydrophobicContact CG2-CG 4.46Å; S385-L388 PolarHBondContact O-N 3.25Å; L388-K390 VanDerWaalsContact C-N 3.31Å; L388-K390 PolarHBondContact O-N 2.92Å; L388-R391 WeakPolarHBondContact O-CB 3.23Å; L388-R391 PolarHBondContact O-N 3.09Å; L388-L392 WeakPolarHBondContact O-CB 3.33Å; L388-L392 PolarHBondContact O-N 2.74Å
389	A	95.2	Very high	93.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.2	-41.5	171.8	0	0	0	0	0	111.7	C383 S385 P386 Y393	C383-A389 HydrophobicContact CB-CB 3.95Å; C383-A389 VanDerWaalsContact SG-CA 3.56Å; S385-A389 PolarHBondContact O-N 3Å; S385-A389 VanDerWaalsContact O-N 3.12Å; P386-A389 PolarHBondContact O-N 3.1Å; A389-Y393 VanDerWaalsContact O-CB 3.31Å; A389-Y393 WeakPolarHBondContact O-CB 3.42Å; A389-Y393 PolarHBondContact O-N 3.02Å
390	K	95.1	Very high	93.6	Very high	116 Å²	116	42 Å²	42	50%	0.504	21%	0.214	S	C	.	.	H	α-helix	trans	-66.2	-40.1	173.5	-174.4	178.7	179.2	-174	0	112	P386 I387 L388 Y393 N394	P386-K390 PolarHBondContact O-N 3.06Å; I387-K390 WeakPolarHBondContact O-CB 3.37Å; I387-K390 PolarHBondContact O-N 3.36Å; L388-K390 VanDerWaalsContact C-N 3.31Å; L388-K390 PolarHBondContact O-N 2.92Å; K390-Y393 WeakPolarHBondContact O-CB 3.45Å; K390-Y393 PolarHBondContact O-N 2.86Å; K390-N394 VanDerWaalsContact O-CG 3.32Å; K390-N394 PolarHBondContact O-N 3.16Å; K390-N394 PolarHBondContact O-OD1 2.89Å
391	R	94.3	Very high	93.5	Very high	30 Å²	30	43.2 Å²	43.2	11%	0.113	22%	0.218	C	C	.	.	H	α-helix	trans	-59.1	-54.4	175	-174.3	-176.5	72.2	178.9	4.2	111.2	W176 F177 I387 L388 Y393 N394 V395	W176-R391 WeakPolarHBondContact O-CD 3.48Å; W176-R391 PolarHBondContact O-NH1 3.06Å; F177-R391 HydrophobicContact CD1-CB 4.14Å; F177-R391 HydrophobicContact CD1-CG 3.92Å; F177-R391 HydrophobicContact CE1-CB 3.98Å; F177-R391 HydrophobicContact CE1-CG 4.17Å; I387-R391 PolarHBondContact O-N 3.01Å; L388-R391 WeakPolarHBondContact O-CB 3.23Å; L388-R391 PolarHBondContact O-N 3.09Å; R391-Y393 VanDerWaalsContact C-N 3.27Å; R391-Y393 PolarHBondContact O-N 3.07Å; R391-N394 PolarHBondContact O-N 2.83Å; R391-N394 VanDerWaalsContact O-N 3.13Å; R391-V395 WeakPolarHBondContact O-CG2 3.42Å; R391-V395 PolarHBondContact O-N 3.1Å
392	L	96.2	Very high	93.1	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-56.8	-42.8	177.3	170	59.7	0	0	0	111.4	H318 V320 L330 V332 F364 L388 V395 C396	H318-L392 HydrophobicContact CB-CD1 3.91Å; H318-L392 HydrophobicContact CB-CD2 4.26Å; H318-L392 HydrophobicContact CB-CG 4.49Å; V320-L392 HydrophobicContact CG1-CD2 4.03Å; L330-L392 HydrophobicContact CD1-CD2 3.91Å; V332-L392 HydrophobicContact CG2-CD1 4.04Å; F364-L392 HydrophobicContact CB-CD2 4.16Å; F364-L392 HydrophobicContact CD1-CD2 3.52Å; F364-L392 HydrophobicContact CD1-CG 4.04Å; F364-L392 HydrophobicContact CD2-CD2 4.45Å; F364-L392 HydrophobicContact CD2-CG 4.34Å; F364-L392 HydrophobicContact CE1-CD2 3.94Å; F364-L392 HydrophobicContact CE1-CG 4.05Å; F364-L392 HydrophobicContact CE2-CG 4.38Å; F364-L392 HydrophobicContact CG-CD2 3.79Å; F364-L392 HydrophobicContact CG-CG 4.16Å; F364-L392 HydrophobicContact CZ-CG 4.22Å; L388-L392 WeakPolarHBondContact O-CB 3.33Å; L388-L392 PolarHBondContact O-N 2.74Å; L392-V395 PolarHBondContact O-N 2.87Å; L392-C396 WeakPolarHBondContact O-CB 3.45Å; L392-C396 PolarHBondContact O-N 2.72Å; L392-C396 PolarHBondContact O-SG 2.81Å
393	Y	97	Very high	92.7	Very high	61 Å²	61	42.5 Å²	42.5	24%	0.239	22%	0.216	C	C	.	.	H	α-helix	trans	-57.7	-50	174.3	170.8	-101.1	0	0	0	112.5	L357 H359 F364 A389 K390 R391 V395 C396 V397	L357-Y393 HydrophobicContact CB-CD2 4.16Å; L357-Y393 HydrophobicContact CB-CE2 3.95Å; L357-Y393 VanDerWaalsContact O-CE2 3.32Å; L357-Y393 WeakPolarHBondContact O-CE2 3.28Å; H359-Y393 HydrophobicContact CB-CG 4.38Å; H359-Y393 AromaticContact CE1-CD1 3.67Å; H359-Y393 AromaticContact ND1-CD1 3.28Å; H359-Y393 VanDerWaalsContact ND1-CD1 3.28Å; H359-Y393 WeakPolarHBondContact ND1-CD1 3.3Å; H359-Y393 AromaticContact ND1-CD2 3.9Å; H359-Y393 AromaticContact ND1-CE1 3.84Å; H359-Y393 AromaticContact ND1-CG 3.31Å; H359-Y393 VanDerWaalsContact ND1-CG 3.31Å; F364-Y393 HydrophobicContact CE2-CD2 4.19Å; A389-Y393 VanDerWaalsContact O-CB 3.31Å; A389-Y393 WeakPolarHBondContact O-CB 3.42Å; A389-Y393 PolarHBondContact O-N 3.02Å; K390-Y393 WeakPolarHBondContact O-CB 3.45Å; K390-Y393 PolarHBondContact O-N 2.86Å; R391-Y393 VanDerWaalsContact C-N 3.27Å; R391-Y393 PolarHBondContact O-N 3.07Å; Y393-V395 PolarHBondContact O-N 2.81Å; Y393-C396 PolarHBondContact O-N 2.81Å; Y393-V397 HydrophobicContact CD1-CG2 4.46Å; Y393-V397 HydrophobicContact CD2-CG2 4.04Å; Y393-V397 HydrophobicContact CE1-CG2 4.04Å; Y393-V397 HydrophobicContact CE2-CG2 3.53Å; Y393-V397 HydrophobicContact CG-CG2 4.47Å; Y393-V397 WeakPolarHBondContact O-CG2 2.82Å; Y393-V397 PolarHBondContact O-N 2.77Å
394	N	95	Very high	92	Very high	42 Å²	42	46.2 Å²	46.2	23%	0.225	23%	0.229	C	C	.	.	H	α-helix	trans	-60.7	-46.3	178.5	-71.3	-3.8	0	0	0	111.4	K390 R391 C396 V397 D398	K390-N394 VanDerWaalsContact O-CG 3.32Å; K390-N394 PolarHBondContact O-N 3.16Å; K390-N394 PolarHBondContact O-OD1 2.89Å; R391-N394 PolarHBondContact O-N 2.83Å; R391-N394 VanDerWaalsContact O-N 3.13Å; N394-C396 VanDerWaalsContact C-N 3.32Å; N394-C396 PolarHBondContact O-N 3.2Å; N394-V397 PolarHBondContact O-N 3.31Å; N394-D398 WeakPolarHBondContact O-CB 3.27Å; N394-D398 PolarHBondContact O-N 3.44Å
395	V	95.5	Very high	90.5	Very high	1 Å²	1	46 Å²	46	1%	0.006	23%	0.228	C	C	.	.	H	α-helix	trans	-55.5	-48.1	176	170.1	0	0	0	0	110.8	D316 V332 R391 L392 Y393 D398 H399	D316-V395 VanDerWaalsContact OD2-CG1 3.26Å; D316-V395 WeakPolarHBondContact OD2-CG1 3.39Å; V332-V395 HydrophobicContact CB-CG1 3.99Å; V332-V395 HydrophobicContact CG1-CG1 3.98Å; V332-V395 HydrophobicContact CG2-CG1 4.1Å; R391-V395 WeakPolarHBondContact O-CG2 3.42Å; R391-V395 PolarHBondContact O-N 3.1Å; L392-V395 PolarHBondContact O-N 2.87Å; Y393-V395 PolarHBondContact O-N 2.81Å; V395-D398 PolarHBondContact O-N 2.81Å; V395-H399 WeakPolarHBondContact O-CB 3.3Å; V395-H399 PolarHBondContact O-N 2.96Å; V395-H399 PolarHBondContact O-ND1 3.07Å
396	C	95.9	Very high	88.7	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66.2	-40.6	-179.6	-68.4	0	0	0	0	112.6	V332 I337 W351 L357 F364 L392 Y393 N394 H400	V332-C396 WeakPolarHBondContact CG2-SG 3.36Å; I337-C396 HydrophobicContact CD1-CB 4.39Å; W351-C396 HydrophobicContact CH2-CB 4.46Å; L357-C396 HydrophobicContact CD1-CB 3.7Å; F364-C396 HydrophobicContact CZ-CB 4.09Å; L392-C396 WeakPolarHBondContact O-CB 3.45Å; L392-C396 PolarHBondContact O-N 2.72Å; L392-C396 PolarHBondContact O-SG 2.81Å; Y393-C396 PolarHBondContact O-N 2.81Å; N394-C396 VanDerWaalsContact C-N 3.32Å; N394-C396 PolarHBondContact O-N 3.2Å; C396-H400 WeakPolarHBondContact O-CB 3.41Å; C396-H400 PolarHBondContact O-N 3.33Å
397	V	93.8	Very high	86.1	Confident	32 Å²	32	51.9 Å²	51.9	19%	0.194	26%	0.258	C	S	.	.	H	α-helix	trans	-65.5	-44.9	177.6	168.3	0	0	0	0	110.7	L357 Y393 N394 H400 N401	L357-V397 HydrophobicContact CB-CG2 4.41Å; L357-V397 HydrophobicContact CD1-CG2 4.19Å; Y393-V397 HydrophobicContact CD1-CG2 4.46Å; Y393-V397 HydrophobicContact CD2-CG2 4.04Å; Y393-V397 HydrophobicContact CE1-CG2 4.04Å; Y393-V397 HydrophobicContact CE2-CG2 3.53Å; Y393-V397 HydrophobicContact CG-CG2 4.47Å; Y393-V397 WeakPolarHBondContact O-CG2 2.82Å; Y393-V397 PolarHBondContact O-N 2.77Å; N394-V397 PolarHBondContact O-N 3.31Å; V397-H400 PolarHBondContact O-N 3.18Å; V397-N401 WeakPolarHBondContact CG1-ND2 3.24Å; V397-N401 WeakPolarHBondContact O-CB 3.22Å; V397-N401 PolarHBondContact O-N 2.81Å; V397-N401 PolarHBondContact O-ND2 3.26Å
398	D	93.2	Very high	83.2	Confident	41 Å²	41	51.2 Å²	51.2	22%	0.219	26%	0.262	C	S	.	.	H	α-helix	trans	-60.2	-49.7	178.2	-74.2	-6.5	0	0	0	110.9	K201 F202 N394 V395 N401 F402	K201-D398 WeakPolarHBondContact CE-OD2 3.42Å; K201-D398 IonicContact NZ-OD2 3.27Å; K201-D398 PolarHBondContact NZ-OD2 2.75Å; F202-D398 HydrophobicContact CE1-CB 4.15Å; F202-D398 HydrophobicContact CZ-CB 4.05Å; N394-D398 WeakPolarHBondContact O-CB 3.27Å; N394-D398 PolarHBondContact O-N 3.44Å; V395-D398 PolarHBondContact O-N 2.81Å; D398-N401 PolarHBondContact O-N 2.89Å; D398-F402 WeakPolarHBondContact O-CB 3.36Å; D398-F402 PolarHBondContact O-N 2.98Å
399	H	93.9	Very high	80	Confident	6 Å²	6	55.8 Å²	55.8	3%	0.028	30%	0.296	C	S	.	.	H	α-helix	trans	-64	-44.4	177.4	-77.5	70.9	0	0	0	112.1	K201 F202 V332 W351 V395 N401 F402 F403	K201-H399 PolarHBondContact O-NE2 3Å; F202-H399 AromaticContact CD1-CD2 3.98Å; F202-H399 AromaticContact CD1-CE1 3.99Å; F202-H399 AromaticContact CD1-NE2 3.91Å; F202-H399 AromaticContact CE1-ND1 3.8Å; V332-H399 HydrophobicContact CG1-CB 3.87Å; W351-H399 HydrophobicContact CH2-CB 3.89Å; W351-H399 HydrophobicContact CZ2-CB 3.46Å; W351-H399 VanDerWaalsContact CZ2-CB 3.46Å; V395-H399 WeakPolarHBondContact O-CB 3.3Å; V395-H399 PolarHBondContact O-N 2.96Å; V395-H399 PolarHBondContact O-ND1 3.07Å; H399-N401 VanDerWaalsContact C-N 3.31Å; H399-N401 PolarHBondContact O-N 2.88Å; H399-F402 PolarHBondContact O-N 3.44Å; H399-F403 HydrophobicContact CB-CD2 4.38Å; H399-F403 AromaticContact CD2-CE2 3.84Å; H399-F403 VanDerWaalsContact O-CD2 3.31Å; H399-F403 WeakPolarHBondContact O-CD2 3.36Å; H399-F403 PolarHBondContact O-N 3.38Å
400	H	90.6	Very high	76.8	Confident	34 Å²	34	66.5 Å²	66.5	16%	0.157	34%	0.336	C	S	.	.	H	α-helix	trans	-59.9	-42.8	177	177.7	-97.7	0	0	0	111.4	W351 L357 C396 V397 R404	W351-H400 HydrophobicContact CD2-CB 4.21Å; W351-H400 HydrophobicContact CE3-CB 3.64Å; W351-H400 AromaticContact CE3-CD2 3.67Å; W351-H400 HydrophobicContact CZ3-CB 3.81Å; L357-H400 HydrophobicContact CD1-CB 4.43Å; C396-H400 WeakPolarHBondContact O-CB 3.41Å; C396-H400 PolarHBondContact O-N 3.33Å; V397-H400 PolarHBondContact O-N 3.18Å; H400-R404 WeakPolarHBondContact NE2-CD 3.43Å; H400-R404 PolarHBondContact NE2-NH1 3.21Å; H400-R404 WeakPolarHBondContact O-CB 3.18Å; H400-R404 PolarHBondContact O-N 3.15Å; H400-R404 VanDerWaalsContact O-N 3.07Å
401	N	89.6	Confident	73.6	Confident	75 Å²	75	70.2 Å²	70.2	40%	0.401	36%	0.355	S	S	.	.	H	α-helix	trans	-66.3	-46.9	177.9	-71.8	-21	0	0	0	111.5	V397 D398 H399 L405	V397-N401 WeakPolarHBondContact CG1-ND2 3.24Å; V397-N401 WeakPolarHBondContact O-CB 3.22Å; V397-N401 PolarHBondContact O-N 2.81Å; V397-N401 PolarHBondContact O-ND2 3.26Å; D398-N401 PolarHBondContact O-N 2.89Å; H399-N401 VanDerWaalsContact C-N 3.31Å; H399-N401 PolarHBondContact O-N 2.88Å; N401-L405 HydrophobicContact CB-CD1 4.48Å; N401-L405 WeakPolarHBondContact O-CB 3.24Å; N401-L405 WeakPolarHBondContact O-CD1 3.39Å; N401-L405 WeakPolarHBondContact O-CG 3.31Å; N401-L405 PolarHBondContact O-N 2.85Å
402	F	88.5	Confident	70.5	Confident	35 Å²	35	78.7 Å²	78.7	15%	0.154	39%	0.393	C	S	.	.	H	α-helix	trans	-61.5	-52.9	-178.8	-174.9	-93.5	0	0	0	112.1	E163 F164 F202 D398 H399	E163-F402 HydrophobicContact CB-CE2 4.03Å; E163-F402 HydrophobicContact CG-CE2 3.75Å; E163-F402 HydrophobicContact CG-CZ 4.23Å; F164-F402 HydrophobicContact CD1-CE1 4.43Å; F164-F402 AromaticContact CD1-CZ 3.81Å; F164-F402 HydrophobicContact CD1-CZ 3.81Å; F164-F402 HydrophobicContact CE1-CE1 4.3Å; F164-F402 AromaticContact CE1-CZ 3.77Å; F164-F402 HydrophobicContact CE1-CZ 3.77Å; F202-F402 HydrophobicContact CB-CD1 3.82Å; F202-F402 HydrophobicContact CB-CE1 3.63Å; F202-F402 HydrophobicContact CB-CE2 4.38Å; F202-F402 HydrophobicContact CB-CG 4.3Å; F202-F402 HydrophobicContact CB-CZ 3.93Å; F202-F402 HydrophobicContact CD1-CB 4.07Å; F202-F402 HydrophobicContact CD1-CD1 4.1Å; F202-F402 AromaticContact CD1-CG 4Å; F202-F402 HydrophobicContact CD1-CG 4Å; F202-F402 HydrophobicContact CD2-CD1 4.3Å; F202-F402 AromaticContact CD2-CD2 3.65Å; F202-F402 HydrophobicContact CD2-CD2 3.65Å; F202-F402 HydrophobicContact CD2-CE1 4.44Å; F202-F402 AromaticContact CD2-CE2 3.8Å; F202-F402 HydrophobicContact CD2-CE2 3.8Å; F202-F402 AromaticContact CD2-CG 3.91Å; F202-F402 HydrophobicContact CD2-CG 3.91Å; F202-F402 HydrophobicContact CD2-CZ 4.21Å; F202-F402 HydrophobicContact CE1-CB 3.92Å; F202-F402 HydrophobicContact CE1-CG 4.25Å; F202-F402 HydrophobicContact CE2-CB 4.39Å; F202-F402 AromaticContact CE2-CD2 3.83Å; F202-F402 HydrophobicContact CE2-CD2 3.83Å; F202-F402 HydrophobicContact CE2-CE2 4.34Å; F202-F402 HydrophobicContact CE2-CG 4.16Å; F202-F402 HydrophobicContact CG-CB 4.36Å; F202-F402 AromaticContact CG-CD1 3.82Å; F202-F402 HydrophobicContact CG-CD1 3.82Å; F202-F402 HydrophobicContact CG-CD2 4.02Å; F202-F402 HydrophobicContact CG-CE1 4.06Å; F202-F402 HydrophobicContact CG-CE2 4.23Å; F202-F402 AromaticContact CG-CG 3.8Å; F202-F402 HydrophobicContact CG-CG 3.8Å; F202-F402 HydrophobicContact CG-CZ 4.26Å; F202-F402 HydrophobicContact CZ-CB 4.07Å; F202-F402 HydrophobicContact CZ-CD2 4.35Å; F202-F402 HydrophobicContact CZ-CG 4.31Å; D398-F402 WeakPolarHBondContact O-CB 3.36Å; D398-F402 PolarHBondContact O-N 2.98Å; H399-F402 PolarHBondContact O-N 3.44Å
403	F	86.7	Confident	67.2	Low	49 Å²	49	88.2 Å²	88.2	22%	0.215	43%	0.434	C	S	.	.	H	α-helix	trans	-83.6	-24.4	-172.7	-68.7	-69.9	0	0	0	114.4	F202 Y203 H399	F202-F403 HydrophobicContact CB-CE2 4.22Å; F202-F403 HydrophobicContact CB-CZ 3.96Å; F202-F403 HydrophobicContact CD1-CE2 4.05Å; Y203-F403 WeakPolarHBondContact O-CZ 3.31Å; H399-F403 HydrophobicContact CB-CD2 4.38Å; H399-F403 AromaticContact CD2-CE2 3.84Å; H399-F403 VanDerWaalsContact O-CD2 3.31Å; H399-F403 WeakPolarHBondContact O-CD2 3.36Å; H399-F403 PolarHBondContact O-N 3.38Å
404	R	77.3	Confident	64	Low	83 Å²	83	91.4 Å²	91.4	31%	0.313	46%	0.463	S	S	.	.	H	α-helix	trans	-83	-38.2	179.8	-170.5	176.5	-176.8	133.2	8.9	113.5	W351 I354 H400 R406 G407	W351-R404 PolarHBondContact O-NH1 2.86Å; I354-R404 PolarHBondContact O-NH1 3.28Å; H400-R404 WeakPolarHBondContact NE2-CD 3.43Å; H400-R404 PolarHBondContact NE2-NH1 3.21Å; H400-R404 WeakPolarHBondContact O-CB 3.18Å; H400-R404 PolarHBondContact O-N 3.15Å; H400-R404 VanDerWaalsContact O-N 3.07Å; R404-R406 PolarHBondContact O-N 3.35Å; R404-G407 PolarHBondContact O-N 2.81Å
405	L	58.2	Low	60.9	Low	130 Å²	130	94.8 Å²	94.8	68%	0.681	49%	0.49	S	S	*	.	H	α-helix	trans	-70.6	-17.9	-170.7	-71.2	171.9	0	0	0	113.5	N401	N401-L405 HydrophobicContact CB-CD1 4.48Å; N401-L405 WeakPolarHBondContact O-CB 3.24Å; N401-L405 WeakPolarHBondContact O-CD1 3.39Å; N401-L405 WeakPolarHBondContact O-CG 3.31Å; N401-L405 PolarHBondContact O-N 2.85Å
406	R	50.8	Low	58	Low	159 Å²	159	102.1 Å²	102.1	60%	0.6	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-16.6	173.9	-72.8	-170.5	173	169.3	1	114.3	E163 R404	E163-R406 IonicContact OE1-CZ 3.87Å; E163-R406 IonicContact OE1-NH2 3.21Å; E163-R406 PolarHBondContact OE1-NH2 2.82Å; R404-R406 PolarHBondContact O-N 3.35Å
407	G	36.8	Very low	54.9	Low	68 Å²	68	111.4 Å²	111.4	70%	0.701	57%	0.569	S	S	*	*	S	Bend	trans	-102.2	5.5	-163.9	0	0	0	0	0	119	R404	R404-G407 PolarHBondContact O-N 2.81Å
408	S	31.5	Very low	51.9	Low	84 Å²	84	115.4 Å²	115.4	59%	0.587	60%	0.596	S	S	*	*			trans	-138	92.9	-176.2	62	0	0	0	0	115.5	R410	S408-R410 VanDerWaalsContact C-N 3.3Å; S408-R410 PolarHBondContact O-N 3.02Å; S408-R410 VanDerWaalsContact O-N 3.1Å
409	S	25	Very low	48.7	Very low	125 Å²	125	118.8 Å²	118.8	87%	0.874	62%	0.623	S	S	*	*			trans	-72.2	86.9	152.6	56	0	0	0	0	108.4	Q411	S409-Q411 PolarHBondContact O-N 3.07Å
410	R	27.8	Very low	45.5	Very low	224 Å²	224	128.5 Å²	128.5	85%	0.845	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-66	119.4	-177.6	-115.4	179.8	177.7	-173.5	-2	111.2	S408 K412	S408-R410 VanDerWaalsContact C-N 3.3Å; S408-R410 PolarHBondContact O-N 3.02Å; S408-R410 VanDerWaalsContact O-N 3.1Å; R410-K412 PolarHBondContact O-N 3.35Å
411	Q	28	Very low	42.3	Very low	194 Å²	194	130.3 Å²	130.3	91%	0.907	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-60.5	128.3	167.4	-67.3	-168.4	-25.2	0	0	110.7	S409	S409-Q411 PolarHBondContact O-N 3.07Å
412	K	29.4	Very low	39.1	Very low	208 Å²	208	133.2 Å²	133.2	90%	0.904	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-74.5	120.8	-175.5	-67.7	175.3	178.9	174.7	0	110.5	R410	R410-K412 PolarHBondContact O-N 3.35Å
413	K	27	Very low	36	Very low	201 Å²	201	142.1 Å²	142.1	87%	0.874	74%	0.739	S	S	*	*			trans	-110.5	135.1	157.7	-77.3	-171.9	176.6	-177.5	0	109.2
414	P	28.5	Very low	32.9	Very low	128 Å²	128	148.7 Å²	148.7	83%	0.831	77%	0.767	S	S	*	*			trans	-80.9	126.9	-172.9	30.3	-28.9	0	0	0	110.6
415	S	31.6	Very low	30.5	Very low	113 Å²	113	153.6 Å²	153.6	79%	0.79	79%	0.787	S	S	*	*			trans	-115.5	119.1	175.7	163.8	0	0	0	0	109	F417	S415-F417 PolarHBondContact O-N 3.42Å
416	L	34.7	Very low	28.8	Very low	156 Å²	156	156.1 Å²	156.1	82%	0.817	80%	0.795	S	S	*	*			trans	-90.3	67.2	-178.9	-79.8	140.6	0	0	0	110.9
417	F	31	Very low	27.6	Very low	194 Å²	194	158.8 Å²	158.8	85%	0.851	81%	0.807	S	S	*	*			trans	-156.9	131.4	155	-76.5	-61.5	0	0	0	111.5	S415	S415-F417 PolarHBondContact O-N 3.42Å
418	P	28.9	Very low	27	Very low	117 Å²	117	161.6 Å²	161.6	76%	0.76	81%	0.812	S	S	*	*			trans	-87.4	112.2	-179	33	-29	0	0	0	110.4
419	S	26.8	Very low	26.6	Very low	112 Å²	112	160.9 Å²	160.9	78%	0.783	82%	0.818	S	S	*	*			trans	-106.7	122.9	167.9	179.8	0	0	0	0	110.2	A421	S419-A421 VanDerWaalsContact C-N 3.35Å; S419-A421 PolarHBondContact O-N 3.06Å
420	F	26.4	Very low	26.4	Very low	210 Å²	210	161.1 Å²	161.1	92%	0.921	82%	0.815	S	S	*	*			trans	-72.3	80.1	177.3	-80.3	-99.9	0	0	0	110.8
421	A	23.8	Very low	26.2	Very low	72 Å²	72	156.3 Å²	156.3	60%	0.595	81%	0.81	S	S	*	*			trans	-160.7	125.3	160	0	0	0	0	0	111	S419	S419-A421 VanDerWaalsContact C-N 3.35Å; S419-A421 PolarHBondContact O-N 3.06Å
422	T	23.5	Very low	25.9	Very low	135 Å²	135	155.9 Å²	155.9	83%	0.828	81%	0.811	S	S	*	*			trans	73.3	99.9	171.1	64.6	0	0	0	0	117.5	K424	T422-K424 PolarHBondContact O-N 3.18Å
423	R	22.2	Very low	25.6	Very low	223 Å²	223	153.4 Å²	153.4	84%	0.842	81%	0.807	S	S	*	*			trans	-52.4	121.8	177.9	-62.6	172.7	-175.8	-157.6	0.3	112.6
424	K	22	Very low	25.4	Very low	187 Å²	187	151.2 Å²	151.2	81%	0.813	80%	0.804	S	S	*	*			trans	-130.2	128	164.9	-73	-173.5	179.6	-179.8	0	109.4	T422	T422-K424 PolarHBondContact O-N 3.18Å
425	Y	25.7	Very low	25	Very low	185 Å²	185	149.6 Å²	149.6	73%	0.725	80%	0.796	S	S	*	*			trans	-86.2	145.9	-176	-68.4	-86.2	0	0	0	111.7
426	H	24.2	Very low	24.6	Very low	184 Å²	184	148.9 Å²	148.9	85%	0.852	79%	0.791	S	S	*	*			trans	-96.5	145.8	-176.8	-70.3	-97.8	0	0	0	111.3
427	Y	24	Very low	24.1	Very low	215 Å²	215	149.1 Å²	149.1	84%	0.843	79%	0.792	S	S	*	*			trans	-129.6	131.5	175.3	-75	-84.3	0	0	0	111.5
428	P	26	Very low	23.7	Very low	126 Å²	126	146.8 Å²	146.8	82%	0.818	79%	0.788	S	S	*	*			trans	-91.3	139.8	174.3	33.7	-28.8	0	0	0	111.5
429	G	21.8	Very low	23.4	Very low	69 Å²	69	144.3 Å²	144.3	71%	0.711	78%	0.778	S	S	*	*			trans	-104.4	169.3	174.6	0	0	0	0	0	112.2
430	T	21	Very low	23.2	Very low	131 Å²	131	145.3 Å²	145.3	80%	0.804	78%	0.779	S	S	*	*			trans	-157.4	127.5	152.7	-62.7	0	0	0	0	108.9
431	T	23.1	Very low	23.1	Very low	122 Å²	122	141.9 Å²	141.9	75%	0.748	78%	0.775	S	S	*	*			trans	-72.5	143	172.7	38.7	0	0	0	0	112.3
432	M	22.5	Very low	23.1	Very low	186 Å²	186	141.2 Å²	141.2	92%	0.916	78%	0.775	S	S	*	*			trans	-146.4	136.2	154.7	-81	-59.9	159	0	0	111.9
433	N	23.8	Very low	23.1	Very low	155 Å²	155	142.3 Å²	142.3	83%	0.829	78%	0.782	S	S	*	*			trans	-80.6	163.5	177.4	-95.2	-40	0	0	0	112.8
434	L	21	Very low	23.2	Very low	155 Å²	155	134.8 Å²	134.8	81%	0.812	77%	0.773	S	S	*	*			trans	145.2	111.5	142.1	-104.3	66.3	0	0	0	106.7
435	S	21.4	Very low	23.2	Very low	94 Å²	94	134.4 Å²	134.4	66%	0.657	78%	0.775	S	S	*	*				68.7	117	57.9	81.1	0	0	0	0	115.9
436	S	22.7	Very low	23.2	Very low	99 Å²	99	133.1 Å²	133.1	69%	0.692	78%	0.775	S	S	*	*			trans	91.5	144.4	135	71.3	0	0	0	0	120.8
437	I	24.6	Very low	23.2	Very low	160 Å²	160	130.2 Å²	130.2	82%	0.821	77%	0.765	S	S	*	*			trans	96.8	141.3	154.9	-57.1	165.8	0	0	0	115.5
438	D	22	Very low	23.1	Very low	146 Å²	146	128.8 Å²	128.8	78%	0.781	77%	0.767	S	S	*	*			cis	-179.4	146.8	-28.8	-158.7	2	0	0	0	105.4
439	A	22.3	Very low	23	Very low	65 Å²	65	129.8 Å²	129.8	54%	0.537	77%	0.77	S	S	.	*			trans	40.6	149.3	150.2	0	0	0	0	0	125.7
440	T	23.9	Very low	22.9	Very low	132 Å²	132	132.1 Å²	132.1	81%	0.81	78%	0.776	S	S	*	*			trans	87.9	145.3	148.4	73.2	0	0	0	0	117.9
441	V	24.3	Very low	23	Very low	138 Å²	138	137.5 Å²	137.5	84%	0.836	78%	0.781	S	S	*	*			cis	-179.4	156.4	0.4	136.2	0	0	0	0	106.5
442	G	24.3	Very low	22.9	Very low	59 Å²	59	137 Å²	137	61%	0.608	78%	0.783	S	S	*	*			trans	95.5	104	145.3	0	0	0	0	0	117.5
443	V	22.5	Very low	23	Very low	158 Å²	158	136.1 Å²	136.1	96%	0.958	78%	0.781	S	S	*	*				71.9	124.4	76	-178.1	0	0	0	0	115
444	G	24	Very low	23	Very low	65 Å²	65	132.4 Å²	132.4	67%	0.67	77%	0.767	S	S	*	*			trans	130.1	91.2	156.7	0	0	0	0	0	113.7
445	E	21.8	Very low	23.1	Very low	179 Å²	179	134.4 Å²	134.4	84%	0.836	77%	0.769	S	S	*	*				48.8	111.9	92.8	-71	-168.7	163.2	0	0	115.2
446	H	25.8	Very low	23.2	Very low	158 Å²	158	140.1 Å²	140.1	73%	0.731	78%	0.783	S	S	*	*				174.4	133.9	118	-99.7	-59.8	0	0	0	115.2
447	N	23.7	Very low	23.2	Very low	122 Å²	122	146.9 Å²	146.9	65%	0.652	79%	0.793	S	S	*	*			trans	50.7	100.6	137.8	-62.6	-6.2	0	0	0	118.5
448	Q	22	Very low	23.1	Very low	186 Å²	186	144.9 Å²	144.9	87%	0.869	79%	0.791	S	S	*	*				40.6	102.9	84.6	-62.8	-170.8	34.8	0	0	114
449	T	24	Very low	23.1	Very low	146 Å²	146	146.6 Å²	146.6	90%	0.896	80%	0.796	S	S	*	*			trans	-152.4	116.4	130.9	34.1	0	0	0	0	109.3
450	S	21.3	Very low	23.3	Very low	118 Å²	118	149.5 Å²	149.5	83%	0.825	81%	0.809	S	S	*	*			trans	-70.1	138	173.3	61.2	0	0	0	0	110.3
451	R	21.3	Very low	23.2	Very low	244 Å²	244	148 Å²	148	92%	0.921	81%	0.81	S	S	*	*			trans	-124.3	108.3	154.1	-83.4	-168.3	178.4	-167.9	1.4	109.1	L453	R451-L453 PolarHBondContact O-N 3.31Å
452	S	22.8	Very low	23.1	Very low	113 Å²	113	149.3 Å²	149.3	79%	0.79	81%	0.807	S	S	*	*			trans	-51.3	113.8	164	176.1	0	0	0	0	110.2
453	L	24	Very low	23.2	Very low	167 Å²	167	152.2 Å²	152.2	87%	0.874	82%	0.815	S	S	*	*			trans	-113	100.6	159.7	-89.2	166.1	0	0	0	108.9	R451	R451-L453 PolarHBondContact O-N 3.31Å
454	S	23.7	Very low	23.3	Very low	76 Å²	76	149.1 Å²	149.1	53%	0.531	80%	0.8	S	S	.	*			trans	-41	136.3	167.8	52.1	0	0	0	0	115.2
455	K	23.7	Very low	23.3	Very low	197 Å²	197	155 Å²	155	86%	0.857	81%	0.811	S	S	*	*				59.9	89.6	129.1	-60.1	175.7	-178.1	177.8	0	116.6
456	F	22.5	Very low	23.5	Very low	215 Å²	215	152.3 Å²	152.3	94%	0.943	81%	0.806	S	S	*	*			trans	-122	115.4	139.6	-88.1	-83.8	0	0	0	109.1
457	R	22.7	Very low	23.3	Very low	241 Å²	241	148.2 Å²	148.2	91%	0.909	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-84.5	146.9	179.9	-162.5	173	-167.5	-169.4	4.4	109
458	P	22.9	Very low	23.3	Very low	118 Å²	118	150.4 Å²	150.4	77%	0.766	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-78	140.8	-160.6	-8.3	25.8	0	0	0	112.5
459	M	22.5	Very low	23.4	Very low	182 Å²	182	147.8 Å²	147.8	90%	0.897	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-86.7	128.1	161.1	-107	-167.8	-49.8	0	0	109.1	A461	M459-A461 PolarHBondContact O-N 2.7Å
460	P	24.9	Very low	23.2	Very low	125 Å²	125	147 Å²	147	81%	0.812	79%	0.787	S	S	*	*			trans	-76	112.1	170.2	17	-5.5	0	0	0	108.7
461	A	23.2	Very low	23.2	Very low	100 Å²	100	150.7 Å²	150.7	83%	0.826	79%	0.789	S	S	*	*			trans	-82.6	122.5	169.3	0	0	0	0	0	108.8	M459	M459-A461 PolarHBondContact O-N 2.7Å
462	H	22.2	Very low	23.3	Very low	166 Å²	166	143.5 Å²	143.5	77%	0.769	78%	0.781	S	S	*	*			trans	-63.5	142.5	-178.4	-150.7	-84.6	0	0	0	111.1	S464	H462-S464 PolarHBondContact O-N 2.9Å
463	P	25	Very low	23.2	Very low	120 Å²	120	146 Å²	146	78%	0.779	79%	0.786	S	S	*	*			trans	-82.4	107.6	178.4	31.4	-31.4	0	0	0	110.2
464	S	24.7	Very low	23.2	Very low	93 Å²	93	149 Å²	149	65%	0.65	79%	0.785	S	S	*	*			trans	-167	132.3	159.4	51.4	0	0	0	0	107.9	H462	H462-S464 PolarHBondContact O-N 2.9Å
465	E	24.5	Very low	23.1	Very low	190 Å²	190	149.3 Å²	149.3	89%	0.888	80%	0.801	S	S	*	*			trans	95.1	48.6	174.2	-51.1	-179.4	-177.9	0	0	117.5
466	T	25.3	Very low	23.1	Very low	122 Å²	122	149 Å²	149	75%	0.748	80%	0.802	S	S	*	*			trans	-98.2	87.7	146.5	36.8	0	0	0	0	108.4	W468	T466-W468 VanDerWaalsContact C-N 3.34Å; T466-W468 PolarHBondContact O-N 2.51Å
467	G	22.6	Very low	23.1	Very low	71 Å²	71	147.1 Å²	147.1	73%	0.732	80%	0.799	S	S	*	*			trans	-71.2	88.1	171.6	0	0	0	0	0	110.2
468	W	23.2	Very low	23.1	Very low	169 Å²	169	141.9 Å²	141.9	64%	0.64	79%	0.789	S	S	*	*			trans	-104.7	119.5	172.7	-78.2	47.5	0	0	0	107.5	T466	T466-W468 VanDerWaalsContact C-N 3.34Å; T466-W468 PolarHBondContact O-N 2.51Å
469	F	23.8	Very low	23.2	Very low	130 Å²	130	143.9 Å²	143.9	57%	0.57	79%	0.787	S	S	*	*			trans	53.8	69.6	179.2	-60.8	-80.7	0	0	0	116.9	F471	F469-F471 PolarHBondContact O-N 2.84Å
470	T	20.3	Very low	23.2	Very low	130 Å²	130	137.6 Å²	137.6	80%	0.798	76%	0.756	S	S	*	*			trans	-82.4	105.5	150.9	42.5	0	0	0	0	108.6	A472	T470-A472 PolarHBondContact O-N 3.16Å; T470-A472 VanDerWaalsContact O-N 3.16Å
471	F	21.9	Very low	23.3	Very low	196 Å²	196	133 Å²	133	86%	0.86	73%	0.725	S	S	*	*			trans	-47.5	123.9	148.8	-89.5	-89.7	0	0	0	106.7	F469 N473	F469-F471 PolarHBondContact O-N 2.84Å; F471-N473 VanDerWaalsContact C-N 3.29Å; F471-N473 PolarHBondContact O-N 2.79Å
472	A	23	Very low	23.3	Very low	93 Å²	93	129.8 Å²	129.8	77%	0.769	70%	0.702	S	S	*	*			trans	-58.1	99.9	173.6	0	0	0	0	0	107.7	T470 R474	T470-A472 PolarHBondContact O-N 3.16Å; T470-A472 VanDerWaalsContact O-N 3.16Å; A472-R474 PolarHBondContact O-N 2.88Å
473	N	21.4	Very low	23.4	Very low	165 Å²	165	124.5 Å²	124.5	88%	0.882	69%	0.686	S	S	*	*			trans	-73.2	79.2	167	-156.4	13.6	0	0	0	106.1	F471	F471-N473 VanDerWaalsContact C-N 3.29Å; F471-N473 PolarHBondContact O-N 2.79Å
474	R	22.3	Very low	23.5	Very low	230 Å²	230	120.1 Å²	120.1	87%	0.868	66%	0.657	S	S	*	*	S	Bend	trans	-164.6	123.5	166	-106.6	170.8	-148.4	-98.7	2.7	108.6	A472 E476	A472-R474 PolarHBondContact O-N 2.88Å; R474-E476 PolarHBondContact O-N 3.46Å; R474-E476 VanDerWaalsContact O-N 3.17Å
475	G	22.5	Very low	23.5	Very low	83 Å²	83	116.2 Å²	116.2	86%	0.856	63%	0.631	S	S	*	*			trans	-58.9	116.2	177.6	0	0	0	0	0	111.1
476	E	22.8	Very low	23.4	Very low	190 Å²	190	108.2 Å²	108.2	89%	0.888	60%	0.596	S	S	*	*			trans	-146.8	118.6	153.9	-105.6	167.1	-155.1	0	0	106.8	R474	R474-E476 PolarHBondContact O-N 3.46Å; R474-E476 VanDerWaalsContact O-N 3.17Å
477	M	23.1	Very low	23.4	Very low	175 Å²	175	102.6 Å²	102.6	86%	0.862	56%	0.561	S	S	*	*			trans	-72	154.2	-173.2	-65.8	169.5	142.9	0	0	111
478	N	23.8	Very low	23.9	Very low	132 Å²	132	102.1 Å²	102.1	71%	0.706	54%	0.538	S	S	*	.			trans	86.6	67.6	163.3	-51.9	-37.4	0	0	0	117.8
479	H	23.8	Very low	24	Very low	159 Å²	159	95.7 Å²	95.7	74%	0.736	52%	0.515	S	S	*	.			trans	-122.4	93.4	157.9	-70.7	-13.1	0	0	0	109.6
480	M	23.6	Very low	23.9	Very low	50 Å²	50	92.9 Å²	92.9	25%	0.246	50%	0.501	C	S	.	.			trans	-139.7	92.2	-177.6	-101.8	-175.1	146.2	0	0	110.8	N174 D722	N174-M480 WeakPolarHBondContact ND2-CB 3.38Å; N174-M480 PolarHBondContact ND2-O 2.83Å; N174-M480 PolarHBondContact OD1-O 3.14Å; M480-D722 HydrophobicContact CE-CB 3.64Å; M480-D722 VanDerWaalsContact CE-O 3.26Å; M480-D722 WeakPolarHBondContact CE-O 3.32Å
481	N	25.7	Very low	24.1	Very low	30 Å²	30	90.9 Å²	90.9	16%	0.16	48%	0.482	C	S	.	.			trans	169.9	45.9	138.3	-86.3	-29	0	0	0	111.2	Y170 N174	Y170-N481 HydrophobicContact CD1-CB 4.28Å; Y170-N481 VanDerWaalsContact CE1-C 3.44Å; Y170-N481 HydrophobicContact CE1-CB 3.65Å; Y170-N481 PolarHBondContact OH-O 3.08Å; N174-N481 WeakPolarHBondContact O-CB 3.48Å; N174-N481 PolarHBondContact O-ND2 2.75Å
482	G	23.9	Very low	24.1	Very low	32 Å²	32	84.1 Å²	84.1	33%	0.33	46%	0.458	S	S	.	.	S	Bend	trans	-57.2	147	144.6	0	0	0	0	0	106.3	Y170 V484	Y170-G482 PolarHBondContact OH-N 3Å; G482-V484 VanDerWaalsContact C-N 3.26Å; G482-V484 WeakPolarHBondContact O-CG2 3.23Å; G482-V484 PolarHBondContact O-N 2.81Å
483	A	24.1	Very low	24.2	Very low	54 Å²	54	84.5 Å²	84.5	45%	0.446	46%	0.462	S	S	.	.			trans	-64.2	94.4	174.9	0	0	0	0	0	107.9	Q231 A485	Q231-A483 VanDerWaalsContact CD-O 3.31Å; Q231-A483 HydrophobicContact CG-CB 4.13Å; Q231-A483 WeakPolarHBondContact CG-O 3.46Å; A483-A485 PolarHBondContact O-N 3.25Å; A483-A485 VanDerWaalsContact O-N 3.12Å
484	V	26.2	Very low	24.4	Very low	28 Å²	28	84.7 Å²	84.7	17%	0.17	46%	0.459	C	S	.	.			trans	-83.1	104	-169.4	-165.9	0	0	0	0	107.4	G482 R591	G482-V484 VanDerWaalsContact C-N 3.26Å; G482-V484 WeakPolarHBondContact O-CG2 3.23Å; G482-V484 PolarHBondContact O-N 2.81Å; V484-R591 HydrophobicContact CB-CB 3.89Å; V484-R591 HydrophobicContact CB-CG 3.63Å; V484-R591 HydrophobicContact CG1-CG 4.29Å; V484-R591 HydrophobicContact CG2-CB 3.94Å; V484-R591 HydrophobicContact CG2-CG 3.73Å
485	A	24.7	Very low	24.4	Very low	11 Å²	11	80.2 Å²	80.2	9%	0.091	46%	0.457	C	S	.	.			trans	-114.7	40.4	-172.7	0	0	0	0	0	110.1	S229 G230 Q231 A483 Q487 Y488	S229-A485 CarbonylContact O-C 3.53Å; S229-A485 PolarHBondContact O-N 3.29Å; G230-A485 CarbonylContact C-O 3.57Å; G230-A485 WeakPolarHBondContact CA-O 3.27Å; G230-A485 VanDerWaalsContact O-CB 3.23Å; G230-A485 WeakPolarHBondContact O-CB 3.49Å; Q231-A485 HydrophobicContact CB-CB 4.18Å; Q231-A485 HydrophobicContact CG-CB 3.84Å; Q231-A485 VanDerWaalsContact N-CB 3.26Å; A483-A485 PolarHBondContact O-N 3.25Å; A483-A485 VanDerWaalsContact O-N 3.12Å; A485-Q487 PolarHBondContact O-N 3.41Å; A485-Y488 HydrophobicContact CB-CD2 4.25Å; A485-Y488 HydrophobicContact CB-CE2 4.04Å
486	S	23.4	Very low	24.6	Very low	22 Å²	22	82 Å²	82	15%	0.154	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	16.5	163.8	54.2	0	0	0	0	114.2	S229	S229-S486 PolarHBondContact O-N 3.09Å
487	Q	25.6	Very low	24.8	Very low	4 Å²	4	75.6 Å²	75.6	2%	0.019	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	3.9	-163.2	-66.6	-156.4	-48.6	0	0	116.1	R343 A485 G577 G579 A588 T590	R343-Q487 VanDerWaalsContact CZ-O 3.31Å; R343-Q487 PolarHBondContact NH1-O 3.1Å; R343-Q487 PolarHBondContact NH2-O 2.93Å; A485-Q487 PolarHBondContact O-N 3.41Å; Q487-G577 PolarHBondContact NE2-O 3.13Å; Q487-G579 VanDerWaalsContact NE2-N 3.2Å; Q487-A588 PolarHBondContact NE2-O 3.08Å; Q487-T590 VanDerWaalsContact CD-CA 3.42Å; Q487-T590 VanDerWaalsContact NE2-CA 3.27Å; Q487-T590 PolarHBondContact NE2-OG1 2.85Å; Q487-T590 VanDerWaalsContact NE2-OG1 3.16Å; Q487-T590 PolarHBondContact OE1-OG1 2.88Å
488	Y	32.6	Very low	25	Very low	61 Å²	61	73.7 Å²	73.7	24%	0.239	44%	0.435	C	S	.	.			trans	-122.1	64.2	-174.9	-58.4	-75.1	0	0	0	109.6	G230 P233 L312 R343 A485	G230-Y488 WeakPolarHBondContact O-CD2 3.48Å; P233-Y488 HydrophobicContact CB-CD1 4.41Å; P233-Y488 HydrophobicContact CB-CD2 4.05Å; P233-Y488 HydrophobicContact CB-CG 3.67Å; P233-Y488 HydrophobicContact CG-CD1 4.07Å; P233-Y488 HydrophobicContact CG-CD2 3.78Å; P233-Y488 HydrophobicContact CG-CE2 4.36Å; P233-Y488 HydrophobicContact CG-CG 3.61Å; L312-Y488 HydrophobicContact CD1-CE2 4.38Å; R343-Y488 HydrophobicContact CG-CE1 4.24Å; A485-Y488 HydrophobicContact CB-CD2 4.25Å; A485-Y488 HydrophobicContact CB-CE2 4.04Å
489	Q	24.6	Very low	25.2	Very low	34 Å²	34	73.2 Å²	73.2	16%	0.159	44%	0.439	C	S	.	.			trans	-87.9	125.5	-167	-144.9	159.7	-31.1	0	0	110	M274 L275	M274-Q489 HydrophobicContact CE-CG 4.22Å; M274-Q489 PolarHBondContact SD-NE2 2.83Å; L275-Q489 HydrophobicContact CD2-CB 4.46Å; L275-Q489 HydrophobicContact CD2-CG 3.58Å; L275-Q489 HydrophobicContact CG-CG 4.33Å
490	Y	23.3	Very low	25.5	Very low	72 Å²	72	70.2 Å²	70.2	28%	0.282	44%	0.442	S	S	.	.			trans	-122.3	108.4	-177.8	-144.5	-80.8	0	0	0	107.6	F236 L275 P933 F934	F236-Y490 HydrophobicContact CB-CD1 4.23Å; L275-Y490 VanDerWaalsContact CD2-O 3.29Å; L275-Y490 WeakPolarHBondContact CD2-O 3.44Å; Y490-P933 HydrophobicContact CD2-CB 4.15Å; Y490-P933 HydrophobicContact CD2-CG 4.22Å; Y490-P933 HydrophobicContact CE2-CB 3.54Å; Y490-P933 HydrophobicContact CE2-CG 4.12Å; Y490-F934 PolarHBondContact OH-O 3.28Å
491	Q	23.6	Very low	25.6	Very low	87 Å²	87	73 Å²	73	41%	0.407	47%	0.465	S	S	.	.			trans	-119.2	122.2	176.2	-163	167.8	6.5	0	0	110.3
492	P	22.9	Very low	25.5	Very low	54 Å²	54	80.1 Å²	80.1	35%	0.351	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-72.5	143.9	170.4	-13.8	28.6	0	0	0	111.8	F236	F236-P492 HydrophobicContact CB-CG 4.47Å; F236-P492 HydrophobicContact CD2-CG 3.84Å; F236-P492 HydrophobicContact CE2-CG 4.21Å; F236-P492 HydrophobicContact CG-CG 4.11Å
493	A	24.6	Very low	25.6	Very low	102 Å²	102	85.1 Å²	85.1	84%	0.843	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-65.9	134.6	176.3	0	0	0	0	0	111.7
494	M	24.5	Very low	25.6	Very low	168 Å²	168	88.3 Å²	88.3	83%	0.828	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-78.1	130.5	178.5	-64.7	168.2	55.1	0	0	110.1
495	V	23	Very low	25.6	Very low	137 Å²	137	90.4 Å²	90.4	83%	0.83	56%	0.555	S	S	*	*			trans	-115.1	105	156.5	-176	0	0	0	0	106.7	G497	V495-G497 PolarHBondContact O-N 3.36Å
496	S	26.9	Very low	25.6	Very low	120 Å²	120	100.5 Å²	100.5	84%	0.839	59%	0.592	S	S	*	*			trans	-73	78	169.1	56.1	0	0	0	0	109.1
497	G	26	Very low	25.5	Very low	55 Å²	55	109.6 Å²	109.6	57%	0.567	63%	0.629	S	S	*	*			trans	-90.9	100.7	173.5	0	0	0	0	0	110.3	V495	V495-G497 PolarHBondContact O-N 3.36Å
498	D	28.2	Very low	25.4	Very low	135 Å²	135	114.8 Å²	114.8	72%	0.722	67%	0.665	S	S	*	*			trans	-57.2	131.5	166.8	-137.7	-7.5	0	0	0	108.5	A500	D498-A500 PolarHBondContact O-N 3.24Å
499	P	27.5	Very low	25	Very low	123 Å²	123	116.2 Å²	116.2	80%	0.799	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	15.9	-168.1	21.9	-25.3	0	0	0	115.3
500	A	30.3	Very low	24.9	Very low	96 Å²	96	124.4 Å²	124.4	79%	0.793	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	-2	-178.5	0	0	0	0	0	115	D498	D498-A500 PolarHBondContact O-N 3.24Å
501	C	26.2	Very low	25	Very low	108 Å²	108	124.5 Å²	124.5	73%	0.73	73%	0.733	S	S	*	*			trans	-107.2	37.2	-178.5	68.1	0	0	0	0	114.8	N503	C501-N503 PolarHBondContact O-N 2.65Å
502	M	23.2	Very low	24.9	Very low	180 Å²	180	128.1 Å²	128.1	89%	0.887	75%	0.754	S	S	*	*			trans	-83.9	95.2	161.7	-74.1	-70.2	177	0	0	108.5	P504	M502-P504 VanDerWaalsContact O-CD 3.3Å; M502-P504 WeakPolarHBondContact O-CD 3.17Å
503	N	27	Very low	25.1	Very low	136 Å²	136	132.7 Å²	132.7	73%	0.727	77%	0.774	S	S	*	*			trans	-79.8	111.7	169.1	-168.1	-1.5	0	0	0	108.9	C501 A505	C501-N503 PolarHBondContact O-N 2.65Å; N503-A505 VanDerWaalsContact C-N 3.26Å; N503-A505 PolarHBondContact O-N 3.41Å
504	P	24.5	Very low	25.2	Very low	121 Å²	121	134.5 Å²	134.5	79%	0.786	77%	0.769	S	S	*	*			trans	-81.8	71.2	-174.8	34.3	-32.4	0	0	0	110.1	M502	M502-P504 VanDerWaalsContact O-CD 3.3Å; M502-P504 WeakPolarHBondContact O-CD 3.17Å
505	A	26	Very low	25.1	Very low	73 Å²	73	130.1 Å²	130.1	60%	0.603	77%	0.767	S	S	*	*			trans	-99	1.6	171.4	0	0	0	0	0	113.1	N503 F507	N503-A505 VanDerWaalsContact C-N 3.26Å; N503-A505 PolarHBondContact O-N 3.41Å; A505-F507 VanDerWaalsContact C-N 3.29Å; A505-F507 PolarHBondContact O-N 3.23Å
506	Y	23.7	Very low	25.2	Very low	222 Å²	222	131.2 Å²	131.2	87%	0.871	77%	0.768	S	S	*	*			trans	-84.4	19.1	-173.3	-97.9	-79.7	0	0	0	116.2
507	F	21.3	Very low	25	Very low	213 Å²	213	131.3 Å²	131.3	93%	0.934	77%	0.765	S	S	*	*	S	Bend	trans	-134.1	56.1	174.5	-79.7	-77.7	0	0	0	113	A505	A505-F507 VanDerWaalsContact C-N 3.29Å; A505-F507 PolarHBondContact O-N 3.23Å
508	C	23.1	Very low	25	Very low	114 Å²	114	136.3 Å²	136.3	77%	0.77	78%	0.777	S	S	*	*			trans	-165.7	113.2	159.2	-156.7	0	0	0	0	106
509	S	24.9	Very low	24.8	Very low	91 Å²	91	135 Å²	135	64%	0.636	78%	0.776	S	S	*	*			cis	-172.5	119.2	44.1	30.5	0	0	0	0	107.1	S511	S509-S511 VanDerWaalsContact C-N 3.28Å; S509-S511 PolarHBondContact O-N 2.87Å; S509-S511 VanDerWaalsContact O-N 3.08Å
510	Q	22.3	Very low	24.7	Very low	205 Å²	205	135.3 Å²	135.3	96%	0.958	78%	0.776	S	S	*	*			trans	-69.7	91.3	155.9	-76.6	177.1	-21.1	0	0	107
511	S	24.6	Very low	24.3	Very low	74 Å²	74	135.4 Å²	135.4	52%	0.517	78%	0.776	S	S	.	*			trans	-124	93.7	165.7	54.4	0	0	0	0	108.9	S509 I513	S509-S511 VanDerWaalsContact C-N 3.28Å; S509-S511 PolarHBondContact O-N 2.87Å; S509-S511 VanDerWaalsContact O-N 3.08Å; S511-I513 PolarHBondContact O-N 3.46Å; S511-I513 VanDerWaalsContact O-N 3.1Å
512	I	22.2	Very low	24.4	Very low	164 Å²	164	139.1 Å²	139.1	84%	0.841	78%	0.783	S	S	*	*			trans	-50.8	107.3	157.4	-62.5	165.1	0	0	0	106.6
513	I	26.9	Very low	24.2	Very low	150 Å²	150	134.7 Å²	134.7	77%	0.769	78%	0.784	S	S	*	*			trans	-104.3	116.1	169.3	-64.5	-179.8	0	0	0	108.2	S511	S511-I513 PolarHBondContact O-N 3.46Å; S511-I513 VanDerWaalsContact O-N 3.1Å
514	N	26.2	Very low	24.1	Very low	140 Å²	140	133.4 Å²	133.4	75%	0.749	78%	0.781	S	S	*	*			trans	-37.4	139.6	174.1	-68.3	-31.9	0	0	0	116.2
515	G	22.8	Very low	23.9	Very low	76 Å²	76	136 Å²	136	78%	0.784	78%	0.782	S	S	*	*			trans	-6.4	117.4	151.8	0	0	0	0	0	118.7
516	L	26.1	Very low	23.8	Very low	160 Å²	160	142.3 Å²	142.3	84%	0.838	79%	0.79	S	S	*	*			trans	-128.9	115	147.6	-88.5	160.4	0	0	0	107.4
517	P	22.6	Very low	23.7	Very low	121 Å²	121	141.7 Å²	141.7	79%	0.786	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-80.7	123.2	174.6	29.8	-28.3	0	0	0	109.6
518	I	25.7	Very low	23.9	Very low	160 Å²	160	142.5 Å²	142.5	82%	0.821	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-98.9	125.2	174.4	-58.1	177.3	0	0	0	109
519	P	23.8	Very low	23.8	Very low	108 Å²	108	146.3 Å²	146.3	70%	0.701	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-73.1	130.8	-177.6	-12.3	27.4	0	0	0	113.3
520	T	24.9	Very low	23.5	Very low	130 Å²	130	147.6 Å²	147.6	80%	0.798	80%	0.802	S	S	*	*			trans	21.8	115.1	142.7	53.5	0	0	0	0	119.4
521	A	23.2	Very low	23.7	Very low	97 Å²	97	143.5 Å²	143.5	80%	0.802	80%	0.796	S	S	*	*			trans	24.1	107.7	134.8	0	0	0	0	0	118.3
522	Q	26.6	Very low	23.6	Very low	187 Å²	187	144.5 Å²	144.5	87%	0.874	80%	0.803	S	S	*	*			trans	-158.3	120.4	141.4	-107.1	171.1	21.4	0	0	109.3	V524	Q522-V524 PolarHBondContact O-N 2.82Å
523	G	20.5	Very low	23.9	Very low	87 Å²	87	142.9 Å²	142.9	90%	0.897	80%	0.796	S	S	*	*			trans	-62	122.3	178	0	0	0	0	0	111.2
524	V	24.1	Very low	24	Very low	109 Å²	109	141.9 Å²	141.9	66%	0.661	79%	0.792	S	S	*	*			trans	-111.8	96.4	172	-175.1	0	0	0	0	107.8	Q522 R526	Q522-V524 PolarHBondContact O-N 2.82Å; V524-R526 HydrophobicContact CG1-CG 3.93Å; V524-R526 PolarHBondContact O-N 2.87Å; V524-R526 VanDerWaalsContact O-N 3.1Å
525	Q	20.3	Very low	24	Very low	174 Å²	174	140.9 Å²	140.9	81%	0.813	79%	0.791	S	S	*	*			trans	-56.2	106.8	160	-76.5	178	-36.8	0	0	108.4
526	R	23.2	Very low	24	Very low	206 Å²	206	143.6 Å²	143.6	78%	0.777	79%	0.793	S	S	*	*			trans	-97.2	107.4	168.4	-69.7	-167.6	179.6	-175.5	1.4	108.8	V524 Y528	V524-R526 HydrophobicContact CG1-CG 3.93Å; V524-R526 PolarHBondContact O-N 2.87Å; V524-R526 VanDerWaalsContact O-N 3.1Å; R526-Y528 PolarHBondContact O-N 3.42Å
527	Y	22.6	Very low	23.9	Very low	210 Å²	210	139.1 Å²	139.1	82%	0.824	79%	0.785	S	S	*	*			trans	-57.1	117.8	164.2	-80.5	-94.9	0	0	0	109.2	Q529	Y527-Q529 PolarHBondContact O-N 3.39Å
528	Y	25	Very low	24.2	Very low	229 Å²	229	141.4 Å²	141.4	90%	0.898	79%	0.79	S	S	*	*			trans	-78.9	111.2	166.9	-77.9	-87.7	0	0	0	108.6	R526	R526-Y528 PolarHBondContact O-N 3.42Å
529	Q	20.4	Very low	24	Very low	194 Å²	194	141.7 Å²	141.7	91%	0.907	79%	0.79	S	S	*	*			trans	-78.3	122.8	166.5	-107.1	173.6	-24.8	0	0	109	Y527 S531	Y527-Q529 PolarHBondContact O-N 3.39Å; Q529-S531 PolarHBondContact O-N 2.8Å
530	S	19.8	Very low	24.1	Very low	118 Å²	118	143.2 Å²	143.2	83%	0.825	79%	0.792	S	S	*	*			trans	-71.5	109.3	172.2	56.1	0	0	0	0	110.3
531	S	26.1	Very low	24.2	Very low	119 Å²	119	142.6 Å²	142.6	83%	0.832	78%	0.784	S	S	*	*			trans	-99.1	99.1	161.6	72	0	0	0	0	109.1	Q529	Q529-S531 PolarHBondContact O-N 2.8Å
532	S	23.2	Very low	24.3	Very low	95 Å²	95	146 Å²	146	66%	0.664	78%	0.782	S	S	*	*			trans	-64.7	157.5	154.9	53.1	0	0	0	0	110.2
533	N	28	Very low	24.4	Very low	130 Å²	130	148.3 Å²	148.3	70%	0.695	79%	0.785	S	S	*	*			trans	109.2	114.1	155	-66.6	11.5	0	0	0	118.1
534	D	27.9	Very low	24.6	Very low	130 Å²	130	149.9 Å²	149.9	70%	0.695	78%	0.782	S	S	*	*				100	109.8	123.3	-64.9	-16.7	0	0	0	121.5
535	V	27.1	Very low	24.8	Very low	118 Å²	118	149.1 Å²	149.1	72%	0.715	78%	0.782	S	S	*	*				68.5	104.3	119.2	-174.6	0	0	0	0	118.2
536	T	22.4	Very low	25.1	Very low	134 Å²	134	150.4 Å²	150.4	82%	0.822	78%	0.784	S	S	*	*			trans	5.3	125.6	135.5	58.3	0	0	0	0	118.3
537	G	24.9	Very low	25.3	Very low	66 Å²	66	146.6 Å²	146.6	68%	0.68	78%	0.78	S	S	*	*			trans	160.2	113.4	154	0	0	0	0	0	116.9
538	L	27.6	Very low	25.5	Very low	168 Å²	168	144.3 Å²	144.3	88%	0.88	78%	0.782	S	S	*	*			trans	75	112	134.2	-67.2	153.5	0	0	0	120.2
539	M	22.1	Very low	25.6	Very low	167 Å²	167	141.5 Å²	141.5	82%	0.823	78%	0.777	S	S	*	*			trans	-8	127.8	140.1	-71.1	135.6	94	0	0	116.9
540	N	26.9	Very low	26.1	Very low	139 Å²	139	139.5 Å²	139.5	74%	0.743	77%	0.77	S	S	*	*				180	134.7	118.3	-96.5	-1.6	0	0	0	113.1
541	D	26.5	Very low	26.5	Very low	118 Å²	118	139.7 Å²	139.7	63%	0.631	76%	0.762	S	S	*	*			trans	64	112.8	137.3	-59.4	-29.9	0	0	0	123
542	H	25.2	Very low	26.7	Very low	167 Å²	167	141.3 Å²	141.3	77%	0.773	76%	0.761	S	S	*	*				46.1	90.5	126	-67	-62.1	0	0	0	119.3
543	Y	28.9	Very low	26.8	Very low	236 Å²	236	144 Å²	144	93%	0.925	77%	0.765	S	S	*	*			trans	-141.3	112.9	136.7	-89.2	-79.7	0	0	0	111.1	S545	Y543-S545 PolarHBondContact O-N 2.81Å
544	S	24.4	Very low	27	Very low	120 Å²	120	143.3 Å²	143.3	84%	0.839	77%	0.766	S	S	*	*			trans	-67.7	104.7	166.7	153.7	0	0	0	0	109.1
545	S	28.2	Very low	27.4	Very low	93 Å²	93	142.6 Å²	142.6	65%	0.65	77%	0.766	S	S	*	*			trans	-123.5	113.7	161.9	-170.4	0	0	0	0	109.5	Y543 N547	Y543-S545 PolarHBondContact O-N 2.81Å; S545-N547 VanDerWaalsContact C-N 3.26Å; S545-N547 PolarHBondContact O-N 2.79Å
546	K	26.4	Very low	27.8	Very low	201 Å²	201	144.8 Å²	144.8	87%	0.874	77%	0.771	S	S	*	*			trans	-65.8	82.3	171.7	-71.2	174.4	174.8	176.7	0	109
547	N	28.4	Very low	29.3	Very low	126 Å²	126	142.2 Å²	142.2	67%	0.674	75%	0.751	S	S	*	*			trans	-110.2	123.6	163	-88.7	-15.9	0	0	0	108.3	S545 H549	S545-N547 VanDerWaalsContact C-N 3.26Å; S545-N547 PolarHBondContact O-N 2.79Å; N547-H549 VanDerWaalsContact C-N 3.27Å; N547-H549 PolarHBondContact O-N 2.8Å
548	N	26.3	Very low	30.9	Very low	162 Å²	162	145.4 Å²	145.4	87%	0.866	76%	0.757	S	S	*	*			trans	-49.6	90.2	170.9	-80.7	-23	0	0	0	109.7	I550	N548-I550 PolarHBondContact O-N 2.79Å
549	H	27.6	Very low	33	Very low	171 Å²	171	139.4 Å²	139.4	79%	0.792	72%	0.723	S	S	*	*			trans	-68.8	87.1	156.7	-80	-52.2	0	0	0	106.1	N547 N551	N547-H549 VanDerWaalsContact C-N 3.27Å; N547-H549 PolarHBondContact O-N 2.8Å; H549-N551 PolarHBondContact O-N 2.98Å
550	I	29	Very low	35.6	Very low	152 Å²	152	134.6 Å²	134.6	78%	0.779	70%	0.7	S	S	*	*			trans	-50.5	105	145.2	-66.7	168.8	0	0	0	103.1	N548 N552	N548-I550 PolarHBondContact O-N 2.79Å; I550-N552 VanDerWaalsContact C-N 3.27Å; I550-N552 PolarHBondContact O-N 3.34Å
551	N	29.9	Very low	38.2	Very low	121 Å²	121	132.9 Å²	132.9	65%	0.647	70%	0.697	S	S	*	*			trans	-52	102.8	174.1	-77.5	-31.4	0	0	0	105.7	H549 M553	H549-N551 PolarHBondContact O-N 2.98Å; N551-M553 HydrophobicContact CB-CG 4Å; N551-M553 PolarHBondContact O-N 2.77Å
552	N	29.5	Very low	41	Very low	153 Å²	153	129.8 Å²	129.8	82%	0.818	68%	0.677	S	S	*	*			trans	-61.6	77.3	147.8	-120.9	5.3	0	0	0	103.4	I550 T554	I550-N552 VanDerWaalsContact C-N 3.27Å; I550-N552 PolarHBondContact O-N 3.34Å; N552-T554 PolarHBondContact O-N 3.21Å
553	M	26.4	Very low	43.6	Very low	151 Å²	151	129 Å²	129	74%	0.744	67%	0.674	S	S	*	*			trans	-62.5	89.4	157	-77.7	-130.3	176.9	0	0	102.6	N551 V555	N551-M553 HydrophobicContact CB-CG 4Å; N551-M553 PolarHBondContact O-N 2.77Å; M553-V555 PolarHBondContact O-N 3.1Å
554	T	31.5	Very low	46.1	Very low	117 Å²	117	122.4 Å²	122.4	72%	0.718	66%	0.66	S	S	*	*			trans	-53.4	95.7	156.9	-36.1	0	0	0	0	102.8	N552 M556	N552-T554 PolarHBondContact O-N 3.21Å; T554-M556 PolarHBondContact O-N 3.25Å
555	V	36	Very low	49	Very low	114 Å²	114	118.2 Å²	118.2	69%	0.691	63%	0.628	S	S	*	*			trans	-57.3	103	171.9	176.3	0	0	0	0	102.6	M553 I557	M553-V555 PolarHBondContact O-N 3.1Å; V555-I557 HydrophobicContact CG1-CG1 4.17Å; V555-I557 PolarHBondContact O-N 2.82Å
556	M	35.6	Very low	52	Low	165 Å²	165	117.4 Å²	117.4	81%	0.813	61%	0.613	S	S	*	*			trans	-67.2	95	172.5	-70.6	-151.9	-173.7	0	0	104	T554 T558	T554-M556 PolarHBondContact O-N 3.25Å; M556-T558 VanDerWaalsContact C-N 3.28Å; M556-T558 PolarHBondContact O-N 3.25Å
