A0A087YKY5_POEFO Loading...

EGF like, fibronectin type III and laminin G domains

AlphaFold DB , UniProt , Accession A0A087YKY5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,067 aa.

						>A0A087YKY5_POEFO|A0A087YKY5
MDPTCKEKRLLCLLFFAICSASVCFGARRSNARRSDRLSPPLDIQLETLNCSAFSVRWKMPRRHVSTITGYKVFYTEMKNGRPVSTTSIMEVPLSLDMLTTGQFDGQASFDVNIGNLKMNSKYRVSVGAYGWAGEGRPSMPRDISTASHEMCMPPSPPTQPIVMAVSDTELALSWQEGESEGSSPVLHFLVAYIRPEMDTEWTYIREPIETSSMVLKGLLPETEYQFVVRAVNIYGVSPPSHINNPVRTLGSLEMGSGDVGRYNTDPRYKDEDGFDIDDSDYDVFIEELKPFPGIGENNGKSQLRSHPGPPSGRNVVYRMNGKVPPNVTDQPVDVTPSSIFSDFTDLVFTVPSERSSTTDTPTTAPSTTTSPPSATTASICTISPWKGEIPRVYDLACDDTVCPPDSFCLTDYESGGSRCHCNLGRRGDSCSEAVTVNFPRFYGYSHMTFEPLKNSYQTFQITLEFKADSEDGLLLYCGENEHGRGDFTSLALVQGKLHYRFNCGTGAAQIISESPVVLGQWHIVTIFRDGMSGWLRMDNDNPISGRSLGQYTKITFRSPLYVGGSPGAYWLVRATGTNRGFVGCIQSLTINNKATDIRPWPLGKALSGADIGECSDRVCDMVSCANGGVCFANRADGYICLCPLGFKGALCEESFSLSSPLFNETVFSYAVIRWPQSSQSYLSFMEFEVTFWPSAPSGVLLYSDDAGSRDFLAINLVDRYLEFRFDCGSGEAVIRSEEQINLDSWHELRVSRTAKSGILQVDNQKPMEGIAEGAFTQINCSSPLYLGGVPDYEKTKRTAGVMKPFTGIIQKLILNDRAMPITAGSAGGVNIANSAHPCVENPCANGGTCRPKWDDYECDCPLGYDGRHCQKECGNYCLNTVTEAIEIPQFIGRSYLTYDNRDILKRVSGSRTNLFMHFKSTAKDGLLLWRGDSPMRPNSDFISMGLQDGALIFSYNLGSGMANIVVNGTFSDGKWHRVKAVRDGQSGKLTVDDYGAKTGRSPGKMRQLNINGPLYVGGMKEIALHTNRQYLGGLVGCVSHFTLSTDFHLALVEDAADGKNINTCSN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.1	Very low	31.3	Very low	238 Å²	238	165.3 Å²	165.3	100%	1.172	84%	0.837	S	S	*	*				0	81.3	0	-61.9	169.5	179.7	0	0	106.7
2	D	27.8	Very low	30.8	Very low	149 Å²	149	160.7 Å²	160.7	80%	0.797	83%	0.829	S	S	*	*			cis	80.5	137.7	23.7	-146.4	52.8	0	0	0	113.5
3	P	46.8	Very low	30.3	Very low	100 Å²	100	160 Å²	160	65%	0.649	83%	0.827	S	S	*	*				-134.6	176.5	-51.1	36.4	-22.7	0	0	0	116.4
4	T	34.3	Very low	30	Very low	140 Å²	140	156.9 Å²	156.9	86%	0.859	81%	0.811	S	S	*	*			trans	-17.3	133.1	170	44.4	0	0	0	0	120.3
5	C	28.8	Very low	29.9	Very low	136 Å²	136	160.5 Å²	160.5	92%	0.919	82%	0.819	S	S	*	*			trans	-87.3	164.5	177.3	-163	0	0	0	0	113.8
6	K	29.8	Very low	29.8	Very low	176 Å²	176	161.6 Å²	161.6	77%	0.765	82%	0.816	S	S	*	*			trans	-129.1	152.8	-169.6	-131.4	-174.7	-176.4	-179.8	0	111.5
7	E	31.3	Very low	29.7	Very low	132 Å²	132	156.1 Å²	156.1	62%	0.617	80%	0.802	S	S	*	*			trans	74	130.9	150.4	-67.3	-157.4	141.1	0	0	123.5
8	K	29.8	Very low	29.7	Very low	159 Å²	159	156.6 Å²	156.6	69%	0.691	80%	0.804	S	S	*	*			trans	75	112.5	134.4	-70.5	166.1	-172.5	155.2	0	121
9	R	26.3	Very low	29.5	Very low	234 Å²	234	154.4 Å²	154.4	88%	0.883	80%	0.802	S	S	*	*			trans	65.1	92.2	143.4	-66.7	-176.6	171	-177.8	-3	118
10	L	28.3	Very low	29.4	Very low	185 Å²	185	152.1 Å²	152.1	97%	0.969	80%	0.8	S	S	*	*				-131.3	107.9	128	-149.3	72.6	0	0	0	108
11	L	29	Very low	29.5	Very low	169 Å²	169	149.5 Å²	149.5	89%	0.885	80%	0.801	S	S	*	*			trans	-137	75.3	-172.3	-171.9	105.9	0	0	0	110.2
12	C	25	Very low	29.2	Very low	110 Å²	110	143.8 Å²	143.8	74%	0.743	78%	0.784	S	S	*	*			trans	-160.6	122.7	171.2	-139.7	0	0	0	0	110.1
13	L	25.1	Very low	29.3	Very low	152 Å²	152	143.4 Å²	143.4	80%	0.796	79%	0.787	S	S	*	*			trans	66.4	150.6	164.5	-49.1	170.2	0	0	0	115
14	L	25.3	Very low	28.6	Very low	116 Å²	116	144.1 Å²	144.1	61%	0.607	79%	0.793	S	S	*	*			cis	-158	134.2	-9.8	-120.6	165.6	0	0	0	107.2	F16	L14-F16 HydrophobicContact CD2-CD2 3.86Å; L14-F16 HydrophobicContact CD2-CE2 3.94Å
15	F	28.8	Very low	28.3	Very low	211 Å²	211	147.8 Å²	147.8	93%	0.925	80%	0.798	S	S	*	*			trans	-147.4	94.2	166.1	-101.9	-73.1	0	0	0	112.7
16	F	29	Very low	28.3	Very low	178 Å²	178	144.6 Å²	144.6	78%	0.781	79%	0.787	S	S	*	*			trans	-74.1	167	145.8	-75.8	-110.8	0	0	0	108.7	L14	L14-F16 HydrophobicContact CD2-CD2 3.86Å; L14-F16 HydrophobicContact CD2-CE2 3.94Å
17	A	27.7	Very low	28.4	Very low	69 Å²	69	141 Å²	141	57%	0.57	79%	0.791	S	S	*	*			cis	-177.6	145.7	-31.6	0	0	0	0	0	107.6
18	I	29.4	Very low	28.2	Very low	164 Å²	164	146.7 Å²	146.7	84%	0.841	81%	0.807	S	S	*	*			trans	66.5	125.8	159.8	-58.5	154.6	0	0	0	114.5
19	C	25.3	Very low	28.7	Very low	115 Å²	115	149.7 Å²	149.7	78%	0.777	81%	0.814	S	S	*	*				-170.4	-175	52.5	-148.6	0	0	0	0	114.6
20	S	28.9	Very low	28.8	Very low	108 Å²	108	143.8 Å²	143.8	76%	0.755	81%	0.808	S	S	*	*			trans	70.1	78	153.6	44.4	0	0	0	0	122.4
21	A	30.3	Very low	29.1	Very low	98 Å²	98	141.5 Å²	141.5	81%	0.81	80%	0.797	S	S	*	*				49	130.4	120.2	0	0	0	0	0	124.4
22	S	26.9	Very low	29.4	Very low	118 Å²	118	137.4 Å²	137.4	83%	0.825	79%	0.787	S	S	*	*			trans	-162.5	114.3	137.6	-84.6	0	0	0	0	114.4
23	V	29.2	Very low	29.9	Very low	141 Å²	141	144.1 Å²	144.1	86%	0.855	80%	0.797	S	S	*	*			trans	43.6	140.4	148.4	-166.5	0	0	0	0	122
24	C	31.8	Very low	30.7	Very low	115 Å²	115	147.4 Å²	147.4	78%	0.777	80%	0.799	S	S	*	*			trans	-116.1	162.6	-179.1	-54	0	0	0	0	113.3
25	F	28.9	Very low	31.6	Very low	218 Å²	218	146 Å²	146	96%	0.956	80%	0.798	S	S	*	*			trans	-167.4	120.7	142.4	-109.5	-68.9	0	0	0	115.6
26	G	27.3	Very low	32.4	Very low	68 Å²	68	141.2 Å²	141.2	70%	0.701	78%	0.783	S	S	*	*			trans	78.8	93.5	132.1	0	0	0	0	0	125.7
27	A	33.4	Very low	33.8	Very low	102 Å²	102	140.3 Å²	140.3	84%	0.843	77%	0.774	S	S	*	*			trans	61.1	166.3	141.7	0	0	0	0	0	120.5
28	R	27.3	Very low	35.5	Very low	251 Å²	251	137.1 Å²	137.1	95%	0.947	75%	0.748	S	S	*	*			cis	-146.2	-170.5	6.1	-144.2	172.4	-164.9	-178.8	5.2	111.3
29	R	39.3	Very low	37.6	Very low	222 Å²	222	131.7 Å²	131.7	84%	0.838	72%	0.724	S	S	*	*			trans	-152.5	144.3	-161.3	-173.9	-166.8	-165.1	-176	9.4	115.9
30	S	29.5	Very low	40.4	Very low	110 Å²	110	128.7 Å²	128.7	77%	0.769	70%	0.703	S	S	*	*			trans	-154	147.2	155.7	51.4	0	0	0	0	109
31	N	32.8	Very low	43.1	Very low	137 Å²	137	123.9 Å²	123.9	73%	0.733	67%	0.669	S	S	*	*			cis	83.2	135.3	24.3	-74.5	2.6	0	0	0	116.2
32	A	36.6	Very low	45.5	Very low	82 Å²	82	122 Å²	122	68%	0.678	65%	0.646	S	S	*	*			cis	-173.6	164.4	-15.9	0	0	0	0	0	110.6
33	R	36.1	Very low	48.1	Very low	251 Å²	251	120 Å²	120	95%	0.947	63%	0.625	S	S	*	*				-164.4	121.4	127.9	-106	171.9	-158.9	-139.1	3.9	112.5
34	R	41.2	Very low	50.8	Low	221 Å²	221	113.8 Å²	113.8	83%	0.834	59%	0.587	S	S	*	*			trans	-127.5	149.8	156.7	-73.6	179.4	178.3	162.8	-0.2	105.5
35	S	43.3	Very low	53.4	Low	86 Å²	86	113.5 Å²	113.5	60%	0.601	57%	0.574	S	S	*	*			trans	-141.7	-178.3	162.8	52.5	0	0	0	0	109.3	R37	S35-R37 PolarHBondContact O-N 2.65Å
36	D	46.8	Very low	56.2	Low	112 Å²	112	105 Å²	105	60%	0.599	54%	0.539	S	S	*	.	S	Bend	trans	68.1	41.9	158.3	-38	-32.7	0	0	0	115.9
37	R	57.2	Low	59	Low	158 Å²	158	106.9 Å²	106.9	60%	0.596	53%	0.529	S	S	*	.	S	Bend	trans	-143.2	149.2	148.5	-72.8	-159.9	-175.6	-154.9	-0.1	110.2	S35	S35-R37 PolarHBondContact O-N 2.65Å
38	L	63.8	Low	61.3	Low	3 Å²	3	105.1 Å²	105.1	2%	0.016	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-61	137.7	170.9	-64.3	174.2	0	0	0	111.3	H64 I68 A129 Y130 G134 G136 R137	L38-H64 HydrophobicContact CD2-CB 3.69Å; L38-I68 HydrophobicContact CD1-CG1 4.15Å; L38-I68 HydrophobicContact CD2-CG1 3.95Å; L38-A129 HydrophobicContact CB-CB 4.43Å; L38-A129 HydrophobicContact CD1-CB 4.23Å; L38-Y130 VanDerWaalsContact CD1-C 3.46Å; L38-G134 WeakPolarHBondContact CD1-O 3.39Å; L38-G136 VanDerWaalsContact O-CA 3.22Å; L38-G136 WeakPolarHBondContact O-CA 3.38Å; L38-R137 PolarHBondContact O-N 2.92Å
39	S	74.4	Confident	63.4	Low	49 Å²	49	96.9 Å²	96.9	34%	0.343	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-67.7	150.3	173.7	-64.9	0	0	0	0	110.8	P61 R63	S39-P61 WeakPolarHBondContact O-CB 3.43Å; S39-P61 WeakPolarHBondContact O-CG 3.44Å; S39-R63 VanDerWaalsContact CB-O 3.28Å; S39-R63 WeakPolarHBondContact CB-O 3.41Å; S39-R63 PolarHBondContact OG-O 2.9Å
40	P	82.6	Confident	64.7	Low	52 Å²	52	88.7 Å²	88.7	34%	0.338	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-61.5	147.7	174.5	-20.2	31.1	0	0	0	112.5	R137	P40-R137 WeakPolarHBondContact CA-O 3.35Å; P40-R137 WeakPolarHBondContact CB-O 3.17Å; P40-R137 HydrophobicContact CG-CB 4.23Å; P40-R137 WeakPolarHBondContact CG-O 3.27Å
41	P	85.7	Confident	66.5	Low	8 Å²	8	83.6 Å²	83.6	5%	0.052	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-53.3	150	168.1	-26.6	35.8	0	0	0	113.4	I44 W58 Y71 V127 A129	P41-I44 HydrophobicContact CB-CD1 4.42Å; P41-W58 HydrophobicContact CB-CB 4.07Å; P41-W58 HydrophobicContact CB-CG 4.06Å; P41-Y71 HydrophobicContact CG-CD1 3.8Å; P41-Y71 HydrophobicContact CG-CE1 3.95Å; P41-V127 HydrophobicContact CB-CB 4.42Å; P41-V127 HydrophobicContact CB-CG1 4.48Å; P41-V127 VanDerWaalsContact CD-O 3.29Å; P41-V127 WeakPolarHBondContact CD-O 3.32Å; P41-V127 HydrophobicContact CG-CB 4.12Å; P41-V127 HydrophobicContact CG-CG1 3.94Å; P41-A129 HydrophobicContact CG-CB 4.43Å
42	L	81.2	Confident	68.4	Low	59 Å²	59	79 Å²	79	31%	0.309	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	170.7	-174.8	-62.8	177.7	0	0	0	112.1	I44 W58 K59 R62	L42-I44 PolarHBondContact O-N 3.48Å; L42-W58 WeakPolarHBondContact O-CA 3.16Å; L42-K59 HydrophobicContact CB-CB 4.38Å; L42-K59 PolarHBondContact N-O 2.93Å; L42-K59 PolarHBondContact O-N 2.88Å; L42-R62 HydrophobicContact CD1-CB 3.99Å; L42-R62 HydrophobicContact CD1-CG 3.6Å
43	D	81.4	Confident	70.4	Confident	75 Å²	75	75.5 Å²	75.5	40%	0.401	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	47.7	36.9	170.5	-64.2	9.7	0	0	0	114.9	Q45 K59	D43-Q45 PolarHBondContact O-N 2.95Å; D43-K59 HydrophobicContact CB-CB 4.4Å; D43-K59 HydrophobicContact CB-CD 3.99Å; D43-K59 HydrophobicContact CB-CG 4.09Å; D43-K59 WeakPolarHBondContact OD2-CD 3.37Å; D43-K59 WeakPolarHBondContact OD2-CE 3.44Å; D43-K59 IonicContact OD2-NZ 3.45Å; D43-K59 PolarHBondContact OD2-NZ 3.19Å
44	I	86.8	Confident	72.7	Confident	10 Å²	10	63.6 Å²	63.6	5%	0.051	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	121	-175.2	-59	-179.7	0	0	0	110.9	P41 L42 L46 R57 W58 V127 S139 R142	P41-I44 HydrophobicContact CB-CD1 4.42Å; L42-I44 PolarHBondContact O-N 3.48Å; I44-L46 HydrophobicContact CG2-CD2 4.44Å; I44-R57 CarbonylContact C-O 3.47Å; I44-R57 VanDerWaalsContact CA-O 3.24Å; I44-R57 WeakPolarHBondContact CA-O 3.22Å; I44-W58 HydrophobicContact CG1-CB 3.82Å; I44-V127 HydrophobicContact CD1-CB 4.03Å; I44-V127 HydrophobicContact CD1-CG2 4.02Å; I44-S139 WeakPolarHBondContact CD1-OG 3.46Å; I44-R142 PolarHBondContact O-NE 3.28Å; I44-R142 PolarHBondContact O-NH2 2.99Å
45	Q	86.1	Confident	74.8	Confident	109 Å²	109	53.2 Å²	53.2	51%	0.509	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	142.4	175.6	-67.8	169.2	-11.3	0	0	108.5	D43 R57	D43-Q45 PolarHBondContact O-N 2.95Å; Q45-R57 HydrophobicContact CB-CB 4.3Å; Q45-R57 PolarHBondContact N-O 3.35Å; Q45-R57 PolarHBondContact O-N 2.98Å
46	L	88.4	Confident	77	Confident	39 Å²	39	49.1 Å²	49.1	20%	0.204	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	134.2	174.2	-57.1	179.7	0	0	0	107	I44 V56 V125 R142 I144	I44-L46 HydrophobicContact CG2-CD2 4.44Å; L46-V56 HydrophobicContact CD2-CB 4.15Å; L46-V56 HydrophobicContact CD2-CG1 3.82Å; L46-V56 HydrophobicContact CD2-CG2 3.83Å; L46-V125 HydrophobicContact CD1-CB 4.01Å; L46-V125 HydrophobicContact CD1-CG2 4.06Å; L46-V125 HydrophobicContact CD2-CB 4.03Å; L46-V125 HydrophobicContact CD2-CG1 3.94Å; L46-V125 HydrophobicContact CD2-CG2 4.29Å; L46-R142 HydrophobicContact CD1-CB 3.55Å; L46-R142 HydrophobicContact CG-CB 4.33Å; L46-I144 HydrophobicContact CB-CB 4.15Å; L46-I144 HydrophobicContact CB-CD1 3.59Å; L46-I144 HydrophobicContact CB-CG1 4.44Å; L46-I144 HydrophobicContact CD1-CB 3.9Å; L46-I144 HydrophobicContact CD1-CG2 3.9Å
47	E	84.9	Confident	78.9	Confident	109 Å²	109	47.2 Å²	47.2	51%	0.509	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	126.9	-175.9	173	175.6	-138.7	0	0	109.2	L49 F54 S55	E47-L49 PolarHBondContact O-N 3.02Å; E47-F54 CarbonylContact O-C 3.54Å; E47-F54 WeakPolarHBondContact O-CA 3.34Å; E47-F54 WeakPolarHBondContact O-CB 3.41Å; E47-S55 PolarHBondContact N-O 3.28Å; E47-S55 PolarHBondContact O-N 3.37Å
48	T	81.4	Confident	80.4	Confident	65 Å²	65	39.8 Å²	39.8	40%	0.399	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	124.2	-177.4	-56.5	0	0	0	0	108.9	S145 A147	T48-S145 VanDerWaalsContact CG2-O 3.26Å; T48-S145 WeakPolarHBondContact CG2-O 3.35Å; T48-S145 PolarHBondContact OG1-O 2.76Å; T48-A147 HydrophobicContact CG2-CB 4.2Å
49	L	72.1	Confident	81.2	Confident	78 Å²	78	42.6 Å²	42.6	41%	0.408	23%	0.226	S	C	.	.			trans	-94.1	-47.1	-175	-64.2	172.5	0	0	0	111.8	E47 A53 N113	E47-L49 PolarHBondContact O-N 3.02Å; L49-A53 HydrophobicContact CB-CB 4.27Å; L49-A53 HydrophobicContact CD1-CB 4.33Å; L49-A53 PolarHBondContact N-O 3.29Å; L49-N113 HydrophobicContact CD1-CB 3.78Å; L49-N113 VanDerWaalsContact CD1-CG 3.41Å; L49-N113 WeakPolarHBondContact CD1-OD1 3.49Å
50	N	67.2	Low	81.3	Confident	50 Å²	50	41.8 Å²	41.8	27%	0.267	22%	0.217	S	C	.	.	S	Bend	trans	-159.9	-164.3	178.4	66.1	24.3	0	0	0	110.2	S52 A53 A147 Y235	N50-S52 VanDerWaalsContact C-N 3.3Å; N50-S52 PolarHBondContact O-N 3.06Å; N50-S52 PolarHBondContact OD1-N 2.77Å; N50-A53 PolarHBondContact N-O 2.85Å; N50-A53 VanDerWaalsContact OD1-CB 3.32Å; N50-A53 WeakPolarHBondContact OD1-CB 3.43Å; N50-A53 PolarHBondContact OD1-N 3.04Å; N50-A147 PolarHBondContact O-N 2.87Å; N50-A147 VanDerWaalsContact O-N 3.17Å; N50-Y235 HydrophobicContact CB-CE1 4.44Å
51	C	67	Low	80.8	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.014	20%	0.201	C	C	.	.	S	Bend	trans	-72.6	-15.9	-177.6	-48.8	0	0	0	0	114.5	M119 T146 A147 S148 C152	C51-M119 HydrophobicContact CB-CB 4.49Å; C51-M119 HydrophobicContact CB-CE 4.29Å; C51-M119 HydrophobicContact CB-CG 3.91Å; C51-M119 HydrophobicContact CB-SD 4.16Å; C51-M119 VanDerWaalsContact O-CA 3.23Å; C51-M119 WeakPolarHBondContact O-CA 3.45Å; C51-M119 WeakPolarHBondContact O-CG 3.31Å; C51-T146 WeakPolarHBondContact O-CB 3.5Å; C51-A147 HydrophobicContact CB-CB 4.45Å; C51-S148 PolarHBondContact SG-O 3.01Å; C51-C152 HydrophobicContact CB-CB 3.74Å; C51-C152 WeakPolarHBondContact CB-SG 3.43Å; C51-C152 PolarHBondContact N-SG 3.4Å; C51-C152 VanDerWaalsContact N-SG 3.37Å; C51-C152 WeakPolarHBondContact SG-CB 3.47Å; C51-C152 CovalentContact SG-SG 2.03Å; C51-C152 PolarHBondContact SG-SG 3.38Å
52	S	72.8	Confident	79.6	Confident	41 Å²	41	46.4 Å²	46.4	29%	0.287	23%	0.227	S	C	.	.	S	Bend	trans	-123.3	7.3	178.6	67.6	0	0	0	0	113.9	N50 G115 N116 L117	N50-S52 VanDerWaalsContact C-N 3.3Å; N50-S52 PolarHBondContact O-N 3.06Å; N50-S52 PolarHBondContact OD1-N 2.77Å; S52-G115 CarbonylContact O-C 3.59Å; S52-G115 WeakPolarHBondContact O-CA 3.42Å; S52-N116 PolarHBondContact O-N 3.05Å; S52-N116 VanDerWaalsContact O-N 3.15Å; S52-L117 WeakPolarHBondContact CA-O 3.36Å; S52-L117 WeakPolarHBondContact CB-O 3.38Å; S52-L117 VanDerWaalsContact O-CB 3.26Å; S52-L117 WeakPolarHBondContact O-CB 3.26Å; S52-L117 PolarHBondContact O-N 2.91Å
53	A	77.4	Confident	78.3	Confident	9 Å²	9	53.9 Å²	53.9	7%	0.074	25%	0.251	C	S	.	.			trans	-147.1	149.9	-175.5	0	0	0	0	0	115.6	L49 N50 I114	L49-A53 HydrophobicContact CB-CB 4.27Å; L49-A53 HydrophobicContact CD1-CB 4.33Å; L49-A53 PolarHBondContact N-O 3.29Å; N50-A53 PolarHBondContact N-O 2.85Å; N50-A53 VanDerWaalsContact OD1-CB 3.32Å; N50-A53 WeakPolarHBondContact OD1-CB 3.43Å; N50-A53 PolarHBondContact OD1-N 3.04Å; A53-I114 WeakPolarHBondContact CA-O 3.5Å
54	F	84.4	Confident	77.2	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	154.8	163.7	60.9	-106.8	0	0	0	111.2	E47 V56 I114 L117 Y123 V125 I144	E47-F54 CarbonylContact O-C 3.54Å; E47-F54 WeakPolarHBondContact O-CA 3.34Å; E47-F54 WeakPolarHBondContact O-CB 3.41Å; F54-V56 HydrophobicContact CD2-CG2 3.84Å; F54-V56 HydrophobicContact CE2-CG2 3.59Å; F54-I114 HydrophobicContact CD2-CB 4.46Å; F54-I114 HydrophobicContact CE2-CB 4.14Å; F54-I114 HydrophobicContact CE2-CD1 3.93Å; F54-I114 HydrophobicContact CE2-CG1 4.36Å; F54-I114 HydrophobicContact CZ-CB 4.41Å; F54-I114 HydrophobicContact CZ-CD1 4.35Å; F54-I114 HydrophobicContact CZ-CG2 4.49Å; F54-I114 PolarHBondContact N-O 2.75Å; F54-I114 VanDerWaalsContact N-O 3.17Å; F54-I114 PolarHBondContact O-N 2.96Å; F54-L117 HydrophobicContact CD1-CD1 3.33Å; F54-L117 HydrophobicContact CE1-CD1 3.2Å; F54-L117 HydrophobicContact CG-CD1 4.27Å; F54-L117 HydrophobicContact CZ-CD1 4.06Å; F54-Y123 HydrophobicContact CE1-CD2 4.01Å; F54-Y123 AromaticContact CE1-CG 3.86Å; F54-Y123 HydrophobicContact CE1-CG 3.86Å; F54-V125 HydrophobicContact CE1-CG2 4.4Å; F54-V125 HydrophobicContact CE2-CG1 4.41Å; F54-V125 HydrophobicContact CE2-CG2 3.56Å; F54-V125 HydrophobicContact CZ-CG2 3.43Å; F54-V125 VanDerWaalsContact CZ-CG2 3.43Å; F54-I144 HydrophobicContact CB-CD1 3.61Å; F54-I144 HydrophobicContact CB-CG1 4.28Å; F54-I144 HydrophobicContact CD1-CG2 3.65Å; F54-I144 HydrophobicContact CD2-CD1 4.48Å; F54-I144 HydrophobicContact CD2-CG2 4.05Å; F54-I144 HydrophobicContact CE1-CG2 3.7Å; F54-I144 HydrophobicContact CE2-CG2 4.12Å; F54-I144 HydrophobicContact CG-CD1 4.04Å; F54-I144 HydrophobicContact CG-CG1 4.43Å; F54-I144 HydrophobicContact CG-CG2 3.85Å; F54-I144 HydrophobicContact CZ-CG2 3.97Å
55	S	86.1	Confident	75.6	Confident	3 Å²	3	57 Å²	57	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	153.7	171.8	80.5	0	0	0	0	111.2	E47 V112 N113	E47-S55 PolarHBondContact N-O 3.28Å; E47-S55 PolarHBondContact O-N 3.37Å; S55-V112 WeakPolarHBondContact CA-O 3.4Å; S55-N113 WeakPolarHBondContact CB-OD1 3.27Å
56	V	89.1	Confident	74	Confident	0 Å²	0	53 Å²	53	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	113.8	171.9	-172.3	0	0	0	0	107.2	L46 F54 W58 V73 D111 V112 I114 V125 V127	L46-V56 HydrophobicContact CD2-CB 4.15Å; L46-V56 HydrophobicContact CD2-CG1 3.82Å; L46-V56 HydrophobicContact CD2-CG2 3.83Å; F54-V56 HydrophobicContact CD2-CG2 3.84Å; F54-V56 HydrophobicContact CE2-CG2 3.59Å; V56-W58 HydrophobicContact CB-CZ3 4.35Å; V56-W58 HydrophobicContact CG1-CE3 4.03Å; V56-W58 HydrophobicContact CG1-CZ3 4.17Å; V56-W58 VanDerWaalsContact O-CZ3 3.31Å; V56-W58 WeakPolarHBondContact O-CZ3 3.39Å; V56-V73 HydrophobicContact CB-CG1 4.41Å; V56-V73 HydrophobicContact CG1-CG1 4.13Å; V56-V73 HydrophobicContact CG2-CG1 4.12Å; V56-D111 VanDerWaalsContact O-CA 3.25Å; V56-D111 WeakPolarHBondContact O-CA 3.4Å; V56-V112 HydrophobicContact CB-CG1 4.32Å; V56-V112 PolarHBondContact N-O 3.05Å; V56-V112 PolarHBondContact O-N 2.67Å; V56-V112 VanDerWaalsContact O-N 3.08Å; V56-I114 HydrophobicContact CG2-CD1 3.81Å; V56-I114 HydrophobicContact CG2-CG1 4.27Å; V56-V125 HydrophobicContact CG1-CG1 4.17Å; V56-V125 HydrophobicContact CG2-CG1 3.91Å; V56-V127 HydrophobicContact CG1-CG2 3.69Å
57	R	86.7	Confident	72.8	Confident	73 Å²	73	54.8 Å²	54.8	28%	0.275	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	140	176.2	-179.1	173.3	-71.6	126.1	4.9	110.3	I44 Q45 S109 F110 D111	I44-R57 CarbonylContact C-O 3.47Å; I44-R57 VanDerWaalsContact CA-O 3.24Å; I44-R57 WeakPolarHBondContact CA-O 3.22Å; Q45-R57 HydrophobicContact CB-CB 4.3Å; Q45-R57 PolarHBondContact N-O 3.35Å; Q45-R57 PolarHBondContact O-N 2.98Å; R57-S109 WeakPolarHBondContact CG-OG 3.19Å; R57-F110 CarbonylContact C-O 3.6Å; R57-F110 VanDerWaalsContact CA-O 3.28Å; R57-F110 WeakPolarHBondContact CA-O 3.49Å; R57-D111 HydrophobicContact CB-CB 3.72Å; R57-D111 HydrophobicContact CG-CB 4Å; R57-D111 IonicContact CZ-OD1 2.72Å; R57-D111 IonicContact NE-OD1 3.98Å; R57-D111 PolarHBondContact NE-OD1 2.84Å; R57-D111 IonicContact NH2-OD1 3.88Å; R57-D111 PolarHBondContact NH2-OD1 3.42Å; R57-D111 IonicContact NH2-OD2 3.33Å
58	W	89.9	Confident	71.9	Confident	1 Å²	1	49.7 Å²	49.7	0%	0.004	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	168.3	175.4	66.4	92	0	0	0	111.8	P41 L42 I44 V56 Y71 V73 V92 S109 F110 V112 V127	P41-W58 HydrophobicContact CB-CB 4.07Å; P41-W58 HydrophobicContact CB-CG 4.06Å; L42-W58 WeakPolarHBondContact O-CA 3.16Å; I44-W58 HydrophobicContact CG1-CB 3.82Å; V56-W58 HydrophobicContact CB-CZ3 4.35Å; V56-W58 HydrophobicContact CG1-CE3 4.03Å; V56-W58 HydrophobicContact CG1-CZ3 4.17Å; V56-W58 VanDerWaalsContact O-CZ3 3.31Å; V56-W58 WeakPolarHBondContact O-CZ3 3.39Å; W58-Y71 AromaticContact CD1-CE1 3.86Å; W58-Y71 AromaticContact CE2-CD2 3.79Å; W58-Y71 AromaticContact CE2-CG 3.67Å; W58-Y71 HydrophobicContact CZ2-CD1 4.5Å; W58-Y71 AromaticContact CZ2-CD2 3.68Å; W58-Y71 HydrophobicContact CZ2-CD2 3.68Å; W58-Y71 HydrophobicContact CZ2-CE2 4.49Å; W58-Y71 AromaticContact CZ2-CG 3.68Å; W58-Y71 HydrophobicContact CZ2-CG 3.68Å; W58-Y71 AromaticContact NE1-CD1 3.28Å; W58-Y71 VanDerWaalsContact NE1-CD1 3.28Å; W58-Y71 AromaticContact NE1-CD2 3.32Å; W58-Y71 VanDerWaalsContact NE1-CD2 3.32Å; W58-Y71 AromaticContact NE1-CE1 3.4Å; W58-Y71 AromaticContact NE1-CE2 3.42Å; W58-Y71 AromaticContact NE1-CG 3.24Å; W58-Y71 AromaticContact NE1-CZ 3.48Å; W58-V73 HydrophobicContact CH2-CG2 3.93Å; W58-V73 HydrophobicContact CZ3-CG2 3.88Å; W58-V92 HydrophobicContact CH2-CB 4.42Å; W58-V92 HydrophobicContact CH2-CG1 4.31Å; W58-V92 HydrophobicContact CH2-CG2 4.24Å; W58-V92 HydrophobicContact CZ2-CG1 4.37Å; W58-S109 CarbonylContact O-C 3.55Å; W58-S109 WeakPolarHBondContact O-CA 3.37Å; W58-F110 AromaticContact CD1-CD2 3.79Å; W58-F110 HydrophobicContact CD2-CB 4.17Å; W58-F110 HydrophobicContact CH2-CB 4.42Å; W58-F110 HydrophobicContact CZ2-CB 3.77Å; W58-F110 PolarHBondContact N-O 2.91Å; W58-F110 AromaticContact NE1-CD2 3.53Å; W58-F110 AromaticContact NE1-CG 3.9Å; W58-F110 PolarHBondContact O-N 2.86Å; W58-V112 HydrophobicContact CH2-CB 4.48Å; W58-V112 HydrophobicContact CH2-CG1 3.98Å; W58-V112 HydrophobicContact CZ3-CG1 3.8Å; W58-V127 HydrophobicContact CD2-CG1 3.97Å; W58-V127 HydrophobicContact CD2-CG2 4.37Å; W58-V127 HydrophobicContact CE3-CG1 4.24Å; W58-V127 HydrophobicContact CE3-CG2 4.03Å; W58-V127 HydrophobicContact CG-CG1 4.36Å; W58-V127 HydrophobicContact CZ2-CG1 4.4Å
59	K	80.4	Confident	70.9	Confident	63 Å²	63	48.5 Å²	48.5	27%	0.274	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	157.9	172.3	-66.6	-176.1	-166.5	156.8	0	112.7	L42 D43 A108	L42-K59 HydrophobicContact CB-CB 4.38Å; L42-K59 PolarHBondContact N-O 2.93Å; L42-K59 PolarHBondContact O-N 2.88Å; D43-K59 HydrophobicContact CB-CB 4.4Å; D43-K59 HydrophobicContact CB-CD 3.99Å; D43-K59 HydrophobicContact CB-CG 4.09Å; D43-K59 WeakPolarHBondContact OD2-CD 3.37Å; D43-K59 WeakPolarHBondContact OD2-CE 3.44Å; D43-K59 IonicContact OD2-NZ 3.45Å; D43-K59 PolarHBondContact OD2-NZ 3.19Å; K59-A108 VanDerWaalsContact CA-O 3.28Å; K59-A108 WeakPolarHBondContact CA-O 3.31Å; K59-A108 WeakPolarHBondContact CB-O 3.41Å
60	M	75	Confident	71	Confident	31 Å²	31	44.8 Å²	44.8	15%	0.153	21%	0.214	C	C	.	.			trans	-57	140.6	177.8	-159.6	170.9	-158.6	0	0	111.7	R62 I68 A108 F110	M60-R62 PolarHBondContact O-N 3.31Å; M60-I68 HydrophobicContact CE-CB 4.15Å; M60-I68 HydrophobicContact CE-CD1 3.97Å; M60-I68 HydrophobicContact CE-CG1 4.3Å; M60-I68 HydrophobicContact CG-CD1 4.22Å; M60-A108 PolarHBondContact N-O 2.89Å; M60-F110 HydrophobicContact CB-CE2 4.05Å
61	P	73.1	Confident	71.8	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.013	20%	0.202	C	C	.	.			trans	-65.8	114.5	174.5	-14	26.1	0	0	0	111.6	S39 R63 H64 I68 A129	S39-P61 WeakPolarHBondContact O-CB 3.43Å; S39-P61 WeakPolarHBondContact O-CG 3.44Å; P61-R63 PolarHBondContact O-N 2.81Å; P61-H64 PolarHBondContact O-ND1 3.14Å; P61-I68 HydrophobicContact CG-CD1 3.88Å; P61-A129 HydrophobicContact CG-CB 4.36Å
62	R	59.2	Low	72.7	Confident	155 Å²	155	43.8 Å²	43.8	59%	0.585	21%	0.207	S	C	*	.	S	Bend	trans	-53	-5.7	-179.7	-76	177.7	-164.9	-151.1	9.3	117.4	L42 M60	L42-R62 HydrophobicContact CD1-CB 3.99Å; L42-R62 HydrophobicContact CD1-CG 3.6Å; M60-R62 PolarHBondContact O-N 3.31Å
63	R	55.9	Low	73.5	Confident	216 Å²	216	41.8 Å²	41.8	82%	0.815	19%	0.193	S	C	*	.	S	Bend	trans	-151.6	113.1	168.3	-61.8	-172.2	-161.2	-109.1	-3.5	107.9	S39 P61	S39-R63 VanDerWaalsContact CB-O 3.28Å; S39-R63 WeakPolarHBondContact CB-O 3.41Å; S39-R63 PolarHBondContact OG-O 2.9Å; P61-R63 PolarHBondContact O-N 2.81Å
64	H	56.7	Low	74.1	Confident	70 Å²	70	43 Å²	43	32%	0.324	20%	0.197	S	C	.	.			trans	-125.6	153.1	173.3	43.5	-88.2	0	0	0	109.5	L38 P61 S66 I68	L38-H64 HydrophobicContact CD2-CB 3.69Å; P61-H64 PolarHBondContact O-ND1 3.14Å; H64-S66 PolarHBondContact CD2-O 3.36Å; H64-S66 VanDerWaalsContact CD2-O 3.32Å; H64-I68 HydrophobicContact CB-CD1 4.12Å; H64-I68 HydrophobicContact CB-CG1 4.3Å
65	V	53.2	Low	74.5	Confident	81 Å²	81	44.3 Å²	44.3	49%	0.491	20%	0.202	S	C	.	.	S	Bend	trans	-105	0	-171.7	-68.3	0	0	0	0	113.3	A133	V65-A133 HydrophobicContact CG2-CB 4.33Å
66	S	53.8	Low	74.7	Confident	25 Å²	25	44.9 Å²	44.9	18%	0.175	21%	0.205	C	C	.	.	S	Bend	trans	-153.8	163.8	169.7	71.7	0	0	0	0	108.6	H64 I68 A133	H64-S66 PolarHBondContact CD2-O 3.36Å; H64-S66 VanDerWaalsContact CD2-O 3.32Å; S66-I68 PolarHBondContact O-N 2.97Å; S66-A133 WeakPolarHBondContact OG-CB 3.5Å; S66-A133 PolarHBondContact OG-N 3.03Å
67	T	62.7	Low	74.7	Confident	76 Å²	76	45.2 Å²	45.2	47%	0.466	21%	0.207	S	C	.	.			trans	-52.2	132.7	166.7	-45.4	0	0	0	0	110.3	L99 G131 W132	T67-L99 HydrophobicContact CG2-CD2 3.8Å; T67-G131 WeakPolarHBondContact O-CA 3.25Å; T67-W132 PolarHBondContact O-N 2.83Å
68	I	65.5	Low	74.8	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	129.1	172.6	-62.7	179.4	0	0	0	106.8	L38 M60 P61 H64 S66 G70 Y71 L94 L99 A129 Y130	L38-I68 HydrophobicContact CD1-CG1 4.15Å; L38-I68 HydrophobicContact CD2-CG1 3.95Å; M60-I68 HydrophobicContact CE-CB 4.15Å; M60-I68 HydrophobicContact CE-CD1 3.97Å; M60-I68 HydrophobicContact CE-CG1 4.3Å; M60-I68 HydrophobicContact CG-CD1 4.22Å; P61-I68 HydrophobicContact CG-CD1 3.88Å; H64-I68 HydrophobicContact CB-CD1 4.12Å; H64-I68 HydrophobicContact CB-CG1 4.3Å; S66-I68 PolarHBondContact O-N 2.97Å; I68-G70 WeakPolarHBondContact CG2-O 3.46Å; I68-Y71 HydrophobicContact CG2-CE1 4.29Å; I68-Y71 HydrophobicContact CG2-CE2 4.37Å; I68-L94 HydrophobicContact CG2-CD1 4.24Å; I68-L99 VanDerWaalsContact O-CD2 3.29Å; I68-L99 WeakPolarHBondContact O-CD2 3.29Å; I68-A129 HydrophobicContact CD1-CB 4.12Å; I68-A129 HydrophobicContact CG2-CB 4.21Å; I68-Y130 CarbonylContact C-O 3.54Å; I68-Y130 WeakPolarHBondContact CA-O 3.35Å; I68-Y130 WeakPolarHBondContact CG2-O 3.49Å
69	T	60.9	Low	74.4	Confident	41 Å²	41	47.6 Å²	47.6	25%	0.252	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	-10.6	178.3	57.7	0	0	0	0	112.8	L94 Y130 G131	T69-L94 PolarHBondContact O-N 2.92Å; T69-Y130 PolarHBondContact N-O 2.73Å; T69-Y130 WeakPolarHBondContact OG1-CD2 3.43Å; T69-G131 WeakPolarHBondContact OG1-CA 3.47Å
70	G	73.8	Confident	74.3	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.4	-173.2	173.5	0	0	0	0	0	114	I68 V92 Y130	I68-G70 WeakPolarHBondContact CG2-O 3.46Å; G70-V92 CarbonylContact C-O 3.53Å; G70-V92 WeakPolarHBondContact CA-O 3.39Å; G70-Y130 PolarHBondContact N-O 3.37Å; G70-Y130 WeakPolarHBondContact O-CD1 3.35Å; G70-Y130 PolarHBondContact O-N 2.87Å
71	Y	84.8	Confident	74.2	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	151.1	176.4	-59.8	-85.6	0	0	0	111.2	P41 W58 I68 V92 L94 F110 V127 G128 A129 Y130	P41-Y71 HydrophobicContact CG-CD1 3.8Å; P41-Y71 HydrophobicContact CG-CE1 3.95Å; W58-Y71 AromaticContact CD1-CE1 3.86Å; W58-Y71 AromaticContact CE2-CD2 3.79Å; W58-Y71 AromaticContact CE2-CG 3.67Å; W58-Y71 HydrophobicContact CZ2-CD1 4.5Å; W58-Y71 AromaticContact CZ2-CD2 3.68Å; W58-Y71 HydrophobicContact CZ2-CD2 3.68Å; W58-Y71 HydrophobicContact CZ2-CE2 4.49Å; W58-Y71 AromaticContact CZ2-CG 3.68Å; W58-Y71 HydrophobicContact CZ2-CG 3.68Å; W58-Y71 AromaticContact NE1-CD1 3.28Å; W58-Y71 VanDerWaalsContact NE1-CD1 3.28Å; W58-Y71 AromaticContact NE1-CD2 3.32Å; W58-Y71 VanDerWaalsContact NE1-CD2 3.32Å; W58-Y71 AromaticContact NE1-CE1 3.4Å; W58-Y71 AromaticContact NE1-CE2 3.42Å; W58-Y71 AromaticContact NE1-CG 3.24Å; W58-Y71 AromaticContact NE1-CZ 3.48Å; I68-Y71 HydrophobicContact CG2-CE1 4.29Å; I68-Y71 HydrophobicContact CG2-CE2 4.37Å; Y71-V92 PolarHBondContact N-O 2.95Å; Y71-V92 PolarHBondContact O-N 3.2Å; Y71-L94 HydrophobicContact CE2-CD1 4.33Å; Y71-L94 HydrophobicContact CE2-CD2 4.15Å; Y71-L94 HydrophobicContact CE2-CG 4.49Å; Y71-F110 HydrophobicContact CE2-CD1 4.32Å; Y71-F110 AromaticContact CE2-CD2 3.78Å; Y71-F110 HydrophobicContact CE2-CD2 3.78Å; Y71-F110 HydrophobicContact CE2-CE1 4.28Å; Y71-F110 AromaticContact CE2-CE2 3.73Å; Y71-F110 HydrophobicContact CE2-CE2 3.73Å; Y71-F110 HydrophobicContact CE2-CG 4.09Å; Y71-F110 AromaticContact CE2-CZ 3.99Å; Y71-F110 HydrophobicContact CE2-CZ 3.99Å; Y71-F110 AromaticContact CZ-CE2 3.77Å; Y71-F110 WeakPolarHBondContact OH-CE2 3.46Å; Y71-V127 HydrophobicContact CD1-CG1 4.38Å; Y71-G128 CarbonylContact C-O 3.59Å; Y71-G128 WeakPolarHBondContact CA-O 3.36Å; Y71-G128 WeakPolarHBondContact CB-O 3.31Å; Y71-A129 HydrophobicContact CD1-CB 3.79Å; Y71-A129 HydrophobicContact CE1-CB 3.73Å; Y71-Y130 VanDerWaalsContact N-CE1 3.3Å; Y71-Y130 WeakPolarHBondContact O-CE1 3.38Å
72	K	86.2	Confident	74.5	Confident	30 Å²	30	63.4 Å²	63.4	13%	0.13	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	121.8	171.3	-52.7	-162.9	-178.1	-168.2	0	109	F74 I89 M90 E91 V127 G128 Y130 E135	K72-F74 HydrophobicContact CB-CE2 3.76Å; K72-F74 HydrophobicContact CB-CZ 3.83Å; K72-F74 WeakPolarHBondContact O-CD2 3.48Å; K72-F74 WeakPolarHBondContact O-CE2 3.37Å; K72-I89 HydrophobicContact CB-CG2 4.13Å; K72-I89 HydrophobicContact CD-CG2 4.38Å; K72-M90 CarbonylContact C-O 3.51Å; K72-M90 WeakPolarHBondContact CA-O 3.43Å; K72-E91 HydrophobicContact CD-CG 4.15Å; K72-E91 WeakPolarHBondContact CD-OE1 3.09Å; K72-E91 WeakPolarHBondContact CE-OE1 3.42Å; K72-E91 HydrophobicContact CG-CG 4.17Å; K72-E91 IonicContact NZ-OE1 3.2Å; K72-E91 PolarHBondContact NZ-OE1 2.97Å; K72-V127 CarbonylContact O-C 3.54Å; K72-V127 WeakPolarHBondContact O-CA 3.28Å; K72-G128 PolarHBondContact N-O 3.16Å; K72-G128 PolarHBondContact O-N 2.66Å; K72-Y130 HydrophobicContact CD-CD1 4.3Å; K72-Y130 HydrophobicContact CG-CD1 3.6Å; K72-Y130 HydrophobicContact CG-CE1 3.85Å; K72-E135 WeakPolarHBondContact CE-OE1 3.48Å; K72-E135 IonicContact NZ-OE1 3.2Å; K72-E135 PolarHBondContact NZ-OE1 2.81Å
73	V	88.9	Confident	75.5	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	116.5	174.1	-170.8	0	0	0	0	108.6	V56 W58 I89 M90 V92 V112 I114 V125 V127	V56-V73 HydrophobicContact CB-CG1 4.41Å; V56-V73 HydrophobicContact CG1-CG1 4.13Å; V56-V73 HydrophobicContact CG2-CG1 4.12Å; W58-V73 HydrophobicContact CH2-CG2 3.93Å; W58-V73 HydrophobicContact CZ3-CG2 3.88Å; V73-I89 WeakPolarHBondContact O-CA 3.47Å; V73-M90 HydrophobicContact CB-CE 4.42Å; V73-M90 HydrophobicContact CG2-CE 4.41Å; V73-M90 PolarHBondContact N-O 2.88Å; V73-M90 PolarHBondContact O-N 2.79Å; V73-V92 HydrophobicContact CG2-CG2 4.41Å; V73-V112 HydrophobicContact CG2-CG1 4.15Å; V73-I114 HydrophobicContact CB-CD1 4.4Å; V73-I114 HydrophobicContact CG1-CD1 3.68Å; V73-V125 HydrophobicContact CG1-CG1 3.83Å; V73-V127 HydrophobicContact CG1-CG2 4.25Å; V73-V127 HydrophobicContact CG2-CG1 4.16Å; V73-V127 HydrophobicContact CG2-CG2 4.16Å
74	F	90.4	Very high	76.5	Confident	35 Å²	35	53.4 Å²	53.4	15%	0.154	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	127.4	179.3	-56.5	-94.6	0	0	0	108.8	K72 T87 S88 I89 V125 S126 P138	K72-F74 HydrophobicContact CB-CE2 3.76Å; K72-F74 HydrophobicContact CB-CZ 3.83Å; K72-F74 WeakPolarHBondContact O-CD2 3.48Å; K72-F74 WeakPolarHBondContact O-CE2 3.37Å; F74-T87 HydrophobicContact CB-CG2 3.9Å; F74-T87 HydrophobicContact CD1-CG2 4.38Å; F74-S88 CarbonylContact C-O 3.49Å; F74-S88 WeakPolarHBondContact CA-O 3.37Å; F74-I89 HydrophobicContact CD1-CD1 4.09Å; F74-I89 HydrophobicContact CD1-CG1 3.84Å; F74-I89 HydrophobicContact CD1-CG2 4.38Å; F74-I89 HydrophobicContact CE1-CD1 3.87Å; F74-I89 HydrophobicContact CE1-CG1 4.08Å; F74-I89 HydrophobicContact CE1-CG2 4.24Å; F74-V125 CarbonylContact O-C 3.55Å; F74-V125 VanDerWaalsContact O-CA 3.27Å; F74-V125 WeakPolarHBondContact O-CA 3.27Å; F74-S126 PolarHBondContact N-O 2.79Å; F74-S126 PolarHBondContact O-N 3.06Å; F74-P138 HydrophobicContact CD2-CB 4.33Å; F74-P138 HydrophobicContact CD2-CG 4.22Å; F74-P138 HydrophobicContact CE2-CB 4.28Å; F74-P138 HydrophobicContact CE2-CG 3.78Å; F74-P138 HydrophobicContact CZ-CG 4.25Å
75	Y	92.1	Very high	77.2	Confident	27 Å²	27	52.5 Å²	52.5	11%	0.106	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	144.5	178.4	63.8	-76.6	0	0	0	113.4	S88 M90 I114 L117 R124	Y75-S88 VanDerWaalsContact CE1-CB 3.49Å; Y75-S88 PolarHBondContact N-O 2.82Å; Y75-S88 PolarHBondContact O-N 3.16Å; Y75-M90 HydrophobicContact CE1-CB 4.31Å; Y75-I114 HydrophobicContact CD1-CD1 3.76Å; Y75-I114 HydrophobicContact CD1-CG2 4.38Å; Y75-I114 HydrophobicContact CD2-CG2 4.03Å; Y75-I114 HydrophobicContact CE1-CD1 4.1Å; Y75-I114 HydrophobicContact CE1-CG2 4.06Å; Y75-I114 HydrophobicContact CE2-CG2 3.69Å; Y75-I114 HydrophobicContact CG-CD1 4.14Å; Y75-I114 HydrophobicContact CG-CG2 4.37Å; Y75-L117 HydrophobicContact CD2-CD2 4.03Å; Y75-L117 HydrophobicContact CE2-CD2 3.71Å; Y75-R124 CarbonylContact C-O 3.59Å; Y75-R124 VanDerWaalsContact CA-O 3.23Å; Y75-R124 WeakPolarHBondContact CA-O 3.34Å
76	T	90.4	Very high	78.2	Confident	14 Å²	14	54.8 Å²	54.8	9%	0.086	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	138.2	-175.7	-34.1	0	0	0	0	111.3	P83 S85 T87 Y123 R124	T76-P83 HydrophobicContact CG2-CB 3.64Å; T76-S85 VanDerWaalsContact CG2-O 3.24Å; T76-S85 WeakPolarHBondContact CG2-O 3.43Å; T76-T87 PolarHBondContact OG1-OG1 2.87Å; T76-Y123 CarbonylContact O-C 3.58Å; T76-Y123 VanDerWaalsContact O-CA 3.26Å; T76-Y123 WeakPolarHBondContact O-CA 3.32Å; T76-Y123 WeakPolarHBondContact O-CD1 3.38Å; T76-R124 PolarHBondContact N-O 3.26Å; T76-R124 PolarHBondContact O-N 2.95Å
77	E	89.9	Confident	79.5	Confident	8 Å²	8	56.7 Å²	56.7	4%	0.037	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	136.1	172.3	-178.1	-173.2	156.5	0	0	110.3	K79 P83 V84 K118 Y123	E77-K79 WeakPolarHBondContact OE1-CE 3.39Å; E77-K79 IonicContact OE1-NZ 3.42Å; E77-K79 PolarHBondContact OE1-NZ 3.48Å; E77-P83 CarbonylContact O-C 3.27Å; E77-P83 WeakPolarHBondContact O-CA 3Å; E77-V84 HydrophobicContact CB-CB 4.25Å; E77-V84 HydrophobicContact CG-CB 4.12Å; E77-V84 HydrophobicContact CG-CG2 4.13Å; E77-V84 PolarHBondContact O-N 3.46Å; E77-K118 IonicContact OE1-NZ 3.24Å; E77-K118 WeakPolarHBondContact OE2-CD 3.4Å; E77-K118 WeakPolarHBondContact OE2-CE 3.21Å; E77-K118 IonicContact OE2-NZ 3.98Å; E77-K118 PolarHBondContact OE2-NZ 3.49Å; E77-Y123 HydrophobicContact CB-CD1 4.3Å; E77-Y123 HydrophobicContact CB-CE1 3.81Å; E77-Y123 HydrophobicContact CG-CE1 4.46Å
78	M	86.9	Confident	80.6	Confident	12 Å²	12	55.4 Å²	55.4	6%	0.059	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	116	-175.2	-62.6	-64.1	-57	0	0	111.4	G81 R82 P83 K122 R124	M78-G81 VanDerWaalsContact CE-C 3.45Å; M78-G81 WeakPolarHBondContact CE-O 3.3Å; M78-R82 WeakPolarHBondContact CA-O 3.11Å; M78-P83 HydrophobicContact SD-CB 4.17Å; M78-K122 HydrophobicContact CB-CB 4.48Å; M78-K122 HydrophobicContact CB-CG 4.47Å; M78-K122 PolarHBondContact N-O 3.14Å; M78-R124 HydrophobicContact CG-CB 3.62Å; M78-R124 HydrophobicContact SD-CB 3.74Å
79	K	81.6	Confident	81.4	Confident	112 Å²	112	59.9 Å²	59.9	49%	0.487	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	135.6	168.9	-74.3	171.1	173.3	145	0	109.8	E77 G81 R82 V84	E77-K79 WeakPolarHBondContact OE1-CE 3.39Å; E77-K79 IonicContact OE1-NZ 3.42Å; E77-K79 PolarHBondContact OE1-NZ 3.48Å; K79-G81 PolarHBondContact O-N 2.87Å; K79-R82 PolarHBondContact N-O 3.1Å; K79-R82 PolarHBondContact O-N 2.85Å; K79-R82 VanDerWaalsContact O-O 3.1Å; K79-V84 HydrophobicContact CB-CG2 3.54Å; K79-V84 HydrophobicContact CD-CG1 4.44Å; K79-V84 HydrophobicContact CD-CG2 3.91Å; K79-V84 HydrophobicContact CG-CG2 3.72Å; K79-V84 VanDerWaalsContact N-CG2 3.33Å
80	N	79.1	Confident	82	Confident	172 Å²	172	59.4 Å²	59.4	92%	0.92	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	37.4	179.7	-58.3	-5.9	0	0	0	113.6	R82	N80-R82 VanDerWaalsContact C-N 3.31Å; N80-R82 PolarHBondContact O-N 2.82Å
81	G	73.5	Confident	82.2	Confident	58 Å²	58	64.6 Å²	64.6	60%	0.598	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	-0.5	179.7	0	0	0	0	0	116.2	M78 K79	M78-G81 VanDerWaalsContact CE-C 3.45Å; M78-G81 WeakPolarHBondContact CE-O 3.3Å; K79-G81 PolarHBondContact O-N 2.87Å
82	R	78.3	Confident	81.9	Confident	197 Å²	197	65.2 Å²	65.2	74%	0.743	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	148.4	177.5	-63.5	-174.6	-179.4	-170.6	0.5	111.7	M78 K79 N80	M78-R82 WeakPolarHBondContact CA-O 3.11Å; K79-R82 PolarHBondContact N-O 3.1Å; K79-R82 PolarHBondContact O-N 2.85Å; K79-R82 VanDerWaalsContact O-O 3.1Å; N80-R82 VanDerWaalsContact C-N 3.31Å; N80-R82 PolarHBondContact O-N 2.82Å
83	P	81.5	Confident	81.1	Confident	86 Å²	86	67.6 Å²	67.6	56%	0.558	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66	140.6	169.8	29.4	-34.2	0	0	0	110.4	T76 E77 M78	T76-P83 HydrophobicContact CG2-CB 3.64Å; E77-P83 CarbonylContact O-C 3.27Å; E77-P83 WeakPolarHBondContact O-CA 3Å; M78-P83 HydrophobicContact SD-CB 4.17Å
84	V	75.9	Confident	79.8	Confident	75 Å²	75	68.7 Å²	68.7	46%	0.455	38%	0.379	S	S	.	.			trans	-104.4	-33.6	-176.4	-172.4	0	0	0	0	111.4	E77 K79	E77-V84 HydrophobicContact CB-CB 4.25Å; E77-V84 HydrophobicContact CG-CB 4.12Å; E77-V84 HydrophobicContact CG-CG2 4.13Å; E77-V84 PolarHBondContact O-N 3.46Å; K79-V84 HydrophobicContact CB-CG2 3.54Å; K79-V84 HydrophobicContact CD-CG1 4.44Å; K79-V84 HydrophobicContact CD-CG2 3.91Å; K79-V84 HydrophobicContact CG-CG2 3.72Å; K79-V84 VanDerWaalsContact N-CG2 3.33Å
85	S	71.1	Confident	77.9	Confident	51 Å²	51	68.9 Å²	68.9	36%	0.357	39%	0.385	S	S	.	.	S	Bend	trans	-110.8	168.1	179.8	67.1	0	0	0	0	111.1	T76	T76-S85 VanDerWaalsContact CG2-O 3.24Å; T76-S85 WeakPolarHBondContact CG2-O 3.43Å
86	T	74.8	Confident	75.4	Confident	129 Å²	129	71.4 Å²	71.4	79%	0.791	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-52.5	146.7	153.1	-44.9	0	0	0	0	109.5	S88	T86-S88 PolarHBondContact O-N 3.28Å
87	T	81.4	Confident	73	Confident	66 Å²	66	76.3 Å²	76.3	41%	0.405	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-69.1	118.1	173.1	-60.4	0	0	0	0	110.1	F74 T76	F74-T87 HydrophobicContact CB-CG2 3.9Å; F74-T87 HydrophobicContact CD1-CG2 4.38Å; T76-T87 PolarHBondContact OG1-OG1 2.87Å
88	S	84.4	Confident	70.9	Confident	49 Å²	49	78.5 Å²	78.5	34%	0.343	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	144.7	170.3	-61.1	0	0	0	0	110.2	F74 Y75 T86	F74-S88 CarbonylContact C-O 3.49Å; F74-S88 WeakPolarHBondContact CA-O 3.37Å; Y75-S88 VanDerWaalsContact CE1-CB 3.49Å; Y75-S88 PolarHBondContact N-O 2.82Å; Y75-S88 PolarHBondContact O-N 3.16Å; T86-S88 PolarHBondContact O-N 3.28Å
89	I	82.9	Confident	69.1	Low	96 Å²	96	81 Å²	81	49%	0.492	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	137.1	178.1	-50.9	179.7	0	0	0	107.6	K72 V73 F74	K72-I89 HydrophobicContact CB-CG2 4.13Å; K72-I89 HydrophobicContact CD-CG2 4.38Å; V73-I89 WeakPolarHBondContact O-CA 3.47Å; F74-I89 HydrophobicContact CD1-CD1 4.09Å; F74-I89 HydrophobicContact CD1-CG1 3.84Å; F74-I89 HydrophobicContact CD1-CG2 4.38Å; F74-I89 HydrophobicContact CE1-CD1 3.87Å; F74-I89 HydrophobicContact CE1-CG1 4.08Å; F74-I89 HydrophobicContact CE1-CG2 4.24Å
90	M	73.8	Confident	67	Low	31 Å²	31	80.6 Å²	80.6	15%	0.153	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	125.4	171.1	-176.4	176.1	69.2	0	0	108.8	K72 V73 Y75 V92 V112 I114	K72-M90 CarbonylContact C-O 3.51Å; K72-M90 WeakPolarHBondContact CA-O 3.43Å; V73-M90 HydrophobicContact CB-CE 4.42Å; V73-M90 HydrophobicContact CG2-CE 4.41Å; V73-M90 PolarHBondContact N-O 2.88Å; V73-M90 PolarHBondContact O-N 2.79Å; Y75-M90 HydrophobicContact CE1-CB 4.31Å; M90-V92 HydrophobicContact CE-CG2 4.38Å; M90-V112 HydrophobicContact CE-CB 4.06Å; M90-V112 HydrophobicContact CE-CG1 3.39Å; M90-V112 HydrophobicContact CE-CG2 3.44Å; M90-V112 VanDerWaalsContact CE-CG2 3.44Å; M90-V112 HydrophobicContact SD-CG2 4.3Å; M90-I114 HydrophobicContact CE-CD1 3.98Å; M90-I114 HydrophobicContact CE-CG1 3.57Å; M90-I114 HydrophobicContact SD-CG1 4.36Å
91	E	77.4	Confident	65.2	Low	108 Å²	108	75.5 Å²	75.5	51%	0.505	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	140.3	179.7	-52.6	-161.1	162	0	0	110.4	K72	K72-E91 HydrophobicContact CD-CG 4.15Å; K72-E91 WeakPolarHBondContact CD-OE1 3.09Å; K72-E91 WeakPolarHBondContact CE-OE1 3.42Å; K72-E91 HydrophobicContact CG-CG 4.17Å; K72-E91 IonicContact NZ-OE1 3.2Å; K72-E91 PolarHBondContact NZ-OE1 2.97Å
92	V	78.6	Confident	63.8	Low	14 Å²	14	76.7 Å²	76.7	9%	0.085	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	84.9	-175	-174.9	0	0	0	0	107.3	W58 G70 Y71 V73 M90 V112	W58-V92 HydrophobicContact CH2-CB 4.42Å; W58-V92 HydrophobicContact CH2-CG1 4.31Å; W58-V92 HydrophobicContact CH2-CG2 4.24Å; W58-V92 HydrophobicContact CZ2-CG1 4.37Å; G70-V92 CarbonylContact C-O 3.53Å; G70-V92 WeakPolarHBondContact CA-O 3.39Å; Y71-V92 PolarHBondContact N-O 2.95Å; Y71-V92 PolarHBondContact O-N 3.2Å; V73-V92 HydrophobicContact CG2-CG2 4.41Å; M90-V92 HydrophobicContact CE-CG2 4.38Å; V92-V112 HydrophobicContact CG2-CG1 4.46Å; V92-V112 HydrophobicContact CG2-CG2 4.39Å
93	P	70.6	Confident	62.1	Low	79 Å²	79	75.9 Å²	75.9	51%	0.513	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	159.7	177.3	29.5	-35	0	0	0	111.6
94	L	61.7	Low	60.4	Low	23 Å²	23	76.2 Å²	76.2	12%	0.12	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-97	144	173.6	-64.2	179	0	0	0	111.2	I68 T69 Y71 M98 L99 F110	I68-L94 HydrophobicContact CG2-CD1 4.24Å; T69-L94 PolarHBondContact O-N 2.92Å; Y71-L94 HydrophobicContact CE2-CD1 4.33Å; Y71-L94 HydrophobicContact CE2-CD2 4.15Å; Y71-L94 HydrophobicContact CE2-CG 4.49Å; L94-M98 HydrophobicContact CB-CB 4.37Å; L94-M98 HydrophobicContact CD2-SD 4.04Å; L94-L99 HydrophobicContact CB-CD2 4.44Å; L94-F110 HydrophobicContact CD2-CD1 3.94Å; L94-F110 HydrophobicContact CD2-CE1 3.48Å; L94-F110 VanDerWaalsContact CD2-CE1 3.48Å; L94-F110 HydrophobicContact CD2-CZ 4.22Å
95	S	49.8	Very low	59.1	Low	39 Å²	39	78.4 Å²	78.4	27%	0.273	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-77.2	163.8	174.1	63.1	0	0	0	0	112.1	D97 M98 L99	S95-D97 VanDerWaalsContact C-N 3.33Å; S95-D97 PolarHBondContact O-N 2.85Å; S95-M98 WeakPolarHBondContact O-CB 3.33Å; S95-M98 PolarHBondContact O-N 3.24Å; S95-L99 PolarHBondContact O-N 2.81Å
96	L	39	Very low	58.2	Low	81 Å²	81	76.4 Å²	76.4	42%	0.424	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-37.8	-176.1	-165.3	58.9	0	0	0	112.7	M98 L99 T100 E769	L96-M98 PolarHBondContact O-N 2.86Å; L96-L99 HydrophobicContact CD1-CD1 4.41Å; L96-L99 WeakPolarHBondContact O-CA 3.5Å; L96-L99 WeakPolarHBondContact O-CB 3.14Å; L96-L99 PolarHBondContact O-N 2.91Å; L96-T100 PolarHBondContact O-N 3.39Å; L96-T100 PolarHBondContact O-OG1 2.85Å; L96-E769 VanDerWaalsContact CD2-OE1 3.31Å; L96-E769 WeakPolarHBondContact CD2-OE1 3.48Å; L96-E769 WeakPolarHBondContact CD2-OE2 3.24Å
97	D	40.4	Very low	57.1	Low	117 Å²	117	77.6 Å²	77.6	63%	0.626	44%	0.435	S	S	*	.	H	α-helix	trans	-57.1	-32.9	173.2	-51.5	-57.6	0	0	0	113.3	S95 L99 T100 T101	S95-D97 VanDerWaalsContact C-N 3.33Å; S95-D97 PolarHBondContact O-N 2.85Å; D97-L99 VanDerWaalsContact C-N 3.32Å; D97-T100 PolarHBondContact O-OG1 3.35Å; D97-T101 WeakPolarHBondContact O-CG2 3.37Å; D97-T101 PolarHBondContact O-N 2.94Å; D97-T101 PolarHBondContact O-OG1 3.23Å
98	M	46.8	Very low	55.8	Low	53 Å²	53	75.6 Å²	75.6	26%	0.261	43%	0.425	S	S	.	.	H	α-helix	trans	-83	-8.7	177.7	-67.7	-164.1	162.6	0	0	113.2	L94 S95 L96 F110 Y318	L94-M98 HydrophobicContact CB-CB 4.37Å; L94-M98 HydrophobicContact CD2-SD 4.04Å; S95-M98 WeakPolarHBondContact O-CB 3.33Å; S95-M98 PolarHBondContact O-N 3.24Å; L96-M98 PolarHBondContact O-N 2.86Å; M98-F110 HydrophobicContact SD-CD1 4.49Å; M98-F110 HydrophobicContact SD-CE1 3.93Å; M98-Y318 HydrophobicContact CE-CD1 3.44Å; M98-Y318 VanDerWaalsContact CE-CD1 3.44Å; M98-Y318 HydrophobicContact CE-CE1 3.85Å; M98-Y318 HydrophobicContact CE-CG 4.28Å; M98-Y318 HydrophobicContact SD-CD1 4.24Å; M98-Y318 HydrophobicContact SD-CE1 4.02Å
99	L	48.8	Very low	54.9	Low	65 Å²	65	76 Å²	76	34%	0.34	43%	0.428	S	S	.	.	H	α-helix	trans	-98.1	-29.6	175.5	-63.7	171.6	0	0	0	111.9	T67 I68 L94 S95 L96 D97	T67-L99 HydrophobicContact CG2-CD2 3.8Å; I68-L99 VanDerWaalsContact O-CD2 3.29Å; I68-L99 WeakPolarHBondContact O-CD2 3.29Å; L94-L99 HydrophobicContact CB-CD2 4.44Å; S95-L99 PolarHBondContact O-N 2.81Å; L96-L99 HydrophobicContact CD1-CD1 4.41Å; L96-L99 WeakPolarHBondContact O-CA 3.5Å; L96-L99 WeakPolarHBondContact O-CB 3.14Å; L96-L99 PolarHBondContact O-N 2.91Å; D97-L99 VanDerWaalsContact C-N 3.32Å
100	T	37.9	Very low	54.5	Low	103 Å²	103	72.4 Å²	72.4	63%	0.632	41%	0.409	S	S	*	.	H	α-helix	trans	-84.3	-27.8	178.7	56	0	0	0	0	113.5	L96 D97 G102	L96-T100 PolarHBondContact O-N 3.39Å; L96-T100 PolarHBondContact O-OG1 2.85Å; D97-T100 PolarHBondContact O-OG1 3.35Å; T100-G102 VanDerWaalsContact C-N 3.28Å; T100-G102 PolarHBondContact O-N 2.8Å
101	T	40.4	Very low	54.7	Low	66 Å²	66	73 Å²	73	41%	0.405	41%	0.413	S	S	.	.			trans	-79.9	65.8	178.9	48.8	0	0	0	0	113.2	D97 Q103	D97-T101 WeakPolarHBondContact O-CG2 3.37Å; D97-T101 PolarHBondContact O-N 2.94Å; D97-T101 PolarHBondContact O-OG1 3.23Å; T101-Q103 PolarHBondContact O-N 2.9Å
102	G	45.1	Very low	54.7	Low	83 Å²	83	68.2 Å²	68.2	86%	0.856	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	43.1	-172.9	0	0	0	0	0	117.8	T100	T100-G102 VanDerWaalsContact C-N 3.28Å; T100-G102 PolarHBondContact O-N 2.8Å
103	Q	41.8	Very low	54.9	Low	179 Å²	179	69.4 Å²	69.4	84%	0.836	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141	20.8	-173	-144.2	173.5	15.2	0	0	116.5	T101	T101-Q103 PolarHBondContact O-N 2.9Å
104	F	45.3	Very low	55.2	Low	93 Å²	93	65.7 Å²	65.7	41%	0.408	37%	0.372	S	S	.	.			trans	-109.4	70.6	178.3	-70.6	-67.5	0	0	0	114.5	G106 Q107 A108	F104-G106 VanDerWaalsContact C-N 3.31Å; F104-G106 PolarHBondContact O-N 2.96Å; F104-Q107 HydrophobicContact CD1-CB 4.41Å; F104-A108 HydrophobicContact CB-CB 3.94Å; F104-A108 HydrophobicContact CG-CB 4.49Å
105	D	49.3	Very low	55.9	Low	122 Å²	122	65.1 Å²	65.1	65%	0.652	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	78.3	-177.5	-155.2	6.6	0	0	0	112.9
106	G	51.6	Low	57	Low	8 Å²	8	70 Å²	70	8%	0.082	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	13.4	179.4	0	0	0	0	0	116.2	F104	F104-G106 VanDerWaalsContact C-N 3.31Å; F104-G106 PolarHBondContact O-N 2.96Å
107	Q	51.3	Low	59	Low	154 Å²	154	66.9 Å²	66.9	72%	0.72	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-31.3	172.6	-74	-173.6	-14.6	0	0	113.4	F104 S109	F104-Q107 HydrophobicContact CD1-CB 4.41Å; Q107-S109 PolarHBondContact O-N 2.8Å
108	A	55.7	Low	60.7	Low	24 Å²	24	66.6 Å²	66.6	20%	0.198	37%	0.372	C	S	.	.			trans	-60.6	129.3	176.8	0	0	0	0	0	111.2	K59 M60 F104 F110	K59-A108 VanDerWaalsContact CA-O 3.28Å; K59-A108 WeakPolarHBondContact CA-O 3.31Å; K59-A108 WeakPolarHBondContact CB-O 3.41Å; M60-A108 PolarHBondContact N-O 2.89Å; F104-A108 HydrophobicContact CB-CB 3.94Å; F104-A108 HydrophobicContact CG-CB 4.49Å; A108-F110 HydrophobicContact CB-CE2 4.24Å; A108-F110 HydrophobicContact CB-CZ 4.03Å
109	S	65.6	Low	62	Low	57 Å²	57	68.1 Å²	68.1	40%	0.399	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	133.8	177.6	-171.4	0	0	0	0	109.2	R57 W58 Q107	R57-S109 WeakPolarHBondContact CG-OG 3.19Å; W58-S109 CarbonylContact O-C 3.55Å; W58-S109 WeakPolarHBondContact O-CA 3.37Å; Q107-S109 PolarHBondContact O-N 2.8Å
110	F	73.9	Confident	63.4	Low	21 Å²	21	70.8 Å²	70.8	9%	0.092	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	141.3	177.9	-48.6	-86.4	0	0	0	107.9	R57 W58 M60 Y71 L94 M98 A108	R57-F110 CarbonylContact C-O 3.6Å; R57-F110 VanDerWaalsContact CA-O 3.28Å; R57-F110 WeakPolarHBondContact CA-O 3.49Å; W58-F110 AromaticContact CD1-CD2 3.79Å; W58-F110 HydrophobicContact CD2-CB 4.17Å; W58-F110 HydrophobicContact CH2-CB 4.42Å; W58-F110 HydrophobicContact CZ2-CB 3.77Å; W58-F110 PolarHBondContact N-O 2.91Å; W58-F110 AromaticContact NE1-CD2 3.53Å; W58-F110 AromaticContact NE1-CG 3.9Å; W58-F110 PolarHBondContact O-N 2.86Å; M60-F110 HydrophobicContact CB-CE2 4.05Å; Y71-F110 HydrophobicContact CE2-CD1 4.32Å; Y71-F110 AromaticContact CE2-CD2 3.78Å; Y71-F110 HydrophobicContact CE2-CD2 3.78Å; Y71-F110 HydrophobicContact CE2-CE1 4.28Å; Y71-F110 AromaticContact CE2-CE2 3.73Å; Y71-F110 HydrophobicContact CE2-CE2 3.73Å; Y71-F110 HydrophobicContact CE2-CG 4.09Å; Y71-F110 AromaticContact CE2-CZ 3.99Å; Y71-F110 HydrophobicContact CE2-CZ 3.99Å; Y71-F110 AromaticContact CZ-CE2 3.77Å; Y71-F110 WeakPolarHBondContact OH-CE2 3.46Å; L94-F110 HydrophobicContact CD2-CD1 3.94Å; L94-F110 HydrophobicContact CD2-CE1 3.48Å; L94-F110 VanDerWaalsContact CD2-CE1 3.48Å; L94-F110 HydrophobicContact CD2-CZ 4.22Å; M98-F110 HydrophobicContact SD-CD1 4.49Å; M98-F110 HydrophobicContact SD-CE1 3.93Å; A108-F110 HydrophobicContact CB-CE2 4.24Å; A108-F110 HydrophobicContact CB-CZ 4.03Å
111	D	78.4	Confident	65.6	Low	45 Å²	45	66.7 Å²	66.7	24%	0.241	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	157.1	167.4	54.7	-110	0	0	0	113.2	V56 R57	V56-D111 VanDerWaalsContact O-CA 3.25Å; V56-D111 WeakPolarHBondContact O-CA 3.4Å; R57-D111 HydrophobicContact CB-CB 3.72Å; R57-D111 HydrophobicContact CG-CB 4Å; R57-D111 IonicContact CZ-OD1 2.72Å; R57-D111 IonicContact NE-OD1 3.98Å; R57-D111 PolarHBondContact NE-OD1 2.84Å; R57-D111 IonicContact NH2-OD1 3.88Å; R57-D111 PolarHBondContact NH2-OD1 3.42Å; R57-D111 IonicContact NH2-OD2 3.33Å
112	V	76.6	Confident	67.9	Low	6 Å²	6	68.1 Å²	68.1	4%	0.036	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	147.3	-177.5	71.5	0	0	0	0	110.4	S55 V56 W58 V73 M90 V92 V316	S55-V112 WeakPolarHBondContact CA-O 3.4Å; V56-V112 HydrophobicContact CB-CG1 4.32Å; V56-V112 PolarHBondContact N-O 3.05Å; V56-V112 PolarHBondContact O-N 2.67Å; V56-V112 VanDerWaalsContact O-N 3.08Å; W58-V112 HydrophobicContact CH2-CB 4.48Å; W58-V112 HydrophobicContact CH2-CG1 3.98Å; W58-V112 HydrophobicContact CZ3-CG1 3.8Å; V73-V112 HydrophobicContact CG2-CG1 4.15Å; M90-V112 HydrophobicContact CE-CB 4.06Å; M90-V112 HydrophobicContact CE-CG1 3.39Å; M90-V112 HydrophobicContact CE-CG2 3.44Å; M90-V112 VanDerWaalsContact CE-CG2 3.44Å; M90-V112 HydrophobicContact SD-CG2 4.3Å; V92-V112 HydrophobicContact CG2-CG1 4.46Å; V92-V112 HydrophobicContact CG2-CG2 4.39Å; V112-V316 HydrophobicContact CG2-CG2 4.18Å
113	N	82.1	Confident	70	Confident	40 Å²	40	64.8 Å²	64.8	21%	0.214	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	114.6	-177.1	-66	-11.4	0	0	0	110.9	L49 S55 G115	L49-N113 HydrophobicContact CD1-CB 3.78Å; L49-N113 VanDerWaalsContact CD1-CG 3.41Å; L49-N113 WeakPolarHBondContact CD1-OD1 3.49Å; S55-N113 WeakPolarHBondContact CB-OD1 3.27Å; N113-G115 PolarHBondContact O-N 2.82Å
114	I	78.4	Confident	72.5	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	96.8	177.7	-58.6	-174.8	0	0	0	108.6	A53 F54 V56 V73 Y75 M90 L117	A53-I114 WeakPolarHBondContact CA-O 3.5Å; F54-I114 HydrophobicContact CD2-CB 4.46Å; F54-I114 HydrophobicContact CE2-CB 4.14Å; F54-I114 HydrophobicContact CE2-CD1 3.93Å; F54-I114 HydrophobicContact CE2-CG1 4.36Å; F54-I114 HydrophobicContact CZ-CB 4.41Å; F54-I114 HydrophobicContact CZ-CD1 4.35Å; F54-I114 HydrophobicContact CZ-CG2 4.49Å; F54-I114 PolarHBondContact N-O 2.75Å; F54-I114 VanDerWaalsContact N-O 3.17Å; F54-I114 PolarHBondContact O-N 2.96Å; V56-I114 HydrophobicContact CG2-CD1 3.81Å; V56-I114 HydrophobicContact CG2-CG1 4.27Å; V73-I114 HydrophobicContact CB-CD1 4.4Å; V73-I114 HydrophobicContact CG1-CD1 3.68Å; Y75-I114 HydrophobicContact CD1-CD1 3.76Å; Y75-I114 HydrophobicContact CD1-CG2 4.38Å; Y75-I114 HydrophobicContact CD2-CG2 4.03Å; Y75-I114 HydrophobicContact CE1-CD1 4.1Å; Y75-I114 HydrophobicContact CE1-CG2 4.06Å; Y75-I114 HydrophobicContact CE2-CG2 3.69Å; Y75-I114 HydrophobicContact CG-CD1 4.14Å; Y75-I114 HydrophobicContact CG-CG2 4.37Å; M90-I114 HydrophobicContact CE-CD1 3.98Å; M90-I114 HydrophobicContact CE-CG1 3.57Å; M90-I114 HydrophobicContact SD-CG1 4.36Å; I114-L117 HydrophobicContact CG2-CD1 4.12Å; I114-L117 HydrophobicContact CG2-CD2 3.95Å; I114-L117 HydrophobicContact CG2-CG 4.23Å; I114-L117 WeakPolarHBondContact O-CD1 3.19Å
115	G	76.2	Confident	74.7	Confident	12 Å²	12	56.1 Å²	56.1	12%	0.124	29%	0.289	C	S	.	.			trans	-95.8	-179.7	172.6	0	0	0	0	0	114.3	S52 N113 R314	S52-G115 CarbonylContact O-C 3.59Å; S52-G115 WeakPolarHBondContact O-CA 3.42Å; N113-G115 PolarHBondContact O-N 2.82Å; G115-R314 PolarHBondContact O-NH2 3.25Å
116	N	72.2	Confident	76.8	Confident	140 Å²	140	51.2 Å²	51.2	75%	0.749	27%	0.265	S	S	*	.	S	Bend	trans	65.6	34.5	-175.9	-56.7	7.8	0	0	0	113.6	S52	S52-N116 PolarHBondContact O-N 3.05Å; S52-N116 VanDerWaalsContact O-N 3.15Å
117	L	80.4	Confident	78.7	Confident	17 Å²	17	50.8 Å²	50.8	9%	0.089	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-92.8	160.3	175	-55.4	175.1	0	0	0	111.3	S52 F54 Y75 I114 Y123 T146	S52-L117 WeakPolarHBondContact CA-O 3.36Å; S52-L117 WeakPolarHBondContact CB-O 3.38Å; S52-L117 VanDerWaalsContact O-CB 3.26Å; S52-L117 WeakPolarHBondContact O-CB 3.26Å; S52-L117 PolarHBondContact O-N 2.91Å; F54-L117 HydrophobicContact CD1-CD1 3.33Å; F54-L117 HydrophobicContact CE1-CD1 3.2Å; F54-L117 HydrophobicContact CG-CD1 4.27Å; F54-L117 HydrophobicContact CZ-CD1 4.06Å; Y75-L117 HydrophobicContact CD2-CD2 4.03Å; Y75-L117 HydrophobicContact CE2-CD2 3.71Å; I114-L117 HydrophobicContact CG2-CD1 4.12Å; I114-L117 HydrophobicContact CG2-CD2 3.95Å; I114-L117 HydrophobicContact CG2-CG 4.23Å; I114-L117 WeakPolarHBondContact O-CD1 3.19Å; L117-Y123 HydrophobicContact CB-CE2 3.87Å; L117-Y123 HydrophobicContact CD1-CD2 4.34Å; L117-Y123 HydrophobicContact CD1-CE2 4.25Å; L117-Y123 HydrophobicContact CD2-CD1 4.4Å; L117-Y123 HydrophobicContact CD2-CE1 3.9Å; L117-Y123 HydrophobicContact CD2-CE2 4.36Å; L117-Y123 HydrophobicContact CG-CE2 4.41Å; L117-T146 HydrophobicContact CB-CG2 3.86Å; L117-T146 HydrophobicContact CD1-CG2 3.98Å
118	K	76.2	Confident	80.5	Confident	110 Å²	110	43.7 Å²	43.7	48%	0.478	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-69.7	143.8	174.8	-66.6	173.9	-176	167.1	0	110.2	E77 S121 Y123 T146	E77-K118 IonicContact OE1-NZ 3.24Å; E77-K118 WeakPolarHBondContact OE2-CD 3.4Å; E77-K118 WeakPolarHBondContact OE2-CE 3.21Å; E77-K118 IonicContact OE2-NZ 3.98Å; E77-K118 PolarHBondContact OE2-NZ 3.49Å; K118-S121 WeakPolarHBondContact CB-OG 3.22Å; K118-S121 WeakPolarHBondContact O-CB 3.39Å; K118-Y123 PolarHBondContact N-OH 3.5Å; K118-T146 PolarHBondContact O-OG1 3.47Å
119	M	75.1	Confident	81.7	Confident	85 Å²	85	42.6 Å²	42.6	42%	0.419	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	152.8	175	-59.4	-175.4	178	0	0	112.1	C51 S121	C51-M119 HydrophobicContact CB-CB 4.49Å; C51-M119 HydrophobicContact CB-CE 4.29Å; C51-M119 HydrophobicContact CB-CG 3.91Å; C51-M119 HydrophobicContact CB-SD 4.16Å; C51-M119 VanDerWaalsContact O-CA 3.23Å; C51-M119 WeakPolarHBondContact O-CA 3.45Å; C51-M119 WeakPolarHBondContact O-CG 3.31Å; M119-S121 PolarHBondContact O-N 2.66Å; M119-S121 PolarHBondContact O-OG 3.11Å
120	N	78.2	Confident	82.4	Confident	122 Å²	122	41.8 Å²	41.8	65%	0.652	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	44.4	38.8	179.2	-165.7	18.4	0	0	0	113.8	T146 A147	N120-T146 PolarHBondContact N-OG1 2.82Å; N120-A147 PolarHBondContact N-O 2.91Å; N120-A147 VanDerWaalsContact N-O 3.09Å