557	I	52.9	Low	55.2	Low	80 Å²	80	108 Å²	108	41%	0.41	57%	0.572	S	S	.	*			trans	-66.9	98	175.9	-63.1	162.1	0	0	0	105.1	V555 R559 F786 T815	V555-I557 HydrophobicContact CG1-CG1 4.17Å; V555-I557 PolarHBondContact O-N 2.82Å; I557-R559 PolarHBondContact O-N 3.15Å; I557-F786 HydrophobicContact CB-CZ 4.17Å; I557-F786 HydrophobicContact CG2-CZ 3.87Å; I557-T815 HydrophobicContact CD1-CG2 4.16Å; I557-T815 HydrophobicContact CG2-CG2 3.99Å
558	T	59.1	Low	58.3	Low	132 Å²	132	104.1 Å²	104.1	81%	0.81	55%	0.548	S	S	*	.			trans	-69.1	116	172.7	-54	0	0	0	0	107.4	M556	M556-T558 VanDerWaalsContact C-N 3.28Å; M556-T558 PolarHBondContact O-N 3.25Å
559	R	72.6	Confident	61.6	Low	42 Å²	42	96.5 Å²	96.5	16%	0.158	51%	0.507	C	S	.	.			trans	-75	151.3	-179.4	-73	-84	-83	-107.5	-23.9	110.4	I557 P561 S784 F786 E813	I557-R559 PolarHBondContact O-N 3.15Å; R559-P561 WeakPolarHBondContact O-CD 3.3Å; R559-S784 VanDerWaalsContact CZ-O 3.25Å; R559-S784 PolarHBondContact NH1-O 3.34Å; R559-S784 VanDerWaalsContact NH1-O 3.1Å; R559-S784 PolarHBondContact NH2-O 3.45Å; R559-F786 VanDerWaalsContact CD-CZ 3.44Å; R559-F786 HydrophobicContact CG-CD2 4.35Å; R559-F786 HydrophobicContact CG-CE2 3.41Å; R559-F786 VanDerWaalsContact CG-CE2 3.41Å; R559-F786 HydrophobicContact CG-CZ 3.83Å; R559-F786 VanDerWaalsContact NH1-CD1 3.33Å; R559-E813 WeakPolarHBondContact CD-OE1 3.49Å; R559-E813 IonicContact NE-OE1 2.85Å; R559-E813 IonicContact NE-OE2 2.63Å
560	I	75.4	Confident	64.4	Low	66 Å²	66	88.7 Å²	88.7	34%	0.338	47%	0.472	S	S	.	.			trans	-68.3	113.9	174.4	-59.4	166.3	0	0	0	107	Q783 I812 E813	I560-Q783 PolarHBondContact O-NE2 3.31Å; I560-Q783 VanDerWaalsContact O-NE2 3.12Å; I560-I812 HydrophobicContact CD1-CB 4.46Å; I560-I812 HydrophobicContact CD1-CD1 4.5Å; I560-I812 HydrophobicContact CD1-CG1 4.26Å; I560-I812 WeakPolarHBondContact CD1-O 3.3Å; I560-E813 HydrophobicContact CD1-CB 4.43Å
561	P	81.6	Confident	66.9	Low	104 Å²	104	83.9 Å²	83.9	68%	0.675	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-70	142.1	174.2	30.5	-32.4	0	0	0	108.8	R559 E563	R559-P561 WeakPolarHBondContact O-CD 3.3Å; P561-E563 PolarHBondContact O-N 2.81Å
562	F	86.4	Confident	69.5	Low	52 Å²	52	80.1 Å²	80.1	23%	0.228	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-65.9	132.7	170.8	-66	-33.5	0	0	0	110.1	D774 A776 Q781 Q783 T924	F562-D774 HydrophobicContact CE2-CB 3.75Å; F562-D774 HydrophobicContact CZ-CB 4.36Å; F562-A776 HydrophobicContact CB-CB 4.38Å; F562-A776 HydrophobicContact CD1-CB 3.86Å; F562-A776 HydrophobicContact CD2-CB 4.03Å; F562-A776 HydrophobicContact CE1-CB 4.05Å; F562-A776 HydrophobicContact CE2-CB 4.19Å; F562-A776 HydrophobicContact CG-CB 3.85Å; F562-A776 HydrophobicContact CZ-CB 4.2Å; F562-Q781 HydrophobicContact CD1-CB 4.43Å; F562-Q781 HydrophobicContact CE1-CB 3.93Å; F562-Q783 HydrophobicContact CE1-CB 3.92Å; F562-Q783 HydrophobicContact CE2-CB 4.41Å; F562-Q783 HydrophobicContact CZ-CB 3.49Å; F562-Q783 VanDerWaalsContact CZ-CB 3.49Å; F562-T924 HydrophobicContact CE1-CG2 4.44Å
563	E	79.8	Confident	72.4	Confident	150 Å²	150	73.2 Å²	73.2	70%	0.701	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-70.6	141.9	172.2	-66.5	-175.1	165.3	0	0	109.8	P561 E565	P561-E563 PolarHBondContact O-N 2.81Å; E563-E565 PolarHBondContact O-N 3.47Å
564	P	80.5	Confident	75.5	Confident	98 Å²	98	67.4 Å²	67.4	64%	0.636	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-55.9	139.9	168.8	-22.5	33.2	0	0	0	110.4	H566	P564-H566 PolarHBondContact O-N 3.26Å; P564-H566 VanDerWaalsContact O-N 3.15Å
565	E	85.5	Confident	78.4	Confident	33 Å²	33	63 Å²	63	15%	0.154	36%	0.356	C	S	.	.			trans	-70.5	114.8	177.6	-175.5	178.9	-164	0	0	110.5	E563 R568 N601 K602 P777 D778	E563-E565 PolarHBondContact O-N 3.47Å; E565-R568 IonicContact OE1-CZ 2.81Å; E565-R568 IonicContact OE1-NH1 3.68Å; E565-R568 PolarHBondContact OE1-NH1 3.42Å; E565-R568 IonicContact OE1-NH2 3.67Å; E565-R568 PolarHBondContact OE1-NH2 3.01Å; E565-N601 WeakPolarHBondContact CG-ND2 3.5Å; E565-N601 PolarHBondContact OE1-ND2 2.87Å; E565-K602 PolarHBondContact O-NZ 3.19Å; E565-P777 HydrophobicContact CB-CB 4.12Å; E565-D778 HydrophobicContact CB-CB 4.24Å; E565-D778 HydrophobicContact CG-CB 3.78Å
566	H	91	Very high	80.6	Confident	75 Å²	75	60.5 Å²	60.5	35%	0.347	34%	0.341	S	S	.	.			trans	-64.3	149.9	176.7	-65.7	-54.5	0	0	0	113.5	P564 R568 N601 E731	P564-H566 PolarHBondContact O-N 3.26Å; P564-H566 VanDerWaalsContact O-N 3.15Å; H566-R568 PolarHBondContact O-N 3.32Å; H566-R568 PolarHBondContact O-NH1 3.42Å; H566-R568 VanDerWaalsContact O-NH1 3.14Å; H566-N601 PolarHBondContact O-ND2 2.84Å; H566-E731 WeakPolarHBondContact CA-OE2 3.23Å; H566-E731 WeakPolarHBondContact CB-OE2 3.18Å; H566-E731 IonicContact CE1-OE1 3.55Å; H566-E731 IonicContact CG-OE1 2.72Å; H566-E731 IonicContact CG-OE2 2.75Å; H566-E731 VanDerWaalsContact ND1-CD 3.26Å; H566-E731 IonicContact ND1-OE1 3.37Å; H566-E731 PolarHBondContact ND1-OE1 2.98Å; H566-E731 IonicContact ND1-OE2 3.27Å
567	W	94.5	Very high	83	Confident	5 Å²	5	53.1 Å²	53.1	2%	0.019	31%	0.308	C	S	.	.			trans	-71	118.9	174.8	-79.2	80.1	0	0	0	110.3	L585 K602 V604 P716 F729 E731 V746 A747 Q754	W567-L585 WeakPolarHBondContact O-CD2 3.37Å; W567-K602 HydrophobicContact CD2-CB 4.35Å; W567-K602 HydrophobicContact CE3-CB 4.15Å; W567-K602 HydrophobicContact CH2-CB 3.85Å; W567-K602 HydrophobicContact CZ2-CB 4.07Å; W567-K602 HydrophobicContact CZ3-CB 3.89Å; W567-K602 WeakPolarHBondContact CZ3-O 3.34Å; W567-V604 HydrophobicContact CH2-CG1 4.04Å; W567-P716 HydrophobicContact CZ3-CG 4.24Å; W567-F729 HydrophobicContact CB-CB 3.75Å; W567-F729 HydrophobicContact CB-CD2 3.61Å; W567-F729 HydrophobicContact CB-CE2 4.43Å; W567-F729 HydrophobicContact CB-CG 3.81Å; W567-F729 HydrophobicContact CE3-CD1 4.45Å; W567-F729 HydrophobicContact CE3-CG 4.47Å; W567-F729 HydrophobicContact CG-CB 4.3Å; W567-F729 VanDerWaalsContact O-CD2 3.31Å; W567-F729 WeakPolarHBondContact O-CD2 3.41Å; W567-E731 PolarHBondContact N-OE2 2.96Å; W567-V746 HydrophobicContact CD2-CG2 4.25Å; W567-V746 HydrophobicContact CE3-CB 4.24Å; W567-V746 HydrophobicContact CE3-CG2 3.79Å; W567-V746 HydrophobicContact CH2-CB 3.8Å; W567-V746 HydrophobicContact CH2-CG2 4.29Å; W567-V746 HydrophobicContact CZ2-CB 4.24Å; W567-V746 WeakPolarHBondContact CZ2-O 3.17Å; W567-V746 HydrophobicContact CZ3-CB 3.8Å; W567-V746 HydrophobicContact CZ3-CG2 3.82Å; W567-A747 HydrophobicContact CG-CB 4.17Å; W567-Q754 HydrophobicContact CZ2-CG 3.95Å
568	R	94	Very high	84.7	Confident	44 Å²	44	49.7 Å²	49.7	17%	0.166	29%	0.29	C	S	.	.			trans	-153.8	159.5	-177.4	69.5	-177.3	178.8	-66.7	-4.8	112.1	E565 H566 R583 A600 N601	E565-R568 IonicContact OE1-CZ 2.81Å; E565-R568 IonicContact OE1-NH1 3.68Å; E565-R568 PolarHBondContact OE1-NH1 3.42Å; E565-R568 IonicContact OE1-NH2 3.67Å; E565-R568 PolarHBondContact OE1-NH2 3.01Å; H566-R568 PolarHBondContact O-N 3.32Å; H566-R568 PolarHBondContact O-NH1 3.42Å; H566-R568 VanDerWaalsContact O-NH1 3.14Å; R568-R583 WeakPolarHBondContact CB-O 3.37Å; R568-A600 CarbonylContact O-C 3.49Å; R568-A600 VanDerWaalsContact O-CA 3.27Å; R568-A600 WeakPolarHBondContact O-CA 3.46Å; R568-N601 HydrophobicContact CG-CB 4.47Å; R568-N601 PolarHBondContact N-OD1 2.89Å; R568-N601 PolarHBondContact NH1-ND2 3.43Å; R568-N601 VanDerWaalsContact NH1-ND2 3.12Å; R568-N601 PolarHBondContact O-N 3.25Å; R568-N601 PolarHBondContact O-OD1 3.19Å
569	I	94.8	Very high	86	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	131.2	162.2	-58.4	-52.4	0	0	0	109.3	I580 G584 V587 C598 A600 F727 F729	I569-I580 HydrophobicContact CG2-CD1 3.93Å; I569-G584 WeakPolarHBondContact CB-O 3.47Å; I569-G584 PolarHBondContact N-O 2.81Å; I569-V587 HydrophobicContact CB-CG2 4.09Å; I569-V587 HydrophobicContact CG1-CG2 3.9Å; I569-V587 HydrophobicContact CG2-CG2 4.19Å; I569-C598 HydrophobicContact CG2-CB 3.48Å; I569-C598 VanDerWaalsContact CG2-CB 3.48Å; I569-C598 VanDerWaalsContact CG2-SG 3.58Å; I569-A600 HydrophobicContact CD1-CB 4.19Å; I569-F727 HydrophobicContact CD1-CD1 4.3Å; I569-F727 HydrophobicContact CD1-CD2 3.88Å; I569-F727 HydrophobicContact CD1-CE1 4.01Å; I569-F727 HydrophobicContact CD1-CE2 3.57Å; I569-F727 HydrophobicContact CD1-CG 4.22Å; I569-F727 HydrophobicContact CD1-CZ 3.62Å; I569-F727 HydrophobicContact CG1-CD2 3.44Å; I569-F727 VanDerWaalsContact CG1-CD2 3.44Å; I569-F727 HydrophobicContact CG1-CE2 3.38Å; I569-F727 HydrophobicContact CG1-CG 4.12Å; I569-F727 HydrophobicContact CG1-CZ 4.01Å; I569-F729 HydrophobicContact CD1-CZ 4.03Å
570	T	86.9	Confident	86.7	Confident	7 Å²	7	43.3 Å²	43.3	4%	0.043	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	130.6	179.3	174.6	0	0	0	0	110.9	A572 D573 R599	T570-A572 PolarHBondContact O-N 3.39Å; T570-A572 WeakPolarHBondContact OG1-CB 3.13Å; T570-A572 PolarHBondContact OG1-N 2.72Å; T570-A572 VanDerWaalsContact OG1-N 3.1Å; T570-D573 HydrophobicContact CG2-CB 3.48Å; T570-D573 VanDerWaalsContact CG2-CB 3.48Å; T570-D573 PolarHBondContact O-N 3.37Å; T570-R599 VanDerWaalsContact CG2-O 3.28Å; T570-R599 WeakPolarHBondContact CG2-O 3.49Å; T570-R599 PolarHBondContact N-O 2.79Å; T570-R599 VanDerWaalsContact N-O 3.13Å
571	G	81.8	Confident	87.3	Confident	51 Å²	51	40.6 Å²	40.6	53%	0.526	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	-9.2	170.4	0	0	0	0	0	113.7	C574	G571-C574 PolarHBondContact O-SG 2.87Å
572	A	83.4	Confident	87.3	Confident	42 Å²	42	39.6 Å²	39.6	35%	0.347	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-28.5	178	0	0	0	0	0	114	T570 G761	T570-A572 PolarHBondContact O-N 3.39Å; T570-A572 WeakPolarHBondContact OG1-CB 3.13Å; T570-A572 PolarHBondContact OG1-N 2.72Å; T570-A572 VanDerWaalsContact OG1-N 3.1Å; A572-G761 VanDerWaalsContact CB-N 3.3Å
573	D	90.3	Very high	87.3	Confident	8 Å²	8	43 Å²	43	4%	0.043	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	53.3	-177.8	-157.1	15.7	0	0	0	109.8	T570 C598 R599 L633 N757 N759	T570-D573 HydrophobicContact CG2-CB 3.48Å; T570-D573 VanDerWaalsContact CG2-CB 3.48Å; T570-D573 PolarHBondContact O-N 3.37Å; D573-C598 WeakPolarHBondContact O-CA 3.45Å; D573-R599 HydrophobicContact CB-CB 4.48Å; D573-R599 VanDerWaalsContact CG-NE 3.34Å; D573-R599 PolarHBondContact O-N 3.33Å; D573-R599 IonicContact OD1-CZ 3.71Å; D573-R599 IonicContact OD1-NE 3.9Å; D573-R599 PolarHBondContact OD1-NE 2.66Å; D573-R599 IonicContact OD1-NH2 3.75Å; D573-R599 PolarHBondContact OD1-NH2 3.45Å; D573-R599 IonicContact OD2-CZ 3.54Å; D573-R599 IonicContact OD2-NE 3.86Å; D573-R599 PolarHBondContact OD2-NE 3.1Å; D573-R599 IonicContact OD2-NH2 3.98Å; D573-R599 PolarHBondContact OD2-NH2 3.2Å; D573-L633 WeakPolarHBondContact O-CD2 3.37Å; D573-N757 PolarHBondContact OD2-ND2 2.87Å; D573-N757 PolarHBondContact OD2-OD1 2.85Å; D573-N759 HydrophobicContact CB-CB 3.98Å; D573-N759 PolarHBondContact OD1-ND2 3.1Å; D573-N759 VanDerWaalsContact OD1-ND2 3.12Å
574	C	92.6	Very high	87.9	Confident	29 Å²	29	36 Å²	36	20%	0.196	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	155.3	-178.5	76.5	0	0	0	0	111.7	G571 L578 I580 G597 C598	G571-C574 PolarHBondContact O-SG 2.87Å; C574-L578 HydrophobicContact CB-CD1 4.17Å; C574-I580 HydrophobicContact CB-CD1 4.26Å; C574-G597 CarbonylContact C-O 3.6Å; C574-G597 WeakPolarHBondContact CA-O 3.29Å; C574-C598 HydrophobicContact CB-CB 3.64Å
575	T	91.1	Very high	88.6	Confident	25 Å²	25	32.8 Å²	32.8	15%	0.153	20%	0.197	C	C	.	.			trans	-72.9	148.1	171.7	60.3	0	0	0	0	110.6	G577 L578 Q596 G597 L633	T575-G577 PolarHBondContact O-N 2.97Å; T575-G577 VanDerWaalsContact O-N 3.14Å; T575-L578 PolarHBondContact O-N 2.88Å; T575-Q596 VanDerWaalsContact OG1-C 3.31Å; T575-Q596 WeakPolarHBondContact OG1-CA 3.22Å; T575-Q596 VanDerWaalsContact OG1-CB 3.3Å; T575-Q596 WeakPolarHBondContact OG1-CB 3.48Å; T575-Q596 PolarHBondContact OG1-NE2 3.02Å; T575-G597 PolarHBondContact N-O 2.78Å; T575-G597 PolarHBondContact OG1-N 2.91Å; T575-G597 PolarHBondContact OG1-O 3.04Å; T575-L633 HydrophobicContact CG2-CB 3.78Å; T575-L633 HydrophobicContact CG2-CD1 3.78Å; T575-L633 HydrophobicContact CG2-CG 4.44Å
576	P	82.4	Confident	89	Confident	61 Å²	61	31.7 Å²	31.7	40%	0.396	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-18.8	-171	25.3	-37	0	0	0	115.9	N342 L578	N342-P576 HydrophobicContact CB-CB 3.85Å; N342-P576 WeakPolarHBondContact OD1-CB 3.36Å; N342-P576 WeakPolarHBondContact OD1-CG 3.33Å; P576-L578 PolarHBondContact O-N 3.45Å
577	G	85.5	Confident	89.3	Confident	10 Å²	10	28.1 Å²	28.1	10%	0.103	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	17.6	176.9	0	0	0	0	0	113.6	Q487 T575 S589 T590 Q596	Q487-G577 PolarHBondContact NE2-O 3.13Å; T575-G577 PolarHBondContact O-N 2.97Å; T575-G577 VanDerWaalsContact O-N 3.14Å; G577-S589 CarbonylContact O-C 3.49Å; G577-T590 VanDerWaalsContact CA-OG1 3.3Å; G577-T590 WeakPolarHBondContact CA-OG1 3.22Å; G577-T590 PolarHBondContact O-N 2.84Å; G577-T590 PolarHBondContact O-OG1 3.01Å; G577-Q596 VanDerWaalsContact CA-NE2 3.25Å
578	L	88.9	Confident	89.4	Confident	7 Å²	7	28 Å²	28	4%	0.037	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	141.4	168.4	-66.1	-178.5	0	0	0	110.9	R343 C574 T575 P576 I580 V587 A588 Q596 G597 C598 L720	R343-L578 PolarHBondContact NH2-O 3.47Å; C574-L578 HydrophobicContact CB-CD1 4.17Å; T575-L578 PolarHBondContact O-N 2.88Å; P576-L578 PolarHBondContact O-N 3.45Å; L578-I580 HydrophobicContact CB-CG1 4.43Å; L578-V587 HydrophobicContact CB-CG1 4.37Å; L578-V587 HydrophobicContact CD1-CG1 3.96Å; L578-V587 HydrophobicContact CD2-CG1 4.05Å; L578-V587 HydrophobicContact CG-CG1 4.35Å; L578-A588 CarbonylContact C-O 3.5Å; L578-A588 WeakPolarHBondContact CA-O 3.44Å; L578-Q596 HydrophobicContact CD2-CB 3.43Å; L578-Q596 VanDerWaalsContact CD2-CB 3.43Å; L578-Q596 HydrophobicContact CG-CB 3.79Å; L578-G597 VanDerWaalsContact CD1-C 3.47Å; L578-G597 VanDerWaalsContact CD1-O 3.26Å; L578-G597 WeakPolarHBondContact CD1-O 3.39Å; L578-C598 HydrophobicContact CD1-CB 3.52Å; L578-L720 HydrophobicContact CD2-CD1 4.33Å
579	G	86.7	Confident	89.3	Confident	1 Å²	1	26 Å²	26	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	134.7	159.9	0	0	0	0	0	108.1	Q487 V587 A588	Q487-G579 VanDerWaalsContact NE2-N 3.2Å; G579-V587 CarbonylContact O-C 3.47Å; G579-V587 WeakPolarHBondContact O-CA 3.05Å; G579-A588 PolarHBondContact N-O 2.8Å; G579-A588 PolarHBondContact O-N 3.45Å
580	I	88.2	Confident	88.9	Confident	39 Å²	39	27.2 Å²	27.2	20%	0.2	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	133.7	-176.7	-58.7	168.5	0	0	0	106.6	I569 C574 L578 D586 V587	I569-I580 HydrophobicContact CG2-CD1 3.93Å; C574-I580 HydrophobicContact CB-CD1 4.26Å; L578-I580 HydrophobicContact CB-CG1 4.43Å; I580-D586 CarbonylContact C-O 3.56Å; I580-D586 VanDerWaalsContact CA-O 3.31Å; I580-D586 WeakPolarHBondContact CA-O 3.36Å; I580-V587 HydrophobicContact CG1-CG1 4.2Å; I580-V587 HydrophobicContact CG1-CG2 4.25Å; I580-V587 HydrophobicContact CG2-CG2 4.44Å
581	D	87.7	Confident	88.7	Confident	9 Å²	9	29.7 Å²	29.7	5%	0.048	19%	0.185	C	C	.	.			trans	-69.2	169.6	176.1	79.5	-26.7	0	0	0	112.6	R583 G584 L585 D586	D581-R583 PolarHBondContact O-N 3.41Å; D581-R583 IonicContact OD2-CZ 3.19Å; D581-R583 IonicContact OD2-NE 3.08Å; D581-R583 PolarHBondContact OD2-NE 2.62Å; D581-R583 IonicContact OD2-NH2 2.85Å; D581-R583 PolarHBondContact OD2-NH2 2.79Å; D581-G584 PolarHBondContact O-N 3.08Å; D581-G584 WeakPolarHBondContact OD1-CA 3.46Å; D581-G584 PolarHBondContact OD1-N 3.21Å; D581-L585 PolarHBondContact OD1-N 2.97Å; D581-D586 HydrophobicContact CB-CB 3.91Å; D581-D586 PolarHBondContact N-O 3.08Å; D581-D586 PolarHBondContact OD1-N 3.29Å
582	A	81.1	Confident	88.7	Confident	83 Å²	83	29.5 Å²	29.5	69%	0.686	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-26.6	-176.1	0	0	0	0	0	113.6
583	R	87.2	Confident	88.6	Confident	125 Å²	125	28.6 Å²	28.6	47%	0.472	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-18.1	176.3	-60.9	171.9	-61.5	168.8	5.3	112.5	R568 D581 L585	R568-R583 WeakPolarHBondContact CB-O 3.37Å; D581-R583 PolarHBondContact O-N 3.41Å; D581-R583 IonicContact OD2-CZ 3.19Å; D581-R583 IonicContact OD2-NE 3.08Å; D581-R583 PolarHBondContact OD2-NE 2.62Å; D581-R583 IonicContact OD2-NH2 2.85Å; D581-R583 PolarHBondContact OD2-NH2 2.79Å; R583-L585 HydrophobicContact CB-CD1 4.44Å; R583-L585 HydrophobicContact CB-CG 4.26Å
584	G	90.8	Very high	88.5	Confident	3 Å²	3	29.3 Å²	29.3	3%	0.031	18%	0.184	C	C	.	.	S	Bend	trans	72.1	29.2	-175.3	0	0	0	0	0	114.3	I569 D581	I569-G584 WeakPolarHBondContact CB-O 3.47Å; I569-G584 PolarHBondContact N-O 2.81Å; D581-G584 PolarHBondContact O-N 3.08Å; D581-G584 WeakPolarHBondContact OD1-CA 3.46Å; D581-G584 PolarHBondContact OD1-N 3.21Å
585	L	95.3	Very high	88.5	Confident	30 Å²	30	29.9 Å²	29.9	16%	0.157	18%	0.182	C	C	.	.			trans	-108.8	-31.3	179	-62	-179.6	0	0	0	111.9	W567 D581 R583 L726 F727 F729	W567-L585 WeakPolarHBondContact O-CD2 3.37Å; D581-L585 PolarHBondContact OD1-N 2.97Å; R583-L585 HydrophobicContact CB-CD1 4.44Å; R583-L585 HydrophobicContact CB-CG 4.26Å; L585-L726 HydrophobicContact CB-CD1 3.99Å; L585-L726 CarbonylContact O-C 3.56Å; L585-L726 WeakPolarHBondContact O-CA 3.11Å; L585-F727 HydrophobicContact CD2-CB 4.39Å; L585-F727 PolarHBondContact O-N 3.08Å; L585-F729 HydrophobicContact CD2-CD2 3.68Å; L585-F729 HydrophobicContact CD2-CE2 3.66Å
586	D	95.6	Very high	88.7	Confident	10 Å²	10	29.9 Å²	29.9	5%	0.053	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	117.8	-178.2	-172.3	-20.3	0	0	0	110	I580 D581 R724 L726	I580-D586 CarbonylContact C-O 3.56Å; I580-D586 VanDerWaalsContact CA-O 3.31Å; I580-D586 WeakPolarHBondContact CA-O 3.36Å; D581-D586 HydrophobicContact CB-CB 3.91Å; D581-D586 PolarHBondContact N-O 3.08Å; D581-D586 PolarHBondContact OD1-N 3.29Å; D586-R724 WeakPolarHBondContact OD1-CG 3.31Å; D586-R724 IonicContact OD1-CZ 3.69Å; D586-R724 IonicContact OD1-NE 3.64Å; D586-R724 PolarHBondContact OD1-NE 3.36Å; D586-R724 IonicContact OD1-NH2 3.87Å; D586-R724 IonicContact OD2-CZ 2.95Å; D586-R724 IonicContact OD2-NE 2.7Å; D586-R724 PolarHBondContact OD2-NE 2.88Å; D586-R724 IonicContact OD2-NH2 3.88Å; D586-R724 PolarHBondContact OD2-NH2 2.9Å; D586-L726 HydrophobicContact CB-CD1 3.98Å
587	V	96.5	Very high	89.4	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	122.7	-171.4	-173.9	0	0	0	0	110.5	I569 L578 G579 I580 L720 R724 I725 F727	I569-V587 HydrophobicContact CB-CG2 4.09Å; I569-V587 HydrophobicContact CG1-CG2 3.9Å; I569-V587 HydrophobicContact CG2-CG2 4.19Å; L578-V587 HydrophobicContact CB-CG1 4.37Å; L578-V587 HydrophobicContact CD1-CG1 3.96Å; L578-V587 HydrophobicContact CD2-CG1 4.05Å; L578-V587 HydrophobicContact CG-CG1 4.35Å; G579-V587 CarbonylContact O-C 3.47Å; G579-V587 WeakPolarHBondContact O-CA 3.05Å; I580-V587 HydrophobicContact CG1-CG1 4.2Å; I580-V587 HydrophobicContact CG1-CG2 4.25Å; I580-V587 HydrophobicContact CG2-CG2 4.44Å; V587-L720 HydrophobicContact CB-CD1 4.21Å; V587-L720 HydrophobicContact CG1-CD1 3.82Å; V587-L720 VanDerWaalsContact O-CD1 3.24Å; V587-L720 WeakPolarHBondContact O-CD1 3.35Å; V587-R724 CarbonylContact O-C 3.53Å; V587-R724 VanDerWaalsContact O-CA 3.24Å; V587-R724 WeakPolarHBondContact O-CA 3.41Å; V587-R724 WeakPolarHBondContact O-CG 3.35Å; V587-I725 HydrophobicContact CB-CG1 4.4Å; V587-I725 PolarHBondContact N-O 2.93Å; V587-I725 PolarHBondContact O-N 3.19Å; V587-F727 HydrophobicContact CB-CE2 4.45Å; V587-F727 HydrophobicContact CG2-CD2 4.05Å; V587-F727 HydrophobicContact CG2-CE2 3.9Å
588	A	95.6	Very high	89.9	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.008	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	133.2	179.5	0	0	0	0	0	111.9	Q487 L578 G579 R724	Q487-A588 PolarHBondContact NE2-O 3.08Å; L578-A588 CarbonylContact C-O 3.5Å; L578-A588 WeakPolarHBondContact CA-O 3.44Å; G579-A588 PolarHBondContact N-O 2.8Å; G579-A588 PolarHBondContact O-N 3.45Å; A588-R724 HydrophobicContact CB-CB 3.91Å; A588-R724 HydrophobicContact CB-CG 3.74Å
589	S	93.4	Very high	90.4	Very high	4 Å²	4	26.8 Å²	26.8	3%	0.028	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	148.2	170.7	53.9	0	0	0	0	112.8	G577 R591 D722 S723	G577-S589 CarbonylContact O-C 3.49Å; S589-R591 PolarHBondContact O-N 3.49Å; S589-D722 PolarHBondContact OG-N 3.26Å; S589-S723 PolarHBondContact N-O 2.97Å; S589-S723 PolarHBondContact OG-N 3.11Å; S589-S723 PolarHBondContact OG-O 2.82Å
590	T	84.9	Confident	90.9	Very high	27 Å²	27	26.8 Å²	26.8	17%	0.166	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-73.4	132.1	177.8	-32.9	0	0	0	0	106.2	Q487 G577 G592 A593	Q487-T590 VanDerWaalsContact CD-CA 3.42Å; Q487-T590 VanDerWaalsContact NE2-CA 3.27Å; Q487-T590 PolarHBondContact NE2-OG1 2.85Å; Q487-T590 VanDerWaalsContact NE2-OG1 3.16Å; Q487-T590 PolarHBondContact OE1-OG1 2.88Å; G577-T590 VanDerWaalsContact CA-OG1 3.3Å; G577-T590 WeakPolarHBondContact CA-OG1 3.22Å; G577-T590 PolarHBondContact O-N 2.84Å; G577-T590 PolarHBondContact O-OG1 3.01Å; T590-G592 PolarHBondContact O-N 2.91Å; T590-A593 WeakPolarHBondContact O-CB 3.14Å; T590-A593 PolarHBondContact O-N 3.45Å
591	R	83	Confident	91.1	Very high	59 Å²	59	25.3 Å²	25.3	22%	0.223	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	139.5	174.8	-70	-157.3	-157	165.1	-5.3	112	K319 V484 S589 A593 D722	K319-R591 PolarHBondContact NZ-O 3.21Å; V484-R591 HydrophobicContact CB-CB 3.89Å; V484-R591 HydrophobicContact CB-CG 3.63Å; V484-R591 HydrophobicContact CG1-CG 4.29Å; V484-R591 HydrophobicContact CG2-CB 3.94Å; V484-R591 HydrophobicContact CG2-CG 3.73Å; S589-R591 PolarHBondContact O-N 3.49Å; R591-A593 PolarHBondContact O-N 2.78Å; R591-D722 WeakPolarHBondContact CA-OD1 3.45Å; R591-D722 HydrophobicContact CG-CB 4.2Å
592	G	82	Confident	91.3	Very high	46 Å²	46	25.8 Å²	25.8	47%	0.474	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	13.5	-173.9	0	0	0	0	0	115.2	K319 T590 G594 D722	K319-G592 WeakPolarHBondContact CD-O 3.32Å; K319-G592 VanDerWaalsContact NZ-C 3.32Å; T590-G592 PolarHBondContact O-N 2.91Å; G592-G594 VanDerWaalsContact C-N 3.25Å; G592-D722 PolarHBondContact N-OD1 2.89Å
593	A	81.3	Confident	92	Very high	23 Å²	23	21.8 Å²	21.8	19%	0.19	12%	0.119	C	C	.	.	S	Bend	trans	-74.4	-17.9	175.8	0	0	0	0	0	113.4	T590 R591 Q596	T590-A593 WeakPolarHBondContact O-CB 3.14Å; T590-A593 PolarHBondContact O-N 3.45Å; R591-A593 PolarHBondContact O-N 2.78Å; A593-Q596 HydrophobicContact CB-CG 3.52Å; A593-Q596 PolarHBondContact O-OE1 2.98Å
594	G	88.2	Confident	92.5	Very high	23 Å²	23	15.9 Å²	15.9	24%	0.237	10%	0.097	C	C	.	.			trans	79.5	-158.6	-161.4	0	0	0	0	0	109.9	G592 Q596 K721	G592-G594 VanDerWaalsContact C-N 3.25Å; G594-Q596 PolarHBondContact O-N 2.93Å; G594-K721 WeakPolarHBondContact O-CB 3.14Å
595	W	92.9	Very high	92.5	Very high	42 Å²	42	18.3 Å²	18.3	16%	0.159	11%	0.106	C	C	.	.			trans	-72.3	125.3	178.9	-70.7	111.3	0	0	0	110.8	L621 R623 E634 S719 K721	W595-L621 HydrophobicContact CH2-CB 3.42Å; W595-L621 VanDerWaalsContact CH2-CB 3.42Å; W595-L621 HydrophobicContact CZ2-CB 3.79Å; W595-L621 HydrophobicContact CZ2-CD1 4.1Å; W595-L621 HydrophobicContact CZ3-CB 4.08Å; W595-L621 WeakPolarHBondContact CZ3-O 3.49Å; W595-R623 HydrophobicContact CH2-CG 3.8Å; W595-R623 HydrophobicContact CZ3-CG 3.88Å; W595-E634 HydrophobicContact CB-CG 3.93Å; W595-E634 HydrophobicContact CG-CG 4.31Å; W595-S719 VanDerWaalsContact CZ3-O 3.32Å; W595-S719 WeakPolarHBondContact CZ3-O 3.5Å; W595-K721 HydrophobicContact CD2-CB 3.84Å; W595-K721 HydrophobicContact CD2-CD 4.44Å; W595-K721 HydrophobicContact CE3-CB 3.77Å; W595-K721 HydrophobicContact CG-CB 4.34Å; W595-K721 HydrophobicContact CG-CD 4.5Å; W595-K721 HydrophobicContact CZ3-CB 4.17Å
596	Q	95.8	Very high	91.9	Very high	24 Å²	24	18.3 Å²	18.3	11%	0.112	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	119.9	178.8	-62.8	-58.9	130.9	0	0	108.3	T575 G577 L578 A593 G594 S719 L720	T575-Q596 VanDerWaalsContact OG1-C 3.31Å; T575-Q596 WeakPolarHBondContact OG1-CA 3.22Å; T575-Q596 VanDerWaalsContact OG1-CB 3.3Å; T575-Q596 WeakPolarHBondContact OG1-CB 3.48Å; T575-Q596 PolarHBondContact OG1-NE2 3.02Å; G577-Q596 VanDerWaalsContact CA-NE2 3.25Å; L578-Q596 HydrophobicContact CD2-CB 3.43Å; L578-Q596 VanDerWaalsContact CD2-CB 3.43Å; L578-Q596 HydrophobicContact CG-CB 3.79Å; A593-Q596 HydrophobicContact CB-CG 3.52Å; A593-Q596 PolarHBondContact O-OE1 2.98Å; G594-Q596 PolarHBondContact O-N 2.93Å; Q596-S719 CarbonylContact O-C 3.55Å; Q596-S719 WeakPolarHBondContact O-CA 3.27Å; Q596-L720 PolarHBondContact N-O 2.98Å; Q596-L720 PolarHBondContact O-N 2.8Å
597	G	96.5	Very high	91.6	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.01	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	165.4	-176.6	0	0	0	0	0	115.8	C574 T575 L578 L633 A718	C574-G597 CarbonylContact C-O 3.6Å; C574-G597 WeakPolarHBondContact CA-O 3.29Å; T575-G597 PolarHBondContact N-O 2.78Å; T575-G597 PolarHBondContact OG1-N 2.91Å; T575-G597 PolarHBondContact OG1-O 3.04Å; L578-G597 VanDerWaalsContact CD1-C 3.47Å; L578-G597 VanDerWaalsContact CD1-O 3.26Å; L578-G597 WeakPolarHBondContact CD1-O 3.39Å; G597-L633 WeakPolarHBondContact CA-O 3.36Å; G597-A718 CarbonylContact C-O 3.46Å; G597-A718 WeakPolarHBondContact CA-O 3.16Å
598	C	97.3	Very high	91.2	Very high	2 Å²	2	22 Å²	22	1%	0.014	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	158.2	-177.5	57.9	0	0	0	0	111.6	I569 D573 C574 L578 A717 A718	I569-C598 HydrophobicContact CG2-CB 3.48Å; I569-C598 VanDerWaalsContact CG2-CB 3.48Å; I569-C598 VanDerWaalsContact CG2-SG 3.58Å; D573-C598 WeakPolarHBondContact O-CA 3.45Å; C574-C598 HydrophobicContact CB-CB 3.64Å; L578-C598 HydrophobicContact CD1-CB 3.52Å; C598-A717 VanDerWaalsContact O-CA 3.31Å; C598-A717 WeakPolarHBondContact O-CA 3.28Å; C598-A718 PolarHBondContact N-O 3.29Å; C598-A718 PolarHBondContact O-N 2.73Å
599	R	97.5	Very high	91.2	Very high	11 Å²	11	22.1 Å²	22.1	4%	0.042	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	155.7	170.3	-77.9	180	-75.1	-99.9	1.9	111.8	T570 D573 S627 A631 L633 A717	T570-R599 VanDerWaalsContact CG2-O 3.28Å; T570-R599 WeakPolarHBondContact CG2-O 3.49Å; T570-R599 PolarHBondContact N-O 2.79Å; T570-R599 VanDerWaalsContact N-O 3.13Å; D573-R599 HydrophobicContact CB-CB 4.48Å; D573-R599 VanDerWaalsContact CG-NE 3.34Å; D573-R599 PolarHBondContact O-N 3.33Å; D573-R599 IonicContact OD1-CZ 3.71Å; D573-R599 IonicContact OD1-NE 3.9Å; D573-R599 PolarHBondContact OD1-NE 2.66Å; D573-R599 IonicContact OD1-NH2 3.75Å; D573-R599 PolarHBondContact OD1-NH2 3.45Å; D573-R599 IonicContact OD2-CZ 3.54Å; D573-R599 IonicContact OD2-NE 3.86Å; D573-R599 PolarHBondContact OD2-NE 3.1Å; D573-R599 IonicContact OD2-NH2 3.98Å; D573-R599 PolarHBondContact OD2-NH2 3.2Å; R599-S627 WeakPolarHBondContact CD-OG 3.41Å; R599-S627 VanDerWaalsContact CG-OG 3.29Å; R599-S627 WeakPolarHBondContact CG-OG 3.24Å; R599-A631 PolarHBondContact NH1-O 3.17Å; R599-L633 HydrophobicContact CG-CD2 4.45Å; R599-L633 VanDerWaalsContact CZ-CD2 3.42Å; R599-A717 HydrophobicContact CG-CB 3.94Å
600	A	97.3	Very high	91.4	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	159.6	169	0	0	0	0	0	112	R568 I569 K602 L715 P716 F729 N757	R568-A600 CarbonylContact O-C 3.49Å; R568-A600 VanDerWaalsContact O-CA 3.27Å; R568-A600 WeakPolarHBondContact O-CA 3.46Å; I569-A600 HydrophobicContact CD1-CB 4.19Å; A600-K602 WeakPolarHBondContact CB-O 3.44Å; A600-K602 PolarHBondContact O-N 2.82Å; A600-L715 WeakPolarHBondContact O-CD2 3.12Å; A600-P716 HydrophobicContact CB-CB 3.97Å; A600-P716 HydrophobicContact CB-CG 4.18Å; A600-P716 PolarHBondContact N-O 2.9Å; A600-F729 HydrophobicContact CB-CZ 4.38Å; A600-N757 PolarHBondContact O-ND2 3.3Å
601	N	93.4	Very high	92.1	Very high	9 Å²	9	20.9 Å²	20.9	5%	0.048	13%	0.131	C	C	.	.	S	Bend	trans	-69.7	-18.4	174.4	65.1	-29.3	0	0	0	113.3	E565 H566 R568 N757	E565-N601 WeakPolarHBondContact CG-ND2 3.5Å; E565-N601 PolarHBondContact OE1-ND2 2.87Å; H566-N601 PolarHBondContact O-ND2 2.84Å; R568-N601 HydrophobicContact CG-CB 4.47Å; R568-N601 PolarHBondContact N-OD1 2.89Å; R568-N601 PolarHBondContact NH1-ND2 3.43Å; R568-N601 VanDerWaalsContact NH1-ND2 3.12Å; R568-N601 PolarHBondContact O-N 3.25Å; R568-N601 PolarHBondContact O-OD1 3.19Å; N601-N757 WeakPolarHBondContact O-CB 3.5Å; N601-N757 PolarHBondContact O-N 3.35Å
602	K	92.8	Very high	92.8	Very high	18 Å²	18	18.1 Å²	18.1	8%	0.078	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	159.4	-179.7	-64.1	177.7	-66.4	178.5	0	110.3	E565 W567 A600 V755	E565-K602 PolarHBondContact O-NZ 3.19Å; W567-K602 HydrophobicContact CD2-CB 4.35Å; W567-K602 HydrophobicContact CE3-CB 4.15Å; W567-K602 HydrophobicContact CH2-CB 3.85Å; W567-K602 HydrophobicContact CZ2-CB 4.07Å; W567-K602 HydrophobicContact CZ3-CB 3.89Å; W567-K602 WeakPolarHBondContact CZ3-O 3.34Å; A600-K602 WeakPolarHBondContact CB-O 3.44Å; A600-K602 PolarHBondContact O-N 2.82Å; K602-V755 CarbonylContact C-O 3.41Å; K602-V755 WeakPolarHBondContact CA-O 3.4Å
603	G	95.6	Very high	93.6	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	-175.7	172.1	0	0	0	0	0	111.2	F714 Q754 V755	G603-F714 CarbonylContact C-O 3.5Å; G603-F714 WeakPolarHBondContact CA-O 3.39Å; G603-Q754 WeakPolarHBondContact O-CA 3.47Å; G603-V755 PolarHBondContact N-O 3.23Å; G603-V755 PolarHBondContact O-N 2.97Å
604	V	96.6	Very high	94.4	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	150.6	-179.3	-65.7	0	0	0	0	109.9	W567 Y610 W626 L683 A713 F714 V746 S753	W567-V604 HydrophobicContact CH2-CG1 4.04Å; V604-Y610 HydrophobicContact CB-CD1 4.16Å; V604-Y610 HydrophobicContact CB-CD2 3.72Å; V604-Y610 HydrophobicContact CB-CE1 4.18Å; V604-Y610 HydrophobicContact CB-CE2 3.73Å; V604-Y610 HydrophobicContact CB-CG 3.92Å; V604-Y610 HydrophobicContact CG1-CD1 3.8Å; V604-Y610 HydrophobicContact CG1-CD2 4.27Å; V604-Y610 HydrophobicContact CG1-CE1 3.96Å; V604-Y610 HydrophobicContact CG1-CE2 4.4Å; V604-Y610 HydrophobicContact CG1-CG 3.95Å; V604-Y610 HydrophobicContact CG2-CD1 4.38Å; V604-Y610 HydrophobicContact CG2-CD2 3.43Å; V604-Y610 VanDerWaalsContact CG2-CD2 3.43Å; V604-Y610 HydrophobicContact CG2-CE2 3.93Å; V604-Y610 HydrophobicContact CG2-CG 3.68Å; V604-W626 HydrophobicContact CG2-CH2 4.29Å; V604-W626 HydrophobicContact CG2-CZ3 3.9Å; V604-L683 HydrophobicContact CG2-CD2 3.8Å; V604-A713 WeakPolarHBondContact O-CA 3.44Å; V604-F714 PolarHBondContact N-O 2.74Å; V604-F714 PolarHBondContact O-N 3.02Å; V604-V746 HydrophobicContact CG1-CB 4.38Å; V604-V746 HydrophobicContact CG1-CG1 4.21Å; V604-S753 WeakPolarHBondContact CA-O 3.34Å
605	K	92	Very high	94.9	Very high	54 Å²	54	14.7 Å²	14.7	24%	0.235	8%	0.083	C	C	.	.			trans	-132.4	167.9	173	65	174.2	178.8	-170.2	0	110	Y610 A713 D752 S753 V755	K605-Y610 PolarHBondContact O-OH 2.88Å; K605-A713 HydrophobicContact CB-CB 4.36Å; K605-D752 WeakPolarHBondContact CE-O 3.28Å; K605-D752 PolarHBondContact NZ-O 2.96Å; K605-S753 WeakPolarHBondContact CG-O 3.34Å; K605-S753 PolarHBondContact N-O 3.28Å; K605-V755 HydrophobicContact CB-CG2 4.07Å; K605-V755 HydrophobicContact CD-CG2 3.62Å; K605-V755 HydrophobicContact CG-CG2 3.74Å
606	A	82.4	Confident	95.1	Very high	31 Å²	31	12.8 Å²	12.8	26%	0.256	8%	0.076	S	C	.	.	S	Bend	trans	-64.9	152.6	-178.7	0	0	0	0	0	111.9	L685	A606-L685 HydrophobicContact CB-CB 3.93Å; A606-L685 HydrophobicContact CB-CD1 4.26Å
607	P	87.6	Confident	95.1	Very high	73 Å²	73	13.8 Å²	13.8	47%	0.474	8%	0.082	S	C	.	.	S	Bend	cis	-80.7	163.3	-3.7	34.9	-35.7	0	0	0	112.5	Y610 D686	P607-Y610 PolarHBondContact O-OH 2.91Å; P607-D686 VanDerWaalsContact CA-OD1 3.29Å; P607-D686 WeakPolarHBondContact CA-OD1 3.43Å; P607-D686 WeakPolarHBondContact CB-OD1 3.36Å
608	G	89.7	Confident	94.9	Very high	13 Å²	13	15.6 Å²	15.6	13%	0.134	9%	0.09	C	C	.	.			trans	137.9	164.8	170.2	0	0	0	0	0	115	L685 D686	G608-L685 WeakPolarHBondContact O-CB 3.36Å; G608-L685 PolarHBondContact O-N 3.05Å; G608-D686 VanDerWaalsContact CA-OD2 3.23Å; G608-D686 WeakPolarHBondContact CA-OD2 3.39Å; G608-D686 PolarHBondContact N-OD1 3.03Å; G608-D686 PolarHBondContact N-OD2 2.87Å; G608-D686 VanDerWaalsContact N-OD2 3.15Å; G608-D686 PolarHBondContact O-N 3.21Å
609	A	95	Very high	94.5	Very high	4 Å²	4	19.3 Å²	19.3	3%	0.033	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.7	170.7	0	0	0	0	0	109.6	L683 D684 P742 F743 I744	A609-L683 CarbonylContact C-O 3.57Å; A609-L683 WeakPolarHBondContact CA-O 3.37Å; A609-D684 HydrophobicContact CB-CB 4.37Å; A609-P742 HydrophobicContact CB-CB 4.5Å; A609-P742 HydrophobicContact CB-CG 4.16Å; A609-F743 HydrophobicContact CB-CD1 3.69Å; A609-F743 HydrophobicContact CB-CE1 3.85Å; A609-F743 HydrophobicContact CB-CG 4.15Å; A609-F743 HydrophobicContact CB-CZ 4.44Å; A609-F743 WeakPolarHBondContact O-CA 3.28Å; A609-I744 PolarHBondContact O-N 2.75Å
610	Y	98.2	Very high	94.1	Very high	4 Å²	4	19.5 Å²	19.5	2%	0.016	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	150.7	-167.7	-56.8	-74.9	0	0	0	112.3	V604 K605 P607 L683 L685 I744 S753	V604-Y610 HydrophobicContact CB-CD1 4.16Å; V604-Y610 HydrophobicContact CB-CD2 3.72Å; V604-Y610 HydrophobicContact CB-CE1 4.18Å; V604-Y610 HydrophobicContact CB-CE2 3.73Å; V604-Y610 HydrophobicContact CB-CG 3.92Å; V604-Y610 HydrophobicContact CG1-CD1 3.8Å; V604-Y610 HydrophobicContact CG1-CD2 4.27Å; V604-Y610 HydrophobicContact CG1-CE1 3.96Å; V604-Y610 HydrophobicContact CG1-CE2 4.4Å; V604-Y610 HydrophobicContact CG1-CG 3.95Å; V604-Y610 HydrophobicContact CG2-CD1 4.38Å; V604-Y610 HydrophobicContact CG2-CD2 3.43Å; V604-Y610 VanDerWaalsContact CG2-CD2 3.43Å; V604-Y610 HydrophobicContact CG2-CE2 3.93Å; V604-Y610 HydrophobicContact CG2-CG 3.68Å; K605-Y610 PolarHBondContact O-OH 2.88Å; P607-Y610 PolarHBondContact O-OH 2.91Å; Y610-L683 PolarHBondContact N-O 2.92Å; Y610-L683 PolarHBondContact O-N 3.15Å; Y610-L685 HydrophobicContact CD2-CD1 4.2Å; Y610-L685 HydrophobicContact CD2-CG 4.49Å; Y610-L685 HydrophobicContact CE2-CD1 3.91Å; Y610-L685 HydrophobicContact CE2-CG 4.48Å; Y610-I744 CarbonylContact C-O 3.51Å; Y610-I744 WeakPolarHBondContact CA-O 3.48Å; Y610-I744 HydrophobicContact CD1-CD1 4.33Å; Y610-I744 HydrophobicContact CD1-CG1 3.94Å; Y610-I744 HydrophobicContact CE1-CD1 4.08Å; Y610-I744 HydrophobicContact CE1-CG1 4.18Å; Y610-S753 WeakPolarHBondContact OH-CB 3.14Å; Y610-S753 PolarHBondContact OH-OG 3.23Å
611	Y	98.6	Very high	93.8	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.008	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	147.1	-176.7	-178.4	-102.2	0	0	0	112.3	E613 G680 C681 L682 L735 F737 P739 I744 P745 V746	Y611-E613 HydrophobicContact CE1-CG 3.58Å; Y611-E613 WeakPolarHBondContact CE1-OE1 3.48Å; Y611-E613 VanDerWaalsContact OH-CG 3.27Å; Y611-E613 WeakPolarHBondContact OH-CG 3.38Å; Y611-E613 PolarHBondContact OH-OE1 3.25Å; Y611-G680 VanDerWaalsContact OH-CA 3.26Å; Y611-G680 WeakPolarHBondContact OH-CA 3.48Å; Y611-C681 WeakPolarHBondContact CA-O 3.44Å; Y611-C681 WeakPolarHBondContact CD2-O 3.5Å; Y611-L682 HydrophobicContact CD2-CD1 4.02Å; Y611-L682 HydrophobicContact CD2-CG 3.77Å; Y611-L682 HydrophobicContact CE2-CD1 3.84Å; Y611-L682 HydrophobicContact CE2-CG 4.08Å; Y611-L735 HydrophobicContact CD1-CD1 3.51Å; Y611-L735 HydrophobicContact CD1-CD2 4.29Å; Y611-L735 HydrophobicContact CD1-CG 4.48Å; Y611-L735 HydrophobicContact CE1-CD1 3.79Å; Y611-L735 HydrophobicContact CE1-CD2 4.17Å; Y611-L735 HydrophobicContact CE1-CG 4.41Å; Y611-F737 PolarHBondContact OH-O 3.15Å; Y611-P739 HydrophobicContact CD1-CG 4.15Å; Y611-P739 HydrophobicContact CD2-CG 3.83Å; Y611-P739 HydrophobicContact CE1-CG 4.43Å; Y611-P739 HydrophobicContact CE2-CG 4.11Å; Y611-P739 HydrophobicContact CG-CG 3.8Å; Y611-I744 PolarHBondContact N-O 3.13Å; Y611-P745 CarbonylContact O-C 3.59Å; Y611-P745 VanDerWaalsContact O-CA 3.29Å; Y611-P745 WeakPolarHBondContact O-CA 3.3Å; Y611-V746 PolarHBondContact O-N 2.96Å
612	Y	98.7	Very high	93.9	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	166.8	165.4	76.4	-88.9	0	0	0	109.8	V624 G625 W626 C681 P716 A717 F727 F729 V746	Y612-V624 HydrophobicContact CE2-CG1 3.97Å; Y612-V624 WeakPolarHBondContact OH-CG1 3.27Å; Y612-G625 PolarHBondContact OH-N 2.91Å; Y612-G625 PolarHBondContact OH-O 3.11Å; Y612-W626 AromaticContact CD1-CH2 3.7Å; Y612-W626 HydrophobicContact CD1-CH2 3.7Å; Y612-W626 AromaticContact CD1-CZ2 3.65Å; Y612-W626 HydrophobicContact CD1-CZ2 3.65Å; Y612-W626 HydrophobicContact CD1-CZ3 4.31Å; Y612-W626 HydrophobicContact CE1-CD2 4.21Å; Y612-W626 AromaticContact CE1-CE2 3.85Å; Y612-W626 HydrophobicContact CE1-CE3 4.34Å; Y612-W626 AromaticContact CE1-CH2 3.94Å; Y612-W626 HydrophobicContact CE1-CH2 3.94Å; Y612-W626 AromaticContact CE1-CZ2 3.72Å; Y612-W626 HydrophobicContact CE1-CZ2 3.72Å; Y612-W626 HydrophobicContact CE1-CZ3 4.22Å; Y612-C681 HydrophobicContact CD1-CB 3.79Å; Y612-C681 HydrophobicContact CE1-CB 3.39Å; Y612-C681 HydrophobicContact CE2-CB 4.23Å; Y612-C681 HydrophobicContact CG-CB 4.37Å; Y612-C681 VanDerWaalsContact CZ-SG 3.58Å; Y612-C681 PolarHBondContact N-O 2.81Å; Y612-C681 PolarHBondContact O-N 2.86Å; Y612-P716 HydrophobicContact CD1-CB 4Å; Y612-P716 HydrophobicContact CD1-CG 3.91Å; Y612-P716 HydrophobicContact CE1-CB 3.55Å; Y612-P716 HydrophobicContact CE1-CG 3.86Å; Y612-P716 HydrophobicContact CE2-CB 4.15Å; Y612-P716 HydrophobicContact CG-CB 4.45Å; Y612-P716 HydrophobicContact CG-CG 4.48Å; Y612-A717 PolarHBondContact OH-O 2.71Å; Y612-F727 HydrophobicContact CD2-CD1 4.09Å; Y612-F727 AromaticContact CE2-CD1 3.7Å; Y612-F727 HydrophobicContact CE2-CD1 3.7Å; Y612-F727 AromaticContact CE2-CE1 3.72Å; Y612-F727 HydrophobicContact CE2-CE1 3.72Å; Y612-F729 HydrophobicContact CD2-CD1 4.18Å; Y612-F729 HydrophobicContact CD2-CE1 4.03Å; Y612-F729 HydrophobicContact CE2-CE1 4.48Å; Y612-F729 HydrophobicContact CG-CD1 4.14Å; Y612-F729 HydrophobicContact CG-CE1 4.3Å; Y612-V746 HydrophobicContact CD1-CG1 4.48Å
613	E	98.7	Very high	94	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	153.7	-179.9	-75.8	169.7	178.8	0	0	112.8	Y611 V678 I679 N728 L735 E736 F737	Y611-E613 HydrophobicContact CE1-CG 3.58Å; Y611-E613 WeakPolarHBondContact CE1-OE1 3.48Å; Y611-E613 VanDerWaalsContact OH-CG 3.27Å; Y611-E613 WeakPolarHBondContact OH-CG 3.38Å; Y611-E613 PolarHBondContact OH-OE1 3.25Å; E613-V678 HydrophobicContact CB-CG1 3.91Å; E613-V678 HydrophobicContact CG-CG1 3.88Å; E613-I679 CarbonylContact C-O 3.52Å; E613-I679 VanDerWaalsContact CA-O 3.23Å; E613-I679 WeakPolarHBondContact CA-O 3.49Å; E613-N728 HydrophobicContact CB-CB 4.13Å; E613-N728 PolarHBondContact N-O 2.95Å; E613-N728 PolarHBondContact O-N 3.45Å; E613-L735 HydrophobicContact CB-CD2 4.24Å; E613-L735 HydrophobicContact CG-CD2 4.04Å; E613-L735 WeakPolarHBondContact OE2-CA 3.29Å; E613-E736 PolarHBondContact OE1-N 2.95Å; E613-E736 PolarHBondContact OE2-N 3.33Å; E613-F737 VanDerWaalsContact OE1-CA 3.3Å; E613-F737 WeakPolarHBondContact OE1-CA 3.04Å; E613-F737 PolarHBondContact OE1-N 2.9Å
614	A	98.5	Very high	94.2	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.008	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	127	166.1	0	0	0	0	0	110.2	V624 I679 I725 L726 F727	A614-V624 HydrophobicContact CB-CG1 3.76Å; A614-V624 HydrophobicContact CB-CG2 4.21Å; A614-I679 PolarHBondContact N-O 2.95Å; A614-I679 PolarHBondContact O-N 3.44Å; A614-I725 HydrophobicContact CB-CD1 4.25Å; A614-L726 CarbonylContact C-O 3.5Å; A614-L726 VanDerWaalsContact CA-O 3.28Å; A614-L726 WeakPolarHBondContact CA-O 3.32Å; A614-F727 HydrophobicContact CB-CD1 4.44Å
615	V	98.1	Very high	94.3	Very high	18 Å²	18	20.3 Å²	20.3	11%	0.109	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	129.7	177.2	-170.4	0	0	0	0	109.3	L617 D677 V678 I725 L726	V615-L617 HydrophobicContact CB-CD2 4.4Å; V615-L617 HydrophobicContact CG1-CD2 4.1Å; V615-L617 PolarHBondContact O-N 2.75Å; V615-D677 CarbonylContact C-O 3.51Å; V615-D677 WeakPolarHBondContact CA-O 3.46Å; V615-V678 HydrophobicContact CG1-CG2 4.33Å; V615-V678 HydrophobicContact CG2-CG1 4.41Å; V615-V678 HydrophobicContact CG2-CG2 4.05Å; V615-I725 CarbonylContact O-C 3.38Å; V615-I725 WeakPolarHBondContact O-CA 3.26Å; V615-I725 WeakPolarHBondContact O-CB 3.23Å; V615-L726 HydrophobicContact CB-CB 4.28Å; V615-L726 PolarHBondContact N-O 2.85Å; V615-L726 PolarHBondContact O-N 3.39Å
616	C	96.6	Very high	94.6	Very high	2 Å²	2	17.8 Å²	17.8	1%	0.014	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	107.4	171.4	-171.9	0	0	0	0	109.8	I622 V673 H674 G676 D677	C616-I622 HydrophobicContact CB-CD1 4.11Å; C616-V673 HydrophobicContact CB-CG1 4.2Å; C616-H674 WeakPolarHBondContact CB-O 3.29Å; C616-G676 PolarHBondContact O-N 3.49Å; C616-D677 PolarHBondContact N-O 2.83Å
617	L	96	Very high	95.3	Very high	46 Å²	46	16.3 Å²	16.3	24%	0.241	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-30.2	-176.4	-64.8	-174.3	0	0	0	113.4	V615 Q675 R724 L726	V615-L617 HydrophobicContact CB-CD2 4.4Å; V615-L617 HydrophobicContact CG1-CD2 4.1Å; V615-L617 PolarHBondContact O-N 2.75Å; L617-Q675 WeakPolarHBondContact O-CG 3.31Å; L617-Q675 PolarHBondContact O-NE2 2.86Å; L617-R724 HydrophobicContact CB-CB 4.34Å; L617-R724 HydrophobicContact CB-CG 4.05Å; L617-R724 HydrophobicContact CD1-CG 4.13Å; L617-R724 PolarHBondContact N-O 3.04Å; L617-L726 HydrophobicContact CD1-CB 3.81Å; L617-L726 HydrophobicContact CD2-CB 4.19Å; L617-L726 HydrophobicContact CG-CB 4Å
618	E	92.8	Very high	95.7	Very high	39 Å²	39	12.9 Å²	12.9	18%	0.182	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	135.9	177.6	-67.2	179.9	-153.6	0	0	110.5	G620 S723 R724	E618-G620 PolarHBondContact O-N 3.41Å; E618-S723 PolarHBondContact O-OG 2.94Å; E618-R724 HydrophobicContact CB-CB 3.92Å; E618-R724 HydrophobicContact CG-CB 3.95Å; E618-R724 PolarHBondContact N-O 2.88Å; E618-R724 WeakPolarHBondContact OE1-CD 3.23Å; E618-R724 IonicContact OE1-NH1 2.71Å; E618-R724 PolarHBondContact OE1-NH1 2.71Å
619	E	88	Confident	95.7	Very high	80 Å²	80	12.9 Å²	12.9	37%	0.374	7%	0.068	S	C	.	.	S	Bend	trans	-58.2	133.2	177.9	-167.7	71.8	-168.3	0	0	111.2	H674 Q675	E619-H674 IonicContact OE1-ND1 3.76Å; E619-H674 PolarHBondContact OE1-ND1 3.06Å; E619-H674 VanDerWaalsContact OE1-ND1 3.12Å; E619-H674 WeakPolarHBondContact OE2-CA 3.39Å; E619-H674 IonicContact OE2-ND1 2.86Å; E619-Q675 HydrophobicContact CB-CB 4.3Å; E619-Q675 PolarHBondContact OE2-N 3.22Å
620	G	88.4	Confident	95.5	Very high	14 Å²	14	17.2 Å²	17.2	14%	0.144	9%	0.091	C	C	.	.	S	Bend	trans	167.9	-162.9	174.3	0	0	0	0	0	110.1	E618 S646	E618-G620 PolarHBondContact O-N 3.41Å; G620-S646 PolarHBondContact O-OG 3.46Å
621	L	91.7	Very high	95.3	Very high	30 Å²	30	17.4 Å²	17.4	16%	0.157	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	128.4	-178.8	-51.6	-177.8	0	0	0	110.2	W595 S646 A648 K721	W595-L621 HydrophobicContact CH2-CB 3.42Å; W595-L621 VanDerWaalsContact CH2-CB 3.42Å; W595-L621 HydrophobicContact CZ2-CB 3.79Å; W595-L621 HydrophobicContact CZ2-CD1 4.1Å; W595-L621 HydrophobicContact CZ3-CB 4.08Å; W595-L621 WeakPolarHBondContact CZ3-O 3.49Å; L621-S646 WeakPolarHBondContact CA-O 3.48Å; L621-S646 WeakPolarHBondContact CA-OG 3.48Å; L621-S646 WeakPolarHBondContact CB-O 3.33Å; L621-A648 HydrophobicContact CD1-CB 3.9Å; L621-K721 HydrophobicContact CB-CB 4.22Å; L621-K721 HydrophobicContact CD1-CD 4.21Å; L621-K721 PolarHBondContact N-O 3.19Å; L621-K721 PolarHBondContact O-N 3.06Å
622	I	95	Very high	95	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	146.2	-179.1	66.8	177.3	0	0	0	111.3	C616 G645 S646 V673 I679 S719 L720 S723 I725	C616-I622 HydrophobicContact CB-CD1 4.11Å; I622-G645 CarbonylContact O-C 3.49Å; I622-G645 WeakPolarHBondContact O-CA 3.48Å; I622-S646 PolarHBondContact N-O 3.36Å; I622-S646 VanDerWaalsContact N-O 3.12Å; I622-S646 PolarHBondContact N-OG 2.96Å; I622-S646 VanDerWaalsContact N-OG 3.08Å; I622-S646 PolarHBondContact O-N 3.39Å; I622-V673 HydrophobicContact CD1-CB 4.46Å; I622-V673 HydrophobicContact CD1-CG1 3.85Å; I622-I679 HydrophobicContact CD1-CD1 3.57Å; I622-I679 HydrophobicContact CG1-CD1 4.3Å; I622-S719 CarbonylContact C-O 3.41Å; I622-L720 HydrophobicContact CB-CD2 3.94Å; I622-L720 HydrophobicContact CG2-CD2 3.57Å; I622-S723 WeakPolarHBondContact CG2-OG 3.42Å; I622-I725 HydrophobicContact CD1-CG2 4.18Å; I622-I725 HydrophobicContact CG2-CG2 4.03Å
623	R	96.4	Very high	94.9	Very high	15 Å²	15	23.2 Å²	23.2	6%	0.057	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	119.9	167.3	-61.7	171.6	-174	164.7	6.1	106.6	W595 E634 L635 Y644 I661 A718 S719	W595-R623 HydrophobicContact CH2-CG 3.8Å; W595-R623 HydrophobicContact CZ3-CG 3.88Å; R623-E634 IonicContact CZ-OE1 2.63Å; R623-E634 IonicContact NH1-OE1 3.1Å; R623-E634 PolarHBondContact NH1-OE1 2.96Å; R623-E634 IonicContact NH2-OE1 3.01Å; R623-L635 HydrophobicContact CB-CB 4.4Å; R623-L635 HydrophobicContact CB-CD2 4.36Å; R623-L635 WeakPolarHBondContact CD-O 3.22Å; R623-Y644 CarbonylContact C-O 3.55Å; R623-Y644 WeakPolarHBondContact CA-O 3.41Å; R623-I661 HydrophobicContact CG-CG2 4.32Å; R623-A718 CarbonylContact O-C 3.52Å; R623-A718 WeakPolarHBondContact O-CA 3.47Å; R623-A718 WeakPolarHBondContact O-CB 3.49Å; R623-S719 PolarHBondContact N-O 2.96Å; R623-S719 PolarHBondContact O-N 3.17Å