121	S	83.3	Confident	82.2	Confident	17 Å²	17	41.4 Å²	41.4	12%	0.119	21%	0.21	C	C	.	.			trans	-122.4	134.9	-169.8	-68.8	0	0	0	0	110.9	K118 M119 Y123 S145 T146	K118-S121 WeakPolarHBondContact CB-OG 3.22Å; K118-S121 WeakPolarHBondContact O-CB 3.39Å; M119-S121 PolarHBondContact O-N 2.66Å; M119-S121 PolarHBondContact O-OG 3.11Å; S121-Y123 VanDerWaalsContact O-CD2 3.31Å; S121-Y123 WeakPolarHBondContact O-CD2 3.46Å; S121-S145 WeakPolarHBondContact O-CA 3.12Å; S121-T146 PolarHBondContact N-OG1 3.06Å; S121-T146 PolarHBondContact O-N 2.93Å; S121-T146 PolarHBondContact O-OG1 2.85Å
122	K	88.4	Confident	81.1	Confident	95 Å²	95	49.5 Å²	49.5	41%	0.413	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	135.9	179.9	-168.7	175	176.2	-171.6	0	110.4	M78 D143 I144	M78-K122 HydrophobicContact CB-CB 4.48Å; M78-K122 HydrophobicContact CB-CG 4.47Å; M78-K122 PolarHBondContact N-O 3.14Å; K122-D143 WeakPolarHBondContact CE-OD2 3.21Å; K122-D143 IonicContact NZ-OD2 2.81Å; K122-D143 PolarHBondContact NZ-OD2 3.47Å; K122-I144 CarbonylContact C-O 3.55Å; K122-I144 WeakPolarHBondContact CA-O 3.26Å; K122-I144 WeakPolarHBondContact CG-O 3.36Å
123	Y	90.7	Very high	79.9	Confident	13 Å²	13	51.2 Å²	51.2	5%	0.051	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	152.1	178.7	-71.2	-88.7	0	0	0	111.1	F54 T76 E77 L117 K118 S121 D143 I144 T146	F54-Y123 HydrophobicContact CE1-CD2 4.01Å; F54-Y123 AromaticContact CE1-CG 3.86Å; F54-Y123 HydrophobicContact CE1-CG 3.86Å; T76-Y123 CarbonylContact O-C 3.58Å; T76-Y123 VanDerWaalsContact O-CA 3.26Å; T76-Y123 WeakPolarHBondContact O-CA 3.32Å; T76-Y123 WeakPolarHBondContact O-CD1 3.38Å; E77-Y123 HydrophobicContact CB-CD1 4.3Å; E77-Y123 HydrophobicContact CB-CE1 3.81Å; E77-Y123 HydrophobicContact CG-CE1 4.46Å; L117-Y123 HydrophobicContact CB-CE2 3.87Å; L117-Y123 HydrophobicContact CD1-CD2 4.34Å; L117-Y123 HydrophobicContact CD1-CE2 4.25Å; L117-Y123 HydrophobicContact CD2-CD1 4.4Å; L117-Y123 HydrophobicContact CD2-CE1 3.9Å; L117-Y123 HydrophobicContact CD2-CE2 4.36Å; L117-Y123 HydrophobicContact CG-CE2 4.41Å; K118-Y123 PolarHBondContact N-OH 3.5Å; S121-Y123 VanDerWaalsContact O-CD2 3.31Å; S121-Y123 WeakPolarHBondContact O-CD2 3.46Å; Y123-D143 CarbonylContact O-C 3.55Å; Y123-D143 VanDerWaalsContact O-CA 3.28Å; Y123-D143 WeakPolarHBondContact O-CA 3.4Å; Y123-I144 PolarHBondContact N-O 3.11Å; Y123-I144 PolarHBondContact O-N 3.2Å; Y123-T146 HydrophobicContact CE2-CG2 4.25Å
124	R	93.2	Very high	78.9	Confident	86 Å²	86	51 Å²	51	33%	0.325	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.6	170.4	175.2	160.7	-68.9	156	9.8	109.4	Y75 T76 M78 P141 R142 D143	Y75-R124 CarbonylContact C-O 3.59Å; Y75-R124 VanDerWaalsContact CA-O 3.23Å; Y75-R124 WeakPolarHBondContact CA-O 3.34Å; T76-R124 PolarHBondContact N-O 3.26Å; T76-R124 PolarHBondContact O-N 2.95Å; M78-R124 HydrophobicContact CG-CB 3.62Å; M78-R124 HydrophobicContact SD-CB 3.74Å; R124-P141 HydrophobicContact CG-CB 3.82Å; R124-R142 CarbonylContact C-O 3.53Å; R124-R142 WeakPolarHBondContact CA-O 3.3Å; R124-D143 IonicContact CZ-OD1 3.59Å; R124-D143 VanDerWaalsContact CZ-OD1 3.24Å; R124-D143 IonicContact CZ-OD2 3.54Å; R124-D143 IonicContact NE-OD1 2.89Å; R124-D143 PolarHBondContact NE-OD1 2.91Å; R124-D143 VanDerWaalsContact NH2-CG 3.34Å; R124-D143 IonicContact NH2-OD1 2.81Å; R124-D143 PolarHBondContact NH2-OD1 2.82Å; R124-D143 IonicContact NH2-OD2 3.96Å; R124-D143 PolarHBondContact NH2-OD2 3.14Å
125	V	92.5	Very high	78.5	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.024	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	139.2	-168.9	-169.2	0	0	0	0	110.9	L46 F54 V56 V73 F74 P141 R142 I144	L46-V125 HydrophobicContact CD1-CB 4.01Å; L46-V125 HydrophobicContact CD1-CG2 4.06Å; L46-V125 HydrophobicContact CD2-CB 4.03Å; L46-V125 HydrophobicContact CD2-CG1 3.94Å; L46-V125 HydrophobicContact CD2-CG2 4.29Å; F54-V125 HydrophobicContact CE1-CG2 4.4Å; F54-V125 HydrophobicContact CE2-CG1 4.41Å; F54-V125 HydrophobicContact CE2-CG2 3.56Å; F54-V125 HydrophobicContact CZ-CG2 3.43Å; F54-V125 VanDerWaalsContact CZ-CG2 3.43Å; V56-V125 HydrophobicContact CG1-CG1 4.17Å; V56-V125 HydrophobicContact CG2-CG1 3.91Å; V73-V125 HydrophobicContact CG1-CG1 3.83Å; F74-V125 CarbonylContact O-C 3.55Å; F74-V125 VanDerWaalsContact O-CA 3.27Å; F74-V125 WeakPolarHBondContact O-CA 3.27Å; V125-P141 CarbonylContact O-C 3.5Å; V125-P141 VanDerWaalsContact O-CA 3.25Å; V125-P141 WeakPolarHBondContact O-CA 3.3Å; V125-R142 PolarHBondContact N-O 2.87Å; V125-R142 PolarHBondContact O-N 3.01Å; V125-I144 HydrophobicContact CG2-CG2 3.95Å
126	S	92.1	Very high	78.4	Confident	19 Å²	19	55.6 Å²	55.6	13%	0.133	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	157.7	166.6	62.8	0	0	0	0	110.8	F74 S139	F74-S126 PolarHBondContact N-O 2.79Å; F74-S126 PolarHBondContact O-N 3.06Å; S126-S139 WeakPolarHBondContact CA-OG 3.47Å; S126-S139 WeakPolarHBondContact CB-OG 3.49Å
127	V	92.4	Very high	78.8	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	133.7	178.6	-167.3	0	0	0	0	109.7	P41 I44 V56 W58 Y71 K72 V73 P138 S139	P41-V127 HydrophobicContact CB-CB 4.42Å; P41-V127 HydrophobicContact CB-CG1 4.48Å; P41-V127 VanDerWaalsContact CD-O 3.29Å; P41-V127 WeakPolarHBondContact CD-O 3.32Å; P41-V127 HydrophobicContact CG-CB 4.12Å; P41-V127 HydrophobicContact CG-CG1 3.94Å; I44-V127 HydrophobicContact CD1-CB 4.03Å; I44-V127 HydrophobicContact CD1-CG2 4.02Å; V56-V127 HydrophobicContact CG1-CG2 3.69Å; W58-V127 HydrophobicContact CD2-CG1 3.97Å; W58-V127 HydrophobicContact CD2-CG2 4.37Å; W58-V127 HydrophobicContact CE3-CG1 4.24Å; W58-V127 HydrophobicContact CE3-CG2 4.03Å; W58-V127 HydrophobicContact CG-CG1 4.36Å; W58-V127 HydrophobicContact CZ2-CG1 4.4Å; Y71-V127 HydrophobicContact CD1-CG1 4.38Å; K72-V127 CarbonylContact O-C 3.54Å; K72-V127 WeakPolarHBondContact O-CA 3.28Å; V73-V127 HydrophobicContact CG1-CG2 4.25Å; V73-V127 HydrophobicContact CG2-CG1 4.16Å; V73-V127 HydrophobicContact CG2-CG2 4.16Å; V127-P138 CarbonylContact O-C 3.55Å; V127-P138 WeakPolarHBondContact O-CA 3.36Å; V127-S139 PolarHBondContact N-OG 2.9Å; V127-S139 VanDerWaalsContact N-OG 3.08Å; V127-S139 PolarHBondContact O-N 3.13Å
128	G	88.3	Confident	79.1	Confident	4 Å²	4	57.8 Å²	57.8	4%	0.041	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	151.5	168.3	0	0	0	0	0	111.2	Y71 K72	Y71-G128 CarbonylContact C-O 3.59Å; Y71-G128 WeakPolarHBondContact CA-O 3.36Å; Y71-G128 WeakPolarHBondContact CB-O 3.31Å; K72-G128 PolarHBondContact N-O 3.16Å; K72-G128 PolarHBondContact O-N 2.66Å
129	A	81.7	Confident	79.7	Confident	2 Å²	2	53.3 Å²	53.3	2%	0.017	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	145.5	169.2	0	0	0	0	0	110	L38 P41 P61 I68 Y71 G136	L38-A129 HydrophobicContact CB-CB 4.43Å; L38-A129 HydrophobicContact CD1-CB 4.23Å; P41-A129 HydrophobicContact CG-CB 4.43Å; P61-A129 HydrophobicContact CG-CB 4.36Å; I68-A129 HydrophobicContact CD1-CB 4.12Å; I68-A129 HydrophobicContact CG2-CB 4.21Å; Y71-A129 HydrophobicContact CD1-CB 3.79Å; Y71-A129 HydrophobicContact CE1-CB 3.73Å; A129-G136 WeakPolarHBondContact O-CA 3.41Å; A129-G136 PolarHBondContact O-N 2.85Å
130	Y	80.5	Confident	80.2	Confident	40 Å²	40	56.9 Å²	56.9	16%	0.157	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	157.1	169.1	70	-89.3	0	0	0	111.1	L38 I68 T69 G70 Y71 K72	L38-Y130 VanDerWaalsContact CD1-C 3.46Å; I68-Y130 CarbonylContact C-O 3.54Å; I68-Y130 WeakPolarHBondContact CA-O 3.35Å; I68-Y130 WeakPolarHBondContact CG2-O 3.49Å; T69-Y130 PolarHBondContact N-O 2.73Å; T69-Y130 WeakPolarHBondContact OG1-CD2 3.43Å; G70-Y130 PolarHBondContact N-O 3.37Å; G70-Y130 WeakPolarHBondContact O-CD1 3.35Å; G70-Y130 PolarHBondContact O-N 2.87Å; Y71-Y130 VanDerWaalsContact N-CE1 3.3Å; Y71-Y130 WeakPolarHBondContact O-CE1 3.38Å; K72-Y130 HydrophobicContact CD-CD1 4.3Å; K72-Y130 HydrophobicContact CG-CD1 3.6Å; K72-Y130 HydrophobicContact CG-CE1 3.85Å
131	G	69.9	Low	80.7	Confident	13 Å²	13	54.3 Å²	54.3	13%	0.134	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.6	-164.9	-172.4	0	0	0	0	0	111.3	T67 T69 A133 G134	T67-G131 WeakPolarHBondContact O-CA 3.25Å; T69-G131 WeakPolarHBondContact OG1-CA 3.47Å; G131-A133 VanDerWaalsContact C-N 3.27Å; G131-A133 PolarHBondContact O-N 2.9Å; G131-G134 PolarHBondContact N-O 2.93Å; G131-G134 WeakPolarHBondContact O-CA 3.43Å; G131-G134 PolarHBondContact O-N 2.86Å
132	W	54.5	Low	81	Confident	215 Å²	215	59.9 Å²	59.9	81%	0.814	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-26.7	-173.2	-65.4	77.6	0	0	0	113.8	T67 G134	T67-W132 PolarHBondContact O-N 2.83Å; W132-G134 PolarHBondContact O-N 2.81Å
133	A	52.6	Low	81	Confident	42 Å²	42	58 Å²	58	35%	0.347	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	19.9	169	0	0	0	0	0	114.1	V65 S66 G131	V65-A133 HydrophobicContact CG2-CB 4.33Å; S66-A133 WeakPolarHBondContact OG-CB 3.5Å; S66-A133 PolarHBondContact OG-N 3.03Å; G131-A133 VanDerWaalsContact C-N 3.27Å; G131-A133 PolarHBondContact O-N 2.9Å
134	G	59.1	Low	81	Confident	35 Å²	35	58.2 Å²	58.2	36%	0.361	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	75.3	-161.7	179.9	0	0	0	0	0	114.4	L38 G131 W132 G136	L38-G134 WeakPolarHBondContact CD1-O 3.39Å; G131-G134 PolarHBondContact N-O 2.93Å; G131-G134 WeakPolarHBondContact O-CA 3.43Å; G131-G134 PolarHBondContact O-N 2.86Å; W132-G134 PolarHBondContact O-N 2.81Å; G134-G136 PolarHBondContact O-N 3.2Å
135	E	70.3	Confident	80.6	Confident	102 Å²	102	56.6 Å²	56.6	48%	0.477	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	122.4	-175.9	-63.4	-169.5	171.6	0	0	112.9	K72	K72-E135 WeakPolarHBondContact CE-OE1 3.48Å; K72-E135 IonicContact NZ-OE1 3.2Å; K72-E135 PolarHBondContact NZ-OE1 2.81Å
136	G	75.2	Confident	80	Confident	6 Å²	6	56.7 Å²	56.7	6%	0.062	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-65.5	166.8	167.5	0	0	0	0	0	112.5	L38 A129 G134	L38-G136 VanDerWaalsContact O-CA 3.22Å; L38-G136 WeakPolarHBondContact O-CA 3.38Å; A129-G136 WeakPolarHBondContact O-CA 3.41Å; A129-G136 PolarHBondContact O-N 2.85Å; G134-G136 PolarHBondContact O-N 3.2Å
137	R	80.3	Confident	78.9	Confident	144 Å²	144	56.7 Å²	56.7	54%	0.543	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-71	133.5	172.8	-69.1	-176.4	177.7	-138	-5.3	109.4	L38 P40	L38-R137 PolarHBondContact O-N 2.92Å; P40-R137 WeakPolarHBondContact CA-O 3.35Å; P40-R137 WeakPolarHBondContact CB-O 3.17Å; P40-R137 HydrophobicContact CG-CB 4.23Å; P40-R137 WeakPolarHBondContact CG-O 3.27Å
138	P	85.8	Confident	77.6	Confident	59 Å²	59	58.9 Å²	58.9	38%	0.383	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-56.1	154.9	166.7	-25.2	35	0	0	0	111.7	F74 V127	F74-P138 HydrophobicContact CD2-CB 4.33Å; F74-P138 HydrophobicContact CD2-CG 4.22Å; F74-P138 HydrophobicContact CE2-CB 4.28Å; F74-P138 HydrophobicContact CE2-CG 3.78Å; F74-P138 HydrophobicContact CZ-CG 4.25Å; V127-P138 CarbonylContact O-C 3.55Å; V127-P138 WeakPolarHBondContact O-CA 3.36Å
139	S	90.4	Very high	75.9	Confident	16 Å²	16	65.1 Å²	65.1	11%	0.112	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-60.8	170.2	175.3	70.2	0	0	0	0	113	I44 S126 V127	I44-S139 WeakPolarHBondContact CD1-OG 3.46Å; S126-S139 WeakPolarHBondContact CA-OG 3.47Å; S126-S139 WeakPolarHBondContact CB-OG 3.49Å; V127-S139 PolarHBondContact N-OG 2.9Å; V127-S139 VanDerWaalsContact N-OG 3.08Å; V127-S139 PolarHBondContact O-N 3.13Å
140	M	85	Confident	74.8	Confident	160 Å²	160	72.9 Å²	72.9	79%	0.788	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-55.2	131.1	157.9	-69.2	-60.8	-65.8	0	0	108.8
141	P	87.6	Confident	73.5	Confident	69 Å²	69	76.8 Å²	76.8	45%	0.448	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-71.7	145.1	178.1	28.7	-33.8	0	0	0	110.9	R124 V125	R124-P141 HydrophobicContact CG-CB 3.82Å; V125-P141 CarbonylContact O-C 3.5Å; V125-P141 VanDerWaalsContact O-CA 3.25Å; V125-P141 WeakPolarHBondContact O-CA 3.3Å
142	R	89.8	Confident	73.1	Confident	133 Å²	133	76.5 Å²	76.5	50%	0.502	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	151.2	175.6	-70.3	175	177.3	-102	9.7	109.2	I44 L46 R124 V125	I44-R142 PolarHBondContact O-NE 3.28Å; I44-R142 PolarHBondContact O-NH2 2.99Å; L46-R142 HydrophobicContact CD1-CB 3.55Å; L46-R142 HydrophobicContact CG-CB 4.33Å; R124-R142 CarbonylContact C-O 3.53Å; R124-R142 WeakPolarHBondContact CA-O 3.3Å; V125-R142 PolarHBondContact N-O 2.87Å; V125-R142 PolarHBondContact O-N 3.01Å
143	D	90.1	Very high	73.7	Confident	57 Å²	57	70.9 Å²	70.9	31%	0.305	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	147.1	176.9	-69	3.2	0	0	0	110.7	K122 Y123 R124	K122-D143 WeakPolarHBondContact CE-OD2 3.21Å; K122-D143 IonicContact NZ-OD2 2.81Å; K122-D143 PolarHBondContact NZ-OD2 3.47Å; Y123-D143 CarbonylContact O-C 3.55Å; Y123-D143 VanDerWaalsContact O-CA 3.28Å; Y123-D143 WeakPolarHBondContact O-CA 3.4Å; R124-D143 IonicContact CZ-OD1 3.59Å; R124-D143 VanDerWaalsContact CZ-OD1 3.24Å; R124-D143 IonicContact CZ-OD2 3.54Å; R124-D143 IonicContact NE-OD1 2.89Å; R124-D143 PolarHBondContact NE-OD1 2.91Å; R124-D143 VanDerWaalsContact NH2-CG 3.34Å; R124-D143 IonicContact NH2-OD1 2.81Å; R124-D143 PolarHBondContact NH2-OD1 2.82Å; R124-D143 IonicContact NH2-OD2 3.96Å; R124-D143 PolarHBondContact NH2-OD2 3.14Å
144	I	90.6	Very high	74.8	Confident	16 Å²	16	71.4 Å²	71.4	8%	0.082	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	160.6	173.7	-177.3	156.8	0	0	0	109.8	L46 F54 K122 Y123 V125	L46-I144 HydrophobicContact CB-CB 4.15Å; L46-I144 HydrophobicContact CB-CD1 3.59Å; L46-I144 HydrophobicContact CB-CG1 4.44Å; L46-I144 HydrophobicContact CD1-CB 3.9Å; L46-I144 HydrophobicContact CD1-CG2 3.9Å; F54-I144 HydrophobicContact CB-CD1 3.61Å; F54-I144 HydrophobicContact CB-CG1 4.28Å; F54-I144 HydrophobicContact CD1-CG2 3.65Å; F54-I144 HydrophobicContact CD2-CD1 4.48Å; F54-I144 HydrophobicContact CD2-CG2 4.05Å; F54-I144 HydrophobicContact CE1-CG2 3.7Å; F54-I144 HydrophobicContact CE2-CG2 4.12Å; F54-I144 HydrophobicContact CG-CD1 4.04Å; F54-I144 HydrophobicContact CG-CG1 4.43Å; F54-I144 HydrophobicContact CG-CG2 3.85Å; F54-I144 HydrophobicContact CZ-CG2 3.97Å; K122-I144 CarbonylContact C-O 3.55Å; K122-I144 WeakPolarHBondContact CA-O 3.26Å; K122-I144 WeakPolarHBondContact CG-O 3.36Å; Y123-I144 PolarHBondContact N-O 3.11Å; Y123-I144 PolarHBondContact O-N 3.2Å; V125-I144 HydrophobicContact CG2-CG2 3.95Å
145	S	84.7	Confident	76	Confident	53 Å²	53	69.9 Å²	69.9	37%	0.371	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	147	170.1	-61.2	0	0	0	0	111.2	T48 S121	T48-S145 VanDerWaalsContact CG2-O 3.26Å; T48-S145 WeakPolarHBondContact CG2-O 3.35Å; T48-S145 PolarHBondContact OG1-O 2.76Å; S121-S145 WeakPolarHBondContact O-CA 3.12Å
146	T	78.6	Confident	76.8	Confident	5 Å²	5	66.4 Å²	66.4	3%	0.031	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-69.1	159	162.6	47.2	0	0	0	0	111.1	C51 L117 K118 N120 S121 Y123	C51-T146 WeakPolarHBondContact O-CB 3.5Å; L117-T146 HydrophobicContact CB-CG2 3.86Å; L117-T146 HydrophobicContact CD1-CG2 3.98Å; K118-T146 PolarHBondContact O-OG1 3.47Å; N120-T146 PolarHBondContact N-OG1 2.82Å; S121-T146 PolarHBondContact N-OG1 3.06Å; S121-T146 PolarHBondContact O-N 2.93Å; S121-T146 PolarHBondContact O-OG1 2.85Å; Y123-T146 HydrophobicContact CE2-CG2 4.25Å
147	A	70.6	Confident	77.3	Confident	20 Å²	20	68.6 Å²	68.6	17%	0.165	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-66.7	163.3	-177	0	0	0	0	0	113.6	T48 N50 C51 N120	T48-A147 HydrophobicContact CG2-CB 4.2Å; N50-A147 PolarHBondContact O-N 2.87Å; N50-A147 VanDerWaalsContact O-N 3.17Å; C51-A147 HydrophobicContact CB-CB 4.45Å; N120-A147 PolarHBondContact N-O 2.91Å; N120-A147 VanDerWaalsContact N-O 3.09Å
148	S	63.3	Low	77.9	Confident	46 Å²	46	62 Å²	62	32%	0.322	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-73.6	156.7	177.5	52.3	0	0	0	0	112.2	C51 E150 M151	C51-S148 PolarHBondContact SG-O 3.01Å; S148-E150 PolarHBondContact O-N 2.76Å; S148-M151 PolarHBondContact O-N 2.81Å
149	H	54.3	Low	78.1	Confident	135 Å²	135	61.9 Å²	61.9	63%	0.625	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-60.3	-31.9	-173.8	-170.9	45.1	0	0	0	113.7	M151 C152	H149-M151 PolarHBondContact O-N 2.89Å; H149-M151 VanDerWaalsContact O-N 3.09Å; H149-C152 PolarHBondContact O-N 3.04Å
150	E	56.8	Low	78.1	Confident	164 Å²	164	65.4 Å²	65.4	77%	0.766	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-65	-10.5	-178.4	-62.6	168.2	154.8	0	0	114.3	S148	S148-E150 PolarHBondContact O-N 2.76Å
151	M	54.1	Low	78.5	Confident	123 Å²	123	57.9 Å²	57.9	61%	0.606	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-102.5	-2.4	-179.1	-66.7	-173.7	70.9	0	0	115	S148 H149	S148-M151 PolarHBondContact O-N 2.81Å; H149-M151 PolarHBondContact O-N 2.89Å; H149-M151 VanDerWaalsContact O-N 3.09Å
152	C	61.6	Low	78.5	Confident	6 Å²	6	59.4 Å²	59.4	4%	0.041	31%	0.311	C	S	.	.			trans	-141.5	70.1	-176.9	-51.9	0	0	0	0	112.5	C51 H149 Y235	C51-C152 HydrophobicContact CB-CB 3.74Å; C51-C152 WeakPolarHBondContact CB-SG 3.43Å; C51-C152 PolarHBondContact N-SG 3.4Å; C51-C152 VanDerWaalsContact N-SG 3.37Å; C51-C152 WeakPolarHBondContact SG-CB 3.47Å; C51-C152 CovalentContact SG-SG 2.03Å; C51-C152 PolarHBondContact SG-SG 3.38Å; H149-C152 PolarHBondContact O-N 3.04Å; C152-Y235 HydrophobicContact CB-CD1 3.63Å; C152-Y235 HydrophobicContact CB-CD2 4.49Å; C152-Y235 HydrophobicContact CB-CE1 4.11Å; C152-Y235 HydrophobicContact CB-CG 3.84Å
153	M	67.2	Low	78.4	Confident	97 Å²	97	54.8 Å²	54.8	48%	0.478	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-88.6	132.7	172.5	-64.3	-175.6	-71.7	0	0	111.2	S183 N233	M153-S183 PolarHBondContact N-OG 3.15Å; M153-S183 PolarHBondContact O-N 2.84Å; M153-N233 PolarHBondContact O-ND2 3.16Å
154	P	74.8	Confident	77.8	Confident	53 Å²	53	58.1 Å²	58.1	34%	0.344	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-71.3	172.2	166.4	34.7	-36.5	0	0	0	110.5	G182	P154-G182 WeakPolarHBondContact O-CA 3.44Å
155	P	84.6	Confident	77	Confident	4 Å²	4	60.1 Å²	60.1	3%	0.026	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-67.4	156.1	178.8	-17.9	33.6	0	0	0	112.4	V186 A231 N233 G236 S238	P155-V186 HydrophobicContact CB-CG2 4.2Å; P155-V186 HydrophobicContact CG-CG2 4.08Å; P155-A231 HydrophobicContact CB-CB 3.79Å; P155-A231 HydrophobicContact CG-CB 4.07Å; P155-N233 HydrophobicContact CG-CB 3.82Å; P155-G236 WeakPolarHBondContact CD-O 3.45Å; P155-S238 WeakPolarHBondContact O-CA 3.49Å; P155-S238 WeakPolarHBondContact O-CB 3.4Å
156	S	86.8	Confident	76.9	Confident	29 Å²	29	60 Å²	60	20%	0.203	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-67.3	161.4	160.8	59.8	0	0	0	0	111.2	G178 E179 S180 S238	S156-G178 VanDerWaalsContact OG-CA 3.31Å; S156-G178 WeakPolarHBondContact OG-CA 3.49Å; S156-E179 PolarHBondContact OG-N 2.9Å; S156-E179 VanDerWaalsContact OG-N 3.15Å; S156-S180 WeakPolarHBondContact CB-O 3.19Å; S156-S180 PolarHBondContact N-O 2.81Å; S156-S180 PolarHBondContact OG-N 2.91Å; S156-S180 PolarHBondContact OG-O 2.81Å; S156-S238 WeakPolarHBondContact O-CB 3.24Å
157	P	87.4	Confident	77	Confident	51 Å²	51	61.5 Å²	61.5	33%	0.331	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-60.2	141.6	179.2	-23.8	35.2	0	0	0	112.8	G178 P239	P157-G178 WeakPolarHBondContact O-CA 3.42Å; P157-P239 WeakPolarHBondContact CB-O 3.41Å; P157-P239 HydrophobicContact CG-CB 3.91Å; P157-P239 HydrophobicContact CG-CG 4.01Å
158	P	91.9	Very high	77.2	Confident	6 Å²	6	62.9 Å²	62.9	4%	0.039	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-55.8	162.7	164	-23.7	34.2	0	0	0	112.5	Q176 F189 V229 A231 S241	P158-Q176 WeakPolarHBondContact CA-O 3.46Å; P158-Q176 WeakPolarHBondContact CB-O 3.34Å; P158-F189 HydrophobicContact CG-CD1 3.98Å; P158-F189 HydrophobicContact CG-CE1 4.16Å; P158-V229 HydrophobicContact CB-CB 4.22Å; P158-V229 HydrophobicContact CB-CG1 4.26Å; P158-V229 HydrophobicContact CG-CB 4.21Å; P158-V229 HydrophobicContact CG-CG1 3.99Å; P158-A231 HydrophobicContact CG-CB 3.94Å; P158-S241 VanDerWaalsContact O-CB 3.22Å; P158-S241 WeakPolarHBondContact O-CB 3.46Å
159	T	90.4	Very high	77.9	Confident	57 Å²	57	63.2 Å²	63.2	35%	0.35	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-64.9	161.8	169.8	64.7	0	0	0	0	111.5	Q176 S241	T159-Q176 HydrophobicContact CG2-CB 3.92Å; T159-Q176 PolarHBondContact N-O 3.01Å; T159-Q176 PolarHBondContact OG1-N 2.82Å; T159-Q176 PolarHBondContact OG1-O 3.1Å; T159-S241 WeakPolarHBondContact O-CB 3.4Å
160	Q	91.4	Very high	79.1	Confident	89 Å²	89	60.1 Å²	60.1	42%	0.416	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-56.5	127.2	174.9	-173.2	-179.4	31.2	0	0	109.8	H242 I243 N244	Q160-H242 HydrophobicContact CB-CB 4.23Å; Q160-H242 HydrophobicContact CG-CB 4.27Å; Q160-I243 PolarHBondContact NE2-O 3.02Å; Q160-N244 HydrophobicContact CG-CB 4.42Å
161	P	92.1	Very high	80.5	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.019	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-68	138	-176.9	25.2	-31.3	0	0	0	111.4	S174 F227 V229 H242 N244	P161-S174 CarbonylContact C-O 3.49Å; P161-S174 WeakPolarHBondContact CA-O 3.44Å; P161-F227 HydrophobicContact CG-CB 4.02Å; P161-F227 WeakPolarHBondContact CG-O 3.08Å; P161-V229 HydrophobicContact CB-CG2 3.86Å; P161-V229 HydrophobicContact CG-CG2 3.97Å; P161-H242 WeakPolarHBondContact CD-O 3.35Å; P161-N244 HydrophobicContact CG-CB 4.22Å; P161-N244 WeakPolarHBondContact O-CB 3.37Å
162	I	87.4	Confident	81.6	Confident	101 Å²	101	47.5 Å²	47.5	52%	0.518	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.9	-178.2	-55.3	177.5	0	0	0	108.1	M164 S174	I162-M164 HydrophobicContact CG2-SD 4.07Å; I162-S174 PolarHBondContact N-O 2.82Å; I162-S174 PolarHBondContact O-N 2.97Å
163	V	87.7	Confident	82.9	Confident	36 Å²	36	47.4 Å²	47.4	22%	0.218	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	126.3	173	-174.5	0	0	0	0	109.3	V166 L171 A172 L173 V247	V163-V166 HydrophobicContact CG1-CG2 3.53Å; V163-L171 HydrophobicContact CG1-CD1 4.05Å; V163-L171 HydrophobicContact CG1-CD2 3.77Å; V163-L171 HydrophobicContact CG1-CG 3.73Å; V163-L171 HydrophobicContact CG2-CD2 4.1Å; V163-A172 CarbonylContact C-O 3.45Å; V163-A172 WeakPolarHBondContact CA-O 3.33Å; V163-L173 HydrophobicContact CG2-CD2 3.87Å; V163-V247 HydrophobicContact CB-CG2 4.28Å; V163-V247 HydrophobicContact CG1-CG1 4.34Å; V163-V247 HydrophobicContact CG2-CB 4.27Å; V163-V247 HydrophobicContact CG2-CG2 3.72Å
164	M	77.3	Confident	83.9	Confident	127 Å²	127	44.2 Å²	44.2	63%	0.626	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	-31.4	-173.7	-62.7	-58.4	-63.5	0	0	113	I162 A172 S174	I162-M164 HydrophobicContact CG2-SD 4.07Å; M164-A172 HydrophobicContact CB-CB 4.24Å; M164-A172 PolarHBondContact N-O 2.98Å; M164-S174 WeakPolarHBondContact CG-OG 3.39Å; M164-S174 PolarHBondContact SD-OG 3.15Å; M164-S174 VanDerWaalsContact SD-OG 3.33Å
165	A	73.8	Confident	84.8	Confident	58 Å²	58	42.2 Å²	42.2	48%	0.479	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	154.5	177	0	0	0	0	0	110	A172	A165-A172 HydrophobicContact CB-CB 4.09Å; A165-A172 PolarHBondContact O-N 3.13Å
166	V	83.6	Confident	85	Confident	49 Å²	49	48.7 Å²	48.7	30%	0.297	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	135.8	-178.2	-174.6	0	0	0	0	108.5	V163 L171 V247	V163-V166 HydrophobicContact CG1-CG2 3.53Å; V166-L171 HydrophobicContact CG2-CD1 4.17Å; V166-L171 HydrophobicContact CG2-CG 4.26Å; V166-V247 HydrophobicContact CG2-CG1 3.65Å
167	S	79.9	Confident	85	Confident	38 Å²	38	51.5 Å²	51.5	27%	0.266	29%	0.285	S	S	.	.			trans	-118.9	-159.7	165.1	72.8	0	0	0	0	110.3	T169 E170 L250	S167-T169 PolarHBondContact OG-N 3.29Å; S167-E170 PolarHBondContact N-O 2.82Å; S167-E170 WeakPolarHBondContact OG-CB 3.37Å; S167-E170 PolarHBondContact OG-N 2.99Å; S167-E170 PolarHBondContact OG-O 2.88Å; S167-L250 PolarHBondContact O-N 2.82Å
168	D	75.9	Confident	84.9	Confident	49 Å²	49	50 Å²	50	26%	0.262	28%	0.279	S	S	.	.	S	Bend	trans	-73	-29	170.2	56.2	-2	0	0	0	113.2	P221 L250	D168-P221 HydrophobicContact CB-CB 4.45Å; D168-P221 HydrophobicContact CB-CG 4.36Å; D168-P221 WeakPolarHBondContact O-CA 3.37Å; D168-L250 WeakPolarHBondContact CA-O 3.44Å; D168-L250 VanDerWaalsContact CB-O 3.26Å; D168-L250 WeakPolarHBondContact CB-O 3.18Å
169	T	77.8	Confident	84.3	Confident	53 Å²	53	59.7 Å²	59.7	33%	0.325	32%	0.324	S	S	.	.	S	Bend	trans	-134.4	-6.5	-167.6	48.5	0	0	0	0	114.4	S167 K217 G218 L219	S167-T169 PolarHBondContact OG-N 3.29Å; T169-K217 CarbonylContact O-C 3.01Å; T169-G218 PolarHBondContact O-N 2.79Å; T169-L219 PolarHBondContact O-N 2.03Å
170	E	78	Confident	83.6	Confident	70 Å²	70	60 Å²	60	33%	0.327	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	149	-179.8	-50.2	-167.5	175.3	0	0	112.3	S167 L216 K217	S167-E170 PolarHBondContact N-O 2.82Å; S167-E170 WeakPolarHBondContact OG-CB 3.37Å; S167-E170 PolarHBondContact OG-N 2.99Å; S167-E170 PolarHBondContact OG-O 2.88Å; E170-L216 CarbonylContact C-O 3.55Å; E170-L216 VanDerWaalsContact CA-O 3.27Å; E170-L216 WeakPolarHBondContact CA-O 3.26Å; E170-K217 HydrophobicContact CB-CG 4.4Å; E170-K217 VanDerWaalsContact CD-NZ 3.28Å; E170-K217 HydrophobicContact CG-CB 4.21Å; E170-K217 HydrophobicContact CG-CD 4.24Å; E170-K217 HydrophobicContact CG-CG 3.85Å; E170-K217 VanDerWaalsContact OE1-CD 3.28Å; E170-K217 WeakPolarHBondContact OE1-CD 3.22Å; E170-K217 WeakPolarHBondContact OE1-CE 3.28Å; E170-K217 IonicContact OE1-NZ 2.99Å; E170-K217 PolarHBondContact OE1-NZ 2.78Å; E170-K217 WeakPolarHBondContact OE2-CE 3.49Å; E170-K217 IonicContact OE2-NZ 3.41Å; E170-K217 PolarHBondContact OE2-NZ 2.92Å
171	L	86.5	Confident	82.8	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	133.6	177.1	-172.3	152.1	0	0	0	111.2	V163 V166 L173 L216 L219 F227 V247	V163-L171 HydrophobicContact CG1-CD1 4.05Å; V163-L171 HydrophobicContact CG1-CD2 3.77Å; V163-L171 HydrophobicContact CG1-CG 3.73Å; V163-L171 HydrophobicContact CG2-CD2 4.1Å; V166-L171 HydrophobicContact CG2-CD1 4.17Å; V166-L171 HydrophobicContact CG2-CG 4.26Å; L171-L173 HydrophobicContact CD2-CD1 4.5Å; L171-L173 HydrophobicContact CD2-CD2 3.55Å; L171-L173 HydrophobicContact CD2-CG 3.67Å; L171-L216 PolarHBondContact N-O 3.28Å; L171-L216 PolarHBondContact O-N 3.15Å; L171-L219 HydrophobicContact CB-CD1 3.48Å; L171-L219 VanDerWaalsContact CB-CD1 3.48Å; L171-L219 HydrophobicContact CD1-CD1 4.43Å; L171-F227 HydrophobicContact CD1-CE2 3.92Å; L171-F227 HydrophobicContact CD1-CZ 4.13Å; L171-F227 HydrophobicContact CD2-CE2 3.84Å; L171-F227 HydrophobicContact CD2-CZ 3.93Å; L171-V247 HydrophobicContact CD1-CG1 4.1Å
172	A	78.1	Confident	82	Confident	21 Å²	21	60.6 Å²	60.6	17%	0.174	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	130.2	179.4	0	0	0	0	0	111.8	V163 M164 A165 M214 V215	V163-A172 CarbonylContact C-O 3.45Å; V163-A172 WeakPolarHBondContact CA-O 3.33Å; M164-A172 HydrophobicContact CB-CB 4.24Å; M164-A172 PolarHBondContact N-O 2.98Å; A165-A172 HydrophobicContact CB-CB 4.09Å; A165-A172 PolarHBondContact O-N 3.13Å; A172-M214 WeakPolarHBondContact CA-O 3.29Å; A172-V215 HydrophobicContact CB-CG2 4.13Å
173	L	88.1	Confident	81.2	Confident	3 Å²	3	58 Å²	58	2%	0.016	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	149.3	-179.1	-67.4	173.1	0	0	0	111.7	V163 L171 W175 V191 S213 M214 F227	V163-L173 HydrophobicContact CG2-CD2 3.87Å; L171-L173 HydrophobicContact CD2-CD1 4.5Å; L171-L173 HydrophobicContact CD2-CD2 3.55Å; L171-L173 HydrophobicContact CD2-CG 3.67Å; L173-W175 HydrophobicContact CB-CE3 4.36Å; L173-W175 HydrophobicContact CB-CZ3 3.95Å; L173-V191 HydrophobicContact CD1-CG1 4.13Å; L173-S213 CarbonylContact O-C 3.57Å; L173-S213 WeakPolarHBondContact O-CA 3.39Å; L173-S213 WeakPolarHBondContact O-CB 3.19Å; L173-M214 HydrophobicContact CB-CG 4.13Å; L173-M214 HydrophobicContact CD1-CG 4.29Å; L173-M214 HydrophobicContact CD1-SD 4.39Å; L173-M214 PolarHBondContact N-O 3.15Å; L173-M214 PolarHBondContact O-N 3.26Å; L173-F227 HydrophobicContact CD1-CB 4.36Å; L173-F227 HydrophobicContact CD1-CD1 3.7Å; L173-F227 HydrophobicContact CD1-CD2 4.41Å; L173-F227 HydrophobicContact CD1-CE1 4.06Å; L173-F227 HydrophobicContact CD1-CG 3.9Å; L173-F227 HydrophobicContact CD2-CD2 3.88Å; L173-F227 HydrophobicContact CD2-CE2 4.25Å; L173-F227 HydrophobicContact CD2-CG 4.09Å
174	S	87.9	Confident	80.4	Confident	30 Å²	30	57.2 Å²	57.2	21%	0.21	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	154.9	164.8	67.5	0	0	0	0	111.8	P161 I162 M164 S212	P161-S174 CarbonylContact C-O 3.49Å; P161-S174 WeakPolarHBondContact CA-O 3.44Å; I162-S174 PolarHBondContact N-O 2.82Å; I162-S174 PolarHBondContact O-N 2.97Å; M164-S174 WeakPolarHBondContact CG-OG 3.39Å; M164-S174 PolarHBondContact SD-OG 3.15Å; M164-S174 VanDerWaalsContact SD-OG 3.33Å; S174-S212 CarbonylContact C-O 3.53Å; S174-S212 WeakPolarHBondContact CA-O 3.46Å
175	W	93.4	Very high	80.4	Confident	11 Å²	11	54.8 Å²	54.8	4%	0.042	32%	0.318	C	S	.	.			trans	-149.9	-178.5	175.7	54.9	90.2	0	0	0	109.7	L173 F189 V191 I209 T211 S212 M214 V229	L173-W175 HydrophobicContact CB-CE3 4.36Å; L173-W175 HydrophobicContact CB-CZ3 3.95Å; W175-F189 AromaticContact CE2-CG 3.83Å; W175-F189 HydrophobicContact CZ2-CB 3.77Å; W175-F189 AromaticContact CZ2-CD2 3.97Å; W175-F189 HydrophobicContact CZ2-CD2 3.97Å; W175-F189 AromaticContact CZ2-CG 3.9Å; W175-F189 HydrophobicContact CZ2-CG 3.9Å; W175-F189 AromaticContact NE1-CD1 3.32Å; W175-F189 VanDerWaalsContact NE1-CD1 3.32Å; W175-F189 AromaticContact NE1-CD2 3.41Å; W175-F189 AromaticContact NE1-CE1 3.62Å; W175-F189 AromaticContact NE1-CE2 3.73Å; W175-F189 AromaticContact NE1-CG 3.22Å; W175-F189 AromaticContact NE1-CZ 3.83Å; W175-V191 HydrophobicContact CH2-CG2 3.63Å; W175-V191 HydrophobicContact CZ2-CG2 4.21Å; W175-V191 HydrophobicContact CZ3-CG2 4.03Å; W175-I209 HydrophobicContact CH2-CG2 4.17Å; W175-I209 HydrophobicContact CZ2-CB 4.44Å; W175-I209 HydrophobicContact CZ2-CG2 4.23Å; W175-T211 VanDerWaalsContact CZ2-O 3.23Å; W175-T211 WeakPolarHBondContact CZ2-O 3.26Å; W175-S212 PolarHBondContact N-O 3.39Å; W175-S212 WeakPolarHBondContact O-CB 3.01Å; W175-M214 HydrophobicContact CH2-CB 4.42Å; W175-M214 HydrophobicContact CH2-CG 4.12Å; W175-M214 HydrophobicContact CH2-SD 4.49Å; W175-M214 HydrophobicContact CZ3-CG 4.12Å; W175-V229 HydrophobicContact CD2-CB 4.47Å; W175-V229 HydrophobicContact CD2-CG1 3.94Å; W175-V229 HydrophobicContact CD2-CG2 3.91Å; W175-V229 HydrophobicContact CE3-CG2 3.85Å; W175-V229 HydrophobicContact CG-CG1 4.19Å; W175-V229 HydrophobicContact CG-CG2 4.25Å; W175-V229 HydrophobicContact CZ2-CG1 4.14Å; W175-V229 HydrophobicContact CZ3-CG2 4.35Å
176	Q	89.3	Confident	80.7	Confident	140 Å²	140	53.2 Å²	53.2	65%	0.654	30%	0.302	S	S	*	.			trans	-128.7	160.9	170.7	-67	-177.8	-25.1	0	0	109.8	P158 T159	P158-Q176 WeakPolarHBondContact CA-O 3.46Å; P158-Q176 WeakPolarHBondContact CB-O 3.34Å; T159-Q176 HydrophobicContact CG2-CB 3.92Å; T159-Q176 PolarHBondContact N-O 3.01Å; T159-Q176 PolarHBondContact OG1-N 2.82Å; T159-Q176 PolarHBondContact OG1-O 3.1Å
177	E	86.7	Confident	80.6	Confident	89 Å²	89	55 Å²	55	42%	0.416	31%	0.309	S	S	.	.			trans	-68.6	158.6	178	-42.9	-161.6	124.4	0	0	111.1	F189	E177-F189 HydrophobicContact CG-CZ 4Å
178	G	85.4	Confident	80.9	Confident	19 Å²	19	55.3 Å²	55.3	20%	0.196	31%	0.307	C	S	.	.			trans	-74.4	166.9	179.8	0	0	0	0	0	113.5	S156 P157 S180	S156-G178 VanDerWaalsContact OG-CA 3.31Å; S156-G178 WeakPolarHBondContact OG-CA 3.49Å; P157-G178 WeakPolarHBondContact O-CA 3.42Å; G178-S180 PolarHBondContact O-N 2.86Å
179	E	80.4	Confident	81.4	Confident	210 Å²	210	53.1 Å²	53.1	98%	0.981	30%	0.295	S	S	*	.	S	Bend	trans	-56	-17.6	-178.8	-59	-174.1	152.1	0	0	114.8	S156	S156-E179 PolarHBondContact OG-N 2.9Å; S156-E179 VanDerWaalsContact OG-N 3.15Å
180	S	74.7	Confident	81.9	Confident	62 Å²	62	52.8 Å²	52.8	43%	0.434	29%	0.291	S	S	.	.			trans	-149.9	135.6	174.8	-175.8	0	0	0	0	111.9	S156 G178 G182	S156-S180 WeakPolarHBondContact CB-O 3.19Å; S156-S180 PolarHBondContact N-O 2.81Å; S156-S180 PolarHBondContact OG-N 2.91Å; S156-S180 PolarHBondContact OG-O 2.81Å; G178-S180 PolarHBondContact O-N 2.86Å; S180-G182 PolarHBondContact O-N 3.33Å; S180-G182 PolarHBondContact OG-N 2.93Å; S180-G182 VanDerWaalsContact OG-N 3.12Å
181	E	74.8	Confident	82.4	Confident	80 Å²	80	49.5 Å²	49.5	37%	0.374	28%	0.276	S	S	.	.			trans	-74.7	-3.8	169.4	-51.4	-175.2	96.5	0	0	112.9	P185 V186 N233	E181-P185 WeakPolarHBondContact OE1-CA 3.11Å; E181-P185 WeakPolarHBondContact OE1-CB 3.49Å; E181-V186 HydrophobicContact CB-CG2 4.47Å; E181-V186 HydrophobicContact CG-CG2 4.3Å; E181-V186 PolarHBondContact OE1-N 3.05Å; E181-V186 VanDerWaalsContact OE1-N 3.12Å; E181-N233 PolarHBondContact O-ND2 3.27Å
182	G	75.8	Confident	82.4	Confident	26 Å²	26	49.5 Å²	49.5	27%	0.268	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	-119.8	-174.1	0	0	0	0	0	111.7	P154 S180	P154-G182 WeakPolarHBondContact O-CA 3.44Å; S180-G182 PolarHBondContact O-N 3.33Å; S180-G182 PolarHBondContact OG-N 2.93Å; S180-G182 VanDerWaalsContact OG-N 3.12Å
183	S	70.8	Confident	83	Confident	45 Å²	45	49.9 Å²	49.9	32%	0.315	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	0.5	-178.4	-56.5	0	0	0	0	114.7	M153 Y235	M153-S183 PolarHBondContact N-OG 3.15Å; M153-S183 PolarHBondContact O-N 2.84Å; S183-Y235 WeakPolarHBondContact O-CE2 3.49Å
184	S	70.1	Confident	82.9	Confident	20 Å²	20	50.7 Å²	50.7	14%	0.14	28%	0.277	C	S	.	.	S	Bend	trans	-154.5	149.6	177.7	173.1	0	0	0	0	109.6	N233 I234	S184-N233 WeakPolarHBondContact O-CB 3.24Å; S184-N233 PolarHBondContact O-ND2 3.06Å; S184-I234 WeakPolarHBondContact OG-CD1 3.49Å; S184-I234 WeakPolarHBondContact OG-CG1 3.36Å
185	P	77.4	Confident	83	Confident	77 Å²	77	51 Å²	51	50%	0.5	27%	0.273	S	S	.	.			trans	-55.6	153.4	175.4	-27.7	35.9	0	0	0	114.7	E181 N233	E181-P185 WeakPolarHBondContact OE1-CA 3.11Å; E181-P185 WeakPolarHBondContact OE1-CB 3.49Å; P185-N233 WeakPolarHBondContact O-CB 3.47Å
186	V	79.4	Confident	82.3	Confident	24 Å²	24	53.1 Å²	53.1	15%	0.145	29%	0.289	C	S	.	.			trans	-64.7	143	173.2	-175.5	0	0	0	0	109.8	P155 E181 F189 A231	P155-V186 HydrophobicContact CB-CG2 4.2Å; P155-V186 HydrophobicContact CG-CG2 4.08Å; E181-V186 HydrophobicContact CB-CG2 4.47Å; E181-V186 HydrophobicContact CG-CG2 4.3Å; E181-V186 PolarHBondContact OE1-N 3.05Å; E181-V186 VanDerWaalsContact OE1-N 3.12Å; V186-F189 HydrophobicContact CG1-CE1 4.02Å; V186-F189 HydrophobicContact CG1-CE2 4.43Å; V186-F189 HydrophobicContact CG1-CZ 3.88Å; V186-A231 HydrophobicContact CG1-CB 4.02Å; V186-A231 HydrophobicContact CG2-CB 4.2Å
187	L	82.7	Confident	81.9	Confident	86 Å²	86	52.1 Å²	52.1	45%	0.45	28%	0.284	S	S	.	.			trans	-106.5	-42.2	179	-61.7	176.6	0	0	0	112.2	V232 I234	L187-V232 PolarHBondContact N-O 3.27Å; L187-I234 HydrophobicContact CD1-CG2 3.82Å
188	H	85.5	Confident	81.5	Confident	45 Å²	45	53 Å²	53	21%	0.208	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	171.3	179.8	58.2	-98.4	0	0	0	110.3	P208 I209 V232	H188-P208 HydrophobicContact CB-CB 4Å; H188-I209 CarbonylContact C-O 3.21Å; H188-I209 WeakPolarHBondContact CA-O 3.27Å; H188-I209 WeakPolarHBondContact CB-O 3.45Å; H188-V232 PolarHBondContact O-N 3.37Å
189	F	87.7	Confident	81.3	Confident	3 Å²	3	53.6 Å²	53.6	1%	0.013	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	149.9	173.9	-55.4	-82.8	0	0	0	111.1	P158 W175 E177 V186 I209 V229 R230 A231	P158-F189 HydrophobicContact CG-CD1 3.98Å; P158-F189 HydrophobicContact CG-CE1 4.16Å; W175-F189 AromaticContact CE2-CG 3.83Å; W175-F189 HydrophobicContact CZ2-CB 3.77Å; W175-F189 AromaticContact CZ2-CD2 3.97Å; W175-F189 HydrophobicContact CZ2-CD2 3.97Å; W175-F189 AromaticContact CZ2-CG 3.9Å; W175-F189 HydrophobicContact CZ2-CG 3.9Å; W175-F189 AromaticContact NE1-CD1 3.32Å; W175-F189 VanDerWaalsContact NE1-CD1 3.32Å; W175-F189 AromaticContact NE1-CD2 3.41Å; W175-F189 AromaticContact NE1-CE1 3.62Å; W175-F189 AromaticContact NE1-CE2 3.73Å; W175-F189 AromaticContact NE1-CG 3.22Å; W175-F189 AromaticContact NE1-CZ 3.83Å; E177-F189 HydrophobicContact CG-CZ 4Å; V186-F189 HydrophobicContact CG1-CE1 4.02Å; V186-F189 HydrophobicContact CG1-CE2 4.43Å; V186-F189 HydrophobicContact CG1-CZ 3.88Å; F189-I209 WeakPolarHBondContact CD2-O 3.37Å; F189-I209 PolarHBondContact N-O 3.09Å; F189-I209 PolarHBondContact O-N 2.94Å; F189-V229 HydrophobicContact CB-CG1 3.79Å; F189-V229 HydrophobicContact CD1-CG1 4.01Å; F189-V229 HydrophobicContact CG-CG1 4.2Å; F189-R230 CarbonylContact C-O 3.59Å; F189-R230 WeakPolarHBondContact CA-O 3.42Å; F189-A231 HydrophobicContact CD1-CB 4.07Å; F189-A231 HydrophobicContact CE1-CB 3.92Å
190	L	86.8	Confident	80.9	Confident	46 Å²	46	50.2 Å²	50.2	24%	0.241	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123.3	168.9	-57.8	175.2	0	0	0	107.9	V229 R230 V232 V237	L190-V229 CarbonylContact O-C 3.48Å; L190-V229 WeakPolarHBondContact O-CA 3.5Å; L190-R230 HydrophobicContact CB-CB 4.42Å; L190-R230 PolarHBondContact N-O 2.87Å; L190-R230 PolarHBondContact O-N 3.17Å; L190-V232 HydrophobicContact CD1-CG2 3.9Å; L190-V232 HydrophobicContact CG-CG2 3.84Å; L190-V237 HydrophobicContact CD1-CG1 4.24Å; L190-V237 HydrophobicContact CD1-CG2 4.37Å
191	V	89.2	Confident	80.6	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.006	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	138.5	178.6	-174	0	0	0	0	109	L173 W175 I205 I209 M214 V228 V229	L173-V191 HydrophobicContact CD1-CG1 4.13Å; W175-V191 HydrophobicContact CH2-CG2 3.63Å; W175-V191 HydrophobicContact CZ2-CG2 4.21Å; W175-V191 HydrophobicContact CZ3-CG2 4.03Å; V191-I205 HydrophobicContact CB-CD1 3.85Å; V191-I205 HydrophobicContact CG1-CD1 3.83Å; V191-I205 PolarHBondContact O-N 2.88Å; V191-I209 HydrophobicContact CG2-CG1 4.14Å; V191-M214 HydrophobicContact CB-SD 4.09Å; V191-M214 HydrophobicContact CG1-SD 4.16Å; V191-M214 HydrophobicContact CG2-SD 3.83Å; V191-V228 WeakPolarHBondContact CA-O 3.3Å; V191-V229 HydrophobicContact CG2-CG1 4.27Å; V191-V229 HydrophobicContact CG2-CG2 4.33Å
192	A	86.3	Confident	80.8	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.008	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	148	170.3	0	0	0	0	0	109.9	W202 T203 Y204 F227 V228	A192-W202 HydrophobicContact CB-CB 4.4Å; A192-W202 HydrophobicContact CB-CE3 4.07Å; A192-T203 CarbonylContact C-O 3.57Å; A192-T203 WeakPolarHBondContact CA-O 3.2Å; A192-T203 WeakPolarHBondContact CB-O 3.48Å; A192-Y204 HydrophobicContact CB-CD1 3.77Å; A192-Y204 HydrophobicContact CB-CD2 4.44Å; A192-Y204 HydrophobicContact CB-CE1 3.93Å; A192-Y204 HydrophobicContact CB-CG 4.04Å; A192-F227 WeakPolarHBondContact O-CA 3.31Å; A192-V228 HydrophobicContact CB-CG2 4.02Å; A192-V228 PolarHBondContact N-O 3.38Å; A192-V228 PolarHBondContact O-N 3.02Å
193	Y	90.5	Very high	81	Confident	30 Å²	30	56.1 Å²	56.1	12%	0.118	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	164.3	174.7	74	-99.2	0	0	0	111.8	W202 T203 I205 L216 Y225 Q226 F227 V284	Y193-W202 VanDerWaalsContact C-CE3 3.47Å; Y193-T203 HydrophobicContact CD1-CG2 4.42Å; Y193-T203 HydrophobicContact CE1-CG2 3.73Å; Y193-T203 HydrophobicContact CE2-CG2 4.25Å; Y193-T203 PolarHBondContact N-O 3.19Å; Y193-T203 PolarHBondContact O-N 3.05Å; Y193-I205 HydrophobicContact CD1-CD1 4.41Å; Y193-I205 HydrophobicContact CD1-CG1 4.39Å; Y193-L216 HydrophobicContact CD1-CD2 4.26Å; Y193-Y225 AromaticContact CD2-CD1 3.77Å; Y193-Y225 HydrophobicContact CD2-CD1 3.77Å; Y193-Y225 AromaticContact CD2-CE1 3.89Å; Y193-Y225 HydrophobicContact CD2-CE1 3.89Å; Y193-Y225 HydrophobicContact CE2-CD1 4.27Å; Y193-Y225 AromaticContact CE2-CE1 3.9Å; Y193-Y225 HydrophobicContact CE2-CE1 3.9Å; Y193-Y225 HydrophobicContact CG-CD1 4.39Å; Y193-Q226 CarbonylContact C-O 3.51Å; Y193-Q226 WeakPolarHBondContact CA-O 3.39Å; Y193-F227 VanDerWaalsContact CB-CE1 3.49Å; Y193-F227 HydrophobicContact CG-CE1 4.42Å; Y193-V284 HydrophobicContact CE1-CG1 4.49Å
194	I	86.2	Confident	81.4	Confident	19 Å²	19	59.9 Å²	59.9	10%	0.097	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	140.4	169.1	-165.7	169.7	0	0	0	107.9	P196 D199 E201 W202 Q226	I194-P196 HydrophobicContact CG2-CG 4.5Å; I194-P196 WeakPolarHBondContact O-CD 3.33Å; I194-D199 HydrophobicContact CG1-CB 3.68Å; I194-E201 WeakPolarHBondContact CG1-O 3.24Å; I194-W202 HydrophobicContact CB-CD2 4.01Å; I194-W202 HydrophobicContact CB-CE3 3.95Å; I194-W202 HydrophobicContact CB-CH2 4.31Å; I194-W202 HydrophobicContact CB-CZ2 4.38Å; I194-W202 HydrophobicContact CB-CZ3 4.1Å; I194-W202 HydrophobicContact CG2-CD2 4.13Å; I194-W202 HydrophobicContact CG2-CE3 4.03Å; I194-W202 HydrophobicContact CG2-CH2 3.47Å; I194-W202 VanDerWaalsContact CG2-CH2 3.47Å; I194-W202 HydrophobicContact CG2-CZ2 3.58Å; I194-W202 HydrophobicContact CG2-CZ3 3.71Å; I194-Q226 HydrophobicContact CG2-CB 3.94Å; I194-Q226 PolarHBondContact N-O 3.14Å; I194-Q226 PolarHBondContact O-N 2.64Å
195	R	89.9	Confident	81.7	Confident	36 Å²	36	59.7 Å²	59.7	14%	0.136	30%	0.303	C	S	.	.			trans	-89.7	102.8	166.6	-60.5	172.4	-66.8	177.8	7.4	108	E197 M198 D199 L220 T223 E224 Y225 D279	R195-E197 PolarHBondContact O-N 3.31Å; R195-M198 HydrophobicContact CB-CB 3.98Å; R195-M198 HydrophobicContact CB-CG 4.29Å; R195-M198 PolarHBondContact O-N 2.93Å; R195-D199 HydrophobicContact CB-CB 4.49Å; R195-D199 WeakPolarHBondContact CB-OD2 3.43Å; R195-D199 VanDerWaalsContact CG-OD2 3.3Å; R195-D199 WeakPolarHBondContact CG-OD2 3.22Å; R195-D199 IonicContact CZ-OD1 2.68Å; R195-D199 IonicContact CZ-OD2 2.66Å; R195-D199 PolarHBondContact N-OD2 2.9Å; R195-D199 IonicContact NE-OD1 3.87Å; R195-D199 PolarHBondContact NE-OD1 2.96Å; R195-D199 VanDerWaalsContact NE-OD1 3.1Å; R195-D199 IonicContact NE-OD2 3.71Å; R195-D199 PolarHBondContact NE-OD2 3.17Å; R195-D199 IonicContact NH2-OD1 2.65Å; R195-D199 PolarHBondContact NH2-OD1 2.88Å; R195-D199 PolarHBondContact O-N 3.38Å; R195-L220 VanDerWaalsContact NH1-CD1 3.27Å; R195-T223 HydrophobicContact CB-CG2 4.36Å; R195-T223 HydrophobicContact CG-CG2 3.97Å; R195-E224 VanDerWaalsContact CA-O 3.3Å; R195-E224 WeakPolarHBondContact CA-O 3.45Å; R195-Y225 HydrophobicContact CG-CD1 3.76Å; R195-Y225 HydrophobicContact CG-CE1 3.41Å; R195-Y225 VanDerWaalsContact CG-CE1 3.41Å; R195-Y225 HydrophobicContact CG-CG 4.46Å; R195-D279 IonicContact CZ-OD2 3.17Å; R195-D279 IonicContact NH1-OD2 2.97Å; R195-D279 PolarHBondContact NH1-OD2 2.76Å; R195-D279 IonicContact NH2-OD2 2.77Å; R195-D279 PolarHBondContact NH2-OD2 2.79Å
196	P	78.7	Confident	81.3	Confident	57 Å²	57	66.9 Å²	66.9	37%	0.37	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-16.1	-169	-21.4	34.5	0	0	0	114.6	I194 E224 Q226	I194-P196 HydrophobicContact CG2-CG 4.5Å; I194-P196 WeakPolarHBondContact O-CD 3.33Å; P196-E224 WeakPolarHBondContact CD-O 3.5Å; P196-Q226 HydrophobicContact CG-CB 4.25Å; P196-Q226 HydrophobicContact CG-CG 3.84Å
197	E	81.6	Confident	81	Confident	119 Å²	119	70.3 Å²	70.3	56%	0.556	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-15.6	177.1	-57.2	-175.3	134	0	0	113.2	R195 R248	R195-E197 PolarHBondContact O-N 3.31Å; E197-R248 VanDerWaalsContact CD-NH2 3.27Å; E197-R248 IonicContact OE1-CZ 2.72Å; E197-R248 IonicContact OE1-NH1 2.65Å; E197-R248 IonicContact OE1-NH2 3.25Å; E197-R248 PolarHBondContact OE1-NH2 2.93Å; E197-R248 IonicContact OE2-CZ 2.71Å; E197-R248 IonicContact OE2-NH1 3.89Å; E197-R248 PolarHBondContact OE2-NH1 2.85Å; E197-R248 IonicContact OE2-NH2 3.66Å; E197-R248 PolarHBondContact OE2-NH2 3Å
198	M	77.8	Confident	80.6	Confident	106 Å²	106	69.7 Å²	69.7	52%	0.522	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.5	-40.4	-169.1	-55.4	-103.6	-74.3	0	0	113.6	R195 L220	R195-M198 HydrophobicContact CB-CB 3.98Å; R195-M198 HydrophobicContact CB-CG 4.29Å; R195-M198 PolarHBondContact O-N 2.93Å; M198-L220 HydrophobicContact CE-CD1 4.13Å
199	D	82	Confident	80.5	Confident	33 Å²	33	68.2 Å²	68.2	18%	0.176	33%	0.329	C	S	.	.			trans	-103.6	139	-168.7	-57.3	-33.2	0	0	0	112	I194 R195	I194-D199 HydrophobicContact CG1-CB 3.68Å; R195-D199 HydrophobicContact CB-CB 4.49Å; R195-D199 WeakPolarHBondContact CB-OD2 3.43Å; R195-D199 VanDerWaalsContact CG-OD2 3.3Å; R195-D199 WeakPolarHBondContact CG-OD2 3.22Å; R195-D199 IonicContact CZ-OD1 2.68Å; R195-D199 IonicContact CZ-OD2 2.66Å; R195-D199 PolarHBondContact N-OD2 2.9Å; R195-D199 IonicContact NE-OD1 3.87Å; R195-D199 PolarHBondContact NE-OD1 2.96Å; R195-D199 VanDerWaalsContact NE-OD1 3.1Å; R195-D199 IonicContact NE-OD2 3.71Å; R195-D199 PolarHBondContact NE-OD2 3.17Å; R195-D199 IonicContact NH2-OD1 2.65Å; R195-D199 PolarHBondContact NH2-OD1 2.88Å; R195-D199 PolarHBondContact O-N 3.38Å
200	T	72.3	Confident	80.3	Confident	139 Å²	139	75.9 Å²	75.9	85%	0.853	37%	0.365	S	S	*	.	S	Bend	trans	-100.5	-10.1	175.3	58.6	0	0	0	0	114.6
201	E	67.5	Low	80	Confident	155 Å²	155	77.7 Å²	77.7	72%	0.724	38%	0.378	S	S	*	.	S	Bend	trans	-131.2	162.4	178.8	-63	-160.4	151.1	0	0	111.1	I194	I194-E201 WeakPolarHBondContact CG1-O 3.24Å
202	W	78.8	Confident	79.8	Confident	76 Å²	76	79.8 Å²	79.8	29%	0.288	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-86.2	120.1	-177.7	-76	83.2	0	0	0	112	A192 Y193 I194 Y204 Q226 V228 I243	A192-W202 HydrophobicContact CB-CB 4.4Å; A192-W202 HydrophobicContact CB-CE3 4.07Å; Y193-W202 VanDerWaalsContact C-CE3 3.47Å; I194-W202 HydrophobicContact CB-CD2 4.01Å; I194-W202 HydrophobicContact CB-CE3 3.95Å; I194-W202 HydrophobicContact CB-CH2 4.31Å; I194-W202 HydrophobicContact CB-CZ2 4.38Å; I194-W202 HydrophobicContact CB-CZ3 4.1Å; I194-W202 HydrophobicContact CG2-CD2 4.13Å; I194-W202 HydrophobicContact CG2-CE3 4.03Å; I194-W202 HydrophobicContact CG2-CH2 3.47Å; I194-W202 VanDerWaalsContact CG2-CH2 3.47Å; I194-W202 HydrophobicContact CG2-CZ2 3.58Å; I194-W202 HydrophobicContact CG2-CZ3 3.71Å; W202-Y204 HydrophobicContact CB-CE2 4.38Å; W202-Y204 WeakPolarHBondContact O-CD2 3.32Å; W202-Q226 HydrophobicContact CH2-CB 4.15Å; W202-Q226 WeakPolarHBondContact CZ3-O 3.37Å; W202-V228 HydrophobicContact CD2-CG2 4.27Å; W202-V228 HydrophobicContact CE3-CG2 3.77Å; W202-V228 HydrophobicContact CH2-CG1 3.83Å; W202-V228 HydrophobicContact CH2-CG2 4.31Å; W202-V228 HydrophobicContact CZ2-CG1 4.22Å; W202-V228 HydrophobicContact CZ3-CB 4.37Å; W202-V228 HydrophobicContact CZ3-CG1 4.11Å; W202-V228 HydrophobicContact CZ3-CG2 3.8Å; W202-I243 HydrophobicContact CH2-CG1 4.13Å; W202-I243 HydrophobicContact CH2-CG2 3.75Å; W202-I243 HydrophobicContact CZ2-CD1 3.93Å; W202-I243 HydrophobicContact CZ2-CG1 3.91Å; W202-I243 HydrophobicContact CZ2-CG2 4.16Å
203	T	80.9	Confident	79.6	Confident	60 Å²	60	82.5 Å²	82.5	37%	0.368	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	117.2	175.3	-63.2	0	0	0	0	110.2	A192 Y193	A192-T203 CarbonylContact C-O 3.57Å; A192-T203 WeakPolarHBondContact CA-O 3.2Å; A192-T203 WeakPolarHBondContact CB-O 3.48Å; Y193-T203 HydrophobicContact CD1-CG2 4.42Å; Y193-T203 HydrophobicContact CE1-CG2 3.73Å; Y193-T203 HydrophobicContact CE2-CG2 4.25Å; Y193-T203 PolarHBondContact N-O 3.19Å; Y193-T203 PolarHBondContact O-N 3.05Å
204	Y	77.6	Confident	79.2	Confident	124 Å²	124	81.8 Å²	81.8	49%	0.486	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	129.2	177.8	-71.6	-95.7	0	0	0	111.1	A192 W202	A192-Y204 HydrophobicContact CB-CD1 3.77Å; A192-Y204 HydrophobicContact CB-CD2 4.44Å; A192-Y204 HydrophobicContact CB-CE1 3.93Å; A192-Y204 HydrophobicContact CB-CG 4.04Å; W202-Y204 HydrophobicContact CB-CE2 4.38Å; W202-Y204 WeakPolarHBondContact O-CD2 3.32Å
205	I	77.6	Confident	78.8	Confident	17 Å²	17	82.4 Å²	82.4	9%	0.087	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-66.9	136.8	166.1	-69	149.7	0	0	0	107.7	V191 Y193 E207 M214 L216 I286	V191-I205 HydrophobicContact CB-CD1 3.85Å; V191-I205 HydrophobicContact CG1-CD1 3.83Å; V191-I205 PolarHBondContact O-N 2.88Å; Y193-I205 HydrophobicContact CD1-CD1 4.41Å; Y193-I205 HydrophobicContact CD1-CG1 4.39Å; I205-E207 HydrophobicContact CG2-CB 4.49Å; I205-M214 HydrophobicContact CD1-CE 4.07Å; I205-M214 HydrophobicContact CD1-SD 4.2Å; I205-L216 HydrophobicContact CD1-CD1 3.8Å; I205-L216 HydrophobicContact CD1-CD2 4.3Å; I205-L216 HydrophobicContact CG1-CD1 4.14Å; I205-I286 HydrophobicContact CG2-CD1 3.83Å
206	R	68.5	Low	78.4	Confident	227 Å²	227	80.7 Å²	80.7	86%	0.857	41%	0.407	S	S	*	.	S	Bend	trans	-85.3	-24.8	-167.7	-63.5	-177.1	-178.4	-178.4	5.2	112.5
207	E	72.3	Confident	78.3	Confident	96 Å²	96	79.5 Å²	79.5	45%	0.449	40%	0.396	S	S	.	.	S	Bend	trans	-84.8	127.4	-175.8	-64.4	61.2	-136.2	0	0	110.1	I205 I286	I205-E207 HydrophobicContact CG2-CB 4.49Å; E207-I286 HydrophobicContact CB-CD1 3.85Å; E207-I286 HydrophobicContact CG-CD1 4.31Å
208	P	76	Confident	78.1	Confident	73 Å²	73	74.7 Å²	74.7	47%	0.474	38%	0.379	S	S	.	.			trans	-73.4	130.2	174.9	29.9	-32.9	0	0	0	110.5	H188	H188-P208 HydrophobicContact CB-CB 4Å
209	I	83.4	Confident	78.3	Confident	14 Å²	14	69.7 Å²	69.7	7%	0.072	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-94.8	112.2	-177.9	-42.9	-57.8	0	0	0	109.5	W175 H188 F189 V191 T211 M214 I286	W175-I209 HydrophobicContact CH2-CG2 4.17Å; W175-I209 HydrophobicContact CZ2-CB 4.44Å; W175-I209 HydrophobicContact CZ2-CG2 4.23Å; H188-I209 CarbonylContact C-O 3.21Å; H188-I209 WeakPolarHBondContact CA-O 3.27Å; H188-I209 WeakPolarHBondContact CB-O 3.45Å; F189-I209 WeakPolarHBondContact CD2-O 3.37Å; F189-I209 PolarHBondContact N-O 3.09Å; F189-I209 PolarHBondContact O-N 2.94Å; V191-I209 HydrophobicContact CG2-CG1 4.14Å; I209-T211 VanDerWaalsContact C-N 3.31Å; I209-T211 WeakPolarHBondContact CG2-O 3.1Å; I209-M214 HydrophobicContact CD1-CE 4.3Å; I209-M214 HydrophobicContact CD1-SD 4.24Å; I209-M214 HydrophobicContact CG1-SD 4.25Å; I209-M214 HydrophobicContact CG2-CB 4.25Å; I209-I286 HydrophobicContact CD1-CD1 3.61Å
210	E	82.2	Confident	78.2	Confident	165 Å²	165	69.1 Å²	69.1	77%	0.771	35%	0.351	S	S	*	.			trans	-76.9	-16.9	178.5	-61.3	-167.2	168.4	0	0	113.1
211	T	80.9	Confident	78.8	Confident	84 Å²	84	64.7 Å²	64.7	52%	0.515	33%	0.325	S	S	.	.	S	Bend	trans	-99.6	154.2	178.6	45.6	0	0	0	0	113.3	W175 I209 S213	W175-T211 VanDerWaalsContact CZ2-O 3.23Å; W175-T211 WeakPolarHBondContact CZ2-O 3.26Å; I209-T211 VanDerWaalsContact C-N 3.31Å; I209-T211 WeakPolarHBondContact CG2-O 3.1Å; T211-S213 PolarHBondContact O-N 3.16Å; T211-S213 PolarHBondContact OG1-O 2.85Å
212	S	85	Confident	79.6	Confident	45 Å²	45	62.5 Å²	62.5	32%	0.315	32%	0.315	S	S	.	.	S	Bend	trans	-77.5	24.9	173.8	-36.6	0	0	0	0	113.9	S174 W175	S174-S212 CarbonylContact C-O 3.53Å; S174-S212 WeakPolarHBondContact CA-O 3.46Å; W175-S212 PolarHBondContact N-O 3.39Å; W175-S212 WeakPolarHBondContact O-CB 3.01Å
213	S	81.6	Confident	80	Confident	57 Å²	57	59.8 Å²	59.8	40%	0.399	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162	155.1	180	56.8	0	0	0	0	110.9	L173 T211	L173-S213 CarbonylContact O-C 3.57Å; L173-S213 WeakPolarHBondContact O-CA 3.39Å; L173-S213 WeakPolarHBondContact O-CB 3.19Å; T211-S213 PolarHBondContact O-N 3.16Å; T211-S213 PolarHBondContact OG1-O 2.85Å
214	M	82.3	Confident	80.5	Confident	15 Å²	15	59.3 Å²	59.3	7%	0.074	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	168	175.7	69.5	174.5	-65.2	0	0	112.1	A172 L173 W175 V191 I205 I209 L216 I286	A172-M214 WeakPolarHBondContact CA-O 3.29Å; L173-M214 HydrophobicContact CB-CG 4.13Å; L173-M214 HydrophobicContact CD1-CG 4.29Å; L173-M214 HydrophobicContact CD1-SD 4.39Å; L173-M214 PolarHBondContact N-O 3.15Å; L173-M214 PolarHBondContact O-N 3.26Å; W175-M214 HydrophobicContact CH2-CB 4.42Å; W175-M214 HydrophobicContact CH2-CG 4.12Å; W175-M214 HydrophobicContact CH2-SD 4.49Å; W175-M214 HydrophobicContact CZ3-CG 4.12Å; V191-M214 HydrophobicContact CB-SD 4.09Å; V191-M214 HydrophobicContact CG1-SD 4.16Å; V191-M214 HydrophobicContact CG2-SD 3.83Å; I205-M214 HydrophobicContact CD1-CE 4.07Å; I205-M214 HydrophobicContact CD1-SD 4.2Å; I209-M214 HydrophobicContact CD1-CE 4.3Å; I209-M214 HydrophobicContact CD1-SD 4.24Å; I209-M214 HydrophobicContact CG1-SD 4.25Å; I209-M214 HydrophobicContact CG2-CB 4.25Å; M214-L216 HydrophobicContact CE-CB 4.2Å; M214-L216 HydrophobicContact CE-CD1 3.84Å; M214-I286 HydrophobicContact CE-CD1 3.75Å; M214-I286 HydrophobicContact CE-CG1 3.89Å
215	V	78.4	Confident	81.1	Confident	32 Å²	32	53.6 Å²	53.6	19%	0.194	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	132.7	163.5	-177.4	0	0	0	0	108	A172 K217 L289	A172-V215 HydrophobicContact CB-CG2 4.13Å; V215-K217 HydrophobicContact CG1-CG 4.24Å; V215-L289 HydrophobicContact CG2-CD1 4.34Å
216	L	80.8	Confident	81.8	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.2	178.2	-168.4	64.4	0	0	0	108.4	E170 L171 Y193 I205 M214 L219 F227 V284	E170-L216 CarbonylContact C-O 3.55Å; E170-L216 VanDerWaalsContact CA-O 3.27Å; E170-L216 WeakPolarHBondContact CA-O 3.26Å; L171-L216 PolarHBondContact N-O 3.28Å; L171-L216 PolarHBondContact O-N 3.15Å; Y193-L216 HydrophobicContact CD1-CD2 4.26Å; I205-L216 HydrophobicContact CD1-CD1 3.8Å; I205-L216 HydrophobicContact CD1-CD2 4.3Å; I205-L216 HydrophobicContact CG1-CD1 4.14Å; M214-L216 HydrophobicContact CE-CB 4.2Å; M214-L216 HydrophobicContact CE-CD1 3.84Å; L216-L219 HydrophobicContact CD2-CD2 3.87Å; L216-L219 HydrophobicContact CG-CD2 4.08Å; L216-F227 HydrophobicContact CD2-CE1 3.7Å; L216-F227 HydrophobicContact CD2-CZ 4.29Å; L216-V284 HydrophobicContact CD1-CG1 3.4Å; L216-V284 VanDerWaalsContact CD1-CG1 3.4Å; L216-V284 HydrophobicContact CG-CG1 3.89Å
217	K	77	Confident	83	Confident	31 Å²	31	44 Å²	44	14%	0.135	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	157.2	-175.6	-54.3	-168.1	167.9	-146.6	0	111.3	T169 E170 V215 V284 F285 E287	T169-K217 CarbonylContact O-C 3.01Å; E170-K217 HydrophobicContact CB-CG 4.4Å; E170-K217 VanDerWaalsContact CD-NZ 3.28Å; E170-K217 HydrophobicContact CG-CB 4.21Å; E170-K217 HydrophobicContact CG-CD 4.24Å; E170-K217 HydrophobicContact CG-CG 3.85Å; E170-K217 VanDerWaalsContact OE1-CD 3.28Å; E170-K217 WeakPolarHBondContact OE1-CD 3.22Å; E170-K217 WeakPolarHBondContact OE1-CE 3.28Å; E170-K217 IonicContact OE1-NZ 2.99Å; E170-K217 PolarHBondContact OE1-NZ 2.78Å; E170-K217 WeakPolarHBondContact OE2-CE 3.49Å; E170-K217 IonicContact OE2-NZ 3.41Å; E170-K217 PolarHBondContact OE2-NZ 2.92Å; V215-K217 HydrophobicContact CG1-CG 4.24Å; K217-V284 WeakPolarHBondContact O-CA 3.23Å; K217-V284 WeakPolarHBondContact O-CG1 3.26Å; K217-F285 HydrophobicContact CB-CE2 4.46Å; K217-F285 WeakPolarHBondContact CB-O 3.45Å; K217-F285 HydrophobicContact CD-CE2 4.46Å; K217-F285 PolarHBondContact N-O 2.85Å; K217-F285 PolarHBondContact O-N 3.36Å; K217-E287 HydrophobicContact CD-CB 4.28Å; K217-E287 WeakPolarHBondContact CE-OE2 3.49Å; K217-E287 IonicContact NZ-OE2 2.84Å; K217-E287 PolarHBondContact NZ-OE2 3.17Å
218	G	77.6	Confident	83.8	Confident	19 Å²	19	40 Å²	40	20%	0.196	22%	0.224	C	C	.	.	S	Bend	trans	85.5	25.1	-177.3	0	0	0	0	0	113.5	T169	T169-G218 PolarHBondContact O-N 2.79Å
219	L	81.4	Confident	84.6	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-75.6	152.7	175.9	-56.6	-178.8	0	0	0	111.4	T169 L171 L216 Y225 T249	T169-L219 PolarHBondContact O-N 2.03Å; L171-L219 HydrophobicContact CB-CD1 3.48Å; L171-L219 VanDerWaalsContact CB-CD1 3.48Å; L171-L219 HydrophobicContact CD1-CD1 4.43Å; L216-L219 HydrophobicContact CD2-CD2 3.87Å; L216-L219 HydrophobicContact CG-CD2 4.08Å; L219-Y225 HydrophobicContact CB-CE2 4.02Å; L219-Y225 HydrophobicContact CD1-CE2 4.47Å; L219-Y225 HydrophobicContact CD2-CD1 4.39Å; L219-Y225 HydrophobicContact CD2-CE1 3.83Å; L219-Y225 HydrophobicContact CD2-CE2 4.26Å; L219-Y225 HydrophobicContact CG-CE2 4.48Å; L219-T249 HydrophobicContact CB-CG2 3.96Å; L219-T249 HydrophobicContact CD1-CG2 4.03Å