624	V	98.4	Very high	94.7	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	141.6	178.1	-170.6	0	0	0	0	108.7	Y612 A614 Y644 I679 W692 A718 I725 F727	Y612-V624 HydrophobicContact CE2-CG1 3.97Å; Y612-V624 WeakPolarHBondContact OH-CG1 3.27Å; A614-V624 HydrophobicContact CB-CG1 3.76Å; A614-V624 HydrophobicContact CB-CG2 4.21Å; V624-Y644 PolarHBondContact N-O 3.01Å; V624-Y644 PolarHBondContact O-N 2.92Å; V624-I679 HydrophobicContact CB-CD1 4.32Å; V624-I679 HydrophobicContact CG2-CD1 3.97Å; V624-W692 PolarHBondContact O-NE1 3.39Å; V624-A718 HydrophobicContact CG2-CB 4.24Å; V624-I725 HydrophobicContact CG2-CD1 4Å; V624-F727 HydrophobicContact CG1-CE1 4.32Å
625	G	98.5	Very high	94.6	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.6	-132.1	-179.9	0	0	0	0	0	113.6	Y612 F642 A717	Y612-G625 PolarHBondContact OH-N 2.91Å; Y612-G625 PolarHBondContact OH-O 3.11Å; G625-F642 WeakPolarHBondContact CA-O 3.46Å; G625-A717 PolarHBondContact N-O 3.49Å; G625-A717 PolarHBondContact O-N 3.42Å
626	W	98.7	Very high	94.4	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	139.9	-165.5	-59.5	98.4	0	0	0	111	V604 Y612 F642 C681 L683 F714 L715 P716 V746	V604-W626 HydrophobicContact CG2-CH2 4.29Å; V604-W626 HydrophobicContact CG2-CZ3 3.9Å; Y612-W626 AromaticContact CD1-CH2 3.7Å; Y612-W626 HydrophobicContact CD1-CH2 3.7Å; Y612-W626 AromaticContact CD1-CZ2 3.65Å; Y612-W626 HydrophobicContact CD1-CZ2 3.65Å; Y612-W626 HydrophobicContact CD1-CZ3 4.31Å; Y612-W626 HydrophobicContact CE1-CD2 4.21Å; Y612-W626 AromaticContact CE1-CE2 3.85Å; Y612-W626 HydrophobicContact CE1-CE3 4.34Å; Y612-W626 AromaticContact CE1-CH2 3.94Å; Y612-W626 HydrophobicContact CE1-CH2 3.94Å; Y612-W626 AromaticContact CE1-CZ2 3.72Å; Y612-W626 HydrophobicContact CE1-CZ2 3.72Å; Y612-W626 HydrophobicContact CE1-CZ3 4.22Å; W626-F642 PolarHBondContact N-O 2.84Å; W626-F642 PolarHBondContact O-N 3.23Å; W626-C681 HydrophobicContact CZ2-CB 4.35Å; W626-C681 WeakPolarHBondContact CZ2-O 3.49Å; W626-L683 HydrophobicContact CD2-CB 3.98Å; W626-L683 HydrophobicContact CD2-CD2 3.88Å; W626-L683 HydrophobicContact CD2-CG 4.41Å; W626-L683 VanDerWaalsContact CE2-CB 3.43Å; W626-L683 HydrophobicContact CE3-CD2 3.75Å; W626-L683 HydrophobicContact CG-CB 4.47Å; W626-L683 HydrophobicContact CG-CD2 4.49Å; W626-L683 HydrophobicContact CH2-CB 4.02Å; W626-L683 HydrophobicContact CH2-CD2 4.09Å; W626-L683 HydrophobicContact CZ2-CB 3.45Å; W626-L683 VanDerWaalsContact CZ2-CB 3.45Å; W626-L683 HydrophobicContact CZ2-CD2 4.27Å; W626-L683 HydrophobicContact CZ3-CD2 3.85Å; W626-F714 HydrophobicContact CB-CB 4.39Å; W626-F714 HydrophobicContact CB-CD1 4.02Å; W626-F714 HydrophobicContact CE3-CB 3.96Å; W626-L715 WeakPolarHBondContact CA-O 3.45Å; W626-P716 HydrophobicContact CE3-CG 4.5Å; W626-P716 HydrophobicContact CZ3-CG 3.97Å; W626-V746 HydrophobicContact CH2-CG1 3.57Å; W626-V746 HydrophobicContact CZ3-CG1 4.14Å
627	S	97.9	Very high	94.1	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.007	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	148.6	175.9	63.5	0	0	0	0	111.2	R599 Y640 L715 A717	R599-S627 WeakPolarHBondContact CD-OG 3.41Å; R599-S627 VanDerWaalsContact CG-OG 3.29Å; R599-S627 WeakPolarHBondContact CG-OG 3.24Å; S627-Y640 WeakPolarHBondContact CA-O 3.47Å; S627-L715 PolarHBondContact N-O 2.75Å; S627-L715 PolarHBondContact O-N 2.9Å; S627-A717 VanDerWaalsContact OG-CB 3.26Å; S627-A717 WeakPolarHBondContact OG-CB 3.18Å
628	T	95.1	Very high	93.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.138	C	C	.	.			trans	-77.8	169.6	162.7	79.4	0	0	0	0	109.7	D630 A631 Y640 L709 E712 F714	T628-D630 PolarHBondContact O-N 3.22Å; T628-D630 PolarHBondContact OG1-N 2.84Å; T628-A631 WeakPolarHBondContact O-CB 3.48Å; T628-A631 PolarHBondContact O-N 3.14Å; T628-Y640 PolarHBondContact N-O 3.31Å; T628-Y640 WeakPolarHBondContact OG1-CB 3.41Å; T628-L709 HydrophobicContact CG2-CD2 4.3Å; T628-E712 HydrophobicContact CG2-CB 3.95Å; T628-E712 HydrophobicContact CG2-CG 4.38Å; T628-F714 HydrophobicContact CG2-CD1 4.39Å; T628-F714 HydrophobicContact CG2-CE1 4.04Å; T628-F714 HydrophobicContact CG2-CZ 4.35Å
629	N	90.7	Very high	93.7	Very high	13 Å²	13	27.3 Å²	27.3	7%	0.07	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-21.7	175.4	-87	113.6	0	0	0	114.4	L715 N757 R758	N629-L715 WeakPolarHBondContact OD1-CD1 3.29Å; N629-N757 PolarHBondContact ND2-OD1 2.84Å; N629-R758 HydrophobicContact CB-CB 4.38Å; N629-R758 HydrophobicContact CB-CG 4.38Å; N629-R758 PolarHBondContact ND2-N 3.4Å
630	D	90.5	Very high	94	Very high	96 Å²	96	27.9 Å²	27.9	51%	0.513	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-2.8	-177.6	-60.7	-37.3	0	0	0	112.8	T628 R758	T628-D630 PolarHBondContact O-N 3.22Å; T628-D630 PolarHBondContact OG1-N 2.84Å; D630-R758 IonicContact OD1-CZ 2.99Å; D630-R758 IonicContact OD1-NH2 3.89Å; D630-R758 PolarHBondContact OD1-NH2 3.17Å; D630-R758 IonicContact OD2-CZ 2.73Å; D630-R758 IonicContact OD2-NH2 3.7Å; D630-R758 PolarHBondContact OD2-NH2 3.15Å
631	A	93.4	Very high	94.3	Very high	7 Å²	7	27.2 Å²	27.2	6%	0.058	14%	0.141	C	C	.	.	S	Bend	trans	-69.6	150.5	177.5	0	0	0	0	0	112.6	R599 T628 D638	R599-A631 PolarHBondContact NH1-O 3.17Å; T628-A631 WeakPolarHBondContact O-CB 3.48Å; T628-A631 PolarHBondContact O-N 3.14Å; A631-D638 VanDerWaalsContact CA-OD2 3.23Å; A631-D638 WeakPolarHBondContact CA-OD2 3.47Å
632	D	93.7	Very high	94.6	Very high	91 Å²	91	25.8 Å²	25.8	49%	0.487	13%	0.133	S	C	.	.			trans	-55	145.1	160.4	-157.9	-41.4	0	0	0	109.4	E634 D638	D632-E634 PolarHBondContact O-N 2.95Å; D632-E634 PolarHBondContact OD1-N 2.8Å; D632-D638 PolarHBondContact N-OD2 2.89Å
633	L	95.3	Very high	94.7	Very high	34 Å²	34	25.8 Å²	25.8	18%	0.178	13%	0.133	C	C	.	.	S	Bend	trans	-68.4	-25	173	-73.3	171.2	0	0	0	111	D573 T575 G597 R599 L635 S719	D573-L633 WeakPolarHBondContact O-CD2 3.37Å; T575-L633 HydrophobicContact CG2-CB 3.78Å; T575-L633 HydrophobicContact CG2-CD1 3.78Å; T575-L633 HydrophobicContact CG2-CG 4.44Å; G597-L633 WeakPolarHBondContact CA-O 3.36Å; R599-L633 HydrophobicContact CG-CD2 4.45Å; R599-L633 VanDerWaalsContact CZ-CD2 3.42Å; L633-L635 PolarHBondContact O-N 3.46Å; L633-S719 PolarHBondContact O-OG 3.13Å
634	E	94.4	Very high	94.7	Very high	58 Å²	58	25.1 Å²	25.1	27%	0.271	13%	0.131	S	C	.	.	S	Bend	trans	-70.2	94.6	165.2	-169.4	175.2	158	0	0	110.3	W595 R623 D632 G636 A637 S719	W595-E634 HydrophobicContact CB-CG 3.93Å; W595-E634 HydrophobicContact CG-CG 4.31Å; R623-E634 IonicContact CZ-OE1 2.63Å; R623-E634 IonicContact NH1-OE1 3.1Å; R623-E634 PolarHBondContact NH1-OE1 2.96Å; R623-E634 IonicContact NH2-OE1 3.01Å; D632-E634 PolarHBondContact O-N 2.95Å; D632-E634 PolarHBondContact OD1-N 2.8Å; E634-G636 PolarHBondContact O-N 3Å; E634-A637 HydrophobicContact CB-CB 4.03Å; E634-A637 HydrophobicContact CG-CB 4.15Å; E634-A637 WeakPolarHBondContact O-CB 3.31Å; E634-A637 PolarHBondContact O-N 3.29Å; E634-S719 WeakPolarHBondContact CA-OG 3.41Å
635	L	97.6	Very high	94.5	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.01	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	121.5	-170.4	-175.3	63.2	0	0	0	111.7	R623 L633 A717 S719	R623-L635 HydrophobicContact CB-CB 4.4Å; R623-L635 HydrophobicContact CB-CD2 4.36Å; R623-L635 WeakPolarHBondContact CD-O 3.22Å; L633-L635 PolarHBondContact O-N 3.46Å; L635-A717 HydrophobicContact CD1-CB 3.96Å; L635-A717 HydrophobicContact CD2-CB 4.38Å; L635-A717 WeakPolarHBondContact CD2-O 3.35Å; L635-S719 PolarHBondContact N-OG 2.86Å
636	G	92.9	Very high	93.8	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	3.2	179.7	0	0	0	0	0	114.9	E634 D638 H662 R663 N664	E634-G636 PolarHBondContact O-N 3Å; G636-D638 PolarHBondContact O-N 3.36Å; G636-H662 CarbonylContact O-C 3.15Å; G636-H662 WeakPolarHBondContact O-CA 3.4Å; G636-R663 PolarHBondContact O-N 2.94Å; G636-R663 VanDerWaalsContact O-N 3.1Å; G636-N664 WeakPolarHBondContact O-CA 3.09Å; G636-N664 PolarHBondContact O-N 3.29Å
637	A	91.6	Very high	92.4	Very high	27 Å²	27	26.6 Å²	26.6	22%	0.223	14%	0.14	C	C	.	.	S	Bend	trans	-71	-12.4	175.5	0	0	0	0	0	113.6	E634 N664	E634-A637 HydrophobicContact CB-CB 4.03Å; E634-A637 HydrophobicContact CG-CB 4.15Å; E634-A637 WeakPolarHBondContact O-CB 3.31Å; E634-A637 PolarHBondContact O-N 3.29Å; A637-N664 WeakPolarHBondContact O-CB 3.37Å
638	D	90.3	Very high	90.8	Very high	33 Å²	33	29.6 Å²	29.6	18%	0.176	16%	0.164	C	C	.	.	S	Bend	trans	-138.2	-168.2	-175.9	70.9	7.6	0	0	0	113.1	A631 D632 G636 Y640 G641 H662 R663	A631-D638 VanDerWaalsContact CA-OD2 3.23Å; A631-D638 WeakPolarHBondContact CA-OD2 3.47Å; D632-D638 PolarHBondContact N-OD2 2.89Å; G636-D638 PolarHBondContact O-N 3.36Å; D638-Y640 VanDerWaalsContact C-N 3.25Å; D638-Y640 PolarHBondContact O-N 2.92Å; D638-Y640 PolarHBondContact OD1-N 3.03Å; D638-G641 PolarHBondContact OD1-N 3.32Å; D638-H662 PolarHBondContact O-ND1 3.45Å; D638-R663 VanDerWaalsContact O-CA 3.22Å; D638-R663 WeakPolarHBondContact O-CA 3.44Å; D638-R663 PolarHBondContact O-N 2.89Å
639	N	88.9	Confident	88.9	Confident	73 Å²	73	34.3 Å²	34.3	39%	0.39	19%	0.193	S	C	.	.	S	Bend	trans	-80.9	1.8	-177.1	-62.9	-27.8	0	0	0	114.3	H662 R663 L709	N639-H662 PolarHBondContact O-CE1 3.41Å; N639-R663 WeakPolarHBondContact OD1-CD 3.23Å; N639-R663 WeakPolarHBondContact OD1-CG 3.36Å; N639-L709 WeakPolarHBondContact O-CD1 3.44Å
640	Y	93.6	Very high	87	Confident	92 Å²	92	34.2 Å²	34.2	36%	0.361	20%	0.195	S	C	.	.	S	Bend	trans	-122.6	-11.4	-168.1	-60.1	-75.8	0	0	0	113	S627 T628 D638 L709	S627-Y640 WeakPolarHBondContact CA-O 3.47Å; T628-Y640 PolarHBondContact N-O 3.31Å; T628-Y640 WeakPolarHBondContact OG1-CB 3.41Å; D638-Y640 VanDerWaalsContact C-N 3.25Å; D638-Y640 PolarHBondContact O-N 2.92Å; D638-Y640 PolarHBondContact OD1-N 3.03Å; Y640-L709 HydrophobicContact CD1-CD2 3.41Å; Y640-L709 VanDerWaalsContact CD1-CD2 3.41Å; Y640-L709 HydrophobicContact CE1-CD2 3.77Å; Y640-L709 HydrophobicContact CG-CD2 4.49Å
641	G	95.8	Very high	85	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	154.1	175.3	0	0	0	0	0	114.6	D638 H662	D638-G641 PolarHBondContact OD1-N 3.32Å; G641-H662 PolarHBondContact O-ND1 3.23Å
642	F	97.8	Very high	82.7	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	120.8	177.4	-57.3	-90.9	0	0	0	109.4	G625 W626 H662 I690 W692 F703 P706 L709 F714	G625-F642 WeakPolarHBondContact CA-O 3.46Å; W626-F642 PolarHBondContact N-O 2.84Å; W626-F642 PolarHBondContact O-N 3.23Å; F642-H662 HydrophobicContact CD1-CB 3.96Å; F642-H662 AromaticContact CD1-CG 3.77Å; F642-H662 AromaticContact CD1-ND1 3.66Å; F642-H662 HydrophobicContact CE1-CB 4.22Å; F642-H662 AromaticContact CE1-CD2 3.78Å; F642-H662 AromaticContact CE1-CE1 3.48Å; F642-H662 VanDerWaalsContact CE1-CE1 3.48Å; F642-H662 WeakPolarHBondContact CE1-CE1 3.39Å; F642-H662 AromaticContact CE1-CG 3.56Å; F642-H662 AromaticContact CE1-ND1 3.36Å; F642-H662 WeakPolarHBondContact CE1-ND1 3.47Å; F642-H662 AromaticContact CE1-NE2 3.77Å; F642-H662 AromaticContact CZ-CE1 3.49Å; F642-H662 VanDerWaalsContact CZ-CE1 3.49Å; F642-H662 WeakPolarHBondContact CZ-CE1 3.32Å; F642-H662 AromaticContact CZ-ND1 3.72Å; F642-I690 HydrophobicContact CB-CD1 4.08Å; F642-I690 HydrophobicContact CD1-CD1 3.86Å; F642-I690 HydrophobicContact CD2-CD1 3.45Å; F642-I690 VanDerWaalsContact CD2-CD1 3.45Å; F642-I690 HydrophobicContact CE1-CD1 4.13Å; F642-I690 HydrophobicContact CE2-CD1 3.78Å; F642-I690 HydrophobicContact CG-CD1 3.51Å; F642-I690 HydrophobicContact CZ-CD1 4.09Å; F642-W692 HydrophobicContact CB-CH2 4.03Å; F642-W692 HydrophobicContact CB-CZ2 4.26Å; F642-F703 HydrophobicContact CB-CD2 4.48Å; F642-F703 HydrophobicContact CD1-CB 4.11Å; F642-F703 AromaticContact CD1-CD2 3.58Å; F642-F703 HydrophobicContact CD1-CD2 3.58Å; F642-F703 HydrophobicContact CD1-CE2 4.12Å; F642-F703 AromaticContact CD1-CG 3.89Å; F642-F703 HydrophobicContact CD1-CG 3.89Å; F642-F703 HydrophobicContact CE1-CB 4.11Å; F642-F703 HydrophobicContact CE1-CD2 4.34Å; F642-F703 HydrophobicContact CE1-CG 4.19Å; F642-F703 HydrophobicContact CG-CD2 4.47Å; F642-P706 HydrophobicContact CZ-CG 4.28Å; F642-L709 HydrophobicContact CE2-CD1 3.74Å; F642-L709 HydrophobicContact CZ-CD1 3.91Å; F642-F714 HydrophobicContact CD2-CE1 4.22Å; F642-F714 AromaticContact CE2-CE1 3.88Å; F642-F714 HydrophobicContact CE2-CE1 3.88Å
643	G	97.3	Very high	80.2	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	148.9	-177.8	0	0	0	0	0	113.3	V660 I661	G643-V660 CarbonylContact O-C 3.45Å; G643-V660 VanDerWaalsContact O-CA 3.23Å; G643-V660 WeakPolarHBondContact O-CA 3.19Å; G643-I661 PolarHBondContact N-O 3.19Å; G643-I661 PolarHBondContact O-N 2.88Å
644	Y	97.1	Very high	77.8	Confident	0 Å²	0	42 Å²	42	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	142.1	170.6	167.4	-107.8	0	0	0	111.2	R623 V624 R659 V660 Y669 I671 V673 I679 W692 F699	R623-Y644 CarbonylContact C-O 3.55Å; R623-Y644 WeakPolarHBondContact CA-O 3.41Å; V624-Y644 PolarHBondContact N-O 3.01Å; V624-Y644 PolarHBondContact O-N 2.92Å; Y644-R659 CarbonylContact C-O 3.55Å; Y644-R659 VanDerWaalsContact CA-O 3.27Å; Y644-R659 WeakPolarHBondContact CA-O 3.43Å; Y644-R659 WeakPolarHBondContact CD2-O 3.41Å; Y644-V660 HydrophobicContact CD2-CG1 3.82Å; Y644-V660 HydrophobicContact CG-CG1 4.38Å; Y644-Y669 AromaticContact CD2-CD1 3.77Å; Y644-Y669 HydrophobicContact CD2-CD1 3.77Å; Y644-Y669 HydrophobicContact CD2-CE1 4.33Å; Y644-Y669 AromaticContact CE2-CD1 3.78Å; Y644-Y669 HydrophobicContact CE2-CD1 3.78Å; Y644-Y669 HydrophobicContact CE2-CE1 4.43Å; Y644-I671 PolarHBondContact OH-N 2.61Å; Y644-I671 PolarHBondContact OH-O 2.79Å; Y644-V673 HydrophobicContact CE1-CG2 3.88Å; Y644-I679 HydrophobicContact CD1-CD1 4.4Å; Y644-I679 HydrophobicContact CD1-CG1 4.45Å; Y644-I679 HydrophobicContact CD1-CG2 3.72Å; Y644-I679 HydrophobicContact CE1-CD1 4.5Å; Y644-I679 HydrophobicContact CE1-CG1 4.23Å; Y644-I679 HydrophobicContact CE1-CG2 4.06Å; Y644-W692 VanDerWaalsContact CB-CE2 3.43Å; Y644-W692 VanDerWaalsContact CB-CG 3.46Å; Y644-W692 HydrophobicContact CD1-CB 3.68Å; Y644-W692 AromaticContact CD1-CD1 3.83Å; Y644-W692 AromaticContact CD1-CG 3.75Å; Y644-W692 HydrophobicContact CD1-CG 3.75Å; Y644-W692 HydrophobicContact CE1-CB 4.19Å; Y644-W692 HydrophobicContact CG-CB 3.9Å; Y644-W692 HydrophobicContact CG-CD2 4.05Å; Y644-W692 AromaticContact CG-CG 3.73Å; Y644-W692 HydrophobicContact CG-CG 3.73Å; Y644-F699 HydrophobicContact CE1-CE2 4.39Å; Y644-F699 HydrophobicContact CE2-CE2 4.43Å; Y644-F699 AromaticContact CZ-CE2 3.83Å; Y644-F699 WeakPolarHBondContact OH-CE2 3.25Å
645	G	92.3	Very high	75.8	Confident	2 Å²	2	46.7 Å²	46.7	2%	0.021	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.1	-145.7	167.9	0	0	0	0	0	113.3	I622 R659	I622-G645 CarbonylContact O-C 3.49Å; I622-G645 WeakPolarHBondContact O-CA 3.48Å; G645-R659 PolarHBondContact N-O 3.06Å; G645-R659 PolarHBondContact O-N 2.9Å
646	S	84.7	Confident	74.1	Confident	5 Å²	5	47.2 Å²	47.2	4%	0.035	30%	0.296	C	S	.	.			trans	-90.4	132	179.3	54.5	0	0	0	0	111.4	G620 L621 I622	G620-S646 PolarHBondContact O-OG 3.46Å; L621-S646 WeakPolarHBondContact CA-O 3.48Å; L621-S646 WeakPolarHBondContact CA-OG 3.48Å; L621-S646 WeakPolarHBondContact CB-O 3.33Å; I622-S646 PolarHBondContact N-O 3.36Å; I622-S646 VanDerWaalsContact N-O 3.12Å; I622-S646 PolarHBondContact N-OG 2.96Å; I622-S646 VanDerWaalsContact N-OG 3.08Å; I622-S646 PolarHBondContact O-N 3.39Å
647	D	69.3	Low	73.4	Confident	25 Å²	25	50.1 Å²	50.1	13%	0.134	31%	0.314	C	S	.	.			trans	-140	150	178.1	180	30.5	0	0	0	110.4	V649 G650 R659	D647-V649 PolarHBondContact O-N 2.98Å; D647-V649 VanDerWaalsContact O-N 3.1Å; D647-G650 PolarHBondContact O-N 3.06Å; D647-R659 IonicContact OD2-CZ 3.39Å; D647-R659 IonicContact OD2-NH1 2.78Å; D647-R659 PolarHBondContact OD2-NH1 3.33Å
648	A	64	Low	73.2	Confident	63 Å²	63	48.9 Å²	48.9	52%	0.521	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-27.5	-169.3	0	0	0	0	0	114	L621	L621-A648 HydrophobicContact CD1-CB 3.9Å
649	V	56.7	Low	73.2	Confident	100 Å²	100	49.2 Å²	49.2	61%	0.606	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-31.3	179.7	-174.3	0	0	0	0	111.5	D647 S651	D647-V649 PolarHBondContact O-N 2.98Å; D647-V649 VanDerWaalsContact O-N 3.1Å; V649-S651 PolarHBondContact O-N 3.44Å
650	G	49.5	Very low	73.4	Confident	10 Å²	10	45.9 Å²	45.9	10%	0.103	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-73.1	-12.7	179.6	0	0	0	0	0	113.7	D647 A652	D647-G650 PolarHBondContact O-N 3.06Å; G650-A652 PolarHBondContact O-N 2.93Å; G650-A652 VanDerWaalsContact O-N 3.08Å
651	S	48.6	Very low	73.4	Confident	68 Å²	68	42 Å²	42	48%	0.476	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-71	3	-179.5	-52.4	0	0	0	0	114.9	V649	V649-S651 PolarHBondContact O-N 3.44Å
652	A	46.3	Very low	73.1	Confident	101 Å²	101	42.8 Å²	42.8	84%	0.835	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-86.5	-1.1	-170.8	0	0	0	0	0	115.6	G650	G650-A652 PolarHBondContact O-N 2.93Å; G650-A652 VanDerWaalsContact O-N 3.08Å
653	G	39.8	Very low	72.4	Confident	44 Å²	44	48.2 Å²	48.2	45%	0.454	30%	0.295	S	S	.	.	S	Bend	trans	-111.4	140.7	-177.9	0	0	0	0	0	114.1	N655 G656	G653-N655 PolarHBondContact O-N 3Å; G653-G656 PolarHBondContact O-N 2.82Å
654	I	44.7	Very low	71.9	Confident	178 Å²	178	53.2 Å²	53.2	91%	0.913	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-22.4	176.5	-65	170.9	0	0	0	112.7
655	N	52.2	Low	71.1	Confident	158 Å²	158	57.4 Å²	57.4	85%	0.845	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	14.9	177.4	-70.7	-12.8	0	0	0	113.8	G653	G653-N655 PolarHBondContact O-N 3Å
656	G	62.9	Low	70.7	Confident	13 Å²	13	58.2 Å²	58.2	13%	0.134	35%	0.351	C	S	.	.			trans	18.9	112.7	-178.7	0	0	0	0	0	117.8	G653 M672	G653-G656 PolarHBondContact O-N 2.82Å; G656-M672 WeakPolarHBondContact O-CB 3.39Å; G656-M672 PolarHBondContact O-N 2.86Å; G656-M672 VanDerWaalsContact O-N 3.09Å
657	T	78.4	Confident	70.5	Confident	60 Å²	60	64.4 Å²	64.4	37%	0.368	38%	0.375	S	S	.	.			trans	-87.4	151.9	166.7	51.4	0	0	0	0	110.7	D668	T657-D668 WeakPolarHBondContact OG1-CB 3.37Å
658	G	87.1	Confident	71.4	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.01	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	177	166.6	0	0	0	0	0	110.6	D668 Y669 I671	G658-D668 WeakPolarHBondContact O-CA 3.34Å; G658-Y669 CarbonylContact C-O 3.59Å; G658-Y669 WeakPolarHBondContact CA-O 3.21Å; G658-Y669 PolarHBondContact N-O 2.9Å; G658-Y669 PolarHBondContact O-N 2.83Å; G658-I671 WeakPolarHBondContact CA-O 3.5Å; G658-I671 PolarHBondContact N-O 3.39Å
659	R	89.4	Confident	72.5	Confident	40 Å²	40	66.4 Å²	66.4	15%	0.151	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	140.9	175.4	-60.9	-169	82.4	-160.5	5.7	112	Y644 G645 D647 G666 Y667 D668	Y644-R659 CarbonylContact C-O 3.55Å; Y644-R659 VanDerWaalsContact CA-O 3.27Å; Y644-R659 WeakPolarHBondContact CA-O 3.43Å; Y644-R659 WeakPolarHBondContact CD2-O 3.41Å; G645-R659 PolarHBondContact N-O 3.06Å; G645-R659 PolarHBondContact O-N 2.9Å; D647-R659 IonicContact OD2-CZ 3.39Å; D647-R659 IonicContact OD2-NH1 2.78Å; D647-R659 PolarHBondContact OD2-NH1 3.33Å; R659-G666 VanDerWaalsContact NH2-C 3.31Å; R659-G666 PolarHBondContact NH2-O 2.68Å; R659-Y667 CarbonylContact C-O 3.55Å; R659-Y667 VanDerWaalsContact CA-O 3.24Å; R659-Y667 WeakPolarHBondContact CA-O 3.34Å; R659-D668 IonicContact NE-OD1 3.9Å
660	V	93.8	Very high	74	Confident	4 Å²	4	62.9 Å²	62.9	2%	0.024	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	143.7	165.1	-69	0	0	0	0	109.7	G643 Y644 G666 Y667 Y669 W692 A702 F703	G643-V660 CarbonylContact O-C 3.45Å; G643-V660 VanDerWaalsContact O-CA 3.23Å; G643-V660 WeakPolarHBondContact O-CA 3.19Å; Y644-V660 HydrophobicContact CD2-CG1 3.82Å; Y644-V660 HydrophobicContact CG-CG1 4.38Å; V660-G666 CarbonylContact O-C 3.57Å; V660-G666 WeakPolarHBondContact O-CA 3.41Å; V660-Y667 PolarHBondContact N-O 3.38Å; V660-Y667 PolarHBondContact O-N 3.07Å; V660-Y669 HydrophobicContact CB-CG 4.45Å; V660-Y669 HydrophobicContact CG1-CD1 3.3Å; V660-Y669 HydrophobicContact CG1-CD2 4.31Å; V660-Y669 HydrophobicContact CG1-CE1 3.81Å; V660-Y669 HydrophobicContact CG1-CG 3.55Å; V660-Y669 HydrophobicContact CG2-CD2 4.46Å; V660-Y669 HydrophobicContact CG2-CG 4.11Å; V660-W692 HydrophobicContact CB-CZ3 4.2Å; V660-W692 HydrophobicContact CG1-CE3 3.65Å; V660-W692 HydrophobicContact CG1-CH2 4.32Å; V660-W692 HydrophobicContact CG1-CZ3 3.5Å; V660-A702 HydrophobicContact CG1-CB 4.07Å; V660-F703 HydrophobicContact CB-CE2 3.73Å; V660-F703 HydrophobicContact CB-CZ 3.77Å; V660-F703 HydrophobicContact CG1-CE2 4.47Å; V660-F703 HydrophobicContact CG2-CE1 4.49Å; V660-F703 HydrophobicContact CG2-CE2 4.11Å; V660-F703 HydrophobicContact CG2-CZ 3.73Å
661	I	93.3	Very high	75.9	Confident	11 Å²	11	65.1 Å²	65.1	6%	0.056	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	136.6	-176.7	-172.4	166.2	0	0	0	112.1	R623 G643 I665	R623-I661 HydrophobicContact CG-CG2 4.32Å; G643-I661 PolarHBondContact N-O 3.19Å; G643-I661 PolarHBondContact O-N 2.88Å; I661-I665 WeakPolarHBondContact CA-O 3.26Å
662	H	90.1	Very high	77.7	Confident	16 Å²	16	63.9 Å²	63.9	7%	0.074	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	141.8	174.7	175.3	58.4	0	0	0	108.3	G636 D638 N639 G641 F642 N664 I665 F703	G636-H662 CarbonylContact O-C 3.15Å; G636-H662 WeakPolarHBondContact O-CA 3.4Å; D638-H662 PolarHBondContact O-ND1 3.45Å; N639-H662 PolarHBondContact O-CE1 3.41Å; G641-H662 PolarHBondContact O-ND1 3.23Å; F642-H662 HydrophobicContact CD1-CB 3.96Å; F642-H662 AromaticContact CD1-CG 3.77Å; F642-H662 AromaticContact CD1-ND1 3.66Å; F642-H662 HydrophobicContact CE1-CB 4.22Å; F642-H662 AromaticContact CE1-CD2 3.78Å; F642-H662 AromaticContact CE1-CE1 3.48Å; F642-H662 VanDerWaalsContact CE1-CE1 3.48Å; F642-H662 WeakPolarHBondContact CE1-CE1 3.39Å; F642-H662 AromaticContact CE1-CG 3.56Å; F642-H662 AromaticContact CE1-ND1 3.36Å; F642-H662 WeakPolarHBondContact CE1-ND1 3.47Å; F642-H662 AromaticContact CE1-NE2 3.77Å; F642-H662 AromaticContact CZ-CE1 3.49Å; F642-H662 VanDerWaalsContact CZ-CE1 3.49Å; F642-H662 WeakPolarHBondContact CZ-CE1 3.32Å; F642-H662 AromaticContact CZ-ND1 3.72Å; H662-N664 PolarHBondContact O-N 3.01Å; H662-I665 PolarHBondContact N-O 2.96Å; H662-I665 PolarHBondContact O-N 2.83Å; H662-I665 VanDerWaalsContact O-O 3.14Å; H662-F703 HydrophobicContact CB-CE1 3.99Å; H662-F703 HydrophobicContact CB-CE2 4.26Å; H662-F703 HydrophobicContact CB-CZ 3.84Å
663	R	83.4	Confident	79.8	Confident	113 Å²	113	59 Å²	59	43%	0.426	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	29.5	-175.9	-38.8	-172	179.8	173.8	-0.2	114.3	G636 D638 N639 I665	G636-R663 PolarHBondContact O-N 2.94Å; G636-R663 VanDerWaalsContact O-N 3.1Å; D638-R663 VanDerWaalsContact O-CA 3.22Å; D638-R663 WeakPolarHBondContact O-CA 3.44Å; D638-R663 PolarHBondContact O-N 2.89Å; N639-R663 WeakPolarHBondContact OD1-CD 3.23Å; N639-R663 WeakPolarHBondContact OD1-CG 3.36Å; R663-I665 PolarHBondContact O-N 2.97Å
664	N	86.1	Confident	82.2	Confident	106 Å²	106	60.8 Å²	60.8	57%	0.567	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	22.4	-171.5	-156.9	23.2	0	0	0	113.9	G636 A637 H662	G636-N664 WeakPolarHBondContact O-CA 3.09Å; G636-N664 PolarHBondContact O-N 3.29Å; A637-N664 WeakPolarHBondContact O-CB 3.37Å; H662-N664 PolarHBondContact O-N 3.01Å
665	I	80.3	Confident	84.5	Confident	88 Å²	88	58 Å²	58	45%	0.451	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	117	177.8	-58.3	169	0	0	0	108	I661 H662 R663 Y667	I661-I665 WeakPolarHBondContact CA-O 3.26Å; H662-I665 PolarHBondContact N-O 2.96Å; H662-I665 PolarHBondContact O-N 2.83Å; H662-I665 VanDerWaalsContact O-O 3.14Å; R663-I665 PolarHBondContact O-N 2.97Å; I665-Y667 HydrophobicContact CG2-CE1 4.25Å; I665-Y667 HydrophobicContact CG2-CE2 3.83Å; I665-Y667 WeakPolarHBondContact CG2-OH 3.04Å
666	G	84.2	Confident	86.4	Confident	18 Å²	18	53 Å²	53	19%	0.186	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	141.3	-177.1	0	0	0	0	0	113.3	R659 V660	R659-G666 VanDerWaalsContact NH2-C 3.31Å; R659-G666 PolarHBondContact NH2-O 2.68Å; V660-G666 CarbonylContact O-C 3.57Å; V660-G666 WeakPolarHBondContact O-CA 3.41Å
667	Y	80.8	Confident	88	Confident	136 Å²	136	53.6 Å²	53.6	53%	0.533	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	148	175.4	-55.4	-82.2	0	0	0	110.7	R659 V660 I665	R659-Y667 CarbonylContact C-O 3.55Å; R659-Y667 VanDerWaalsContact CA-O 3.24Å; R659-Y667 WeakPolarHBondContact CA-O 3.34Å; V660-Y667 PolarHBondContact N-O 3.38Å; V660-Y667 PolarHBondContact O-N 3.07Å; I665-Y667 HydrophobicContact CG2-CE1 4.25Å; I665-Y667 HydrophobicContact CG2-CE2 3.83Å; I665-Y667 WeakPolarHBondContact CG2-OH 3.04Å
668	D	87	Confident	89	Confident	109 Å²	109	50.9 Å²	50.9	58%	0.583	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.8	132.7	172.8	-64.4	-18.9	0	0	0	110	T657 G658 R659	T657-D668 WeakPolarHBondContact OG1-CB 3.37Å; G658-D668 WeakPolarHBondContact O-CA 3.34Å; R659-D668 IonicContact NE-OD1 3.9Å
669	Y	87.8	Confident	89.5	Confident	21 Å²	21	50.9 Å²	50.9	8%	0.082	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	143.1	-172.7	-179	-94.7	0	0	0	111.3	Y644 G658 V660 W692 F699 Q700 A702	Y644-Y669 AromaticContact CD2-CD1 3.77Å; Y644-Y669 HydrophobicContact CD2-CD1 3.77Å; Y644-Y669 HydrophobicContact CD2-CE1 4.33Å; Y644-Y669 AromaticContact CE2-CD1 3.78Å; Y644-Y669 HydrophobicContact CE2-CD1 3.78Å; Y644-Y669 HydrophobicContact CE2-CE1 4.43Å; G658-Y669 CarbonylContact C-O 3.59Å; G658-Y669 WeakPolarHBondContact CA-O 3.21Å; G658-Y669 PolarHBondContact N-O 2.9Å; G658-Y669 PolarHBondContact O-N 2.83Å; V660-Y669 HydrophobicContact CB-CG 4.45Å; V660-Y669 HydrophobicContact CG1-CD1 3.3Å; V660-Y669 HydrophobicContact CG1-CD2 4.31Å; V660-Y669 HydrophobicContact CG1-CE1 3.81Å; V660-Y669 HydrophobicContact CG1-CG 3.55Å; V660-Y669 HydrophobicContact CG2-CD2 4.46Å; V660-Y669 HydrophobicContact CG2-CG 4.11Å; Y669-W692 HydrophobicContact CE1-CB 4.27Å; Y669-W692 HydrophobicContact CE1-CE3 4.07Å; Y669-W692 PolarHBondContact OH-N 3.25Å; Y669-F699 HydrophobicContact CD1-CD2 4.13Å; Y669-F699 HydrophobicContact CE1-CB 3.7Å; Y669-F699 AromaticContact CE1-CD2 3.57Å; Y669-F699 HydrophobicContact CE1-CD2 3.57Å; Y669-F699 AromaticContact CE1-CG 3.99Å; Y669-F699 HydrophobicContact CE1-CG 3.99Å; Y669-F699 HydrophobicContact CE2-CB 4.06Å; Y669-F699 VanDerWaalsContact OH-CB 3.28Å; Y669-F699 WeakPolarHBondContact OH-CB 3.39Å; Y669-Q700 HydrophobicContact CE2-CG 4.4Å; Y669-Q700 VanDerWaalsContact CE2-O 3.22Å; Y669-Q700 WeakPolarHBondContact CE2-O 3.14Å; Y669-Q700 VanDerWaalsContact CZ-O 3.26Å; Y669-Q700 PolarHBondContact OH-O 2.99Å; Y669-A702 HydrophobicContact CD2-CB 4.26Å; Y669-A702 HydrophobicContact CE1-CB 4.3Å; Y669-A702 HydrophobicContact CE2-CB 3.67Å
670	G	88.9	Confident	89.9	Confident	26 Å²	26	49 Å²	49	27%	0.268	26%	0.256	S	S	.	.	S	Bend	trans	62.2	-136.6	175.4	0	0	0	0	0	113.2	F699	G670-F699 VanDerWaalsContact CA-CZ 3.48Å
671	I	87.9	Confident	90.2	Very high	56 Å²	56	48.8 Å²	48.8	29%	0.287	26%	0.255	S	S	.	.			trans	-124.9	152.6	-179.4	68.2	-172.3	0	0	0	109.7	Y644 G658 V673 C694 F699	Y644-I671 PolarHBondContact OH-N 2.61Å; Y644-I671 PolarHBondContact OH-O 2.79Å; G658-I671 WeakPolarHBondContact CA-O 3.5Å; G658-I671 PolarHBondContact N-O 3.39Å; I671-V673 PolarHBondContact O-N 2.78Å; I671-C694 HydrophobicContact CD1-CB 3.67Å; I671-C694 HydrophobicContact CG1-CB 3.72Å; I671-F699 HydrophobicContact CB-CZ 4.45Å; I671-F699 HydrophobicContact CD1-CZ 4.4Å; I671-F699 HydrophobicContact CG1-CZ 3.98Å; I671-F699 HydrophobicContact CG2-CE1 4.24Å; I671-F699 HydrophobicContact CG2-CZ 4.23Å
672	M	86.9	Confident	90.4	Very high	42 Å²	42	48.4 Å²	48.4	21%	0.207	25%	0.253	C	S	.	.			trans	-62.3	135	174.8	-179.8	167.8	-178.1	0	0	110	G656	G656-M672 WeakPolarHBondContact O-CB 3.39Å; G656-M672 PolarHBondContact O-N 2.86Å; G656-M672 VanDerWaalsContact O-N 3.09Å
673	V	90.4	Very high	90.8	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.249	C	C	.	.			trans	-91.6	130	179.4	-173.4	0	0	0	0	109.3	C616 I622 Y644 I671 D677 I679	C616-V673 HydrophobicContact CB-CG1 4.2Å; I622-V673 HydrophobicContact CD1-CB 4.46Å; I622-V673 HydrophobicContact CD1-CG1 3.85Å; Y644-V673 HydrophobicContact CE1-CG2 3.88Å; I671-V673 PolarHBondContact O-N 2.78Å; V673-D677 HydrophobicContact CG1-CB 3.83Å; V673-I679 HydrophobicContact CG1-CD1 4.01Å; V673-I679 HydrophobicContact CG1-CG1 4.07Å; V673-I679 HydrophobicContact CG2-CD1 4.02Å; V673-I679 HydrophobicContact CG2-CG1 4.06Å
674	H	90.9	Very high	91.2	Very high	81 Å²	81	42.4 Å²	42.4	38%	0.375	23%	0.23	S	C	.	.			trans	-121	167.9	176.8	-65.8	-65.2	0	0	0	111.2	C616 E619 G676 D677	C616-H674 WeakPolarHBondContact CB-O 3.29Å; E619-H674 IonicContact OE1-ND1 3.76Å; E619-H674 PolarHBondContact OE1-ND1 3.06Å; E619-H674 VanDerWaalsContact OE1-ND1 3.12Å; E619-H674 WeakPolarHBondContact OE2-CA 3.39Å; E619-H674 IonicContact OE2-ND1 2.86Å; H674-G676 PolarHBondContact O-N 2.89Å; H674-D677 PolarHBondContact N-OD2 3.15Å; H674-D677 VanDerWaalsContact O-CB 3.28Å; H674-D677 WeakPolarHBondContact O-CB 3.31Å; H674-D677 PolarHBondContact O-N 2.9Å; H674-D677 VanDerWaalsContact O-N 3.1Å
675	Q	91.9	Very high	91.4	Very high	119 Å²	119	38.1 Å²	38.1	56%	0.556	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.6	131.9	170.3	-174.8	179.8	9.9	0	0	111.3	L617 E619	L617-Q675 WeakPolarHBondContact O-CG 3.31Å; L617-Q675 PolarHBondContact O-NE2 2.86Å; E619-Q675 HydrophobicContact CB-CB 4.3Å; E619-Q675 PolarHBondContact OE2-N 3.22Å
676	G	93.2	Very high	91.6	Very high	52 Å²	52	37.1 Å²	37.1	54%	0.536	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.8	-17.9	-176.8	0	0	0	0	0	113.9	C616 H674	C616-G676 PolarHBondContact O-N 3.49Å; H674-G676 PolarHBondContact O-N 2.89Å
677	D	96.9	Very high	91.6	Very high	27 Å²	27	40.8 Å²	40.8	14%	0.144	21%	0.213	C	C	.	.			trans	-73.3	147.4	-178.5	-70.7	-25.5	0	0	0	112.6	V615 C616 V673 H674 N695	V615-D677 CarbonylContact C-O 3.51Å; V615-D677 WeakPolarHBondContact CA-O 3.46Å; C616-D677 PolarHBondContact N-O 2.83Å; V673-D677 HydrophobicContact CG1-CB 3.83Å; H674-D677 PolarHBondContact N-OD2 3.15Å; H674-D677 VanDerWaalsContact O-CB 3.28Å; H674-D677 WeakPolarHBondContact O-CB 3.31Å; H674-D677 PolarHBondContact O-N 2.9Å; H674-D677 VanDerWaalsContact O-N 3.1Å; D677-N695 WeakPolarHBondContact CA-OD1 3.26Å; D677-N695 PolarHBondContact OD1-ND2 3.42Å
678	V	98.2	Very high	91.8	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.012	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	112.8	175.8	-173	0	0	0	0	109.4	E613 V615 C694 N695 F737	E613-V678 HydrophobicContact CB-CG1 3.91Å; E613-V678 HydrophobicContact CG-CG1 3.88Å; V615-V678 HydrophobicContact CG1-CG2 4.33Å; V615-V678 HydrophobicContact CG2-CG1 4.41Å; V615-V678 HydrophobicContact CG2-CG2 4.05Å; V678-C694 CarbonylContact O-C 3.54Å; V678-C694 WeakPolarHBondContact O-CA 3.46Å; V678-N695 PolarHBondContact N-OD1 3.35Å; V678-N695 PolarHBondContact O-N 2.87Å; V678-F737 HydrophobicContact CB-CD2 3.77Å; V678-F737 HydrophobicContact CB-CE2 3.75Å; V678-F737 HydrophobicContact CG1-CD2 3.94Å; V678-F737 HydrophobicContact CG1-CE2 4.37Å; V678-F737 HydrophobicContact CG2-CD2 4.19Å; V678-F737 HydrophobicContact CG2-CE2 3.76Å
679	I	98.5	Very high	91.9	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	125.1	172.7	-60.6	170.1	0	0	0	108.6	E613 A614 I622 V624 Y644 V673 S693	E613-I679 CarbonylContact C-O 3.52Å; E613-I679 VanDerWaalsContact CA-O 3.23Å; E613-I679 WeakPolarHBondContact CA-O 3.49Å; A614-I679 PolarHBondContact N-O 2.95Å; A614-I679 PolarHBondContact O-N 3.44Å; I622-I679 HydrophobicContact CD1-CD1 3.57Å; I622-I679 HydrophobicContact CG1-CD1 4.3Å; V624-I679 HydrophobicContact CB-CD1 4.32Å; V624-I679 HydrophobicContact CG2-CD1 3.97Å; Y644-I679 HydrophobicContact CD1-CD1 4.4Å; Y644-I679 HydrophobicContact CD1-CG1 4.45Å; Y644-I679 HydrophobicContact CD1-CG2 3.72Å; Y644-I679 HydrophobicContact CE1-CD1 4.5Å; Y644-I679 HydrophobicContact CE1-CG1 4.23Å; Y644-I679 HydrophobicContact CE1-CG2 4.06Å; V673-I679 HydrophobicContact CG1-CD1 4.01Å; V673-I679 HydrophobicContact CG1-CG1 4.07Å; V673-I679 HydrophobicContact CG2-CD1 4.02Å; V673-I679 HydrophobicContact CG2-CG1 4.06Å; I679-S693 WeakPolarHBondContact CA-O 3.3Å
680	G	98.6	Very high	92.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	136.3	165.2	0	0	0	0	0	111.7	Y611 W692 S693	Y611-G680 VanDerWaalsContact OH-CA 3.26Å; Y611-G680 WeakPolarHBondContact OH-CA 3.48Å; G680-W692 CarbonylContact O-C 3.54Å; G680-W692 WeakPolarHBondContact O-CA 3.4Å; G680-W692 WeakPolarHBondContact O-CB 3.39Å; G680-S693 VanDerWaalsContact CA-OG 3.23Å; G680-S693 WeakPolarHBondContact CA-OG 3.36Å; G680-S693 PolarHBondContact N-O 2.74Å; G680-S693 PolarHBondContact N-OG 2.88Å; G680-S693 PolarHBondContact O-N 2.93Å
681	C	98.7	Very high	92.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	110.6	-179.3	-63.7	0	0	0	0	109.9	Y611 Y612 W626 W692	Y611-C681 WeakPolarHBondContact CA-O 3.44Å; Y611-C681 WeakPolarHBondContact CD2-O 3.5Å; Y612-C681 HydrophobicContact CD1-CB 3.79Å; Y612-C681 HydrophobicContact CE1-CB 3.39Å; Y612-C681 HydrophobicContact CE2-CB 4.23Å; Y612-C681 HydrophobicContact CG-CB 4.37Å; Y612-C681 VanDerWaalsContact CZ-SG 3.58Å; Y612-C681 PolarHBondContact N-O 2.81Å; Y612-C681 PolarHBondContact O-N 2.86Å; W626-C681 HydrophobicContact CZ2-CB 4.35Å; W626-C681 WeakPolarHBondContact CZ2-O 3.49Å; C681-W692 VanDerWaalsContact SG-CD1 3.59Å
682	L	98.5	Very high	93.1	Very high	3 Å²	3	25.9 Å²	25.9	2%	0.016	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124	-174.9	-62.5	80.7	0	0	0	110.2	Y611 I690 S691 I698 P739 F743	Y611-L682 HydrophobicContact CD2-CD1 4.02Å; Y611-L682 HydrophobicContact CD2-CG 3.77Å; Y611-L682 HydrophobicContact CE2-CD1 3.84Å; Y611-L682 HydrophobicContact CE2-CG 4.08Å; L682-I690 WeakPolarHBondContact O-CA 3.37Å; L682-S691 WeakPolarHBondContact CB-O 3.35Å; L682-S691 WeakPolarHBondContact CB-OG 3.3Å; L682-S691 PolarHBondContact N-O 3.11Å; L682-S691 PolarHBondContact O-N 3.3Å; L682-S691 VanDerWaalsContact O-O 3.13Å; L682-I698 HydrophobicContact CD2-CD1 4.26Å; L682-I698 HydrophobicContact CD2-CG1 4.39Å; L682-I698 HydrophobicContact CD2-CG2 3.91Å; L682-P739 HydrophobicContact CD2-CB 4.31Å; L682-F743 HydrophobicContact CB-CD1 4.35Å; L682-F743 HydrophobicContact CB-CE1 3.82Å; L682-F743 HydrophobicContact CB-CZ 4.16Å; L682-F743 HydrophobicContact CD2-CD2 4.36Å; L682-F743 HydrophobicContact CD2-CE1 4.28Å; L682-F743 HydrophobicContact CD2-CE2 4Å; L682-F743 HydrophobicContact CD2-CZ 3.96Å; L682-F743 HydrophobicContact CG-CE1 4.4Å
683	L	97.6	Very high	93.6	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	106.1	176	177.7	69.1	0	0	0	110.1	V604 A609 Y610 W626 L685 I690 I705 F714	V604-L683 HydrophobicContact CG2-CD2 3.8Å; A609-L683 CarbonylContact C-O 3.57Å; A609-L683 WeakPolarHBondContact CA-O 3.37Å; Y610-L683 PolarHBondContact N-O 2.92Å; Y610-L683 PolarHBondContact O-N 3.15Å; W626-L683 HydrophobicContact CD2-CB 3.98Å; W626-L683 HydrophobicContact CD2-CD2 3.88Å; W626-L683 HydrophobicContact CD2-CG 4.41Å; W626-L683 VanDerWaalsContact CE2-CB 3.43Å; W626-L683 HydrophobicContact CE3-CD2 3.75Å; W626-L683 HydrophobicContact CG-CB 4.47Å; W626-L683 HydrophobicContact CG-CD2 4.49Å; W626-L683 HydrophobicContact CH2-CB 4.02Å; W626-L683 HydrophobicContact CH2-CD2 4.09Å; W626-L683 HydrophobicContact CZ2-CB 3.45Å; W626-L683 VanDerWaalsContact CZ2-CB 3.45Å; W626-L683 HydrophobicContact CZ2-CD2 4.27Å; W626-L683 HydrophobicContact CZ3-CD2 3.85Å; L683-L685 HydrophobicContact CD1-CD2 3.67Å; L683-L685 HydrophobicContact CD1-CG 4.38Å; L683-L685 HydrophobicContact CD2-CD1 4.24Å; L683-L685 HydrophobicContact CD2-CD2 3.89Å; L683-L685 HydrophobicContact CD2-CG 4.03Å; L683-L685 HydrophobicContact CG-CD2 3.71Å; L683-L685 HydrophobicContact CG-CG 3.9Å; L683-I690 HydrophobicContact CD1-CD1 4.21Å; L683-I690 HydrophobicContact CD1-CG1 3.71Å; L683-I705 HydrophobicContact CD1-CD1 3.78Å; L683-F714 HydrophobicContact CD1-CG 4.47Å; L683-F714 HydrophobicContact CD2-CB 3.55Å; L683-F714 HydrophobicContact CD2-CD2 4.26Å; L683-F714 HydrophobicContact CD2-CG 4.03Å
684	D	92.8	Very high	93.9	Very high	4 Å²	4	24 Å²	24	2%	0.021	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	90.7	176.3	-168.1	-20.6	0	0	0	108.8	A609 D686 K687 G688 S689 F743	A609-D684 HydrophobicContact CB-CB 4.37Å; D684-D686 WeakPolarHBondContact OD1-CA 3.48Å; D684-D686 WeakPolarHBondContact OD1-CB 3.5Å; D684-D686 PolarHBondContact OD1-N 2.73Å; D684-K687 HydrophobicContact CB-CB 4.3Å; D684-K687 CarbonylContact O-C 3.52Å; D684-K687 PolarHBondContact O-N 3.45Å; D684-K687 VanDerWaalsContact O-N 3.15Å; D684-K687 PolarHBondContact OD1-N 2.94Å; D684-K687 WeakPolarHBondContact OD2-CD 3.39Å; D684-K687 VanDerWaalsContact OD2-CG 3.3Å; D684-K687 WeakPolarHBondContact OD2-CG 3.41Å; D684-K687 IonicContact OD2-NZ 3.69Å; D684-K687 PolarHBondContact OD2-NZ 3.2Å; D684-G688 CarbonylContact O-C 3.6Å; D684-G688 WeakPolarHBondContact O-CA 3.29Å; D684-G688 PolarHBondContact O-N 3.06Å; D684-S689 PolarHBondContact N-O 2.87Å; D684-S689 PolarHBondContact O-N 2.87Å; D684-F743 HydrophobicContact CB-CE1 3.99Å; D684-F743 HydrophobicContact CB-CZ 4Å
685	L	90.1	Very high	94.1	Very high	15 Å²	15	23.1 Å²	23.1	8%	0.079	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-26.8	177.1	-60.4	-179.3	0	0	0	110.7	A606 G608 Y610 L683 K687 G688 I705 F714	A606-L685 HydrophobicContact CB-CB 3.93Å; A606-L685 HydrophobicContact CB-CD1 4.26Å; G608-L685 WeakPolarHBondContact O-CB 3.36Å; G608-L685 PolarHBondContact O-N 3.05Å; Y610-L685 HydrophobicContact CD2-CD1 4.2Å; Y610-L685 HydrophobicContact CD2-CG 4.49Å; Y610-L685 HydrophobicContact CE2-CD1 3.91Å; Y610-L685 HydrophobicContact CE2-CG 4.48Å; L683-L685 HydrophobicContact CD1-CD2 3.67Å; L683-L685 HydrophobicContact CD1-CG 4.38Å; L683-L685 HydrophobicContact CD2-CD1 4.24Å; L683-L685 HydrophobicContact CD2-CD2 3.89Å; L683-L685 HydrophobicContact CD2-CG 4.03Å; L683-L685 HydrophobicContact CG-CD2 3.71Å; L683-L685 HydrophobicContact CG-CG 3.9Å; L685-K687 PolarHBondContact O-N 3.45Å; L685-G688 PolarHBondContact O-N 3.18Å; L685-I705 HydrophobicContact CD2-CD1 3.53Å; L685-F714 HydrophobicContact CD2-CD2 3.91Å; L685-F714 HydrophobicContact CD2-CE2 4.12Å
686	D	84.9	Confident	94.2	Very high	68 Å²	68	19.1 Å²	19.1	36%	0.364	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	3.2	170.2	-66.7	-21.7	0	0	0	113.5	P607 G608 D684 Y970	P607-D686 VanDerWaalsContact CA-OD1 3.29Å; P607-D686 WeakPolarHBondContact CA-OD1 3.43Å; P607-D686 WeakPolarHBondContact CB-OD1 3.36Å; G608-D686 VanDerWaalsContact CA-OD2 3.23Å; G608-D686 WeakPolarHBondContact CA-OD2 3.39Å; G608-D686 PolarHBondContact N-OD1 3.03Å; G608-D686 PolarHBondContact N-OD2 2.87Å; G608-D686 VanDerWaalsContact N-OD2 3.15Å; G608-D686 PolarHBondContact O-N 3.21Å; D684-D686 WeakPolarHBondContact OD1-CA 3.48Å; D684-D686 WeakPolarHBondContact OD1-CB 3.5Å; D684-D686 PolarHBondContact OD1-N 2.73Å; D686-Y970 VanDerWaalsContact C-CZ 3.43Å; D686-Y970 VanDerWaalsContact C-OH 3.25Å; D686-Y970 WeakPolarHBondContact O-CE2 3.39Å; D686-Y970 PolarHBondContact O-OH 2.8Å
687	K	82.9	Confident	94.2	Very high	94 Å²	94	22.7 Å²	22.7	41%	0.409	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-135.4	1.5	166.6	-65.3	-167.3	-164.2	94.6	0	112.7	D684 L685 S689 Y970	D684-K687 HydrophobicContact CB-CB 4.3Å; D684-K687 CarbonylContact O-C 3.52Å; D684-K687 PolarHBondContact O-N 3.45Å; D684-K687 VanDerWaalsContact O-N 3.15Å; D684-K687 PolarHBondContact OD1-N 2.94Å; D684-K687 WeakPolarHBondContact OD2-CD 3.39Å; D684-K687 VanDerWaalsContact OD2-CG 3.3Å; D684-K687 WeakPolarHBondContact OD2-CG 3.41Å; D684-K687 IonicContact OD2-NZ 3.69Å; D684-K687 PolarHBondContact OD2-NZ 3.2Å; L685-K687 PolarHBondContact O-N 3.45Å; K687-S689 VanDerWaalsContact C-N 3.35Å; K687-S689 PolarHBondContact O-N 3.5Å; K687-Y970 WeakPolarHBondContact CA-OH 3.43Å
688	G	85.2	Confident	94	Very high	12 Å²	12	25.1 Å²	25.1	12%	0.124	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	42.9	-171.8	0	0	0	0	0	112.9	D684 L685 T704 I705	D684-G688 CarbonylContact O-C 3.6Å; D684-G688 WeakPolarHBondContact O-CA 3.29Å; D684-G688 PolarHBondContact O-N 3.06Å; L685-G688 PolarHBondContact O-N 3.18Å; G688-T704 CarbonylContact O-C 3.5Å; G688-T704 WeakPolarHBondContact O-CA 3.06Å; G688-I705 PolarHBondContact O-N 3.12Å
689	S	89.4	Confident	93.7	Very high	11 Å²	11	26.2 Å²	26.2	8%	0.077	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	145.1	-174.6	70.4	0	0	0	0	115.1	D684 K687 F703	D684-S689 PolarHBondContact N-O 2.87Å; D684-S689 PolarHBondContact O-N 2.87Å; K687-S689 VanDerWaalsContact C-N 3.35Å; K687-S689 PolarHBondContact O-N 3.5Å; S689-F703 WeakPolarHBondContact CA-O 3.5Å
690	I	95.1	Very high	93.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	133	177.7	-55.4	176.2	0	0	0	108.6	F642 L682 L683 W692 A702 F703 I705	F642-I690 HydrophobicContact CB-CD1 4.08Å; F642-I690 HydrophobicContact CD1-CD1 3.86Å; F642-I690 HydrophobicContact CD2-CD1 3.45Å; F642-I690 VanDerWaalsContact CD2-CD1 3.45Å; F642-I690 HydrophobicContact CE1-CD1 4.13Å; F642-I690 HydrophobicContact CE2-CD1 3.78Å; F642-I690 HydrophobicContact CG-CD1 3.51Å; F642-I690 HydrophobicContact CZ-CD1 4.09Å; L682-I690 WeakPolarHBondContact O-CA 3.37Å; L683-I690 HydrophobicContact CD1-CD1 4.21Å; L683-I690 HydrophobicContact CD1-CG1 3.71Å; I690-W692 HydrophobicContact CG2-CE3 4.48Å; I690-W692 HydrophobicContact CG2-CH2 3.57Å; I690-W692 HydrophobicContact CG2-CZ2 3.82Å; I690-W692 HydrophobicContact CG2-CZ3 3.93Å; I690-A702 PolarHBondContact O-N 2.73Å; I690-F703 HydrophobicContact CB-CB 4.45Å; I690-F703 PolarHBondContact N-O 2.86Å; I690-F703 PolarHBondContact O-N 3.19Å; I690-I705 HydrophobicContact CD1-CG1 3.99Å; I690-I705 HydrophobicContact CG1-CD1 4.29Å; I690-I705 HydrophobicContact CG1-CG1 3.88Å
691	S	96.7	Very high	92.8	Very high	13 Å²	13	39.6 Å²	39.6	9%	0.091	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	170.3	176.3	53.2	0	0	0	0	110.8	L682	L682-S691 WeakPolarHBondContact CB-O 3.35Å; L682-S691 WeakPolarHBondContact CB-OG 3.3Å; L682-S691 PolarHBondContact N-O 3.11Å; L682-S691 PolarHBondContact O-N 3.3Å; L682-S691 VanDerWaalsContact O-O 3.13Å
692	W	98.3	Very high	92.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	160.6	178.1	-67.6	-95.6	0	0	0	111.4	V624 F642 Y644 V660 Y669 G680 C681 I690 F699 A702 F703	V624-W692 PolarHBondContact O-NE1 3.39Å; F642-W692 HydrophobicContact CB-CH2 4.03Å; F642-W692 HydrophobicContact CB-CZ2 4.26Å; Y644-W692 VanDerWaalsContact CB-CE2 3.43Å; Y644-W692 VanDerWaalsContact CB-CG 3.46Å; Y644-W692 HydrophobicContact CD1-CB 3.68Å; Y644-W692 AromaticContact CD1-CD1 3.83Å; Y644-W692 AromaticContact CD1-CG 3.75Å; Y644-W692 HydrophobicContact CD1-CG 3.75Å; Y644-W692 HydrophobicContact CE1-CB 4.19Å; Y644-W692 HydrophobicContact CG-CB 3.9Å; Y644-W692 HydrophobicContact CG-CD2 4.05Å; Y644-W692 AromaticContact CG-CG 3.73Å; Y644-W692 HydrophobicContact CG-CG 3.73Å; V660-W692 HydrophobicContact CB-CZ3 4.2Å; V660-W692 HydrophobicContact CG1-CE3 3.65Å; V660-W692 HydrophobicContact CG1-CH2 4.32Å; V660-W692 HydrophobicContact CG1-CZ3 3.5Å; Y669-W692 HydrophobicContact CE1-CB 4.27Å; Y669-W692 HydrophobicContact CE1-CE3 4.07Å; Y669-W692 PolarHBondContact OH-N 3.25Å; G680-W692 CarbonylContact O-C 3.54Å; G680-W692 WeakPolarHBondContact O-CA 3.4Å; G680-W692 WeakPolarHBondContact O-CB 3.39Å; C681-W692 VanDerWaalsContact SG-CD1 3.59Å; I690-W692 HydrophobicContact CG2-CE3 4.48Å; I690-W692 HydrophobicContact CG2-CH2 3.57Å; I690-W692 HydrophobicContact CG2-CZ2 3.82Å; I690-W692 HydrophobicContact CG2-CZ3 3.93Å; W692-F699 WeakPolarHBondContact O-CB 3.15Å; W692-F699 WeakPolarHBondContact O-CD2 3.36Å; W692-F699 PolarHBondContact O-N 3.3Å; W692-A702 HydrophobicContact CE3-CB 3.78Å; W692-A702 HydrophobicContact CZ3-CB 3.42Å; W692-A702 VanDerWaalsContact CZ3-CB 3.42Å; W692-F703 AromaticContact CH2-CD2 3.81Å; W692-F703 HydrophobicContact CH2-CD2 3.81Å; W692-F703 AromaticContact CH2-CE2 3.79Å; W692-F703 HydrophobicContact CH2-CE2 3.79Å; W692-F703 AromaticContact CZ3-CD2 3.82Å; W692-F703 HydrophobicContact CZ3-CD2 3.82Å; W692-F703 AromaticContact CZ3-CE2 3.86Å; W692-F703 HydrophobicContact CZ3-CE2 3.86Å