220	L	81.1	Confident	84.9	Confident	22 Å²	22	39 Å²	39	12%	0.115	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-73.6	137.5	171.5	-64.9	-178	0	0	0	110.3	R195 M198 T223 Y225 T249 Y282	R195-L220 VanDerWaalsContact NH1-CD1 3.27Å; M198-L220 HydrophobicContact CE-CD1 4.13Å; L220-T223 HydrophobicContact CB-CG2 4.35Å; L220-T223 WeakPolarHBondContact CB-OG1 3.1Å; L220-T223 WeakPolarHBondContact O-CB 3.31Å; L220-Y225 PolarHBondContact N-OH 3.47Å; L220-T249 WeakPolarHBondContact O-CB 3.19Å; L220-T249 PolarHBondContact O-OG1 2.79Å; L220-Y282 HydrophobicContact CD2-CD1 4.35Å; L220-Y282 HydrophobicContact CD2-CD2 3.49Å; L220-Y282 VanDerWaalsContact CD2-CD2 3.49Å; L220-Y282 HydrophobicContact CD2-CE1 4.35Å; L220-Y282 HydrophobicContact CD2-CE2 3.48Å; L220-Y282 VanDerWaalsContact CD2-CE2 3.48Å; L220-Y282 HydrophobicContact CD2-CG 3.95Å
221	P	83.8	Confident	85.1	Confident	45 Å²	45	31.1 Å²	31.1	29%	0.292	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	158.3	170.3	-24.9	35.6	0	0	0	113.8	D168 T223 T249	D168-P221 HydrophobicContact CB-CB 4.45Å; D168-P221 HydrophobicContact CB-CG 4.36Å; D168-P221 WeakPolarHBondContact O-CA 3.37Å; P221-T223 PolarHBondContact O-N 2.8Å; P221-T223 PolarHBondContact O-OG1 3.13Å; P221-T249 VanDerWaalsContact C-OG1 3.23Å; P221-T249 WeakPolarHBondContact CA-OG1 3.23Å
222	E	84.4	Confident	85.3	Confident	110 Å²	110	27.9 Å²	27.9	51%	0.514	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	17.9	-178.8	-72	-63.7	156.7	0	0	116.3	R248 T249 G251	E222-R248 VanDerWaalsContact C-CG 3.4Å; E222-R248 VanDerWaalsContact O-CD 3.25Å; E222-R248 WeakPolarHBondContact O-CD 3.43Å; E222-R248 VanDerWaalsContact O-CG 3.26Å; E222-R248 WeakPolarHBondContact O-CG 3.48Å; E222-R248 PolarHBondContact O-NH1 2.71Å; E222-T249 WeakPolarHBondContact CA-O 3.24Å; E222-T249 PolarHBondContact N-O 3.1Å; E222-T249 PolarHBondContact N-OG1 2.93Å; E222-T249 VanDerWaalsContact N-OG1 3.11Å; E222-G251 WeakPolarHBondContact OE1-CA 3.39Å; E222-G251 PolarHBondContact OE1-N 3.24Å
223	T	87.6	Confident	85.2	Confident	18 Å²	18	26 Å²	26	11%	0.11	14%	0.139	C	C	.	.			trans	-105.6	132.9	-170.8	-62.1	0	0	0	0	110.5	R195 L220 P221 Y225 R248 T249	R195-T223 HydrophobicContact CB-CG2 4.36Å; R195-T223 HydrophobicContact CG-CG2 3.97Å; L220-T223 HydrophobicContact CB-CG2 4.35Å; L220-T223 WeakPolarHBondContact CB-OG1 3.1Å; L220-T223 WeakPolarHBondContact O-CB 3.31Å; P221-T223 PolarHBondContact O-N 2.8Å; P221-T223 PolarHBondContact O-OG1 3.13Å; T223-Y225 HydrophobicContact CG2-CD2 4.25Å; T223-Y225 HydrophobicContact CG2-CE2 3.69Å; T223-Y225 WeakPolarHBondContact O-CD2 2.99Å; T223-R248 WeakPolarHBondContact O-CA 3.28Å; T223-T249 PolarHBondContact N-OG1 3.21Å; T223-T249 PolarHBondContact O-N 3.49Å; T223-T249 PolarHBondContact O-OG1 2.86Å
224	E	90.1	Very high	84.6	Confident	51 Å²	51	26 Å²	26	24%	0.238	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	132.4	175.2	-92.6	178	-140.2	0	0	112.5	R195 P196 P246 R248	R195-E224 VanDerWaalsContact CA-O 3.3Å; R195-E224 WeakPolarHBondContact CA-O 3.45Å; P196-E224 WeakPolarHBondContact CD-O 3.5Å; E224-P246 HydrophobicContact CG-CB 4.25Å; E224-P246 WeakPolarHBondContact OE2-CB 3.35Å; E224-R248 VanDerWaalsContact CD-NH2 3.26Å; E224-R248 HydrophobicContact CG-CB 3.72Å; E224-R248 HydrophobicContact CG-CG 4.08Å; E224-R248 IonicContact OE1-CZ 2.96Å; E224-R248 VanDerWaalsContact OE1-CZ 3.3Å; E224-R248 IonicContact OE1-NE 2.74Å; E224-R248 PolarHBondContact OE1-NE 3.48Å; E224-R248 VanDerWaalsContact OE1-NE 3.15Å; E224-R248 IonicContact OE1-NH2 2.71Å; E224-R248 PolarHBondContact OE1-NH2 3.48Å
225	Y	90.4	Very high	83.8	Confident	4 Å²	4	28.9 Å²	28.9	2%	0.016	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	142.9	174.8	-70	-94.4	0	0	0	111.3	Y193 R195 L219 L220 T223 F227 V247 T249	Y193-Y225 AromaticContact CD2-CD1 3.77Å; Y193-Y225 HydrophobicContact CD2-CD1 3.77Å; Y193-Y225 AromaticContact CD2-CE1 3.89Å; Y193-Y225 HydrophobicContact CD2-CE1 3.89Å; Y193-Y225 HydrophobicContact CE2-CD1 4.27Å; Y193-Y225 AromaticContact CE2-CE1 3.9Å; Y193-Y225 HydrophobicContact CE2-CE1 3.9Å; Y193-Y225 HydrophobicContact CG-CD1 4.39Å; R195-Y225 HydrophobicContact CG-CD1 3.76Å; R195-Y225 HydrophobicContact CG-CE1 3.41Å; R195-Y225 VanDerWaalsContact CG-CE1 3.41Å; R195-Y225 HydrophobicContact CG-CG 4.46Å; L219-Y225 HydrophobicContact CB-CE2 4.02Å; L219-Y225 HydrophobicContact CD1-CE2 4.47Å; L219-Y225 HydrophobicContact CD2-CD1 4.39Å; L219-Y225 HydrophobicContact CD2-CE1 3.83Å; L219-Y225 HydrophobicContact CD2-CE2 4.26Å; L219-Y225 HydrophobicContact CG-CE2 4.48Å; L220-Y225 PolarHBondContact N-OH 3.47Å; T223-Y225 HydrophobicContact CG2-CD2 4.25Å; T223-Y225 HydrophobicContact CG2-CE2 3.69Å; T223-Y225 WeakPolarHBondContact O-CD2 2.99Å; Y225-F227 HydrophobicContact CG-CZ 4.34Å; Y225-V247 PolarHBondContact N-O 2.95Å; Y225-V247 PolarHBondContact O-N 3.25Å; Y225-T249 HydrophobicContact CD2-CG2 4.24Å; Y225-T249 HydrophobicContact CE2-CG2 4.11Å
226	Q	92.3	Very high	83.3	Confident	42 Å²	42	28.6 Å²	28.6	20%	0.196	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	153.3	165.9	-75.3	-171.3	-69.1	0	0	110.8	Y193 I194 P196 W202 I243 N244 P246	Y193-Q226 CarbonylContact C-O 3.51Å; Y193-Q226 WeakPolarHBondContact CA-O 3.39Å; I194-Q226 HydrophobicContact CG2-CB 3.94Å; I194-Q226 PolarHBondContact N-O 3.14Å; I194-Q226 PolarHBondContact O-N 2.64Å; P196-Q226 HydrophobicContact CG-CB 4.25Å; P196-Q226 HydrophobicContact CG-CG 3.84Å; W202-Q226 HydrophobicContact CH2-CB 4.15Å; W202-Q226 WeakPolarHBondContact CZ3-O 3.37Å; Q226-I243 HydrophobicContact CB-CG2 3.76Å; Q226-I243 HydrophobicContact CG-CG2 4.16Å; Q226-N244 WeakPolarHBondContact CA-OD1 3.37Å; Q226-N244 PolarHBondContact NE2-O 2.83Å; Q226-P246 HydrophobicContact CG-CB 4.06Å; Q226-P246 HydrophobicContact CG-CG 3.92Å
227	F	93.8	Very high	83.1	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	145	-169.9	-58.9	-82.1	0	0	0	112.4	P161 L171 L173 A192 Y193 L216 Y225 N244	P161-F227 HydrophobicContact CG-CB 4.02Å; P161-F227 WeakPolarHBondContact CG-O 3.08Å; L171-F227 HydrophobicContact CD1-CE2 3.92Å; L171-F227 HydrophobicContact CD1-CZ 4.13Å; L171-F227 HydrophobicContact CD2-CE2 3.84Å; L171-F227 HydrophobicContact CD2-CZ 3.93Å; L173-F227 HydrophobicContact CD1-CB 4.36Å; L173-F227 HydrophobicContact CD1-CD1 3.7Å; L173-F227 HydrophobicContact CD1-CD2 4.41Å; L173-F227 HydrophobicContact CD1-CE1 4.06Å; L173-F227 HydrophobicContact CD1-CG 3.9Å; L173-F227 HydrophobicContact CD2-CD2 3.88Å; L173-F227 HydrophobicContact CD2-CE2 4.25Å; L173-F227 HydrophobicContact CD2-CG 4.09Å; A192-F227 WeakPolarHBondContact O-CA 3.31Å; Y193-F227 VanDerWaalsContact CB-CE1 3.49Å; Y193-F227 HydrophobicContact CG-CE1 4.42Å; L216-F227 HydrophobicContact CD2-CE1 3.7Å; L216-F227 HydrophobicContact CD2-CZ 4.29Å; Y225-F227 HydrophobicContact CG-CZ 4.34Å; F227-N244 PolarHBondContact N-OD1 3.36Å; F227-N244 PolarHBondContact O-N 3.38Å
228	V	90.4	Very high	83.6	Confident	12 Å²	12	30 Å²	30	7%	0.073	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	151.5	166.7	-67.7	0	0	0	0	111	V191 A192 W202 P240 I243	V191-V228 WeakPolarHBondContact CA-O 3.3Å; A192-V228 HydrophobicContact CB-CG2 4.02Å; A192-V228 PolarHBondContact N-O 3.38Å; A192-V228 PolarHBondContact O-N 3.02Å; W202-V228 HydrophobicContact CD2-CG2 4.27Å; W202-V228 HydrophobicContact CE3-CG2 3.77Å; W202-V228 HydrophobicContact CH2-CG1 3.83Å; W202-V228 HydrophobicContact CH2-CG2 4.31Å; W202-V228 HydrophobicContact CZ2-CG1 4.22Å; W202-V228 HydrophobicContact CZ3-CB 4.37Å; W202-V228 HydrophobicContact CZ3-CG1 4.11Å; W202-V228 HydrophobicContact CZ3-CG2 3.8Å; V228-P240 HydrophobicContact CB-CB 4.23Å; V228-P240 HydrophobicContact CG2-CB 4.46Å; V228-I243 HydrophobicContact CG1-CB 4.09Å; V228-I243 HydrophobicContact CG1-CG1 3.47Å; V228-I243 VanDerWaalsContact CG1-CG1 3.47Å; V228-I243 HydrophobicContact CG1-CG2 4.46Å
229	V	91.7	Very high	84	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	145.2	-179.7	-167.5	0	0	0	0	110.2	P158 P161 W175 F189 L190 V191 S241	P158-V229 HydrophobicContact CB-CB 4.22Å; P158-V229 HydrophobicContact CB-CG1 4.26Å; P158-V229 HydrophobicContact CG-CB 4.21Å; P158-V229 HydrophobicContact CG-CG1 3.99Å; P161-V229 HydrophobicContact CB-CG2 3.86Å; P161-V229 HydrophobicContact CG-CG2 3.97Å; W175-V229 HydrophobicContact CD2-CB 4.47Å; W175-V229 HydrophobicContact CD2-CG1 3.94Å; W175-V229 HydrophobicContact CD2-CG2 3.91Å; W175-V229 HydrophobicContact CE3-CG2 3.85Å; W175-V229 HydrophobicContact CG-CG1 4.19Å; W175-V229 HydrophobicContact CG-CG2 4.25Å; W175-V229 HydrophobicContact CZ2-CG1 4.14Å; W175-V229 HydrophobicContact CZ3-CG2 4.35Å; F189-V229 HydrophobicContact CB-CG1 3.79Å; F189-V229 HydrophobicContact CD1-CG1 4.01Å; F189-V229 HydrophobicContact CG-CG1 4.2Å; L190-V229 CarbonylContact O-C 3.48Å; L190-V229 WeakPolarHBondContact O-CA 3.5Å; V191-V229 HydrophobicContact CG2-CG1 4.27Å; V191-V229 HydrophobicContact CG2-CG2 4.33Å; V229-S241 PolarHBondContact N-OG 3.06Å; V229-S241 PolarHBondContact O-N 3.44Å
230	R	90.8	Very high	84.1	Confident	65 Å²	65	35.6 Å²	35.6	25%	0.245	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	135.2	174.7	-40.3	-174.1	66.8	153.3	-3.8	109.4	F189 L190 V237 S238 P240	F189-R230 CarbonylContact C-O 3.59Å; F189-R230 WeakPolarHBondContact CA-O 3.42Å; L190-R230 HydrophobicContact CB-CB 4.42Å; L190-R230 PolarHBondContact N-O 2.87Å; L190-R230 PolarHBondContact O-N 3.17Å; R230-V237 HydrophobicContact CB-CG1 3.7Å; R230-V237 HydrophobicContact CG-CG1 4.49Å; R230-S238 WeakPolarHBondContact CA-OG 3.34Å; R230-S238 PolarHBondContact NE-O 2.96Å; R230-S238 PolarHBondContact NH2-O 3.23Å; R230-P240 HydrophobicContact CG-CB 4.27Å
231	A	85.5	Confident	84.7	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	148	173.1	0	0	0	0	0	110.7	P155 P158 V186 F189 V237 S238	P155-A231 HydrophobicContact CB-CB 3.79Å; P155-A231 HydrophobicContact CG-CB 4.07Å; P158-A231 HydrophobicContact CG-CB 3.94Å; V186-A231 HydrophobicContact CG1-CB 4.02Å; V186-A231 HydrophobicContact CG2-CB 4.2Å; F189-A231 HydrophobicContact CD1-CB 4.07Å; F189-A231 HydrophobicContact CE1-CB 3.92Å; A231-V237 CarbonylContact O-C 3.59Å; A231-V237 WeakPolarHBondContact O-CA 3.23Å; A231-S238 PolarHBondContact N-OG 3.08Å; A231-S238 PolarHBondContact O-N 3.19Å
232	V	86.1	Confident	84.9	Confident	16 Å²	16	40 Å²	40	10%	0.097	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	129.5	179.6	-169.8	0	0	0	0	110.4	L187 H188 L190 V237	L187-V232 PolarHBondContact N-O 3.27Å; H188-V232 PolarHBondContact O-N 3.37Å; L190-V232 HydrophobicContact CD1-CG2 3.9Å; L190-V232 HydrophobicContact CG-CG2 3.84Å; V232-V237 HydrophobicContact CG1-CG2 4.18Å; V232-V237 HydrophobicContact CG2-CB 4.47Å; V232-V237 HydrophobicContact CG2-CG1 4.19Å; V232-V237 HydrophobicContact CG2-CG2 4.01Å
233	N	82.6	Confident	85.1	Confident	5 Å²	5	38.5 Å²	38.5	3%	0.027	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	178.8	165.3	76.1	11.1	0	0	0	111	M153 P155 E181 S184 P185 Y235 G236	M153-N233 PolarHBondContact O-ND2 3.16Å; P155-N233 HydrophobicContact CG-CB 3.82Å; E181-N233 PolarHBondContact O-ND2 3.27Å; S184-N233 WeakPolarHBondContact O-CB 3.24Å; S184-N233 PolarHBondContact O-ND2 3.06Å; P185-N233 WeakPolarHBondContact O-CB 3.47Å; N233-Y235 PolarHBondContact O-N 2.87Å; N233-Y235 WeakPolarHBondContact OD1-CA 3.25Å; N233-Y235 WeakPolarHBondContact OD1-CB 3.26Å; N233-Y235 PolarHBondContact OD1-N 3.38Å; N233-G236 PolarHBondContact N-O 2.88Å; N233-G236 PolarHBondContact O-N 2.73Å; N233-G236 VanDerWaalsContact O-N 3.13Å; N233-G236 PolarHBondContact OD1-N 2.94Å; N233-G236 VanDerWaalsContact OD1-N 3.08Å
234	I	68.9	Low	85.3	Confident	58 Å²	58	38 Å²	38	30%	0.297	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-9.5	179	68.1	-176	0	0	0	114.9	S184 L187	S184-I234 WeakPolarHBondContact OG-CD1 3.49Å; S184-I234 WeakPolarHBondContact OG-CG1 3.36Å; L187-I234 HydrophobicContact CD1-CG2 3.82Å
235	Y	66	Low	85.1	Confident	75 Å²	75	41.5 Å²	41.5	29%	0.294	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-15.1	179.5	-57	-55.4	0	0	0	113.9	N50 C152 S183 N233	N50-Y235 HydrophobicContact CB-CE1 4.44Å; C152-Y235 HydrophobicContact CB-CD1 3.63Å; C152-Y235 HydrophobicContact CB-CD2 4.49Å; C152-Y235 HydrophobicContact CB-CE1 4.11Å; C152-Y235 HydrophobicContact CB-CG 3.84Å; S183-Y235 WeakPolarHBondContact O-CE2 3.49Å; N233-Y235 PolarHBondContact O-N 2.87Å; N233-Y235 WeakPolarHBondContact OD1-CA 3.25Å; N233-Y235 WeakPolarHBondContact OD1-CB 3.26Å; N233-Y235 PolarHBondContact OD1-N 3.38Å
236	G	66.4	Low	85	Confident	26 Å²	26	44.2 Å²	44.2	27%	0.268	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	156.3	-175	169.9	0	0	0	0	0	115.4	P155 N233	P155-G236 WeakPolarHBondContact CD-O 3.45Å; N233-G236 PolarHBondContact N-O 2.88Å; N233-G236 PolarHBondContact O-N 2.73Å; N233-G236 VanDerWaalsContact O-N 3.13Å; N233-G236 PolarHBondContact OD1-N 2.94Å; N233-G236 VanDerWaalsContact OD1-N 3.08Å
237	V	77.9	Confident	84.8	Confident	62 Å²	62	43.8 Å²	43.8	38%	0.376	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	137.6	178.1	-173	0	0	0	0	109.7	L190 R230 A231 V232	L190-V237 HydrophobicContact CD1-CG1 4.24Å; L190-V237 HydrophobicContact CD1-CG2 4.37Å; R230-V237 HydrophobicContact CB-CG1 3.7Å; R230-V237 HydrophobicContact CG-CG1 4.49Å; A231-V237 CarbonylContact O-C 3.59Å; A231-V237 WeakPolarHBondContact O-CA 3.23Å; V232-V237 HydrophobicContact CG1-CG2 4.18Å; V232-V237 HydrophobicContact CG2-CB 4.47Å; V232-V237 HydrophobicContact CG2-CG1 4.19Å; V232-V237 HydrophobicContact CG2-CG2 4.01Å
238	S	87.5	Confident	84.6	Confident	1 Å²	1	48 Å²	48	1%	0.007	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-63.8	164.5	174.8	75.6	0	0	0	0	112.4	P155 S156 R230 A231	P155-S238 WeakPolarHBondContact O-CA 3.49Å; P155-S238 WeakPolarHBondContact O-CB 3.4Å; S156-S238 WeakPolarHBondContact O-CB 3.24Å; R230-S238 WeakPolarHBondContact CA-OG 3.34Å; R230-S238 PolarHBondContact NE-O 2.96Å; R230-S238 PolarHBondContact NH2-O 3.23Å; A231-S238 PolarHBondContact N-OG 3.08Å; A231-S238 PolarHBondContact O-N 3.19Å
239	P	84.7	Confident	84.4	Confident	73 Å²	73	47.5 Å²	47.5	47%	0.474	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-58.2	155.6	153.6	-10.3	24.9	0	0	0	109.9	P157	P157-P239 WeakPolarHBondContact CB-O 3.41Å; P157-P239 HydrophobicContact CG-CB 3.91Å; P157-P239 HydrophobicContact CG-CG 4.01Å
240	P	84	Confident	84	Confident	63 Å²	63	52.2 Å²	52.2	41%	0.409	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-66.2	152.8	177.7	29.7	-35.2	0	0	0	112	V228 R230	V228-P240 HydrophobicContact CB-CB 4.23Å; V228-P240 HydrophobicContact CG2-CB 4.46Å; R230-P240 HydrophobicContact CG-CB 4.27Å
241	S	93.2	Very high	83.2	Confident	7 Å²	7	50.1 Å²	50.1	5%	0.049	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-55.8	166.8	164.8	69.2	0	0	0	0	111.1	P158 T159 V229	P158-S241 VanDerWaalsContact O-CB 3.22Å; P158-S241 WeakPolarHBondContact O-CB 3.46Å; T159-S241 WeakPolarHBondContact O-CB 3.4Å; V229-S241 PolarHBondContact N-OG 3.06Å; V229-S241 PolarHBondContact O-N 3.44Å
242	H	88.8	Confident	82	Confident	152 Å²	152	54.6 Å²	54.6	70%	0.704	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-59.7	143.5	160.6	-69.8	-73.4	0	0	0	110	Q160 P161	Q160-H242 HydrophobicContact CB-CB 4.23Å; Q160-H242 HydrophobicContact CG-CB 4.27Å; P161-H242 WeakPolarHBondContact CD-O 3.35Å
243	I	89	Confident	80.3	Confident	78 Å²	78	61.8 Å²	61.8	40%	0.4	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-66.8	138.5	174.6	-53.3	159.8	0	0	0	108.3	Q160 W202 Q226 V228	Q160-I243 PolarHBondContact NE2-O 3.02Å; W202-I243 HydrophobicContact CH2-CG1 4.13Å; W202-I243 HydrophobicContact CH2-CG2 3.75Å; W202-I243 HydrophobicContact CZ2-CD1 3.93Å; W202-I243 HydrophobicContact CZ2-CG1 3.91Å; W202-I243 HydrophobicContact CZ2-CG2 4.16Å; Q226-I243 HydrophobicContact CB-CG2 3.76Å; Q226-I243 HydrophobicContact CG-CG2 4.16Å; V228-I243 HydrophobicContact CG1-CB 4.09Å; V228-I243 HydrophobicContact CG1-CG1 3.47Å; V228-I243 VanDerWaalsContact CG1-CG1 3.47Å; V228-I243 HydrophobicContact CG1-CG2 4.46Å
244	N	90.7	Very high	78.4	Confident	8 Å²	8	70.3 Å²	70.3	4%	0.043	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-69.7	168.2	173.8	74.9	-38.1	0	0	0	112.6	Q160 P161 Q226 F227	Q160-N244 HydrophobicContact CG-CB 4.42Å; P161-N244 HydrophobicContact CG-CB 4.22Å; P161-N244 WeakPolarHBondContact O-CB 3.37Å; Q226-N244 WeakPolarHBondContact CA-OD1 3.37Å; Q226-N244 PolarHBondContact NE2-O 2.83Å; F227-N244 PolarHBondContact N-OD1 3.36Å; F227-N244 PolarHBondContact O-N 3.38Å
245	N	87.6	Confident	76.7	Confident	125 Å²	125	77.4 Å²	77.4	67%	0.668	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-62.9	144.1	166.2	-61	-27	0	0	0	109.2
246	P	87.6	Confident	75.1	Confident	60 Å²	60	76.9 Å²	76.9	39%	0.39	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-54	140.5	174.5	-22.4	31.5	0	0	0	112	E224 Q226	E224-P246 HydrophobicContact CG-CB 4.25Å; E224-P246 WeakPolarHBondContact OE2-CB 3.35Å; Q226-P246 HydrophobicContact CG-CB 4.06Å; Q226-P246 HydrophobicContact CG-CG 3.92Å
247	V	88.6	Confident	73.6	Confident	34 Å²	34	82 Å²	82	21%	0.206	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	123.4	175.3	175.5	0	0	0	0	109.2	V163 V166 L171 Y225	V163-V247 HydrophobicContact CB-CG2 4.28Å; V163-V247 HydrophobicContact CG1-CG1 4.34Å; V163-V247 HydrophobicContact CG2-CB 4.27Å; V163-V247 HydrophobicContact CG2-CG2 3.72Å; V166-V247 HydrophobicContact CG2-CG1 3.65Å; L171-V247 HydrophobicContact CD1-CG1 4.1Å; Y225-V247 PolarHBondContact N-O 2.95Å; Y225-V247 PolarHBondContact O-N 3.25Å
248	R	89.8	Confident	71.3	Confident	87 Å²	87	82.9 Å²	82.9	33%	0.328	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	133.2	176.5	-158.3	168.8	-71.6	-95.2	3	110	E197 E222 T223 E224	E197-R248 VanDerWaalsContact CD-NH2 3.27Å; E197-R248 IonicContact OE1-CZ 2.72Å; E197-R248 IonicContact OE1-NH1 2.65Å; E197-R248 IonicContact OE1-NH2 3.25Å; E197-R248 PolarHBondContact OE1-NH2 2.93Å; E197-R248 IonicContact OE2-CZ 2.71Å; E197-R248 IonicContact OE2-NH1 3.89Å; E197-R248 PolarHBondContact OE2-NH1 2.85Å; E197-R248 IonicContact OE2-NH2 3.66Å; E197-R248 PolarHBondContact OE2-NH2 3Å; E222-R248 VanDerWaalsContact C-CG 3.4Å; E222-R248 VanDerWaalsContact O-CD 3.25Å; E222-R248 WeakPolarHBondContact O-CD 3.43Å; E222-R248 VanDerWaalsContact O-CG 3.26Å; E222-R248 WeakPolarHBondContact O-CG 3.48Å; E222-R248 PolarHBondContact O-NH1 2.71Å; T223-R248 WeakPolarHBondContact O-CA 3.28Å; E224-R248 VanDerWaalsContact CD-NH2 3.26Å; E224-R248 HydrophobicContact CG-CB 3.72Å; E224-R248 HydrophobicContact CG-CG 4.08Å; E224-R248 IonicContact OE1-CZ 2.96Å; E224-R248 VanDerWaalsContact OE1-CZ 3.3Å; E224-R248 IonicContact OE1-NE 2.74Å; E224-R248 PolarHBondContact OE1-NE 3.48Å; E224-R248 VanDerWaalsContact OE1-NE 3.15Å; E224-R248 IonicContact OE1-NH2 2.71Å; E224-R248 PolarHBondContact OE1-NH2 3.48Å
249	T	85.4	Confident	68.6	Low	2 Å²	2	90.2 Å²	90.2	1%	0.012	53%	0.528	C	S	.	.	P	Polyproline II helix	trans	-65.1	157.9	167	45.4	0	0	0	0	110.7	L219 L220 P221 E222 T223 Y225	L219-T249 HydrophobicContact CB-CG2 3.96Å; L219-T249 HydrophobicContact CD1-CG2 4.03Å; L220-T249 WeakPolarHBondContact O-CB 3.19Å; L220-T249 PolarHBondContact O-OG1 2.79Å; P221-T249 VanDerWaalsContact C-OG1 3.23Å; P221-T249 WeakPolarHBondContact CA-OG1 3.23Å; E222-T249 WeakPolarHBondContact CA-O 3.24Å; E222-T249 PolarHBondContact N-O 3.1Å; E222-T249 PolarHBondContact N-OG1 2.93Å; E222-T249 VanDerWaalsContact N-OG1 3.11Å; T223-T249 PolarHBondContact N-OG1 3.21Å; T223-T249 PolarHBondContact O-N 3.49Å; T223-T249 PolarHBondContact O-OG1 2.86Å; Y225-T249 HydrophobicContact CD2-CG2 4.24Å; Y225-T249 HydrophobicContact CE2-CG2 4.11Å
250	L	82.4	Confident	65.9	Low	99 Å²	99	92.7 Å²	92.7	52%	0.518	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-76.5	148.6	-179.9	-56.4	-179.1	0	0	0	111.3	S167 D168	S167-L250 PolarHBondContact O-N 2.82Å; D168-L250 WeakPolarHBondContact CA-O 3.44Å; D168-L250 VanDerWaalsContact CB-O 3.26Å; D168-L250 WeakPolarHBondContact CB-O 3.18Å
251	G	73.8	Confident	63.3	Low	22 Å²	22	92.9 Å²	92.9	23%	0.227	56%	0.555	C	S	.	*	P	Polyproline II helix	trans	-70.8	142.2	167.3	0	0	0	0	0	112.9	E222 L253	E222-G251 WeakPolarHBondContact OE1-CA 3.39Å; E222-G251 PolarHBondContact OE1-N 3.24Å; G251-L253 PolarHBondContact O-N 2.89Å
252	S	60.4	Low	60.3	Low	93 Å²	93	102.4 Å²	102.4	65%	0.65	59%	0.59	S	S	*	*			trans	-72.5	94.4	173.1	-152	0	0	0	0	109.2
253	L	50.3	Low	57.4	Low	168 Å²	168	103.3 Å²	103.3	88%	0.88	59%	0.588	S	S	*	*			trans	-86	122.7	-166.5	-120	170.9	0	0	0	112.3	G251	G251-L253 PolarHBondContact O-N 2.89Å
254	E	43.2	Very low	54.4	Low	183 Å²	183	106.2 Å²	106.2	86%	0.855	61%	0.605	S	S	*	*			trans	-59.8	143.6	-177.6	-65	-171.2	123.5	0	0	114.1	G256	E254-G256 VanDerWaalsContact C-N 3.33Å; E254-G256 PolarHBondContact O-N 2.97Å
255	M	34.4	Very low	51.9	Low	207 Å²	207	112.2 Å²	112.2	100%	1.02	64%	0.642	S	S	*	*			trans	-87.2	62.1	-177.2	-158.9	174.1	-173.3	0	0	113.8
256	G	31.7	Very low	49.1	Very low	64 Å²	64	112 Å²	112	66%	0.66	64%	0.641	S	S	*	*			trans	122	141.9	134.8	0	0	0	0	0	121.2	E254	E254-G256 VanDerWaalsContact C-N 3.33Å; E254-G256 PolarHBondContact O-N 2.97Å
257	S	35.1	Very low	46.9	Very low	134 Å²	134	114.1 Å²	114.1	94%	0.937	65%	0.654	S	S	*	*			trans	76.1	98.7	150.3	-169	0	0	0	0	119.5
258	G	28.5	Very low	44.5	Very low	80 Å²	80	121.9 Å²	121.9	83%	0.825	68%	0.68	S	S	*	*			trans	-163.6	135.7	162.1	0	0	0	0	0	111.9
259	D	31.9	Very low	41.8	Very low	156 Å²	156	128.3 Å²	128.3	83%	0.834	71%	0.706	S	S	*	*			trans	-100.1	166.4	179.9	-173.7	24	0	0	0	111.5
260	V	28	Very low	39.8	Very low	125 Å²	125	136.6 Å²	136.6	76%	0.758	74%	0.742	S	S	*	*			trans	72.6	117	171.7	-166.5	0	0	0	0	115.9
261	G	29.7	Very low	37.4	Very low	67 Å²	67	139.3 Å²	139.3	69%	0.691	76%	0.757	S	S	*	*			trans	-101.8	-154.8	169.7	0	0	0	0	0	114
262	R	29.7	Very low	36.1	Very low	206 Å²	206	146.5 Å²	146.5	78%	0.777	78%	0.784	S	S	*	*			trans	88.8	100.8	176.3	-75.2	178.8	134.3	-176.2	-8.5	118.8
263	Y	27.3	Very low	35.1	Very low	171 Å²	171	149.7 Å²	149.7	67%	0.671	79%	0.794	S	S	*	*				119.8	132.5	115.9	-78.8	-46.2	0	0	0	119.7
264	N	26.5	Very low	34.4	Very low	140 Å²	140	145.4 Å²	145.4	75%	0.749	79%	0.791	S	S	*	*			trans	64.9	101.9	145.2	-69.1	19.3	0	0	0	120.5
265	T	38.4	Very low	33.9	Very low	134 Å²	134	146.2 Å²	146.2	82%	0.822	79%	0.791	S	S	*	*			trans	-38.8	141	136.5	53.2	0	0	0	0	114.7
266	D	28.5	Very low	33.9	Very low	120 Å²	120	144.1 Å²	144.1	64%	0.642	78%	0.784	S	S	*	*			trans	-138.8	119.3	135.6	-177.2	44.2	0	0	0	108.5	R268	D266-R268 IonicContact OD1-NH2 3.68Å; D266-R268 IonicContact OD2-CZ 2.71Å; D266-R268 IonicContact OD2-NH2 2.68Å; D266-R268 PolarHBondContact OD2-NH2 2.92Å
267	P	42.1	Very low	34.3	Very low	105 Å²	105	148.1 Å²	148.1	68%	0.682	79%	0.789	S	S	*	*			trans	-85.4	130.8	-177.9	32.4	-32.6	0	0	0	111.5
268	R	36.7	Very low	34.3	Very low	196 Å²	196	148.4 Å²	148.4	74%	0.74	78%	0.78	S	S	*	*			trans	-174.7	97.2	154.7	-104.5	163.3	-60	160.9	6.7	110.4	D266	D266-R268 IonicContact OD1-NH2 3.68Å; D266-R268 IonicContact OD2-CZ 2.71Å; D266-R268 IonicContact OD2-NH2 2.68Å; D266-R268 PolarHBondContact OD2-NH2 2.92Å
269	Y	33.3	Very low	34.9	Very low	223 Å²	223	147.9 Å²	147.9	88%	0.875	76%	0.758	S	S	*	*				-163.6	147.5	115.8	-112.6	-85.9	0	0	0	107.6
270	K	44.3	Very low	35.3	Very low	176 Å²	176	143.7 Å²	143.7	77%	0.765	74%	0.742	S	S	*	*			trans	-101.4	138	158.9	-87.8	-166.7	166.5	-150.5	0	106.1
271	D	31.9	Very low	35.7	Very low	156 Å²	156	144.6 Å²	144.6	83%	0.834	74%	0.742	S	S	*	*			trans	-143	170	137.6	-80.6	-53.1	0	0	0	106.7
272	E	47	Very low	36.1	Very low	172 Å²	172	147.8 Å²	147.8	80%	0.804	73%	0.734	S	S	*	*			trans	-95.3	-147.5	-170.6	-60.5	-173	145.1	0	0	111.5
273	D	39.4	Very low	36.6	Very low	161 Å²	161	144.6 Å²	144.6	86%	0.861	73%	0.733	S	S	*	*			trans	73.4	54.9	-180	-54.4	-10.8	0	0	0	116.6
274	G	33.8	Very low	37.4	Very low	78 Å²	78	138.5 Å²	138.5	80%	0.804	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-80.6	121.2	161.4	0	0	0	0	0	111.7
275	F	34.4	Very low	38.3	Very low	199 Å²	199	137.7 Å²	137.7	87%	0.873	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-67.8	131.3	164.2	-92.6	-117.9	0	0	0	109.6	I277	F275-I277 PolarHBondContact O-N 2.68Å
276	D	33.9	Very low	38.5	Very low	163 Å²	163	133.7 Å²	133.7	87%	0.872	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-65.5	119.6	158.1	-70.1	-46.2	0	0	0	107.9
277	I	39.1	Very low	39	Very low	149 Å²	149	133.2 Å²	133.2	76%	0.764	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-77.2	124.5	172.8	-64.3	173.9	0	0	0	107.1	F275 D279	F275-I277 PolarHBondContact O-N 2.68Å; I277-D279 PolarHBondContact O-N 2.7Å; I277-D279 VanDerWaalsContact O-N 3.09Å
278	D	36.8	Very low	38.6	Very low	139 Å²	139	137.2 Å²	137.2	74%	0.743	68%	0.68	S	S	*	*			trans	-72.4	103.9	177.1	-155.1	-8.8	0	0	0	108.9	S280	D278-S280 PolarHBondContact O-N 2.77Å
279	D	40.5	Very low	38.5	Very low	69 Å²	69	134.1 Å²	134.1	37%	0.369	68%	0.677	S	S	.	*			trans	-77.7	23.4	-169.3	-148.6	35.4	0	0	0	111.9	R195 I277	R195-D279 IonicContact CZ-OD2 3.17Å; R195-D279 IonicContact NH1-OD2 2.97Å; R195-D279 PolarHBondContact NH1-OD2 2.76Å; R195-D279 IonicContact NH2-OD2 2.77Å; R195-D279 PolarHBondContact NH2-OD2 2.79Å; I277-D279 PolarHBondContact O-N 2.7Å; I277-D279 VanDerWaalsContact O-N 3.09Å
280	S	39	Very low	38.4	Very low	69 Å²	69	132.4 Å²	132.4	48%	0.483	67%	0.674	S	S	.	*			trans	-84.6	-22.3	-159.9	61.3	0	0	0	0	116.3	D278 Y282	D278-S280 PolarHBondContact O-N 2.77Å; S280-Y282 PolarHBondContact O-N 2.73Å
281	D	37	Very low	37.9	Very low	144 Å²	144	130 Å²	130	77%	0.77	68%	0.677	S	S	*	*			trans	-96.2	10.2	-161.7	-79.3	27.8	0	0	0	114.4
282	Y	39	Very low	37.7	Very low	133 Å²	133	131.8 Å²	131.8	52%	0.522	68%	0.677	S	S	.	*			trans	-100.3	78	171.8	-69.9	-80.1	0	0	0	111.5	L220 S280 V284	L220-Y282 HydrophobicContact CD2-CD1 4.35Å; L220-Y282 HydrophobicContact CD2-CD2 3.49Å; L220-Y282 VanDerWaalsContact CD2-CD2 3.49Å; L220-Y282 HydrophobicContact CD2-CE1 4.35Å; L220-Y282 HydrophobicContact CD2-CE2 3.48Å; L220-Y282 VanDerWaalsContact CD2-CE2 3.48Å; L220-Y282 HydrophobicContact CD2-CG 3.95Å; S280-Y282 PolarHBondContact O-N 2.73Å; Y282-V284 PolarHBondContact O-N 2.8Å
283	D	40.3	Very low	37.2	Very low	140 Å²	140	129.8 Å²	129.8	75%	0.749	68%	0.679	S	S	*	*			trans	-61.1	106.8	167.8	-101	-30.2	0	0	0	109.8	F285	D283-F285 WeakPolarHBondContact O-CD1 3.4Å
284	V	43.8	Very low	36.7	Very low	43 Å²	43	125.4 Å²	125.4	26%	0.261	67%	0.672	S	S	.	*			trans	-81.5	115.3	177.3	171	0	0	0	0	109.7	Y193 L216 K217 Y282	Y193-V284 HydrophobicContact CE1-CG1 4.49Å; L216-V284 HydrophobicContact CD1-CG1 3.4Å; L216-V284 VanDerWaalsContact CD1-CG1 3.4Å; L216-V284 HydrophobicContact CG-CG1 3.89Å; K217-V284 WeakPolarHBondContact O-CA 3.23Å; K217-V284 WeakPolarHBondContact O-CG1 3.26Å; Y282-V284 PolarHBondContact O-N 2.8Å
285	F	45.2	Very low	36.5	Very low	123 Å²	123	130.2 Å²	130.2	54%	0.539	68%	0.678	S	S	.	*	B	Isolated β-bridge	trans	-130.6	166.3	-176.9	58.6	-99.3	0	0	0	114	K217 D283	K217-F285 HydrophobicContact CB-CE2 4.46Å; K217-F285 WeakPolarHBondContact CB-O 3.45Å; K217-F285 HydrophobicContact CD-CE2 4.46Å; K217-F285 PolarHBondContact N-O 2.85Å; K217-F285 PolarHBondContact O-N 3.36Å; D283-F285 WeakPolarHBondContact O-CD1 3.4Å