693	S	97.1	Very high	91.8	Very high	1 Å²	1	42 Å²	42	1%	0.007	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	159	166.2	68.3	0	0	0	0	109.9	I679 G680 K697	I679-S693 WeakPolarHBondContact CA-O 3.3Å; G680-S693 VanDerWaalsContact CA-OG 3.23Å; G680-S693 WeakPolarHBondContact CA-OG 3.36Å; G680-S693 PolarHBondContact N-O 2.74Å; G680-S693 PolarHBondContact N-OG 2.88Å; G680-S693 PolarHBondContact O-N 2.93Å; S693-K697 WeakPolarHBondContact CA-O 3.41Å; S693-K697 WeakPolarHBondContact CB-O 3.49Å
694	C	96.1	Very high	91.3	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.007	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	123.6	169.1	-165.1	0	0	0	0	108.2	I671 V678 G696 K697 F699	I671-C694 HydrophobicContact CD1-CB 3.67Å; I671-C694 HydrophobicContact CG1-CB 3.72Å; V678-C694 CarbonylContact O-C 3.54Å; V678-C694 WeakPolarHBondContact O-CA 3.46Å; C694-G696 PolarHBondContact O-N 3.46Å; C694-K697 PolarHBondContact N-O 3.43Å; C694-K697 VanDerWaalsContact N-O 3.16Å; C694-K697 WeakPolarHBondContact O-CB 3.46Å; C694-K697 PolarHBondContact O-N 2.86Å; C694-F699 HydrophobicContact CB-CE2 3.98Å; C694-F699 HydrophobicContact CB-CZ 3.85Å
695	N	96.2	Very high	90.9	Very high	63 Å²	63	45.9 Å²	45.9	34%	0.337	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	46.4	-174.7	-56.6	-31	0	0	0	112.1	D677 V678 K697 F737	D677-N695 WeakPolarHBondContact CA-OD1 3.26Å; D677-N695 PolarHBondContact OD1-ND2 3.42Å; V678-N695 PolarHBondContact N-OD1 3.35Å; V678-N695 PolarHBondContact O-N 2.87Å; N695-K697 PolarHBondContact O-N 3.48Å; N695-F737 HydrophobicContact CB-CE2 4.43Å; N695-F737 HydrophobicContact CB-CZ 4.27Å
696	G	93.4	Very high	90.4	Very high	34 Å²	34	45.9 Å²	45.9	35%	0.351	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	-9.1	-179.1	0	0	0	0	0	116.4	C694 I698	C694-G696 PolarHBondContact O-N 3.46Å; G696-I698 PolarHBondContact O-N 3.32Å; G696-I698 VanDerWaalsContact O-N 3.12Å
697	K	93.6	Very high	89.8	Confident	128 Å²	128	47.8 Å²	47.8	56%	0.557	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	98.4	174.4	-174.1	179.2	177.5	-177	0	110.3	S693 C694 N695 F699	S693-K697 WeakPolarHBondContact CA-O 3.41Å; S693-K697 WeakPolarHBondContact CB-O 3.49Å; C694-K697 PolarHBondContact N-O 3.43Å; C694-K697 VanDerWaalsContact N-O 3.16Å; C694-K697 WeakPolarHBondContact O-CB 3.46Å; C694-K697 PolarHBondContact O-N 2.86Å; N695-K697 PolarHBondContact O-N 3.48Å; K697-F699 HydrophobicContact CB-CE1 4.45Å; K697-F699 HydrophobicContact CD-CE1 4Å; K697-F699 HydrophobicContact CG-CD1 4.48Å; K697-F699 HydrophobicContact CG-CE1 3.97Å
698	I	92.8	Very high	89.6	Confident	77 Å²	77	48.6 Å²	48.6	40%	0.395	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	132.8	175.7	-58.1	169.7	0	0	0	110	L682 G696 P739	L682-I698 HydrophobicContact CD2-CD1 4.26Å; L682-I698 HydrophobicContact CD2-CG1 4.39Å; L682-I698 HydrophobicContact CD2-CG2 3.91Å; G696-I698 PolarHBondContact O-N 3.32Å; G696-I698 VanDerWaalsContact O-N 3.12Å; I698-P739 HydrophobicContact CD1-CB 3.59Å
699	F	92.3	Very high	89.5	Confident	25 Å²	25	48.1 Å²	48.1	11%	0.11	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-96.2	162	176	-52.8	-51.5	0	0	0	111.4	Y644 Y669 G670 I671 W692 C694 K697	Y644-F699 HydrophobicContact CE1-CE2 4.39Å; Y644-F699 HydrophobicContact CE2-CE2 4.43Å; Y644-F699 AromaticContact CZ-CE2 3.83Å; Y644-F699 WeakPolarHBondContact OH-CE2 3.25Å; Y669-F699 HydrophobicContact CD1-CD2 4.13Å; Y669-F699 HydrophobicContact CE1-CB 3.7Å; Y669-F699 AromaticContact CE1-CD2 3.57Å; Y669-F699 HydrophobicContact CE1-CD2 3.57Å; Y669-F699 AromaticContact CE1-CG 3.99Å; Y669-F699 HydrophobicContact CE1-CG 3.99Å; Y669-F699 HydrophobicContact CE2-CB 4.06Å; Y669-F699 VanDerWaalsContact OH-CB 3.28Å; Y669-F699 WeakPolarHBondContact OH-CB 3.39Å; G670-F699 VanDerWaalsContact CA-CZ 3.48Å; I671-F699 HydrophobicContact CB-CZ 4.45Å; I671-F699 HydrophobicContact CD1-CZ 4.4Å; I671-F699 HydrophobicContact CG1-CZ 3.98Å; I671-F699 HydrophobicContact CG2-CE1 4.24Å; I671-F699 HydrophobicContact CG2-CZ 4.23Å; W692-F699 WeakPolarHBondContact O-CB 3.15Å; W692-F699 WeakPolarHBondContact O-CD2 3.36Å; W692-F699 PolarHBondContact O-N 3.3Å; C694-F699 HydrophobicContact CB-CE2 3.98Å; C694-F699 HydrophobicContact CB-CZ 3.85Å; K697-F699 HydrophobicContact CB-CE1 4.45Å; K697-F699 HydrophobicContact CD-CE1 4Å; K697-F699 HydrophobicContact CG-CD1 4.48Å; K697-F699 HydrophobicContact CG-CE1 3.97Å
700	Q	86.8	Confident	88.8	Confident	163 Å²	163	52.4 Å²	52.4	76%	0.762	26%	0.262	S	S	*	.	P	Polyproline II helix	trans	-59.3	159.9	174.6	66.6	-173.6	-9.8	0	0	111.8	Y669 A702	Y669-Q700 HydrophobicContact CE2-CG 4.4Å; Y669-Q700 VanDerWaalsContact CE2-O 3.22Å; Y669-Q700 WeakPolarHBondContact CE2-O 3.14Å; Y669-Q700 VanDerWaalsContact CZ-O 3.26Å; Y669-Q700 PolarHBondContact OH-O 2.99Å; Q700-A702 PolarHBondContact O-N 2.9Å; Q700-A702 VanDerWaalsContact O-N 3.13Å
701	R	89.9	Confident	87.9	Confident	120 Å²	120	54.1 Å²	54.1	45%	0.453	28%	0.28	S	S	.	.			trans	-44.9	122.9	175.4	177.6	-176.7	-62	157.3	-6.6	111.3	F703	R701-F703 WeakPolarHBondContact CG-O 3.45Å
702	A	86.4	Confident	87.4	Confident	26 Å²	26	55.6 Å²	55.6	22%	0.215	29%	0.285	C	S	.	.			trans	-85.7	-47.8	175.6	0	0	0	0	0	111.2	V660 Y669 I690 W692 Q700	V660-A702 HydrophobicContact CG1-CB 4.07Å; Y669-A702 HydrophobicContact CD2-CB 4.26Å; Y669-A702 HydrophobicContact CE1-CB 4.3Å; Y669-A702 HydrophobicContact CE2-CB 3.67Å; I690-A702 PolarHBondContact O-N 2.73Å; W692-A702 HydrophobicContact CE3-CB 3.78Å; W692-A702 HydrophobicContact CZ3-CB 3.42Å; W692-A702 VanDerWaalsContact CZ3-CB 3.42Å; Q700-A702 PolarHBondContact O-N 2.9Å; Q700-A702 VanDerWaalsContact O-N 3.13Å
703	F	90.6	Very high	87.1	Confident	26 Å²	26	56.1 Å²	56.1	11%	0.114	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	145.1	-178.1	-56.8	-67.1	0	0	0	111.6	F642 V660 H662 S689 I690 W692 R701	F642-F703 HydrophobicContact CB-CD2 4.48Å; F642-F703 HydrophobicContact CD1-CB 4.11Å; F642-F703 AromaticContact CD1-CD2 3.58Å; F642-F703 HydrophobicContact CD1-CD2 3.58Å; F642-F703 HydrophobicContact CD1-CE2 4.12Å; F642-F703 AromaticContact CD1-CG 3.89Å; F642-F703 HydrophobicContact CD1-CG 3.89Å; F642-F703 HydrophobicContact CE1-CB 4.11Å; F642-F703 HydrophobicContact CE1-CD2 4.34Å; F642-F703 HydrophobicContact CE1-CG 4.19Å; F642-F703 HydrophobicContact CG-CD2 4.47Å; V660-F703 HydrophobicContact CB-CE2 3.73Å; V660-F703 HydrophobicContact CB-CZ 3.77Å; V660-F703 HydrophobicContact CG1-CE2 4.47Å; V660-F703 HydrophobicContact CG2-CE1 4.49Å; V660-F703 HydrophobicContact CG2-CE2 4.11Å; V660-F703 HydrophobicContact CG2-CZ 3.73Å; H662-F703 HydrophobicContact CB-CE1 3.99Å; H662-F703 HydrophobicContact CB-CE2 4.26Å; H662-F703 HydrophobicContact CB-CZ 3.84Å; S689-F703 WeakPolarHBondContact CA-O 3.5Å; I690-F703 HydrophobicContact CB-CB 4.45Å; I690-F703 PolarHBondContact N-O 2.86Å; I690-F703 PolarHBondContact O-N 3.19Å; W692-F703 AromaticContact CH2-CD2 3.81Å; W692-F703 HydrophobicContact CH2-CD2 3.81Å; W692-F703 AromaticContact CH2-CE2 3.79Å; W692-F703 HydrophobicContact CH2-CE2 3.79Å; W692-F703 AromaticContact CZ3-CD2 3.82Å; W692-F703 HydrophobicContact CZ3-CD2 3.82Å; W692-F703 AromaticContact CZ3-CE2 3.86Å; W692-F703 HydrophobicContact CZ3-CE2 3.86Å; R701-F703 WeakPolarHBondContact CG-O 3.45Å
704	T	86	Confident	87.2	Confident	82 Å²	82	56.1 Å²	56.1	50%	0.503	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	131.9	159.2	-56.9	0	0	0	0	107.6	G688 P706	G688-T704 CarbonylContact O-C 3.5Å; G688-T704 WeakPolarHBondContact O-CA 3.06Å; T704-P706 VanDerWaalsContact O-CD 3.3Å; T704-P706 WeakPolarHBondContact O-CD 3.35Å
705	I	85.1	Confident	87.3	Confident	5 Å²	5	56.1 Å²	56.1	3%	0.026	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-61.6	119.6	178	-62	177.9	0	0	0	108.1	L683 L685 G688 I690 L709 F714	L683-I705 HydrophobicContact CD1-CD1 3.78Å; L685-I705 HydrophobicContact CD2-CD1 3.53Å; G688-I705 PolarHBondContact O-N 3.12Å; I690-I705 HydrophobicContact CD1-CG1 3.99Å; I690-I705 HydrophobicContact CG1-CD1 4.29Å; I690-I705 HydrophobicContact CG1-CG1 3.88Å; I705-L709 HydrophobicContact CG2-CB 4.02Å; I705-F714 HydrophobicContact CD1-CE2 4.28Å; I705-F714 HydrophobicContact CD1-CZ 4.44Å; I705-F714 HydrophobicContact CG2-CE2 4.32Å; I705-F714 HydrophobicContact CG2-CZ 3.95Å
706	P	80.3	Confident	87.4	Confident	15 Å²	15	53.1 Å²	53.1	10%	0.097	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-59.7	145	179.4	-24.1	34.2	0	0	0	112	F642 T704 Q708 L709	F642-P706 HydrophobicContact CZ-CG 4.28Å; T704-P706 VanDerWaalsContact O-CD 3.3Å; T704-P706 WeakPolarHBondContact O-CD 3.35Å; P706-Q708 HydrophobicContact CB-CG 4.43Å; P706-Q708 VanDerWaalsContact CB-NE2 3.27Å; P706-Q708 PolarHBondContact O-N 2.89Å; P706-Q708 VanDerWaalsContact O-N 3.11Å; P706-L709 PolarHBondContact O-N 3.36Å
707	D	72	Confident	87.6	Confident	108 Å²	108	51.7 Å²	51.7	58%	0.578	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-50.7	-39	-178.3	-71	26.4	0	0	0	113.2	L709 R710	D707-L709 PolarHBondContact O-N 2.88Å; D707-R710 WeakPolarHBondContact O-CB 3.5Å; D707-R710 PolarHBondContact O-N 3.34Å; D707-R710 VanDerWaalsContact O-N 3.13Å; D707-R710 IonicContact OD1-CZ 3.37Å; D707-R710 IonicContact OD1-NH1 3.21Å; D707-R710 PolarHBondContact OD1-NH1 2.81Å; D707-R710 IonicContact OD1-NH2 3.55Å; D707-R710 PolarHBondContact OD1-NH2 3.22Å; D707-R710 IonicContact OD2-CZ 2.87Å; D707-R710 IonicContact OD2-NH1 3.42Å; D707-R710 PolarHBondContact OD2-NH1 3.27Å
708	Q	78.2	Confident	87.9	Confident	111 Å²	111	45.6 Å²	45.6	52%	0.519	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-67.5	-18	179.4	70.9	-87.4	13.4	0	0	114.6	P706	P706-Q708 HydrophobicContact CB-CG 4.43Å; P706-Q708 VanDerWaalsContact CB-NE2 3.27Å; P706-Q708 PolarHBondContact O-N 2.89Å; P706-Q708 VanDerWaalsContact O-N 3.11Å
709	L	83.9	Confident	88.1	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.01	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-98.2	3.6	176.4	-55	-173	0	0	0	112.1	T628 N639 Y640 F642 I705 P706 D707 G711 E712 F714	T628-L709 HydrophobicContact CG2-CD2 4.3Å; N639-L709 WeakPolarHBondContact O-CD1 3.44Å; Y640-L709 HydrophobicContact CD1-CD2 3.41Å; Y640-L709 VanDerWaalsContact CD1-CD2 3.41Å; Y640-L709 HydrophobicContact CE1-CD2 3.77Å; Y640-L709 HydrophobicContact CG-CD2 4.49Å; F642-L709 HydrophobicContact CE2-CD1 3.74Å; F642-L709 HydrophobicContact CZ-CD1 3.91Å; I705-L709 HydrophobicContact CG2-CB 4.02Å; P706-L709 PolarHBondContact O-N 3.36Å; D707-L709 PolarHBondContact O-N 2.88Å; L709-G711 PolarHBondContact O-N 3.43Å; L709-E712 WeakPolarHBondContact O-CB 3.23Å; L709-E712 PolarHBondContact O-N 3.22Å; L709-F714 HydrophobicContact CB-CZ 4.03Å; L709-F714 HydrophobicContact CD1-CE1 4.32Å; L709-F714 HydrophobicContact CD1-CZ 4.17Å
710	R	74.3	Confident	88.3	Confident	101 Å²	101	40.7 Å²	40.7	38%	0.381	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	130.3	176.3	-70.8	-168.7	-178.4	113.9	16.9	110.2	D707 E712	D707-R710 WeakPolarHBondContact O-CB 3.5Å; D707-R710 PolarHBondContact O-N 3.34Å; D707-R710 VanDerWaalsContact O-N 3.13Å; D707-R710 IonicContact OD1-CZ 3.37Å; D707-R710 IonicContact OD1-NH1 3.21Å; D707-R710 PolarHBondContact OD1-NH1 2.81Å; D707-R710 IonicContact OD1-NH2 3.55Å; D707-R710 PolarHBondContact OD1-NH2 3.22Å; D707-R710 IonicContact OD2-CZ 2.87Å; D707-R710 IonicContact OD2-NH1 3.42Å; D707-R710 PolarHBondContact OD2-NH1 3.27Å; R710-E712 VanDerWaalsContact C-N 3.28Å
711	G	75.8	Confident	88.6	Confident	35 Å²	35	36 Å²	36	36%	0.361	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.2	-6.5	-175.8	0	0	0	0	0	114.3	L709	L709-G711 PolarHBondContact O-N 3.43Å
712	E	86.8	Confident	88.8	Confident	44 Å²	44	31.8 Å²	31.8	21%	0.206	17%	0.171	C	C	.	.			trans	-73.1	156.1	170.4	-67.7	-59.8	147.6	0	0	111.4	T628 L709 R710	T628-E712 HydrophobicContact CG2-CB 3.95Å; T628-E712 HydrophobicContact CG2-CG 4.38Å; L709-E712 WeakPolarHBondContact O-CB 3.23Å; L709-E712 PolarHBondContact O-N 3.22Å; R710-E712 VanDerWaalsContact C-N 3.28Å
713	A	92.4	Very high	89.2	Confident	12 Å²	12	30.6 Å²	30.6	10%	0.099	16%	0.161	C	C	.	.			trans	-88.1	142.2	169.5	0	0	0	0	0	110.2	V604 K605 V755	V604-A713 WeakPolarHBondContact O-CA 3.44Å; K605-A713 HydrophobicContact CB-CB 4.36Å; A713-V755 HydrophobicContact CB-CB 3.74Å; A713-V755 HydrophobicContact CB-CG1 3.8Å; A713-V755 HydrophobicContact CB-CG2 3.79Å
714	F	97.5	Very high	89.5	Confident	1 Å²	1	30.9 Å²	30.9	0%	0.004	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-113.2	125	176.8	-72.8	-87.1	0	0	0	110.1	G603 V604 W626 T628 F642 L683 L685 I705 L709	G603-F714 CarbonylContact C-O 3.5Å; G603-F714 WeakPolarHBondContact CA-O 3.39Å; V604-F714 PolarHBondContact N-O 2.74Å; V604-F714 PolarHBondContact O-N 3.02Å; W626-F714 HydrophobicContact CB-CB 4.39Å; W626-F714 HydrophobicContact CB-CD1 4.02Å; W626-F714 HydrophobicContact CE3-CB 3.96Å; T628-F714 HydrophobicContact CG2-CD1 4.39Å; T628-F714 HydrophobicContact CG2-CE1 4.04Å; T628-F714 HydrophobicContact CG2-CZ 4.35Å; F642-F714 HydrophobicContact CD2-CE1 4.22Å; F642-F714 AromaticContact CE2-CE1 3.88Å; F642-F714 HydrophobicContact CE2-CE1 3.88Å; L683-F714 HydrophobicContact CD1-CG 4.47Å; L683-F714 HydrophobicContact CD2-CB 3.55Å; L683-F714 HydrophobicContact CD2-CD2 4.26Å; L683-F714 HydrophobicContact CD2-CG 4.03Å; L685-F714 HydrophobicContact CD2-CD2 3.91Å; L685-F714 HydrophobicContact CD2-CE2 4.12Å; I705-F714 HydrophobicContact CD1-CE2 4.28Å; I705-F714 HydrophobicContact CD1-CZ 4.44Å; I705-F714 HydrophobicContact CG2-CE2 4.32Å; I705-F714 HydrophobicContact CG2-CZ 3.95Å; L709-F714 HydrophobicContact CB-CZ 4.03Å; L709-F714 HydrophobicContact CD1-CE1 4.32Å; L709-F714 HydrophobicContact CD1-CZ 4.17Å
715	L	98.5	Very high	90.1	Very high	1 Å²	1	27 Å²	27	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	137	177.6	-60.6	90.6	0	0	0	109	A600 W626 S627 N629 A717 N757	A600-L715 WeakPolarHBondContact O-CD2 3.12Å; W626-L715 WeakPolarHBondContact CA-O 3.45Å; S627-L715 PolarHBondContact N-O 2.75Å; S627-L715 PolarHBondContact O-N 2.9Å; N629-L715 WeakPolarHBondContact OD1-CD1 3.29Å; L715-A717 PolarHBondContact O-N 2.74Å; L715-N757 HydrophobicContact CD2-CB 3.58Å
716	P	98.7	Very high	90.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.5	132.8	161.6	-27	35.2	0	0	0	110.6	W567 A600 Y612 W626 F729	W567-P716 HydrophobicContact CZ3-CG 4.24Å; A600-P716 HydrophobicContact CB-CB 3.97Å; A600-P716 HydrophobicContact CB-CG 4.18Å; A600-P716 PolarHBondContact N-O 2.9Å; Y612-P716 HydrophobicContact CD1-CB 4Å; Y612-P716 HydrophobicContact CD1-CG 3.91Å; Y612-P716 HydrophobicContact CE1-CB 3.55Å; Y612-P716 HydrophobicContact CE1-CG 3.86Å; Y612-P716 HydrophobicContact CE2-CB 4.15Å; Y612-P716 HydrophobicContact CG-CB 4.45Å; Y612-P716 HydrophobicContact CG-CG 4.48Å; W626-P716 HydrophobicContact CE3-CG 4.5Å; W626-P716 HydrophobicContact CZ3-CG 3.97Å; P716-F729 HydrophobicContact CB-CD1 4.47Å; P716-F729 HydrophobicContact CB-CE1 3.6Å; P716-F729 HydrophobicContact CB-CZ 4.36Å; P716-F729 HydrophobicContact CG-CD1 4.31Å; P716-F729 HydrophobicContact CG-CE1 3.87Å
717	A	98.6	Very high	91.6	Very high	3 Å²	3	27.7 Å²	27.7	3%	0.025	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	155.6	-174.9	0	0	0	0	0	111	C598 R599 Y612 G625 S627 L635 L715	C598-A717 VanDerWaalsContact O-CA 3.31Å; C598-A717 WeakPolarHBondContact O-CA 3.28Å; R599-A717 HydrophobicContact CG-CB 3.94Å; Y612-A717 PolarHBondContact OH-O 2.71Å; G625-A717 PolarHBondContact N-O 3.49Å; G625-A717 PolarHBondContact O-N 3.42Å; S627-A717 VanDerWaalsContact OG-CB 3.26Å; S627-A717 WeakPolarHBondContact OG-CB 3.18Å; L635-A717 HydrophobicContact CD1-CB 3.96Å; L635-A717 HydrophobicContact CD2-CB 4.38Å; L635-A717 WeakPolarHBondContact CD2-O 3.35Å; L715-A717 PolarHBondContact O-N 2.74Å
718	A	98.5	Very high	92.8	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	159.3	170.2	0	0	0	0	0	112.1	G597 C598 R623 V624 L720 I725 F727	G597-A718 CarbonylContact C-O 3.46Å; G597-A718 WeakPolarHBondContact CA-O 3.16Å; C598-A718 PolarHBondContact N-O 3.29Å; C598-A718 PolarHBondContact O-N 2.73Å; R623-A718 CarbonylContact O-C 3.52Å; R623-A718 WeakPolarHBondContact O-CA 3.47Å; R623-A718 WeakPolarHBondContact O-CB 3.49Å; V624-A718 HydrophobicContact CG2-CB 4.24Å; A718-L720 HydrophobicContact CB-CD2 4.4Å; A718-I725 HydrophobicContact CB-CD1 3.61Å; A718-F727 HydrophobicContact CB-CE2 4.38Å; A718-F727 HydrophobicContact CB-CZ 3.64Å
719	S	97.9	Very high	93.8	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	130.5	162.3	-71.3	0	0	0	0	109.2	W595 Q596 I622 R623 L633 E634 L635	W595-S719 VanDerWaalsContact CZ3-O 3.32Å; W595-S719 WeakPolarHBondContact CZ3-O 3.5Å; Q596-S719 CarbonylContact O-C 3.55Å; Q596-S719 WeakPolarHBondContact O-CA 3.27Å; I622-S719 CarbonylContact C-O 3.41Å; R623-S719 PolarHBondContact N-O 2.96Å; R623-S719 PolarHBondContact O-N 3.17Å; L633-S719 PolarHBondContact O-OG 3.13Å; E634-S719 WeakPolarHBondContact CA-OG 3.41Å; L635-S719 PolarHBondContact N-OG 2.86Å
720	L	96.9	Very high	94.3	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	143.2	-174.8	-51.7	177.8	0	0	0	108.7	L578 V587 Q596 I622 A718 I725	L578-L720 HydrophobicContact CD2-CD1 4.33Å; V587-L720 HydrophobicContact CB-CD1 4.21Å; V587-L720 HydrophobicContact CG1-CD1 3.82Å; V587-L720 VanDerWaalsContact O-CD1 3.24Å; V587-L720 WeakPolarHBondContact O-CD1 3.35Å; Q596-L720 PolarHBondContact N-O 2.98Å; Q596-L720 PolarHBondContact O-N 2.8Å; I622-L720 HydrophobicContact CB-CD2 3.94Å; I622-L720 HydrophobicContact CG2-CD2 3.57Å; A718-L720 HydrophobicContact CB-CD2 4.4Å; L720-I725 HydrophobicContact CD1-CG1 3.98Å; L720-I725 HydrophobicContact CD2-CB 4.44Å; L720-I725 HydrophobicContact CD2-CD1 3.89Å; L720-I725 HydrophobicContact CD2-CG1 3.92Å; L720-I725 HydrophobicContact CD2-CG2 3.71Å
721	K	93.3	Very high	95.1	Very high	64 Å²	64	17 Å²	17	28%	0.278	9%	0.092	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	115.6	169.7	173.1	176.7	170.7	-165	0	108.7	G594 W595 L621 S723	G594-K721 WeakPolarHBondContact O-CB 3.14Å; W595-K721 HydrophobicContact CD2-CB 3.84Å; W595-K721 HydrophobicContact CD2-CD 4.44Å; W595-K721 HydrophobicContact CE3-CB 3.77Å; W595-K721 HydrophobicContact CG-CB 4.34Å; W595-K721 HydrophobicContact CG-CD 4.5Å; W595-K721 HydrophobicContact CZ3-CB 4.17Å; L621-K721 HydrophobicContact CB-CB 4.22Å; L621-K721 HydrophobicContact CD1-CD 4.21Å; L621-K721 PolarHBondContact N-O 3.19Å; L621-K721 PolarHBondContact O-N 3.06Å; K721-S723 PolarHBondContact O-N 2.74Å
722	D	92.7	Very high	95.5	Very high	31 Å²	31	21.7 Å²	21.7	17%	0.166	11%	0.105	C	C	.	.	S	Bend	trans	57.1	29.2	-179.2	-47.9	-41.8	0	0	0	113.2	M480 S589 R591 G592	M480-D722 HydrophobicContact CE-CB 3.64Å; M480-D722 VanDerWaalsContact CE-O 3.26Å; M480-D722 WeakPolarHBondContact CE-O 3.32Å; S589-D722 PolarHBondContact OG-N 3.26Å; R591-D722 WeakPolarHBondContact CA-OD1 3.45Å; R591-D722 HydrophobicContact CG-CB 4.2Å; G592-D722 PolarHBondContact N-OD1 2.89Å
723	S	94.1	Very high	95.5	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.007	12%	0.117	C	C	.	.			trans	-137.5	172	-175.3	-175.1	0	0	0	0	111.9	S589 E618 I622 K721	S589-S723 PolarHBondContact N-O 2.97Å; S589-S723 PolarHBondContact OG-N 3.11Å; S589-S723 PolarHBondContact OG-O 2.82Å; E618-S723 PolarHBondContact O-OG 2.94Å; I622-S723 WeakPolarHBondContact CG2-OG 3.42Å; K721-S723 PolarHBondContact O-N 2.74Å
724	R	97.6	Very high	95.5	Very high	33 Å²	33	29.7 Å²	29.7	13%	0.125	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	139.2	179.2	179.1	178.5	164.8	-145.6	-17	110.6	M274 D586 V587 A588 L617 E618	M274-R724 PolarHBondContact SD-NH1 2.85Å; M274-R724 PolarHBondContact SD-NH2 2.77Å; D586-R724 WeakPolarHBondContact OD1-CG 3.31Å; D586-R724 IonicContact OD1-CZ 3.69Å; D586-R724 IonicContact OD1-NE 3.64Å; D586-R724 PolarHBondContact OD1-NE 3.36Å; D586-R724 IonicContact OD1-NH2 3.87Å; D586-R724 IonicContact OD2-CZ 2.95Å; D586-R724 IonicContact OD2-NE 2.7Å; D586-R724 PolarHBondContact OD2-NE 2.88Å; D586-R724 IonicContact OD2-NH2 3.88Å; D586-R724 PolarHBondContact OD2-NH2 2.9Å; V587-R724 CarbonylContact O-C 3.53Å; V587-R724 VanDerWaalsContact O-CA 3.24Å; V587-R724 WeakPolarHBondContact O-CA 3.41Å; V587-R724 WeakPolarHBondContact O-CG 3.35Å; A588-R724 HydrophobicContact CB-CB 3.91Å; A588-R724 HydrophobicContact CB-CG 3.74Å; L617-R724 HydrophobicContact CB-CB 4.34Å; L617-R724 HydrophobicContact CB-CG 4.05Å; L617-R724 HydrophobicContact CD1-CG 4.13Å; L617-R724 PolarHBondContact N-O 3.04Å; E618-R724 HydrophobicContact CB-CB 3.92Å; E618-R724 HydrophobicContact CG-CB 3.95Å; E618-R724 PolarHBondContact N-O 2.88Å; E618-R724 WeakPolarHBondContact OE1-CD 3.23Å; E618-R724 IonicContact OE1-NH1 2.71Å; E618-R724 PolarHBondContact OE1-NH1 2.71Å
725	I	98.1	Very high	95.4	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	157.3	178.2	64.9	169.2	0	0	0	111.8	V587 A614 V615 I622 V624 A718 L720 F727	V587-I725 HydrophobicContact CB-CG1 4.4Å; V587-I725 PolarHBondContact N-O 2.93Å; V587-I725 PolarHBondContact O-N 3.19Å; A614-I725 HydrophobicContact CB-CD1 4.25Å; V615-I725 CarbonylContact O-C 3.38Å; V615-I725 WeakPolarHBondContact O-CA 3.26Å; V615-I725 WeakPolarHBondContact O-CB 3.23Å; I622-I725 HydrophobicContact CD1-CG2 4.18Å; I622-I725 HydrophobicContact CG2-CG2 4.03Å; V624-I725 HydrophobicContact CG2-CD1 4Å; A718-I725 HydrophobicContact CB-CD1 3.61Å; L720-I725 HydrophobicContact CD1-CG1 3.98Å; L720-I725 HydrophobicContact CD2-CB 4.44Å; L720-I725 HydrophobicContact CD2-CD1 3.89Å; L720-I725 HydrophobicContact CD2-CG1 3.92Å; L720-I725 HydrophobicContact CD2-CG2 3.71Å; I725-F727 HydrophobicContact CD1-CD2 4.13Å; I725-F727 HydrophobicContact CD1-CE1 4.27Å; I725-F727 HydrophobicContact CD1-CE2 3.41Å; I725-F727 VanDerWaalsContact CD1-CE2 3.41Å; I725-F727 HydrophobicContact CD1-CZ 3.52Å; I725-F727 HydrophobicContact CG1-CD2 4.41Å; I725-F727 HydrophobicContact CG1-CE2 3.99Å
726	L	98.3	Very high	95.4	Very high	30 Å²	30	35.6 Å²	35.6	16%	0.157	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	118.2	170.4	-179.2	71.1	0	0	0	109.7	L585 D586 A614 V615 L617	L585-L726 HydrophobicContact CB-CD1 3.99Å; L585-L726 CarbonylContact O-C 3.56Å; L585-L726 WeakPolarHBondContact O-CA 3.11Å; D586-L726 HydrophobicContact CB-CD1 3.98Å; A614-L726 CarbonylContact C-O 3.5Å; A614-L726 VanDerWaalsContact CA-O 3.28Å; A614-L726 WeakPolarHBondContact CA-O 3.32Å; V615-L726 HydrophobicContact CB-CB 4.28Å; V615-L726 PolarHBondContact N-O 2.85Å; V615-L726 PolarHBondContact O-N 3.39Å; L617-L726 HydrophobicContact CD1-CB 3.81Å; L617-L726 HydrophobicContact CD2-CB 4.19Å; L617-L726 HydrophobicContact CG-CB 4Å
727	F	98.5	Very high	95.3	Very high	3 Å²	3	38.6 Å²	38.6	1%	0.013	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	142	172.5	-72.9	-88.5	0	0	0	111.6	I569 L585 V587 Y612 A614 V624 A718 I725 F729	I569-F727 HydrophobicContact CD1-CD1 4.3Å; I569-F727 HydrophobicContact CD1-CD2 3.88Å; I569-F727 HydrophobicContact CD1-CE1 4.01Å; I569-F727 HydrophobicContact CD1-CE2 3.57Å; I569-F727 HydrophobicContact CD1-CG 4.22Å; I569-F727 HydrophobicContact CD1-CZ 3.62Å; I569-F727 HydrophobicContact CG1-CD2 3.44Å; I569-F727 VanDerWaalsContact CG1-CD2 3.44Å; I569-F727 HydrophobicContact CG1-CE2 3.38Å; I569-F727 HydrophobicContact CG1-CG 4.12Å; I569-F727 HydrophobicContact CG1-CZ 4.01Å; L585-F727 HydrophobicContact CD2-CB 4.39Å; L585-F727 PolarHBondContact O-N 3.08Å; V587-F727 HydrophobicContact CB-CE2 4.45Å; V587-F727 HydrophobicContact CG2-CD2 4.05Å; V587-F727 HydrophobicContact CG2-CE2 3.9Å; Y612-F727 HydrophobicContact CD2-CD1 4.09Å; Y612-F727 AromaticContact CE2-CD1 3.7Å; Y612-F727 HydrophobicContact CE2-CD1 3.7Å; Y612-F727 AromaticContact CE2-CE1 3.72Å; Y612-F727 HydrophobicContact CE2-CE1 3.72Å; A614-F727 HydrophobicContact CB-CD1 4.44Å; V624-F727 HydrophobicContact CG1-CE1 4.32Å; A718-F727 HydrophobicContact CB-CE2 4.38Å; A718-F727 HydrophobicContact CB-CZ 3.64Å; I725-F727 HydrophobicContact CD1-CD2 4.13Å; I725-F727 HydrophobicContact CD1-CE1 4.27Å; I725-F727 HydrophobicContact CD1-CE2 3.41Å; I725-F727 VanDerWaalsContact CD1-CE2 3.41Å; I725-F727 HydrophobicContact CD1-CZ 3.52Å; I725-F727 HydrophobicContact CG1-CD2 4.41Å; I725-F727 HydrophobicContact CG1-CE2 3.99Å; F727-F729 HydrophobicContact CB-CD2 4.4Å; F727-F729 HydrophobicContact CB-CE1 4.18Å; F727-F729 HydrophobicContact CB-CE2 3.72Å; F727-F729 HydrophobicContact CB-CZ 3.6Å; F727-F729 AromaticContact CD1-CE1 3.75Å; F727-F729 HydrophobicContact CD1-CE1 3.75Å; F727-F729 AromaticContact CD1-CZ 3.6Å; F727-F729 HydrophobicContact CD1-CZ 3.6Å; F727-F729 HydrophobicContact CE1-CZ 4.42Å; F727-F729 HydrophobicContact CG-CE1 4.27Å; F727-F729 HydrophobicContact CG-CE2 4.28Å; F727-F729 AromaticContact CG-CZ 3.71Å; F727-F729 HydrophobicContact CG-CZ 3.71Å
728	N	98.1	Very high	95.1	Very high	10 Å²	10	42.5 Å²	42.5	5%	0.053	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	104.6	169.1	-177.9	6.6	0	0	0	109.1	E613 G730 R733 P734	E613-N728 HydrophobicContact CB-CB 4.13Å; E613-N728 PolarHBondContact N-O 2.95Å; E613-N728 PolarHBondContact O-N 3.45Å; N728-G730 PolarHBondContact OD1-N 2.84Å; N728-G730 VanDerWaalsContact OD1-N 3.15Å; N728-R733 PolarHBondContact OD1-O 3.2Å; N728-R733 VanDerWaalsContact OD1-O 3.11Å; N728-P734 PolarHBondContact ND2-O 3.45Å
729	F	98.3	Very high	94.7	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.018	22%	0.217	C	C	.	.			trans	-88.3	-4.6	-178.7	-60.9	-59.3	0	0	0	113.6	W567 I569 L585 A600 Y612 P716 F727 V746 A747	W567-F729 HydrophobicContact CB-CB 3.75Å; W567-F729 HydrophobicContact CB-CD2 3.61Å; W567-F729 HydrophobicContact CB-CE2 4.43Å; W567-F729 HydrophobicContact CB-CG 3.81Å; W567-F729 HydrophobicContact CE3-CD1 4.45Å; W567-F729 HydrophobicContact CE3-CG 4.47Å; W567-F729 HydrophobicContact CG-CB 4.3Å; W567-F729 VanDerWaalsContact O-CD2 3.31Å; W567-F729 WeakPolarHBondContact O-CD2 3.41Å; I569-F729 HydrophobicContact CD1-CZ 4.03Å; L585-F729 HydrophobicContact CD2-CD2 3.68Å; L585-F729 HydrophobicContact CD2-CE2 3.66Å; A600-F729 HydrophobicContact CB-CZ 4.38Å; Y612-F729 HydrophobicContact CD2-CD1 4.18Å; Y612-F729 HydrophobicContact CD2-CE1 4.03Å; Y612-F729 HydrophobicContact CE2-CE1 4.48Å; Y612-F729 HydrophobicContact CG-CD1 4.14Å; Y612-F729 HydrophobicContact CG-CE1 4.3Å; P716-F729 HydrophobicContact CB-CD1 4.47Å; P716-F729 HydrophobicContact CB-CE1 3.6Å; P716-F729 HydrophobicContact CB-CZ 4.36Å; P716-F729 HydrophobicContact CG-CD1 4.31Å; P716-F729 HydrophobicContact CG-CE1 3.87Å; F727-F729 HydrophobicContact CB-CD2 4.4Å; F727-F729 HydrophobicContact CB-CE1 4.18Å; F727-F729 HydrophobicContact CB-CE2 3.72Å; F727-F729 HydrophobicContact CB-CZ 3.6Å; F727-F729 AromaticContact CD1-CE1 3.75Å; F727-F729 HydrophobicContact CD1-CE1 3.75Å; F727-F729 AromaticContact CD1-CZ 3.6Å; F727-F729 HydrophobicContact CD1-CZ 3.6Å; F727-F729 HydrophobicContact CE1-CZ 4.42Å; F727-F729 HydrophobicContact CG-CE1 4.27Å; F727-F729 HydrophobicContact CG-CE2 4.28Å; F727-F729 AromaticContact CG-CZ 3.71Å; F727-F729 HydrophobicContact CG-CZ 3.71Å; F729-V746 HydrophobicContact CB-CG2 3.78Å; F729-V746 HydrophobicContact CD1-CG2 3.66Å; F729-V746 HydrophobicContact CG-CG2 4.12Å; F729-A747 HydrophobicContact CB-CB 4.22Å; F729-A747 WeakPolarHBondContact O-CB 3.33Å; F729-A747 PolarHBondContact O-N 2.82Å; F729-A747 VanDerWaalsContact O-N 3.1Å
730	G	95.2	Very high	94.1	Very high	5 Å²	5	50.7 Å²	50.7	5%	0.052	26%	0.256	C	S	.	.	S	Bend	trans	80.9	27	-177.2	0	0	0	0	0	114.9	N728 Q748	N728-G730 PolarHBondContact OD1-N 2.84Å; N728-G730 VanDerWaalsContact OD1-N 3.15Å; G730-Q748 PolarHBondContact O-NE2 3.29Å
731	E	90.8	Very high	93.5	Very high	78 Å²	78	53.8 Å²	53.8	36%	0.364	29%	0.288	S	S	.	.	S	Bend	trans	-90.8	-75.9	177.8	-168.7	167.9	-150.5	0	0	111.3	H566 W567 A747	H566-E731 WeakPolarHBondContact CA-OE2 3.23Å; H566-E731 WeakPolarHBondContact CB-OE2 3.18Å; H566-E731 IonicContact CE1-OE1 3.55Å; H566-E731 IonicContact CG-OE1 2.72Å; H566-E731 IonicContact CG-OE2 2.75Å; H566-E731 VanDerWaalsContact ND1-CD 3.26Å; H566-E731 IonicContact ND1-OE1 3.37Å; H566-E731 PolarHBondContact ND1-OE1 2.98Å; H566-E731 IonicContact ND1-OE2 3.27Å; W567-E731 PolarHBondContact N-OE2 2.96Å; E731-A747 HydrophobicContact CB-CB 3.65Å; E731-A747 HydrophobicContact CG-CB 4.39Å
732	E	85	Confident	93.3	Very high	135 Å²	135	54.8 Å²	54.8	63%	0.631	30%	0.3	S	S	*	.	S	Bend	trans	-87.6	-34.7	-178.7	-60.9	-177.8	166.9	0	0	113.1
733	R	87.2	Confident	93.5	Very high	119 Å²	119	55 Å²	55	45%	0.449	30%	0.3	S	S	.	.	S	Bend	trans	-106.2	133.1	-178.4	-172.4	-178.8	168.9	177.3	-7.1	109.2	N728 E736	N728-R733 PolarHBondContact OD1-O 3.2Å; N728-R733 VanDerWaalsContact OD1-O 3.11Å; R733-E736 IonicContact NH2-OE2 3.42Å; R733-E736 PolarHBondContact NH2-OE2 3.21Å
734	P	91.4	Very high	93.6	Very high	105 Å²	105	58.3 Å²	58.3	68%	0.682	32%	0.317	S	S	*	.			trans	-61.7	146.4	170.8	26.6	-33.8	0	0	0	110.3	N728	N728-P734 PolarHBondContact ND2-O 3.45Å
735	L	96.4	Very high	93.6	Very high	26 Å²	26	57.7 Å²	57.7	14%	0.136	32%	0.317	C	S	.	.			trans	-62.6	140	170.1	-63	169.9	0	0	0	109.6	Y611 E613 P738 P745	Y611-L735 HydrophobicContact CD1-CD1 3.51Å; Y611-L735 HydrophobicContact CD1-CD2 4.29Å; Y611-L735 HydrophobicContact CD1-CG 4.48Å; Y611-L735 HydrophobicContact CE1-CD1 3.79Å; Y611-L735 HydrophobicContact CE1-CD2 4.17Å; Y611-L735 HydrophobicContact CE1-CG 4.41Å; E613-L735 HydrophobicContact CB-CD2 4.24Å; E613-L735 HydrophobicContact CG-CD2 4.04Å; E613-L735 WeakPolarHBondContact OE2-CA 3.29Å; L735-P738 HydrophobicContact CB-CB 4.34Å; L735-P738 HydrophobicContact CD1-CB 4.44Å; L735-P745 HydrophobicContact CD1-CB 4.02Å; L735-P745 HydrophobicContact CD1-CG 3.65Å; L735-P745 HydrophobicContact CG-CG 4.49Å
736	E	96.9	Very high	93.6	Very high	99 Å²	99	57.6 Å²	57.6	46%	0.463	32%	0.317	S	S	.	.	S	Bend	trans	-79.7	-36.6	-177.9	-166	164.5	157.1	0	0	111.5	E613 R733	E613-E736 PolarHBondContact OE1-N 2.95Å; E613-E736 PolarHBondContact OE2-N 3.33Å; R733-E736 IonicContact NH2-OE2 3.42Å; R733-E736 PolarHBondContact NH2-OE2 3.21Å
737	F	97.3	Very high	93.4	Very high	64 Å²	64	57.1 Å²	57.1	28%	0.281	32%	0.317	S	S	.	.	S	Bend	trans	-130.3	64.6	179.8	-58.6	-77.6	0	0	0	111.5	Y611 E613 V678 N695	Y611-F737 PolarHBondContact OH-O 3.15Å; E613-F737 VanDerWaalsContact OE1-CA 3.3Å; E613-F737 WeakPolarHBondContact OE1-CA 3.04Å; E613-F737 PolarHBondContact OE1-N 2.9Å; V678-F737 HydrophobicContact CB-CD2 3.77Å; V678-F737 HydrophobicContact CB-CE2 3.75Å; V678-F737 HydrophobicContact CG1-CD2 3.94Å; V678-F737 HydrophobicContact CG1-CE2 4.37Å; V678-F737 HydrophobicContact CG2-CD2 4.19Å; V678-F737 HydrophobicContact CG2-CE2 3.76Å; N695-F737 HydrophobicContact CB-CE2 4.43Å; N695-F737 HydrophobicContact CB-CZ 4.27Å
738	P	94.1	Very high	93.2	Very high	84 Å²	84	63 Å²	63	55%	0.545	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-59.6	129.6	176.6	26.7	-33.9	0	0	0	110.2	L735	L735-P738 HydrophobicContact CB-CB 4.34Å; L735-P738 HydrophobicContact CD1-CB 4.44Å
739	P	90.3	Very high	92.9	Very high	20 Å²	20	62.7 Å²	62.7	13%	0.13	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-72.9	151.3	180	31	-37.1	0	0	0	111.4	Y611 L682 I698 F743	Y611-P739 HydrophobicContact CD1-CG 4.15Å; Y611-P739 HydrophobicContact CD2-CG 3.83Å; Y611-P739 HydrophobicContact CE1-CG 4.43Å; Y611-P739 HydrophobicContact CE2-CG 4.11Å; Y611-P739 HydrophobicContact CG-CG 3.8Å; L682-P739 HydrophobicContact CD2-CB 4.31Å; I698-P739 HydrophobicContact CD1-CB 3.59Å; P739-F743 HydrophobicContact CG-CB 3.67Å; P739-F743 HydrophobicContact CG-CD2 4.33Å; P739-F743 HydrophobicContact CG-CG 4.15Å
740	D	85.5	Confident	92.5	Very high	153 Å²	153	65 Å²	65	82%	0.818	36%	0.363	S	S	*	.	S	Bend	trans	-68.3	152.5	166.7	-67	-45.9	0	0	0	111.2
741	G	84.9	Confident	91.8	Very high	65 Å²	65	71.7 Å²	71.7	67%	0.67	40%	0.398	S	S	*	.	S	Bend	trans	103.8	-154.3	173.5	0	0	0	0	0	114.2	F743	G741-F743 PolarHBondContact O-N 3.1Å
742	P	89.1	Confident	91.4	Very high	84 Å²	84	73.4 Å²	73.4	55%	0.545	41%	0.409	S	S	.	.	S	Bend	trans	-83.3	7.6	-171	35.4	-37	0	0	0	114	A609 I744	A609-P742 HydrophobicContact CB-CB 4.5Å; A609-P742 HydrophobicContact CB-CG 4.16Å; P742-I744 PolarHBondContact O-N 2.66Å
743	F	96.5	Very high	91.6	Very high	37 Å²	37	67.5 Å²	67.5	16%	0.162	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	125.2	-174.9	-70	-83	0	0	0	111.1	A609 L682 D684 P739 G741	A609-F743 HydrophobicContact CB-CD1 3.69Å; A609-F743 HydrophobicContact CB-CE1 3.85Å; A609-F743 HydrophobicContact CB-CG 4.15Å; A609-F743 HydrophobicContact CB-CZ 4.44Å; A609-F743 WeakPolarHBondContact O-CA 3.28Å; L682-F743 HydrophobicContact CB-CD1 4.35Å; L682-F743 HydrophobicContact CB-CE1 3.82Å; L682-F743 HydrophobicContact CB-CZ 4.16Å; L682-F743 HydrophobicContact CD2-CD2 4.36Å; L682-F743 HydrophobicContact CD2-CE1 4.28Å; L682-F743 HydrophobicContact CD2-CE2 4Å; L682-F743 HydrophobicContact CD2-CZ 3.96Å; L682-F743 HydrophobicContact CG-CE1 4.4Å; D684-F743 HydrophobicContact CB-CE1 3.99Å; D684-F743 HydrophobicContact CB-CZ 4Å; P739-F743 HydrophobicContact CG-CB 3.67Å; P739-F743 HydrophobicContact CG-CD2 4.33Å; P739-F743 HydrophobicContact CG-CG 4.15Å; G741-F743 PolarHBondContact O-N 3.1Å
744	I	95.6	Very high	91.7	Very high	70 Å²	70	63.7 Å²	63.7	36%	0.359	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	150.5	174.3	61.8	172.7	0	0	0	111.2	A609 Y610 Y611 P742 V746	A609-I744 PolarHBondContact O-N 2.75Å; Y610-I744 CarbonylContact C-O 3.51Å; Y610-I744 WeakPolarHBondContact CA-O 3.48Å; Y610-I744 HydrophobicContact CD1-CD1 4.33Å; Y610-I744 HydrophobicContact CD1-CG1 3.94Å; Y610-I744 HydrophobicContact CE1-CD1 4.08Å; Y610-I744 HydrophobicContact CE1-CG1 4.18Å; Y611-I744 PolarHBondContact N-O 3.13Å; P742-I744 PolarHBondContact O-N 2.66Å; I744-V746 PolarHBondContact O-N 3.38Å
745	P	97.8	Very high	91.6	Very high	19 Å²	19	60.5 Å²	60.5	12%	0.123	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	138.2	171.8	-18.4	29.7	0	0	0	110.5	Y611 L735 A747 Q748 S749	Y611-P745 CarbonylContact O-C 3.59Å; Y611-P745 VanDerWaalsContact O-CA 3.29Å; Y611-P745 WeakPolarHBondContact O-CA 3.3Å; L735-P745 HydrophobicContact CD1-CB 4.02Å; L735-P745 HydrophobicContact CD1-CG 3.65Å; L735-P745 HydrophobicContact CG-CG 4.49Å; P745-A747 PolarHBondContact O-N 2.41Å; P745-A747 VanDerWaalsContact O-N 3.15Å; P745-Q748 HydrophobicContact CB-CB 4.42Å; P745-Q748 HydrophobicContact CB-CG 4.19Å; P745-Q748 HydrophobicContact CG-CG 4.22Å; P745-Q748 PolarHBondContact O-N 3.32Å; P745-S749 PolarHBondContact O-N 2.99Å
746	V	97.7	Very high	91.1	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-55.4	-34.7	177.8	-67.1	0	0	0	0	111.9	W567 V604 Y611 Y612 W626 F729 I744 Q748 S749	W567-V746 HydrophobicContact CD2-CG2 4.25Å; W567-V746 HydrophobicContact CE3-CB 4.24Å; W567-V746 HydrophobicContact CE3-CG2 3.79Å; W567-V746 HydrophobicContact CH2-CB 3.8Å; W567-V746 HydrophobicContact CH2-CG2 4.29Å; W567-V746 HydrophobicContact CZ2-CB 4.24Å; W567-V746 WeakPolarHBondContact CZ2-O 3.17Å; W567-V746 HydrophobicContact CZ3-CB 3.8Å; W567-V746 HydrophobicContact CZ3-CG2 3.82Å; V604-V746 HydrophobicContact CG1-CB 4.38Å; V604-V746 HydrophobicContact CG1-CG1 4.21Å; Y611-V746 PolarHBondContact O-N 2.96Å; Y612-V746 HydrophobicContact CD1-CG1 4.48Å; W626-V746 HydrophobicContact CH2-CG1 3.57Å; W626-V746 HydrophobicContact CZ3-CG1 4.14Å; F729-V746 HydrophobicContact CB-CG2 3.78Å; F729-V746 HydrophobicContact CD1-CG2 3.66Å; F729-V746 HydrophobicContact CG-CG2 4.12Å; I744-V746 PolarHBondContact O-N 3.38Å; V746-Q748 PolarHBondContact O-N 2.72Å; V746-S749 VanDerWaalsContact O-CB 3.32Å; V746-S749 WeakPolarHBondContact O-CB 3.17Å; V746-S749 PolarHBondContact O-N 3.36Å; V746-S749 VanDerWaalsContact O-N 3.13Å; V746-S749 PolarHBondContact O-OG 3.15Å
747	A	94.9	Very high	90.8	Very high	19 Å²	19	59 Å²	59	16%	0.157	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-64.3	-21.1	176.9	0	0	0	0	0	114.8	W567 F729 E731 P745	W567-A747 HydrophobicContact CG-CB 4.17Å; F729-A747 HydrophobicContact CB-CB 4.22Å; F729-A747 WeakPolarHBondContact O-CB 3.33Å; F729-A747 PolarHBondContact O-N 2.82Å; F729-A747 VanDerWaalsContact O-N 3.1Å; E731-A747 HydrophobicContact CB-CB 3.65Å; E731-A747 HydrophobicContact CG-CB 4.39Å; P745-A747 PolarHBondContact O-N 2.41Å; P745-A747 VanDerWaalsContact O-N 3.15Å
748	Q	94.2	Very high	90.2	Very high	126 Å²	126	61.2 Å²	61.2	59%	0.589	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-103.4	7.5	-179.9	-59.8	177.5	10.2	0	0	112.2	G730 P745 V746	G730-Q748 PolarHBondContact O-NE2 3.29Å; P745-Q748 HydrophobicContact CB-CB 4.42Å; P745-Q748 HydrophobicContact CB-CG 4.19Å; P745-Q748 HydrophobicContact CG-CG 4.22Å; P745-Q748 PolarHBondContact O-N 3.32Å; V746-Q748 PolarHBondContact O-N 2.72Å
749	S	92.8	Very high	89.7	Confident	5 Å²	5	60.5 Å²	60.5	4%	0.035	35%	0.349	C	S	.	.	S	Bend	trans	-64.8	145.3	174.1	61.1	0	0	0	0	111.2	P745 V746 Q754	P745-S749 PolarHBondContact O-N 2.99Å; V746-S749 VanDerWaalsContact O-CB 3.32Å; V746-S749 WeakPolarHBondContact O-CB 3.17Å; V746-S749 PolarHBondContact O-N 3.36Å; V746-S749 VanDerWaalsContact O-N 3.13Å; V746-S749 PolarHBondContact O-OG 3.15Å; S749-Q754 PolarHBondContact O-NE2 3.37Å; S749-Q754 WeakPolarHBondContact OG-CG 3.39Å; S749-Q754 PolarHBondContact OG-NE2 3.28Å
750	A	88.3	Confident	89.3	Confident	53 Å²	53	61.9 Å²	61.9	44%	0.438	36%	0.358	S	S	.	.			trans	-63.9	147.4	178.4	0	0	0	0	0	111.8	D752 S753 Q754	A750-D752 WeakPolarHBondContact CB-OD1 3.49Å; A750-D752 PolarHBondContact O-N 3.15Å; A750-D752 VanDerWaalsContact O-N 3.12Å; A750-S753 WeakPolarHBondContact O-CA 2.93Å; A750-S753 WeakPolarHBondContact O-CB 3.43Å; A750-S753 PolarHBondContact O-N 3.15Å; A750-Q754 PolarHBondContact O-N 3.4Å
751	D	81	Confident	89.4	Confident	144 Å²	144	55.4 Å²	55.4	77%	0.77	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-32.1	-176.3	-66.5	-18.5	0	0	0	113.2	Q754	D751-Q754 PolarHBondContact O-N 3.04Å
752	D	82.2	Confident	89.8	Confident	115 Å²	115	53.2 Å²	53.2	62%	0.615	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-26	178.5	66.5	-33.7	0	0	0	113.2	K605 A750	K605-D752 WeakPolarHBondContact CE-O 3.28Å; K605-D752 PolarHBondContact NZ-O 2.96Å; A750-D752 WeakPolarHBondContact CB-OD1 3.49Å; A750-D752 PolarHBondContact O-N 3.15Å; A750-D752 VanDerWaalsContact O-N 3.12Å
753	S	89	Confident	90	Very high	10 Å²	10	50.1 Å²	50.1	7%	0.07	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-20.9	171.6	-71.2	0	0	0	0	113.5	V604 K605 Y610 A750	V604-S753 WeakPolarHBondContact CA-O 3.34Å; K605-S753 WeakPolarHBondContact CG-O 3.34Å; K605-S753 PolarHBondContact N-O 3.28Å; Y610-S753 WeakPolarHBondContact OH-CB 3.14Å; Y610-S753 PolarHBondContact OH-OG 3.23Å; A750-S753 WeakPolarHBondContact O-CA 2.93Å; A750-S753 WeakPolarHBondContact O-CB 3.43Å; A750-S753 PolarHBondContact O-N 3.15Å
754	Q	90.6	Very high	90	Very high	39 Å²	39	48.7 Å²	48.7	18%	0.182	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	141.6	176.1	-67.9	-171.1	38	0	0	111.5	W567 G603 S749 A750 D751	W567-Q754 HydrophobicContact CZ2-CG 3.95Å; G603-Q754 WeakPolarHBondContact O-CA 3.47Å; S749-Q754 PolarHBondContact O-NE2 3.37Å; S749-Q754 WeakPolarHBondContact OG-CG 3.39Å; S749-Q754 PolarHBondContact OG-NE2 3.28Å; A750-Q754 PolarHBondContact O-N 3.4Å; D751-Q754 PolarHBondContact O-N 3.04Å
755	V	88.3	Confident	89.9	Confident	38 Å²	38	46.1 Å²	46.1	23%	0.23	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	122	177.1	-175.9	0	0	0	0	109.1	K602 G603 K605 A713	K602-V755 CarbonylContact C-O 3.41Å; K602-V755 WeakPolarHBondContact CA-O 3.4Å; G603-V755 PolarHBondContact N-O 3.23Å; G603-V755 PolarHBondContact O-N 2.97Å; K605-V755 HydrophobicContact CB-CG2 4.07Å; K605-V755 HydrophobicContact CD-CG2 3.62Å; K605-V755 HydrophobicContact CG-CG2 3.74Å; A713-V755 HydrophobicContact CB-CB 3.74Å; A713-V755 HydrophobicContact CB-CG1 3.8Å; A713-V755 HydrophobicContact CB-CG2 3.79Å
756	S	86.2	Confident	89.5	Confident	85 Å²	85	50.7 Å²	50.7	59%	0.594	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.6	141.8	174.9	-50.8	0	0	0	0	111.1	R758	S756-R758 PolarHBondContact O-N 3.38Å
757	N	89.8	Confident	89.2	Confident	9 Å²	9	55.6 Å²	55.6	5%	0.048	30%	0.296	C	S	.	.			trans	-60.7	130.1	173	-174.4	-28	0	0	0	110.3	D573 A600 N601 N629 L715 N759	D573-N757 PolarHBondContact OD2-ND2 2.87Å; D573-N757 PolarHBondContact OD2-OD1 2.85Å; A600-N757 PolarHBondContact O-ND2 3.3Å; N601-N757 WeakPolarHBondContact O-CB 3.5Å; N601-N757 PolarHBondContact O-N 3.35Å; N629-N757 PolarHBondContact ND2-OD1 2.84Å; L715-N757 HydrophobicContact CD2-CB 3.58Å; N757-N759 PolarHBondContact O-N 3.24Å; N757-N759 WeakPolarHBondContact OD1-CB 3.09Å; N757-N759 PolarHBondContact OD1-N 2.71Å
758	R	84.5	Confident	89.2	Confident	111 Å²	111	54.7 Å²	54.7	42%	0.419	29%	0.289	S	S	.	.	S	Bend	trans	-68.1	-12.6	179.1	-61.1	-165.4	-62.8	-137.2	3.6	114.4	N629 D630 S756 P760	N629-R758 HydrophobicContact CB-CB 4.38Å; N629-R758 HydrophobicContact CB-CG 4.38Å; N629-R758 PolarHBondContact ND2-N 3.4Å; D630-R758 IonicContact OD1-CZ 2.99Å; D630-R758 IonicContact OD1-NH2 3.89Å; D630-R758 PolarHBondContact OD1-NH2 3.17Å; D630-R758 IonicContact OD2-CZ 2.73Å; D630-R758 IonicContact OD2-NH2 3.7Å; D630-R758 PolarHBondContact OD2-NH2 3.15Å; S756-R758 PolarHBondContact O-N 3.38Å; R758-P760 WeakPolarHBondContact O-CD 3.35Å
759	N	84.1	Confident	89.2	Confident	68 Å²	68	49.6 Å²	49.6	36%	0.364	27%	0.268	S	S	.	.			trans	-112.2	66.3	178.4	-60	-27.4	0	0	0	111.2	D573 N757 G761	D573-N759 HydrophobicContact CB-CB 3.98Å; D573-N759 PolarHBondContact OD1-ND2 3.1Å; D573-N759 VanDerWaalsContact OD1-ND2 3.12Å; N757-N759 PolarHBondContact O-N 3.24Å; N757-N759 WeakPolarHBondContact OD1-CB 3.09Å; N757-N759 PolarHBondContact OD1-N 2.71Å; N759-G761 PolarHBondContact O-N 2.86Å
760	P	82.5	Confident	89.3	Confident	49 Å²	49	51 Å²	51	32%	0.318	28%	0.276	S	S	.	.			trans	-75.4	-4.8	-175.7	33.6	-39	0	0	0	113.8	R758 R763	R758-P760 WeakPolarHBondContact O-CD 3.35Å; P760-R763 HydrophobicContact CB-CG 4.18Å
761	G	87.8	Confident	89.2	Confident	18 Å²	18	56.6 Å²	56.6	19%	0.186	30%	0.299	C	S	.	.			trans	76.4	-151.6	-172.2	0	0	0	0	0	112.9	A572 N759 N796 H797	A572-G761 VanDerWaalsContact CB-N 3.3Å; N759-G761 PolarHBondContact O-N 2.86Å; G761-N796 PolarHBondContact O-ND2 3.12Å; G761-N796 PolarHBondContact O-OD1 3.21Å; G761-H797 PolarHBondContact O-CE1 3.46Å
762	W	92.6	Very high	89.5	Confident	18 Å²	18	50.3 Å²	50.3	7%	0.068	27%	0.267	C	S	.	.	S	Bend	trans	-81.2	116.5	179.4	-77.1	65.6	0	0	0	110.1	N796 H797 I799 P916 F929 V945 C946 A948 T953	W762-N796 WeakPolarHBondContact CA-OD1 3.47Å; W762-H797 HydrophobicContact CD2-CB 3.68Å; W762-H797 HydrophobicContact CE3-CB 3.79Å; W762-H797 HydrophobicContact CG-CB 4.38Å; W762-H797 HydrophobicContact CH2-CB 3.72Å; W762-H797 HydrophobicContact CZ2-CB 3.62Å; W762-H797 HydrophobicContact CZ3-CB 3.8Å; W762-H797 WeakPolarHBondContact CZ3-O 3.29Å; W762-I799 HydrophobicContact CH2-CD1 3.61Å; W762-I799 HydrophobicContact CH2-CG1 4.09Å; W762-I799 HydrophobicContact CZ2-CD1 4.07Å; W762-P916 HydrophobicContact CZ3-CG 4.12Å; W762-F929 HydrophobicContact CB-CB 3.65Å; W762-F929 HydrophobicContact CB-CD1 4.39Å; W762-F929 HydrophobicContact CB-CD2 4.05Å; W762-F929 HydrophobicContact CB-CG 3.77Å; W762-F929 HydrophobicContact CE3-CD1 4.33Å; W762-F929 WeakPolarHBondContact O-CD2 3.39Å; W762-V945 HydrophobicContact CD2-CB 4.29Å; W762-V945 HydrophobicContact CD2-CG2 4.12Å; W762-V945 HydrophobicContact CE3-CB 3.88Å; W762-V945 HydrophobicContact CE3-CG2 3.66Å; W762-V945 HydrophobicContact CH2-CB 3.91Å; W762-V945 HydrophobicContact CZ2-CB 4.28Å; W762-V945 WeakPolarHBondContact CZ2-O 3.5Å; W762-V945 HydrophobicContact CZ3-CB 3.69Å; W762-V945 HydrophobicContact CZ3-CG1 4.4Å; W762-V945 HydrophobicContact CZ3-CG2 3.94Å; W762-V945 PolarHBondContact NE1-O 3.34Å; W762-C946 HydrophobicContact CB-CB 4.4Å; W762-C946 VanDerWaalsContact CD1-CA 3.42Å; W762-C946 HydrophobicContact CG-CB 4.19Å; W762-A948 HydrophobicContact CZ2-CB 4.45Å; W762-T953 HydrophobicContact CH2-CG2 4.47Å; W762-T953 HydrophobicContact CZ2-CG2 3.66Å
763	R	93.5	Very high	90.1	Very high	20 Å²	20	45.3 Å²	45.3	8%	0.075	24%	0.24	C	C	.	.			trans	-144.7	159.7	-175.5	-66.1	-57.4	-176.2	-102.9	9.6	110.9	P760 D778 S795 N796 D931	P760-R763 HydrophobicContact CB-CG 4.18Å; R763-D778 WeakPolarHBondContact CD-O 3.43Å; R763-D778 PolarHBondContact NE-O 2.87Å; R763-S795 CarbonylContact O-C 3.57Å; R763-S795 VanDerWaalsContact O-CA 3.25Å; R763-S795 WeakPolarHBondContact O-CA 3.43Å; R763-N796 PolarHBondContact N-OD1 3.2Å; R763-N796 PolarHBondContact O-N 2.8Å; R763-N796 PolarHBondContact O-OD1 2.77Å; R763-N796 VanDerWaalsContact O-OD1 3.11Å; R763-D931 IonicContact CZ-OD2 3.4Å; R763-D931 IonicContact NH1-OD2 3.79Å; R763-D931 PolarHBondContact NH1-OD2 3.04Å; R763-D931 IonicContact NH2-OD2 3.7Å; R763-D931 PolarHBondContact NH2-OD2 3.07Å
764	M	96.5	Very high	90.3	Very high	7 Å²	7	48 Å²	48	3%	0.034	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	135.9	165.1	-64.4	-52.4	-69	0	0	109.9	V775 G779 V782 C793 V918 L927 F929	M764-V775 HydrophobicContact CB-CG1 3.84Å; M764-G779 PolarHBondContact N-O 3.4Å; M764-V782 HydrophobicContact CB-CG1 3.65Å; M764-V782 HydrophobicContact CE-CG1 4.42Å; M764-V782 HydrophobicContact CG-CG1 3.75Å; M764-C793 VanDerWaalsContact CE-C 3.49Å; M764-C793 HydrophobicContact CE-CB 3.63Å; M764-C793 VanDerWaalsContact CE-O 3.22Å; M764-C793 WeakPolarHBondContact CE-O 3.35Å; M764-C793 VanDerWaalsContact CE-SG 3.54Å; M764-V918 HydrophobicContact CE-CG2 3.82Å; M764-L927 HydrophobicContact CE-CD2 4.46Å; M764-L927 HydrophobicContact CG-CD1 3.68Å; M764-L927 HydrophobicContact CG-CD2 4.15Å; M764-L927 HydrophobicContact CG-CG 4.42Å; M764-L927 HydrophobicContact SD-CD1 4.07Å; M764-L927 HydrophobicContact SD-CD2 3.46Å; M764-L927 WeakPolarHBondContact SD-CD2 3.12Å; M764-L927 HydrophobicContact SD-CG 4.35Å; M764-F929 HydrophobicContact CG-CZ 4.32Å; M764-F929 HydrophobicContact SD-CZ 3.73Å
765	N	93.9	Very high	90.5	Very high	15 Å²	15	47.3 Å²	47.3	8%	0.08	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	106.4	-173.4	-174.4	5.1	0	0	0	110.1	Y767 D768 C793 R794 N796 R958	N765-Y767 PolarHBondContact O-N 3.25Å; N765-Y767 WeakPolarHBondContact OD1-CB 3.43Å; N765-Y767 WeakPolarHBondContact OD1-CD2 3.36Å; N765-Y767 PolarHBondContact OD1-N 2.76Å; N765-D768 HydrophobicContact CB-CB 3.88Å; N765-D768 CarbonylContact O-C 3.53Å; N765-D768 VanDerWaalsContact O-C 3.31Å; N765-D768 WeakPolarHBondContact O-CA 3.37Å; N765-D768 PolarHBondContact O-N 2.71Å; N765-C793 PolarHBondContact O-SG 3.07Å; N765-C793 VanDerWaalsContact O-SG 3.34Å; N765-R794 VanDerWaalsContact CB-O 3.31Å; N765-R794 WeakPolarHBondContact CB-O 3.23Å; N765-R794 PolarHBondContact N-O 3.1Å; N765-N796 HydrophobicContact CB-CB 4.02Å; N765-R958 PolarHBondContact ND2-O 3.3Å
766	Q	90.1	Very high	90.6	Very high	115 Å²	115	45.8 Å²	45.8	54%	0.537	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	-25	174.9	66.9	179.6	-23.3	0	0	113.7	V775	Q766-V775 HydrophobicContact CB-CB 4.13Å; Q766-V775 HydrophobicContact CB-CG2 3.93Å
767	Y	90.7	Very high	90.5	Very high	103 Å²	103	45.8 Å²	45.8	40%	0.404	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-5.1	177.6	-51.5	-65.8	0	0	0	113.1	N765 R958 G960	N765-Y767 PolarHBondContact O-N 3.25Å; N765-Y767 WeakPolarHBondContact OD1-CB 3.43Å; N765-Y767 WeakPolarHBondContact OD1-CD2 3.36Å; N765-Y767 PolarHBondContact OD1-N 2.76Å; Y767-R958 WeakPolarHBondContact CB-O 3.24Å; Y767-R958 WeakPolarHBondContact O-CB 3.23Å; Y767-R958 WeakPolarHBondContact O-CD 3.47Å; Y767-G960 VanDerWaalsContact CG-CA 3.41Å
768	D	94.8	Very high	90.3	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.005	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	47.6	173.2	-155.4	-0.4	0	0	0	109.9	N765 C793 R794 L829 S956 R958	N765-D768 HydrophobicContact CB-CB 3.88Å; N765-D768 CarbonylContact O-C 3.53Å; N765-D768 VanDerWaalsContact O-C 3.31Å; N765-D768 WeakPolarHBondContact O-CA 3.37Å; N765-D768 PolarHBondContact O-N 2.71Å; D768-C793 WeakPolarHBondContact O-CA 3.35Å; D768-R794 HydrophobicContact CB-CB 4.29Å; D768-R794 PolarHBondContact O-N 2.8Å; D768-R794 IonicContact OD1-CZ 3.04Å; D768-R794 IonicContact OD1-NE 3.53Å; D768-R794 PolarHBondContact OD1-NE 3.29Å; D768-R794 IonicContact OD1-NH2 2.9Å; D768-R794 PolarHBondContact OD1-NH2 3.27Å; D768-R794 IonicContact OD2-CZ 3.86Å; D768-R794 IonicContact OD2-NE 2.85Å; D768-R794 PolarHBondContact OD2-NE 3.2Å; D768-R794 IonicContact OD2-NH2 2.71Å; D768-L829 VanDerWaalsContact O-CD2 3.27Å; D768-L829 WeakPolarHBondContact O-CD2 3.5Å; D768-S956 PolarHBondContact OD2-OG 2.6Å; D768-R958 HydrophobicContact CB-CB 4.26Å; D768-R958 WeakPolarHBondContact OD1-CD 3.12Å; D768-R958 IonicContact OD1-CZ 3.37Å; D768-R958 IonicContact OD1-NE 3.13Å; D768-R958 PolarHBondContact OD1-NE 2.83Å; D768-R958 IonicContact OD1-NH1 3.85Å; D768-R958 PolarHBondContact OD1-NH1 3.25Å
769	A	94.9	Very high	90.5	Very high	18 Å²	18	42.3 Å²	42.3	15%	0.149	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	158.1	-177.8	0	0	0	0	0	111.5	L773 G792 C793 L829	A769-L773 HydrophobicContact CB-CD2 4.08Å; A769-G792 CarbonylContact C-O 3.57Å; A769-G792 VanDerWaalsContact CA-O 3.29Å; A769-G792 WeakPolarHBondContact CA-O 3.49Å; A769-C793 HydrophobicContact CB-CB 4.05Å; A769-L829 VanDerWaalsContact C-CD1 3.47Å
770	T	94.4	Very high	90.8	Very high	34 Å²	34	39.8 Å²	39.8	21%	0.209	22%	0.22	C	C	.	.			trans	-70.6	146.5	166	50.5	0	0	0	0	110.4	A772 L773 Q791 G792 L829 I830	T770-A772 PolarHBondContact O-N 3.41Å; T770-L773 PolarHBondContact O-N 3.12Å; T770-Q791 WeakPolarHBondContact OG1-CA 3.34Å; T770-Q791 WeakPolarHBondContact OG1-CB 3.36Å; T770-G792 PolarHBondContact N-O 3.36Å; T770-G792 PolarHBondContact OG1-N 2.78Å; T770-G792 PolarHBondContact OG1-O 2.77Å; T770-L829 HydrophobicContact CG2-CB 4.16Å; T770-L829 HydrophobicContact CG2-CD1 4.01Å; T770-I830 HydrophobicContact CG2-CD1 4.37Å
771	N	85.7	Confident	91.5	Very high	172 Å²	172	39.3 Å²	39.3	92%	0.92	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-28.6	-174.3	-68.1	-9	0	0	0	115.6	L773	N771-L773 VanDerWaalsContact C-N 3.33Å
772	A	88.3	Confident	91.9	Very high	11 Å²	11	38.4 Å²	38.4	9%	0.091	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	7.7	-176.8	0	0	0	0	0	113.7	T770 H785 Q788 Q791	T770-A772 PolarHBondContact O-N 3.41Å; A772-H785 HydrophobicContact CB-CB 4.24Å; A772-H785 VanDerWaalsContact O-CB 3.29Å; A772-H785 WeakPolarHBondContact O-CB 3.1Å; A772-H785 PolarHBondContact O-CD2 2.86Å; A772-H785 PolarHBondContact O-N 3.27Å; A772-H785 PolarHBondContact O-ND1 3Å; A772-H785 PolarHBondContact O-NE2 3.14Å; A772-Q788 HydrophobicContact CB-CB 4.03Å; A772-Q788 HydrophobicContact CB-CG 4.46Å; A772-Q791 HydrophobicContact CB-CG 4.09Å; A772-Q791 PolarHBondContact O-OE1 3.49Å
773	L	94.1	Very high	92	Very high	11 Å²	11	38.6 Å²	38.6	6%	0.058	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	123.7	-178.5	-176.8	150.2	0	0	0	109.9	A769 T770 N771 V775 V782 Q783 Q791 C793	A769-L773 HydrophobicContact CB-CD2 4.08Å; T770-L773 PolarHBondContact O-N 3.12Å; N771-L773 VanDerWaalsContact C-N 3.33Å; L773-V775 HydrophobicContact CD2-CG2 3.88Å; L773-V782 HydrophobicContact CD2-CB 3.86Å; L773-V782 HydrophobicContact CD2-CG1 3.95Å; L773-V782 HydrophobicContact CG-CB 4.4Å; L773-Q783 WeakPolarHBondContact CA-O 3.38Å; L773-Q791 HydrophobicContact CB-CB 4.16Å; L773-Q791 HydrophobicContact CD1-CB 4.11Å; L773-C793 HydrophobicContact CD1-CB 4.03Å; L773-C793 HydrophobicContact CD2-CB 3.7Å
774	D	93.6	Very high	92	Very high	67 Å²	67	37.6 Å²	37.6	36%	0.358	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	138.9	175.9	-59.6	-39	0	0	0	109.9	F562 V782 Q783 H785	F562-D774 HydrophobicContact CE2-CB 3.75Å; F562-D774 HydrophobicContact CZ-CB 4.36Å; D774-V782 CarbonylContact O-C 3.43Å; D774-V782 VanDerWaalsContact O-CA 3.31Å; D774-V782 WeakPolarHBondContact O-CA 3.32Å; D774-Q783 PolarHBondContact N-O 2.87Å; D774-Q783 PolarHBondContact O-N 3.01Å; D774-H785 IonicContact OD1-CE1 3.19Å; D774-H785 IonicContact OD1-NE2 3.85Å; D774-H785 PolarHBondContact OD1-NE2 2.8Å; D774-H785 IonicContact OD2-CD2 2.86Å; D774-H785 PolarHBondContact OD2-CD2 2.98Å; D774-H785 IonicContact OD2-CE1 2.71Å; D774-H785 IonicContact OD2-NE2 2.96Å; D774-H785 PolarHBondContact OD2-NE2 2.8Å
775	V	93.6	Very high	91.6	Very high	24 Å²	24	39.9 Å²	39.9	15%	0.145	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	132.9	172.7	-175.5	0	0	0	0	107.7	M764 Q766 L773 V782	M764-V775 HydrophobicContact CB-CG1 3.84Å; Q766-V775 HydrophobicContact CB-CB 4.13Å; Q766-V775 HydrophobicContact CB-CG2 3.93Å; L773-V775 HydrophobicContact CD2-CG2 3.88Å; V775-V782 HydrophobicContact CB-CG1 4.28Å; V775-V782 HydrophobicContact CG1-CG1 4.12Å; V775-V782 HydrophobicContact CG2-CG1 3.89Å
776	A	91.6	Very high	91.2	Very high	6 Å²	6	42.5 Å²	42.5	5%	0.05	22%	0.223	C	C	.	.			trans	-59.5	151.9	177.2	0	0	0	0	0	111.3	F562 D778 G779 Q781	F562-A776 HydrophobicContact CB-CB 4.38Å; F562-A776 HydrophobicContact CD1-CB 3.86Å; F562-A776 HydrophobicContact CD2-CB 4.03Å; F562-A776 HydrophobicContact CE1-CB 4.05Å; F562-A776 HydrophobicContact CE2-CB 4.19Å; F562-A776 HydrophobicContact CG-CB 3.85Å; F562-A776 HydrophobicContact CZ-CB 4.2Å; A776-D778 PolarHBondContact O-N 2.9Å; A776-D778 VanDerWaalsContact O-N 3.16Å; A776-G779 WeakPolarHBondContact O-CA 3.39Å; A776-G779 PolarHBondContact O-N 2.79Å; A776-Q781 HydrophobicContact CB-CB 3.82Å; A776-Q781 PolarHBondContact N-O 2.68Å
777	P	83.5	Confident	90.8	Very high	85 Å²	85	43.8 Å²	43.8	55%	0.552	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-36.5	-175.8	-27.3	35.3	0	0	0	113.9	E565 G779	E565-P777 HydrophobicContact CB-CB 4.12Å; P777-G779 VanDerWaalsContact C-N 3.26Å; P777-G779 PolarHBondContact O-N 3.18Å
778	D	84.8	Confident	90.6	Very high	42 Å²	42	44.2 Å²	44.2	23%	0.225	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-8.9	177.8	78	-22.7	0	0	0	113.5	E565 R763 A776 S780	E565-D778 HydrophobicContact CB-CB 4.24Å; E565-D778 HydrophobicContact CG-CB 3.78Å; R763-D778 WeakPolarHBondContact CD-O 3.43Å; R763-D778 PolarHBondContact NE-O 2.87Å; A776-D778 PolarHBondContact O-N 2.9Å; A776-D778 VanDerWaalsContact O-N 3.16Å; D778-S780 PolarHBondContact OD1-N 3.13Å; D778-S780 PolarHBondContact OD1-OG 2.86Å; D778-S780 VanDerWaalsContact OD2-CB 3.28Å; D778-S780 WeakPolarHBondContact OD2-CB 3.45Å; D778-S780 PolarHBondContact OD2-OG 3.15Å
779	G	90	Very high	90.2	Very high	5 Å²	5	45.8 Å²	45.8	5%	0.052	26%	0.256	C	S	.	.	S	Bend	trans	74.6	13.5	-178.9	0	0	0	0	0	115.9	M764 A776 P777	M764-G779 PolarHBondContact N-O 3.4Å; A776-G779 WeakPolarHBondContact O-CA 3.39Å; A776-G779 PolarHBondContact O-N 2.79Å; P777-G779 VanDerWaalsContact C-N 3.26Å; P777-G779 PolarHBondContact O-N 3.18Å
780	S	91	Very high	90.1	Very high	15 Å²	15	48.4 Å²	48.4	11%	0.105	26%	0.262	C	S	.	.	S	Bend	trans	-92	-22.3	-178.1	71.6	0	0	0	0	113.7	D778 E926 L927	D778-S780 PolarHBondContact OD1-N 3.13Å; D778-S780 PolarHBondContact OD1-OG 2.86Å; D778-S780 VanDerWaalsContact OD2-CB 3.28Å; D778-S780 WeakPolarHBondContact OD2-CB 3.45Å; D778-S780 PolarHBondContact OD2-OG 3.15Å; S780-E926 CarbonylContact O-C 2.88Å; S780-L927 PolarHBondContact O-N 2.84Å
781	Q	95.2	Very high	90.1	Very high	38 Å²	38	47 Å²	47	18%	0.178	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	152.7	-179.8	-59	174	9.1	0	0	111.9	F562 A776 I812 V925 E926	F562-Q781 HydrophobicContact CD1-CB 4.43Å; F562-Q781 HydrophobicContact CE1-CB 3.93Å; A776-Q781 HydrophobicContact CB-CB 3.82Å; A776-Q781 PolarHBondContact N-O 2.68Å; Q781-I812 HydrophobicContact CG-CD1 4.35Å; Q781-V925 CarbonylContact C-O 3.59Å; Q781-V925 VanDerWaalsContact CA-O 3.23Å; Q781-V925 WeakPolarHBondContact CA-O 3.41Å; Q781-V925 WeakPolarHBondContact CB-O 3.12Å; Q781-E926 HydrophobicContact CG-CB 4.03Å; Q781-E926 HydrophobicContact CG-CG 3.94Å
782	V	96.4	Very high	90.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	141.2	170	-64.4	0	0	0	0	111.3	M764 L773 D774 V775 C793 V918 L920 T924 V925 L927	M764-V782 HydrophobicContact CB-CG1 3.65Å; M764-V782 HydrophobicContact CE-CG1 4.42Å; M764-V782 HydrophobicContact CG-CG1 3.75Å; L773-V782 HydrophobicContact CD2-CB 3.86Å; L773-V782 HydrophobicContact CD2-CG1 3.95Å; L773-V782 HydrophobicContact CG-CB 4.4Å; D774-V782 CarbonylContact O-C 3.43Å; D774-V782 VanDerWaalsContact O-CA 3.31Å; D774-V782 WeakPolarHBondContact O-CA 3.32Å; V775-V782 HydrophobicContact CB-CG1 4.28Å; V775-V782 HydrophobicContact CG1-CG1 4.12Å; V775-V782 HydrophobicContact CG2-CG1 3.89Å; V782-C793 HydrophobicContact CG1-CB 4.48Å; V782-V918 HydrophobicContact CG2-CG2 3.53Å; V782-L920 HydrophobicContact CG2-CD1 3.83Å; V782-L920 WeakPolarHBondContact O-CD1 3.19Å; V782-T924 WeakPolarHBondContact O-CA 3.43Å; V782-T924 WeakPolarHBondContact O-CG2 3.36Å; V782-V925 HydrophobicContact CG2-CG2 3.49Å; V782-V925 VanDerWaalsContact CG2-CG2 3.49Å; V782-V925 PolarHBondContact N-O 3.24Å; V782-V925 PolarHBondContact O-N 3.35Å; V782-L927 HydrophobicContact CG2-CD1 4.24Å
783	Q	95	Very high	91.1	Very high	21 Å²	21	38.2 Å²	38.2	10%	0.098	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	128.3	-175.1	-179.8	171	99.4	0	0	110.1	I560 F562 L773 D774 T924	I560-Q783 PolarHBondContact O-NE2 3.31Å; I560-Q783 VanDerWaalsContact O-NE2 3.12Å; F562-Q783 HydrophobicContact CE1-CB 3.92Å; F562-Q783 HydrophobicContact CE2-CB 4.41Å; F562-Q783 HydrophobicContact CZ-CB 3.49Å; F562-Q783 VanDerWaalsContact CZ-CB 3.49Å; L773-Q783 WeakPolarHBondContact CA-O 3.38Å; D774-Q783 PolarHBondContact N-O 2.87Å; D774-Q783 PolarHBondContact O-N 3.01Å; Q783-T924 HydrophobicContact CB-CG2 3.98Å; Q783-T924 HydrophobicContact CG-CG2 4.39Å; Q783-T924 VanDerWaalsContact CG-OG1 3.3Å; Q783-T924 WeakPolarHBondContact CG-OG1 3.4Å; Q783-T924 PolarHBondContact NE2-OG1 3.25Å
784	S	94.3	Very high	91.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	131.4	179.2	52	0	0	0	0	112.2	R559 Q791 L920 N922 S923	R559-S784 VanDerWaalsContact CZ-O 3.25Å; R559-S784 PolarHBondContact NH1-O 3.34Å; R559-S784 VanDerWaalsContact NH1-O 3.1Å; R559-S784 PolarHBondContact NH2-O 3.45Å; S784-Q791 VanDerWaalsContact C-OE1 3.29Å; S784-L920 WeakPolarHBondContact OG-CB 3.22Å; S784-N922 PolarHBondContact OG-N 2.85Å; S784-N922 VanDerWaalsContact OG-N 3.11Å; S784-S923 PolarHBondContact N-O 3.35Å; S784-S923 PolarHBondContact OG-N 3.26Å; S784-S923 PolarHBondContact OG-O 3.38Å
785	H	87.3	Confident	91.5	Very high	54 Å²	54	34.6 Å²	34.6	25%	0.25	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-61.1	144.9	177.1	-68.3	-177.1	0	0	0	111.8	A772 D774 Q788 Q791	A772-H785 HydrophobicContact CB-CB 4.24Å; A772-H785 VanDerWaalsContact O-CB 3.29Å; A772-H785 WeakPolarHBondContact O-CB 3.1Å; A772-H785 PolarHBondContact O-CD2 2.86Å; A772-H785 PolarHBondContact O-N 3.27Å; A772-H785 PolarHBondContact O-ND1 3Å; A772-H785 PolarHBondContact O-NE2 3.14Å; D774-H785 IonicContact OD1-CE1 3.19Å; D774-H785 IonicContact OD1-NE2 3.85Å; D774-H785 PolarHBondContact OD1-NE2 2.8Å; D774-H785 IonicContact OD2-CD2 2.86Å; D774-H785 PolarHBondContact OD2-CD2 2.98Å; D774-H785 IonicContact OD2-CE1 2.71Å; D774-H785 IonicContact OD2-NE2 2.96Å; D774-H785 PolarHBondContact OD2-NE2 2.8Å; H785-Q788 HydrophobicContact CB-CG 4.22Å; H785-Q788 VanDerWaalsContact CB-NE2 3.29Å; H785-Q788 PolarHBondContact ND1-NE2 3.43Å; H785-Q791 PolarHBondContact O-NE2 2.69Å
786	F	85.5	Confident	91.6	Very high	70 Å²	70	34.2 Å²	34.2	31%	0.307	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	140.3	179	-76.5	-55.6	0	0	0	112.5	I557 R559 Q788 N922	I557-F786 HydrophobicContact CB-CZ 4.17Å; I557-F786 HydrophobicContact CG2-CZ 3.87Å; R559-F786 VanDerWaalsContact CD-CZ 3.44Å; R559-F786 HydrophobicContact CG-CD2 4.35Å; R559-F786 HydrophobicContact CG-CE2 3.41Å; R559-F786 VanDerWaalsContact CG-CE2 3.41Å; R559-F786 HydrophobicContact CG-CZ 3.83Å; R559-F786 VanDerWaalsContact NH1-CD1 3.33Å; F786-Q788 PolarHBondContact O-N 3.37Å; F786-Q788 VanDerWaalsContact O-N 3.15Å; F786-N922 WeakPolarHBondContact CA-OD1 3.43Å; F786-N922 HydrophobicContact CD1-CB 3.72Å; F786-N922 HydrophobicContact CE1-CB 3.98Å
787	N	81.9	Confident	91.7	Very high	142 Å²	142	35.6 Å²	35.6	76%	0.759	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.1	24.6	170.4	-55.4	-42.3	0	0	0	114.6	N922	N787-N922 PolarHBondContact N-OD1 3Å
788	Q	86.2	Confident	92.3	Very high	113 Å²	113	31.5 Å²	31.5	53%	0.528	16%	0.162	S	C	.	.	S	Bend	trans	-107.6	18.2	175.2	-63.2	-166.6	47.2	0	0	112.9	A772 H785 F786	A772-Q788 HydrophobicContact CB-CB 4.03Å; A772-Q788 HydrophobicContact CB-CG 4.46Å; H785-Q788 HydrophobicContact CB-CG 4.22Å; H785-Q788 VanDerWaalsContact CB-NE2 3.29Å; H785-Q788 PolarHBondContact ND1-NE2 3.43Å; F786-Q788 PolarHBondContact O-N 3.37Å; F786-Q788 VanDerWaalsContact O-N 3.15Å
789	G	86.6	Confident	92.9	Very high	34 Å²	34	29.6 Å²	29.6	35%	0.351	15%	0.151	S	C	.	.			trans	71.9	-168.1	-179.2	0	0	0	0	0	113.1	Q791 L921	G789-Q791 PolarHBondContact O-NE2 3.08Å; G789-L921 WeakPolarHBondContact O-CD1 3.45Å
790	W	92.8	Very high	92.9	Very high	73 Å²	73	34 Å²	34	28%	0.277	17%	0.166	S	C	.	.			trans	-66	136	177.7	-74.7	99.9	0	0	0	110.9	L817 R819 I830 S919 L920 L921	W790-L817 HydrophobicContact CH2-CB 3.44Å; W790-L817 VanDerWaalsContact CH2-CB 3.44Å; W790-L817 HydrophobicContact CH2-CD1 4.21Å; W790-L817 HydrophobicContact CH2-CG 4.47Å; W790-L817 HydrophobicContact CZ2-CB 3.98Å; W790-L817 HydrophobicContact CZ2-CD1 3.9Å; W790-L817 HydrophobicContact CZ3-CB 4.16Å; W790-R819 HydrophobicContact CH2-CG 3.8Å; W790-R819 HydrophobicContact CZ3-CB 4.48Å; W790-R819 HydrophobicContact CZ3-CG 3.77Å; W790-I830 HydrophobicContact CB-CD1 3.96Å; W790-I830 HydrophobicContact CB-CG1 4.35Å; W790-I830 HydrophobicContact CB-CG2 3.94Å; W790-I830 HydrophobicContact CG-CG2 4.37Å; W790-I830 VanDerWaalsContact O-CD1 3.31Å; W790-I830 WeakPolarHBondContact O-CD1 3.48Å; W790-S919 WeakPolarHBondContact CZ3-O 3.37Å; W790-L920 WeakPolarHBondContact CA-O 3.45Å; W790-L921 HydrophobicContact CD2-CB 4.04Å; W790-L921 HydrophobicContact CE3-CB 3.96Å; W790-L921 HydrophobicContact CH2-CB 4.38Å; W790-L921 HydrophobicContact CZ2-CB 4.43Å; W790-L921 HydrophobicContact CZ3-CB 4.13Å
791	Q	95.4	Very high	92.7	Very high	3 Å²	3	33.9 Å²	33.9	1%	0.014	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	137.4	-174.6	-69.3	159.2	47.4	0	0	109.2	T770 A772 L773 S784 H785 G789 S919 L920	T770-Q791 WeakPolarHBondContact OG1-CA 3.34Å; T770-Q791 WeakPolarHBondContact OG1-CB 3.36Å; A772-Q791 HydrophobicContact CB-CG 4.09Å; A772-Q791 PolarHBondContact O-OE1 3.49Å; L773-Q791 HydrophobicContact CB-CB 4.16Å; L773-Q791 HydrophobicContact CD1-CB 4.11Å; S784-Q791 VanDerWaalsContact C-OE1 3.29Å; H785-Q791 PolarHBondContact O-NE2 2.69Å; G789-Q791 PolarHBondContact O-NE2 3.08Å; Q791-S919 CarbonylContact O-C 3.46Å; Q791-S919 WeakPolarHBondContact O-CA 3.43Å; Q791-L920 PolarHBondContact N-O 2.76Å; Q791-L920 PolarHBondContact O-N 2.91Å
792	G	96.9	Very high	92.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	152	-167	0	0	0	0	0	113.3	A769 T770 L829 V918	A769-G792 CarbonylContact C-O 3.57Å; A769-G792 VanDerWaalsContact CA-O 3.29Å; A769-G792 WeakPolarHBondContact CA-O 3.49Å; T770-G792 PolarHBondContact N-O 3.36Å; T770-G792 PolarHBondContact OG1-N 2.78Å; T770-G792 PolarHBondContact OG1-O 2.77Å; G792-L829 WeakPolarHBondContact CA-O 3.37Å; G792-V918 VanDerWaalsContact CA-O 3.25Å; G792-V918 WeakPolarHBondContact CA-O 3.32Å
793	C	98.3	Very high	92.2	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	142.4	176.9	-173.3	0	0	0	0	110.4	M764 N765 D768 A769 L773 V782 T917 V918	M764-C793 VanDerWaalsContact CE-C 3.49Å; M764-C793 HydrophobicContact CE-CB 3.63Å; M764-C793 VanDerWaalsContact CE-O 3.22Å; M764-C793 WeakPolarHBondContact CE-O 3.35Å; M764-C793 VanDerWaalsContact CE-SG 3.54Å; N765-C793 PolarHBondContact O-SG 3.07Å; N765-C793 VanDerWaalsContact O-SG 3.34Å; D768-C793 WeakPolarHBondContact O-CA 3.35Å; A769-C793 HydrophobicContact CB-CB 4.05Å; L773-C793 HydrophobicContact CD1-CB 4.03Å; L773-C793 HydrophobicContact CD2-CB 3.7Å; V782-C793 HydrophobicContact CG1-CB 4.48Å; C793-T917 WeakPolarHBondContact O-CA 3.44Å; C793-V918 PolarHBondContact N-O 2.86Å; C793-V918 PolarHBondContact O-N 2.9Å
794	R	97.9	Very high	92.3	Very high	1 Å²	1	41 Å²	41	0%	0.004	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	155	171	-83.9	-174.3	-67.8	-101.6	-6.7	111.4	N765 D768 T824 G827 L829 T917	N765-R794 VanDerWaalsContact CB-O 3.31Å; N765-R794 WeakPolarHBondContact CB-O 3.23Å; N765-R794 PolarHBondContact N-O 3.1Å; D768-R794 HydrophobicContact CB-CB 4.29Å; D768-R794 PolarHBondContact O-N 2.8Å; D768-R794 IonicContact OD1-CZ 3.04Å; D768-R794 IonicContact OD1-NE 3.53Å; D768-R794 PolarHBondContact OD1-NE 3.29Å; D768-R794 IonicContact OD1-NH2 2.9Å; D768-R794 PolarHBondContact OD1-NH2 3.27Å; D768-R794 IonicContact OD2-CZ 3.86Å; D768-R794 IonicContact OD2-NE 2.85Å; D768-R794 PolarHBondContact OD2-NE 3.2Å; D768-R794 IonicContact OD2-NH2 2.71Å; R794-T824 PolarHBondContact NH1-O 3.22Å; R794-T824 VanDerWaalsContact NH1-O 3.08Å; R794-G827 PolarHBondContact NH1-O 3.29Å; R794-L829 HydrophobicContact CB-CD2 4.46Å; R794-L829 HydrophobicContact CG-CD2 4.14Å; R794-L829 VanDerWaalsContact CZ-CD2 3.48Å; R794-T917 HydrophobicContact CG-CG2 3.92Å; R794-T917 WeakPolarHBondContact CG-OG1 3.35Å
795	S	97.7	Very high	92.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	160.3	168.7	57.1	0	0	0	0	112.7	R763 H797 Y915 P916	R763-S795 CarbonylContact O-C 3.57Å; R763-S795 VanDerWaalsContact O-CA 3.25Å; R763-S795 WeakPolarHBondContact O-CA 3.43Å; S795-H797 PolarHBondContact O-N 3.4Å; S795-H797 PolarHBondContact OG-O 2.97Å; S795-Y915 WeakPolarHBondContact O-CD1 3.43Å; S795-P916 PolarHBondContact N-O 3.46Å; S795-P916 WeakPolarHBondContact OG-CD 3.48Å; S795-P916 PolarHBondContact OG-O 2.63Å
796	N	94.4	Very high	93	Very high	17 Å²	17	38.7 Å²	38.7	9%	0.091	19%	0.194	C	C	.	.	S	Bend	trans	-75.2	-10.9	176.8	65.9	-7.8	0	0	0	114	G761 W762 R763 N765 S956	G761-N796 PolarHBondContact O-ND2 3.12Å; G761-N796 PolarHBondContact O-OD1 3.21Å; W762-N796 WeakPolarHBondContact CA-OD1 3.47Å; R763-N796 PolarHBondContact N-OD1 3.2Å; R763-N796 PolarHBondContact O-N 2.8Å; R763-N796 PolarHBondContact O-OD1 2.77Å; R763-N796 VanDerWaalsContact O-OD1 3.11Å; N765-N796 HydrophobicContact CB-CB 4.02Å; N796-S956 PolarHBondContact O-N 2.98Å
797	H	95.3	Very high	93.6	Very high	34 Å²	34	35.3 Å²	35.3	16%	0.157	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	146.9	175.8	-63.9	85.7	0	0	0	110.7	G761 W762 S795 Y915 K954	G761-H797 PolarHBondContact O-CE1 3.46Å; W762-H797 HydrophobicContact CD2-CB 3.68Å; W762-H797 HydrophobicContact CE3-CB 3.79Å; W762-H797 HydrophobicContact CG-CB 4.38Å; W762-H797 HydrophobicContact CH2-CB 3.72Å; W762-H797 HydrophobicContact CZ2-CB 3.62Å; W762-H797 HydrophobicContact CZ3-CB 3.8Å; W762-H797 WeakPolarHBondContact CZ3-O 3.29Å; S795-H797 PolarHBondContact O-N 3.4Å; S795-H797 PolarHBondContact OG-O 2.97Å; H797-Y915 VanDerWaalsContact C-CE1 3.47Å; H797-Y915 VanDerWaalsContact O-CD1 3.28Å; H797-Y915 WeakPolarHBondContact O-CD1 3.33Å; H797-K954 CarbonylContact C-O 3.59Å; H797-K954 WeakPolarHBondContact CA-O 3.46Å
798	G	95.9	Very high	94.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	162.4	176.2	0	0	0	0	0	111.8	L914 Y915 T953 K954	G798-L914 CarbonylContact C-O 3.48Å; G798-L914 VanDerWaalsContact CA-O 3.28Å; G798-L914 WeakPolarHBondContact CA-O 3.2Å; G798-Y915 VanDerWaalsContact CA-CD1 3.49Å; G798-Y915 VanDerWaalsContact N-CD1 3.3Å; G798-T953 CarbonylContact O-C 3.58Å; G798-T953 VanDerWaalsContact O-CA 3.27Å; G798-T953 WeakPolarHBondContact O-CA 3.24Å; G798-K954 PolarHBondContact N-O 3.11Å; G798-K954 PolarHBondContact O-N 2.95Å
799	I	95.9	Very high	94.9	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.005	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	130.7	-179.3	-60.6	-60.7	0	0	0	110.1	W762 F805 W822 L879 T881 A913 L914 V945 A948 T953	W762-I799 HydrophobicContact CH2-CD1 3.61Å; W762-I799 HydrophobicContact CH2-CG1 4.09Å; W762-I799 HydrophobicContact CZ2-CD1 4.07Å; I799-F805 HydrophobicContact CB-CD2 4.45Å; I799-F805 HydrophobicContact CD1-CD1 3.77Å; I799-F805 HydrophobicContact CD1-CD2 4.41Å; I799-F805 HydrophobicContact CD1-CE1 4Å; I799-F805 HydrophobicContact CD1-CG 3.98Å; I799-F805 HydrophobicContact CD1-CZ 4.39Å; I799-F805 HydrophobicContact CG1-CB 4.33Å; I799-F805 HydrophobicContact CG1-CD1 4.37Å; I799-F805 HydrophobicContact CG1-CD2 4.27Å; I799-F805 HydrophobicContact CG1-CG 4.05Å; I799-F805 HydrophobicContact CG2-CD2 3.44Å; I799-F805 VanDerWaalsContact CG2-CD2 3.44Å; I799-F805 HydrophobicContact CG2-CE2 3.35Å; I799-F805 HydrophobicContact CG2-CG 4.09Å; I799-F805 HydrophobicContact CG2-CZ 3.95Å; I799-W822 HydrophobicContact CG1-CZ3 4.28Å; I799-L879 HydrophobicContact CB-CD2 3.92Å; I799-L879 HydrophobicContact CG1-CD2 4.34Å; I799-L879 HydrophobicContact CG2-CD2 3.97Å; I799-T881 HydrophobicContact CG2-CG2 4.25Å; I799-A913 CarbonylContact O-C 3.31Å; I799-A913 WeakPolarHBondContact O-CA 3.46Å; I799-L914 PolarHBondContact N-O 3.03Å; I799-L914 PolarHBondContact O-N 3.46Å; I799-V945 HydrophobicContact CD1-CG1 4.46Å; I799-V945 HydrophobicContact CG1-CG1 4.37Å; I799-A948 HydrophobicContact CD1-CB 3.49Å; I799-A948 VanDerWaalsContact CD1-CB 3.49Å; I799-T953 HydrophobicContact CD1-CG2 4.44Å
800	R	91.3	Very high	95.4	Very high	98 Å²	98	22.9 Å²	22.9	37%	0.37	11%	0.109	S	C	.	.			trans	-131.3	-5.7	174.7	64.8	170.6	-177	88	-0.3	114.4	T912 A913 E951 C952 T953	R800-T912 WeakPolarHBondContact CB-O 3.39Å; R800-A913 HydrophobicContact CB-CB 3.99Å; R800-E951 PolarHBondContact NH1-O 3.27Å; R800-E951 PolarHBondContact NH2-O 2.75Å; R800-C952 WeakPolarHBondContact CG-O 3.44Å; R800-C952 PolarHBondContact N-O 3.12Å; R800-T953 PolarHBondContact NE-O 3.22Å; R800-T953 VanDerWaalsContact NE-O 3.09Å
801	G	86.5	Confident	95.5	Very high	12 Å²	12	19.4 Å²	19.4	12%	0.124	10%	0.096	C	C	.	.	S	Bend	trans	-99.1	167.3	-177.2	0	0	0	0	0	113.1	T881 C952	G801-T881 PolarHBondContact O-OG1 3.35Å; G801-C952 PolarHBondContact N-O 3.2Å
802	L	88.6	Confident	95.3	Very high	133 Å²	133	21 Å²	21	70%	0.696	10%	0.104	S	C	*	.	S	Bend	trans	-68.5	133.7	173.5	-64.9	178.3	0	0	0	110.9	T881 I882	L802-T881 WeakPolarHBondContact CA-OG1 3.39Å; L802-T881 WeakPolarHBondContact CD2-O 3.26Å; L802-I882 HydrophobicContact CB-CG1 4.41Å
803	G	92	Very high	94.7	Very high	13 Å²	13	21.5 Å²	21.5	13%	0.134	11%	0.107	C	C	.	.	S	Bend	trans	158.2	179.8	177.8	0	0	0	0	0	112.8	F805 T881	G803-F805 VanDerWaalsContact C-CE2 3.49Å; G803-T881 PolarHBondContact N-OG1 3.43Å; G803-T881 PolarHBondContact O-N 2.84Å; G803-T881 PolarHBondContact O-OG1 2.77Å; G803-T881 VanDerWaalsContact O-OG1 3.04Å
804	R	96.8	Very high	93.7	Very high	63 Å²	63	25.4 Å²	25.4	24%	0.238	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	116.6	174.7	-77.9	175.9	178.6	-179.6	-5.5	107.9	L879 D880 E883 D941 W942 T943	R804-L879 CarbonylContact C-O 3.58Å; R804-L879 WeakPolarHBondContact CA-O 3.49Å; R804-D880 HydrophobicContact CG-CB 4.15Å; R804-D880 WeakPolarHBondContact CG-OD2 3.39Å; R804-D880 IonicContact CZ-OD2 2.62Å; R804-D880 VanDerWaalsContact CZ-OD2 3.27Å; R804-D880 IonicContact NE-OD2 2.83Å; R804-D880 PolarHBondContact NE-OD2 3.49Å; R804-D880 IonicContact NH2-OD2 3.85Å; R804-D880 PolarHBondContact NH2-OD2 2.81Å; R804-E883 IonicContact NH2-OE1 3.75Å; R804-E883 PolarHBondContact NH2-OE1 3.19Å; R804-E883 IonicContact NH2-OE2 3.47Å; R804-E883 PolarHBondContact NH2-OE2 3.08Å; R804-D941 VanDerWaalsContact CB-O 3.32Å; R804-D941 WeakPolarHBondContact CB-O 3.25Å; R804-W942 HydrophobicContact CB-CD2 4.02Å; R804-W942 HydrophobicContact CB-CE3 3.58Å; R804-W942 HydrophobicContact CB-CH2 4.47Å; R804-W942 HydrophobicContact CB-CZ3 3.82Å; R804-W942 HydrophobicContact CG-CE3 4.3Å; R804-W942 HydrophobicContact CG-CH2 4.35Å; R804-W942 HydrophobicContact CG-CZ3 4.13Å; R804-T943 WeakPolarHBondContact O-CB 3.32Å; R804-T943 PolarHBondContact O-N 3.04Å
805	F	97.8	Very high	92.6	Very high	4 Å²	4	27 Å²	27	2%	0.018	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	148.7	-171.2	-56.2	-81.5	0	0	0	112	I799 G803 W822 L879 T943 V945 A948 C952	I799-F805 HydrophobicContact CB-CD2 4.45Å; I799-F805 HydrophobicContact CD1-CD1 3.77Å; I799-F805 HydrophobicContact CD1-CD2 4.41Å; I799-F805 HydrophobicContact CD1-CE1 4Å; I799-F805 HydrophobicContact CD1-CG 3.98Å; I799-F805 HydrophobicContact CD1-CZ 4.39Å; I799-F805 HydrophobicContact CG1-CB 4.33Å; I799-F805 HydrophobicContact CG1-CD1 4.37Å; I799-F805 HydrophobicContact CG1-CD2 4.27Å; I799-F805 HydrophobicContact CG1-CG 4.05Å; I799-F805 HydrophobicContact CG2-CD2 3.44Å; I799-F805 VanDerWaalsContact CG2-CD2 3.44Å; I799-F805 HydrophobicContact CG2-CE2 3.35Å; I799-F805 HydrophobicContact CG2-CG 4.09Å; I799-F805 HydrophobicContact CG2-CZ 3.95Å; G803-F805 VanDerWaalsContact C-CE2 3.49Å; F805-W822 HydrophobicContact CB-CH2 4.49Å; F805-L879 HydrophobicContact CB-CB 4.46Å; F805-L879 PolarHBondContact N-O 2.93Å; F805-L879 PolarHBondContact O-N 2.82Å; F805-T943 CarbonylContact C-O 3.51Å; F805-T943 VanDerWaalsContact CA-O 3.23Å; F805-T943 WeakPolarHBondContact CA-O 3.4Å; F805-T943 HydrophobicContact CD1-CG2 4.49Å; F805-V945 HydrophobicContact CB-CG1 4.03Å; F805-A948 HydrophobicContact CD1-CB 3.93Å; F805-A948 HydrophobicContact CE1-CB 3.53Å; F805-A948 HydrophobicContact CZ-CB 4.47Å; F805-C952 HydrophobicContact CZ-CB 4.4Å
806	Y	98.3	Very high	91.9	Very high	1 Å²	1	27.8 Å²	27.8	0%	0.004	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	143.1	-173.8	178.9	-97.2	0	0	0	112.6	E808 G876 C877 F878 F934 Y936 P938 T943 P944 V945	Y806-E808 HydrophobicContact CE1-CG 3.58Å; Y806-E808 WeakPolarHBondContact OH-CG 3.33Å; Y806-E808 PolarHBondContact OH-OE1 3.03Å; Y806-G876 WeakPolarHBondContact OH-CA 3.16Å; Y806-C877 WeakPolarHBondContact CA-O 3.12Å; Y806-F878 AromaticContact CD2-CD1 3.63Å; Y806-F878 HydrophobicContact CD2-CD1 3.63Å; Y806-F878 HydrophobicContact CD2-CD2 4.06Å; Y806-F878 AromaticContact CD2-CE1 3.53Å; Y806-F878 HydrophobicContact CD2-CE1 3.53Å; Y806-F878 AromaticContact CD2-CE2 3.96Å; Y806-F878 HydrophobicContact CD2-CE2 3.96Å; Y806-F878 AromaticContact CD2-CG 3.91Å; Y806-F878 HydrophobicContact CD2-CG 3.91Å; Y806-F878 AromaticContact CD2-CZ 3.7Å; Y806-F878 HydrophobicContact CD2-CZ 3.7Å; Y806-F878 HydrophobicContact CE2-CD1 4.2Å; Y806-F878 HydrophobicContact CE2-CD2 4.09Å; Y806-F878 AromaticContact CE2-CE1 3.73Å; Y806-F878 HydrophobicContact CE2-CE1 3.73Å; Y806-F878 AromaticContact CE2-CE2 3.58Å; Y806-F878 HydrophobicContact CE2-CE2 3.58Å; Y806-F878 HydrophobicContact CE2-CG 4.38Å; Y806-F878 AromaticContact CE2-CZ 3.39Å; Y806-F878 HydrophobicContact CE2-CZ 3.39Å; Y806-F934 HydrophobicContact CD1-CD1 4.25Å; Y806-F934 AromaticContact CD1-CD2 3.86Å; Y806-F934 HydrophobicContact CD1-CD2 3.86Å; Y806-F934 AromaticContact CD1-CE1 3.98Å; Y806-F934 HydrophobicContact CD1-CE1 3.98Å; Y806-F934 AromaticContact CD1-CE2 3.54Å; Y806-F934 HydrophobicContact CD1-CE2 3.54Å; Y806-F934 HydrophobicContact CD1-CG 4.21Å; Y806-F934 AromaticContact CD1-CZ 3.62Å; Y806-F934 HydrophobicContact CD1-CZ 3.62Å; Y806-F934 HydrophobicContact CE1-CB 4.39Å; Y806-F934 AromaticContact CE1-CD1 3.84Å; Y806-F934 HydrophobicContact CE1-CD1 3.84Å; Y806-F934 AromaticContact CE1-CD2 3.86Å; Y806-F934 HydrophobicContact CE1-CD2 3.86Å; Y806-F934 HydrophobicContact CE1-CE1 4Å; Y806-F934 AromaticContact CE1-CE2 3.99Å; Y806-F934 HydrophobicContact CE1-CE2 3.99Å; Y806-F934 AromaticContact CE1-CG 3.78Å; Y806-F934 HydrophobicContact CE1-CG 3.78Å; Y806-F934 HydrophobicContact CE1-CZ 4.07Å; Y806-Y936 PolarHBondContact OH-O 2.69Å; Y806-P938 HydrophobicContact CD1-CB 3.84Å; Y806-P938 HydrophobicContact CD1-CG 3.62Å; Y806-P938 HydrophobicContact CD2-CB 3.79Å; Y806-P938 HydrophobicContact CD2-CG 4.46Å; Y806-P938 HydrophobicContact CE1-CB 4.01Å; Y806-P938 HydrophobicContact CE1-CG 3.94Å; Y806-P938 HydrophobicContact CE2-CB 3.96Å; Y806-P938 HydrophobicContact CG-CB 3.71Å; Y806-P938 HydrophobicContact CG-CG 3.88Å; Y806-T943 PolarHBondContact N-O 3Å; Y806-P944 WeakPolarHBondContact O-CA 3.06Å; Y806-V945 PolarHBondContact O-N 3.26Å
807	F	98.4	Very high	91.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	165.2	166.8	74.7	-84.5	0	0	0	110.4	V809 W822 C877 P916 L927 N928 F929 V945	F807-V809 HydrophobicContact CD2-CG2 3.89Å; F807-V809 HydrophobicContact CE2-CG2 3.37Å; F807-V809 HydrophobicContact CZ-CG2 4.4Å; F807-W822 AromaticContact CD1-CH2 3.6Å; F807-W822 HydrophobicContact CD1-CH2 3.6Å; F807-W822 AromaticContact CD1-CZ2 3.55Å; F807-W822 HydrophobicContact CD1-CZ2 3.55Å; F807-W822 HydrophobicContact CD1-CZ3 4.33Å; F807-W822 HydrophobicContact CE1-CD2 4.12Å; F807-W822 AromaticContact CE1-CE2 3.63Å; F807-W822 HydrophobicContact CE1-CE3 4.33Å; F807-W822 AromaticContact CE1-CH2 3.7Å; F807-W822 HydrophobicContact CE1-CH2 3.7Å; F807-W822 AromaticContact CE1-CZ2 3.42Å; F807-W822 HydrophobicContact CE1-CZ2 3.42Å; F807-W822 VanDerWaalsContact CE1-CZ2 3.42Å; F807-W822 HydrophobicContact CE1-CZ3 4.15Å; F807-C877 HydrophobicContact CD1-CB 3.62Å; F807-C877 HydrophobicContact CD2-CB 4.28Å; F807-C877 HydrophobicContact CE1-CB 3.29Å; F807-C877 HydrophobicContact CE2-CB 4.02Å; F807-C877 HydrophobicContact CG-CB 4.1Å; F807-C877 HydrophobicContact CZ-CB 3.51Å; F807-C877 PolarHBondContact N-O 2.8Å; F807-C877 PolarHBondContact O-N 2.84Å; F807-P916 HydrophobicContact CD1-CB 4.17Å; F807-P916 HydrophobicContact CD1-CG 3.95Å; F807-P916 HydrophobicContact CD2-CB 4.42Å; F807-P916 HydrophobicContact CE1-CB 3.74Å; F807-P916 HydrophobicContact CE1-CG 3.87Å; F807-P916 HydrophobicContact CE2-CB 4.01Å; F807-P916 HydrophobicContact CG-CB 4.49Å; F807-P916 HydrophobicContact CG-CG 4.46Å; F807-P916 HydrophobicContact CZ-CB 3.66Å; F807-P916 HydrophobicContact CZ-CG 4.31Å; F807-L927 HydrophobicContact CE2-CD2 4.21Å; F807-N928 WeakPolarHBondContact CB-O 3.39Å; F807-F929 HydrophobicContact CB-CD1 4.24Å; F807-F929 HydrophobicContact CD2-CE1 4.45Å; F807-V945 HydrophobicContact CB-CG1 4.47Å; F807-V945 HydrophobicContact CB-CG2 3.94Å; F807-V945 HydrophobicContact CD1-CG1 4.48Å
808	E	98.4	Very high	91.4	Very high	4 Å²	4	27 Å²	27	2%	0.019	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	147.5	178.8	-72	178.4	158.8	0	0	111.7	Y806 V874 I875 L927 N928 F934 K935 Y936	Y806-E808 HydrophobicContact CE1-CG 3.58Å; Y806-E808 WeakPolarHBondContact OH-CG 3.33Å; Y806-E808 PolarHBondContact OH-OE1 3.03Å; E808-V874 HydrophobicContact CB-CG1 3.72Å; E808-V874 HydrophobicContact CG-CG1 3.74Å; E808-I875 CarbonylContact C-O 3.54Å; E808-I875 WeakPolarHBondContact CA-O 3.39Å; E808-L927 WeakPolarHBondContact O-CA 3.4Å; E808-N928 HydrophobicContact CB-CB 4.19Å; E808-N928 PolarHBondContact N-O 2.89Å; E808-N928 PolarHBondContact O-N 3.48Å; E808-F934 HydrophobicContact CB-CD1 4.28Å; E808-F934 HydrophobicContact CG-CD1 3.74Å; E808-F934 HydrophobicContact CG-CE1 4.3Å; E808-F934 HydrophobicContact CG-CG 4.46Å; E808-F934 WeakPolarHBondContact OE2-CA 3.27Å; E808-F934 WeakPolarHBondContact OE2-CD1 3.41Å; E808-K935 PolarHBondContact OE1-N 2.88Å; E808-K935 PolarHBondContact OE2-N 2.67Å; E808-Y936 PolarHBondContact OE1-N 2.86Å
809	V	98.4	Very high	91.4	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.006	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	135.4	169.8	-172.3	0	0	0	0	109.5	F807 V820 I875 V918 V925 E926 L927	F807-V809 HydrophobicContact CD2-CG2 3.89Å; F807-V809 HydrophobicContact CE2-CG2 3.37Å; F807-V809 HydrophobicContact CZ-CG2 4.4Å; V809-V820 HydrophobicContact CB-CG1 4.05Å; V809-V820 HydrophobicContact CG1-CG1 3.76Å; V809-V820 HydrophobicContact CG2-CB 4.24Å; V809-V820 HydrophobicContact CG2-CG1 4.15Å; V809-I875 PolarHBondContact N-O 2.74Å; V809-I875 PolarHBondContact O-N 3Å; V809-V918 HydrophobicContact CG2-CG1 4.5Å; V809-V925 HydrophobicContact CG1-CB 3.81Å; V809-V925 HydrophobicContact CG1-CG1 4.13Å; V809-V925 HydrophobicContact CG1-CG2 4.03Å; V809-E926 CarbonylContact C-O 3.58Å; V809-E926 WeakPolarHBondContact CA-O 3.48Å; V809-L927 HydrophobicContact CG1-CG 4.41Å; V809-L927 HydrophobicContact CG2-CD2 4.15Å; V809-L927 HydrophobicContact CG2-CG 4.16Å
810	T	96.7	Very high	91.5	Very high	23 Å²	23	28.6 Å²	28.6	14%	0.141	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	115.7	178.3	-50.6	0	0	0	0	108.8	I812 V874 V925 E926	T810-I812 HydrophobicContact CG2-CG2 4.2Å; T810-I812 PolarHBondContact O-N 3.04Å; T810-V874 HydrophobicContact CG2-CG2 4.19Å; T810-V874 WeakPolarHBondContact OG1-CG2 3.4Å; T810-V925 CarbonylContact O-C 3.56Å; T810-V925 WeakPolarHBondContact O-CA 3.49Å; T810-E926 PolarHBondContact N-O 2.91Å; T810-E926 PolarHBondContact O-N 2.69Å
811	P	93.6	Very high	91.8	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	125.4	163.9	-20.8	35.2	0	0	0	109.5	W818 F869 E871 G872 D873	P811-W818 HydrophobicContact CB-CD2 4.08Å; P811-W818 HydrophobicContact CB-CG 4.44Å; P811-W818 HydrophobicContact CB-CZ2 4.16Å; P811-W818 HydrophobicContact CG-CD2 4.12Å; P811-W818 HydrophobicContact CG-CG 4.23Å; P811-F869 HydrophobicContact CG-CD2 3.73Å; P811-F869 HydrophobicContact CG-CE2 3.74Å; P811-E871 WeakPolarHBondContact O-CA 3.29Å; P811-G872 PolarHBondContact O-N 2.83Å; P811-D873 WeakPolarHBondContact CD-O 3.31Å
812	I	92.1	Very high	92.3	Very high	35 Å²	35	23.4 Å²	23.4	18%	0.179	13%	0.13	C	C	.	.			trans	-111.6	3.1	-179.7	60.9	172.9	0	0	0	112.3	I560 Q781 T810 T924 E926	I560-I812 HydrophobicContact CD1-CB 4.46Å; I560-I812 HydrophobicContact CD1-CD1 4.5Å; I560-I812 HydrophobicContact CD1-CG1 4.26Å; I560-I812 WeakPolarHBondContact CD1-O 3.3Å; Q781-I812 HydrophobicContact CG-CD1 4.35Å; T810-I812 HydrophobicContact CG2-CG2 4.2Å; T810-I812 PolarHBondContact O-N 3.04Å; I812-T924 HydrophobicContact CD1-CG2 3.69Å; I812-T924 HydrophobicContact CG1-CG2 3.7Å; I812-T924 PolarHBondContact N-O 2.94Å; I812-T924 VanDerWaalsContact N-O 3.16Å; I812-E926 HydrophobicContact CG2-CB 4.05Å
813	E	84.8	Confident	92.7	Very high	11 Å²	11	17 Å²	17	5%	0.051	10%	0.097	C	C	.	.			trans	-128.3	138.1	174.4	-172.4	175.6	-174.7	0	0	107.9	R559 I560 T815 W818 S923 T924	R559-E813 WeakPolarHBondContact CD-OE1 3.49Å; R559-E813 IonicContact NE-OE1 2.85Å; R559-E813 IonicContact NE-OE2 2.63Å; I560-E813 HydrophobicContact CD1-CB 4.43Å; E813-T815 VanDerWaalsContact C-N 3.27Å; E813-T815 VanDerWaalsContact CD-OG1 3.31Å; E813-T815 HydrophobicContact CG-CG2 4.45Å; E813-T815 PolarHBondContact OE1-OG1 3.41Å; E813-W818 WeakPolarHBondContact O-CZ2 3.09Å; E813-S923 WeakPolarHBondContact OE2-CA 3.45Å; E813-T924 WeakPolarHBondContact OE2-CB 3.24Å; E813-T924 PolarHBondContact OE2-N 3.29Å; E813-T924 PolarHBondContact OE2-OG1 3.38Å
814	S	76.5	Confident	92.9	Very high	83 Å²	83	16.5 Å²	16.5	58%	0.58	9%	0.091	S	C	*	.	S	Bend	trans	-80.7	-9.9	179.8	27.1	0	0	0	0	113.5	E871	S814-E871 WeakPolarHBondContact CA-OE2 3.13Å; S814-E871 WeakPolarHBondContact CB-OE2 3.48Å; S814-E871 PolarHBondContact N-OE2 2.88Å; S814-E871 PolarHBondContact OG-OE2 3.22Å
815	T	75.4	Confident	92.6	Very high	33 Å²	33	13.9 Å²	13.9	20%	0.202	8%	0.082	C	C	.	.	S	Bend	trans	-89.4	147.3	-178.6	78	0	0	0	0	111	I557 E813 W818 N922 S923	I557-T815 HydrophobicContact CD1-CG2 4.16Å; I557-T815 HydrophobicContact CG2-CG2 3.99Å; E813-T815 VanDerWaalsContact C-N 3.27Å; E813-T815 VanDerWaalsContact CD-OG1 3.31Å; E813-T815 HydrophobicContact CG-CG2 4.45Å; E813-T815 PolarHBondContact OE1-OG1 3.41Å; T815-W818 VanDerWaalsContact O-CZ2 3.25Å; T815-W818 WeakPolarHBondContact O-CZ2 3.3Å; T815-N922 CarbonylContact C-O 3.54Å; T815-N922 PolarHBondContact OG1-O 3.47Å; T815-S923 WeakPolarHBondContact O-CB 3.28Å
816	G	82.8	Confident	92.3	Very high	17 Å²	17	18.1 Å²	18.1	18%	0.175	11%	0.105	C	C	.	.	S	Bend	trans	84	-160.6	170.3	0	0	0	0	0	115.4	W818 N844 L921	G816-W818 WeakPolarHBondContact O-CH2 3.13Å; G816-N844 PolarHBondContact O-OD1 3.05Å; G816-L921 CarbonylContact C-O 3.43Å; G816-L921 WeakPolarHBondContact CA-O 2.95Å
817	L	88.5	Confident	92	Very high	20 Å²	20	18.4 Å²	18.4	11%	0.105	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	156.9	-175.3	-61.2	177.7	0	0	0	112.2	W790 D843 N844 L921 S923	W790-L817 HydrophobicContact CH2-CB 3.44Å; W790-L817 VanDerWaalsContact CH2-CB 3.44Å; W790-L817 HydrophobicContact CH2-CD1 4.21Å; W790-L817 HydrophobicContact CH2-CG 4.47Å; W790-L817 HydrophobicContact CZ2-CB 3.98Å; W790-L817 HydrophobicContact CZ2-CD1 3.9Å; W790-L817 HydrophobicContact CZ3-CB 4.16Å; L817-D843 VanDerWaalsContact CD2-C 3.5Å; L817-N844 HydrophobicContact CD2-CB 4.18Å; L817-N844 WeakPolarHBondContact CD2-OD1 3.45Å; L817-N844 VanDerWaalsContact CG-OD1 3.3Å; L817-N844 WeakPolarHBondContact CG-OD1 2.77Å; L817-L921 HydrophobicContact CB-CB 4.2Å; L817-L921 HydrophobicContact CD1-CD2 4.11Å; L817-L921 HydrophobicContact CG-CD2 4.46Å; L817-L921 PolarHBondContact N-O 2.83Å; L817-L921 PolarHBondContact O-N 3.12Å; L817-S923 PolarHBondContact O-OG 2.87Å
818	W	91.3	Very high	91.8	Very high	14 Å²	14	22 Å²	22	5%	0.053	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	138.2	-176.8	-49.6	-86	0	0	0	110.9	P811 E813 T815 G816 G841 F869 L920 S923 V925	P811-W818 HydrophobicContact CB-CD2 4.08Å; P811-W818 HydrophobicContact CB-CG 4.44Å; P811-W818 HydrophobicContact CB-CZ2 4.16Å; P811-W818 HydrophobicContact CG-CD2 4.12Å; P811-W818 HydrophobicContact CG-CG 4.23Å; E813-W818 WeakPolarHBondContact O-CZ2 3.09Å; T815-W818 VanDerWaalsContact O-CZ2 3.25Å; T815-W818 WeakPolarHBondContact O-CZ2 3.3Å; G816-W818 WeakPolarHBondContact O-CH2 3.13Å; W818-G841 WeakPolarHBondContact O-CA 3.36Å; W818-F869 HydrophobicContact CB-CE2 3.81Å; W818-F869 HydrophobicContact CB-CZ 3.96Å; W818-F869 HydrophobicContact CD2-CE2 4.31Å; W818-F869 HydrophobicContact CE3-CD2 4.47Å; W818-F869 HydrophobicContact CE3-CE2 4.09Å; W818-F869 HydrophobicContact CG-CE2 4.2Å; W818-L920 HydrophobicContact CB-CD2 4.39Å; W818-L920 HydrophobicContact CG-CD2 4.37Å; W818-S923 VanDerWaalsContact CD1-OG 3.31Å; W818-S923 PolarHBondContact NE1-OG 2.9Å; W818-S923 VanDerWaalsContact NE1-OG 3.09Å; W818-V925 HydrophobicContact CG-CG1 4.26Å
819	R	95.2	Very high	91.6	Very high	35 Å²	35	22.6 Å²	22.6	13%	0.132	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	132.1	160.9	-60.6	175.3	-174.6	-178.8	-0.6	108	W790 V831 Y840 V918 S919	W790-R819 HydrophobicContact CH2-CG 3.8Å; W790-R819 HydrophobicContact CZ3-CB 4.48Å; W790-R819 HydrophobicContact CZ3-CG 3.77Å; R819-V831 HydrophobicContact CB-CG1 3.52Å; R819-Y840 CarbonylContact C-O 3.49Å; R819-Y840 VanDerWaalsContact CA-O 3.25Å; R819-Y840 WeakPolarHBondContact CA-O 3.12Å; R819-V918 CarbonylContact O-C 3.55Å; R819-V918 VanDerWaalsContact O-CA 3.27Å; R819-V918 WeakPolarHBondContact O-CA 3.44Å; R819-S919 PolarHBondContact N-O 2.92Å; R819-S919 PolarHBondContact O-N 2.88Å
820	V	97.6	Very high	91.5	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	143.9	-178.8	-55.8	0	0	0	0	109.4	V809 Y840 I875 W888 V918	V809-V820 HydrophobicContact CB-CG1 4.05Å; V809-V820 HydrophobicContact CG1-CG1 3.76Å; V809-V820 HydrophobicContact CG2-CB 4.24Å; V809-V820 HydrophobicContact CG2-CG1 4.15Å; V820-Y840 HydrophobicContact CG2-CD1 4.31Å; V820-Y840 PolarHBondContact N-O 3.39Å; V820-Y840 PolarHBondContact O-N 3.08Å; V820-I875 HydrophobicContact CG2-CB 4.42Å; V820-I875 HydrophobicContact CG2-CG2 3.8Å; V820-W888 PolarHBondContact O-NE1 2.97Å; V820-V918 HydrophobicContact CB-CG1 4.5Å; V820-V918 HydrophobicContact CG1-CG1 4.09Å
821	G	97.6	Very high	91.5	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.3	-137.4	178.2	0	0	0	0	0	113.7	F838 T917	G821-F838 WeakPolarHBondContact CA-O 3.26Å; G821-T917 PolarHBondContact N-O 3.33Å; G821-T917 PolarHBondContact O-N 3.01Å
822	W	98.4	Very high	91.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	135	-168.8	-55.6	90.9	0	0	0	110.4	I799 F805 F807 G837 F838 C877 F878 L879 I886 L914 Y915 P916 V945	I799-W822 HydrophobicContact CG1-CZ3 4.28Å; F805-W822 HydrophobicContact CB-CH2 4.49Å; F807-W822 AromaticContact CD1-CH2 3.6Å; F807-W822 HydrophobicContact CD1-CH2 3.6Å; F807-W822 AromaticContact CD1-CZ2 3.55Å; F807-W822 HydrophobicContact CD1-CZ2 3.55Å; F807-W822 HydrophobicContact CD1-CZ3 4.33Å; F807-W822 HydrophobicContact CE1-CD2 4.12Å; F807-W822 AromaticContact CE1-CE2 3.63Å; F807-W822 HydrophobicContact CE1-CE3 4.33Å; F807-W822 AromaticContact CE1-CH2 3.7Å; F807-W822 HydrophobicContact CE1-CH2 3.7Å; F807-W822 AromaticContact CE1-CZ2 3.42Å; F807-W822 HydrophobicContact CE1-CZ2 3.42Å; F807-W822 VanDerWaalsContact CE1-CZ2 3.42Å; F807-W822 HydrophobicContact CE1-CZ3 4.15Å; W822-G837 CarbonylContact O-C 3.42Å; W822-G837 WeakPolarHBondContact O-CA 3.33Å; W822-F838 PolarHBondContact N-O 3.29Å; W822-F838 PolarHBondContact O-N 3.41Å; W822-C877 HydrophobicContact CZ2-CB 4.5Å; W822-F878 PolarHBondContact NE1-O 3.11Å; W822-L879 HydrophobicContact CD2-CB 4.13Å; W822-L879 HydrophobicContact CD2-CD2 4.15Å; W822-L879 HydrophobicContact CE3-CB 4.44Å; W822-L879 HydrophobicContact CE3-CD2 3.77Å; W822-L879 HydrophobicContact CH2-CB 3.74Å; W822-L879 HydrophobicContact CH2-CD2 3.99Å; W822-L879 HydrophobicContact CZ2-CB 3.38Å; W822-L879 HydrophobicContact CZ2-CD2 4.36Å; W822-L879 HydrophobicContact CZ2-CG 4.48Å; W822-L879 HydrophobicContact CZ3-CB 4.26Å; W822-L879 HydrophobicContact CZ3-CD2 3.68Å; W822-I886 HydrophobicContact CB-CD1 4.27Å; W822-I886 HydrophobicContact CG-CD1 4.37Å; W822-L914 HydrophobicContact CB-CB 4.4Å; W822-L914 HydrophobicContact CB-CD2 4.36Å; W822-L914 HydrophobicContact CE3-CB 4.28Å; W822-Y915 WeakPolarHBondContact CA-O 3.3Å; W822-P916 HydrophobicContact CE3-CG 4.26Å; W822-P916 HydrophobicContact CH2-CG 4.37Å; W822-P916 HydrophobicContact CZ3-CG 3.81Å; W822-V945 HydrophobicContact CH2-CG1 3.72Å; W822-V945 HydrophobicContact CZ3-CG1 4.24Å