286	I	41.5	Very low	36.1	Very low	50 Å²	50	124.3 Å²	124.3	26%	0.256	67%	0.672	S	S	.	*			trans	-111	140.3	-176.9	-54.1	175.8	0	0	0	109.8	I205 E207 I209 M214	I205-I286 HydrophobicContact CG2-CD1 3.83Å; E207-I286 HydrophobicContact CB-CD1 3.85Å; E207-I286 HydrophobicContact CG-CD1 4.31Å; I209-I286 HydrophobicContact CD1-CD1 3.61Å; M214-I286 HydrophobicContact CE-CD1 3.75Å; M214-I286 HydrophobicContact CE-CG1 3.89Å
287	E	40.2	Very low	35.9	Very low	110 Å²	110	126.1 Å²	126.1	51%	0.514	68%	0.676	S	S	.	*			trans	-119.2	114.6	171.3	-171	177.3	-166.6	0	0	109.9	K217 L289	K217-E287 HydrophobicContact CD-CB 4.28Å; K217-E287 WeakPolarHBondContact CE-OE2 3.49Å; K217-E287 IonicContact NZ-OE2 2.84Å; K217-E287 PolarHBondContact NZ-OE2 3.17Å; E287-L289 PolarHBondContact O-N 3.48Å
288	E	34.3	Very low	35.3	Very low	188 Å²	188	125.8 Å²	125.8	88%	0.879	68%	0.675	S	S	*	*			trans	-73.2	107.6	-179.5	-75.9	-163.8	145.6	0	0	112.4	K290	E288-K290 PolarHBondContact O-N 2.88Å
289	L	33.8	Very low	34.8	Very low	131 Å²	131	126.9 Å²	126.9	69%	0.686	68%	0.681	S	S	*	*			trans	-74.1	113.9	170.4	-71.7	172.3	0	0	0	111.3	V215 E287	V215-L289 HydrophobicContact CG2-CD1 4.34Å; E287-L289 PolarHBondContact O-N 3.48Å
290	K	31.3	Very low	34.2	Very low	188 Å²	188	127.3 Å²	127.3	82%	0.817	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-61.2	142.6	167.4	-70.9	175.5	-178.7	169.2	0	110.4	E288	E288-K290 PolarHBondContact O-N 2.88Å
291	P	32.8	Very low	33.6	Very low	125 Å²	125	134.5 Å²	134.5	81%	0.812	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-64.8	142.7	-172.5	25.1	-34.8	0	0	0	113.1
292	F	28.1	Very low	33.1	Very low	194 Å²	194	133.3 Å²	133.3	85%	0.851	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-64.6	143.1	177.6	-80.4	-91.9	0	0	0	112.5
293	P	36	Very low	32.5	Very low	130 Å²	130	135.1 Å²	135.1	84%	0.844	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-79.4	131.7	179.8	31.4	-34.2	0	0	0	112.3
294	G	29.5	Very low	31.7	Very low	69 Å²	69	135.1 Å²	135.1	71%	0.711	74%	0.74	S	S	*	*			trans	-152.4	89.6	-177.9	0	0	0	0	0	115.1
295	I	29.2	Very low	30.7	Very low	179 Å²	179	144.5 Å²	144.5	92%	0.918	77%	0.771	S	S	*	*			trans	45.6	103.3	150.4	-49.6	175	0	0	0	116.6
296	G	27.8	Very low	29.9	Very low	74 Å²	74	143.2 Å²	143.2	76%	0.763	78%	0.777	S	S	*	*			trans	-103.1	-171.9	178.2	0	0	0	0	0	115.6
297	E	28.1	Very low	29.3	Very low	201 Å²	201	149.4 Å²	149.4	94%	0.939	81%	0.805	S	S	*	*			trans	-148.1	-173.7	158.8	-132.5	179.7	-154.4	0	0	111.3
298	N	27.1	Very low	29.6	Very low	142 Å²	142	150 Å²	150	76%	0.759	82%	0.818	S	S	*	*			trans	-106.9	165.3	-148.8	-104	-49.3	0	0	0	118
299	N	26.4	Very low	29.1	Very low	162 Å²	162	144.2 Å²	144.2	87%	0.866	81%	0.81	S	S	*	*			trans	78.8	121.9	158.6	-63.8	-43.7	0	0	0	120.4
300	G	27	Very low	29.3	Very low	79 Å²	79	143.8 Å²	143.8	81%	0.814	81%	0.814	S	S	*	*			trans	171.5	75.1	165.3	0	0	0	0	0	114.9	S302	G300-S302 PolarHBondContact O-N 2.92Å
301	K	28.3	Very low	29.8	Very low	220 Å²	220	138.1 Å²	138.1	96%	0.957	80%	0.797	S	S	*	*			trans	-73.9	119.4	173.3	-77.8	-174.5	179.1	179.1	0	111.2
302	S	26.2	Very low	29.6	Very low	119 Å²	119	137.6 Å²	137.6	83%	0.832	80%	0.796	S	S	*	*			trans	-150.3	139.9	154.7	-169.3	0	0	0	0	110.5	G300	G300-S302 PolarHBondContact O-N 2.92Å
303	Q	25.1	Very low	29.5	Very low	170 Å²	170	131.1 Å²	131.1	79%	0.794	78%	0.784	S	S	*	*			trans	-118.6	141.1	166.8	-70.5	-169.5	-0.3	0	0	108.6
304	L	24	Very low	29.1	Very low	140 Å²	140	131.6 Å²	131.6	73%	0.733	77%	0.769	S	S	*	*				170.6	127.4	116.5	-90.9	159.6	0	0	0	113.3
305	R	23.5	Very low	29.1	Very low	240 Å²	240	131.3 Å²	131.3	91%	0.906	75%	0.751	S	S	*	*			trans	69.5	143.1	148.6	-69.5	177.9	175.4	-169.6	-3.1	120.9
306	S	27.6	Very low	29	Very low	96 Å²	96	126.3 Å²	126.3	67%	0.671	73%	0.729	S	S	*	*			trans	-91.6	157.8	-177.8	50.7	0	0	0	0	113.9
307	H	29.6	Very low	29.1	Very low	180 Å²	180	126.6 Å²	126.6	83%	0.833	72%	0.716	S	S	*	*				-170.4	165.1	116.6	-103.2	58.2	0	0	0	112.1
308	P	45.2	Very low	29.1	Very low	122 Å²	122	123.3 Å²	123.3	79%	0.792	70%	0.695	S	S	*	*			trans	-129.5	178.7	-145.1	45.1	-34.6	0	0	0	118.5
309	G	24.5	Very low	29.1	Very low	68 Å²	68	127.1 Å²	127.1	70%	0.701	70%	0.699	S	S	*	*			trans	114.5	179.6	161.5	0	0	0	0	0	114.6
310	P	38.4	Very low	29.1	Very low	121 Å²	121	126.1 Å²	126.1	79%	0.786	69%	0.691	S	S	*	*			cis	-138	-141.5	-8.3	33.2	-6.7	0	0	0	112.1
311	P	41.5	Very low	29.1	Very low	69 Å²	69	130.3 Å²	130.3	45%	0.448	70%	0.695	S	S	.	*				-134.1	159.9	-81.8	39.6	-23.4	0	0	0	117.4
312	S	28.4	Very low	29.1	Very low	114 Å²	114	123.3 Å²	123.3	80%	0.797	69%	0.685	S	S	*	*			trans	-163.1	156	132	65.5	0	0	0	0	110.5
313	G	26	Very low	29.2	Very low	58 Å²	58	127.8 Å²	127.8	60%	0.598	69%	0.69	S	S	*	*	S	Bend	cis	-158.4	21.8	10.7	0	0	0	0	0	119.3
314	R	26.9	Very low	29.3	Very low	141 Å²	141	126.1 Å²	126.1	53%	0.532	69%	0.691	S	S	.	*			trans	-162	121.2	151.8	-115.9	172.9	-167.8	-160.7	1.7	112.8	G115	G115-R314 PolarHBondContact O-NH2 3.25Å
315	N	29.4	Very low	29.5	Very low	63 Å²	63	125 Å²	125	34%	0.337	69%	0.692	S	S	.	*			trans	-114.1	132.5	-161.7	-59.3	5.4	0	0	0	112.4	V317	N315-V317 HydrophobicContact CB-CG2 4.27Å
316	V	27.7	Very low	30.1	Very low	73 Å²	73	118.7 Å²	118.7	44%	0.442	68%	0.682	S	S	.	*			trans	-120.1	118.4	149.2	-177.9	0	0	0	0	105.8	V112 Y318	V112-V316 HydrophobicContact CG2-CG2 4.18Å; V316-Y318 HydrophobicContact CG1-CE1 4.09Å; V316-Y318 HydrophobicContact CG1-CE2 4.24Å
317	V	29.6	Very low	30	Very low	81 Å²	81	121 Å²	121	49%	0.491	69%	0.686	S	S	.	*			trans	-123.7	113.3	-176.5	175.2	0	0	0	0	109	N315 R319	N315-V317 HydrophobicContact CB-CG2 4.27Å; V317-R319 HydrophobicContact CG1-CG 4.46Å
318	Y	28.6	Very low	30	Very low	131 Å²	131	119.4 Å²	119.4	51%	0.514	69%	0.689	S	S	.	*			trans	-81.4	132.9	176	-57	-70.5	0	0	0	110.6	M98 V316	M98-Y318 HydrophobicContact CE-CD1 3.44Å; M98-Y318 VanDerWaalsContact CE-CD1 3.44Å; M98-Y318 HydrophobicContact CE-CE1 3.85Å; M98-Y318 HydrophobicContact CE-CG 4.28Å; M98-Y318 HydrophobicContact SD-CD1 4.24Å; M98-Y318 HydrophobicContact SD-CE1 4.02Å; V316-Y318 HydrophobicContact CG1-CE1 4.09Å; V316-Y318 HydrophobicContact CG1-CE2 4.24Å
319	R	27.9	Very low	29.1	Very low	223 Å²	223	118.6 Å²	118.6	84%	0.842	68%	0.682	S	S	*	*			trans	-132	113.1	172	-76.8	-175.9	172	177.2	-1.8	110.5	V317	V317-R319 HydrophobicContact CG1-CG 4.46Å
320	M	25.3	Very low	29.2	Very low	140 Å²	140	122.7 Å²	122.7	69%	0.69	69%	0.688	S	S	*	*			trans	-97.7	132.9	163.5	-72.9	-165.3	-179.6	0	0	110
321	N	27.3	Very low	28.8	Very low	168 Å²	168	125.8 Å²	125.8	90%	0.898	69%	0.692	S	S	*	*			trans	-104.8	99.5	171.7	-84.3	-6.2	0	0	0	110
322	G	29.4	Very low	28.5	Very low	73 Å²	73	128 Å²	128	75%	0.753	71%	0.707	S	S	*	*			trans	-94.6	144.5	169	0	0	0	0	0	112.2
323	K	26.5	Very low	28.5	Very low	213 Å²	213	129.5 Å²	129.5	93%	0.926	71%	0.71	S	S	*	*			trans	-90.5	141.3	168	-88.6	-171.6	171.8	-175.8	0	110.3
324	V	27.9	Very low	28.4	Very low	135 Å²	135	133.7 Å²	133.7	82%	0.818	72%	0.719	S	S	*	*			trans	-128.7	128.7	179.1	177.8	0	0	0	0	110.8
325	P	28.4	Very low	28.4	Very low	116 Å²	116	133.5 Å²	133.5	75%	0.753	73%	0.733	S	S	*	*			trans	-98.5	164	155.2	3.9	17.8	0	0	0	111.5
326	P	36.9	Very low	28	Very low	107 Å²	107	136.4 Å²	136.4	70%	0.695	75%	0.754	S	S	*	*			trans	-118.9	170.3	-141.8	42.3	-35	0	0	0	117.8
327	N	25	Very low	28.8	Very low	144 Å²	144	138.2 Å²	138.2	77%	0.77	77%	0.767	S	S	*	*			trans	61.3	125.6	153.8	-67	7.8	0	0	0	121.1
328	V	29.1	Very low	28.6	Very low	147 Å²	147	140.5 Å²	140.5	89%	0.891	79%	0.786	S	S	*	*				-140.9	152.5	115.1	176.9	0	0	0	0	107.8
329	T	27	Very low	28.4	Very low	106 Å²	106	139.1 Å²	139.1	65%	0.65	80%	0.796	S	S	*	*			trans	-107.2	159	178	50.9	0	0	0	0	112
330	D	26.8	Very low	28.4	Very low	154 Å²	154	135.2 Å²	135.2	82%	0.824	79%	0.791	S	S	*	*				-179.5	-174.4	113.1	-91	2.9	0	0	0	113
331	Q	28.7	Very low	28.4	Very low	185 Å²	185	137.2 Å²	137.2	86%	0.864	80%	0.796	S	S	*	*			trans	-114.1	168.3	-150.6	-95.5	-168.2	-9.3	0	0	115.9
332	P	36.7	Very low	28.3	Very low	116 Å²	116	133.3 Å²	133.3	75%	0.753	78%	0.782	S	S	*	*			trans	-92.8	176	-173.4	39.2	-37.8	0	0	0	113.9
333	V	27.1	Very low	28.2	Very low	145 Å²	145	135.7 Å²	135.7	88%	0.879	78%	0.777	S	S	*	*			trans	-139	131.6	166.4	-175.7	0	0	0	0	109.8
334	D	24.2	Very low	28.1	Very low	146 Å²	146	133.5 Å²	133.5	78%	0.781	77%	0.768	S	S	*	*			trans	-77.5	167.1	172.8	-76.9	-67.6	0	0	0	112.9
335	V	26	Very low	28	Very low	137 Å²	137	132.2 Å²	132.2	83%	0.83	76%	0.76	S	S	*	*				174.8	140.2	116.7	151.3	0	0	0	0	110.5
336	T	22.4	Very low	27.9	Very low	125 Å²	125	133 Å²	133	77%	0.767	76%	0.759	S	S	*	*			trans	-109.5	-157.6	-179.5	53.2	0	0	0	0	111
337	P	44.5	Very low	27.4	Very low	111 Å²	111	134.6 Å²	134.6	72%	0.721	76%	0.76	S	S	*	*				-122.4	177.4	-102.4	39.3	-23	0	0	0	114
338	S	24.8	Very low	27.4	Very low	128 Å²	128	133.1 Å²	133.1	90%	0.895	76%	0.756	S	S	*	*			trans	-172.7	163	141.7	24.2	0	0	0	0	112.9
339	S	25.4	Very low	27.1	Very low	103 Å²	103	134.8 Å²	134.8	72%	0.72	75%	0.752	S	S	*	*			trans	-111.6	173.2	-179.5	51.1	0	0	0	0	111.4
340	I	26.9	Very low	26.9	Very low	141 Å²	141	136.3 Å²	136.3	72%	0.723	76%	0.761	S	S	*	*			trans	161.3	118.8	131	-86.3	161.3	0	0	0	113.6
341	F	25.7	Very low	27.1	Very low	181 Å²	181	135.3 Å²	135.3	79%	0.794	76%	0.76	S	S	*	*			trans	58	172.7	145.3	-75.1	-109	0	0	0	119.9
342	S	24.6	Very low	27.7	Very low	87 Å²	87	131.9 Å²	131.9	61%	0.608	75%	0.754	S	S	*	*			cis	-153.5	139.5	5.4	40.1	0	0	0	0	112.6
343	D	26.6	Very low	27.3	Very low	122 Å²	122	130.7 Å²	130.7	65%	0.652	75%	0.748	S	S	*	*			trans	53.4	-176.9	134	-44.4	-32.5	0	0	0	119.8
344	F	25.4	Very low	27.2	Very low	167 Å²	167	130.5 Å²	130.5	73%	0.732	74%	0.738	S	S	*	*			cis	-153.1	125.6	8.3	-121.9	-76.1	0	0	0	110
345	T	26.1	Very low	27.2	Very low	108 Å²	108	132.8 Å²	132.8	66%	0.663	74%	0.736	S	S	*	*			trans	54.6	165.8	139.7	61.8	0	0	0	0	122.2
346	D	26.2	Very low	27.2	Very low	134 Å²	134	131.1 Å²	131.1	72%	0.717	73%	0.73	S	S	*	*			cis	-165.7	-179.6	-4.1	-132	-41.2	0	0	0	115.3
347	L	25.3	Very low	27.4	Very low	139 Å²	139	129.4 Å²	129.4	73%	0.728	72%	0.723	S	S	*	*			trans	74.5	109.3	143.7	-70.7	157.1	0	0	0	123.8
348	V	25	Very low	26.5	Very low	113 Å²	113	130 Å²	130	69%	0.685	73%	0.725	S	S	*	*				88.6	116.3	118.4	167.9	0	0	0	0	123.9
349	F	24	Very low	26.6	Very low	182 Å²	182	129.2 Å²	129.2	80%	0.798	72%	0.715	S	S	*	*			trans	21.6	133.9	144.4	-64.9	-102.8	0	0	0	122.4
350	T	23.3	Very low	26.7	Very low	139 Å²	139	130.7 Å²	130.7	85%	0.853	72%	0.715	S	S	*	*				-162.8	148.9	105.4	9.7	0	0	0	0	113.9
351	V	30.8	Very low	26.7	Very low	132 Å²	132	129.7 Å²	129.7	80%	0.8	72%	0.715	S	S	*	*			trans	-148.5	138.8	174.4	-173.8	0	0	0	0	103
352	P	41.4	Very low	27.7	Very low	113 Å²	113	126.2 Å²	126.2	73%	0.734	71%	0.711	S	S	*	*			cis	-146.5	-176.1	46.9	41.4	-20.5	0	0	0	116.4
353	S	26.7	Very low	27.9	Very low	91 Å²	91	127.6 Å²	127.6	64%	0.636	72%	0.716	S	S	*	*				148.7	147.3	102.3	-148.1	0	0	0	0	114.1
354	E	25.6	Very low	28	Very low	142 Å²	142	128.1 Å²	128.1	66%	0.664	72%	0.723	S	S	*	*			trans	66.8	148.3	147	-85.1	-173.5	165.9	0	0	120.2
355	R	25.4	Very low	28	Very low	194 Å²	194	124.2 Å²	124.2	73%	0.732	72%	0.722	S	S	*	*			cis	-164.2	170	-13.8	-157.4	-171.1	-97.5	-153.4	-0.7	108.2
356	S	25.8	Very low	29	Very low	101 Å²	101	124.8 Å²	124.8	71%	0.706	73%	0.728	S	S	*	*			trans	68.6	151.7	142.5	51.7	0	0	0	0	119.9
357	S	26.2	Very low	29.2	Very low	90 Å²	90	122.8 Å²	122.8	63%	0.629	72%	0.724	S	S	*	*			cis	-173.8	136.8	-18.3	50.5	0	0	0	0	111.7
358	T	26.1	Very low	29.3	Very low	123 Å²	123	121.8 Å²	121.8	76%	0.755	72%	0.724	S	S	*	*			trans	53.6	-173.2	141.9	66.3	0	0	0	0	116.7
359	T	27	Very low	29.4	Very low	111 Å²	111	121.9 Å²	121.9	68%	0.681	73%	0.725	S	S	*	*			cis	-159.1	161.4	7.6	-7.9	0	0	0	0	105.7
360	D	26.1	Very low	29.6	Very low	135 Å²	135	118.9 Å²	118.9	72%	0.722	72%	0.722	S	S	*	*			cis	-157	168.6	5.1	-148.5	-22.7	0	0	0	112.2
361	T	27.4	Very low	29.8	Very low	120 Å²	120	117.3 Å²	117.3	74%	0.736	72%	0.716	S	S	*	*			trans	-63.5	-167.8	158.4	6.3	0	0	0	0	112.6
362	P	46.5	Very low	30.6	Very low	107 Å²	107	116.5 Å²	116.5	70%	0.695	71%	0.714	S	S	*	*			cis	-130.9	-163.5	16.8	34.4	-8.4	0	0	0	113.5
363	T	28.7	Very low	30.8	Very low	117 Å²	117	116.6 Å²	116.6	72%	0.718	71%	0.714	S	S	*	*			cis	-163.6	167.5	29.6	-20.3	0	0	0	0	107.6
364	T	28.8	Very low	30.8	Very low	132 Å²	132	118.5 Å²	118.5	81%	0.81	73%	0.728	S	S	*	*			cis	-154.9	171.4	15.7	-37.7	0	0	0	0	110.9
365	A	26	Very low	31	Very low	86 Å²	86	116 Å²	116	71%	0.711	73%	0.732	S	S	*	*			trans	-97	-165	168.2	0	0	0	0	0	111.3
366	P	47.3	Very low	31.4	Very low	120 Å²	120	113 Å²	113	78%	0.779	74%	0.735	S	S	*	*			cis	-128.9	-178.8	23.3	39.9	-21.2	0	0	0	115.3
367	S	29.2	Very low	31.5	Very low	92 Å²	92	115.2 Å²	115.2	64%	0.643	75%	0.745	S	S	*	*			cis	-172.6	-174.9	-26.6	60	0	0	0	0	111.8
368	T	27.6	Very low	31.9	Very low	117 Å²	117	115.3 Å²	115.3	72%	0.718	75%	0.751	S	S	*	*			trans	81.4	114.8	145.5	37.2	0	0	0	0	123.7
369	T	27.1	Very low	32.2	Very low	116 Å²	116	115.1 Å²	115.1	71%	0.712	75%	0.754	S	S	*	*			trans	83.4	102.3	134.9	48.4	0	0	0	0	124.4
370	T	28.3	Very low	32.5	Very low	119 Å²	119	117 Å²	117	73%	0.73	76%	0.759	S	S	*	*				61.7	98	128.5	57.7	0	0	0	0	123.1
371	S	27.7	Very low	32.7	Very low	105 Å²	105	116.3 Å²	116.3	73%	0.734	76%	0.763	S	S	*	*				27	158.7	115.9	66	0	0	0	0	122.8
372	P	46.8	Very low	32.8	Very low	116 Å²	116	116.8 Å²	116.8	75%	0.753	77%	0.766	S	S	*	*			cis	-132.4	-153.4	-48.8	43.4	-26.4	0	0	0	109.1
373	P	45.8	Very low	32.5	Very low	114 Å²	114	119.4 Å²	119.4	74%	0.74	77%	0.772	S	S	*	*			cis	-119	174	-28.7	40.9	-28.1	0	0	0	112.8
374	S	27	Very low	32.8	Very low	131 Å²	131	118.5 Å²	118.5	92%	0.916	77%	0.771	S	S	*	*			trans	-166.2	164.9	152.6	-87.9	0	0	0	0	111.6
375	A	30.1	Very low	33.4	Very low	91 Å²	91	118 Å²	118	75%	0.752	77%	0.77	S	S	*	*			trans	-97.2	154.8	-164.7	0	0	0	0	0	115.4
376	T	33.8	Very low	34.3	Very low	131 Å²	131	120.3 Å²	120.3	80%	0.804	76%	0.761	S	S	*	*			trans	4.5	121.4	158.1	52.7	0	0	0	0	119.6
377	T	28.9	Very low	33.9	Very low	147 Å²	147	124.3 Å²	124.3	90%	0.902	77%	0.766	S	S	*	*				-153.2	126.2	121.4	-9.1	0	0	0	0	109.5
378	A	33.5	Very low	34.9	Very low	91 Å²	91	122 Å²	122	75%	0.752	76%	0.756	S	S	*	*			trans	-88.8	140.8	171.5	0	0	0	0	0	109.6	I380	A378-I380 PolarHBondContact O-N 3.05Å
379	S	32.2	Very low	35.7	Very low	119 Å²	119	126 Å²	126	83%	0.832	77%	0.767	S	S	*	*			trans	-74.9	110.6	178.1	52.2	0	0	0	0	110.9
380	I	33.3	Very low	36.9	Very low	152 Å²	152	126.9 Å²	126.9	78%	0.779	77%	0.766	S	S	*	*			trans	-71.9	126.7	170.8	-63.2	171.2	0	0	0	108.9	A378 T382	A378-I380 PolarHBondContact O-N 3.05Å; I380-T382 PolarHBondContact O-N 2.04Å; I380-T382 VanDerWaalsContact O-N 3.09Å
381	C	30.7	Very low	38.2	Very low	120 Å²	120	124.7 Å²	124.7	81%	0.811	75%	0.754	S	S	*	*			trans	-72	97.1	165.4	-73.5	0	0	0	0	109.5	I383	C381-I383 PolarHBondContact O-N 2.88Å; C381-I383 VanDerWaalsContact O-N 3.11Å
382	T	30.1	Very low	40.1	Very low	130 Å²	130	124.3 Å²	124.3	80%	0.798	74%	0.736	S	S	*	*			trans	-64.7	109.4	170	46.5	0	0	0	0	110.3	I380	I380-T382 PolarHBondContact O-N 2.04Å; I380-T382 VanDerWaalsContact O-N 3.09Å
383	I	39.6	Very low	41.1	Very low	161 Å²	161	120.2 Å²	120.2	83%	0.826	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-58.3	138.7	166.1	-60.9	171.5	0	0	0	108.1	C381	C381-I383 PolarHBondContact O-N 2.88Å; C381-I383 VanDerWaalsContact O-N 3.11Å
384	S	35.3	Very low	42.4	Very low	98 Å²	98	118.3 Å²	118.3	69%	0.685	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-68.5	129.9	176.7	46	0	0	0	0	110.3	W386	S384-W386 PolarHBondContact O-N 2.81Å
385	P	41.9	Very low	44.8	Very low	123 Å²	123	116.4 Å²	116.4	80%	0.799	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-62	124.9	177.6	25.4	-33.5	0	0	0	109.5
386	W	44.4	Very low	47.1	Very low	134 Å²	134	114.4 Å²	114.4	51%	0.508	64%	0.643	S	S	.	*	P	Polyproline II helix	trans	-73.2	159.6	-176.3	-164.5	74.6	0	0	0	111.3	S384 G388 I390	S384-W386 PolarHBondContact O-N 2.81Å; W386-G388 VanDerWaalsContact CE3-N 3.34Å; W386-G388 VanDerWaalsContact CH2-CA 3.48Å; W386-G388 VanDerWaalsContact CZ3-C 3.48Å; W386-I390 WeakPolarHBondContact CH2-O 3.46Å; W386-I390 WeakPolarHBondContact CZ3-O 3.25Å
387	K	39	Very low	49.4	Very low	203 Å²	203	110.2 Å²	110.2	88%	0.883	62%	0.622	S	S	*	*			trans	-144.7	17.9	-159	-118.2	-173.9	-177.3	-173.1	0	115.8
388	G	48.8	Very low	51.8	Low	43 Å²	43	105 Å²	105	44%	0.443	59%	0.591	S	S	.	*	S	Bend	trans	-88.5	176.3	168.6	0	0	0	0	0	112.1	W386	W386-G388 VanDerWaalsContact CE3-N 3.34Å; W386-G388 VanDerWaalsContact CH2-CA 3.48Å; W386-G388 VanDerWaalsContact CZ3-C 3.48Å
389	E	45.1	Very low	54.1	Low	201 Å²	201	108.3 Å²	108.3	94%	0.939	60%	0.596	S	S	*	*	S	Bend	trans	-88.3	-8	-168.9	-59.7	-179.9	146.8	0	0	114.4
390	I	51.8	Low	56.4	Low	135 Å²	135	107.9 Å²	107.9	69%	0.692	59%	0.585	S	S	*	*	S	Bend	trans	-124.9	117.2	-177.1	-55.3	175.1	0	0	0	108.6	W386	W386-I390 WeakPolarHBondContact CH2-O 3.46Å; W386-I390 WeakPolarHBondContact CZ3-O 3.25Å
391	P	57.2	Low	58.7	Low	74 Å²	74	101.2 Å²	101.2	48%	0.481	55%	0.551	S	S	.	*			trans	-55.1	152	177.5	-23.4	33.2	0	0	0	112.6	D395 L396	P391-D395 HydrophobicContact CB-CB 4.02Å; P391-L396 HydrophobicContact CB-CD2 3.87Å; P391-L396 HydrophobicContact CB-CG 4.17Å; P391-L396 HydrophobicContact CG-CD2 4.19Å
392	R	67.1	Low	61.1	Low	96 Å²	96	101.6 Å²	101.6	36%	0.362	55%	0.55	S	S	.	.			trans	-79.8	162.6	173.1	-54.6	-177.6	177.4	-166.1	3.2	109.7	Y394 D395 L396	R392-Y394 VanDerWaalsContact C-N 3.26Å; R392-Y394 HydrophobicContact CB-CD2 4.11Å; R392-Y394 HydrophobicContact CB-CE1 4.38Å; R392-Y394 HydrophobicContact CB-CE2 3.83Å; R392-Y394 WeakPolarHBondContact CD-OH 3.05Å; R392-Y394 HydrophobicContact CG-CE2 4.28Å; R392-Y394 PolarHBondContact NH1-OH 3.42Å; R392-Y394 PolarHBondContact O-N 2.96Å; R392-D395 VanDerWaalsContact CB-OD2 3.29Å; R392-D395 WeakPolarHBondContact CB-OD2 3.3Å; R392-D395 PolarHBondContact N-OD2 3.34Å; R392-D395 WeakPolarHBondContact O-CA 3.4Å; R392-D395 WeakPolarHBondContact O-CB 3.33Å; R392-D395 PolarHBondContact O-N 3.47Å; R392-L396 PolarHBondContact O-N 3.49Å
393	V	68.4	Low	63.5	Low	30 Å²	30	96.7 Å²	96.7	18%	0.182	52%	0.52	C	S	.	.	G	3₁₀ helix	trans	-53.7	-44.1	-179	-174.9	0	0	0	0	111.7	D395 L396 T401 S418 D429	V393-D395 PolarHBondContact O-N 2.96Å; V393-L396 WeakPolarHBondContact O-CB 3.34Å; V393-L396 PolarHBondContact O-N 2.79Å; V393-T401 HydrophobicContact CG1-CG2 3.55Å; V393-S418 CarbonylContact C-O 3.4Å; V393-D429 HydrophobicContact CB-CB 4.46Å; V393-D429 HydrophobicContact CG2-CB 4Å
394	Y	73.1	Confident	65.4	Low	74 Å²	74	90.2 Å²	90.2	29%	0.29	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-73.8	-0.5	176.4	37.3	-90.9	0	0	0	116	R392 G417 S418 D429	R392-Y394 VanDerWaalsContact C-N 3.26Å; R392-Y394 HydrophobicContact CB-CD2 4.11Å; R392-Y394 HydrophobicContact CB-CE1 4.38Å; R392-Y394 HydrophobicContact CB-CE2 3.83Å; R392-Y394 WeakPolarHBondContact CD-OH 3.05Å; R392-Y394 HydrophobicContact CG-CE2 4.28Å; R392-Y394 PolarHBondContact NH1-OH 3.42Å; R392-Y394 PolarHBondContact O-N 2.96Å; Y394-G417 WeakPolarHBondContact O-CA 3.44Å; Y394-S418 WeakPolarHBondContact CA-O 3.44Å; Y394-S418 PolarHBondContact N-O 3.01Å; Y394-D429 WeakPolarHBondContact CE1-OD2 3.21Å
395	D	76.4	Confident	67.1	Low	91 Å²	91	92.3 Å²	92.3	49%	0.487	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-98.7	-6.3	167.9	-49.6	-40.2	0	0	0	112	P391 R392 V393	P391-D395 HydrophobicContact CB-CB 4.02Å; R392-D395 VanDerWaalsContact CB-OD2 3.29Å; R392-D395 WeakPolarHBondContact CB-OD2 3.3Å; R392-D395 PolarHBondContact N-OD2 3.34Å; R392-D395 WeakPolarHBondContact O-CA 3.4Å; R392-D395 WeakPolarHBondContact O-CB 3.33Å; R392-D395 PolarHBondContact O-N 3.47Å; V393-D395 PolarHBondContact O-N 2.96Å
396	L	78.6	Confident	68.5	Low	49 Å²	49	89.6 Å²	89.6	26%	0.257	48%	0.478	S	S	.	.	S	Bend	trans	-105.4	158.3	-175.4	-65.4	173.9	0	0	0	112.9	P391 R392 V393 D400 G417 S418	P391-L396 HydrophobicContact CB-CD2 3.87Å; P391-L396 HydrophobicContact CB-CG 4.17Å; P391-L396 HydrophobicContact CG-CD2 4.19Å; R392-L396 PolarHBondContact O-N 3.49Å; V393-L396 WeakPolarHBondContact O-CB 3.34Å; V393-L396 PolarHBondContact O-N 2.79Å; L396-D400 HydrophobicContact CB-CB 4.32Å; L396-D400 HydrophobicContact CD2-CB 4.36Å; L396-G417 CarbonylContact O-C 3.54Å; L396-G417 VanDerWaalsContact O-CA 3.24Å; L396-G417 WeakPolarHBondContact O-CA 3.37Å; L396-S418 VanDerWaalsContact O-CB 3.31Å; L396-S418 WeakPolarHBondContact O-CB 3.41Å; L396-S418 PolarHBondContact O-N 3.19Å; L396-S418 PolarHBondContact O-OG 3.05Å
397	A	81.5	Confident	70.2	Confident	44 Å²	44	83.9 Å²	83.9	36%	0.364	46%	0.459	S	S	.	.			trans	-77.1	162.5	167.8	0	0	0	0	0	111.3	D399 D400 T401 S418	A397-D399 PolarHBondContact O-N 2.89Å; A397-D400 PolarHBondContact O-N 2.9Å; A397-D400 VanDerWaalsContact O-N 3.12Å; A397-T401 WeakPolarHBondContact O-CB 3.03Å; A397-T401 PolarHBondContact O-N 2.59Å; A397-T401 PolarHBondContact O-OG1 3.04Å; A397-T401 VanDerWaalsContact O-OG1 3.12Å; A397-S418 VanDerWaalsContact C-OG 3.24Å; A397-S418 PolarHBondContact O-OG 3.27Å
398	C	80.2	Confident	72.1	Confident	36 Å²	36	79 Å²	79	24%	0.243	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-64.8	-28.3	177.9	-86.6	0	0	0	0	113.7	D400 T401 C409 L410 S418	C398-D400 PolarHBondContact O-N 2.96Å; C398-T401 PolarHBondContact O-N 3.11Å; C398-C409 WeakPolarHBondContact CA-SG 3.06Å; C398-C409 HydrophobicContact CB-CB 3.76Å; C398-C409 WeakPolarHBondContact CB-SG 3.33Å; C398-C409 WeakPolarHBondContact SG-CB 3.49Å; C398-C409 CovalentContact SG-SG 2.05Å; C398-C409 PolarHBondContact SG-SG 2.89Å; C398-L410 PolarHBondContact SG-N 2.6Å; C398-S418 PolarHBondContact N-OG 3.06Å; C398-S418 VanDerWaalsContact SG-CB 3.52Å
399	D	81.3	Confident	73.7	Confident	162 Å²	162	78.6 Å²	78.6	87%	0.866	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-67.4	-23.1	177.3	-50.8	-46.6	0	0	0	112	A397	A397-D399 PolarHBondContact O-N 2.89Å
400	D	81.1	Confident	75.4	Confident	109 Å²	109	72.3 Å²	72.3	58%	0.583	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-99.7	-6.7	176.6	-58.9	-62.5	0	0	0	113.1	L396 A397 C398	L396-D400 HydrophobicContact CB-CB 4.32Å; L396-D400 HydrophobicContact CD2-CB 4.36Å; A397-D400 PolarHBondContact O-N 2.9Å; A397-D400 VanDerWaalsContact O-N 3.12Å; C398-D400 PolarHBondContact O-N 2.96Å
401	T	80.4	Confident	76.6	Confident	13 Å²	13	69.3 Å²	69.3	8%	0.08	39%	0.389	C	S	.	.			trans	-99.7	107.1	-171.5	-76.8	0	0	0	0	111.8	V393 A397 C398 C403 C409 S418	V393-T401 HydrophobicContact CG1-CG2 3.55Å; A397-T401 WeakPolarHBondContact O-CB 3.03Å; A397-T401 PolarHBondContact O-N 2.59Å; A397-T401 PolarHBondContact O-OG1 3.04Å; A397-T401 VanDerWaalsContact O-OG1 3.12Å; C398-T401 PolarHBondContact O-N 3.11Å; T401-C403 PolarHBondContact O-N 2.9Å; T401-C409 HydrophobicContact CG2-CB 4.35Å; T401-S418 PolarHBondContact OG1-OG 2.84Å
402	V	81.7	Confident	77.2	Confident	128 Å²	128	67.3 Å²	67.3	78%	0.776	37%	0.374	S	S	*	.			trans	-80.9	105.5	179.8	-175.8	0	0	0	0	111
403	C	81.3	Confident	77.1	Confident	27 Å²	27	72.5 Å²	72.5	18%	0.182	40%	0.395	C	S	.	.			trans	-98.8	155.3	165.7	-50.2	0	0	0	0	110.7	T401 C420	T401-C403 PolarHBondContact O-N 2.9Å; C403-C420 WeakPolarHBondContact CA-SG 3.45Å; C403-C420 HydrophobicContact CB-CB 3.9Å; C403-C420 WeakPolarHBondContact CB-SG 3.41Å; C403-C420 WeakPolarHBondContact SG-CA 3.38Å; C403-C420 WeakPolarHBondContact SG-CB 3.44Å; C403-C420 CovalentContact SG-SG 2.04Å; C403-C420 PolarHBondContact SG-SG 3.39Å
404	P	79.4	Confident	76.7	Confident	24 Å²	24	80.3 Å²	80.3	16%	0.156	43%	0.43	C	S	.	.			trans	-55.6	152.2	168.7	-25.8	34.5	0	0	0	112.2	D406 S407 S430 C431	P404-D406 VanDerWaalsContact CB-OD1 3.26Å; P404-D406 WeakPolarHBondContact CB-OD1 3.3Å; P404-D406 PolarHBondContact O-N 3.04Å; P404-D406 VanDerWaalsContact O-N 3.13Å; P404-S407 CarbonylContact O-C 3.58Å; P404-S407 PolarHBondContact O-N 3.36Å; P404-S430 VanDerWaalsContact CD-O 3.23Å; P404-S430 WeakPolarHBondContact CD-O 3.3Å; P404-C431 HydrophobicContact CG-CB 4.08Å
405	P	70.9	Confident	76.4	Confident	142 Å²	142	80.5 Å²	80.5	92%	0.922	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-27	178.8	-24	34.3	0	0	0	113.8	S407	P405-S407 VanDerWaalsContact C-N 3.3Å; P405-S407 PolarHBondContact O-N 2.91Å
406	D	71.4	Confident	75.8	Confident	66 Å²	66	79.5 Å²	79.5	35%	0.353	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	34.7	173	64.6	-45.8	0	0	0	112.4	P404 N423 R426	P404-D406 VanDerWaalsContact CB-OD1 3.26Å; P404-D406 WeakPolarHBondContact CB-OD1 3.3Å; P404-D406 PolarHBondContact O-N 3.04Å; P404-D406 VanDerWaalsContact O-N 3.13Å; D406-N423 VanDerWaalsContact O-CB 3.25Å; D406-N423 WeakPolarHBondContact O-CB 3.37Å; D406-N423 VanDerWaalsContact O-CG 3.26Å; D406-N423 PolarHBondContact O-ND2 2.96Å; D406-R426 IonicContact OD1-CZ 3.37Å; D406-R426 IonicContact OD1-NE 2.8Å; D406-R426 PolarHBondContact OD1-NE 3.43Å; D406-R426 IonicContact OD1-NH2 2.77Å; D406-R426 PolarHBondContact OD1-NH2 2.86Å; D406-R426 IonicContact OD2-CZ 3.66Å; D406-R426 IonicContact OD2-NE 3.68Å; D406-R426 PolarHBondContact OD2-NE 3.47Å; D406-R426 IonicContact OD2-NH2 2.79Å; D406-R426 PolarHBondContact OD2-NH2 2.66Å
407	S	79.6	Confident	75.8	Confident	15 Å²	15	77.5 Å²	77.5	11%	0.105	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	165.6	172	-71.7	0	0	0	0	109.1	P404 P405 H421 N423	P404-S407 CarbonylContact O-C 3.58Å; P404-S407 PolarHBondContact O-N 3.36Å; P405-S407 VanDerWaalsContact C-N 3.3Å; P405-S407 PolarHBondContact O-N 2.91Å; S407-H421 WeakPolarHBondContact CB-O 3.24Å; S407-N423 PolarHBondContact OG-N 2.79Å
408	F	79.7	Confident	75.7	Confident	101 Å²	101	75.4 Å²	75.4	44%	0.443	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	147.8	-177.3	58.8	-92.9	0	0	0	113.4	L410 H421	F408-L410 HydrophobicContact CD2-CD2 4.12Å; F408-L410 HydrophobicContact CD2-CG 4.1Å; F408-L410 HydrophobicContact CE2-CD1 4.19Å; F408-L410 HydrophobicContact CE2-CD2 3.91Å; F408-L410 HydrophobicContact CE2-CG 4Å; F408-H421 HydrophobicContact CD2-CB 4.08Å; F408-H421 AromaticContact CE1-CD2 3.92Å; F408-H421 HydrophobicContact CE2-CB 3.97Å; F408-H421 AromaticContact CE2-CD2 3.71Å; F408-H421 HydrophobicContact CG-CB 4.48Å; F408-H421 HydrophobicContact CZ-CB 4.29Å; F408-H421 AromaticContact CZ-CD2 3.34Å; F408-H421 WeakPolarHBondContact CZ-CD2 3.47Å; F408-H421 PolarHBondContact N-O 3.05Å; F408-H421 WeakPolarHBondContact O-CB 3.28Å; F408-H421 PolarHBondContact O-N 2.65Å
409	C	82.1	Confident	75.8	Confident	34 Å²	34	76.4 Å²	76.4	23%	0.23	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	142.8	176.8	-173.2	0	0	0	0	111.9	C398 T401 S418 R419	C398-C409 WeakPolarHBondContact CA-SG 3.06Å; C398-C409 HydrophobicContact CB-CB 3.76Å; C398-C409 WeakPolarHBondContact CB-SG 3.33Å; C398-C409 WeakPolarHBondContact SG-CB 3.49Å; C398-C409 CovalentContact SG-SG 2.05Å; C398-C409 PolarHBondContact SG-SG 2.89Å; T401-C409 HydrophobicContact CG2-CB 4.35Å; C409-S418 VanDerWaalsContact SG-CB 3.56Å; C409-R419 CarbonylContact C-O 3.54Å; C409-R419 WeakPolarHBondContact CA-O 3.49Å
410	L	79.6	Confident	75.9	Confident	68 Å²	68	69 Å²	69	36%	0.356	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	133.7	170.2	-70.8	176.5	0	0	0	110.1	C398 F408 D412 S418 R419 H421	C398-L410 PolarHBondContact SG-N 2.6Å; F408-L410 HydrophobicContact CD2-CD2 4.12Å; F408-L410 HydrophobicContact CD2-CG 4.1Å; F408-L410 HydrophobicContact CE2-CD1 4.19Å; F408-L410 HydrophobicContact CE2-CD2 3.91Å; F408-L410 HydrophobicContact CE2-CG 4Å; L410-D412 PolarHBondContact O-N 3.24Å; L410-S418 CarbonylContact O-C 3.51Å; L410-S418 VanDerWaalsContact O-CA 3.28Å; L410-S418 WeakPolarHBondContact O-CA 3.4Å; L410-S418 WeakPolarHBondContact O-CB 3.06Å; L410-R419 HydrophobicContact CB-CG 4.36Å; L410-R419 PolarHBondContact N-O 2.83Å; L410-R419 PolarHBondContact O-N 3.46Å; L410-H421 HydrophobicContact CD1-CB 3.89Å; L410-H421 HydrophobicContact CG-CB 4.27Å