823	S	97	Very high	91.3	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	148.8	175.7	-173.7	0	0	0	0	110.8	Y836 Y915 T917	S823-Y836 WeakPolarHBondContact CA-O 3.28Å; S823-Y915 PolarHBondContact N-O 3.12Å; S823-Y915 PolarHBondContact O-N 3.01Å; S823-T917 VanDerWaalsContact CB-OG1 3.24Å; S823-T917 WeakPolarHBondContact CB-OG1 3.49Å; S823-T917 PolarHBondContact N-OG1 2.76Å
824	T	95.2	Very high	91.7	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	168.8	170.7	78.6	0	0	0	0	111.4	R794 D826 G827 Y836 L905 T912 A913 L914	R794-T824 PolarHBondContact NH1-O 3.22Å; R794-T824 VanDerWaalsContact NH1-O 3.08Å; T824-D826 PolarHBondContact O-N 2.78Å; T824-D826 PolarHBondContact OG1-N 2.86Å; T824-G827 PolarHBondContact O-N 2.81Å; T824-G827 PolarHBondContact OG1-N 2.73Å; T824-Y836 PolarHBondContact N-O 3.31Å; T824-Y836 VanDerWaalsContact N-O 3.08Å; T824-Y836 WeakPolarHBondContact OG1-CB 3.4Å; T824-L905 HydrophobicContact CG2-CD2 3.79Å; T824-T912 HydrophobicContact CG2-CG2 3.61Å; T824-A913 WeakPolarHBondContact CA-O 3.46Å; T824-L914 HydrophobicContact CG2-CD2 3.9Å
825	D	91.5	Very high	92.5	Very high	9 Å²	9	24.7 Å²	24.7	5%	0.048	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-5	174.3	53.8	-29.3	0	0	0	114.1	Y915 K954 R957	D825-Y915 HydrophobicContact CB-CD2 4.45Å; D825-Y915 HydrophobicContact CB-CE2 3.78Å; D825-K954 IonicContact OD1-NZ 2.73Å; D825-K954 PolarHBondContact OD1-NZ 3Å; D825-K954 IonicContact OD2-NZ 3.39Å; D825-K954 PolarHBondContact OD2-NZ 3.09Å; D825-R957 VanDerWaalsContact CG-NH2 3.34Å; D825-R957 PolarHBondContact O-NH2 2.87Å; D825-R957 IonicContact OD2-CZ 3.48Å; D825-R957 IonicContact OD2-NE 3.49Å; D825-R957 PolarHBondContact OD2-NE 2.83Å; D825-R957 IonicContact OD2-NH2 3.42Å; D825-R957 PolarHBondContact OD2-NH2 3.01Å
826	D	90.4	Very high	93.4	Very high	92 Å²	92	26.9 Å²	26.9	49%	0.492	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-10.4	171.5	-62.3	-36.9	0	0	0	112.3	T824 R957	T824-D826 PolarHBondContact O-N 2.78Å; T824-D826 PolarHBondContact OG1-N 2.86Å; D826-R957 IonicContact OD1-CZ 3.51Å; D826-R957 IonicContact OD1-NH1 2.71Å; D826-R957 IonicContact OD1-NH2 2.74Å; D826-R957 PolarHBondContact OD1-NH2 3.2Å
827	G	91.7	Very high	94	Very high	8 Å²	8	26 Å²	26	8%	0.082	13%	0.129	C	C	.	.	S	Bend	trans	-78.3	161.6	177.7	0	0	0	0	0	114.3	R794 T824 D834 Y836	R794-G827 PolarHBondContact NH1-O 3.29Å; T824-G827 PolarHBondContact O-N 2.81Å; T824-G827 PolarHBondContact OG1-N 2.73Å; G827-D834 WeakPolarHBondContact CA-OD2 3.21Å; G827-Y836 VanDerWaalsContact CA-CB 3.5Å
828	N	94.1	Very high	94.5	Very high	74 Å²	74	25.1 Å²	25.1	40%	0.396	13%	0.125	S	C	.	.			trans	-61.5	147	169.1	-164	-14.9	0	0	0	110.1	I830 T833 D834	N828-I830 PolarHBondContact O-N 2.83Å; N828-I830 PolarHBondContact OD1-N 2.68Å; N828-I830 VanDerWaalsContact OD1-N 3.16Å; N828-T833 WeakPolarHBondContact CB-OG1 3.29Å; N828-T833 PolarHBondContact ND2-OG1 3.06Å; N828-T833 VanDerWaalsContact ND2-OG1 3.08Å; N828-D834 WeakPolarHBondContact CB-OD2 3.49Å; N828-D834 PolarHBondContact N-OD2 3.39Å
829	L	95.5	Very high	94.7	Very high	18 Å²	18	24.5 Å²	24.5	9%	0.094	12%	0.122	C	C	.	.	S	Bend	trans	-70	-24.6	173.2	-74.4	174.8	0	0	0	111.8	D768 A769 T770 G792 R794 V831 S919	D768-L829 VanDerWaalsContact O-CD2 3.27Å; D768-L829 WeakPolarHBondContact O-CD2 3.5Å; A769-L829 VanDerWaalsContact C-CD1 3.47Å; T770-L829 HydrophobicContact CG2-CB 4.16Å; T770-L829 HydrophobicContact CG2-CD1 4.01Å; G792-L829 WeakPolarHBondContact CA-O 3.37Å; R794-L829 HydrophobicContact CB-CD2 4.46Å; R794-L829 HydrophobicContact CG-CD2 4.14Å; R794-L829 VanDerWaalsContact CZ-CD2 3.48Å; L829-V831 PolarHBondContact O-N 3.25Å; L829-S919 PolarHBondContact O-OG 3.18Å
830	I	95.6	Very high	94.8	Very high	22 Å²	22	22.8 Å²	22.8	11%	0.113	12%	0.116	C	C	.	.	S	Bend	trans	-79.6	98.7	169.3	-46.5	-48.1	0	0	0	107.7	T770 W790 N828 G832 T833 S919	T770-I830 HydrophobicContact CG2-CD1 4.37Å; W790-I830 HydrophobicContact CB-CD1 3.96Å; W790-I830 HydrophobicContact CB-CG1 4.35Å; W790-I830 HydrophobicContact CB-CG2 3.94Å; W790-I830 HydrophobicContact CG-CG2 4.37Å; W790-I830 VanDerWaalsContact O-CD1 3.31Å; W790-I830 WeakPolarHBondContact O-CD1 3.48Å; N828-I830 PolarHBondContact O-N 2.83Å; N828-I830 PolarHBondContact OD1-N 2.68Å; N828-I830 VanDerWaalsContact OD1-N 3.16Å; I830-G832 PolarHBondContact O-N 3.49Å; I830-T833 HydrophobicContact CB-CG2 3.87Å; I830-T833 HydrophobicContact CG2-CG2 3.66Å; I830-T833 WeakPolarHBondContact O-CG2 3.42Å; I830-T833 PolarHBondContact O-N 2.9Å; I830-T833 PolarHBondContact O-OG1 3.16Å; I830-T833 VanDerWaalsContact O-OG1 3.1Å; I830-S919 VanDerWaalsContact CA-OG 3.32Å; I830-S919 WeakPolarHBondContact CA-OG 3.47Å
831	V	96.9	Very high	94.6	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	136.6	-171.6	72.6	0	0	0	0	110.9	R819 L829 F838 T917 S919	R819-V831 HydrophobicContact CB-CG1 3.52Å; L829-V831 PolarHBondContact O-N 3.25Å; V831-F838 WeakPolarHBondContact CG2-O 3.27Å; V831-T917 HydrophobicContact CB-CG2 3.94Å; V831-T917 HydrophobicContact CG2-CG2 4.26Å; V831-S919 PolarHBondContact N-OG 3.32Å
832	G	90.9	Very high	93.6	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	88	-3.3	178.7	0	0	0	0	0	115.5	I830 D834 G837 I857 H858 C859 D860	I830-G832 PolarHBondContact O-N 3.49Å; G832-D834 VanDerWaalsContact C-N 3.29Å; G832-D834 PolarHBondContact O-N 3.41Å; G832-G837 WeakPolarHBondContact CA-O 3.34Å; G832-I857 WeakPolarHBondContact CA-O 3.25Å; G832-H858 CarbonylContact O-C 3.19Å; G832-H858 VanDerWaalsContact O-CA 3.32Å; G832-H858 WeakPolarHBondContact O-CA 3.39Å; G832-C859 PolarHBondContact O-N 2.81Å; G832-D860 PolarHBondContact O-N 3.09Å
833	T	91.1	Very high	91.9	Very high	28 Å²	28	26 Å²	26	17%	0.172	14%	0.136	C	C	.	.	S	Bend	trans	-80.8	-7.8	179.8	66.7	0	0	0	0	114.1	N828 I830 D860	N828-T833 WeakPolarHBondContact CB-OG1 3.29Å; N828-T833 PolarHBondContact ND2-OG1 3.06Å; N828-T833 VanDerWaalsContact ND2-OG1 3.08Å; I830-T833 HydrophobicContact CB-CG2 3.87Å; I830-T833 HydrophobicContact CG2-CG2 3.66Å; I830-T833 WeakPolarHBondContact O-CG2 3.42Å; I830-T833 PolarHBondContact O-N 2.9Å; I830-T833 PolarHBondContact O-OG1 3.16Å; I830-T833 VanDerWaalsContact O-OG1 3.1Å; T833-D860 VanDerWaalsContact CA-OD1 3.27Å; T833-D860 WeakPolarHBondContact CA-OD1 3.39Å; T833-D860 WeakPolarHBondContact CB-OD1 3.38Å; T833-D860 WeakPolarHBondContact CG2-OD1 3.43Å
834	D	92.4	Very high	89.9	Confident	37 Å²	37	31.4 Å²	31.4	20%	0.198	17%	0.165	C	C	.	.	S	Bend	trans	-143.4	-179.1	-179	63.7	28.3	0	0	0	111	G827 N828 G832 Y836 G837 H858 C859	G827-D834 WeakPolarHBondContact CA-OD2 3.21Å; N828-D834 WeakPolarHBondContact CB-OD2 3.49Å; N828-D834 PolarHBondContact N-OD2 3.39Å; G832-D834 VanDerWaalsContact C-N 3.29Å; G832-D834 PolarHBondContact O-N 3.41Å; D834-Y836 PolarHBondContact O-N 2.83Å; D834-Y836 WeakPolarHBondContact OD1-CA 3.47Å; D834-Y836 WeakPolarHBondContact OD1-CB 3.41Å; D834-Y836 PolarHBondContact OD1-N 3.12Å; D834-G837 PolarHBondContact OD1-N 3.39Å; D834-G837 VanDerWaalsContact OD1-N 3.12Å; D834-H858 PolarHBondContact O-ND1 2.78Å; D834-C859 PolarHBondContact O-N 3.12Å; D834-C859 VanDerWaalsContact O-N 3.17Å
835	Q	92.6	Very high	87.6	Confident	110 Å²	110	39.1 Å²	39.1	51%	0.514	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-2.5	-179.6	69.1	-179.5	-0.8	0	0	114.6	H858 C859	Q835-H858 PolarHBondContact O-CE1 2.93Å; Q835-C859 WeakPolarHBondContact CA-SG 3.19Å
836	Y	94.9	Very high	85.3	Confident	78 Å²	78	39 Å²	39	31%	0.306	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107	-12.8	-174.6	-58.7	-61.6	0	0	0	113	S823 T824 G827 D834 L905	S823-Y836 WeakPolarHBondContact CA-O 3.28Å; T824-Y836 PolarHBondContact N-O 3.31Å; T824-Y836 VanDerWaalsContact N-O 3.08Å; T824-Y836 WeakPolarHBondContact OG1-CB 3.4Å; G827-Y836 VanDerWaalsContact CA-CB 3.5Å; D834-Y836 PolarHBondContact O-N 2.83Å; D834-Y836 WeakPolarHBondContact OD1-CA 3.47Å; D834-Y836 WeakPolarHBondContact OD1-CB 3.41Å; D834-Y836 PolarHBondContact OD1-N 3.12Å; Y836-L905 HydrophobicContact CD1-CD2 3.92Å; Y836-L905 HydrophobicContact CE1-CD2 4.47Å
837	G	95.8	Very high	82.7	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	140.2	179.1	0	0	0	0	0	113.5	W822 G832 D834 H858	W822-G837 CarbonylContact O-C 3.42Å; W822-G837 WeakPolarHBondContact O-CA 3.33Å; G832-G837 WeakPolarHBondContact CA-O 3.34Å; D834-G837 PolarHBondContact OD1-N 3.39Å; D834-G837 VanDerWaalsContact OD1-N 3.12Å; G837-H858 PolarHBondContact O-ND1 3.19Å
838	F	98.2	Very high	80.2	Confident	1 Å²	1	44 Å²	44	0%	0.004	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	114.7	176.5	-54	-87.8	0	0	0	108.4	G821 W822 V831 H858 I886 W888 Y899 L905 L914	G821-F838 WeakPolarHBondContact CA-O 3.26Å; W822-F838 PolarHBondContact N-O 3.29Å; W822-F838 PolarHBondContact O-N 3.41Å; V831-F838 WeakPolarHBondContact CG2-O 3.27Å; F838-H858 AromaticContact CD1-CE1 3.85Å; F838-H858 AromaticContact CD1-ND1 3.53Å; F838-H858 AromaticContact CE1-CE1 3.35Å; F838-H858 WeakPolarHBondContact CE1-CE1 3.33Å; F838-H858 AromaticContact CE1-ND1 3.54Å; F838-H858 AromaticContact CE1-NE2 3.83Å; F838-H858 AromaticContact CZ-CE1 3.78Å; F838-I886 HydrophobicContact CB-CD1 3.79Å; F838-I886 HydrophobicContact CD1-CD1 4.3Å; F838-I886 HydrophobicContact CD2-CD1 3.56Å; F838-I886 HydrophobicContact CE2-CD1 4.21Å; F838-I886 HydrophobicContact CG-CD1 3.62Å; F838-W888 HydrophobicContact CB-CH2 4.43Å; F838-Y899 HydrophobicContact CB-CD2 4.01Å; F838-Y899 HydrophobicContact CB-CE2 4.15Å; F838-Y899 HydrophobicContact CD1-CD1 4.08Å; F838-Y899 AromaticContact CD1-CD2 3.94Å; F838-Y899 HydrophobicContact CD1-CD2 3.94Å; F838-Y899 HydrophobicContact CD1-CE2 4.43Å; F838-Y899 AromaticContact CD1-CG 3.73Å; F838-Y899 HydrophobicContact CD1-CG 3.73Å; F838-Y899 HydrophobicContact CE1-CG 4.43Å; F838-Y899 HydrophobicContact CG-CD2 4.4Å; F838-L905 HydrophobicContact CE2-CD1 4.25Å; F838-L905 HydrophobicContact CZ-CD1 3.97Å; F838-L914 HydrophobicContact CD2-CD2 4.48Å; F838-L914 HydrophobicContact CE2-CD2 4.32Å
839	G	97.3	Very high	77.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	150.5	-173.7	0	0	0	0	0	113.4	R856 I857	G839-R856 CarbonylContact O-C 3.54Å; G839-R856 WeakPolarHBondContact O-CA 3.19Å; G839-I857 PolarHBondContact N-O 3.13Å; G839-I857 PolarHBondContact O-N 2.96Å
840	Y	97.2	Very high	75.3	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.6	169.4	175.6	-116.3	0	0	0	110.1	R819 V820 K855 Y865 E867 F869 I875 W888 F895	R819-Y840 CarbonylContact C-O 3.49Å; R819-Y840 VanDerWaalsContact CA-O 3.25Å; R819-Y840 WeakPolarHBondContact CA-O 3.12Å; V820-Y840 HydrophobicContact CG2-CD1 4.31Å; V820-Y840 PolarHBondContact N-O 3.39Å; V820-Y840 PolarHBondContact O-N 3.08Å; Y840-K855 WeakPolarHBondContact CA-O 3.28Å; Y840-K855 WeakPolarHBondContact CD2-O 3.34Å; Y840-Y865 AromaticContact CD2-CD1 3.63Å; Y840-Y865 HydrophobicContact CD2-CD1 3.63Å; Y840-Y865 AromaticContact CD2-CE1 4Å; Y840-Y865 HydrophobicContact CD2-CE1 4Å; Y840-Y865 AromaticContact CE2-CD1 3.61Å; Y840-Y865 HydrophobicContact CE2-CD1 3.61Å; Y840-Y865 HydrophobicContact CE2-CE1 4.05Å; Y840-Y865 WeakPolarHBondContact CE2-O 3.12Å; Y840-E867 PolarHBondContact OH-N 2.95Å; Y840-E867 VanDerWaalsContact OH-N 3.09Å; Y840-E867 PolarHBondContact OH-O 2.78Å; Y840-F869 HydrophobicContact CD1-CD1 4.48Å; Y840-F869 AromaticContact CD1-CE1 3.88Å; Y840-F869 HydrophobicContact CD1-CE1 3.88Å; Y840-F869 AromaticContact CE1-CD1 3.73Å; Y840-F869 HydrophobicContact CE1-CD1 3.73Å; Y840-F869 AromaticContact CE1-CE1 3.57Å; Y840-F869 HydrophobicContact CE1-CE1 3.57Å; Y840-I875 HydrophobicContact CD1-CG2 3.93Å; Y840-I875 HydrophobicContact CE1-CG2 4.11Å; Y840-W888 VanDerWaalsContact CB-CD2 3.41Å; Y840-W888 HydrophobicContact CD1-CB 3.93Å; Y840-W888 AromaticContact CD1-CD1 3.96Å; Y840-W888 HydrophobicContact CD1-CD2 4.35Å; Y840-W888 AromaticContact CD1-CG 3.81Å; Y840-W888 HydrophobicContact CD1-CG 3.81Å; Y840-W888 HydrophobicContact CE1-CB 4.28Å; Y840-W888 HydrophobicContact CG-CB 4.21Å; Y840-W888 AromaticContact CG-CD2 3.9Å; Y840-W888 HydrophobicContact CG-CD2 3.9Å; Y840-W888 HydrophobicContact CG-CE3 4.26Å; Y840-W888 AromaticContact CG-CG 3.85Å; Y840-W888 HydrophobicContact CG-CG 3.85Å; Y840-F895 HydrophobicContact CE1-CE2 4.29Å; Y840-F895 AromaticContact CZ-CE2 3.85Å; Y840-F895 VanDerWaalsContact OH-CE2 3.24Å; Y840-F895 WeakPolarHBondContact OH-CE2 3.43Å
841	G	92.2	Very high	73.3	Confident	5 Å²	5	55.5 Å²	55.5	5%	0.052	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	-169.9	-176.1	0	0	0	0	0	113.1	W818 K855	W818-G841 WeakPolarHBondContact O-CA 3.36Å; G841-K855 PolarHBondContact N-O 3.43Å; G841-K855 PolarHBondContact O-N 3.24Å
842	A	76.2	Confident	71.9	Confident	15 Å²	15	61.9 Å²	61.9	12%	0.124	33%	0.33	C	S	.	.			trans	-138.7	167.6	171.1	0	0	0	0	0	109.6	A868	A842-A868 HydrophobicContact CB-CB 3.92Å
843	D	63.4	Low	71.5	Confident	48 Å²	48	64.7 Å²	64.7	26%	0.257	34%	0.343	S	S	.	.			trans	-99	165.4	172.9	50.3	19.1	0	0	0	110.9	L817 E845 G846 F847 K855	L817-D843 VanDerWaalsContact CD2-C 3.5Å; D843-E845 PolarHBondContact O-N 2.78Å; D843-G846 WeakPolarHBondContact OD1-CA 3.29Å; D843-G846 PolarHBondContact OD1-N 2.88Å; D843-F847 PolarHBondContact OD1-N 2.97Å; D843-F847 VanDerWaalsContact OD2-CB 3.3Å; D843-F847 WeakPolarHBondContact OD2-CB 3.22Å; D843-F847 PolarHBondContact OD2-N 2.86Å; D843-K855 IonicContact OD2-NZ 3.96Å
844	N	54.4	Low	71.4	Confident	114 Å²	114	63.4 Å²	63.4	61%	0.61	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-27.2	-173.3	-90.2	-22.4	0	0	0	111.8	G816 L817	G816-N844 PolarHBondContact O-OD1 3.05Å; L817-N844 HydrophobicContact CD2-CB 4.18Å; L817-N844 WeakPolarHBondContact CD2-OD1 3.45Å; L817-N844 VanDerWaalsContact CG-OD1 3.3Å; L817-N844 WeakPolarHBondContact CG-OD1 2.77Å
845	E	48.5	Very low	71.2	Confident	162 Å²	162	62.9 Å²	62.9	76%	0.757	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	4	-169.1	-64.9	-172.5	172.8	0	0	112.8	D843	D843-E845 PolarHBondContact O-N 2.78Å
846	G	42.1	Very low	71.3	Confident	7 Å²	7	60.9 Å²	60.9	7%	0.072	32%	0.318	C	S	.	.			trans	50.3	69.5	-176.1	0	0	0	0	0	110.5	D843 G848	D843-G846 WeakPolarHBondContact OD1-CA 3.29Å; D843-G846 PolarHBondContact OD1-N 2.88Å; G846-G848 VanDerWaalsContact C-N 3.31Å; G846-G848 PolarHBondContact O-N 3.44Å
847	F	35.8	Very low	71.3	Confident	164 Å²	164	57.5 Å²	57.5	72%	0.719	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	98.9	176.3	-120.8	-94.6	0	0	0	108.3	D843 K855	D843-F847 PolarHBondContact OD1-N 2.97Å; D843-F847 VanDerWaalsContact OD2-CB 3.3Å; D843-F847 WeakPolarHBondContact OD2-CB 3.22Å; D843-F847 PolarHBondContact OD2-N 2.86Å; F847-K855 PolarHBondContact O-NZ 2.92Å
848	G	39.1	Very low	71.2	Confident	42 Å²	42	59.3 Å²	59.3	43%	0.433	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	157.5	136.9	-168.8	0	0	0	0	0	107.1	G846 N850 G851	G846-G848 VanDerWaalsContact C-N 3.31Å; G846-G848 PolarHBondContact O-N 3.44Å; G848-N850 PolarHBondContact O-N 3.21Å; G848-G851 PolarHBondContact O-N 3.43Å
849	L	40.4	Very low	70.9	Confident	181 Å²	181	61.8 Å²	61.8	95%	0.948	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-16.5	-169.6	-70.8	162.1	0	0	0	115.5
850	N	45.6	Very low	70.3	Confident	133 Å²	133	66.8 Å²	66.8	71%	0.711	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.7	4.2	-175.5	-61.7	-16.6	0	0	0	115	G848 Q852	G848-N850 PolarHBondContact O-N 3.21Å; N850-Q852 WeakPolarHBondContact O-CG 3.48Å; N850-Q852 PolarHBondContact O-N 3.38Å
851	G	53.6	Low	69.7	Low	41 Å²	41	73.1 Å²	73.1	42%	0.423	39%	0.387	S	S	.	.	S	Bend	trans	69	5.6	176.9	0	0	0	0	0	115.7	G848	G848-G851 PolarHBondContact O-N 3.43Å
852	Q	67.5	Low	69.4	Low	134 Å²	134	77.8 Å²	77.8	63%	0.626	41%	0.41	S	S	*	.			trans	-114.8	14.4	-167.8	-72.7	-178.2	21	0	0	113.9	N850 A868	N850-Q852 WeakPolarHBondContact O-CG 3.48Å; N850-Q852 PolarHBondContact O-N 3.38Å; Q852-A868 VanDerWaalsContact C-CB 3.45Å; Q852-A868 PolarHBondContact O-N 2.94Å
853	Q	84.2	Confident	69.9	Low	59 Å²	59	81.4 Å²	81.4	28%	0.276	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	114.1	-171	-175.7	57	69.3	0	0	112.9	K855 N864 G866	Q853-K855 PolarHBondContact O-NZ 2.63Å; Q853-N864 HydrophobicContact CG-CB 4.08Å; Q853-N864 VanDerWaalsContact CG-OD1 3.24Å; Q853-N864 WeakPolarHBondContact CG-OD1 3.13Å; Q853-G866 PolarHBondContact NE2-O 3.08Å
854	G	88.9	Confident	71.1	Confident	0 Å²	0	84.1 Å²	84.1	0%	0	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	163.5	171.2	0	0	0	0	0	112.4	Y865 A868	G854-Y865 CarbonylContact C-O 3.52Å; G854-Y865 VanDerWaalsContact CA-O 3.22Å; G854-Y865 WeakPolarHBondContact CA-O 3.23Å; G854-Y865 PolarHBondContact O-N 2.86Å; G854-Y865 VanDerWaalsContact O-N 3.08Å; G854-A868 VanDerWaalsContact N-N 3.11Å
855	K	88.5	Confident	73	Confident	27 Å²	27	79.8 Å²	79.8	12%	0.117	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	135.6	-176.3	-59.7	-66.1	-171.5	-87.9	0	111.3	Y840 G841 D843 F847 Q853 I862 E863 N864 Y865	Y840-K855 WeakPolarHBondContact CA-O 3.28Å; Y840-K855 WeakPolarHBondContact CD2-O 3.34Å; G841-K855 PolarHBondContact N-O 3.43Å; G841-K855 PolarHBondContact O-N 3.24Å; D843-K855 IonicContact OD2-NZ 3.96Å; F847-K855 PolarHBondContact O-NZ 2.92Å; Q853-K855 PolarHBondContact O-NZ 2.63Å; K855-I862 HydrophobicContact CB-CG2 3.92Å; K855-I862 HydrophobicContact CD-CG2 3.92Å; K855-I862 HydrophobicContact CG-CG2 4.06Å; K855-E863 CarbonylContact C-O 3.48Å; K855-E863 VanDerWaalsContact CA-O 3.24Å; K855-E863 WeakPolarHBondContact CA-O 2.94Å; K855-N864 WeakPolarHBondContact CD-OD1 3.21Å; K855-N864 VanDerWaalsContact CE-OD1 3.23Å; K855-N864 WeakPolarHBondContact CE-OD1 3.38Å; K855-N864 PolarHBondContact NZ-OD1 2.81Å; K855-Y865 PolarHBondContact N-O 3.12Å
856	R	94.5	Very high	75	Confident	67 Å²	67	73.1 Å²	73.1	25%	0.253	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	140.4	164.9	72.7	176.1	179.5	-167.1	-4.6	108.8	G839 I862 E863 Y865 A898 Y899	G839-R856 CarbonylContact O-C 3.54Å; G839-R856 WeakPolarHBondContact O-CA 3.19Å; R856-I862 WeakPolarHBondContact O-CA 3.44Å; R856-E863 HydrophobicContact CG-CB 4.03Å; R856-E863 IonicContact CZ-OE2 2.77Å; R856-E863 PolarHBondContact N-O 2.89Å; R856-E863 IonicContact NE-OE2 3.95Å; R856-E863 PolarHBondContact NE-OE2 2.93Å; R856-E863 IonicContact NH2-OE2 2.71Å; R856-E863 PolarHBondContact NH2-OE2 3.04Å; R856-E863 PolarHBondContact O-N 2.87Å; R856-Y865 HydrophobicContact CB-CD1 4.15Å; R856-Y865 HydrophobicContact CB-CG 4.05Å; R856-Y865 HydrophobicContact CG-CG 4.4Å; R856-A898 PolarHBondContact NH1-O 3.03Å; R856-Y899 HydrophobicContact CB-CE2 4.05Å; R856-Y899 WeakPolarHBondContact CB-OH 3.37Å; R856-Y899 HydrophobicContact CG-CE1 4.46Å; R856-Y899 WeakPolarHBondContact CG-OH 3.46Å
857	I	93.4	Very high	77.3	Confident	7 Å²	7	75.8 Å²	75.8	4%	0.036	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	129.2	178.6	-173	174.6	0	0	0	113.4	G832 G839 E861 I862 Y899	G832-I857 WeakPolarHBondContact CA-O 3.25Å; G839-I857 PolarHBondContact N-O 3.13Å; G839-I857 PolarHBondContact O-N 2.96Å; I857-E861 VanDerWaalsContact CA-O 3.31Å; I857-E861 WeakPolarHBondContact CA-O 3.23Å; I857-I862 HydrophobicContact CB-CG1 4.23Å; I857-I862 HydrophobicContact CD1-CD1 4.02Å; I857-I862 HydrophobicContact CD1-CG1 3.66Å; I857-I862 HydrophobicContact CG1-CG1 3.82Å; I857-Y899 WeakPolarHBondContact CA-OH 3.45Å; I857-Y899 PolarHBondContact N-OH 3.45Å; I857-Y899 PolarHBondContact O-OH 3.36Å
858	H	94.9	Very high	79.7	Confident	39 Å²	39	68.7 Å²	68.7	18%	0.181	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	139.7	176.2	178.4	65.7	0	0	0	109.3	G832 D834 Q835 G837 F838 D860 E861 Y899	G832-H858 CarbonylContact O-C 3.19Å; G832-H858 VanDerWaalsContact O-CA 3.32Å; G832-H858 WeakPolarHBondContact O-CA 3.39Å; D834-H858 PolarHBondContact O-ND1 2.78Å; Q835-H858 PolarHBondContact O-CE1 2.93Å; G837-H858 PolarHBondContact O-ND1 3.19Å; F838-H858 AromaticContact CD1-CE1 3.85Å; F838-H858 AromaticContact CD1-ND1 3.53Å; F838-H858 AromaticContact CE1-CE1 3.35Å; F838-H858 WeakPolarHBondContact CE1-CE1 3.33Å; F838-H858 AromaticContact CE1-ND1 3.54Å; F838-H858 AromaticContact CE1-NE2 3.83Å; F838-H858 AromaticContact CZ-CE1 3.78Å; H858-D860 PolarHBondContact O-N 2.91Å; H858-E861 PolarHBondContact N-O 2.7Å; H858-E861 WeakPolarHBondContact O-CB 3.49Å; H858-E861 PolarHBondContact O-N 3.36Å; H858-Y899 HydrophobicContact CB-CD1 4.43Å; H858-Y899 HydrophobicContact CB-CE1 3.63Å
859	C	91.5	Very high	82.1	Confident	53 Å²	53	67.3 Å²	67.3	36%	0.358	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	35.2	-175.1	-63.8	0	0	0	0	115.1	G832 D834 Q835 E861	G832-C859 PolarHBondContact O-N 2.81Å; D834-C859 PolarHBondContact O-N 3.12Å; D834-C859 VanDerWaalsContact O-N 3.17Å; Q835-C859 WeakPolarHBondContact CA-SG 3.19Å; C859-E861 PolarHBondContact O-N 3.23Å; C859-E861 VanDerWaalsContact O-N 3.1Å
860	D	84.3	Confident	84.3	Confident	104 Å²	104	62 Å²	62	56%	0.556	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	8.6	-172.3	-79.2	-39.4	0	0	0	114.9	G832 T833 H858	G832-D860 PolarHBondContact O-N 3.09Å; T833-D860 VanDerWaalsContact CA-OD1 3.27Å; T833-D860 WeakPolarHBondContact CA-OD1 3.39Å; T833-D860 WeakPolarHBondContact CB-OD1 3.38Å; T833-D860 WeakPolarHBondContact CG2-OD1 3.43Å; H858-D860 PolarHBondContact O-N 2.91Å
861	E	84	Confident	86.4	Confident	134 Å²	134	60.1 Å²	60.1	63%	0.626	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	125.1	173	-60.6	-170.9	160.6	0	0	109.8	I857 H858 C859	I857-E861 VanDerWaalsContact CA-O 3.31Å; I857-E861 WeakPolarHBondContact CA-O 3.23Å; H858-E861 PolarHBondContact N-O 2.7Å; H858-E861 WeakPolarHBondContact O-CB 3.49Å; H858-E861 PolarHBondContact O-N 3.36Å; C859-E861 PolarHBondContact O-N 3.23Å; C859-E861 VanDerWaalsContact O-N 3.1Å
862	I	86.4	Confident	88.1	Confident	102 Å²	102	60 Å²	60	52%	0.523	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	125.3	-176.5	-58.6	175.3	0	0	0	109.1	K855 R856 I857	K855-I862 HydrophobicContact CB-CG2 3.92Å; K855-I862 HydrophobicContact CD-CG2 3.92Å; K855-I862 HydrophobicContact CG-CG2 4.06Å; R856-I862 WeakPolarHBondContact O-CA 3.44Å; I857-I862 HydrophobicContact CB-CG1 4.23Å; I857-I862 HydrophobicContact CD1-CD1 4.02Å; I857-I862 HydrophobicContact CD1-CG1 3.66Å; I857-I862 HydrophobicContact CG1-CG1 3.82Å
863	E	86.8	Confident	89.3	Confident	91 Å²	91	54.8 Å²	54.8	43%	0.425	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	155.3	-179.7	-63.3	-177.2	151.3	0	0	111.9	K855 R856 Y865	K855-E863 CarbonylContact C-O 3.48Å; K855-E863 VanDerWaalsContact CA-O 3.24Å; K855-E863 WeakPolarHBondContact CA-O 2.94Å; R856-E863 HydrophobicContact CG-CB 4.03Å; R856-E863 IonicContact CZ-OE2 2.77Å; R856-E863 PolarHBondContact N-O 2.89Å; R856-E863 IonicContact NE-OE2 3.95Å; R856-E863 PolarHBondContact NE-OE2 2.93Å; R856-E863 IonicContact NH2-OE2 2.71Å; R856-E863 PolarHBondContact NH2-OE2 3.04Å; R856-E863 PolarHBondContact O-N 2.87Å; E863-Y865 PolarHBondContact O-N 2.85Å
864	N	90	Very high	90	Very high	106 Å²	106	52 Å²	52	57%	0.567	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	128.4	175.9	-70.3	-29.5	0	0	0	110.7	Q853 K855	Q853-N864 HydrophobicContact CG-CB 4.08Å; Q853-N864 VanDerWaalsContact CG-OD1 3.24Å; Q853-N864 WeakPolarHBondContact CG-OD1 3.13Å; K855-N864 WeakPolarHBondContact CD-OD1 3.21Å; K855-N864 VanDerWaalsContact CE-OD1 3.23Å; K855-N864 WeakPolarHBondContact CE-OD1 3.38Å; K855-N864 PolarHBondContact NZ-OD1 2.81Å
865	Y	92.9	Very high	90.4	Very high	22 Å²	22	52 Å²	52	9%	0.086	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	138.5	178.3	171	-95.9	0	0	0	109.6	Y840 G854 K855 R856 E863 W888 F895 G896 A898	Y840-Y865 AromaticContact CD2-CD1 3.63Å; Y840-Y865 HydrophobicContact CD2-CD1 3.63Å; Y840-Y865 AromaticContact CD2-CE1 4Å; Y840-Y865 HydrophobicContact CD2-CE1 4Å; Y840-Y865 AromaticContact CE2-CD1 3.61Å; Y840-Y865 HydrophobicContact CE2-CD1 3.61Å; Y840-Y865 HydrophobicContact CE2-CE1 4.05Å; Y840-Y865 WeakPolarHBondContact CE2-O 3.12Å; G854-Y865 CarbonylContact C-O 3.52Å; G854-Y865 VanDerWaalsContact CA-O 3.22Å; G854-Y865 WeakPolarHBondContact CA-O 3.23Å; G854-Y865 PolarHBondContact O-N 2.86Å; G854-Y865 VanDerWaalsContact O-N 3.08Å; K855-Y865 PolarHBondContact N-O 3.12Å; R856-Y865 HydrophobicContact CB-CD1 4.15Å; R856-Y865 HydrophobicContact CB-CG 4.05Å; R856-Y865 HydrophobicContact CG-CG 4.4Å; E863-Y865 PolarHBondContact O-N 2.85Å; Y865-W888 HydrophobicContact CD1-CE3 4.46Å; Y865-W888 HydrophobicContact CE1-CB 4.3Å; Y865-W888 AromaticContact CE1-CE3 3.68Å; Y865-W888 HydrophobicContact CE1-CE3 3.68Å; Y865-W888 HydrophobicContact CE1-CZ3 4.46Å; Y865-W888 PolarHBondContact OH-N 2.73Å; Y865-W888 VanDerWaalsContact OH-N 3.15Å; Y865-F895 HydrophobicContact CE1-CB 4.17Å; Y865-F895 HydrophobicContact CE1-CD2 4Å; Y865-F895 HydrophobicContact CE2-CB 4.08Å; Y865-F895 WeakPolarHBondContact OH-CB 3.35Å; Y865-G896 WeakPolarHBondContact CE2-O 3.45Å; Y865-G896 VanDerWaalsContact CZ-O 3.28Å; Y865-G896 PolarHBondContact OH-O 3.49Å; Y865-A898 HydrophobicContact CD1-CB 4.34Å; Y865-A898 HydrophobicContact CD2-CB 4.1Å; Y865-A898 HydrophobicContact CE1-CB 3.9Å; Y865-A898 HydrophobicContact CE2-CB 3.61Å; Y865-A898 HydrophobicContact CG-CB 4.43Å; Y865-A898 VanDerWaalsContact CZ-CB 3.49Å
866	G	91.6	Very high	90.9	Very high	23 Å²	23	50.8 Å²	50.8	24%	0.237	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	59.6	-153.5	178.3	0	0	0	0	0	113.9	Q853	Q853-G866 PolarHBondContact NE2-O 3.08Å
867	E	89.5	Confident	91.1	Very high	63 Å²	63	47.6 Å²	47.6	29%	0.294	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	139.9	-173.5	-61.3	-179.3	144.9	0	0	111.3	Y840 R890 F895	Y840-E867 PolarHBondContact OH-N 2.95Å; Y840-E867 VanDerWaalsContact OH-N 3.09Å; Y840-E867 PolarHBondContact OH-O 2.78Å; E867-R890 VanDerWaalsContact CD-NH2 3.33Å; E867-R890 IonicContact OE1-NH2 3.98Å; E867-R890 IonicContact OE2-CZ 2.74Å; E867-R890 IonicContact OE2-NE 3.91Å; E867-R890 PolarHBondContact OE2-NE 3.33Å; E867-R890 IonicContact OE2-NH2 3.27Å; E867-R890 PolarHBondContact OE2-NH2 3.38Å; E867-F895 HydrophobicContact CB-CE1 4.25Å; E867-F895 HydrophobicContact CB-CZ 3.95Å; E867-F895 HydrophobicContact CG-CE1 3.88Å; E867-F895 HydrophobicContact CG-CZ 4.1Å
868	A	87.4	Confident	91.3	Very high	15 Å²	15	47.3 Å²	47.3	12%	0.124	26%	0.262	C	S	.	.			trans	-58.6	152	175.6	0	0	0	0	0	110.5	A842 Q852 G854 R890	A842-A868 HydrophobicContact CB-CB 3.92Å; Q852-A868 VanDerWaalsContact C-CB 3.45Å; Q852-A868 PolarHBondContact O-N 2.94Å; G854-A868 VanDerWaalsContact N-N 3.11Å; A868-R890 WeakPolarHBondContact O-CD 3.46Å; A868-R890 PolarHBondContact O-NH1 2.97Å
869	F	88.7	Confident	91.5	Very high	12 Å²	12	45.5 Å²	45.5	5%	0.053	25%	0.253	C	S	.	.			trans	-138.4	154.1	-176.3	61.3	-91.2	0	0	0	110.8	P811 W818 Y840 D873 I875 R890	P811-F869 HydrophobicContact CG-CD2 3.73Å; P811-F869 HydrophobicContact CG-CE2 3.74Å; W818-F869 HydrophobicContact CB-CE2 3.81Å; W818-F869 HydrophobicContact CB-CZ 3.96Å; W818-F869 HydrophobicContact CD2-CE2 4.31Å; W818-F869 HydrophobicContact CE3-CD2 4.47Å; W818-F869 HydrophobicContact CE3-CE2 4.09Å; W818-F869 HydrophobicContact CG-CE2 4.2Å; Y840-F869 HydrophobicContact CD1-CD1 4.48Å; Y840-F869 AromaticContact CD1-CE1 3.88Å; Y840-F869 HydrophobicContact CD1-CE1 3.88Å; Y840-F869 AromaticContact CE1-CD1 3.73Å; Y840-F869 HydrophobicContact CE1-CD1 3.73Å; Y840-F869 AromaticContact CE1-CE1 3.57Å; Y840-F869 HydrophobicContact CE1-CE1 3.57Å; F869-D873 VanDerWaalsContact CA-OD2 3.25Å; F869-D873 WeakPolarHBondContact CA-OD2 3.22Å; F869-D873 HydrophobicContact CB-CB 4Å; F869-D873 WeakPolarHBondContact CB-OD2 3.43Å; F869-I875 HydrophobicContact CB-CD1 3.65Å; F869-I875 HydrophobicContact CD1-CD1 3.8Å; F869-I875 HydrophobicContact CD1-CG1 4.31Å; F869-I875 HydrophobicContact CD2-CD1 3.82Å; F869-I875 HydrophobicContact CD2-CG1 3.86Å; F869-I875 HydrophobicContact CE1-CD1 4.38Å; F869-I875 HydrophobicContact CE1-CG1 4.44Å; F869-I875 HydrophobicContact CE2-CD1 4.4Å; F869-I875 HydrophobicContact CE2-CG1 4.01Å; F869-I875 HydrophobicContact CG-CD1 3.48Å; F869-I875 VanDerWaalsContact CG-CD1 3.48Å; F869-I875 HydrophobicContact CG-CG1 4.02Å; F869-I875 HydrophobicContact CZ-CG1 4.3Å; F869-R890 HydrophobicContact CB-CG 4.37Å
870	S	87.5	Confident	91.7	Very high	69 Å²	69	43 Å²	43	48%	0.483	24%	0.237	S	C	.	.			trans	-132.8	-175.1	-175.8	58.5	0	0	0	0	111.7	G872 D873	S870-G872 PolarHBondContact O-N 3.01Å; S870-D873 PolarHBondContact N-OD2 2.81Å; S870-D873 WeakPolarHBondContact O-CB 3.38Å; S870-D873 PolarHBondContact O-N 2.65Å
871	E	88.2	Confident	92.2	Very high	94 Å²	94	38.2 Å²	38.2	44%	0.439	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.2	131	172.6	-170.6	-176.3	154.4	0	0	112	P811 S814 D873	P811-E871 WeakPolarHBondContact O-CA 3.29Å; S814-E871 WeakPolarHBondContact CA-OE2 3.13Å; S814-E871 WeakPolarHBondContact CB-OE2 3.48Å; S814-E871 PolarHBondContact N-OE2 2.88Å; S814-E871 PolarHBondContact OG-OE2 3.22Å; E871-D873 VanDerWaalsContact C-N 3.31Å; E871-D873 PolarHBondContact O-N 3.4Å
872	G	89.4	Confident	92.6	Very high	39 Å²	39	36.7 Å²	36.7	40%	0.402	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.9	-15.5	177	0	0	0	0	0	115.7	P811 S870	P811-G872 PolarHBondContact O-N 2.83Å; S870-G872 PolarHBondContact O-N 3.01Å
873	D	94.2	Very high	92.9	Very high	24 Å²	24	37 Å²	37	13%	0.128	21%	0.206	C	C	.	.			trans	-67.3	144.9	171.1	-74	-34.1	0	0	0	110.5	P811 F869 S870 E871 I875 R890 N891	P811-D873 WeakPolarHBondContact CD-O 3.31Å; F869-D873 VanDerWaalsContact CA-OD2 3.25Å; F869-D873 WeakPolarHBondContact CA-OD2 3.22Å; F869-D873 HydrophobicContact CB-CB 4Å; F869-D873 WeakPolarHBondContact CB-OD2 3.43Å; S870-D873 PolarHBondContact N-OD2 2.81Å; S870-D873 WeakPolarHBondContact O-CB 3.38Å; S870-D873 PolarHBondContact O-N 2.65Å; E871-D873 VanDerWaalsContact C-N 3.31Å; E871-D873 PolarHBondContact O-N 3.4Å; D873-I875 HydrophobicContact CB-CD1 4.46Å; D873-R890 HydrophobicContact CB-CG 4.42Å; D873-N891 PolarHBondContact OD1-ND2 2.95Å
874	V	97.4	Very high	93.3	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.012	20%	0.195	C	C	.	.			trans	-111.4	123.7	174.9	-176.7	0	0	0	0	110.4	E808 T810 N891 K935 Y936	E808-V874 HydrophobicContact CB-CG1 3.72Å; E808-V874 HydrophobicContact CG-CG1 3.74Å; T810-V874 HydrophobicContact CG2-CG2 4.19Å; T810-V874 WeakPolarHBondContact OG1-CG2 3.4Å; V874-N891 PolarHBondContact N-OD1 3.44Å; V874-N891 PolarHBondContact O-N 2.68Å; V874-K935 HydrophobicContact CB-CD 4.32Å; V874-K935 HydrophobicContact CG2-CB 4.31Å; V874-K935 HydrophobicContact CG2-CD 3.34Å; V874-K935 HydrophobicContact CG2-CG 4.41Å; V874-Y936 HydrophobicContact CB-CD2 3.77Å; V874-Y936 HydrophobicContact CB-CE2 3.64Å; V874-Y936 HydrophobicContact CG1-CD2 4.05Å; V874-Y936 HydrophobicContact CG1-CE2 4.41Å; V874-Y936 HydrophobicContact CG2-CD2 4.42Å; V874-Y936 HydrophobicContact CG2-CE2 4Å
875	I	97.8	Very high	93.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	109.8	-178.2	-49	-53.2	0	0	0	108.4	E808 V809 V820 Y840 F869 D873 S889 R890	E808-I875 CarbonylContact C-O 3.54Å; E808-I875 WeakPolarHBondContact CA-O 3.39Å; V809-I875 PolarHBondContact N-O 2.74Å; V809-I875 PolarHBondContact O-N 3Å; V820-I875 HydrophobicContact CG2-CB 4.42Å; V820-I875 HydrophobicContact CG2-CG2 3.8Å; Y840-I875 HydrophobicContact CD1-CG2 3.93Å; Y840-I875 HydrophobicContact CE1-CG2 4.11Å; F869-I875 HydrophobicContact CB-CD1 3.65Å; F869-I875 HydrophobicContact CD1-CD1 3.8Å; F869-I875 HydrophobicContact CD1-CG1 4.31Å; F869-I875 HydrophobicContact CD2-CD1 3.82Å; F869-I875 HydrophobicContact CD2-CG1 3.86Å; F869-I875 HydrophobicContact CE1-CD1 4.38Å; F869-I875 HydrophobicContact CE1-CG1 4.44Å; F869-I875 HydrophobicContact CE2-CD1 4.4Å; F869-I875 HydrophobicContact CE2-CG1 4.01Å; F869-I875 HydrophobicContact CG-CD1 3.48Å; F869-I875 VanDerWaalsContact CG-CD1 3.48Å; F869-I875 HydrophobicContact CG-CG1 4.02Å; F869-I875 HydrophobicContact CZ-CG1 4.3Å; D873-I875 HydrophobicContact CB-CD1 4.46Å; I875-S889 VanDerWaalsContact CA-O 3.29Å; I875-S889 WeakPolarHBondContact CA-O 3.32Å; I875-R890 HydrophobicContact CD1-CB 4.26Å; I875-R890 HydrophobicContact CD1-CG 4.08Å
876	G	98.5	Very high	94	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	125.2	172.1	0	0	0	0	0	110.1	Y806 F878 W888 S889	Y806-G876 WeakPolarHBondContact OH-CA 3.16Å; G876-F878 WeakPolarHBondContact O-CD2 3.39Å; G876-W888 CarbonylContact O-C 3.6Å; G876-W888 WeakPolarHBondContact O-CA 3.49Å; G876-S889 WeakPolarHBondContact CA-OG 3.47Å; G876-S889 PolarHBondContact N-O 3.04Å; G876-S889 PolarHBondContact N-OG 2.97Å; G876-S889 PolarHBondContact O-N 2.86Å
877	C	98.7	Very high	94.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	114.5	-177.2	-64.7	0	0	0	0	109.6	Y806 F807 W822 W888	Y806-C877 WeakPolarHBondContact CA-O 3.12Å; F807-C877 HydrophobicContact CD1-CB 3.62Å; F807-C877 HydrophobicContact CD2-CB 4.28Å; F807-C877 HydrophobicContact CE1-CB 3.29Å; F807-C877 HydrophobicContact CE2-CB 4.02Å; F807-C877 HydrophobicContact CG-CB 4.1Å; F807-C877 HydrophobicContact CZ-CB 3.51Å; F807-C877 PolarHBondContact N-O 2.8Å; F807-C877 PolarHBondContact O-N 2.84Å; W822-C877 HydrophobicContact CZ2-CB 4.5Å; C877-W888 VanDerWaalsContact SG-CD1 3.57Å
878	F	98.7	Very high	94.7	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.009	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	139	-173.7	-60.8	-101.4	0	0	0	111	Y806 W822 G876 K887 S889 E894 P938 W942	Y806-F878 AromaticContact CD2-CD1 3.63Å; Y806-F878 HydrophobicContact CD2-CD1 3.63Å; Y806-F878 HydrophobicContact CD2-CD2 4.06Å; Y806-F878 AromaticContact CD2-CE1 3.53Å; Y806-F878 HydrophobicContact CD2-CE1 3.53Å; Y806-F878 AromaticContact CD2-CE2 3.96Å; Y806-F878 HydrophobicContact CD2-CE2 3.96Å; Y806-F878 AromaticContact CD2-CG 3.91Å; Y806-F878 HydrophobicContact CD2-CG 3.91Å; Y806-F878 AromaticContact CD2-CZ 3.7Å; Y806-F878 HydrophobicContact CD2-CZ 3.7Å; Y806-F878 HydrophobicContact CE2-CD1 4.2Å; Y806-F878 HydrophobicContact CE2-CD2 4.09Å; Y806-F878 AromaticContact CE2-CE1 3.73Å; Y806-F878 HydrophobicContact CE2-CE1 3.73Å; Y806-F878 AromaticContact CE2-CE2 3.58Å; Y806-F878 HydrophobicContact CE2-CE2 3.58Å; Y806-F878 HydrophobicContact CE2-CG 4.38Å; Y806-F878 AromaticContact CE2-CZ 3.39Å; Y806-F878 HydrophobicContact CE2-CZ 3.39Å; W822-F878 PolarHBondContact NE1-O 3.11Å; G876-F878 WeakPolarHBondContact O-CD2 3.39Å; F878-K887 HydrophobicContact CB-CG 3.55Å; F878-K887 WeakPolarHBondContact CB-O 3.34Å; F878-K887 HydrophobicContact CD2-CG 4.01Å; F878-K887 HydrophobicContact CG-CG 3.89Å; F878-K887 PolarHBondContact N-O 2.92Å; F878-K887 PolarHBondContact O-N 3.45Å; F878-S889 WeakPolarHBondContact CE2-OG 3.47Å; F878-E894 HydrophobicContact CE2-CG 4.26Å; F878-E894 HydrophobicContact CZ-CG 3.86Å; F878-P938 HydrophobicContact CE1-CB 3.85Å; F878-P938 HydrophobicContact CZ-CB 4.39Å; F878-W942 HydrophobicContact CB-CE3 4.32Å; F878-W942 HydrophobicContact CB-CH2 3.74Å; F878-W942 HydrophobicContact CB-CZ2 4.36Å; F878-W942 HydrophobicContact CB-CZ3 3.71Å; F878-W942 AromaticContact CD1-CD2 3.56Å; F878-W942 HydrophobicContact CD1-CD2 3.56Å; F878-W942 AromaticContact CD1-CE2 3.49Å; F878-W942 VanDerWaalsContact CD1-CE2 3.49Å; F878-W942 AromaticContact CD1-CE3 3.69Å; F878-W942 HydrophobicContact CD1-CE3 3.69Å; F878-W942 HydrophobicContact CD1-CG 4.24Å; F878-W942 AromaticContact CD1-CH2 3.8Å; F878-W942 HydrophobicContact CD1-CH2 3.8Å; F878-W942 AromaticContact CD1-CZ2 3.63Å; F878-W942 HydrophobicContact CD1-CZ2 3.63Å; F878-W942 AromaticContact CD1-CZ3 3.82Å; F878-W942 HydrophobicContact CD1-CZ3 3.82Å; F878-W942 HydrophobicContact CE1-CD2 4.08Å; F878-W942 AromaticContact CE1-CE2 3.94Å; F878-W942 HydrophobicContact CE1-CG 4.33Å; F878-W942 HydrophobicContact CE1-CZ2 4.38Å; F878-W942 HydrophobicContact CG-CE3 4.48Å; F878-W942 HydrophobicContact CG-CH2 4.23Å; F878-W942 HydrophobicContact CG-CZ2 4.39Å; F878-W942 HydrophobicContact CG-CZ3 4.27Å
879	L	98.2	Very high	95.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	112.2	173.8	171.4	64.2	0	0	0	109.9	I799 R804 F805 W822 T881 I886 I901 L914	I799-L879 HydrophobicContact CB-CD2 3.92Å; I799-L879 HydrophobicContact CG1-CD2 4.34Å; I799-L879 HydrophobicContact CG2-CD2 3.97Å; R804-L879 CarbonylContact C-O 3.58Å; R804-L879 WeakPolarHBondContact CA-O 3.49Å; F805-L879 HydrophobicContact CB-CB 4.46Å; F805-L879 PolarHBondContact N-O 2.93Å; F805-L879 PolarHBondContact O-N 2.82Å; W822-L879 HydrophobicContact CD2-CB 4.13Å; W822-L879 HydrophobicContact CD2-CD2 4.15Å; W822-L879 HydrophobicContact CE3-CB 4.44Å; W822-L879 HydrophobicContact CE3-CD2 3.77Å; W822-L879 HydrophobicContact CH2-CB 3.74Å; W822-L879 HydrophobicContact CH2-CD2 3.99Å; W822-L879 HydrophobicContact CZ2-CB 3.38Å; W822-L879 HydrophobicContact CZ2-CD2 4.36Å; W822-L879 HydrophobicContact CZ2-CG 4.48Å; W822-L879 HydrophobicContact CZ3-CB 4.26Å; W822-L879 HydrophobicContact CZ3-CD2 3.68Å; L879-T881 HydrophobicContact CD1-CG2 4.09Å; L879-T881 HydrophobicContact CD2-CG2 4.08Å; L879-T881 HydrophobicContact CG-CG2 3.89Å; L879-I886 HydrophobicContact CD1-CD1 4.36Å; L879-I886 HydrophobicContact CD1-CG1 3.93Å; L879-I901 HydrophobicContact CD1-CD1 3.42Å; L879-I901 VanDerWaalsContact CD1-CD1 3.42Å; L879-L914 HydrophobicContact CD1-CD1 3.7Å; L879-L914 HydrophobicContact CD2-CB 4.1Å; L879-L914 HydrophobicContact CD2-CD1 4.14Å
880	D	96.9	Very high	95.5	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.011	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	107.1	171.5	-168.5	-24	0	0	0	109.4	R804 I882 E883 H884 T885 W942	R804-D880 HydrophobicContact CG-CB 4.15Å; R804-D880 WeakPolarHBondContact CG-OD2 3.39Å; R804-D880 IonicContact CZ-OD2 2.62Å; R804-D880 VanDerWaalsContact CZ-OD2 3.27Å; R804-D880 IonicContact NE-OD2 2.83Å; R804-D880 PolarHBondContact NE-OD2 3.49Å; R804-D880 IonicContact NH2-OD2 3.85Å; R804-D880 PolarHBondContact NH2-OD2 2.81Å; D880-I882 VanDerWaalsContact C-N 3.32Å; D880-I882 WeakPolarHBondContact OD1-CA 3.14Å; D880-I882 VanDerWaalsContact OD1-CB 3.26Å; D880-I882 WeakPolarHBondContact OD1-CB 3.41Å; D880-I882 PolarHBondContact OD1-N 3.41Å; D880-E883 HydrophobicContact CB-CB 4.47Å; D880-E883 PolarHBondContact OD1-N 2.9Å; D880-H884 CarbonylContact O-C 3.49Å; D880-H884 WeakPolarHBondContact O-CA 3.35Å; D880-H884 PolarHBondContact O-N 2.84Å; D880-T885 PolarHBondContact N-O 3.18Å; D880-T885 PolarHBondContact O-N 3.44Å; D880-W942 HydrophobicContact CB-CH2 4.14Å; D880-W942 HydrophobicContact CB-CZ3 4.45Å
881	T	93.6	Very high	95.9	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.018	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-0.9	176.5	60.9	0	0	0	0	113.1	I799 G801 L802 G803 L879 L906	I799-T881 HydrophobicContact CG2-CG2 4.25Å; G801-T881 PolarHBondContact O-OG1 3.35Å; L802-T881 WeakPolarHBondContact CA-OG1 3.39Å; L802-T881 WeakPolarHBondContact CD2-O 3.26Å; G803-T881 PolarHBondContact N-OG1 3.43Å; G803-T881 PolarHBondContact O-N 2.84Å; G803-T881 PolarHBondContact O-OG1 2.77Å; G803-T881 VanDerWaalsContact O-OG1 3.04Å; L879-T881 HydrophobicContact CD1-CG2 4.09Å; L879-T881 HydrophobicContact CD2-CG2 4.08Å; L879-T881 HydrophobicContact CG-CG2 3.89Å; T881-L906 HydrophobicContact CG2-CD1 4.48Å; T881-L906 HydrophobicContact CG2-CD2 3.83Å
882	I	92.2	Very high	96.2	Very high	101 Å²	101	24.4 Å²	24.4	52%	0.518	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-49	173.9	-56.2	168.6	0	0	0	109.6	L802 D880 H884	L802-I882 HydrophobicContact CB-CG1 4.41Å; D880-I882 VanDerWaalsContact C-N 3.32Å; D880-I882 WeakPolarHBondContact OD1-CA 3.14Å; D880-I882 VanDerWaalsContact OD1-CB 3.26Å; D880-I882 WeakPolarHBondContact OD1-CB 3.41Å; D880-I882 PolarHBondContact OD1-N 3.41Å; I882-H884 VanDerWaalsContact C-N 3.32Å; I882-H884 PolarHBondContact O-CD2 2.91Å
883	E	93.7	Very high	96.4	Very high	109 Å²	109	27.1 Å²	27.1	51%	0.509	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-4.1	176.1	-65.7	-178.5	-179.5	0	0	112.3	R804 D880 T885 Q900	R804-E883 IonicContact NH2-OE1 3.75Å; R804-E883 PolarHBondContact NH2-OE1 3.19Å; R804-E883 IonicContact NH2-OE2 3.47Å; R804-E883 PolarHBondContact NH2-OE2 3.08Å; D880-E883 HydrophobicContact CB-CB 4.47Å; D880-E883 PolarHBondContact OD1-N 2.9Å; E883-T885 HydrophobicContact CB-CG2 4.36Å; E883-Q900 PolarHBondContact O-NE2 3.28Å
884	H	94.8	Very high	96.5	Very high	46 Å²	46	30 Å²	30	21%	0.213	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	58	46.4	-179.1	-64.2	-122.7	0	0	0	111.7	D880 I882 Q900 I901 L906	D880-H884 CarbonylContact O-C 3.49Å; D880-H884 WeakPolarHBondContact O-CA 3.35Å; D880-H884 PolarHBondContact O-N 2.84Å; I882-H884 VanDerWaalsContact C-N 3.32Å; I882-H884 PolarHBondContact O-CD2 2.91Å; H884-Q900 CarbonylContact O-C 3.33Å; H884-Q900 WeakPolarHBondContact O-CA 3.43Å; H884-Q900 PolarHBondContact O-NE2 2.88Å; H884-Q900 VanDerWaalsContact O-NE2 3.16Å; H884-I901 HydrophobicContact CB-CB 4.25Å; H884-I901 PolarHBondContact O-N 2.83Å; H884-L906 HydrophobicContact CB-CD1 4.16Å; H884-L906 WeakPolarHBondContact ND1-CD1 3.47Å
885	T	98	Very high	96.4	Very high	7 Å²	7	31.1 Å²	31.1	4%	0.043	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	150.7	-179.3	63.7	0	0	0	0	112.9	D880 E883 D897 Y899	D880-T885 PolarHBondContact N-O 3.18Å; D880-T885 PolarHBondContact O-N 3.44Å; E883-T885 HydrophobicContact CB-CG2 4.36Å; T885-D897 HydrophobicContact CG2-CB 4.33Å; T885-Y899 VanDerWaalsContact CA-O 3.31Å; T885-Y899 WeakPolarHBondContact CA-O 3.49Å
886	I	98.6	Very high	96.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	136.1	168.4	-61.7	176.1	0	0	0	107.7	W822 F838 L879 W888 A898 Y899 I901	W822-I886 HydrophobicContact CB-CD1 4.27Å; W822-I886 HydrophobicContact CG-CD1 4.37Å; F838-I886 HydrophobicContact CB-CD1 3.79Å; F838-I886 HydrophobicContact CD1-CD1 4.3Å; F838-I886 HydrophobicContact CD2-CD1 3.56Å; F838-I886 HydrophobicContact CE2-CD1 4.21Å; F838-I886 HydrophobicContact CG-CD1 3.62Å; L879-I886 HydrophobicContact CD1-CD1 4.36Å; L879-I886 HydrophobicContact CD1-CG1 3.93Å; I886-W888 HydrophobicContact CG2-CE3 4.33Å; I886-W888 HydrophobicContact CG2-CH2 3.45Å; I886-W888 VanDerWaalsContact CG2-CH2 3.45Å; I886-W888 HydrophobicContact CG2-CZ2 3.69Å; I886-W888 HydrophobicContact CG2-CZ3 3.82Å; I886-A898 WeakPolarHBondContact O-CB 3.2Å; I886-A898 PolarHBondContact O-N 3.41Å; I886-Y899 HydrophobicContact CB-CD2 4.46Å; I886-Y899 PolarHBondContact N-O 2.86Å; I886-Y899 PolarHBondContact O-N 2.9Å; I886-I901 HydrophobicContact CD1-CD1 4.05Å; I886-I901 HydrophobicContact CD1-CG1 3.92Å; I886-I901 HydrophobicContact CG1-CD1 3.7Å; I886-I901 HydrophobicContact CG1-CG1 3.77Å
887	K	98.2	Very high	96.1	Very high	31 Å²	31	38 Å²	38	14%	0.135	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	169.3	174.8	68.6	-179.6	-171.4	173	0	111.5	F878 E894	F878-K887 HydrophobicContact CB-CG 3.55Å; F878-K887 WeakPolarHBondContact CB-O 3.34Å; F878-K887 HydrophobicContact CD2-CG 4.01Å; F878-K887 HydrophobicContact CG-CG 3.89Å; F878-K887 PolarHBondContact N-O 2.92Å; F878-K887 PolarHBondContact O-N 3.45Å; K887-E894 WeakPolarHBondContact CE-OE2 3.47Å; K887-E894 IonicContact NZ-OE2 2.97Å; K887-E894 PolarHBondContact NZ-OE2 3.16Å