411	T	77.2	Confident	76	Confident	73 Å²	73	64.4 Å²	64.4	45%	0.448	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	126.7	170.6	-43.8	0	0	0	0	110	Y413 G417	T411-Y413 HydrophobicContact CG2-CE1 4.21Å; T411-Y413 HydrophobicContact CG2-CE2 4.25Å; T411-Y413 WeakPolarHBondContact O-CD2 3.4Å; T411-G417 WeakPolarHBondContact CG2-O 3.15Å
412	D	71.1	Confident	76.3	Confident	32 Å²	32	64.1 Å²	64.1	17%	0.171	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	101	175.6	-173	-17.6	0	0	0	109.8	L410 E414 S415 G416 G417	L410-D412 PolarHBondContact O-N 3.24Å; D412-E414 VanDerWaalsContact C-N 3.31Å; D412-E414 PolarHBondContact O-N 3.48Å; D412-E414 PolarHBondContact OD1-N 2.96Å; D412-S415 VanDerWaalsContact CG-CB 3.45Å; D412-S415 VanDerWaalsContact CG-OG 3.26Å; D412-S415 PolarHBondContact OD1-N 2.89Å; D412-S415 VanDerWaalsContact OD2-CB 3.25Å; D412-S415 WeakPolarHBondContact OD2-CB 3.29Å; D412-S415 PolarHBondContact OD2-OG 2.6Å; D412-G416 WeakPolarHBondContact O-CA 3.12Å; D412-G416 PolarHBondContact O-N 3.05Å; D412-G417 PolarHBondContact N-O 2.82Å; D412-G417 PolarHBondContact O-N 3.12Å
413	Y	63.8	Low	76.6	Confident	204 Å²	204	60.2 Å²	60.2	80%	0.8	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-12.1	179.7	-61.3	-86.6	0	0	0	114.2	T411	T411-Y413 HydrophobicContact CG2-CE1 4.21Å; T411-Y413 HydrophobicContact CG2-CE2 4.25Å; T411-Y413 WeakPolarHBondContact O-CD2 3.4Å
414	E	61.7	Low	76.9	Confident	195 Å²	195	60.4 Å²	60.4	91%	0.911	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-38.5	173.8	-64.3	-165.1	166.1	0	0	111.1	D412	D412-E414 VanDerWaalsContact C-N 3.31Å; D412-E414 PolarHBondContact O-N 3.48Å; D412-E414 PolarHBondContact OD1-N 2.96Å
415	S	65.5	Low	77.1	Confident	77 Å²	77	60.1 Å²	60.1	54%	0.538	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-30.6	178	-55	0	0	0	0	113.8	D412	D412-S415 VanDerWaalsContact CG-CB 3.45Å; D412-S415 VanDerWaalsContact CG-OG 3.26Å; D412-S415 PolarHBondContact OD1-N 2.89Å; D412-S415 VanDerWaalsContact OD2-CB 3.25Å; D412-S415 WeakPolarHBondContact OD2-CB 3.29Å; D412-S415 PolarHBondContact OD2-OG 2.6Å
416	G	64.6	Low	77.8	Confident	70 Å²	70	57.2 Å²	57.2	72%	0.722	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.5	21	-179.9	0	0	0	0	0	115.6	D412	D412-G416 WeakPolarHBondContact O-CA 3.12Å; D412-G416 PolarHBondContact O-N 3.05Å
417	G	78.8	Confident	78.6	Confident	7 Å²	7	58.4 Å²	58.4	7%	0.072	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	-125.6	-178.7	0	0	0	0	0	111.7	Y394 L396 T411 D412	Y394-G417 WeakPolarHBondContact O-CA 3.44Å; L396-G417 CarbonylContact O-C 3.54Å; L396-G417 VanDerWaalsContact O-CA 3.24Å; L396-G417 WeakPolarHBondContact O-CA 3.37Å; T411-G417 WeakPolarHBondContact CG2-O 3.15Å; D412-G417 PolarHBondContact N-O 2.82Å; D412-G417 PolarHBondContact O-N 3.12Å
418	S	79.2	Confident	78.7	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	168.5	-176.4	65.8	0	0	0	0	114.6	V393 Y394 L396 A397 C398 T401 C409 L410	V393-S418 CarbonylContact C-O 3.4Å; Y394-S418 WeakPolarHBondContact CA-O 3.44Å; Y394-S418 PolarHBondContact N-O 3.01Å; L396-S418 VanDerWaalsContact O-CB 3.31Å; L396-S418 WeakPolarHBondContact O-CB 3.41Å; L396-S418 PolarHBondContact O-N 3.19Å; L396-S418 PolarHBondContact O-OG 3.05Å; A397-S418 VanDerWaalsContact C-OG 3.24Å; A397-S418 PolarHBondContact O-OG 3.27Å; C398-S418 PolarHBondContact N-OG 3.06Å; C398-S418 VanDerWaalsContact SG-CB 3.52Å; T401-S418 PolarHBondContact OG1-OG 2.84Å; C409-S418 VanDerWaalsContact SG-CB 3.56Å; L410-S418 CarbonylContact O-C 3.51Å; L410-S418 VanDerWaalsContact O-CA 3.28Å; L410-S418 WeakPolarHBondContact O-CA 3.4Å; L410-S418 WeakPolarHBondContact O-CB 3.06Å
419	R	82.1	Confident	78.7	Confident	58 Å²	58	59 Å²	59	22%	0.219	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	147	-177.4	53.7	-179	-106.9	-165.6	-1.9	110.4	C409 L410 D611	C409-R419 CarbonylContact C-O 3.54Å; C409-R419 WeakPolarHBondContact CA-O 3.49Å; L410-R419 HydrophobicContact CB-CG 4.36Å; L410-R419 PolarHBondContact N-O 2.83Å; L410-R419 PolarHBondContact O-N 3.46Å; R419-D611 IonicContact CZ-OD2 2.77Å; R419-D611 IonicContact NH2-OD2 2.72Å; R419-D611 PolarHBondContact NH2-OD2 3.16Å
420	C	83.9	Confident	78.8	Confident	7 Å²	7	59.5 Å²	59.5	5%	0.047	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	136.6	166.4	-61.6	0	0	0	0	110.2	C403 C431	C403-C420 WeakPolarHBondContact CA-SG 3.45Å; C403-C420 HydrophobicContact CB-CB 3.9Å; C403-C420 WeakPolarHBondContact CB-SG 3.41Å; C403-C420 WeakPolarHBondContact SG-CA 3.38Å; C403-C420 WeakPolarHBondContact SG-CB 3.44Å; C403-C420 CovalentContact SG-SG 2.04Å; C403-C420 PolarHBondContact SG-SG 3.39Å; C420-C431 HydrophobicContact CB-CB 4.43Å; C420-C431 WeakPolarHBondContact CB-SG 3.35Å
421	H	82.9	Confident	79.1	Confident	11 Å²	11	56.3 Å²	56.3	5%	0.051	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	107.4	167.6	-158.5	52.7	0	0	0	106.7	S407 F408 L410 H447 A610 D611	S407-H421 WeakPolarHBondContact CB-O 3.24Å; F408-H421 HydrophobicContact CD2-CB 4.08Å; F408-H421 AromaticContact CE1-CD2 3.92Å; F408-H421 HydrophobicContact CE2-CB 3.97Å; F408-H421 AromaticContact CE2-CD2 3.71Å; F408-H421 HydrophobicContact CG-CB 4.48Å; F408-H421 HydrophobicContact CZ-CB 4.29Å; F408-H421 AromaticContact CZ-CD2 3.34Å; F408-H421 WeakPolarHBondContact CZ-CD2 3.47Å; F408-H421 PolarHBondContact N-O 3.05Å; F408-H421 WeakPolarHBondContact O-CB 3.28Å; F408-H421 PolarHBondContact O-N 2.65Å; L410-H421 HydrophobicContact CD1-CB 3.89Å; L410-H421 HydrophobicContact CG-CB 4.27Å; H421-H447 AromaticContact NE2-CE1 3.63Å; H421-H447 AromaticContact NE2-ND1 3.92Å; H421-A610 WeakPolarHBondContact CD2-CB 3.21Å; H421-A610 WeakPolarHBondContact NE2-CB 3.44Å; H421-D611 WeakPolarHBondContact CA-OD1 3.45Å; H421-D611 IonicContact CE1-OD2 2.72Å; H421-D611 PolarHBondContact CE1-OD2 2.97Å; H421-D611 IonicContact CG-OD2 2.72Å; H421-D611 IonicContact ND1-OD1 2.8Å; H421-D611 PolarHBondContact ND1-OD1 2.84Å; H421-D611 IonicContact ND1-OD2 3.18Å; H421-D611 PolarHBondContact ND1-OD2 2.76Å
422	C	86.6	Confident	79.5	Confident	7 Å²	7	56.7 Å²	56.7	5%	0.047	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	118.7	-169	-56	0	0	0	0	110.4	R426 G428 C431 A610 D611	C422-R426 HydrophobicContact CB-CB 4.16Å; C422-R426 WeakPolarHBondContact CB-O 3.16Å; C422-G428 PolarHBondContact SG-O 2.8Å; C422-C431 WeakPolarHBondContact CA-SG 3.32Å; C422-C431 HydrophobicContact CB-CB 3.71Å; C422-C431 WeakPolarHBondContact CB-SG 3Å; C422-C431 PolarHBondContact N-SG 2.83Å; C422-C431 VanDerWaalsContact N-SG 3.44Å; C422-C431 WeakPolarHBondContact SG-CA 3.48Å; C422-C431 WeakPolarHBondContact SG-CB 3.49Å; C422-C431 CovalentContact SG-SG 2.03Å; C422-C431 PolarHBondContact SG-SG 2.82Å; C422-A610 CarbonylContact O-C 3.59Å; C422-A610 WeakPolarHBondContact O-CA 3.35Å; C422-D611 PolarHBondContact N-OD1 3.18Å; C422-D611 PolarHBondContact O-N 3Å
423	N	88.1	Confident	80.3	Confident	47 Å²	47	59.6 Å²	59.6	25%	0.251	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-60.1	152.8	173.8	-82.7	-20.4	0	0	0	111.7	D406 S407 G425 R426 G609	D406-N423 VanDerWaalsContact O-CB 3.25Å; D406-N423 WeakPolarHBondContact O-CB 3.37Å; D406-N423 VanDerWaalsContact O-CG 3.26Å; D406-N423 PolarHBondContact O-ND2 2.96Å; S407-N423 PolarHBondContact OG-N 2.79Å; N423-G425 PolarHBondContact O-N 3.05Å; N423-R426 WeakPolarHBondContact O-CB 3.47Å; N423-R426 PolarHBondContact O-N 3.38Å; N423-G609 CarbonylContact C-O 3.55Å; N423-G609 WeakPolarHBondContact CA-O 3.31Å
424	L	86.8	Confident	81.2	Confident	30 Å²	30	54 Å²	54	16%	0.157	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	118.6	-176.6	178.5	62.8	0	0	0	112.1	V437 M448 P600 A606 G609 I612	L424-V437 HydrophobicContact CD1-CG2 4.25Å; L424-M448 HydrophobicContact CD1-CE 3.84Å; L424-M448 HydrophobicContact CD2-CE 3.9Å; L424-P600 HydrophobicContact CD1-CG 4.09Å; L424-P600 HydrophobicContact CD2-CB 3.93Å; L424-P600 HydrophobicContact CD2-CG 4.03Å; L424-P600 HydrophobicContact CG-CB 4.03Å; L424-P600 HydrophobicContact CG-CG 3.79Å; L424-A606 HydrophobicContact CD2-CB 3.61Å; L424-G609 WeakPolarHBondContact CB-O 3.4Å; L424-G609 PolarHBondContact N-O 3.25Å; L424-I612 HydrophobicContact CD1-CB 3.86Å; L424-I612 HydrophobicContact CD1-CG1 4.08Å; L424-I612 HydrophobicContact CD1-CG2 3.98Å
425	G	83.5	Confident	82.3	Confident	19 Å²	19	45.4 Å²	45.4	20%	0.196	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	104.8	-3	-173.5	0	0	0	0	0	114.4	N423 A434 V435	N423-G425 PolarHBondContact O-N 3.05Å; G425-A434 CarbonylContact O-C 3.48Å; G425-A434 WeakPolarHBondContact O-CA 3.42Å; G425-V435 WeakPolarHBondContact CA-O 3.22Å; G425-V435 PolarHBondContact O-N 2.86Å
426	R	86.8	Confident	83.2	Confident	81 Å²	81	46.8 Å²	46.8	31%	0.306	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	155.2	173.2	-58.5	-144.3	-171	-130.7	10.4	113.5	D406 C422 N423 C431 E433	D406-R426 IonicContact OD1-CZ 3.37Å; D406-R426 IonicContact OD1-NE 2.8Å; D406-R426 PolarHBondContact OD1-NE 3.43Å; D406-R426 IonicContact OD1-NH2 2.77Å; D406-R426 PolarHBondContact OD1-NH2 2.86Å; D406-R426 IonicContact OD2-CZ 3.66Å; D406-R426 IonicContact OD2-NE 3.68Å; D406-R426 PolarHBondContact OD2-NE 3.47Å; D406-R426 IonicContact OD2-NH2 2.79Å; D406-R426 PolarHBondContact OD2-NH2 2.66Å; C422-R426 HydrophobicContact CB-CB 4.16Å; C422-R426 WeakPolarHBondContact CB-O 3.16Å; N423-R426 WeakPolarHBondContact O-CB 3.47Å; N423-R426 PolarHBondContact O-N 3.38Å; R426-C431 HydrophobicContact CB-CB 4.3Å; R426-C431 WeakPolarHBondContact CD-O 3.4Å; R426-E433 CarbonylContact C-O 3.58Å; R426-E433 VanDerWaalsContact CA-O 3.24Å; R426-E433 WeakPolarHBondContact CA-O 3.37Å
427	R	86.5	Confident	84.4	Confident	90 Å²	90	43.6 Å²	43.6	34%	0.34	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	176.9	176	73.4	175.4	-171.3	-165.6	6.4	113.7	C431 S432 E433 V435 D617	R427-C431 CarbonylContact O-C 3.35Å; R427-C431 VanDerWaalsContact O-CA 3.26Å; R427-C431 WeakPolarHBondContact O-CA 3.16Å; R427-S432 PolarHBondContact O-N 2.88Å; R427-E433 HydrophobicContact CG-CB 3.7Å; R427-E433 IonicContact CZ-OE2 3.5Å; R427-E433 PolarHBondContact N-O 3.08Å; R427-E433 IonicContact NE-OE2 3.98Å; R427-E433 PolarHBondContact NE-OE2 2.92Å; R427-E433 IonicContact NH2-OE2 2.71Å; R427-E433 PolarHBondContact NH2-OE2 2.79Å; R427-E433 PolarHBondContact O-N 2.83Å; R427-V435 HydrophobicContact CB-CB 4.48Å; R427-V435 HydrophobicContact CB-CG1 4.09Å; R427-V435 HydrophobicContact CG-CB 4.1Å; R427-V435 HydrophobicContact CG-CG1 4.25Å; R427-D617 IonicContact CZ-OD2 2.84Å; R427-D617 IonicContact NH1-OD2 2.71Å; R427-D617 PolarHBondContact NH1-OD2 3.08Å
428	G	82	Confident	84.8	Confident	35 Å²	35	46.4 Å²	46.4	36%	0.361	27%	0.268	S	S	.	.	S	Bend	trans	91.3	161.3	-178.2	0	0	0	0	0	112.2	C422 S430 C431	C422-G428 PolarHBondContact SG-O 2.8Å; G428-S430 PolarHBondContact O-N 2.86Å; G428-C431 PolarHBondContact O-N 2.92Å
429	D	80.6	Confident	85.5	Confident	94 Å²	94	48 Å²	48	50%	0.503	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-29.2	-172.4	-62	1.8	0	0	0	113.6	V393 Y394	V393-D429 HydrophobicContact CB-CB 4.46Å; V393-D429 HydrophobicContact CG2-CB 4Å; Y394-D429 WeakPolarHBondContact CE1-OD2 3.21Å
430	S	83.7	Confident	86.1	Confident	45 Å²	45	45.4 Å²	45.4	32%	0.315	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	15.1	176.5	57.4	0	0	0	0	113.7	P404 G428 S432	P404-S430 VanDerWaalsContact CD-O 3.23Å; P404-S430 WeakPolarHBondContact CD-O 3.3Å; G428-S430 PolarHBondContact O-N 2.86Å; S430-S432 PolarHBondContact O-N 2.82Å; S430-S432 PolarHBondContact OG-OG 2.72Å
431	C	86.1	Confident	86.6	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.274	C	S	.	.	S	Bend	trans	52.2	20.6	-179.3	-50.9	0	0	0	0	116.3	P404 C420 C422 R426 R427 G428	P404-C431 HydrophobicContact CG-CB 4.08Å; C420-C431 HydrophobicContact CB-CB 4.43Å; C420-C431 WeakPolarHBondContact CB-SG 3.35Å; C422-C431 WeakPolarHBondContact CA-SG 3.32Å; C422-C431 HydrophobicContact CB-CB 3.71Å; C422-C431 WeakPolarHBondContact CB-SG 3Å; C422-C431 PolarHBondContact N-SG 2.83Å; C422-C431 VanDerWaalsContact N-SG 3.44Å; C422-C431 WeakPolarHBondContact SG-CA 3.48Å; C422-C431 WeakPolarHBondContact SG-CB 3.49Å; C422-C431 CovalentContact SG-SG 2.03Å; C422-C431 PolarHBondContact SG-SG 2.82Å; R426-C431 HydrophobicContact CB-CB 4.3Å; R426-C431 WeakPolarHBondContact CD-O 3.4Å; R427-C431 CarbonylContact O-C 3.35Å; R427-C431 VanDerWaalsContact O-CA 3.26Å; R427-C431 WeakPolarHBondContact O-CA 3.16Å; G428-C431 PolarHBondContact O-N 2.92Å
432	S	85.4	Confident	87.2	Confident	81 Å²	81	47.6 Å²	47.6	57%	0.566	27%	0.272	S	S	*	.			trans	-81.4	-17.6	-174.6	49.8	0	0	0	0	114.1	R427 S430	R427-S432 PolarHBondContact O-N 2.88Å; S430-S432 PolarHBondContact O-N 2.82Å; S430-S432 PolarHBondContact OG-OG 2.72Å
433	E	87.1	Confident	87.5	Confident	94 Å²	94	51.8 Å²	51.8	44%	0.439	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	136.5	175.1	-70.2	-178.9	-144	0	0	111.1	R426 R427	R426-E433 CarbonylContact C-O 3.58Å; R426-E433 VanDerWaalsContact CA-O 3.24Å; R426-E433 WeakPolarHBondContact CA-O 3.37Å; R427-E433 HydrophobicContact CG-CB 3.7Å; R427-E433 IonicContact CZ-OE2 3.5Å; R427-E433 PolarHBondContact N-O 3.08Å; R427-E433 IonicContact NE-OE2 3.98Å; R427-E433 PolarHBondContact NE-OE2 2.92Å; R427-E433 IonicContact NH2-OE2 2.71Å; R427-E433 PolarHBondContact NH2-OE2 2.79Å; R427-E433 PolarHBondContact O-N 2.83Å
434	A	83.4	Confident	87.6	Confident	87 Å²	87	50.6 Å²	50.6	72%	0.719	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	142.9	165.3	0	0	0	0	0	110.7	G425	G425-A434 CarbonylContact O-C 3.48Å; G425-A434 WeakPolarHBondContact O-CA 3.42Å
435	V	84.3	Confident	87.6	Confident	13 Å²	13	54.6 Å²	54.6	8%	0.079	30%	0.3	C	S	.	.			trans	-133.9	128.9	176	60.1	0	0	0	0	111	G425 R427 V437 E614	G425-V435 WeakPolarHBondContact CA-O 3.22Å; G425-V435 PolarHBondContact O-N 2.86Å; R427-V435 HydrophobicContact CB-CB 4.48Å; R427-V435 HydrophobicContact CB-CG1 4.09Å; R427-V435 HydrophobicContact CG-CB 4.1Å; R427-V435 HydrophobicContact CG-CG1 4.25Å; V435-V437 HydrophobicContact CG1-CG2 4.23Å; V435-V437 PolarHBondContact O-N 2.66Å; V435-E614 HydrophobicContact CG2-CB 4.17Å
436	T	85.9	Confident	88	Confident	106 Å²	106	53.7 Å²	53.7	65%	0.65	29%	0.291	S	S	*	.			trans	-85.3	105.7	174.6	-57.1	0	0	0	0	109.2	N438	T436-N438 PolarHBondContact O-N 3Å
437	V	88.3	Confident	88.3	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.018	28%	0.28	C	S	.	.			trans	-88.3	105.6	178.8	-176.5	0	0	0	0	110.3	L424 V435 P440 P600 I612 E614	L424-V437 HydrophobicContact CD1-CG2 4.25Å; V435-V437 HydrophobicContact CG1-CG2 4.23Å; V435-V437 PolarHBondContact O-N 2.66Å; V437-P440 HydrophobicContact CG1-CB 3.8Å; V437-P600 HydrophobicContact CB-CG 4.34Å; V437-P600 WeakPolarHBondContact O-CD 3.28Å; V437-I612 HydrophobicContact CG1-CG2 3.75Å; V437-I612 HydrophobicContact CG2-CG2 4Å; V437-E614 WeakPolarHBondContact CA-OE2 3.46Å
438	N	88.3	Confident	88.7	Confident	67 Å²	67	46.3 Å²	46.3	36%	0.358	26%	0.264	S	S	.	.	S	Bend	trans	-96.8	-43.7	169.1	-64.4	-60.9	0	0	0	111.4	T436 E614	T436-N438 PolarHBondContact O-N 3Å; N438-E614 WeakPolarHBondContact CA-OE2 3.13Å; N438-E614 PolarHBondContact N-OE2 3.47Å
439	F	92.9	Very high	89.2	Confident	34 Å²	34	45.3 Å²	45.3	15%	0.149	25%	0.251	C	S	.	.	S	Bend	trans	-127.2	96.5	178.7	-51.4	-73.7	0	0	0	110	R441 Q587 E614 C615 R635 A636	F439-R441 PolarHBondContact O-N 3.01Å; F439-Q587 HydrophobicContact CD1-CG 4.23Å; F439-Q587 HydrophobicContact CE1-CG 4.32Å; F439-E614 WeakPolarHBondContact CB-OE1 3.16Å; F439-E614 PolarHBondContact N-OE1 2.91Å; F439-E614 PolarHBondContact N-OE2 2.85Å; F439-C615 HydrophobicContact CB-CB 4.34Å; F439-C615 PolarHBondContact O-N 2.8Å; F439-R635 VanDerWaalsContact CE2-C 3.47Å; F439-A636 HydrophobicContact CB-CB 3.68Å; F439-A636 HydrophobicContact CD1-CB 4.36Å; F439-A636 HydrophobicContact CD2-CB 4.39Å; F439-A636 HydrophobicContact CG-CB 3.91Å
440	P	94.8	Very high	89.9	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.013	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	128.9	-168.3	24.2	-34.5	0	0	0	113.8	V437 F442 M448 I586 I598 I612	V437-P440 HydrophobicContact CG1-CB 3.8Å; P440-F442 HydrophobicContact CB-CE2 3.7Å; P440-F442 HydrophobicContact CB-CZ 3.97Å; P440-F442 HydrophobicContact CG-CE2 3.96Å; P440-F442 HydrophobicContact CG-CZ 4.26Å; P440-F442 WeakPolarHBondContact O-CE2 3.48Å; P440-M448 HydrophobicContact CB-CE 4.34Å; P440-M448 HydrophobicContact CB-SD 3.43Å; P440-M448 WeakPolarHBondContact CB-SD 3.17Å; P440-M448 HydrophobicContact CG-SD 3.79Å; P440-I586 WeakPolarHBondContact CD-O 3.5Å; P440-I586 HydrophobicContact CG-CB 4.44Å; P440-I586 PolarHBondContact O-N 2.67Å; P440-I586 VanDerWaalsContact O-N 3.14Å; P440-I598 HydrophobicContact CG-CD1 3.97Å; P440-I598 HydrophobicContact CG-CG1 4.37Å; P440-I612 HydrophobicContact CB-CG2 3.65Å
441	R	95.2	Very high	90.2	Very high	64 Å²	64	43 Å²	43	24%	0.242	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	132.8	170.1	-165.6	159.4	174.3	69.2	8.4	110.6	F439 Y443 D469 G584 C585 G613 C615	F439-R441 PolarHBondContact O-N 3.01Å; R441-Y443 HydrophobicContact CG-CE1 4.1Å; R441-D469 IonicContact CZ-OD2 3.81Å; R441-D469 VanDerWaalsContact CZ-OD2 3.25Å; R441-D469 IonicContact NH1-OD2 2.73Å; R441-D469 PolarHBondContact NH1-OD2 2.78Å; R441-D469 IonicContact NH2-OD2 3.92Å; R441-D469 PolarHBondContact NH2-OD2 2.04Å; R441-G584 WeakPolarHBondContact CA-O 3.47Å; R441-C585 PolarHBondContact NH1-SG 3.27Å; R441-G613 PolarHBondContact N-O 2.95Å; R441-G613 PolarHBondContact O-N 2.96Å; R441-C615 VanDerWaalsContact CA-SG 3.58Å; R441-C615 WeakPolarHBondContact CB-SG 3.2Å
442	F	95.4	Very high	90.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	141.2	179.3	-58.2	-100.2	0	0	0	110.3	P440 M448 V563 F582 V583 G584 I586 I612	P440-F442 HydrophobicContact CB-CE2 3.7Å; P440-F442 HydrophobicContact CB-CZ 3.97Å; P440-F442 HydrophobicContact CG-CE2 3.96Å; P440-F442 HydrophobicContact CG-CZ 4.26Å; P440-F442 WeakPolarHBondContact O-CE2 3.48Å; F442-M448 HydrophobicContact CE1-CB 4.49Å; F442-M448 HydrophobicContact CE1-CG 3.94Å; F442-M448 HydrophobicContact CE1-SD 4.16Å; F442-M448 HydrophobicContact CZ-CG 4.04Å; F442-M448 HydrophobicContact CZ-SD 3.66Å; F442-V563 WeakPolarHBondContact CE1-O 3.21Å; F442-V563 HydrophobicContact CZ-CG1 4.25Å; F442-F582 CarbonylContact C-O 3.55Å; F442-F582 HydrophobicContact CB-CD1 4.02Å; F442-F582 WeakPolarHBondContact CB-O 3.25Å; F442-F582 AromaticContact CD2-CD1 3.95Å; F442-F582 HydrophobicContact CD2-CD1 3.95Å; F442-F582 HydrophobicContact CD2-CE1 4.41Å; F442-F582 HydrophobicContact CG-CD1 4.14Å; F442-V583 WeakPolarHBondContact O-CA 3.47Å; F442-G584 PolarHBondContact N-O 3.4Å; F442-G584 PolarHBondContact O-N 3.42Å; F442-I586 HydrophobicContact CD2-CD1 4.32Å; F442-I586 HydrophobicContact CD2-CG1 4.49Å; F442-I586 HydrophobicContact CE2-CB 4.14Å; F442-I586 HydrophobicContact CE2-CD1 3.69Å; F442-I586 HydrophobicContact CE2-CG1 4.02Å; F442-I586 HydrophobicContact CZ-CD1 4.12Å; F442-I612 HydrophobicContact CD1-CD1 3.45Å; F442-I612 VanDerWaalsContact CD1-CD1 3.45Å; F442-I612 HydrophobicContact CE1-CD1 3.3Å; F442-I612 HydrophobicContact CG-CD1 4.2Å; F442-I612 HydrophobicContact CZ-CD1 3.94Å
443	Y	92.6	Very high	90.5	Very high	95 Å²	95	41.3 Å²	41.3	37%	0.373	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	22.2	-174.9	-55.4	-77.3	0	0	0	113.2	R441 Y445 S446 D611	R441-Y443 HydrophobicContact CG-CE1 4.1Å; Y443-Y445 WeakPolarHBondContact O-CD1 3.21Å; Y443-Y445 WeakPolarHBondContact O-CE1 3.37Å; Y443-Y445 PolarHBondContact O-N 3.01Å; Y443-S446 WeakPolarHBondContact CD2-OG 3.4Å; Y443-S446 PolarHBondContact N-OG 3.24Å; Y443-D611 VanDerWaalsContact CD2-O 3.3Å; Y443-D611 WeakPolarHBondContact CD2-O 3.38Å
444	G	89.8	Confident	89.9	Confident	23 Å²	23	43 Å²	43	24%	0.237	22%	0.224	C	C	.	.	S	Bend	trans	84.7	-18	177.1	0	0	0	0	0	115.4	G581 F582	G444-G581 WeakPolarHBondContact O-CA 3.44Å; G444-G581 PolarHBondContact O-N 2.93Å; G444-F582 VanDerWaalsContact CA-O 3.3Å; G444-F582 WeakPolarHBondContact CA-O 3.21Å; G444-F582 PolarHBondContact N-O 2.71Å
445	Y	86.4	Confident	89.5	Confident	114 Å²	114	45.8 Å²	45.8	45%	0.447	23%	0.227	S	C	.	.	S	Bend	trans	-114.9	-14.2	169.2	46.4	-105.5	0	0	0	112.9	Y443 D611	Y443-Y445 WeakPolarHBondContact O-CD1 3.21Å; Y443-Y445 WeakPolarHBondContact O-CE1 3.37Å; Y443-Y445 PolarHBondContact O-N 3.01Å; Y445-D611 HydrophobicContact CD2-CB 3.75Å; Y445-D611 WeakPolarHBondContact CD2-OD2 3.05Å; Y445-D611 HydrophobicContact CE2-CB 3.6Å; Y445-D611 VanDerWaalsContact CE2-OD2 3.24Å; Y445-D611 WeakPolarHBondContact CE2-OD2 2.87Å
446	S	92.6	Very high	89.3	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.224	C	C	.	.			trans	-68.3	154.4	177.8	-39.2	0	0	0	0	112.2	Y443 G565 A610 D611	Y443-S446 WeakPolarHBondContact CD2-OG 3.4Å; Y443-S446 PolarHBondContact N-OG 3.24Å; S446-G565 WeakPolarHBondContact O-CA 3.44Å; S446-A610 WeakPolarHBondContact CA-O 3.44Å; S446-A610 WeakPolarHBondContact CB-O 3.46Å; S446-D611 WeakPolarHBondContact CB-O 3.5Å; S446-D611 PolarHBondContact OG-O 3.09Å
447	H	92.9	Very high	88.9	Confident	14 Å²	14	45.5 Å²	45.5	7%	0.065	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	159.9	172.9	67.5	-78	0	0	0	112	H421 G565 G609 A610	H421-H447 AromaticContact NE2-CE1 3.63Å; H421-H447 AromaticContact NE2-ND1 3.92Å; H447-G565 WeakPolarHBondContact CB-O 3.44Å; H447-G609 CarbonylContact O-C 3.55Å; H447-G609 WeakPolarHBondContact O-CA 3.48Å; H447-A610 PolarHBondContact N-O 3.05Å; H447-A610 VanDerWaalsContact N-O 3.09Å; H447-A610 PolarHBondContact O-N 2.82Å
448	M	94.7	Very high	88.7	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	151.7	170.4	-64.3	175.2	78.2	0	0	110.2	L424 P440 F442 F450 Y562 V563 I598 A606 I612	L424-M448 HydrophobicContact CD1-CE 3.84Å; L424-M448 HydrophobicContact CD2-CE 3.9Å; P440-M448 HydrophobicContact CB-CE 4.34Å; P440-M448 HydrophobicContact CB-SD 3.43Å; P440-M448 WeakPolarHBondContact CB-SD 3.17Å; P440-M448 HydrophobicContact CG-SD 3.79Å; F442-M448 HydrophobicContact CE1-CB 4.49Å; F442-M448 HydrophobicContact CE1-CG 3.94Å; F442-M448 HydrophobicContact CE1-SD 4.16Å; F442-M448 HydrophobicContact CZ-CG 4.04Å; F442-M448 HydrophobicContact CZ-SD 3.66Å; M448-F450 HydrophobicContact CB-CE2 3.99Å; M448-F450 HydrophobicContact CE-CZ 4.43Å; M448-Y562 CarbonylContact O-C 3.5Å; M448-Y562 WeakPolarHBondContact O-CA 3.29Å; M448-V563 HydrophobicContact CB-CB 4.42Å; M448-V563 PolarHBondContact N-O 3.34Å; M448-V563 PolarHBondContact O-N 2.82Å; M448-I598 WeakPolarHBondContact CE-O 3.49Å; M448-A606 HydrophobicContact CE-CB 3.52Å; M448-I612 HydrophobicContact CG-CD1 3.52Å; M448-I612 HydrophobicContact CG-CG1 3.61Å; M448-I612 HydrophobicContact SD-CD1 3.98Å; M448-I612 HydrophobicContact SD-CG1 4.14Å; M448-I612 HydrophobicContact SD-CG2 4.1Å
449	T	93.9	Very high	88.8	Confident	14 Å²	14	49.7 Å²	49.7	9%	0.086	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	137.3	177.8	61.2	0	0	0	0	111.4	P560 L561 Y562 A606 L607 S608	T449-P560 HydrophobicContact CG2-CB 4.11Å; T449-L561 CarbonylContact C-O 3.57Å; T449-L561 WeakPolarHBondContact CA-O 3.39Å; T449-Y562 HydrophobicContact CG2-CD1 3.71Å; T449-Y562 HydrophobicContact CG2-CE1 3.49Å; T449-Y562 VanDerWaalsContact CG2-CE1 3.49Å; T449-Y562 HydrophobicContact CG2-CG 4.43Å; T449-A606 CarbonylContact O-C 3.59Å; T449-A606 WeakPolarHBondContact O-CA 3.22Å; T449-L607 PolarHBondContact O-N 2.8Å; T449-S608 PolarHBondContact N-O 2.83Å; T449-S608 WeakPolarHBondContact OG1-CB 3.14Å; T449-S608 PolarHBondContact OG1-N 2.88Å; T449-S608 PolarHBondContact OG1-O 2.89Å
450	F	94.3	Very high	88.8	Confident	6 Å²	6	48.1 Å²	48.1	3%	0.026	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	169.8	175.4	-65.3	-99.6	0	0	0	109.1	M448 L561 V563 T596 I598 K605 A606	M448-F450 HydrophobicContact CB-CE2 3.99Å; M448-F450 HydrophobicContact CE-CZ 4.43Å; F450-L561 HydrophobicContact CB-CB 4.17Å; F450-L561 HydrophobicContact CB-CD2 4.39Å; F450-L561 HydrophobicContact CB-CG 4.48Å; F450-L561 PolarHBondContact N-O 2.89Å; F450-L561 PolarHBondContact O-N 2.85Å; F450-V563 HydrophobicContact CD2-CB 4.42Å; F450-V563 HydrophobicContact CD2-CG2 3.55Å; F450-V563 HydrophobicContact CE2-CB 4.09Å; F450-V563 HydrophobicContact CE2-CG2 3.57Å; F450-T596 HydrophobicContact CD1-CG2 3.97Å; F450-T596 HydrophobicContact CE1-CG2 4.06Å; F450-I598 HydrophobicContact CE1-CG2 4.47Å; F450-I598 HydrophobicContact CZ-CB 4.18Å; F450-I598 HydrophobicContact CZ-CG2 4.1Å; F450-K605 HydrophobicContact CD1-CB 4.01Å; F450-K605 VanDerWaalsContact CD1-O 3.27Å; F450-K605 WeakPolarHBondContact CD1-O 3.4Å; F450-K605 HydrophobicContact CE1-CB 4.24Å; F450-A606 HydrophobicContact CE1-CB 3.87Å; F450-A606 HydrophobicContact CE2-CB 4.33Å; F450-A606 HydrophobicContact CZ-CB 3.76Å
451	E	90.8	Very high	88.9	Confident	85 Å²	85	50 Å²	50	40%	0.397	24%	0.237	S	C	.	.			trans	-49.4	142.1	172.2	-70.8	-166	87.3	0	0	111.3	K454 K605 L607	E451-K454 IonicContact OE1-NZ 3.84Å; E451-K454 PolarHBondContact OE1-NZ 3.32Å; E451-K605 IonicContact OE2-NZ 3.1Å; E451-L607 HydrophobicContact CG-CD1 4.12Å
452	P	90.5	Very high	89	Confident	34 Å²	34	47.1 Å²	47.1	22%	0.221	23%	0.226	C	C	.	.			trans	-51.2	152	168.4	-23.1	31.2	0	0	0	110.9	K454 S559	P452-K454 PolarHBondContact O-N 3.39Å; P452-S559 VanDerWaalsContact CB-O 3.32Å; P452-S559 WeakPolarHBondContact CB-O 3.01Å; P452-S559 WeakPolarHBondContact CG-O 3.17Å
453	L	86.3	Confident	89.1	Confident	11 Å²	11	47.9 Å²	47.9	6%	0.058	23%	0.231	C	C	.	.			trans	-70.7	64.8	179.3	-69.7	170.1	0	0	0	112.2	S456 I462 C478 T489 F557 L561 I591	L453-S456 VanDerWaalsContact O-CB 3.26Å; L453-S456 WeakPolarHBondContact O-CB 3.27Å; L453-S456 PolarHBondContact O-N 2.89Å; L453-I462 HydrophobicContact CD1-CD1 3.96Å; L453-I462 HydrophobicContact CD2-CD1 4.32Å; L453-C478 HydrophobicContact CD1-CB 4.2Å; L453-T489 HydrophobicContact CD1-CG2 4.06Å; L453-F557 HydrophobicContact CB-CD2 3.53Å; L453-F557 HydrophobicContact CB-CE2 3.86Å; L453-F557 HydrophobicContact CB-CG 4.23Å; L453-F557 HydrophobicContact CD1-CD2 4.38Å; L453-F557 HydrophobicContact CD1-CE2 4.03Å; L453-F557 HydrophobicContact CD1-CZ 4.31Å; L453-L561 HydrophobicContact CD1-CD1 4.43Å; L453-L561 HydrophobicContact CD2-CD2 4.1Å; L453-L561 HydrophobicContact CG-CD2 4.43Å; L453-I591 HydrophobicContact CD2-CD1 4.19Å; L453-I591 HydrophobicContact CD2-CG2 3.83Å
454	K	74.9	Confident	89.3	Confident	131 Å²	131	43.4 Å²	43.4	57%	0.57	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	145.2	177.2	-67.4	166.8	-174.9	175	0	109.9	E451 P452 S456	E451-K454 IonicContact OE1-NZ 3.84Å; E451-K454 PolarHBondContact OE1-NZ 3.32Å; P452-K454 PolarHBondContact O-N 3.39Å; K454-S456 PolarHBondContact O-N 2.03Å; K454-S456 PolarHBondContact O-OG 2.74Å
455	N	74.4	Confident	89.6	Confident	144 Å²	144	44.8 Å²	44.8	77%	0.77	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	1.1	-178	-56.8	-29.5	0	0	0	116.6	Y457	N455-Y457 PolarHBondContact O-N 3.32Å
456	S	79.4	Confident	90.2	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.021	19%	0.193	C	C	.	.			trans	-87.2	21.6	-178.1	-59.9	0	0	0	0	113.6	L453 K454 Q458 R529	L453-S456 VanDerWaalsContact O-CB 3.26Å; L453-S456 WeakPolarHBondContact O-CB 3.27Å; L453-S456 PolarHBondContact O-N 2.89Å; K454-S456 PolarHBondContact O-N 2.03Å; K454-S456 PolarHBondContact O-OG 2.74Å; S456-Q458 VanDerWaalsContact C-N 3.33Å; S456-Q458 PolarHBondContact O-N 2.97Å; S456-R529 PolarHBondContact O-NH2 2.9Å