888	W	98.5	Very high	96	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	162.7	178	-68	-92	0	0	0	112.1	V820 F838 Y840 Y865 G876 C877 I886 F895 A898 Y899	V820-W888 PolarHBondContact O-NE1 2.97Å; F838-W888 HydrophobicContact CB-CH2 4.43Å; Y840-W888 VanDerWaalsContact CB-CD2 3.41Å; Y840-W888 HydrophobicContact CD1-CB 3.93Å; Y840-W888 AromaticContact CD1-CD1 3.96Å; Y840-W888 HydrophobicContact CD1-CD2 4.35Å; Y840-W888 AromaticContact CD1-CG 3.81Å; Y840-W888 HydrophobicContact CD1-CG 3.81Å; Y840-W888 HydrophobicContact CE1-CB 4.28Å; Y840-W888 HydrophobicContact CG-CB 4.21Å; Y840-W888 AromaticContact CG-CD2 3.9Å; Y840-W888 HydrophobicContact CG-CD2 3.9Å; Y840-W888 HydrophobicContact CG-CE3 4.26Å; Y840-W888 AromaticContact CG-CG 3.85Å; Y840-W888 HydrophobicContact CG-CG 3.85Å; Y865-W888 HydrophobicContact CD1-CE3 4.46Å; Y865-W888 HydrophobicContact CE1-CB 4.3Å; Y865-W888 AromaticContact CE1-CE3 3.68Å; Y865-W888 HydrophobicContact CE1-CE3 3.68Å; Y865-W888 HydrophobicContact CE1-CZ3 4.46Å; Y865-W888 PolarHBondContact OH-N 2.73Å; Y865-W888 VanDerWaalsContact OH-N 3.15Å; G876-W888 CarbonylContact O-C 3.6Å; G876-W888 WeakPolarHBondContact O-CA 3.49Å; C877-W888 VanDerWaalsContact SG-CD1 3.57Å; I886-W888 HydrophobicContact CG2-CE3 4.33Å; I886-W888 HydrophobicContact CG2-CH2 3.45Å; I886-W888 VanDerWaalsContact CG2-CH2 3.45Å; I886-W888 HydrophobicContact CG2-CZ2 3.69Å; I886-W888 HydrophobicContact CG2-CZ3 3.82Å; W888-F895 HydrophobicContact CB-CD2 4.24Å; W888-F895 WeakPolarHBondContact O-CB 3.41Å; W888-F895 VanDerWaalsContact O-CD2 3.26Å; W888-F895 WeakPolarHBondContact O-CD2 3.3Å; W888-F895 PolarHBondContact O-N 2.86Å; W888-A898 HydrophobicContact CE3-CB 3.66Å; W888-A898 HydrophobicContact CZ3-CB 3.31Å; W888-Y899 AromaticContact CH2-CD2 3.79Å; W888-Y899 HydrophobicContact CH2-CD2 3.79Å; W888-Y899 AromaticContact CH2-CE2 3.61Å; W888-Y899 HydrophobicContact CH2-CE2 3.61Å; W888-Y899 AromaticContact CZ3-CD2 3.74Å; W888-Y899 HydrophobicContact CZ3-CD2 3.74Å; W888-Y899 AromaticContact CZ3-CE2 3.61Å; W888-Y899 HydrophobicContact CZ3-CE2 3.61Å
889	S	97.7	Very high	96	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.007	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	154.3	166.9	67.3	0	0	0	0	110.1	I875 G876 F878 L893	I875-S889 VanDerWaalsContact CA-O 3.29Å; I875-S889 WeakPolarHBondContact CA-O 3.32Å; G876-S889 WeakPolarHBondContact CA-OG 3.47Å; G876-S889 PolarHBondContact N-O 3.04Å; G876-S889 PolarHBondContact N-OG 2.97Å; G876-S889 PolarHBondContact O-N 2.86Å; F878-S889 WeakPolarHBondContact CE2-OG 3.47Å; S889-L893 CarbonylContact C-O 3.19Å; S889-L893 WeakPolarHBondContact CA-O 3.37Å; S889-L893 WeakPolarHBondContact CB-O 3.19Å
890	R	95.3	Very high	95.8	Very high	56 Å²	56	45.5 Å²	45.5	21%	0.211	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	122.2	166.4	-176.8	-179.2	71.5	148.6	7.9	108.4	E867 A868 F869 D873 I875 G892 L893 F895	E867-R890 VanDerWaalsContact CD-NH2 3.33Å; E867-R890 IonicContact OE1-NH2 3.98Å; E867-R890 IonicContact OE2-CZ 2.74Å; E867-R890 IonicContact OE2-NE 3.91Å; E867-R890 PolarHBondContact OE2-NE 3.33Å; E867-R890 IonicContact OE2-NH2 3.27Å; E867-R890 PolarHBondContact OE2-NH2 3.38Å; A868-R890 WeakPolarHBondContact O-CD 3.46Å; A868-R890 PolarHBondContact O-NH1 2.97Å; F869-R890 HydrophobicContact CB-CG 4.37Å; D873-R890 HydrophobicContact CB-CG 4.42Å; I875-R890 HydrophobicContact CD1-CB 4.26Å; I875-R890 HydrophobicContact CD1-CG 4.08Å; R890-G892 PolarHBondContact O-N 3Å; R890-L893 PolarHBondContact N-O 3.06Å; R890-L893 VanDerWaalsContact N-O 3.08Å; R890-L893 WeakPolarHBondContact O-CB 3.24Å; R890-L893 PolarHBondContact O-N 3.21Å; R890-F895 HydrophobicContact CB-CE2 4.13Å; R890-F895 HydrophobicContact CB-CZ 3.6Å
891	N	95.8	Very high	95.6	Very high	52 Å²	52	45.5 Å²	45.5	28%	0.278	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	40.4	179.2	-63.5	-40.3	0	0	0	113.7	D873 V874 L893 Y936	D873-N891 PolarHBondContact OD1-ND2 2.95Å; V874-N891 PolarHBondContact N-OD1 3.44Å; V874-N891 PolarHBondContact O-N 2.68Å; N891-L893 PolarHBondContact O-N 2.85Å; N891-Y936 VanDerWaalsContact CA-CE2 3.42Å; N891-Y936 HydrophobicContact CB-CE1 4.13Å; N891-Y936 HydrophobicContact CB-CE2 4.03Å; N891-Y936 WeakPolarHBondContact CB-OH 3.32Å; N891-Y936 WeakPolarHBondContact O-CD1 3.18Å; N891-Y936 WeakPolarHBondContact O-CE1 3.39Å; N891-Y936 PolarHBondContact OD1-OH 2.91Å; N891-Y936 VanDerWaalsContact OD1-OH 3.12Å
892	G	93.6	Very high	95.4	Very high	38 Å²	38	47.8 Å²	47.8	39%	0.392	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	-6.1	-178.3	0	0	0	0	0	115.3	R890 E894	R890-G892 PolarHBondContact O-N 3Å; G892-E894 PolarHBondContact O-N 2.89Å
893	L	94.8	Very high	95	Very high	95 Å²	95	46.7 Å²	46.7	50%	0.497	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	99.3	170.8	-178.4	64.9	0	0	0	109.3	S889 R890 N891 F895	S889-L893 CarbonylContact C-O 3.19Å; S889-L893 WeakPolarHBondContact CA-O 3.37Å; S889-L893 WeakPolarHBondContact CB-O 3.19Å; R890-L893 PolarHBondContact N-O 3.06Å; R890-L893 VanDerWaalsContact N-O 3.08Å; R890-L893 WeakPolarHBondContact O-CB 3.24Å; R890-L893 PolarHBondContact O-N 3.21Å; N891-L893 PolarHBondContact O-N 2.85Å; L893-F895 HydrophobicContact CD2-CE1 4.38Å; L893-F895 HydrophobicContact CG-CE1 4.43Å
894	E	95.1	Very high	94.5	Very high	85 Å²	85	47.2 Å²	47.2	40%	0.397	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	132.2	176	-66	-178.5	-150.9	0	0	111.6	F878 K887 G892	F878-E894 HydrophobicContact CE2-CG 4.26Å; F878-E894 HydrophobicContact CZ-CG 3.86Å; K887-E894 WeakPolarHBondContact CE-OE2 3.47Å; K887-E894 IonicContact NZ-OE2 2.97Å; K887-E894 PolarHBondContact NZ-OE2 3.16Å; G892-E894 PolarHBondContact O-N 2.89Å
895	F	95	Very high	93.9	Very high	26 Å²	26	45.9 Å²	45.9	11%	0.114	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-89.2	167	169	-50.1	-46.1	0	0	0	110.1	Y840 Y865 E867 W888 R890 L893	Y840-F895 HydrophobicContact CE1-CE2 4.29Å; Y840-F895 AromaticContact CZ-CE2 3.85Å; Y840-F895 VanDerWaalsContact OH-CE2 3.24Å; Y840-F895 WeakPolarHBondContact OH-CE2 3.43Å; Y865-F895 HydrophobicContact CE1-CB 4.17Å; Y865-F895 HydrophobicContact CE1-CD2 4Å; Y865-F895 HydrophobicContact CE2-CB 4.08Å; Y865-F895 WeakPolarHBondContact OH-CB 3.35Å; E867-F895 HydrophobicContact CB-CE1 4.25Å; E867-F895 HydrophobicContact CB-CZ 3.95Å; E867-F895 HydrophobicContact CG-CE1 3.88Å; E867-F895 HydrophobicContact CG-CZ 4.1Å; W888-F895 HydrophobicContact CB-CD2 4.24Å; W888-F895 WeakPolarHBondContact O-CB 3.41Å; W888-F895 VanDerWaalsContact O-CD2 3.26Å; W888-F895 WeakPolarHBondContact O-CD2 3.3Å; W888-F895 PolarHBondContact O-N 2.86Å; R890-F895 HydrophobicContact CB-CE2 4.13Å; R890-F895 HydrophobicContact CB-CZ 3.6Å; L893-F895 HydrophobicContact CD2-CE1 4.38Å; L893-F895 HydrophobicContact CG-CE1 4.43Å
896	G	93.1	Very high	93.1	Very high	55 Å²	55	47.2 Å²	47.2	57%	0.567	26%	0.264	S	S	*	.	P	Polyproline II helix	trans	-63	172.7	173.6	0	0	0	0	0	112.6	Y865 A898	Y865-G896 WeakPolarHBondContact CE2-O 3.45Å; Y865-G896 VanDerWaalsContact CZ-O 3.28Å; Y865-G896 PolarHBondContact OH-O 3.49Å; G896-A898 PolarHBondContact O-N 3.37Å
897	D	97.8	Very high	91.9	Very high	89 Å²	89	50 Å²	50	48%	0.476	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-60.9	126.7	176.8	-62.4	-41.9	0	0	0	111	T885	T885-D897 HydrophobicContact CG2-CB 4.33Å
898	A	97.2	Very high	90.3	Very high	3 Å²	3	53.1 Å²	53.1	3%	0.025	30%	0.304	C	S	.	.			trans	-87.2	-36.8	-179.1	0	0	0	0	0	111.8	R856 Y865 I886 W888 G896	R856-A898 PolarHBondContact NH1-O 3.03Å; Y865-A898 HydrophobicContact CD1-CB 4.34Å; Y865-A898 HydrophobicContact CD2-CB 4.1Å; Y865-A898 HydrophobicContact CE1-CB 3.9Å; Y865-A898 HydrophobicContact CE2-CB 3.61Å; Y865-A898 HydrophobicContact CG-CB 4.43Å; Y865-A898 VanDerWaalsContact CZ-CB 3.49Å; I886-A898 WeakPolarHBondContact O-CB 3.2Å; I886-A898 PolarHBondContact O-N 3.41Å; W888-A898 HydrophobicContact CE3-CB 3.66Å; W888-A898 HydrophobicContact CZ3-CB 3.31Å; G896-A898 PolarHBondContact O-N 3.37Å
899	Y	97.2	Very high	88.8	Confident	28 Å²	28	61.7 Å²	61.7	11%	0.11	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	143.6	-175.9	-61.7	-71.5	0	0	0	111.1	F838 R856 I857 H858 T885 I886 W888	F838-Y899 HydrophobicContact CB-CD2 4.01Å; F838-Y899 HydrophobicContact CB-CE2 4.15Å; F838-Y899 HydrophobicContact CD1-CD1 4.08Å; F838-Y899 AromaticContact CD1-CD2 3.94Å; F838-Y899 HydrophobicContact CD1-CD2 3.94Å; F838-Y899 HydrophobicContact CD1-CE2 4.43Å; F838-Y899 AromaticContact CD1-CG 3.73Å; F838-Y899 HydrophobicContact CD1-CG 3.73Å; F838-Y899 HydrophobicContact CE1-CG 4.43Å; F838-Y899 HydrophobicContact CG-CD2 4.4Å; R856-Y899 HydrophobicContact CB-CE2 4.05Å; R856-Y899 WeakPolarHBondContact CB-OH 3.37Å; R856-Y899 HydrophobicContact CG-CE1 4.46Å; R856-Y899 WeakPolarHBondContact CG-OH 3.46Å; I857-Y899 WeakPolarHBondContact CA-OH 3.45Å; I857-Y899 PolarHBondContact N-OH 3.45Å; I857-Y899 PolarHBondContact O-OH 3.36Å; H858-Y899 HydrophobicContact CB-CD1 4.43Å; H858-Y899 HydrophobicContact CB-CE1 3.63Å; T885-Y899 VanDerWaalsContact CA-O 3.31Å; T885-Y899 WeakPolarHBondContact CA-O 3.49Å; I886-Y899 HydrophobicContact CB-CD2 4.46Å; I886-Y899 PolarHBondContact N-O 2.86Å; I886-Y899 PolarHBondContact O-N 2.9Å; W888-Y899 AromaticContact CH2-CD2 3.79Å; W888-Y899 HydrophobicContact CH2-CD2 3.79Å; W888-Y899 AromaticContact CH2-CE2 3.61Å; W888-Y899 HydrophobicContact CH2-CE2 3.61Å; W888-Y899 AromaticContact CZ3-CD2 3.74Å; W888-Y899 HydrophobicContact CZ3-CD2 3.74Å; W888-Y899 AromaticContact CZ3-CE2 3.61Å; W888-Y899 HydrophobicContact CZ3-CE2 3.61Å
900	Q	95.8	Very high	87.4	Confident	128 Å²	128	67.4 Å²	67.4	60%	0.598	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	118.9	160.3	-167.7	70.2	33.4	0	0	107.9	E883 H884 P902	E883-Q900 PolarHBondContact O-NE2 3.28Å; H884-Q900 CarbonylContact O-C 3.33Å; H884-Q900 WeakPolarHBondContact O-CA 3.43Å; H884-Q900 PolarHBondContact O-NE2 2.88Å; H884-Q900 VanDerWaalsContact O-NE2 3.16Å; Q900-P902 WeakPolarHBondContact O-CD 3.31Å
901	I	91.9	Very high	86.3	Confident	3 Å²	3	69.9 Å²	69.9	2%	0.015	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-73.7	122.9	-177.9	-51.9	167.5	0	0	0	108.8	L879 H884 I886 S903 L905 L906 L914	L879-I901 HydrophobicContact CD1-CD1 3.42Å; L879-I901 VanDerWaalsContact CD1-CD1 3.42Å; H884-I901 HydrophobicContact CB-CB 4.25Å; H884-I901 PolarHBondContact O-N 2.83Å; I886-I901 HydrophobicContact CD1-CD1 4.05Å; I886-I901 HydrophobicContact CD1-CG1 3.92Å; I886-I901 HydrophobicContact CG1-CD1 3.7Å; I886-I901 HydrophobicContact CG1-CG1 3.77Å; I901-S903 PolarHBondContact O-N 2.9Å; I901-L905 HydrophobicContact CG2-CB 4.19Å; I901-L905 HydrophobicContact CG2-CD1 4.46Å; I901-L906 HydrophobicContact CB-CD1 3.99Å; I901-L906 HydrophobicContact CD1-CD1 3.95Å; I901-L906 HydrophobicContact CG2-CD1 3.8Å; I901-L906 HydrophobicContact CG2-CG 3.85Å; I901-L914 HydrophobicContact CD1-CD1 4.23Å
902	P	88.5	Confident	85.9	Confident	50 Å²	50	68.5 Å²	68.5	33%	0.325	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-51.8	130.9	172.5	-25.1	31	0	0	0	111.4	Q900 E904 L905	Q900-P902 WeakPolarHBondContact O-CD 3.31Å; P902-E904 WeakPolarHBondContact CB-OE2 3.22Å; P902-E904 PolarHBondContact O-N 3.23Å; P902-E904 VanDerWaalsContact O-N 3.09Å; P902-L905 HydrophobicContact CB-CD1 4.11Å; P902-L905 HydrophobicContact CG-CD1 3.93Å; P902-L905 WeakPolarHBondContact O-CB 3.5Å; P902-L905 PolarHBondContact O-N 2.61Å
903	S	84.4	Confident	85.9	Confident	79 Å²	79	66.8 Å²	66.8	55%	0.552	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.9	-176.6	-68.6	0	0	0	0	112.3	I901 L905 L906 D907	I901-S903 PolarHBondContact O-N 2.9Å; S903-L905 VanDerWaalsContact C-N 3.26Å; S903-L905 PolarHBondContact O-N 2.61Å; S903-L906 CarbonylContact O-C 3.51Å; S903-L906 PolarHBondContact O-N 2.9Å; S903-D907 PolarHBondContact O-N 3.34Å; S903-D907 VanDerWaalsContact O-N 3.11Å
904	E	83.2	Confident	86	Confident	119 Å²	119	62.3 Å²	62.3	56%	0.556	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-22.5	177.9	-53	80.6	-172.7	0	0	113.6	P902 K910	P902-E904 WeakPolarHBondContact CB-OE2 3.22Å; P902-E904 PolarHBondContact O-N 3.23Å; P902-E904 VanDerWaalsContact O-N 3.09Å; E904-K910 PolarHBondContact O-NZ 2.93Å
905	L	82.6	Confident	86.1	Confident	19 Å²	19	58.2 Å²	58.2	10%	0.099	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-26	176.3	-74.9	161.7	0	0	0	112.2	T824 Y836 F838 I901 P902 S903 T912	T824-L905 HydrophobicContact CG2-CD2 3.79Å; Y836-L905 HydrophobicContact CD1-CD2 3.92Å; Y836-L905 HydrophobicContact CE1-CD2 4.47Å; F838-L905 HydrophobicContact CE2-CD1 4.25Å; F838-L905 HydrophobicContact CZ-CD1 3.97Å; I901-L905 HydrophobicContact CG2-CB 4.19Å; I901-L905 HydrophobicContact CG2-CD1 4.46Å; P902-L905 HydrophobicContact CB-CD1 4.11Å; P902-L905 HydrophobicContact CG-CD1 3.93Å; P902-L905 WeakPolarHBondContact O-CB 3.5Å; P902-L905 PolarHBondContact O-N 2.61Å; S903-L905 VanDerWaalsContact C-N 3.26Å; S903-L905 PolarHBondContact O-N 2.61Å; L905-T912 HydrophobicContact CD2-CG2 4.5Å; L905-T912 WeakPolarHBondContact O-CB 3.25Å
906	L	80.8	Confident	86.3	Confident	35 Å²	35	57 Å²	57	18%	0.183	31%	0.311	C	S	.	.	S	Bend	trans	-99.1	7	177.2	-66.1	175.6	0	0	0	112.7	T881 H884 I901 S903 S908 L914	T881-L906 HydrophobicContact CG2-CD1 4.48Å; T881-L906 HydrophobicContact CG2-CD2 3.83Å; H884-L906 HydrophobicContact CB-CD1 4.16Å; H884-L906 WeakPolarHBondContact ND1-CD1 3.47Å; I901-L906 HydrophobicContact CB-CD1 3.99Å; I901-L906 HydrophobicContact CD1-CD1 3.95Å; I901-L906 HydrophobicContact CG2-CD1 3.8Å; I901-L906 HydrophobicContact CG2-CG 3.85Å; S903-L906 CarbonylContact O-C 3.51Å; S903-L906 PolarHBondContact O-N 2.9Å; L906-S908 PolarHBondContact O-N 3.15Å; L906-L914 HydrophobicContact CD2-CD1 4.16Å
907	D	74.1	Confident	86.5	Confident	57 Å²	57	54.4 Å²	54.4	31%	0.305	28%	0.284	S	S	.	.			trans	-64.3	109.8	176.4	-176.8	3.1	0	0	0	110.6	S903 K909 K910	S903-D907 PolarHBondContact O-N 3.34Å; S903-D907 VanDerWaalsContact O-N 3.11Å; D907-K909 PolarHBondContact O-N 2.82Å; D907-K909 WeakPolarHBondContact OD1-CB 3.47Å; D907-K909 PolarHBondContact OD1-N 2.81Å; D907-K910 HydrophobicContact CB-CG 4.48Å; D907-K910 PolarHBondContact O-N 3.43Å
908	S	63	Low	86.6	Confident	97 Å²	97	50.1 Å²	50.1	68%	0.678	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-49.1	-27.4	176.5	63	0	0	0	0	114.1	L906	L906-S908 PolarHBondContact O-N 3.15Å
909	K	67.5	Low	86.6	Confident	181 Å²	181	50 Å²	50	79%	0.787	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-72	-28.6	179.5	-66.7	-179	179.4	176.4	0	113.6	D907 L911	D907-K909 PolarHBondContact O-N 2.82Å; D907-K909 WeakPolarHBondContact OD1-CB 3.47Å; D907-K909 PolarHBondContact OD1-N 2.81Å; K909-L911 VanDerWaalsContact C-N 3.32Å
910	K	68.6	Low	86.5	Confident	121 Å²	121	48.7 Å²	48.7	53%	0.526	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-82.6	-8.9	-176.5	-70	-174	-176.1	171	0	113.8	E904 D907 T912	E904-K910 PolarHBondContact O-NZ 2.93Å; D907-K910 HydrophobicContact CB-CG 4.48Å; D907-K910 PolarHBondContact O-N 3.43Å; K910-T912 WeakPolarHBondContact CB-OG1 3.33Å; K910-T912 PolarHBondContact O-N 3.42Å; K910-T912 VanDerWaalsContact O-N 3.1Å
911	L	72.3	Confident	86.2	Confident	108 Å²	108	44 Å²	44	57%	0.565	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	54	26.7	-174.9	-56.3	172.1	0	0	0	112.7	K909 K954	K909-L911 VanDerWaalsContact C-N 3.32Å; L911-K954 WeakPolarHBondContact O-CD 3.05Å; L911-K954 WeakPolarHBondContact O-CE 3.49Å; L911-K954 PolarHBondContact O-NZ 2.87Å
912	T	87.1	Confident	86	Confident	22 Å²	22	45.4 Å²	45.4	14%	0.135	24%	0.241	C	C	.	.			trans	-73	142.5	175.9	-54.6	0	0	0	0	109.4	R800 T824 L905 K910	R800-T912 WeakPolarHBondContact CB-O 3.39Å; T824-T912 HydrophobicContact CG2-CG2 3.61Å; L905-T912 HydrophobicContact CD2-CG2 4.5Å; L905-T912 WeakPolarHBondContact O-CB 3.25Å; K910-T912 WeakPolarHBondContact CB-OG1 3.33Å; K910-T912 PolarHBondContact O-N 3.42Å; K910-T912 VanDerWaalsContact O-N 3.1Å
913	A	93.5	Very high	86.1	Confident	2 Å²	2	43 Å²	43	2%	0.017	23%	0.226	C	C	.	.			trans	-133.8	148.1	175.7	0	0	0	0	0	110.2	I799 R800 T824 Y915 K954	I799-A913 CarbonylContact O-C 3.31Å; I799-A913 WeakPolarHBondContact O-CA 3.46Å; R800-A913 HydrophobicContact CB-CB 3.99Å; T824-A913 WeakPolarHBondContact CA-O 3.46Å; A913-Y915 HydrophobicContact CB-CD2 4.47Å; A913-Y915 HydrophobicContact CB-CE2 3.82Å; A913-Y915 WeakPolarHBondContact O-CD2 3.31Å; A913-Y915 WeakPolarHBondContact O-CE2 2.97Å; A913-K954 HydrophobicContact CB-CB 3.66Å; A913-K954 HydrophobicContact CB-CD 3.65Å; A913-K954 HydrophobicContact CB-CG 4.27Å
914	L	96.7	Very high	86.5	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	119.5	173.6	-72.4	168.3	0	0	0	109.5	G798 I799 W822 T824 F838 L879 I901 L906	G798-L914 CarbonylContact C-O 3.48Å; G798-L914 VanDerWaalsContact CA-O 3.28Å; G798-L914 WeakPolarHBondContact CA-O 3.2Å; I799-L914 PolarHBondContact N-O 3.03Å; I799-L914 PolarHBondContact O-N 3.46Å; W822-L914 HydrophobicContact CB-CB 4.4Å; W822-L914 HydrophobicContact CB-CD2 4.36Å; W822-L914 HydrophobicContact CE3-CB 4.28Å; T824-L914 HydrophobicContact CG2-CD2 3.9Å; F838-L914 HydrophobicContact CD2-CD2 4.48Å; F838-L914 HydrophobicContact CE2-CD2 4.32Å; L879-L914 HydrophobicContact CD1-CD1 3.7Å; L879-L914 HydrophobicContact CD2-CB 4.1Å; L879-L914 HydrophobicContact CD2-CD1 4.14Å; I901-L914 HydrophobicContact CD1-CD1 4.23Å; L906-L914 HydrophobicContact CD2-CD1 4.16Å
915	Y	97.9	Very high	87.1	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	133.1	-178.8	-64.1	-101.1	0	0	0	109.3	S795 H797 G798 W822 S823 D825 A913 T917 K954	S795-Y915 WeakPolarHBondContact O-CD1 3.43Å; H797-Y915 VanDerWaalsContact C-CE1 3.47Å; H797-Y915 VanDerWaalsContact O-CD1 3.28Å; H797-Y915 WeakPolarHBondContact O-CD1 3.33Å; G798-Y915 VanDerWaalsContact CA-CD1 3.49Å; G798-Y915 VanDerWaalsContact N-CD1 3.3Å; W822-Y915 WeakPolarHBondContact CA-O 3.3Å; S823-Y915 PolarHBondContact N-O 3.12Å; S823-Y915 PolarHBondContact O-N 3.01Å; D825-Y915 HydrophobicContact CB-CD2 4.45Å; D825-Y915 HydrophobicContact CB-CE2 3.78Å; A913-Y915 HydrophobicContact CB-CD2 4.47Å; A913-Y915 HydrophobicContact CB-CE2 3.82Å; A913-Y915 WeakPolarHBondContact O-CD2 3.31Å; A913-Y915 WeakPolarHBondContact O-CE2 2.97Å; Y915-T917 PolarHBondContact O-N 3.48Å; Y915-T917 PolarHBondContact O-OG1 2.98Å; Y915-K954 WeakPolarHBondContact OH-CD 3.45Å
916	P	98.5	Very high	87.8	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-43.9	123.6	158.4	-31.4	34.6	0	0	0	111	W762 S795 F807 W822 F929	W762-P916 HydrophobicContact CZ3-CG 4.12Å; S795-P916 PolarHBondContact N-O 3.46Å; S795-P916 WeakPolarHBondContact OG-CD 3.48Å; S795-P916 PolarHBondContact OG-O 2.63Å; F807-P916 HydrophobicContact CD1-CB 4.17Å; F807-P916 HydrophobicContact CD1-CG 3.95Å; F807-P916 HydrophobicContact CD2-CB 4.42Å; F807-P916 HydrophobicContact CE1-CB 3.74Å; F807-P916 HydrophobicContact CE1-CG 3.87Å; F807-P916 HydrophobicContact CE2-CB 4.01Å; F807-P916 HydrophobicContact CG-CB 4.49Å; F807-P916 HydrophobicContact CG-CG 4.46Å; F807-P916 HydrophobicContact CZ-CB 3.66Å; F807-P916 HydrophobicContact CZ-CG 4.31Å; W822-P916 HydrophobicContact CE3-CG 4.26Å; W822-P916 HydrophobicContact CH2-CG 4.37Å; W822-P916 HydrophobicContact CZ3-CG 3.81Å; P916-F929 HydrophobicContact CB-CE1 3.71Å; P916-F929 HydrophobicContact CG-CD1 4.42Å; P916-F929 HydrophobicContact CG-CE1 4.01Å
917	T	98.6	Very high	88.6	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	140.7	-172.1	-52.7	0	0	0	0	109.6	C793 R794 G821 S823 V831 Y915	C793-T917 WeakPolarHBondContact O-CA 3.44Å; R794-T917 HydrophobicContact CG-CG2 3.92Å; R794-T917 WeakPolarHBondContact CG-OG1 3.35Å; G821-T917 PolarHBondContact N-O 3.33Å; G821-T917 PolarHBondContact O-N 3.01Å; S823-T917 VanDerWaalsContact CB-OG1 3.24Å; S823-T917 WeakPolarHBondContact CB-OG1 3.49Å; S823-T917 PolarHBondContact N-OG1 2.76Å; V831-T917 HydrophobicContact CB-CG2 3.94Å; V831-T917 HydrophobicContact CG2-CG2 4.26Å; Y915-T917 PolarHBondContact O-N 3.48Å; Y915-T917 PolarHBondContact O-OG1 2.98Å
918	V	98.3	Very high	89.6	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	150.3	171.1	-58.9	0	0	0	0	110.3	M764 V782 G792 C793 V809 R819 V820 V925 L927	M764-V918 HydrophobicContact CE-CG2 3.82Å; V782-V918 HydrophobicContact CG2-CG2 3.53Å; G792-V918 VanDerWaalsContact CA-O 3.25Å; G792-V918 WeakPolarHBondContact CA-O 3.32Å; C793-V918 PolarHBondContact N-O 2.86Å; C793-V918 PolarHBondContact O-N 2.9Å; V809-V918 HydrophobicContact CG2-CG1 4.5Å; R819-V918 CarbonylContact O-C 3.55Å; R819-V918 VanDerWaalsContact O-CA 3.27Å; R819-V918 WeakPolarHBondContact O-CA 3.44Å; V820-V918 HydrophobicContact CB-CG1 4.5Å; V820-V918 HydrophobicContact CG1-CG1 4.09Å; V918-V925 HydrophobicContact CG1-CG2 4.33Å; V918-V925 HydrophobicContact CG2-CG2 4.35Å; V918-L927 HydrophobicContact CG1-CD2 4.02Å
919	S	97.3	Very high	91.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	127.9	167.7	-47	0	0	0	0	109.7	W790 Q791 R819 L829 I830 V831	W790-S919 WeakPolarHBondContact CZ3-O 3.37Å; Q791-S919 CarbonylContact O-C 3.46Å; Q791-S919 WeakPolarHBondContact O-CA 3.43Å; R819-S919 PolarHBondContact N-O 2.92Å; R819-S919 PolarHBondContact O-N 2.88Å; L829-S919 PolarHBondContact O-OG 3.18Å; I830-S919 VanDerWaalsContact CA-OG 3.32Å; I830-S919 WeakPolarHBondContact CA-OG 3.47Å; V831-S919 PolarHBondContact N-OG 3.32Å
920	L	94.9	Very high	92.2	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	148.6	-167.6	-59.2	-168	0	0	0	110	V782 S784 W790 Q791 W818 V925	V782-L920 HydrophobicContact CG2-CD1 3.83Å; V782-L920 WeakPolarHBondContact O-CD1 3.19Å; S784-L920 WeakPolarHBondContact OG-CB 3.22Å; W790-L920 WeakPolarHBondContact CA-O 3.45Å; Q791-L920 PolarHBondContact N-O 2.76Å; Q791-L920 PolarHBondContact O-N 2.91Å; W818-L920 HydrophobicContact CB-CD2 4.39Å; W818-L920 HydrophobicContact CG-CD2 4.37Å; L920-V925 HydrophobicContact CD1-CG1 4.35Å; L920-V925 HydrophobicContact CD1-CG2 4.07Å; L920-V925 HydrophobicContact CD2-CG1 3.69Å; L920-V925 HydrophobicContact CD2-CG2 4.23Å
921	L	90.3	Very high	92.7	Very high	30 Å²	30	16.4 Å²	16.4	16%	0.157	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	115.3	169.2	177.1	69.9	0	0	0	107.5	G789 W790 G816 L817 S923	G789-L921 WeakPolarHBondContact O-CD1 3.45Å; W790-L921 HydrophobicContact CD2-CB 4.04Å; W790-L921 HydrophobicContact CE3-CB 3.96Å; W790-L921 HydrophobicContact CH2-CB 4.38Å; W790-L921 HydrophobicContact CZ2-CB 4.43Å; W790-L921 HydrophobicContact CZ3-CB 4.13Å; G816-L921 CarbonylContact C-O 3.43Å; G816-L921 WeakPolarHBondContact CA-O 2.95Å; L817-L921 HydrophobicContact CB-CB 4.2Å; L817-L921 HydrophobicContact CD1-CD2 4.11Å; L817-L921 HydrophobicContact CG-CD2 4.46Å; L817-L921 PolarHBondContact N-O 2.83Å; L817-L921 PolarHBondContact O-N 3.12Å; L921-S923 PolarHBondContact O-N 3.35Å
922	N	87.8	Confident	93.1	Very high	33 Å²	33	14.9 Å²	14.9	18%	0.176	8%	0.08	C	C	.	.	S	Bend	trans	54.8	33.4	176.4	-60.5	-20.1	0	0	0	114	S784 F786 N787 T815	S784-N922 PolarHBondContact OG-N 2.85Å; S784-N922 VanDerWaalsContact OG-N 3.11Å; F786-N922 WeakPolarHBondContact CA-OD1 3.43Å; F786-N922 HydrophobicContact CD1-CB 3.72Å; F786-N922 HydrophobicContact CE1-CB 3.98Å; N787-N922 PolarHBondContact N-OD1 3Å; T815-N922 CarbonylContact C-O 3.54Å; T815-N922 PolarHBondContact OG1-O 3.47Å
923	S	90.7	Very high	92.9	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.097	C	C	.	.			trans	-144.5	170.3	-171.5	71.9	0	0	0	0	113.4	S784 E813 T815 L817 W818 L921	S784-S923 PolarHBondContact N-O 3.35Å; S784-S923 PolarHBondContact OG-N 3.26Å; S784-S923 PolarHBondContact OG-O 3.38Å; E813-S923 WeakPolarHBondContact OE2-CA 3.45Å; T815-S923 WeakPolarHBondContact O-CB 3.28Å; L817-S923 PolarHBondContact O-OG 2.87Å; W818-S923 VanDerWaalsContact CD1-OG 3.31Å; W818-S923 PolarHBondContact NE1-OG 2.9Å; W818-S923 VanDerWaalsContact NE1-OG 3.09Å; L921-S923 PolarHBondContact O-N 3.35Å
924	T	93.7	Very high	92.8	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	139.6	177.7	-49.9	0	0	0	0	110.9	F562 V782 Q783 I812 E813	F562-T924 HydrophobicContact CE1-CG2 4.44Å; V782-T924 WeakPolarHBondContact O-CA 3.43Å; V782-T924 WeakPolarHBondContact O-CG2 3.36Å; Q783-T924 HydrophobicContact CB-CG2 3.98Å; Q783-T924 HydrophobicContact CG-CG2 4.39Å; Q783-T924 VanDerWaalsContact CG-OG1 3.3Å; Q783-T924 WeakPolarHBondContact CG-OG1 3.4Å; Q783-T924 PolarHBondContact NE2-OG1 3.25Å; I812-T924 HydrophobicContact CD1-CG2 3.69Å; I812-T924 HydrophobicContact CG1-CG2 3.7Å; I812-T924 PolarHBondContact N-O 2.94Å; I812-T924 VanDerWaalsContact N-O 3.16Å; E813-T924 WeakPolarHBondContact OE2-CB 3.24Å; E813-T924 PolarHBondContact OE2-N 3.29Å; E813-T924 PolarHBondContact OE2-OG1 3.38Å
925	V	95.6	Very high	92.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	151.3	172.4	-58.2	0	0	0	0	112.4	Q781 V782 V809 T810 W818 V918 L920 L927	Q781-V925 CarbonylContact C-O 3.59Å; Q781-V925 VanDerWaalsContact CA-O 3.23Å; Q781-V925 WeakPolarHBondContact CA-O 3.41Å; Q781-V925 WeakPolarHBondContact CB-O 3.12Å; V782-V925 HydrophobicContact CG2-CG2 3.49Å; V782-V925 VanDerWaalsContact CG2-CG2 3.49Å; V782-V925 PolarHBondContact N-O 3.24Å; V782-V925 PolarHBondContact O-N 3.35Å; V809-V925 HydrophobicContact CG1-CB 3.81Å; V809-V925 HydrophobicContact CG1-CG1 4.13Å; V809-V925 HydrophobicContact CG1-CG2 4.03Å; T810-V925 CarbonylContact O-C 3.56Å; T810-V925 WeakPolarHBondContact O-CA 3.49Å; W818-V925 HydrophobicContact CG-CG1 4.26Å; V918-V925 HydrophobicContact CG1-CG2 4.33Å; V918-V925 HydrophobicContact CG2-CG2 4.35Å; L920-V925 HydrophobicContact CD1-CG1 4.35Å; L920-V925 HydrophobicContact CD1-CG2 4.07Å; L920-V925 HydrophobicContact CD2-CG1 3.69Å; L920-V925 HydrophobicContact CD2-CG2 4.23Å; V925-L927 HydrophobicContact CG2-CD1 3.81Å
926	E	96.5	Very high	92.5	Very high	47 Å²	47	27.6 Å²	27.6	22%	0.22	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	141	165.3	-170.8	-170.4	-136.8	0	0	109.9	S780 Q781 V809 T810 I812 K932	S780-E926 CarbonylContact O-C 2.88Å; Q781-E926 HydrophobicContact CG-CB 4.03Å; Q781-E926 HydrophobicContact CG-CG 3.94Å; V809-E926 CarbonylContact C-O 3.58Å; V809-E926 WeakPolarHBondContact CA-O 3.48Å; T810-E926 PolarHBondContact N-O 2.91Å; T810-E926 PolarHBondContact O-N 2.69Å; I812-E926 HydrophobicContact CG2-CB 4.05Å; E926-K932 IonicContact OE1-NZ 2.89Å; E926-K932 PolarHBondContact OE1-NZ 2.97Å; E926-K932 IonicContact OE2-NZ 2.68Å; E926-K932 PolarHBondContact OE2-NZ 3.16Å
927	L	97.2	Very high	92	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.016	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	139.2	175.1	-63.4	91.2	0	0	0	110.9	M764 S780 V782 F807 E808 V809 V918 V925 F929	M764-L927 HydrophobicContact CE-CD2 4.46Å; M764-L927 HydrophobicContact CG-CD1 3.68Å; M764-L927 HydrophobicContact CG-CD2 4.15Å; M764-L927 HydrophobicContact CG-CG 4.42Å; M764-L927 HydrophobicContact SD-CD1 4.07Å; M764-L927 HydrophobicContact SD-CD2 3.46Å; M764-L927 WeakPolarHBondContact SD-CD2 3.12Å; M764-L927 HydrophobicContact SD-CG 4.35Å; S780-L927 PolarHBondContact O-N 2.84Å; V782-L927 HydrophobicContact CG2-CD1 4.24Å; F807-L927 HydrophobicContact CE2-CD2 4.21Å; E808-L927 WeakPolarHBondContact O-CA 3.4Å; V809-L927 HydrophobicContact CG1-CG 4.41Å; V809-L927 HydrophobicContact CG2-CD2 4.15Å; V809-L927 HydrophobicContact CG2-CG 4.16Å; V918-L927 HydrophobicContact CG1-CD2 4.02Å; V925-L927 HydrophobicContact CG2-CD1 3.81Å; L927-F929 HydrophobicContact CB-CE2 3.96Å; L927-F929 HydrophobicContact CB-CZ 3.95Å; L927-F929 HydrophobicContact CD2-CE1 4.1Å; L927-F929 HydrophobicContact CD2-CZ 3.74Å; L927-F929 HydrophobicContact CG-CZ 4.48Å
928	N	95.9	Very high	91.6	Very high	6 Å²	6	35.6 Å²	35.6	3%	0.032	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	114.1	170.3	179	6.7	0	0	0	109	F807 E808 G930 K932 P933 F934	F807-N928 WeakPolarHBondContact CB-O 3.39Å; E808-N928 HydrophobicContact CB-CB 4.19Å; E808-N928 PolarHBondContact N-O 2.89Å; E808-N928 PolarHBondContact O-N 3.48Å; N928-G930 VanDerWaalsContact C-N 3.33Å; N928-G930 WeakPolarHBondContact OD1-CA 3.25Å; N928-G930 PolarHBondContact OD1-N 3.34Å; N928-K932 HydrophobicContact CB-CG 4.3Å; N928-K932 VanDerWaalsContact CG-CG 3.43Å; N928-K932 WeakPolarHBondContact ND2-CG 3.25Å; N928-K932 PolarHBondContact ND2-O 2.86Å; N928-K932 VanDerWaalsContact OD1-CG 3.29Å; N928-K932 WeakPolarHBondContact OD1-CG 3.27Å; N928-K932 PolarHBondContact OD1-O 3.37Å; N928-P933 PolarHBondContact ND2-O 3.18Å; N928-F934 WeakPolarHBondContact ND2-CD1 3.38Å; N928-F934 WeakPolarHBondContact O-CE1 3.44Å
929	F	95.6	Very high	90.9	Very high	1 Å²	1	36.3 Å²	36.3	0%	0.004	18%	0.179	C	C	.	.			trans	-90.9	-0.1	-180	-63.8	-68.1	0	0	0	113.2	W762 M764 F807 P916 L927 V945 C946	W762-F929 HydrophobicContact CB-CB 3.65Å; W762-F929 HydrophobicContact CB-CD1 4.39Å; W762-F929 HydrophobicContact CB-CD2 4.05Å; W762-F929 HydrophobicContact CB-CG 3.77Å; W762-F929 HydrophobicContact CE3-CD1 4.33Å; W762-F929 WeakPolarHBondContact O-CD2 3.39Å; M764-F929 HydrophobicContact CG-CZ 4.32Å; M764-F929 HydrophobicContact SD-CZ 3.73Å; F807-F929 HydrophobicContact CB-CD1 4.24Å; F807-F929 HydrophobicContact CD2-CE1 4.45Å; P916-F929 HydrophobicContact CB-CE1 3.71Å; P916-F929 HydrophobicContact CG-CD1 4.42Å; P916-F929 HydrophobicContact CG-CE1 4.01Å; L927-F929 HydrophobicContact CB-CE2 3.96Å; L927-F929 HydrophobicContact CB-CZ 3.95Å; L927-F929 HydrophobicContact CD2-CE1 4.1Å; L927-F929 HydrophobicContact CD2-CZ 3.74Å; L927-F929 HydrophobicContact CG-CZ 4.48Å; F929-V945 HydrophobicContact CB-CG2 3.78Å; F929-V945 HydrophobicContact CD1-CG2 3.66Å; F929-V945 HydrophobicContact CG-CG2 4.2Å; F929-V945 WeakPolarHBondContact O-CG2 3.49Å; F929-V945 PolarHBondContact O-N 3.35Å; F929-C946 HydrophobicContact CB-CB 4.45Å; F929-C946 WeakPolarHBondContact O-CB 3.18Å; F929-C946 PolarHBondContact O-N 3.34Å; F929-C946 PolarHBondContact O-SG 2.69Å; F929-C946 VanDerWaalsContact O-SG 3.37Å
930	G	89.7	Confident	90.3	Very high	18 Å²	18	39.4 Å²	39.4	19%	0.186	20%	0.199	C	C	.	.	S	Bend	trans	100.1	6	-178.5	0	0	0	0	0	114.7	N928 K932 F934 C946	N928-G930 VanDerWaalsContact C-N 3.33Å; N928-G930 WeakPolarHBondContact OD1-CA 3.25Å; N928-G930 PolarHBondContact OD1-N 3.34Å; G930-K932 CarbonylContact C-O 3.54Å; G930-F934 VanDerWaalsContact CA-CZ 3.48Å; G930-C946 PolarHBondContact O-SG 3.25Å
931	D	78.7	Confident	90.1	Very high	73 Å²	73	43.9 Å²	43.9	39%	0.39	22%	0.223	S	C	.	.	S	Bend	trans	-73.4	-20.8	169.1	60.6	-36.5	0	0	0	112.2	R763	R763-D931 IonicContact CZ-OD2 3.4Å; R763-D931 IonicContact NH1-OD2 3.79Å; R763-D931 PolarHBondContact NH1-OD2 3.04Å; R763-D931 IonicContact NH2-OD2 3.7Å; R763-D931 PolarHBondContact NH2-OD2 3.07Å
932	K	80.2	Confident	90.3	Very high	77 Å²	77	44.2 Å²	44.2	34%	0.335	22%	0.222	S	C	.	.	S	Bend	trans	-113.7	154.9	161.8	64.6	-176.6	-175.9	175	0	110.5	E926 N928 G930 F934	E926-K932 IonicContact OE1-NZ 2.89Å; E926-K932 PolarHBondContact OE1-NZ 2.97Å; E926-K932 IonicContact OE2-NZ 2.68Å; E926-K932 PolarHBondContact OE2-NZ 3.16Å; N928-K932 HydrophobicContact CB-CG 4.3Å; N928-K932 VanDerWaalsContact CG-CG 3.43Å; N928-K932 WeakPolarHBondContact ND2-CG 3.25Å; N928-K932 PolarHBondContact ND2-O 2.86Å; N928-K932 VanDerWaalsContact OD1-CG 3.29Å; N928-K932 WeakPolarHBondContact OD1-CG 3.27Å; N928-K932 PolarHBondContact OD1-O 3.37Å; G930-K932 CarbonylContact C-O 3.54Å; K932-F934 PolarHBondContact O-N 2.97Å
933	P	82.5	Confident	90.5	Very high	77 Å²	77	43.9 Å²	43.9	50%	0.5	22%	0.222	S	C	.	.			trans	-53.9	135.6	177.7	-25.4	34.2	0	0	0	112.1	Y490 N928	Y490-P933 HydrophobicContact CD2-CB 4.15Å; Y490-P933 HydrophobicContact CD2-CG 4.22Å; Y490-P933 HydrophobicContact CE2-CB 3.54Å; Y490-P933 HydrophobicContact CE2-CG 4.12Å; N928-P933 PolarHBondContact ND2-O 3.18Å
934	F	92.8	Very high	90.7	Very high	24 Å²	24	45.2 Å²	45.2	11%	0.105	23%	0.23	C	C	.	.			trans	-66	143.8	173.9	-68.4	-52.2	0	0	0	111.3	Y490 Y806 E808 N928 G930 K932 Y936 P944	Y490-F934 PolarHBondContact OH-O 3.28Å; Y806-F934 HydrophobicContact CD1-CD1 4.25Å; Y806-F934 AromaticContact CD1-CD2 3.86Å; Y806-F934 HydrophobicContact CD1-CD2 3.86Å; Y806-F934 AromaticContact CD1-CE1 3.98Å; Y806-F934 HydrophobicContact CD1-CE1 3.98Å; Y806-F934 AromaticContact CD1-CE2 3.54Å; Y806-F934 HydrophobicContact CD1-CE2 3.54Å; Y806-F934 HydrophobicContact CD1-CG 4.21Å; Y806-F934 AromaticContact CD1-CZ 3.62Å; Y806-F934 HydrophobicContact CD1-CZ 3.62Å; Y806-F934 HydrophobicContact CE1-CB 4.39Å; Y806-F934 AromaticContact CE1-CD1 3.84Å; Y806-F934 HydrophobicContact CE1-CD1 3.84Å; Y806-F934 AromaticContact CE1-CD2 3.86Å; Y806-F934 HydrophobicContact CE1-CD2 3.86Å; Y806-F934 HydrophobicContact CE1-CE1 4Å; Y806-F934 AromaticContact CE1-CE2 3.99Å; Y806-F934 HydrophobicContact CE1-CE2 3.99Å; Y806-F934 AromaticContact CE1-CG 3.78Å; Y806-F934 HydrophobicContact CE1-CG 3.78Å; Y806-F934 HydrophobicContact CE1-CZ 4.07Å; E808-F934 HydrophobicContact CB-CD1 4.28Å; E808-F934 HydrophobicContact CG-CD1 3.74Å; E808-F934 HydrophobicContact CG-CE1 4.3Å; E808-F934 HydrophobicContact CG-CG 4.46Å; E808-F934 WeakPolarHBondContact OE2-CA 3.27Å; E808-F934 WeakPolarHBondContact OE2-CD1 3.41Å; N928-F934 WeakPolarHBondContact ND2-CD1 3.38Å; N928-F934 WeakPolarHBondContact O-CE1 3.44Å; G930-F934 VanDerWaalsContact CA-CZ 3.48Å; K932-F934 PolarHBondContact O-N 2.97Å; F934-Y936 VanDerWaalsContact C-N 3.32Å; F934-P944 HydrophobicContact CE2-CB 3.63Å; F934-P944 HydrophobicContact CE2-CG 3.74Å; F934-P944 HydrophobicContact CZ-CB 3.73Å; F934-P944 HydrophobicContact CZ-CG 4.36Å
935	K	93.3	Very high	90.8	Very high	125 Å²	125	45.2 Å²	45.2	54%	0.543	23%	0.23	S	C	.	.	S	Bend	trans	-69.2	-37.5	174.7	-166.6	-179.9	-175.3	177.1	0	110.3	E808 V874	E808-K935 PolarHBondContact OE1-N 2.88Å; E808-K935 PolarHBondContact OE2-N 2.67Å; V874-K935 HydrophobicContact CB-CD 4.32Å; V874-K935 HydrophobicContact CG2-CB 4.31Å; V874-K935 HydrophobicContact CG2-CD 3.34Å; V874-K935 HydrophobicContact CG2-CG 4.41Å
936	Y	93.8	Very high	90.5	Very high	65 Å²	65	47.1 Å²	47.1	26%	0.255	24%	0.243	S	C	.	.	S	Bend	trans	-120.1	119.2	177.2	-61.4	-79.9	0	0	0	110.1	Y806 E808 V874 N891 F934 P938	Y806-Y936 PolarHBondContact OH-O 2.69Å; E808-Y936 PolarHBondContact OE1-N 2.86Å; V874-Y936 HydrophobicContact CB-CD2 3.77Å; V874-Y936 HydrophobicContact CB-CE2 3.64Å; V874-Y936 HydrophobicContact CG1-CD2 4.05Å; V874-Y936 HydrophobicContact CG1-CE2 4.41Å; V874-Y936 HydrophobicContact CG2-CD2 4.42Å; V874-Y936 HydrophobicContact CG2-CE2 4Å; N891-Y936 VanDerWaalsContact CA-CE2 3.42Å; N891-Y936 HydrophobicContact CB-CE1 4.13Å; N891-Y936 HydrophobicContact CB-CE2 4.03Å; N891-Y936 WeakPolarHBondContact CB-OH 3.32Å; N891-Y936 WeakPolarHBondContact O-CD1 3.18Å; N891-Y936 WeakPolarHBondContact O-CE1 3.39Å; N891-Y936 PolarHBondContact OD1-OH 2.91Å; N891-Y936 VanDerWaalsContact OD1-OH 3.12Å; F934-Y936 VanDerWaalsContact C-N 3.32Å; Y936-P938 WeakPolarHBondContact O-CD 3.44Å
937	Y	89	Confident	90.2	Very high	159 Å²	159	46.3 Å²	46.3	62%	0.624	24%	0.242	S	C	*	.			trans	-69.5	120.1	-178.8	179.8	-121.8	0	0	0	110.2	G939 P940	Y937-G939 PolarHBondContact O-N 3.12Å; Y937-P940 WeakPolarHBondContact OH-CA 3.42Å; Y937-P940 WeakPolarHBondContact OH-CB 3.29Å
938	P	89.1	Confident	89.8	Confident	9 Å²	9	46.6 Å²	46.6	6%	0.058	25%	0.245	C	C	.	.			trans	-74.9	-7	-177.8	32.1	-38.5	0	0	0	113.1	Y806 F878 Y936 W942	Y806-P938 HydrophobicContact CD1-CB 3.84Å; Y806-P938 HydrophobicContact CD1-CG 3.62Å; Y806-P938 HydrophobicContact CD2-CB 3.79Å; Y806-P938 HydrophobicContact CD2-CG 4.46Å; Y806-P938 HydrophobicContact CE1-CB 4.01Å; Y806-P938 HydrophobicContact CE1-CG 3.94Å; Y806-P938 HydrophobicContact CE2-CB 3.96Å; Y806-P938 HydrophobicContact CG-CB 3.71Å; Y806-P938 HydrophobicContact CG-CG 3.88Å; F878-P938 HydrophobicContact CE1-CB 3.85Å; F878-P938 HydrophobicContact CZ-CB 4.39Å; Y936-P938 WeakPolarHBondContact O-CD 3.44Å; P938-W942 HydrophobicContact CB-CB 3.77Å; P938-W942 HydrophobicContact CB-CG 4.02Å; P938-W942 HydrophobicContact CG-CB 3.86Å
939	G	83.8	Confident	89.2	Confident	15 Å²	15	47.5 Å²	47.5	16%	0.155	25%	0.251	C	S	.	.			trans	101.3	167.7	-173.5	0	0	0	0	0	113.2	Y937 D941 W942	Y937-G939 PolarHBondContact O-N 3.12Å; G939-D941 PolarHBondContact O-N 3.21Å; G939-W942 PolarHBondContact O-N 3.47Å
940	P	86.2	Confident	88.6	Confident	66 Å²	66	51.3 Å²	51.3	43%	0.429	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-6.8	-170.1	33.8	-39.1	0	0	0	114.4	R345 Y937	R345-P940 PolarHBondContact NH2-O 2.84Å; Y937-P940 WeakPolarHBondContact OH-CA 3.42Å; Y937-P940 WeakPolarHBondContact OH-CB 3.29Å
941	D	89.3	Confident	88.3	Confident	94 Å²	94	55.1 Å²	55.1	50%	0.503	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-7.5	-178.7	-61.2	-25	0	0	0	112.5	R345 R804 G939	R345-D941 IonicContact NH2-OD1 3.7Å; R345-D941 PolarHBondContact NH2-OD1 3.27Å; R804-D941 VanDerWaalsContact CB-O 3.32Å; R804-D941 WeakPolarHBondContact CB-O 3.25Å; G939-D941 PolarHBondContact O-N 3.21Å
942	W	94	Very high	88.9	Confident	37 Å²	37	52.4 Å²	52.4	14%	0.14	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-102.6	132.9	179	-64.1	92.2	0	0	0	111.2	R804 F878 D880 P938 G939	R804-W942 HydrophobicContact CB-CD2 4.02Å; R804-W942 HydrophobicContact CB-CE3 3.58Å; R804-W942 HydrophobicContact CB-CH2 4.47Å; R804-W942 HydrophobicContact CB-CZ3 3.82Å; R804-W942 HydrophobicContact CG-CE3 4.3Å; R804-W942 HydrophobicContact CG-CH2 4.35Å; R804-W942 HydrophobicContact CG-CZ3 4.13Å; F878-W942 HydrophobicContact CB-CE3 4.32Å; F878-W942 HydrophobicContact CB-CH2 3.74Å; F878-W942 HydrophobicContact CB-CZ2 4.36Å; F878-W942 HydrophobicContact CB-CZ3 3.71Å; F878-W942 AromaticContact CD1-CD2 3.56Å; F878-W942 HydrophobicContact CD1-CD2 3.56Å; F878-W942 AromaticContact CD1-CE2 3.49Å; F878-W942 VanDerWaalsContact CD1-CE2 3.49Å; F878-W942 AromaticContact CD1-CE3 3.69Å; F878-W942 HydrophobicContact CD1-CE3 3.69Å; F878-W942 HydrophobicContact CD1-CG 4.24Å; F878-W942 AromaticContact CD1-CH2 3.8Å; F878-W942 HydrophobicContact CD1-CH2 3.8Å; F878-W942 AromaticContact CD1-CZ2 3.63Å; F878-W942 HydrophobicContact CD1-CZ2 3.63Å; F878-W942 AromaticContact CD1-CZ3 3.82Å; F878-W942 HydrophobicContact CD1-CZ3 3.82Å; F878-W942 HydrophobicContact CE1-CD2 4.08Å; F878-W942 AromaticContact CE1-CE2 3.94Å; F878-W942 HydrophobicContact CE1-CG 4.33Å; F878-W942 HydrophobicContact CE1-CZ2 4.38Å; F878-W942 HydrophobicContact CG-CE3 4.48Å; F878-W942 HydrophobicContact CG-CH2 4.23Å; F878-W942 HydrophobicContact CG-CZ2 4.39Å; F878-W942 HydrophobicContact CG-CZ3 4.27Å; D880-W942 HydrophobicContact CB-CH2 4.14Å; D880-W942 HydrophobicContact CB-CZ3 4.45Å; P938-W942 HydrophobicContact CB-CB 3.77Å; P938-W942 HydrophobicContact CB-CG 4.02Å; P938-W942 HydrophobicContact CG-CB 3.86Å; G939-W942 PolarHBondContact O-N 3.47Å
943	T	93	Very high	89.4	Confident	26 Å²	26	49.9 Å²	49.9	16%	0.16	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127	179.9	-58	0	0	0	0	109.3	I344 R804 F805 Y806 V945 C947	I344-T943 HydrophobicContact CG1-CG2 4.42Å; I344-T943 HydrophobicContact CG2-CG2 3.63Å; R804-T943 WeakPolarHBondContact O-CB 3.32Å; R804-T943 PolarHBondContact O-N 3.04Å; F805-T943 CarbonylContact C-O 3.51Å; F805-T943 VanDerWaalsContact CA-O 3.23Å; F805-T943 WeakPolarHBondContact CA-O 3.4Å; F805-T943 HydrophobicContact CD1-CG2 4.49Å; Y806-T943 PolarHBondContact N-O 3Å; T943-V945 PolarHBondContact O-N 3.31Å; T943-C947 HydrophobicContact CG2-CB 3.89Å
944	P	94.6	Very high	89.8	Confident	28 Å²	28	48.4 Å²	48.4	18%	0.182	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.8	141.6	169.8	-15.3	22.5	0	0	0	110.6	Y806 F934 C946 C947 A948	Y806-P944 WeakPolarHBondContact O-CA 3.06Å; F934-P944 HydrophobicContact CE2-CB 3.63Å; F934-P944 HydrophobicContact CE2-CG 3.74Å; F934-P944 HydrophobicContact CZ-CB 3.73Å; F934-P944 HydrophobicContact CZ-CG 4.36Å; P944-C946 PolarHBondContact O-N 3.03Å; P944-C947 HydrophobicContact CB-CB 3.95Å; P944-C947 HydrophobicContact CG-CB 4.07Å; P944-C947 WeakPolarHBondContact O-CA 3Å; P944-C947 WeakPolarHBondContact O-CB 3.15Å; P944-C947 PolarHBondContact O-N 3.09Å; P944-A948 PolarHBondContact O-N 3.11Å
945	V	95.3	Very high	89.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-61.7	-34.3	-179.1	-67.5	0	0	0	0	112.5	W762 I799 F805 Y806 F807 W822 F929 T943 C947 A948	W762-V945 HydrophobicContact CD2-CB 4.29Å; W762-V945 HydrophobicContact CD2-CG2 4.12Å; W762-V945 HydrophobicContact CE3-CB 3.88Å; W762-V945 HydrophobicContact CE3-CG2 3.66Å; W762-V945 HydrophobicContact CH2-CB 3.91Å; W762-V945 HydrophobicContact CZ2-CB 4.28Å; W762-V945 WeakPolarHBondContact CZ2-O 3.5Å; W762-V945 HydrophobicContact CZ3-CB 3.69Å; W762-V945 HydrophobicContact CZ3-CG1 4.4Å; W762-V945 HydrophobicContact CZ3-CG2 3.94Å; W762-V945 PolarHBondContact NE1-O 3.34Å; I799-V945 HydrophobicContact CD1-CG1 4.46Å; I799-V945 HydrophobicContact CG1-CG1 4.37Å; F805-V945 HydrophobicContact CB-CG1 4.03Å; Y806-V945 PolarHBondContact O-N 3.26Å; F807-V945 HydrophobicContact CB-CG1 4.47Å; F807-V945 HydrophobicContact CB-CG2 3.94Å; F807-V945 HydrophobicContact CD1-CG1 4.48Å; W822-V945 HydrophobicContact CH2-CG1 3.72Å; W822-V945 HydrophobicContact CZ3-CG1 4.24Å; F929-V945 HydrophobicContact CB-CG2 3.78Å; F929-V945 HydrophobicContact CD1-CG2 3.66Å; F929-V945 HydrophobicContact CG-CG2 4.2Å; F929-V945 WeakPolarHBondContact O-CG2 3.49Å; F929-V945 PolarHBondContact O-N 3.35Å; T943-V945 PolarHBondContact O-N 3.31Å; V945-C947 PolarHBondContact O-N 3.1Å; V945-A948 VanDerWaalsContact O-CB 3.29Å; V945-A948 WeakPolarHBondContact O-CB 3.45Å; V945-A948 PolarHBondContact O-N 3.46Å
946	C	90.5	Very high	89.5	Confident	39 Å²	39	47.4 Å²	47.4	26%	0.264	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-59.9	-20.9	175.6	73.6	0	0	0	0	114	W762 F929 G930 P944	W762-C946 HydrophobicContact CB-CB 4.4Å; W762-C946 VanDerWaalsContact CD1-CA 3.42Å; W762-C946 HydrophobicContact CG-CB 4.19Å; F929-C946 HydrophobicContact CB-CB 4.45Å; F929-C946 WeakPolarHBondContact O-CB 3.18Å; F929-C946 PolarHBondContact O-N 3.34Å; F929-C946 PolarHBondContact O-SG 2.69Å; F929-C946 VanDerWaalsContact O-SG 3.37Å; G930-C946 PolarHBondContact O-SG 3.25Å; P944-C946 PolarHBondContact O-N 3.03Å
947	C	89.3	Confident	88.9	Confident	30 Å²	30	51.5 Å²	51.5	20%	0.203	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-97.6	-7.4	-175.1	-88.8	0	0	0	0	112.1	I344 T943 P944 V945	I344-C947 HydrophobicContact CD1-CB 3.16Å; I344-C947 WeakPolarHBondContact CD1-O 3.35Å; I344-C947 VanDerWaalsContact CD1-SG 3.57Å; I344-C947 HydrophobicContact CG1-CB 3.4Å; I344-C947 WeakPolarHBondContact CG1-SG 3.41Å; T943-C947 HydrophobicContact CG2-CB 3.89Å; P944-C947 HydrophobicContact CB-CB 3.95Å; P944-C947 HydrophobicContact CG-CB 4.07Å; P944-C947 WeakPolarHBondContact O-CA 3Å; P944-C947 WeakPolarHBondContact O-CB 3.15Å; P944-C947 PolarHBondContact O-N 3.09Å; V945-C947 PolarHBondContact O-N 3.1Å
948	A	89.6	Confident	88.6	Confident	10 Å²	10	49.1 Å²	49.1	8%	0.083	25%	0.25	C	C	.	.	S	Bend	trans	-56	134.7	178.9	0	0	0	0	0	111.5	W762 I799 F805 P944 V945 T953	W762-A948 HydrophobicContact CZ2-CB 4.45Å; I799-A948 HydrophobicContact CD1-CB 3.49Å; I799-A948 VanDerWaalsContact CD1-CB 3.49Å; F805-A948 HydrophobicContact CD1-CB 3.93Å; F805-A948 HydrophobicContact CE1-CB 3.53Å; F805-A948 HydrophobicContact CZ-CB 4.47Å; P944-A948 PolarHBondContact O-N 3.11Å; V945-A948 VanDerWaalsContact O-CB 3.29Å; V945-A948 WeakPolarHBondContact O-CB 3.45Å; V945-A948 PolarHBondContact O-N 3.46Å; A948-T953 HydrophobicContact CB-CG2 3.49Å; A948-T953 VanDerWaalsContact CB-CG2 3.49Å
949	P	83.4	Confident	87.6	Confident	24 Å²	24	54.2 Å²	54.2	16%	0.156	27%	0.271	C	S	.	.			trans	-55.7	144	178.6	-24.4	32.6	0	0	0	111.6	E951 C952 T953	P949-E951 HydrophobicContact CB-CG 4.11Å; P949-E951 VanDerWaalsContact CB-OE1 3.28Å; P949-E951 WeakPolarHBondContact CB-OE1 3.36Å; P949-E951 WeakPolarHBondContact CB-OE2 3.32Å; P949-E951 PolarHBondContact O-N 3.36Å; P949-E951 VanDerWaalsContact O-N 3.1Å; P949-C952 HydrophobicContact CB-CB 4.39Å; P949-C952 WeakPolarHBondContact O-CA 3.49Å; P949-C952 WeakPolarHBondContact O-CB 3.41Å; P949-C952 PolarHBondContact O-N 3.02Å; P949-T953 WeakPolarHBondContact O-CG2 3.18Å; P949-T953 PolarHBondContact O-N 2.8Å
950	P	82.6	Confident	86.8	Confident	81 Å²	81	54.9 Å²	54.9	53%	0.526	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-54.3	-33.1	-179	-27.4	35	0	0	0	114.1	C952 T953	P950-C952 PolarHBondContact O-N 2.82Å; P950-T953 PolarHBondContact O-N 3.08Å; P950-T953 PolarHBondContact O-OG1 3.25Å
951	E	84	Confident	85.6	Confident	99 Å²	99	56.7 Å²	56.7	46%	0.463	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-69.8	-16.5	174.6	65.7	-87.7	-156.3	0	0	114	R341 R800 P949	R341-E951 IonicContact NH1-OE2 2.82Å; R800-E951 PolarHBondContact NH1-O 3.27Å; R800-E951 PolarHBondContact NH2-O 2.75Å; P949-E951 HydrophobicContact CB-CG 4.11Å; P949-E951 VanDerWaalsContact CB-OE1 3.28Å; P949-E951 WeakPolarHBondContact CB-OE1 3.36Å; P949-E951 WeakPolarHBondContact CB-OE2 3.32Å; P949-E951 PolarHBondContact O-N 3.36Å; P949-E951 VanDerWaalsContact O-N 3.1Å
952	C	90	Very high	83.8	Confident	15 Å²	15	59.9 Å²	59.9	10%	0.101	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-99.4	-4.7	176.2	-60	0	0	0	0	112.4	R800 G801 F805 P949 P950	R800-C952 WeakPolarHBondContact CG-O 3.44Å; R800-C952 PolarHBondContact N-O 3.12Å; G801-C952 PolarHBondContact N-O 3.2Å; F805-C952 HydrophobicContact CZ-CB 4.4Å; P949-C952 HydrophobicContact CB-CB 4.39Å; P949-C952 WeakPolarHBondContact O-CA 3.49Å; P949-C952 WeakPolarHBondContact O-CB 3.41Å; P949-C952 PolarHBondContact O-N 3.02Å; P950-C952 PolarHBondContact O-N 2.82Å
953	T	91.4	Very high	81.6	Confident	24 Å²	24	68.5 Å²	68.5	15%	0.147	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	158.2	-178.2	64.9	0	0	0	0	112	W762 G798 I799 R800 A948 P949 P950	W762-T953 HydrophobicContact CH2-CG2 4.47Å; W762-T953 HydrophobicContact CZ2-CG2 3.66Å; G798-T953 CarbonylContact O-C 3.58Å; G798-T953 VanDerWaalsContact O-CA 3.27Å; G798-T953 WeakPolarHBondContact O-CA 3.24Å; I799-T953 HydrophobicContact CD1-CG2 4.44Å; R800-T953 PolarHBondContact NE-O 3.22Å; R800-T953 VanDerWaalsContact NE-O 3.09Å; A948-T953 HydrophobicContact CB-CG2 3.49Å; A948-T953 VanDerWaalsContact CB-CG2 3.49Å; P949-T953 WeakPolarHBondContact O-CG2 3.18Å; P949-T953 PolarHBondContact O-N 2.8Å; P950-T953 PolarHBondContact O-N 3.08Å; P950-T953 PolarHBondContact O-OG1 3.25Å
954	K	92	Very high	79.1	Confident	47 Å²	47	76.6 Å²	76.6	20%	0.204	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	123.8	173.3	-174.7	-176.4	176.9	-173	0	108	H797 G798 D825 L911 A913 Y915	H797-K954 CarbonylContact C-O 3.59Å; H797-K954 WeakPolarHBondContact CA-O 3.46Å; G798-K954 PolarHBondContact N-O 3.11Å; G798-K954 PolarHBondContact O-N 2.95Å; D825-K954 IonicContact OD1-NZ 2.73Å; D825-K954 PolarHBondContact OD1-NZ 3Å; D825-K954 IonicContact OD2-NZ 3.39Å; D825-K954 PolarHBondContact OD2-NZ 3.09Å; L911-K954 WeakPolarHBondContact O-CD 3.05Å; L911-K954 WeakPolarHBondContact O-CE 3.49Å; L911-K954 PolarHBondContact O-NZ 2.87Å; A913-K954 HydrophobicContact CB-CB 3.66Å; A913-K954 HydrophobicContact CB-CD 3.65Å; A913-K954 HydrophobicContact CB-CG 4.27Å; Y915-K954 WeakPolarHBondContact OH-CD 3.45Å
955	R	89.6	Confident	76.5	Confident	124 Å²	124	79.9 Å²	79.9	47%	0.468	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	140.2	172.3	-163.9	173.9	-173.8	-155.9	1.8	109.4
956	S	88.2	Confident	73.6	Confident	4 Å²	4	88.7 Å²	88.7	3%	0.028	43%	0.425	C	S	.	.			trans	-57.2	143.9	178.9	178.3	0	0	0	0	111.1	D768 N796 R958	D768-S956 PolarHBondContact OD2-OG 2.6Å; N796-S956 PolarHBondContact O-N 2.98Å; S956-R958 PolarHBondContact O-N 3.38Å; S956-R958 PolarHBondContact OG-N 2.88Å
957	R	82.7	Confident	71	Confident	150 Å²	150	90 Å²	90	57%	0.566	44%	0.444	S	S	*	.	S	Bend	trans	-67.3	-20.3	175.1	-65.3	-177.2	-74	-176.2	1.3	112	D825 D826 K959	D825-R957 VanDerWaalsContact CG-NH2 3.34Å; D825-R957 PolarHBondContact O-NH2 2.87Å; D825-R957 IonicContact OD2-CZ 3.48Å; D825-R957 IonicContact OD2-NE 3.49Å; D825-R957 PolarHBondContact OD2-NE 2.83Å; D825-R957 IonicContact OD2-NH2 3.42Å; D825-R957 PolarHBondContact OD2-NH2 3.01Å; D826-R957 IonicContact OD1-CZ 3.51Å; D826-R957 IonicContact OD1-NH1 2.71Å; D826-R957 IonicContact OD1-NH2 2.74Å; D826-R957 PolarHBondContact OD1-NH2 3.2Å; R957-K959 PolarHBondContact O-N 2.84Å
958	R	81.9	Confident	68.3	Low	110 Å²	110	97.8 Å²	97.8	42%	0.415	47%	0.47	S	S	.	.			trans	-96.1	76.1	-177.1	-56.8	-174.5	-172.4	172.1	-7.4	110.4	N765 Y767 D768 S956 G960	N765-R958 PolarHBondContact ND2-O 3.3Å; Y767-R958 WeakPolarHBondContact CB-O 3.24Å; Y767-R958 WeakPolarHBondContact O-CB 3.23Å; Y767-R958 WeakPolarHBondContact O-CD 3.47Å; D768-R958 HydrophobicContact CB-CB 4.26Å; D768-R958 WeakPolarHBondContact OD1-CD 3.12Å; D768-R958 IonicContact OD1-CZ 3.37Å; D768-R958 IonicContact OD1-NE 3.13Å; D768-R958 PolarHBondContact OD1-NE 2.83Å; D768-R958 IonicContact OD1-NH1 3.85Å; D768-R958 PolarHBondContact OD1-NH1 3.25Å; S956-R958 PolarHBondContact O-N 3.38Å; S956-R958 PolarHBondContact OG-N 2.88Å; R958-G960 VanDerWaalsContact C-N 3.32Å; R958-G960 PolarHBondContact O-N 3.08Å
959	K	68.6	Low	65.9	Low	115 Å²	115	102.8 Å²	102.8	50%	0.5	51%	0.505	S	S	.	.			trans	-79.2	-9.4	-175.9	-63.6	-179.2	-175.9	173.6	0	114.8	R957	R957-K959 PolarHBondContact O-N 2.84Å
960	G	66.2	Low	64	Low	29 Å²	29	105.7 Å²	105.7	30%	0.299	51%	0.513	S	S	.	.			trans	81.4	-177.6	-169.8	0	0	0	0	0	113.3	Y767 R958 E962	Y767-G960 VanDerWaalsContact CG-CA 3.41Å; R958-G960 VanDerWaalsContact C-N 3.32Å; R958-G960 PolarHBondContact O-N 3.08Å; G960-E962 PolarHBondContact O-N 2.77Å
961	P	60.8	Low	62	Low	104 Å²	104	107 Å²	107	68%	0.675	52%	0.515	S	S	*	.			trans	-70.3	119.6	179.5	26.2	-30.3	0	0	0	111.4	R963	P961-R963 PolarHBondContact O-N 2.73Å
962	E	52.8	Low	59.9	Low	161 Å²	161	106.4 Å²	106.4	75%	0.752	51%	0.514	S	S	*	.			trans	-73	104.9	166.3	-70.3	178.9	177.9	0	0	108.1	G960 K964	G960-E962 PolarHBondContact O-N 2.77Å; E962-K964 PolarHBondContact O-N 3.28Å; E962-K964 VanDerWaalsContact O-N 3.08Å
963	R	48.2	Very low	57.5	Low	218 Å²	218	108.3 Å²	108.3	82%	0.823	53%	0.527	S	S	*	.			trans	-59	116.4	174.5	-98.6	-179.1	158.5	157.7	-4.4	108.6	P961 V965	P961-R963 PolarHBondContact O-N 2.73Å; R963-V965 PolarHBondContact O-N 2.99Å
964	K	39.8	Very low	55.2	Low	196 Å²	196	112 Å²	112	85%	0.852	55%	0.549	S	S	*	.			trans	-59.2	124.6	164.3	-69.3	-168.1	176	-173.2	0	107.9	E962 K966	E962-K964 PolarHBondContact O-N 3.28Å; E962-K964 VanDerWaalsContact O-N 3.08Å; K964-K966 PolarHBondContact O-N 2.87Å
965	V	39.7	Very low	52.7	Low	97 Å²	97	115.4 Å²	115.4	59%	0.588	57%	0.568	S	S	*	*			trans	-58	99.5	174.2	-176.8	0	0	0	0	107.6	R963 G967	R963-V965 PolarHBondContact O-N 2.99Å; V965-G967 PolarHBondContact O-N 2.82Å
966	K	35	Very low	50.2	Low	185 Å²	185	115.4 Å²	115.4	80%	0.804	58%	0.577	S	S	*	*			trans	-79	101.5	168.3	-105.6	-174.4	174.3	-176.9	0	105.7	K964 W968	K964-K966 PolarHBondContact O-N 2.87Å; K966-W968 PolarHBondContact O-N 3.06Å; K966-W968 VanDerWaalsContact O-N 3.12Å
967	G	34.4	Very low	47.5	Very low	66 Å²	66	121.5 Å²	121.5	68%	0.68	61%	0.605	S	S	*	*			trans	-55.9	114.4	177.5	0	0	0	0	0	110.3	V965	V965-G967 PolarHBondContact O-N 2.82Å
968	W	34.5	Very low	45.1	Very low	194 Å²	194	119.7 Å²	119.7	74%	0.735	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-79.1	131.4	160.9	-75.5	80.9	0	0	0	107.9	K966	K966-W968 PolarHBondContact O-N 3.06Å; K966-W968 VanDerWaalsContact O-N 3.12Å
969	S	37.3	Very low	42.7	Very low	116 Å²	116	120.1 Å²	120.1	81%	0.811	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-88.9	125.4	173.2	55.2	0	0	0	0	109.5
970	Y	43.6	Very low	41.1	Very low	84 Å²	84	121.7 Å²	121.7	33%	0.329	65%	0.645	S	S	.	*	P	Polyproline II helix	trans	-85.7	155	172.1	-166.7	-98.4	0	0	0	111	D686 K687	D686-Y970 VanDerWaalsContact C-CZ 3.43Å; D686-Y970 VanDerWaalsContact C-OH 3.25Å; D686-Y970 WeakPolarHBondContact O-CE2 3.39Å; D686-Y970 PolarHBondContact O-OH 2.8Å; K687-Y970 WeakPolarHBondContact CA-OH 3.43Å
971	I	40.6	Very low	39.4	Very low	110 Å²	110	123.3 Å²	123.3	56%	0.564	66%	0.662	S	S	*	*			trans	-85.3	113.9	172.4	-62.2	169.8	0	0	0	106.9	I975	I971-I975 HydrophobicContact CG2-CB 4.23Å; I971-I975 HydrophobicContact CG2-CD1 4.14Å; I971-I975 HydrophobicContact CG2-CG2 4.44Å
972	D	41	Very low	38.2	Very low	86 Å²	86	126.3 Å²	126.3	46%	0.46	67%	0.667	S	S	.	*			trans	-44.8	122.3	178.5	-172	-26.9	0	0	0	111	T974 I975	D972-T974 PolarHBondContact O-N 3.09Å; D972-T974 WeakPolarHBondContact OD1-CB 2.91Å; D972-T974 WeakPolarHBondContact OD1-CG2 3.32Å; D972-T974 PolarHBondContact OD1-N 2.75Å; D972-T974 PolarHBondContact OD1-OG1 2.98Å; D972-T974 PolarHBondContact OD2-OG1 3.02Å; D972-I975 HydrophobicContact CB-CD1 4.13Å; D972-I975 HydrophobicContact CB-CG1 4.28Å; D972-I975 VanDerWaalsContact O-CB 3.3Å; D972-I975 WeakPolarHBondContact O-CB 3.39Å; D972-I975 WeakPolarHBondContact O-CG1 3.45Å; D972-I975 PolarHBondContact O-N 2.98Å
973	P	39.7	Very low	37.3	Very low	55 Å²	55	122.4 Å²	122.4	36%	0.357	65%	0.654	S	S	.	*	G	3₁₀ helix	trans	-61.7	-16.5	-177.8	22.3	-30.8	0	0	0	113.2	I975 L976 E977	P973-I975 PolarHBondContact O-N 2.99Å; P973-L976 PolarHBondContact O-N 2.62Å; P973-E977 PolarHBondContact O-N 3.47Å
974	T	41.8	Very low	36.7	Very low	100 Å²	100	119 Å²	119	61%	0.613	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-61.8	-18	169.2	59.6	0	0	0	0	113.2	D972	D972-T974 PolarHBondContact O-N 3.09Å; D972-T974 WeakPolarHBondContact OD1-CB 2.91Å; D972-T974 WeakPolarHBondContact OD1-CG2 3.32Å; D972-T974 PolarHBondContact OD1-N 2.75Å; D972-T974 PolarHBondContact OD1-OG1 2.98Å; D972-T974 PolarHBondContact OD2-OG1 3.02Å
975	I	41.3	Very low	36.6	Very low	119 Å²	119	114.9 Å²	114.9	61%	0.61	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-82.2	-23.5	175.5	-56.9	172.9	0	0	0	111.7	I971 D972 P973	I971-I975 HydrophobicContact CG2-CB 4.23Å; I971-I975 HydrophobicContact CG2-CD1 4.14Å; I971-I975 HydrophobicContact CG2-CG2 4.44Å; D972-I975 HydrophobicContact CB-CD1 4.13Å; D972-I975 HydrophobicContact CB-CG1 4.28Å; D972-I975 VanDerWaalsContact O-CB 3.3Å; D972-I975 WeakPolarHBondContact O-CB 3.39Å; D972-I975 WeakPolarHBondContact O-CG1 3.45Å; D972-I975 PolarHBondContact O-N 2.98Å; P973-I975 PolarHBondContact O-N 2.99Å
976	L	36.3	Very low	36.6	Very low	125 Å²	125	113.5 Å²	113.5	65%	0.654	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-13.7	179.9	-71.5	172.8	0	0	0	113.5	P973 P978	P973-L976 PolarHBondContact O-N 2.62Å; L976-P978 WeakPolarHBondContact O-CD 3.35Å
977	E	31.4	Very low	37	Very low	131 Å²	131	108.9 Å²	108.9	61%	0.612	61%	0.61	S	S	*	*	S	Bend	trans	-77.1	121.1	164.8	-71	-167.6	179.6	0	0	108.6	P973 S979	P973-E977 PolarHBondContact O-N 3.47Å; E977-S979 PolarHBondContact O-N 2.74Å
978	P	31.4	Very low	37.6	Very low	112 Å²	112	112.5 Å²	112.5	73%	0.727	61%	0.61	S	S	*	*			trans	-55.2	122.7	168.2	23.1	-30.1	0	0	0	106.7	L976 I980	L976-P978 WeakPolarHBondContact O-CD 3.35Å; P978-I980 PolarHBondContact O-N 2.99Å
979	S	32.6	Very low	38.2	Very low	120 Å²	120	111.6 Å²	111.6	84%	0.839	61%	0.606	S	S	*	*			trans	-56.4	75.9	-173.6	41.3	0	0	0	0	112.6	E977 G981	E977-S979 PolarHBondContact O-N 2.74Å; S979-G981 PolarHBondContact O-N 3.4Å; S979-G981 VanDerWaalsContact O-N 3.1Å
980	I	34.5	Very low	38.9	Very low	147 Å²	147	108.8 Å²	108.8	75%	0.754	59%	0.587	S	S	*	*			trans	-77.7	90.8	156.5	-58.8	173.5	0	0	0	103.4	P978 Q982	P978-I980 PolarHBondContact O-N 2.99Å; I980-Q982 PolarHBondContact O-N 3.41Å
981	G	30.2	Very low	39.4	Very low	63 Å²	63	113.1 Å²	113.1	65%	0.649	61%	0.61	S	S	*	*			trans	-45.7	105.2	-179.9	0	0	0	0	0	110.3	S979 T983	S979-G981 PolarHBondContact O-N 3.4Å; S979-G981 VanDerWaalsContact O-N 3.1Å; G981-T983 PolarHBondContact O-N 2.9Å
982	Q	35.7	Very low	40.2	Very low	167 Å²	167	111.1 Å²	111.1	78%	0.78	60%	0.604	S	S	*	*			trans	-73.7	82.6	175.1	-75.9	-171.7	12	0	0	107.2	I980 M984	I980-Q982 PolarHBondContact O-N 3.41Å; Q982-M984 PolarHBondContact O-N 2.88Å; Q982-M984 VanDerWaalsContact O-N 3.09Å
983	T	34.1	Very low	41	Very low	79 Å²	79	113.8 Å²	113.8	49%	0.485	61%	0.614	S	S	.	*			trans	-60.8	107.7	157.4	-50.5	0	0	0	0	105.2	G981 Q985 T1021	G981-T983 PolarHBondContact O-N 2.9Å; T983-Q985 HydrophobicContact CG2-CG 4.22Å; T983-Q985 PolarHBondContact O-N 2.95Å; T983-T1021 HydrophobicContact CG2-CG2 3.16Å
984	M	35.5	Very low	42.2	Very low	148 Å²	148	114.7 Å²	114.7	73%	0.729	62%	0.615	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-65.9	90.4	172.7	-77.2	-169.4	69.6	0	0	108.1	Q982 S986	Q982-M984 PolarHBondContact O-N 2.88Å; Q982-M984 VanDerWaalsContact O-N 3.09Å; M984-S986 PolarHBondContact O-N 3.21Å
985	Q	38.9	Very low	43.5	Very low	109 Å²	109	115.2 Å²	115.2	51%	0.509	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.1	95.2	166.7	-76.6	-175.7	-10.6	0	0	107	T983 I987 T1019 T1021	T983-Q985 HydrophobicContact CG2-CG 4.22Å; T983-Q985 PolarHBondContact O-N 2.95Å; Q985-I987 PolarHBondContact O-N 2.9Å; Q985-T1019 HydrophobicContact CB-CG2 3.81Å; Q985-T1019 HydrophobicContact CG-CG2 3.75Å; Q985-T1021 HydrophobicContact CG-CG2 4.29Å
986	S	39.1	Very low	44.8	Very low	67 Å²	67	112.7 Å²	112.7	47%	0.469	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.7	116.2	162.5	55.4	0	0	0	0	107.5	M984 K1020	M984-S986 PolarHBondContact O-N 3.21Å; S986-K1020 PolarHBondContact N-O 2.89Å; S986-K1020 PolarHBondContact O-N 2.89Å; S986-K1020 PolarHBondContact OG-O 3.11Å
987	I	44.1	Very low	46.5	Very low	88 Å²	88	112.6 Å²	112.6	45%	0.451	60%	0.597	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.4	101.2	176.5	-60.2	174.3	0	0	0	107	Q985 R989 T1017 T1019	Q985-I987 PolarHBondContact O-N 2.9Å; I987-R989 HydrophobicContact CG2-CG 4.07Å; I987-T1017 HydrophobicContact CG2-CG2 3.38Å; I987-T1019 HydrophobicContact CG1-CG2 4.47Å
988	E	45.8	Very low	48.6	Very low	143 Å²	143	110 Å²	110	67%	0.668	59%	0.59	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.7	118.4	166.6	-87.3	-178	153.8	0	0	108.6	T1018	E988-T1018 PolarHBondContact N-O 3.24Å; E988-T1018 PolarHBondContact O-N 3.03Å; E988-T1018 VanDerWaalsContact O-N 3.14Å
989	R	47.5	Very low	50.7	Low	174 Å²	174	108.9 Å²	108.9	66%	0.657	57%	0.574	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.6	121.8	173.3	-61	-174.2	-175.9	-152.5	3.2	108.3	I987 E1015	I987-R989 HydrophobicContact CG2-CG 4.07Å; R989-E1015 IonicContact NH1-OE1 3.9Å
990	S	52.7	Low	53	Low	57 Å²	57	109 Å²	109	40%	0.399	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-73.8	150.9	169.7	58.6	0	0	0	0	110.4	V1016	S990-V1016 PolarHBondContact N-O 2.88Å; S990-V1016 PolarHBondContact OG-O 2.9Å
991	E	54.2	Low	54.7	Low	176 Å²	176	104.2 Å²	104.2	82%	0.822	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-58.1	135.9	174.4	-74.6	-172.2	164.7	0	0	110.5	Q993	E991-Q993 PolarHBondContact O-N 3.1Å
992	P	55.8	Low	56.8	Low	68 Å²	68	110.7 Å²	110.7	44%	0.442	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-64.4	123.5	-174.4	23.8	-32.4	0	0	0	111.1	I994	P992-I994 PolarHBondContact O-N 2.65Å
993	Q	59.4	Low	58.9	Low	141 Å²	141	109.7 Å²	109.7	66%	0.659	55%	0.55	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.7	123.1	170.6	-65.5	-149.3	-13.6	0	0	109.6	E991 S1014	E991-Q993 PolarHBondContact O-N 3.1Å; Q993-S1014 PolarHBondContact N-O 2.74Å; Q993-S1014 PolarHBondContact O-N 3.27Å; Q993-S1014 VanDerWaalsContact O-N 3.16Å
994	I	63.5	Low	60.8	Low	75 Å²	75	108.5 Å²	108.5	39%	0.385	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.8	108.3	179.4	-52.4	-178.4	0	0	0	107.7	P992 T996 I1010 R1013	P992-I994 PolarHBondContact O-N 2.65Å; I994-T996 HydrophobicContact CG2-CG2 3.94Å; I994-I1010 HydrophobicContact CG2-CB 4.34Å; I994-I1010 HydrophobicContact CG2-CD1 4.21Å; I994-I1010 HydrophobicContact CG2-CG1 3.86Å; I994-I1010 HydrophobicContact CG2-CG2 3.65Å; I994-R1013 HydrophobicContact CG1-CG 3.98Å; I994-R1013 HydrophobicContact CG2-CG 4.47Å
995	E	70	Confident	62.3	Low	111 Å²	111	108 Å²	108	52%	0.519	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	117.6	168.7	-70.2	176.6	168.7	0	0	108.7	V1011 K1012	E995-V1011 PolarHBondContact O-N 3.37Å; E995-K1012 HydrophobicContact CB-CB 4.25Å; E995-K1012 PolarHBondContact N-O 3.17Å; E995-K1012 PolarHBondContact O-N 3.08Å
996	T	68.5	Low	64.1	Low	66 Å²	66	108.7 Å²	108.7	41%	0.405	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.9	129.6	175.8	57	0	0	0	0	110.4	I994 R1009 I1010	I994-T996 HydrophobicContact CG2-CG2 3.94Å; T996-R1009 CarbonylContact C-O 3.6Å; T996-R1009 WeakPolarHBondContact CA-O 3.37Å; T996-I1010 HydrophobicContact CG2-CG1 3.89Å
997	E	71.3	Confident	65.5	Low	123 Å²	123	109.2 Å²	109.2	58%	0.575	55%	0.551	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96	149.7	163.7	-73.2	-178.9	170.9	0	0	109.7	R1009 V1011	E997-R1009 PolarHBondContact N-O 3.48Å; E997-R1009 PolarHBondContact O-N 2.82Å; E997-V1011 HydrophobicContact CB-CG2 3.56Å; E997-V1011 HydrophobicContact CG-CB 4.46Å; E997-V1011 HydrophobicContact CG-CG2 3.58Å
998	T	75.4	Confident	66.7	Low	77 Å²	77	112.1 Å²	112.1	47%	0.472	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.9	130	176.1	20.5	0	0	0	0	108.2	M1006 K1008	T998-M1006 HydrophobicContact CG2-CG 3.9Å; T998-M1006 HydrophobicContact CG2-SD 3.85Å; T998-K1008 HydrophobicContact CG2-CB 4.39Å; T998-K1008 HydrophobicContact CG2-CD 4.21Å; T998-K1008 HydrophobicContact CG2-CG 3.28Å
999	F	75.8	Confident	67.8	Low	87 Å²	87	113 Å²	113	38%	0.382	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-131.1	165.4	168.7	41.6	-97.2	0	0	0	109.5	M1006 I1007 R1009	F999-M1006 WeakPolarHBondContact O-CA 3.35Å; F999-I1007 HydrophobicContact CD2-CB 4.06Å; F999-I1007 HydrophobicContact CE2-CB 3.8Å; F999-I1007 HydrophobicContact CE2-CG2 3.86Å; F999-I1007 HydrophobicContact CZ-CG2 4.3Å; F999-I1007 PolarHBondContact N-O 3.17Å; F999-I1007 PolarHBondContact O-N 2.82Å; F999-R1009 HydrophobicContact CE1-CB 3.4Å; F999-R1009 VanDerWaalsContact CE1-CB 3.4Å; F999-R1009 HydrophobicContact CE1-CG 4.28Å; F999-R1009 HydrophobicContact CZ-CB 3.53Å; F999-R1009 HydrophobicContact CZ-CG 4.29Å
1000	H	81.4	Confident	68.7	Low	122 Å²	122	108.8 Å²	108.8	57%	0.565	55%	0.547	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.3	131.9	176.6	-62	-3.1	0	0	0	107.5	E1005	H1000-E1005 CarbonylContact C-O 3.57Å; H1000-E1005 VanDerWaalsContact CA-O 3.31Å; H1000-E1005 WeakPolarHBondContact CA-O 3.31Å
1001	D	69.3	Low	69.5	Low	47 Å²	47	109.8 Å²	109.8	25%	0.251	55%	0.551	S	S	.	*			trans	-73.8	179.7	174.7	74.4	8.7	0	0	0	111.5	N1003 G1004 E1005 I1007	D1001-N1003 PolarHBondContact O-N 2.89Å; D1001-N1003 VanDerWaalsContact O-N 3.14Å; D1001-N1003 WeakPolarHBondContact OD1-CA 3.03Å; D1001-N1003 WeakPolarHBondContact OD1-CB 3.3Å; D1001-N1003 PolarHBondContact OD1-N 2.77Å; D1001-G1004 PolarHBondContact O-N 2.63Å; D1001-G1004 PolarHBondContact OD1-N 3.41Å; D1001-G1004 VanDerWaalsContact OD1-N 3.1Å; D1001-E1005 PolarHBondContact N-O 3.2Å; D1001-E1005 WeakPolarHBondContact OD1-CB 3.45Å; D1001-E1005 PolarHBondContact OD1-N 2.85Å; D1001-I1007 HydrophobicContact CB-CD1 3.86Å; D1001-I1007 HydrophobicContact CB-CG1 4.47Å
1002	E	75.6	Confident	69.5	Low	200 Å²	200	107.1 Å²	107.1	94%	0.935	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-17.1	-177.8	-54.5	-173.8	-170.3	0	0	113.3
1003	N	79.5	Confident	69.3	Low	145 Å²	145	112.3 Å²	112.3	78%	0.775	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	1.9	175.6	-58.7	-43.2	0	0	0	112.4	D1001 E1005	D1001-N1003 PolarHBondContact O-N 2.89Å; D1001-N1003 VanDerWaalsContact O-N 3.14Å; D1001-N1003 WeakPolarHBondContact OD1-CA 3.03Å; D1001-N1003 WeakPolarHBondContact OD1-CB 3.3Å; D1001-N1003 PolarHBondContact OD1-N 2.77Å; N1003-E1005 VanDerWaalsContact C-N 3.3Å
1004	G	72.6	Confident	69	Low	54 Å²	54	107.8 Å²	107.8	56%	0.557	53%	0.531	S	S	*	.	S	Bend	trans	78.2	11.8	-175.9	0	0	0	0	0	113.9	D1001	D1001-G1004 PolarHBondContact O-N 2.63Å; D1001-G1004 PolarHBondContact OD1-N 3.41Å; D1001-G1004 VanDerWaalsContact OD1-N 3.1Å
1005	E	68.8	Low	68.3	Low	137 Å²	137	109.2 Å²	109.2	64%	0.64	54%	0.536	S	S	*	.			trans	-81.4	132.2	177.5	-113.8	-173.9	174	0	0	111.1	H1000 D1001 N1003 I1007	H1000-E1005 CarbonylContact C-O 3.57Å; H1000-E1005 VanDerWaalsContact CA-O 3.31Å; H1000-E1005 WeakPolarHBondContact CA-O 3.31Å; D1001-E1005 PolarHBondContact N-O 3.2Å; D1001-E1005 WeakPolarHBondContact OD1-CB 3.45Å; D1001-E1005 PolarHBondContact OD1-N 2.85Å; N1003-E1005 VanDerWaalsContact C-N 3.3Å; E1005-I1007 PolarHBondContact O-N 2.81Å
1006	M	75.8	Confident	67.5	Low	125 Å²	125	108.1 Å²	108.1	62%	0.616	54%	0.537	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	114.5	-178	-175.7	-171	-59.4	0	0	110.7	T998 F999	T998-M1006 HydrophobicContact CG2-CG 3.9Å; T998-M1006 HydrophobicContact CG2-SD 3.85Å; F999-M1006 WeakPolarHBondContact O-CA 3.35Å
1007	I	68.1	Low	66.3	Low	77 Å²	77	108.2 Å²	108.2	40%	0.395	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	122.1	174.4	-55.7	-178.6	0	0	0	109	F999 D1001 E1005	F999-I1007 HydrophobicContact CD2-CB 4.06Å; F999-I1007 HydrophobicContact CE2-CB 3.8Å; F999-I1007 HydrophobicContact CE2-CG2 3.86Å; F999-I1007 HydrophobicContact CZ-CG2 4.3Å; F999-I1007 PolarHBondContact N-O 3.17Å; F999-I1007 PolarHBondContact O-N 2.82Å; D1001-I1007 HydrophobicContact CB-CD1 3.86Å; D1001-I1007 HydrophobicContact CB-CG1 4.47Å; E1005-I1007 PolarHBondContact O-N 2.81Å
1008	K	69	Low	65.1	Low	149 Å²	149	106.1 Å²	106.1	65%	0.648	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.8	114.6	169.2	-95.1	-176.5	177.3	179.9	0	109.5	T998	T998-K1008 HydrophobicContact CG2-CB 4.39Å; T998-K1008 HydrophobicContact CG2-CD 4.21Å; T998-K1008 HydrophobicContact CG2-CG 3.28Å
1009	R	68.8	Low	63.3	Low	161 Å²	161	105.5 Å²	105.5	61%	0.608	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	130.4	171.3	-174.2	178.2	175.4	-174.2	-0.3	109.6	T996 E997 F999 V1011	T996-R1009 CarbonylContact C-O 3.6Å; T996-R1009 WeakPolarHBondContact CA-O 3.37Å; E997-R1009 PolarHBondContact N-O 3.48Å; E997-R1009 PolarHBondContact O-N 2.82Å; F999-R1009 HydrophobicContact CE1-CB 3.4Å; F999-R1009 VanDerWaalsContact CE1-CB 3.4Å; F999-R1009 HydrophobicContact CE1-CG 4.28Å; F999-R1009 HydrophobicContact CZ-CB 3.53Å; F999-R1009 HydrophobicContact CZ-CG 4.29Å; R1009-V1011 PolarHBondContact O-N 3.12Å
1010	I	67.2	Low	61.7	Low	87 Å²	87	107.9 Å²	107.9	45%	0.446	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	112.9	169.5	-61.2	165.4	0	0	0	107	I994 T996 R1013	I994-I1010 HydrophobicContact CG2-CB 4.34Å; I994-I1010 HydrophobicContact CG2-CD1 4.21Å; I994-I1010 HydrophobicContact CG2-CG1 3.86Å; I994-I1010 HydrophobicContact CG2-CG2 3.65Å; T996-I1010 HydrophobicContact CG2-CG1 3.89Å; I1010-R1013 HydrophobicContact CG2-CG 4.3Å
1011	V	69	Low	59.5	Low	77 Å²	77	105.6 Å²	105.6	47%	0.467	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-31.7	-178.6	-177	0	0	0	0	110.3	E995 E997 R1009	E995-V1011 PolarHBondContact O-N 3.37Å; E997-V1011 HydrophobicContact CB-CG2 3.56Å; E997-V1011 HydrophobicContact CG-CB 4.46Å; E997-V1011 HydrophobicContact CG-CG2 3.58Å; R1009-V1011 PolarHBondContact O-N 3.12Å
1012	K	55	Low	58	Low	121 Å²	121	107.7 Å²	107.7	53%	0.526	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	130.7	179.9	-155	174.7	178.4	-175.1	0	111.6	E995	E995-K1012 HydrophobicContact CB-CB 4.25Å; E995-K1012 PolarHBondContact N-O 3.17Å; E995-K1012 PolarHBondContact O-N 3.08Å
1013	R	50.5	Low	56	Low	176 Å²	176	103 Å²	103	66%	0.664	54%	0.538	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	116.5	163.1	-103.2	-179.2	177.7	-170.9	-0.3	106.8	I994 I1010	I994-R1013 HydrophobicContact CG1-CG 3.98Å; I994-R1013 HydrophobicContact CG2-CG 4.47Å; I1010-R1013 HydrophobicContact CG2-CG 4.3Å
1014	S	53.4	Low	53.9	Low	47 Å²	47	104.5 Å²	104.5	33%	0.329	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120.9	171.5	49.4	0	0	0	0	109.5	Q993	Q993-S1014 PolarHBondContact N-O 2.74Å; Q993-S1014 PolarHBondContact O-N 3.27Å; Q993-S1014 VanDerWaalsContact O-N 3.16Å
1015	E	49.2	Very low	51.9	Low	105 Å²	105	112.4 Å²	112.4	49%	0.491	55%	0.553	S	S	.	*			trans	-104.8	120.1	173	-166.1	-179.9	176.5	0	0	107	R989	R989-E1015 IonicContact NH1-OE1 3.9Å
1016	V	53.7	Low	50	Low	88 Å²	88	113.6 Å²	113.6	53%	0.533	56%	0.563	S	S	.	*			trans	-96.9	108.8	176.9	-179.5	0	0	0	0	107.6	S990	S990-V1016 PolarHBondContact N-O 2.88Å; S990-V1016 PolarHBondContact OG-O 2.9Å
1017	T	42.6	Very low	47.9	Very low	68 Å²	68	112.7 Å²	112.7	42%	0.417	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.9	116.4	173.7	-59.3	0	0	0	0	108.5	I987	I987-T1017 HydrophobicContact CG2-CG2 3.38Å
1018	T	45.7	Very low	45.8	Very low	78 Å²	78	113.8 Å²	113.8	48%	0.479	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.2	112.5	175.3	-59.6	0	0	0	0	108.8	E988	E988-T1018 PolarHBondContact N-O 3.24Å; E988-T1018 PolarHBondContact O-N 3.03Å; E988-T1018 VanDerWaalsContact O-N 3.14Å
1019	T	37.7	Very low	43.9	Very low	64 Å²	64	111.7 Å²	111.7	39%	0.393	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.4	111.8	175.2	-52	0	0	0	0	109	Q985 I987	Q985-T1019 HydrophobicContact CB-CG2 3.81Å; Q985-T1019 HydrophobicContact CG-CG2 3.75Å; I987-T1019 HydrophobicContact CG1-CG2 4.47Å
1020	K	43.2	Very low	41.9	Very low	137 Å²	137	110.1 Å²	110.1	60%	0.596	60%	0.597	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.3	116.9	166.7	-90.5	-177.1	176.6	173.3	0	108.8	S986	S986-K1020 PolarHBondContact N-O 2.89Å; S986-K1020 PolarHBondContact O-N 2.89Å; S986-K1020 PolarHBondContact OG-O 3.11Å
1021	T	35.1	Very low	40	Very low	74 Å²	74	112.3 Å²	112.3	45%	0.454	62%	0.615	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.4	105.6	178.5	-50.1	0	0	0	0	108.1	T983 Q985	T983-T1021 HydrophobicContact CG2-CG2 3.16Å; Q985-T1021 HydrophobicContact CG-CG2 4.29Å
1022	V	38.1	Very low	37.8	Very low	91 Å²	91	112.2 Å²	112.2	55%	0.552	63%	0.63	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-95.3	109.7	174.4	-178.2	0	0	0	0	108.1	E1024	V1022-E1024 HydrophobicContact CG1-CG 4.47Å
1023	S	33.9	Very low	36.4	Very low	103 Å²	103	115.2 Å²	115.2	72%	0.72	65%	0.646	S	S	*	*			trans	-102.6	97.2	171.9	61.7	0	0	0	0	108.9	R1025	S1023-R1025 PolarHBondContact O-N 3.44Å
1024	E	34.3	Very low	35.2	Very low	175 Å²	175	114.5 Å²	114.5	82%	0.818	65%	0.653	S	S	*	*			trans	-75.7	104.8	167.4	-82.4	-171.9	162.7	0	0	109.1	V1022 I1026	V1022-E1024 HydrophobicContact CG1-CG 4.47Å; E1024-I1026 PolarHBondContact O-N 3.33Å
1025	R	31.1	Very low	34	Very low	221 Å²	221	118.2 Å²	118.2	83%	0.834	67%	0.674	S	S	*	*			trans	-86.2	104.2	167.9	-128.2	-179.1	-169	179.3	3.3	106.8	S1023 T1027	S1023-R1025 PolarHBondContact O-N 3.44Å; R1025-T1027 VanDerWaalsContact C-N 3.25Å; R1025-T1027 PolarHBondContact O-N 3.08Å
1026	I	29.4	Very low	32.8	Very low	162 Å²	162	121.6 Å²	121.6	83%	0.831	69%	0.689	S	S	*	*			trans	-70.5	88.4	169.9	-56.4	175.1	0	0	0	107.2	E1024 A1028	E1024-I1026 PolarHBondContact O-N 3.33Å; I1026-A1028 PolarHBondContact O-N 2.95Å
1027	T	30.2	Very low	31.7	Very low	105 Å²	105	121.8 Å²	121.8	64%	0.644	70%	0.7	S	S	*	*			trans	-85.4	103.1	169	37.8	0	0	0	0	108.9	R1025 S1029	R1025-T1027 VanDerWaalsContact C-N 3.25Å; R1025-T1027 PolarHBondContact O-N 3.08Å; T1027-S1029 PolarHBondContact O-N 2.89Å; T1027-S1029 VanDerWaalsContact O-N 3.08Å
1028	A	25.6	Very low	31.1	Very low	101 Å²	101	126.2 Å²	126.2	84%	0.835	72%	0.721	S	S	*	*			trans	-56.8	109.6	165.6	0	0	0	0	0	109	I1026	I1026-A1028 PolarHBondContact O-N 2.95Å
1029	S	28.5	Very low	30.1	Very low	104 Å²	104	125.8 Å²	125.8	73%	0.727	73%	0.733	S	S	*	*			trans	-123.3	92.4	173.5	45.4	0	0	0	0	109.8	T1027	T1027-S1029 PolarHBondContact O-N 2.89Å; T1027-S1029 VanDerWaalsContact O-N 3.08Å
1030	T	27.5	Very low	29.6	Very low	128 Å²	128	131.2 Å²	131.2	79%	0.785	75%	0.753	S	S	*	*			trans	12.8	110.5	132.5	-34.4	0	0	0	0	117.1
1031	T	25.9	Very low	28.7	Very low	134 Å²	134	130.7 Å²	130.7	82%	0.822	77%	0.766	S	S	*	*			trans	23.7	115.3	142.8	55.7	0	0	0	0	118.9
1032	G	23.9	Very low	28.3	Very low	75 Å²	75	133.2 Å²	133.2	77%	0.773	78%	0.776	S	S	*	*			trans	160.5	129.5	154.3	0	0	0	0	0	115.6
1033	Q	25.7	Very low	27.8	Very low	184 Å²	184	133.3 Å²	133.3	86%	0.86	78%	0.781	S	S	*	*			trans	87.6	90.4	158.7	-60.8	-172.1	-17.2	0	0	118.7	V1035	Q1033-V1035 PolarHBondContact O-N 2.76Å
1034	I	24.7	Very low	27.6	Very low	160 Å²	160	133.9 Å²	133.9	82%	0.821	78%	0.784	S	S	*	*			trans	-53.9	114.6	151.8	-61.1	163.3	0	0	0	108.8
1035	V	27.9	Very low	27.6	Very low	126 Å²	126	134 Å²	134	76%	0.764	78%	0.779	S	S	*	*			trans	-105.6	116.1	167.8	177.8	0	0	0	0	108	Q1033 A1037	Q1033-V1035 PolarHBondContact O-N 2.76Å; V1035-A1037 PolarHBondContact O-N 2.99Å
1036	H	24.5	Very low	27.9	Very low	175 Å²	175	131.2 Å²	131.2	81%	0.81	78%	0.78	S	S	*	*			trans	-59.8	119.5	173.7	-80	-96.4	0	0	0	111
1037	A	30.2	Very low	28.1	Very low	93 Å²	93	132.8 Å²	132.8	77%	0.769	78%	0.782	S	S	*	*			trans	-124.5	97.5	164.7	0	0	0	0	0	109.7	V1035	V1035-A1037 PolarHBondContact O-N 2.99Å
1038	N	29.2	Very low	29.1	Very low	160 Å²	160	132.3 Å²	132.3	86%	0.856	78%	0.775	S	S	*	*			trans	26.1	102.3	145.1	-62.7	-17.4	0	0	0	118.9
1039	G	25.1	Very low	30.2	Very low	70 Å²	70	135.1 Å²	135.1	72%	0.722	77%	0.771	S	S	*	*				63.8	69.9	110.8	0	0	0	0	0	118.3
1040	H	28	Very low	31.4	Very low	177 Å²	177	136.5 Å²	136.5	82%	0.819	77%	0.77	S	S	*	*			trans	-129.3	111.8	147.4	-84.3	-24.2	0	0	0	110.5	I1042	H1040-I1042 PolarHBondContact O-N 3.5Å; H1040-I1042 VanDerWaalsContact O-N 3.15Å
1041	S	24.5	Very low	32.4	Very low	126 Å²	126	135 Å²	135	88%	0.881	76%	0.757	S	S	*	*			trans	-66.2	99	170.8	52.3	0	0	0	0	109.2
1042	I	25.8	Very low	33.5	Very low	128 Å²	128	131.8 Å²	131.8	66%	0.656	74%	0.735	S	S	*	*			trans	-99	117.1	166	-60	178.7	0	0	0	107	H1040 Y1045	H1040-I1042 PolarHBondContact O-N 3.5Å; H1040-I1042 VanDerWaalsContact O-N 3.15Å; I1042-Y1045 HydrophobicContact CG2-CE2 3.92Å
1043	S	27.8	Very low	35	Very low	93 Å²	93	133.7 Å²	133.7	65%	0.65	73%	0.725	S	S	*	*			trans	-54.9	149	-177.4	48.9	0	0	0	0	113.4	Y1045	S1043-Y1045 PolarHBondContact O-N 3.1Å; S1043-Y1045 VanDerWaalsContact O-N 3.15Å
1044	S	29.6	Very low	36.1	Very low	114 Å²	114	127.3 Å²	127.3	80%	0.797	70%	0.704	S	S	*	*			trans	-17.2	102.8	165	54.8	0	0	0	0	114.6	D1046	S1044-D1046 PolarHBondContact O-N 3.42Å
1045	Y	35.4	Very low	36.9	Very low	178 Å²	178	123 Å²	123	70%	0.698	68%	0.682	S	S	*	*			trans	-68.8	123.3	161.4	-82.2	-89.1	0	0	0	108.1	I1042 S1043 F1047	I1042-Y1045 HydrophobicContact CG2-CE2 3.92Å; S1043-Y1045 PolarHBondContact O-N 3.1Å; S1043-Y1045 VanDerWaalsContact O-N 3.15Å; Y1045-F1047 PolarHBondContact O-N 2.72Å; Y1045-F1047 VanDerWaalsContact O-N 3.08Å
1046	D	36.1	Very low	37.9	Very low	162 Å²	162	119.7 Å²	119.7	87%	0.866	66%	0.66	S	S	*	*			trans	-49.2	109.2	175.1	-86	-42	0	0	0	110.3	S1044 D1048	S1044-D1046 PolarHBondContact O-N 3.42Å; D1046-D1048 PolarHBondContact O-N 3.49Å; D1046-D1048 VanDerWaalsContact O-N 3.08Å
1047	F	33.4	Very low	39.1	Very low	196 Å²	196	116.4 Å²	116.4	86%	0.86	65%	0.652	S	S	*	*			trans	-69.8	96.4	165.7	-97.6	-100.5	0	0	0	107.5	Y1045 E1049	Y1045-F1047 PolarHBondContact O-N 2.72Å; Y1045-F1047 VanDerWaalsContact O-N 3.08Å; F1047-E1049 VanDerWaalsContact C-N 3.28Å; F1047-E1049 PolarHBondContact O-N 3.02Å
1048	D	51.4	Low	39.8	Very low	95 Å²	95	117.9 Å²	117.9	51%	0.508	65%	0.651	S	S	.	*			trans	-75.7	83.8	174.3	-166	-18.8	0	0	0	109.3	D1046 D1050 L1051 N1052	D1046-D1048 PolarHBondContact O-N 3.49Å; D1046-D1048 VanDerWaalsContact O-N 3.08Å; D1048-D1050 PolarHBondContact O-N 3.38Å; D1048-D1050 PolarHBondContact OD1-N 3.26Å; D1048-L1051 HydrophobicContact CB-CB 3.99Å; D1048-L1051 PolarHBondContact O-N 2.79Å; D1048-L1051 PolarHBondContact OD1-N 2.73Å; D1048-L1051 VanDerWaalsContact OD1-N 3.13Å; D1048-N1052 PolarHBondContact O-N 3.16Å
1049	E	48.4	Very low	40.8	Very low	159 Å²	159	113.2 Å²	113.2	74%	0.743	63%	0.629	S	S	*	*	H	α-helix	trans	-58.2	-31.7	-180	-123.2	172.5	-173.8	0	0	111.7	F1047 N1052 M1053	F1047-E1049 VanDerWaalsContact C-N 3.28Å; F1047-E1049 PolarHBondContact O-N 3.02Å; E1049-N1052 PolarHBondContact O-N 3.31Å; E1049-M1053 PolarHBondContact O-N 3.01Å
1050	D	53.6	Low	42.1	Very low	134 Å²	134	119.2 Å²	119.2	72%	0.717	64%	0.635	S	S	*	*	H	α-helix	trans	-70.7	-41.7	178.7	-74.9	-25.4	0	0	0	111.6	D1048 N1052 M1053 A1054	D1048-D1050 PolarHBondContact O-N 3.38Å; D1048-D1050 PolarHBondContact OD1-N 3.26Å; D1050-N1052 VanDerWaalsContact C-N 3.3Å; D1050-N1052 PolarHBondContact O-N 2.87Å; D1050-M1053 PolarHBondContact O-N 3.2Å; D1050-A1054 WeakPolarHBondContact O-CB 3.37Å; D1050-A1054 PolarHBondContact O-N 2.87Å
1051	L	49.8	Very low	43	Very low	95 Å²	95	114.3 Å²	114.3	50%	0.497	61%	0.614	S	S	.	*	H	α-helix	trans	-62.5	-39.3	174.7	-177.1	64.2	0	0	0	111.5	D1048 A1054 L1055	D1048-L1051 HydrophobicContact CB-CB 3.99Å; D1048-L1051 PolarHBondContact O-N 2.79Å; D1048-L1051 PolarHBondContact OD1-N 2.73Å; D1048-L1051 VanDerWaalsContact OD1-N 3.13Å; L1051-A1054 PolarHBondContact O-N 2.92Å; L1051-L1055 HydrophobicContact CG-CD1 4.27Å; L1051-L1055 WeakPolarHBondContact O-CB 3.03Å; L1051-L1055 PolarHBondContact O-N 3.2Å
1052	N	49.2	Very low	44.2	Very low	67 Å²	67	112.7 Å²	112.7	36%	0.358	60%	0.596	S	S	.	*	H	α-helix	trans	-71.1	-39	-178.8	-144.1	29.4	0	0	0	111.6	D1048 E1049 D1050 L1055 L1056	D1048-N1052 PolarHBondContact O-N 3.16Å; E1049-N1052 PolarHBondContact O-N 3.31Å; D1050-N1052 VanDerWaalsContact C-N 3.3Å; D1050-N1052 PolarHBondContact O-N 2.87Å; N1052-L1055 PolarHBondContact O-N 3.01Å; N1052-L1056 WeakPolarHBondContact O-CB 3.31Å; N1052-L1056 PolarHBondContact O-N 3.47Å
1053	M	54.3	Low	45.5	Very low	115 Å²	115	111.5 Å²	111.5	57%	0.567	60%	0.597	S	S	*	*	H	α-helix	trans	-65.8	-37.4	172.4	-80.9	-60.9	-61.2	0	0	112.5	E1049 D1050 L1056 T1057	E1049-M1053 PolarHBondContact O-N 3.01Å; D1050-M1053 PolarHBondContact O-N 3.2Å; M1053-L1056 PolarHBondContact O-N 2.85Å; M1053-T1057 WeakPolarHBondContact O-CB 3.43Å; M1053-T1057 PolarHBondContact O-N 2.63Å; M1053-T1057 PolarHBondContact O-OG1 3.1Å
1054	A	49.4	Very low	46.8	Very low	51 Å²	51	111.6 Å²	111.6	42%	0.421	59%	0.59	S	S	.	*	H	α-helix	trans	-64	-43.7	173.9	0	0	0	0	0	111.5	D1050 L1051 T1057 V1058	D1050-A1054 WeakPolarHBondContact O-CB 3.37Å; D1050-A1054 PolarHBondContact O-N 2.87Å; L1051-A1054 PolarHBondContact O-N 2.92Å; A1054-T1057 PolarHBondContact O-N 3.02Å; A1054-V1058 WeakPolarHBondContact O-CB 3.38Å; A1054-V1058 VanDerWaalsContact O-CG2 3.29Å; A1054-V1058 WeakPolarHBondContact O-CG2 3.35Å; A1054-V1058 PolarHBondContact O-N 2.84Å
1055	L	42.1	Very low	47.6	Very low	69 Å²	69	108.1 Å²	108.1	36%	0.361	56%	0.562	S	S	.	*	H	α-helix	trans	-61.6	-45.3	174.9	-85.6	161.6	0	0	0	111.7	L1051 N1052 T1057 V1058 T1059	L1051-L1055 HydrophobicContact CG-CD1 4.27Å; L1051-L1055 WeakPolarHBondContact O-CB 3.03Å; L1051-L1055 PolarHBondContact O-N 3.2Å; N1052-L1055 PolarHBondContact O-N 3.01Å; L1055-T1057 VanDerWaalsContact C-N 3.35Å; L1055-T1057 PolarHBondContact O-N 3.02Å; L1055-V1058 PolarHBondContact O-N 3.15Å; L1055-T1059 HydrophobicContact CD2-CG2 4.32Å; L1055-T1059 WeakPolarHBondContact O-CB 3.29Å; L1055-T1059 WeakPolarHBondContact O-CG2 3.33Å; L1055-T1059 PolarHBondContact O-N 2.85Å; L1055-T1059 PolarHBondContact O-OG1 3.45Å
1056	L	47.9	Very low	48.2	Very low	56 Å²	56	102.3 Å²	102.3	29%	0.293	55%	0.547	S	S	.	.	H	α-helix	trans	-59.4	-43.9	175.9	-96.4	153.2	0	0	0	112.4	N1052 M1053 V1058 K1060 L1061 P1063	N1052-L1056 WeakPolarHBondContact O-CB 3.31Å; N1052-L1056 PolarHBondContact O-N 3.47Å; M1053-L1056 PolarHBondContact O-N 2.85Å; L1056-V1058 PolarHBondContact O-N 3.23Å; L1056-K1060 PolarHBondContact O-N 2.98Å; L1056-L1061 WeakPolarHBondContact CD2-O 3.42Å; L1056-P1063 HydrophobicContact CD2-CB 4.25Å
1057	T	50.9	Low	48.5	Very low	107 Å²	107	97 Å²	97	66%	0.656	52%	0.52	S	S	*	.	H	α-helix	trans	-67.4	-38.2	-178.5	-49.6	0	0	0	0	111.8	M1053 A1054 L1055	M1053-T1057 WeakPolarHBondContact O-CB 3.43Å; M1053-T1057 PolarHBondContact O-N 2.63Å; M1053-T1057 PolarHBondContact O-OG1 3.1Å; A1054-T1057 PolarHBondContact O-N 3.02Å; L1055-T1057 VanDerWaalsContact C-N 3.35Å; L1055-T1057 PolarHBondContact O-N 3.02Å
1058	V	44.9	Very low	49.1	Very low	124 Å²	124	92.7 Å²	92.7	75%	0.752	51%	0.506	S	S	*	.	H	α-helix	trans	-81.8	-40	-176.5	174.7	0	0	0	0	112.1	A1054 L1055 L1056	A1054-V1058 WeakPolarHBondContact O-CB 3.38Å; A1054-V1058 VanDerWaalsContact O-CG2 3.29Å; A1054-V1058 WeakPolarHBondContact O-CG2 3.35Å; A1054-V1058 PolarHBondContact O-N 2.84Å; L1055-V1058 PolarHBondContact O-N 3.15Å; L1056-V1058 PolarHBondContact O-N 3.23Å
1059	T	49.4	Very low	48.6	Very low	62 Å²	62	94.1 Å²	94.1	38%	0.38	51%	0.513	S	S	.	.	H	α-helix	trans	-94.1	-13	-168.4	62.9	0	0	0	0	113.9	L1055 L1061	L1055-T1059 HydrophobicContact CD2-CG2 4.32Å; L1055-T1059 WeakPolarHBondContact O-CB 3.29Å; L1055-T1059 WeakPolarHBondContact O-CG2 3.33Å; L1055-T1059 PolarHBondContact O-N 2.85Å; L1055-T1059 PolarHBondContact O-OG1 3.45Å; T1059-L1061 HydrophobicContact CG2-CD1 4.28Å; T1059-L1061 PolarHBondContact O-N 2.76Å; T1059-L1061 WeakPolarHBondContact OG1-CB 3.27Å; T1059-L1061 VanDerWaalsContact OG1-CD1 3.3Å; T1059-L1061 WeakPolarHBondContact OG1-CD1 3.35Å; T1059-L1061 VanDerWaalsContact OG1-CG 3.32Å; T1059-L1061 WeakPolarHBondContact OG1-CG 3.4Å; T1059-L1061 PolarHBondContact OG1-N 2.79Å
1060	K	52.2	Low	48.3	Very low	195 Å²	195	90.7 Å²	90.7	85%	0.848	50%	0.5	S	S	*	.			trans	49	24.6	-170.6	-60.7	-171.3	177.5	-174.7	0	112.8	L1056	L1056-K1060 PolarHBondContact O-N 2.98Å
1061	L	47.7	Very low	47.8	Very low	75 Å²	75	90 Å²	90	39%	0.393	50%	0.503	S	S	.	.			trans	-65.1	143.9	174	-75.7	167.6	0	0	0	108.4	L1056 T1059 I1065	L1056-L1061 WeakPolarHBondContact CD2-O 3.42Å; T1059-L1061 HydrophobicContact CG2-CD1 4.28Å; T1059-L1061 PolarHBondContact O-N 2.76Å; T1059-L1061 WeakPolarHBondContact OG1-CB 3.27Å; T1059-L1061 VanDerWaalsContact OG1-CD1 3.3Å; T1059-L1061 WeakPolarHBondContact OG1-CD1 3.35Å; T1059-L1061 VanDerWaalsContact OG1-CG 3.32Å; T1059-L1061 WeakPolarHBondContact OG1-CG 3.4Å; T1059-L1061 PolarHBondContact OG1-N 2.79Å; L1061-I1065 HydrophobicContact CB-CD1 4.36Å; L1061-I1065 HydrophobicContact CD2-CD1 3.92Å
1062	D	48.5	Very low	47.7	Very low	92 Å²	92	91.2 Å²	91.2	49%	0.492	51%	0.514	S	S	.	.			trans	-53.1	131.1	176.5	-166.4	-40.7	0	0	0	109.6	D1064 I1065	D1062-D1064 PolarHBondContact O-N 3.1Å; D1062-D1064 PolarHBondContact OD1-N 2.96Å; D1062-D1064 VanDerWaalsContact OD1-N 3.11Å; D1062-I1065 HydrophobicContact CB-CD1 4.15Å; D1062-I1065 HydrophobicContact CB-CG1 4.33Å; D1062-I1065 WeakPolarHBondContact O-CB 3.3Å; D1062-I1065 PolarHBondContact O-N 2.84Å
1063	P	54.1	Low	47.1	Very low	103 Å²	103	91.2 Å²	91.2	67%	0.669	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-14.1	177.4	21.7	-33.8	0	0	0	114.6	L1056 I1065	L1056-P1063 HydrophobicContact CD2-CB 4.25Å; P1063-I1065 VanDerWaalsContact C-N 3.28Å; P1063-I1065 PolarHBondContact O-N 2.93Å
1064	D	54.3	Low	46.4	Very low	95 Å²	95	92.8 Å²	92.8	51%	0.508	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	3.1	174.7	-72.4	-29.7	0	0	0	115	D1062 K1080	D1062-D1064 PolarHBondContact O-N 3.1Å; D1062-D1064 PolarHBondContact OD1-N 2.96Å; D1062-D1064 VanDerWaalsContact OD1-N 3.11Å; D1064-K1080 PolarHBondContact O-N 3.24Å
1065	I	46.5	Very low	45.9	Very low	41 Å²	41	94.8 Å²	94.8	21%	0.21	54%	0.543	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	120.2	176.3	-62.5	172.6	0	0	0	110.2	L1061 D1062 P1063 I1077 T1079	L1061-I1065 HydrophobicContact CB-CD1 4.36Å; L1061-I1065 HydrophobicContact CD2-CD1 3.92Å; D1062-I1065 HydrophobicContact CB-CD1 4.15Å; D1062-I1065 HydrophobicContact CB-CG1 4.33Å; D1062-I1065 WeakPolarHBondContact O-CB 3.3Å; D1062-I1065 PolarHBondContact O-N 2.84Å; P1063-I1065 VanDerWaalsContact C-N 3.28Å; P1063-I1065 PolarHBondContact O-N 2.93Å; I1065-I1077 HydrophobicContact CG2-CG2 3.38Å; I1065-T1079 HydrophobicContact CG1-CG2 4.01Å
1066	S	47.1	Very low	45.9	Very low	56 Å²	56	96.1 Å²	96.1	39%	0.392	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	136.4	172.7	59.2	0	0	0	0	111.1	R1078	S1066-R1078 PolarHBondContact N-O 2.91Å; S1066-R1078 VanDerWaalsContact N-O 3.12Å; S1066-R1078 PolarHBondContact O-N 3.46Å; S1066-R1078 VanDerWaalsContact O-N 3.12Å
1067	V	43.7	Very low	45.6	Very low	50 Å²	50	98.6 Å²	98.6	30%	0.303	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.2	119.3	178.8	-177.9	0	0	0	0	108.4	V1075	V1067-V1075 HydrophobicContact CG1-CG1 3.49Å; V1067-V1075 VanDerWaalsContact CG1-CG1 3.49Å
1068	L	45.1	Very low	45.2	Very low	105 Å²	105	99.3 Å²	99.3	55%	0.55	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.2	127.8	177	-86.2	152.2	0	0	0	109.9	E1076	L1068-E1076 PolarHBondContact N-O 2.91Å; L1068-E1076 VanDerWaalsContact N-O 3.12Å; L1068-E1076 PolarHBondContact O-N 2.77Å
1069	N	41	Very low	45	Very low	125 Å²	125	96.5 Å²	96.5	67%	0.668	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	110.1	169.6	-95.8	-22.6	0	0	0	109.2
1070	N	41.6	Very low	44.7	Very low	88 Å²	88	101.2 Å²	101.2	47%	0.471	55%	0.549	S	S	.	.			trans	-82.3	142.3	171.6	-170.6	-24.3	0	0	0	109.5	V1072 G1073 Q1074	N1070-V1072 PolarHBondContact O-N 3.08Å; N1070-G1073 PolarHBondContact O-N 3.05Å; N1070-Q1074 PolarHBondContact N-O 2.74Å
1071	P	43	Very low	44.3	Very low	120 Å²	120	96.3 Å²	96.3	78%	0.779	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-10.6	177.2	12.4	-30.2	0	0	0	117.5	G1073	P1071-G1073 VanDerWaalsContact C-N 3.28Å
1072	V	47.8	Very low	44	Very low	119 Å²	119	99.7 Å²	99.7	72%	0.721	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	8.2	172.3	-157.9	0	0	0	0	112.6	N1070 Q1074	N1070-V1072 PolarHBondContact O-N 3.08Å; V1072-Q1074 VanDerWaalsContact C-N 3.27Å; V1072-Q1074 PolarHBondContact O-N 2.75Å
1073	G	38.2	Very low	43.2	Very low	68 Å²	68	103.6 Å²	103.6	70%	0.701	57%	0.568	S	S	*	*	S	Bend	trans	73.4	16.4	175.8	0	0	0	0	0	114.2	N1070 P1071	N1070-G1073 PolarHBondContact O-N 3.05Å; P1071-G1073 VanDerWaalsContact C-N 3.28Å
1074	Q	38.6	Very low	42	Very low	147 Å²	147	104.4 Å²	104.4	69%	0.687	57%	0.57	S	S	*	*			trans	-97.2	130.3	171.4	-72.1	-176.2	-8.4	0	0	110.1	N1070 V1072	N1070-Q1074 PolarHBondContact N-O 2.74Å; V1072-Q1074 VanDerWaalsContact C-N 3.27Å; V1072-Q1074 PolarHBondContact O-N 2.75Å
1075	V	39.1	Very low	40.9	Very low	93 Å²	93	111.6 Å²	111.6	56%	0.564	61%	0.608	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.9	113.8	176.6	179.8	0	0	0	0	107.8	V1067	V1067-V1075 HydrophobicContact CG1-CG1 3.49Å; V1067-V1075 VanDerWaalsContact CG1-CG1 3.49Å
1076	E	42.4	Very low	40.7	Very low	97 Å²	97	115.2 Å²	115.2	45%	0.453	63%	0.628	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.6	127.7	175.5	-146	-179.5	-132.6	0	0	109.4	L1068 R1078	L1068-E1076 PolarHBondContact N-O 2.91Å; L1068-E1076 VanDerWaalsContact N-O 3.12Å; L1068-E1076 PolarHBondContact O-N 2.77Å; E1076-R1078 IonicContact OE2-CZ 2.62Å; E1076-R1078 IonicContact OE2-NE 3.28Å; E1076-R1078 PolarHBondContact OE2-NE 2.88Å; E1076-R1078 IonicContact OE2-NH2 3.21Å; E1076-R1078 PolarHBondContact OE2-NH2 2.76Å
1077	I	41.7	Very low	40.3	Very low	108 Å²	108	118.3 Å²	118.3	55%	0.554	64%	0.64	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.6	118.7	-179.2	-58.2	176	0	0	0	107.2	I1065	I1065-I1077 HydrophobicContact CG2-CG2 3.38Å
1078	R	42.6	Very low	40.1	Very low	122 Å²	122	122.1 Å²	122.1	46%	0.46	66%	0.659	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.6	134.5	176.7	-66.7	-169.4	-172.9	-164.5	-1.8	111.9	S1066 E1076	S1066-R1078 PolarHBondContact N-O 2.91Å; S1066-R1078 VanDerWaalsContact N-O 3.12Å; S1066-R1078 PolarHBondContact O-N 3.46Å; S1066-R1078 VanDerWaalsContact O-N 3.12Å; E1076-R1078 IonicContact OE2-CZ 2.62Å; E1076-R1078 IonicContact OE2-NE 3.28Å; E1076-R1078 PolarHBondContact OE2-NE 2.88Å; E1076-R1078 IonicContact OE2-NH2 3.21Å; E1076-R1078 PolarHBondContact OE2-NH2 2.76Å
1079	T	40.3	Very low	39.9	Very low	65 Å²	65	123.1 Å²	123.1	40%	0.399	67%	0.665	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.2	137.4	170.8	44.8	0	0	0	0	109.9	I1065 S1081 E1082	I1065-T1079 HydrophobicContact CG1-CG2 4.01Å; T1079-S1081 PolarHBondContact O-N 3.24Å; T1079-S1081 PolarHBondContact OG1-OG 3.1Å; T1079-E1082 PolarHBondContact O-N 3.33Å
1080	K	43	Very low	39.8	Very low	161 Å²	161	122.9 Å²	122.9	70%	0.7	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-59.9	-9.1	177.7	-94.5	-178.1	178.4	170.4	0	115.3	D1064 E1082 H1083	D1064-K1080 PolarHBondContact O-N 3.24Å; K1080-E1082 PolarHBondContact O-N 3.29Å; K1080-H1083 PolarHBondContact O-N 3.42Å
1081	S	44.2	Very low	39.7	Very low	93 Å²	93	125.3 Å²	125.3	65%	0.65	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-67.9	-10	174.6	59.2	0	0	0	0	114.4	T1079 H1083	T1079-S1081 PolarHBondContact O-N 3.24Å; T1079-S1081 PolarHBondContact OG1-OG 3.1Å; S1081-H1083 PolarHBondContact O-N 3.37Å
1082	E	40.5	Very low	39.4	Very low	146 Å²	146	125.6 Å²	125.6	68%	0.682	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-80.2	4.9	174.1	-73.1	-166.9	158.2	0	0	114.5	T1079 K1080	T1079-E1082 PolarHBondContact O-N 3.33Å; K1080-E1082 PolarHBondContact O-N 3.29Å
1083	H	33.3	Very low	38.8	Very low	174 Å²	174	126.2 Å²	126.2	81%	0.806	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-108.7	11.8	176.8	-94.3	-65.8	0	0	0	116.1	K1080 S1081	K1080-H1083 PolarHBondContact O-N 3.42Å; S1081-H1083 PolarHBondContact O-N 3.37Å
1084	V	28.6	Very low	38.8	Very low	119 Å²	119	131 Å²	131	72%	0.721	66%	0.664	S	S	*	*			trans	-137.2	101.1	172.4	-171.4	0	0	0	0	111
1085	L	31.5	Very low	38.8	Very low	247 Å²	247	129.5 Å²	129.5	100%	1.293	66%	0.662	S	S	*	*			trans	107.4	0	171.4	-70.7	157.7	0	0	0	116.6

Retrieved 1,085 of 1,085 residues in 1390.6 ms (Link to these results)

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