457	Y	79.5	Confident	90.4	Very high	111 Å²	111	40.8 Å²	40.8	44%	0.435	20%	0.199	S	C	.	.	S	Bend	trans	-70.5	-23.8	-168.8	54.2	-99.3	0	0	0	113.8	N455 R529 K554 I555	N455-Y457 PolarHBondContact O-N 3.32Å; Y457-R529 PolarHBondContact O-NH2 3.23Å; Y457-K554 HydrophobicContact CD2-CD 4.36Å; Y457-K554 VanDerWaalsContact O-CA 3.28Å; Y457-K554 WeakPolarHBondContact O-CA 3.14Å; Y457-I555 WeakPolarHBondContact CA-O 3.29Å; Y457-I555 WeakPolarHBondContact CB-O 3.24Å; Y457-I555 PolarHBondContact O-N 3.22Å
458	Q	83.7	Confident	90.6	Very high	91 Å²	91	40.1 Å²	40.1	43%	0.425	20%	0.196	S	C	.	.	S	Bend	trans	-106.8	-51.4	177.3	-103.3	172.5	-55.3	0	0	113	S456 R529 G531 K554	S456-Q458 VanDerWaalsContact C-N 3.33Å; S456-Q458 PolarHBondContact O-N 2.97Å; Q458-R529 VanDerWaalsContact C-NH2 3.31Å; Q458-R529 PolarHBondContact O-NH2 3.34Å; Q458-R529 VanDerWaalsContact O-NH2 3.09Å; Q458-G531 PolarHBondContact O-N 3.09Å; Q458-K554 HydrophobicContact CG-CG 4.39Å
459	T	90.2	Very high	90.7	Very high	66 Å²	66	43.1 Å²	43.1	41%	0.405	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	150	176.6	179.8	0	0	0	0	111.2	R529	T459-R529 WeakPolarHBondContact CA-O 3.44Å; T459-R529 WeakPolarHBondContact CB-O 3.46Å; T459-R529 PolarHBondContact OG1-O 3.17Å
460	F	93.6	Very high	90.8	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.009	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	159.5	164.3	57.4	-102.4	0	0	0	111.3	I462 T489 F528 R529 I555 F557 N592	F460-I462 HydrophobicContact CD2-CD1 4.41Å; F460-I462 HydrophobicContact CD2-CG1 4.29Å; F460-T489 HydrophobicContact CZ-CG2 4.24Å; F460-F528 CarbonylContact O-C 3.45Å; F460-F528 WeakPolarHBondContact O-CA 3.4Å; F460-F528 WeakPolarHBondContact O-CD2 3.31Å; F460-R529 HydrophobicContact CD1-CB 4.32Å; F460-R529 HydrophobicContact CD2-CB 4.38Å; F460-R529 HydrophobicContact CE1-CB 3.97Å; F460-R529 HydrophobicContact CE2-CB 4Å; F460-R529 HydrophobicContact CZ-CB 3.77Å; F460-R529 PolarHBondContact N-O 2.79Å; F460-R529 PolarHBondContact O-N 2.82Å; F460-I555 HydrophobicContact CE1-CG2 4.48Å; F460-F557 HydrophobicContact CD1-CE2 4.37Å; F460-F557 HydrophobicContact CE1-CE2 4.07Å; F460-F557 AromaticContact CE1-CZ 3.91Å; F460-F557 HydrophobicContact CE1-CZ 3.91Å; F460-N592 WeakPolarHBondContact CA-OD1 3.41Å; F460-N592 WeakPolarHBondContact CB-OD1 3.37Å
461	Q	95.3	Very high	90.9	Very high	41 Å²	41	49.4 Å²	49.4	19%	0.192	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	137.3	165.2	-164	-172.9	-65.6	0	0	108.9	T526 I527 F528 N592 N593	Q461-T526 HydrophobicContact CG-CG2 3.62Å; Q461-I527 CarbonylContact C-O 3.58Å; Q461-I527 WeakPolarHBondContact CA-O 3.42Å; Q461-I527 WeakPolarHBondContact CG-O 3.35Å; Q461-F528 HydrophobicContact CB-CD2 4.04Å; Q461-F528 HydrophobicContact CG-CD2 4.24Å; Q461-N592 PolarHBondContact N-OD1 3.19Å; Q461-N592 PolarHBondContact O-N 2.76Å; Q461-N592 PolarHBondContact O-OD1 2.97Å; Q461-N593 PolarHBondContact NE2-OD1 2.79Å
462	I	96.8	Very high	91.1	Very high	3 Å²	3	47.8 Å²	47.8	2%	0.015	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	126.6	170.1	-55.7	173.6	0	0	0	108.2	L453 F460 L476 T526 I527 L589 T590 I591	L453-I462 HydrophobicContact CD1-CD1 3.96Å; L453-I462 HydrophobicContact CD2-CD1 4.32Å; F460-I462 HydrophobicContact CD2-CD1 4.41Å; F460-I462 HydrophobicContact CD2-CG1 4.29Å; I462-L476 HydrophobicContact CG2-CD1 3.88Å; I462-T526 WeakPolarHBondContact O-CA 3.48Å; I462-I527 HydrophobicContact CB-CD1 4.19Å; I462-I527 HydrophobicContact CB-CG1 3.84Å; I462-I527 HydrophobicContact CD1-CD1 4.42Å; I462-I527 PolarHBondContact N-O 2.03Å; I462-I527 WeakPolarHBondContact O-CG1 3.2Å; I462-I527 PolarHBondContact O-N 3.39Å; I462-L589 HydrophobicContact CG2-CD1 3.62Å; I462-T590 CarbonylContact C-O 3.48Å; I462-T590 VanDerWaalsContact CA-O 3.3Å; I462-T590 WeakPolarHBondContact CA-O 3.47Å; I462-I591 HydrophobicContact CG1-CG1 4.46Å
463	T	97.9	Very high	91.3	Very high	16 Å²	16	46.1 Å²	46.1	10%	0.098	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	136.7	171.7	-51.4	0	0	0	0	109.2	I524 V525 T526 T590	T463-I524 HydrophobicContact CG2-CD1 3.77Å; T463-I524 HydrophobicContact CG2-CG1 3.67Å; T463-V525 CarbonylContact C-O 3.52Å; T463-V525 VanDerWaalsContact CA-O 3.28Å; T463-V525 WeakPolarHBondContact CA-O 3.34Å; T463-T526 WeakPolarHBondContact CG2-OG1 3.49Å; T463-T526 WeakPolarHBondContact OG1-CG2 3.39Å; T463-T526 PolarHBondContact OG1-OG1 2.9Å; T463-T526 VanDerWaalsContact OG1-OG1 3.13Å; T463-T590 PolarHBondContact N-O 2.88Å; T463-T590 PolarHBondContact O-N 2.85Å
464	L	96.8	Very high	91.8	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	130.3	-178.2	-169	80.9	0	0	0	109.8	F466 L475 I524 V525 I586 S588 L589	L464-F466 HydrophobicContact CD2-CB 4.21Å; L464-F466 HydrophobicContact CD2-CD1 4.35Å; L464-F466 HydrophobicContact CD2-CG 4.47Å; L464-L475 HydrophobicContact CD2-CB 4.25Å; L464-L475 HydrophobicContact CD2-CD2 4Å; L464-I524 WeakPolarHBondContact O-CA 3.48Å; L464-V525 HydrophobicContact CB-CG1 3.91Å; L464-V525 PolarHBondContact N-O 2.85Å; L464-V525 PolarHBondContact O-N 3.03Å; L464-I586 HydrophobicContact CD1-CD1 4.27Å; L464-I586 HydrophobicContact CD1-CG2 3.71Å; L464-I586 HydrophobicContact CD2-CD1 4.22Å; L464-I586 HydrophobicContact CD2-CG1 4.49Å; L464-I586 HydrophobicContact CG-CG2 4.33Å; L464-S588 WeakPolarHBondContact CA-O 3.25Å; L464-L589 HydrophobicContact CD1-CB 4.3Å; L464-L589 HydrophobicContact CD1-CD1 3.84Å
465	E	97.6	Very high	92.9	Very high	53 Å²	53	39.4 Å²	39.4	25%	0.248	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	120.4	166	-69.2	176.6	144.6	0	0	109.3	H523 I524 I586 Q587 S588	E465-H523 WeakPolarHBondContact CA-O 3.41Å; E465-I524 HydrophobicContact CG-CB 4.13Å; E465-I524 HydrophobicContact CG-CD1 4.01Å; E465-I524 HydrophobicContact CG-CG1 3.93Å; E465-I586 WeakPolarHBondContact O-CA 3.4Å; E465-Q587 HydrophobicContact CB-CB 4.18Å; E465-Q587 PolarHBondContact O-N 2.84Å; E465-Q587 PolarHBondContact OE2-NE2 2.77Å; E465-S588 WeakPolarHBondContact CB-OG 3.47Å; E465-S588 VanDerWaalsContact CG-OG 3.29Å; E465-S588 WeakPolarHBondContact CG-OG 3.26Å; E465-S588 PolarHBondContact N-O 3.46Å; E465-S588 WeakPolarHBondContact OE2-CB 3.48Å; E465-S588 PolarHBondContact OE2-OG 2.82Å
466	F	97.5	Very high	93.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	154.9	-175	74.4	-75.2	0	0	0	111.9	L464 A468 L475 L498 V517 H523 V525 F582 C585 I586	L464-F466 HydrophobicContact CD2-CB 4.21Å; L464-F466 HydrophobicContact CD2-CD1 4.35Å; L464-F466 HydrophobicContact CD2-CG 4.47Å; F466-A468 HydrophobicContact CD2-CB 4.38Å; F466-A468 HydrophobicContact CE2-CB 4.25Å; F466-L475 HydrophobicContact CB-CD2 4.27Å; F466-L475 HydrophobicContact CD2-CD1 4.22Å; F466-L475 HydrophobicContact CD2-CD2 3.97Å; F466-L475 HydrophobicContact CE1-CD1 4.49Å; F466-L475 HydrophobicContact CE2-CD1 4.12Å; F466-L475 HydrophobicContact CG-CD1 4.47Å; F466-L475 HydrophobicContact CG-CD2 4.11Å; F466-L475 HydrophobicContact CZ-CD1 4.27Å; F466-L498 HydrophobicContact CE1-CD1 4.18Å; F466-L498 HydrophobicContact CE2-CD2 4.44Å; F466-L498 HydrophobicContact CZ-CD1 3.97Å; F466-L498 HydrophobicContact CZ-CD2 3.88Å; F466-L498 HydrophobicContact CZ-CG 4.37Å; F466-V517 HydrophobicContact CE2-CG1 4.06Å; F466-V517 HydrophobicContact CE2-CG2 4.2Å; F466-V517 HydrophobicContact CZ-CG1 4.39Å; F466-V517 HydrophobicContact CZ-CG2 3.85Å; F466-H523 HydrophobicContact CD1-CB 4.39Å; F466-H523 WeakPolarHBondContact CD1-O 3.42Å; F466-H523 HydrophobicContact CE1-CB 3.74Å; F466-H523 HydrophobicContact CZ-CB 3.84Å; F466-H523 PolarHBondContact N-O 3.03Å; F466-H523 PolarHBondContact O-N 3.2Å; F466-V525 HydrophobicContact CD1-CG1 3.88Å; F466-V525 HydrophobicContact CE1-CB 4.13Å; F466-V525 HydrophobicContact CE1-CG1 3.6Å; F466-F582 HydrophobicContact CB-CZ 4.18Å; F466-F582 AromaticContact CD2-CE2 3.96Å; F466-F582 HydrophobicContact CD2-CE2 3.96Å; F466-F582 AromaticContact CD2-CZ 3.9Å; F466-F582 HydrophobicContact CD2-CZ 3.9Å; F466-C585 CarbonylContact C-O 3.57Å; F466-C585 VanDerWaalsContact CA-O 3.27Å; F466-C585 WeakPolarHBondContact CA-O 3.31Å; F466-I586 HydrophobicContact CB-CG1 4.07Å
467	K	97.1	Very high	94.7	Very high	29 Å²	29	32.7 Å²	32.7	13%	0.126	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	115.8	172	169.2	169.6	61.9	173.2	0	108.7	G520 Q521 W522 F582 G584 C585 D637	K467-G520 VanDerWaalsContact CD-O 3.29Å; K467-G520 WeakPolarHBondContact CD-O 3.35Å; K467-Q521 WeakPolarHBondContact CA-O 3.43Å; K467-Q521 WeakPolarHBondContact CB-O 3.29Å; K467-Q521 WeakPolarHBondContact CG-O 3.47Å; K467-W522 HydrophobicContact CB-CD2 3.79Å; K467-W522 HydrophobicContact CB-CE3 3.72Å; K467-W522 HydrophobicContact CB-CG 4.42Å; K467-W522 HydrophobicContact CB-CH2 3.96Å; K467-W522 HydrophobicContact CB-CZ2 4.02Å; K467-W522 HydrophobicContact CB-CZ3 3.82Å; K467-W522 HydrophobicContact CD-CZ2 4.45Å; K467-F582 WeakPolarHBondContact O-CZ 3.01Å; K467-G584 CarbonylContact O-C 3.52Å; K467-G584 VanDerWaalsContact O-CA 3.23Å; K467-G584 WeakPolarHBondContact O-CA 3.48Å; K467-C585 HydrophobicContact CB-CB 4.47Å; K467-C585 PolarHBondContact N-O 3.45Å; K467-C585 PolarHBondContact O-N 3.19Å; K467-D637 IonicContact NZ-OD2 3.95Å; K467-D637 PolarHBondContact NZ-OD2 3.08Å
468	A	96.8	Very high	95.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	136	-173.7	0	0	0	0	0	112.3	F466 L493 V517 L519 G520 F582	F466-A468 HydrophobicContact CD2-CB 4.38Å; F466-A468 HydrophobicContact CE2-CB 4.25Å; A468-L493 HydrophobicContact CB-CD2 4.19Å; A468-V517 HydrophobicContact CB-CG1 3.92Å; A468-L519 HydrophobicContact CB-CD2 3.89Å; A468-L519 CarbonylContact O-C 3.58Å; A468-L519 VanDerWaalsContact O-CA 3.29Å; A468-L519 WeakPolarHBondContact O-CA 3.28Å; A468-G520 PolarHBondContact O-N 3.18Å; A468-F582 HydrophobicContact CB-CE2 3.79Å; A468-F582 HydrophobicContact CB-CZ 4.36Å
469	D	96.6	Very high	95.9	Very high	65 Å²	65	23 Å²	23	35%	0.348	12%	0.12	S	C	.	.	S	Bend	trans	-106.6	3.4	173.4	-61.6	-23	0	0	0	111.8	R441 V583	R441-D469 IonicContact CZ-OD2 3.81Å; R441-D469 VanDerWaalsContact CZ-OD2 3.25Å; R441-D469 IonicContact NH1-OD2 2.73Å; R441-D469 PolarHBondContact NH1-OD2 2.78Å; R441-D469 IonicContact NH2-OD2 3.92Å; R441-D469 PolarHBondContact NH2-OD2 2.04Å; D469-V583 HydrophobicContact CB-CB 4.45Å; D469-V583 HydrophobicContact CB-CG1 4.05Å; D469-V583 PolarHBondContact N-O 2.78Å
470	S	96.8	Very high	95.8	Very high	30 Å²	30	22.8 Å²	22.8	21%	0.21	11%	0.114	C	C	.	.	S	Bend	trans	-143.1	150.2	-176.6	170.5	0	0	0	0	110.7	D472 L493 L519	S470-D472 PolarHBondContact OG-N 2.94Å; S470-D472 PolarHBondContact OG-O 2.96Å; S470-L493 WeakPolarHBondContact O-CD2 3.31Å; S470-L519 VanDerWaalsContact O-CD2 3.26Å; S470-L519 WeakPolarHBondContact O-CD2 3.35Å
471	E	95.9	Very high	95.3	Very high	121 Å²	121	25 Å²	25	57%	0.565	13%	0.126	S	C	*	.	S	Bend	trans	-78.4	-16.1	175.4	-64.3	-170	165	0	0	114.3	L493 Q495 G496 L519	E471-L493 WeakPolarHBondContact O-CD2 3.11Å; E471-L493 WeakPolarHBondContact O-CG 3.28Å; E471-Q495 PolarHBondContact O-N 3Å; E471-G496 PolarHBondContact O-N 3.33Å; E471-L519 HydrophobicContact CG-CD1 3.98Å
472	D	95.3	Very high	94.6	Very high	51 Å²	51	27.2 Å²	27.2	27%	0.273	14%	0.137	S	C	.	.	S	Bend	trans	-125.1	140.7	176.2	-72.3	-44.9	0	0	0	110.2	S470 L493 V494 Q495	S470-D472 PolarHBondContact OG-N 2.94Å; S470-D472 PolarHBondContact OG-O 2.96Å; D472-L493 WeakPolarHBondContact CA-O 3.23Å; D472-V494 VanDerWaalsContact OD1-CA 3.3Å; D472-V494 WeakPolarHBondContact OD1-CA 3.45Å; D472-Q495 PolarHBondContact OD1-N 2.9Å
473	G	95.5	Very high	93.8	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.1	141.7	170	0	0	0	0	0	115.9	L475 A492 L493 G581	G473-L475 PolarHBondContact O-N 3.37Å; G473-A492 WeakPolarHBondContact O-CA 3.39Å; G473-L493 PolarHBondContact N-O 2.6Å; G473-L493 PolarHBondContact O-N 2.74Å; G473-G581 WeakPolarHBondContact CA-O 3.34Å
474	L	97	Very high	92.9	Very high	1 Å²	1	32 Å²	32	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	113.3	178.1	179.3	56.8	0	0	0	112.4	L476 A492 G564 G565 L572 T576 T578 R580 F582	L474-L476 WeakPolarHBondContact CD1-O 3.02Å; L474-A492 HydrophobicContact CD1-CB 4.21Å; L474-G564 CarbonylContact O-C 3.43Å; L474-G564 WeakPolarHBondContact O-CA 3.31Å; L474-G565 PolarHBondContact O-N 3.09Å; L474-L572 HydrophobicContact CD2-CD1 4.11Å; L474-T576 HydrophobicContact CD1-CG2 3.44Å; L474-T576 VanDerWaalsContact CD1-CG2 3.44Å; L474-T576 HydrophobicContact CD2-CG2 4.09Å; L474-T576 HydrophobicContact CG-CG2 4.37Å; L474-T578 HydrophobicContact CB-CG2 4.36Å; L474-R580 WeakPolarHBondContact CB-O 3.34Å; L474-R580 PolarHBondContact N-O 2.79Å; L474-F582 WeakPolarHBondContact O-CB 3.46Å
475	L	97.3	Very high	92.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-43.8	177.7	-74	165.1	0	0	0	112.8	L464 F466 G473 L491 L498 V563 G564 F582	L464-L475 HydrophobicContact CD2-CB 4.25Å; L464-L475 HydrophobicContact CD2-CD2 4Å; F466-L475 HydrophobicContact CB-CD2 4.27Å; F466-L475 HydrophobicContact CD2-CD1 4.22Å; F466-L475 HydrophobicContact CD2-CD2 3.97Å; F466-L475 HydrophobicContact CE1-CD1 4.49Å; F466-L475 HydrophobicContact CE2-CD1 4.12Å; F466-L475 HydrophobicContact CG-CD1 4.47Å; F466-L475 HydrophobicContact CG-CD2 4.11Å; F466-L475 HydrophobicContact CZ-CD1 4.27Å; G473-L475 PolarHBondContact O-N 3.37Å; L475-L491 WeakPolarHBondContact CA-O 3.49Å; L475-L491 HydrophobicContact CB-CD2 4.35Å; L475-L491 HydrophobicContact CB-CG 4.29Å; L475-L491 WeakPolarHBondContact CB-O 3.06Å; L475-L491 HydrophobicContact CD1-CD2 4.17Å; L475-L491 HydrophobicContact CD1-CG 4.22Å; L475-L491 PolarHBondContact N-O 2.79Å; L475-L498 HydrophobicContact CD1-CD2 3.53Å; L475-V563 WeakPolarHBondContact O-CA 3.49Å; L475-G564 PolarHBondContact O-N 2.99Å; L475-F582 HydrophobicContact CD2-CB 4.38Å; L475-F582 HydrophobicContact CD2-CD1 3.99Å; L475-F582 HydrophobicContact CD2-CD2 3.5Å; L475-F582 VanDerWaalsContact CD2-CD2 3.5Å; L475-F582 HydrophobicContact CD2-CE1 4.08Å; L475-F582 HydrophobicContact CD2-CE2 3.6Å; L475-F582 HydrophobicContact CD2-CG 3.7Å; L475-F582 HydrophobicContact CD2-CZ 3.89Å; L475-F582 HydrophobicContact CG-CD2 4.21Å
476	L	96.3	Very high	91.5	Very high	5 Å²	5	39.7 Å²	39.7	3%	0.026	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	141.8	-177.8	-59.2	170.8	0	0	0	111.4	I462 L474 S490 L491 I527 Y562 V563	I462-L476 HydrophobicContact CG2-CD1 3.88Å; L474-L476 WeakPolarHBondContact CD1-O 3.02Å; L476-S490 CarbonylContact O-C 3.59Å; L476-S490 WeakPolarHBondContact O-CA 3.47Å; L476-S490 WeakPolarHBondContact O-CB 3.37Å; L476-L491 HydrophobicContact CB-CB 4.07Å; L476-L491 HydrophobicContact CD1-CB 4.21Å; L476-L491 HydrophobicContact CD1-CD2 4.12Å; L476-L491 HydrophobicContact CG-CB 4.37Å; L476-L491 PolarHBondContact N-O 2.81Å; L476-L491 PolarHBondContact O-N 2.77Å; L476-I527 HydrophobicContact CD1-CD1 4.36Å; L476-Y562 CarbonylContact C-O 3.55Å; L476-Y562 WeakPolarHBondContact CA-O 2.98Å; L476-V563 HydrophobicContact CD2-CB 4.32Å; L476-V563 HydrophobicContact CD2-CG1 4.11Å; L476-V563 HydrophobicContact CD2-CG2 3.82Å
477	Y	96.1	Very high	91.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	137.4	167.4	174.9	-94.2	0	0	0	112.1	N481 G484 F488 Y562 L572 A575 T576	Y477-N481 PolarHBondContact OH-O 2.8Å; Y477-G484 WeakPolarHBondContact OH-CA 3.4Å; Y477-G484 PolarHBondContact OH-N 2.85Å; Y477-F488 HydrophobicContact CE2-CB 3.84Å; Y477-F488 HydrophobicContact CE2-CG 4.4Å; Y477-Y562 HydrophobicContact CD1-CD2 4.04Å; Y477-Y562 PolarHBondContact N-O 3.5Å; Y477-Y562 WeakPolarHBondContact O-CB 3.44Å; Y477-Y562 PolarHBondContact O-N 3.24Å; Y477-L572 HydrophobicContact CD1-CD1 3.84Å; Y477-L572 HydrophobicContact CD1-CD2 4.29Å; Y477-L572 HydrophobicContact CD2-CD1 4.12Å; Y477-L572 HydrophobicContact CD2-CD2 4.18Å; Y477-L572 HydrophobicContact CE1-CD1 4.19Å; Y477-L572 HydrophobicContact CE1-CD2 3.82Å; Y477-L572 HydrophobicContact CE2-CD1 4.46Å; Y477-L572 HydrophobicContact CE2-CD2 3.7Å; Y477-L572 HydrophobicContact CG-CD1 3.82Å; Y477-L572 HydrophobicContact CG-CD2 4.48Å; Y477-A575 HydrophobicContact CE2-CB 4.1Å; Y477-T576 HydrophobicContact CD2-CG2 4.22Å
478	C	94.8	Very high	91	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	138.2	167.6	-166.4	0	0	0	0	109.5	L453 F488 T489 F557 P560 L561	L453-C478 HydrophobicContact CD1-CB 4.2Å; C478-F488 CarbonylContact O-C 3.57Å; C478-F488 WeakPolarHBondContact O-CA 3.06Å; C478-T489 HydrophobicContact CB-CG2 4.08Å; C478-T489 PolarHBondContact N-O 3Å; C478-T489 PolarHBondContact O-N 2.87Å; C478-F557 HydrophobicContact CB-CD1 4.16Å; C478-F557 HydrophobicContact CB-CE1 4.42Å; C478-F557 WeakPolarHBondContact O-CE1 3.06Å; C478-P560 PolarHBondContact SG-O 2.96Å; C478-L561 HydrophobicContact CB-CB 4.47Å; C478-L561 HydrophobicContact CB-CD1 3.93Å
479	G	92	Very high	90.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	-175.3	-175.5	0	0	0	0	0	114.7	N481 D487 R558 S559	G479-N481 PolarHBondContact O-N 2.81Å; G479-D487 CarbonylContact C-O 3.58Å; G479-D487 WeakPolarHBondContact CA-O 3.48Å; G479-R558 PolarHBondContact O-N 3.11Å; G479-S559 PolarHBondContact N-OG 3.33Å; G479-S559 PolarHBondContact O-N 3.06Å; G479-S559 PolarHBondContact O-OG 3Å
480	E	88.3	Confident	90.8	Very high	60 Å²	60	36.7 Å²	36.7	28%	0.28	18%	0.184	S	C	.	.	S	Bend	trans	-69.7	-22.8	175.4	179.8	162.6	-134.9	0	0	112.3	D487 T556 R558	E480-D487 HydrophobicContact CB-CB 4.26Å; E480-D487 PolarHBondContact N-O 2.84Å; E480-T556 PolarHBondContact N-O 2.79Å; E480-R558 HydrophobicContact CG-CG 4.31Å; E480-R558 WeakPolarHBondContact O-CB 3.01Å; E480-R558 IonicContact OE1-CZ 3.79Å; E480-R558 IonicContact OE1-NE 2.77Å; E480-R558 PolarHBondContact OE1-NE 3.19Å; E480-R558 IonicContact OE1-NH2 2.76Å; E480-R558 PolarHBondContact OE1-NH2 2.9Å
481	N	83.9	Confident	90.9	Very high	49 Å²	49	35.3 Å²	35.3	26%	0.262	17%	0.174	S	C	.	.	S	Bend	trans	-156.2	169.2	173.1	54	78	0	0	0	110.5	Y477 G479 H483 R485	Y477-N481 PolarHBondContact OH-O 2.8Å; G479-N481 PolarHBondContact O-N 2.81Å; N481-H483 PolarHBondContact O-N 3.37Å; N481-H483 WeakPolarHBondContact OD1-CB 3.32Å; N481-H483 PolarHBondContact OD1-N 3.36Å; N481-H483 VanDerWaalsContact OD1-N 3.16Å; N481-R485 PolarHBondContact ND2-O 2.88Å; N481-R485 PolarHBondContact OD1-N 3.43Å
482	E	80.1	Confident	91	Very high	88 Å²	88	29.6 Å²	29.6	41%	0.411	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	1.9	-176.5	-63	168.5	179.7	0	0	113.6	Y562 L572	E482-Y562 HydrophobicContact CG-CE2 4.16Å; E482-Y562 PolarHBondContact OE1-OH 3.04Å; E482-L572 VanDerWaalsContact O-CD2 3.3Å; E482-L572 WeakPolarHBondContact O-CD2 3.47Å
483	H	80.3	Confident	91.1	Very high	104 Å²	104	27.1 Å²	27.1	48%	0.481	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	8.1	-176.7	-64.6	77.6	0	0	0	113.4	N481 R485	N481-H483 PolarHBondContact O-N 3.37Å; N481-H483 WeakPolarHBondContact OD1-CB 3.32Å; N481-H483 PolarHBondContact OD1-N 3.36Å; N481-H483 VanDerWaalsContact OD1-N 3.16Å; H483-R485 HydrophobicContact CB-CG 4.36Å; H483-R485 PolarHBondContact O-N 2.87Å
484	G	78.8	Confident	91.1	Very high	15 Å²	15	28 Å²	28	16%	0.155	14%	0.139	C	C	.	.	S	Bend	trans	66.5	21.1	178.7	0	0	0	0	0	114.5	Y477	Y477-G484 WeakPolarHBondContact OH-CA 3.4Å; Y477-G484 PolarHBondContact OH-N 2.85Å
485	R	80.4	Confident	91	Very high	183 Å²	183	35.6 Å²	35.6	69%	0.691	18%	0.175	S	C	*	.			trans	-100.7	138.4	178.5	-58.2	-175.4	-174.9	-172.3	3.7	109.9	N481 H483	N481-R485 PolarHBondContact ND2-O 2.88Å; N481-R485 PolarHBondContact OD1-N 3.43Å; H483-R485 HydrophobicContact CB-CG 4.36Å; H483-R485 PolarHBondContact O-N 2.87Å
486	G	85.6	Confident	90.9	Very high	33 Å²	33	36 Å²	36	34%	0.34	18%	0.178	S	C	.	.	S	Bend	trans	79.9	-141.8	-177.5	0	0	0	0	0	112.3	N503	G486-N503 PolarHBondContact O-ND2 3.06Å
487	D	89.9	Confident	91	Very high	15 Å²	15	39 Å²	39	8%	0.08	19%	0.192	C	C	.	.	S	Bend	trans	-69.4	136.9	-178.9	-78.7	-5.3	0	0	0	112.3	G479 E480 N503 C504 G505 I555 T556	G479-D487 CarbonylContact C-O 3.58Å; G479-D487 WeakPolarHBondContact CA-O 3.48Å; E480-D487 HydrophobicContact CB-CB 4.26Å; E480-D487 PolarHBondContact N-O 2.84Å; D487-N503 WeakPolarHBondContact CA-O 3.45Å; D487-C504 VanDerWaalsContact OD1-C 3.31Å; D487-C504 WeakPolarHBondContact OD1-CA 3.32Å; D487-G505 WeakPolarHBondContact OD1-CA 3.25Å; D487-G505 PolarHBondContact OD1-N 3.26Å; D487-I555 HydrophobicContact CB-CG1 3.76Å; D487-I555 WeakPolarHBondContact OD2-CA 3.4Å; D487-T556 WeakPolarHBondContact CB-O 3.26Å; D487-T556 WeakPolarHBondContact OD2-CB 3.03Å; D487-T556 PolarHBondContact OD2-N 3.33Å; D487-T556 PolarHBondContact OD2-OG1 3.35Å
488	F	92.8	Very high	91.1	Very high	10 Å²	10	39 Å²	39	4%	0.044	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	158.1	172.4	70.3	-95.2	0	0	0	113.4	Y477 C478 R501 F502 N503 A508 I555 A575	Y477-F488 HydrophobicContact CE2-CB 3.84Å; Y477-F488 HydrophobicContact CE2-CG 4.4Å; C478-F488 CarbonylContact O-C 3.57Å; C478-F488 WeakPolarHBondContact O-CA 3.06Å; F488-R501 HydrophobicContact CE2-CB 4.07Å; F488-F502 CarbonylContact O-C 3.59Å; F488-F502 WeakPolarHBondContact O-CA 3.37Å; F488-N503 HydrophobicContact CD1-CB 3.7Å; F488-N503 HydrophobicContact CE1-CB 3.45Å; F488-N503 VanDerWaalsContact CE1-CB 3.45Å; F488-N503 HydrophobicContact CG-CB 4.39Å; F488-N503 HydrophobicContact CZ-CB 3.95Å; F488-N503 PolarHBondContact N-O 2.8Å; F488-N503 PolarHBondContact O-N 3.12Å; F488-A508 HydrophobicContact CE1-CB 4.39Å; F488-A508 HydrophobicContact CZ-CB 3.79Å; F488-I555 WeakPolarHBondContact O-CD1 3.35Å; F488-A575 HydrophobicContact CD1-CB 3.92Å; F488-A575 HydrophobicContact CD2-CB 3.72Å; F488-A575 HydrophobicContact CE1-CB 3.83Å; F488-A575 HydrophobicContact CE2-CB 3.64Å; F488-A575 WeakPolarHBondContact CE2-O 3.23Å; F488-A575 HydrophobicContact CG-CB 3.88Å; F488-A575 HydrophobicContact CZ-CB 3.7Å
489	T	94.6	Very high	91.2	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.031	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	142	162.5	-170.1	0	0	0	0	108.8	L453 F460 C478 R501 F557	L453-T489 HydrophobicContact CD1-CG2 4.06Å; F460-T489 HydrophobicContact CZ-CG2 4.24Å; C478-T489 HydrophobicContact CB-CG2 4.08Å; C478-T489 PolarHBondContact N-O 3Å; C478-T489 PolarHBondContact O-N 2.87Å; T489-R501 CarbonylContact C-O 3.56Å; T489-R501 WeakPolarHBondContact CA-O 3.1Å; T489-F557 HydrophobicContact CG2-CE1 3.57Å; T489-F557 HydrophobicContact CG2-CZ 3.53Å
490	S	96	Very high	91.4	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.007	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	147.9	-179.8	62.4	0	0	0	0	112.4	L476 Y500 R501 A575	L476-S490 CarbonylContact O-C 3.59Å; L476-S490 WeakPolarHBondContact O-CA 3.47Å; L476-S490 WeakPolarHBondContact O-CB 3.37Å; S490-Y500 WeakPolarHBondContact O-CD2 3.32Å; S490-R501 PolarHBondContact N-O 3.06Å; S490-R501 PolarHBondContact O-N 2.97Å; S490-R501 PolarHBondContact OG-O 2.98Å; S490-A575 PolarHBondContact OG-O 2.95Å
491	L	97.9	Very high	91.7	Very high	1 Å²	1	39 Å²	39	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	125.5	170.1	179.8	68.4	0	0	0	107.6	L475 L476 L498 H499 V525 I527 L536	L475-L491 WeakPolarHBondContact CA-O 3.49Å; L475-L491 HydrophobicContact CB-CD2 4.35Å; L475-L491 HydrophobicContact CB-CG 4.29Å; L475-L491 WeakPolarHBondContact CB-O 3.06Å; L475-L491 HydrophobicContact CD1-CD2 4.17Å; L475-L491 HydrophobicContact CD1-CG 4.22Å; L475-L491 PolarHBondContact N-O 2.79Å; L476-L491 HydrophobicContact CB-CB 4.07Å; L476-L491 HydrophobicContact CD1-CB 4.21Å; L476-L491 HydrophobicContact CD1-CD2 4.12Å; L476-L491 HydrophobicContact CG-CB 4.37Å; L476-L491 PolarHBondContact N-O 2.81Å; L476-L491 PolarHBondContact O-N 2.77Å; L491-L498 HydrophobicContact CD1-CB 4.29Å; L491-L498 HydrophobicContact CD1-CD2 4.48Å; L491-H499 WeakPolarHBondContact CA-O 3.36Å; L491-V525 HydrophobicContact CD2-CG1 3.74Å; L491-V525 HydrophobicContact CD2-CG2 4.12Å; L491-I527 HydrophobicContact CD1-CG2 4.16Å; L491-L536 HydrophobicContact CD1-CD1 3.71Å
492	A	97.6	Very high	92.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	148.8	177.4	0	0	0	0	0	110.6	G473 L474 V494 H499 T578	G473-A492 WeakPolarHBondContact O-CA 3.39Å; L474-A492 HydrophobicContact CD1-CB 4.21Å; A492-V494 HydrophobicContact CB-CG2 4.33Å; A492-H499 PolarHBondContact N-O 2.84Å; A492-H499 PolarHBondContact O-N 3.41Å; A492-T578 HydrophobicContact CB-CG2 3.78Å
493	L	97.7	Very high	92.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	131.8	161.5	-161.3	73.3	0	0	0	108.6	A468 S470 E471 D472 G473 K497 L498 V517	A468-L493 HydrophobicContact CB-CD2 4.19Å; S470-L493 WeakPolarHBondContact O-CD2 3.31Å; E471-L493 WeakPolarHBondContact O-CD2 3.11Å; E471-L493 WeakPolarHBondContact O-CG 3.28Å; D472-L493 WeakPolarHBondContact CA-O 3.23Å; G473-L493 PolarHBondContact N-O 2.6Å; G473-L493 PolarHBondContact O-N 2.74Å; L493-K497 WeakPolarHBondContact CA-O 3.45Å; L493-L498 HydrophobicContact CB-CD2 4.49Å; L493-L498 HydrophobicContact CD1-CD2 3.7Å; L493-L498 HydrophobicContact CD1-CG 4.15Å; L493-V517 HydrophobicContact CD1-CB 3.81Å; L493-V517 HydrophobicContact CD1-CG1 4.44Å; L493-V517 HydrophobicContact CD1-CG2 3.49Å; L493-V517 VanDerWaalsContact CD1-CG2 3.49Å
494	V	96.5	Very high	92.9	Very high	18 Å²	18	28.6 Å²	28.6	11%	0.109	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	120.3	177.3	-178.6	0	0	0	0	108	D472 A492 G496 K497 H499	D472-V494 VanDerWaalsContact OD1-CA 3.3Å; D472-V494 WeakPolarHBondContact OD1-CA 3.45Å; A492-V494 HydrophobicContact CB-CG2 4.33Å; V494-G496 PolarHBondContact O-N 2.82Å; V494-K497 PolarHBondContact N-O 3.43Å; V494-K497 PolarHBondContact O-N 2.71Å; V494-H499 WeakPolarHBondContact CB-ND1 3.44Å; V494-H499 HydrophobicContact CG2-CB 4.28Å; V494-H499 WeakPolarHBondContact CG2-ND1 3.46Å
495	Q	95.2	Very high	92.8	Very high	161 Å²	161	30 Å²	30	75%	0.752	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.1	44.3	-178.7	-60.2	-177.7	-31.2	0	0	112.8	E471 D472 K497	E471-Q495 PolarHBondContact O-N 3Å; D472-Q495 PolarHBondContact OD1-N 2.9Å; Q495-K497 VanDerWaalsContact C-N 3.27Å; Q495-K497 PolarHBondContact O-N 2.93Å
496	G	94.9	Very high	92.5	Very high	7 Å²	7	24.6 Å²	24.6	7%	0.072	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	4.5	179.4	0	0	0	0	0	115.5	E471 V494 P516 V517	E471-G496 PolarHBondContact O-N 3.33Å; V494-G496 PolarHBondContact O-N 2.82Å; G496-P516 CarbonylContact O-C 3.54Å; G496-P516 VanDerWaalsContact O-CA 3.28Å; G496-P516 WeakPolarHBondContact O-CA 3.43Å; G496-P516 WeakPolarHBondContact O-CB 3.32Å; G496-V517 PolarHBondContact O-N 3.17Å
497	K	97.1	Very high	92.2	Very high	70 Å²	70	24 Å²	24	30%	0.304	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	145.6	178.1	-80.7	171.7	166.3	-81	0	112.2	L493 V494 Q495 H499 I512 S513 E514 P516	L493-K497 WeakPolarHBondContact CA-O 3.45Å; V494-K497 PolarHBondContact N-O 3.43Å; V494-K497 PolarHBondContact O-N 2.71Å; Q495-K497 VanDerWaalsContact C-N 3.27Å; Q495-K497 PolarHBondContact O-N 2.93Å; K497-H499 PolarHBondContact O-N 2.55Å; K497-I512 HydrophobicContact CB-CG2 4.16Å; K497-I512 HydrophobicContact CD-CG2 4.14Å; K497-S513 PolarHBondContact NZ-O 2.97Å; K497-E514 PolarHBondContact NZ-O 2.85Å; K497-P516 HydrophobicContact CG-CB 4.47Å
498	L	97.9	Very high	92	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	119	177.1	-67.6	176	0	0	0	110.2	F466 L475 L491 L493 I512 S513 V517 V525 L536 M538	F466-L498 HydrophobicContact CE1-CD1 4.18Å; F466-L498 HydrophobicContact CE2-CD2 4.44Å; F466-L498 HydrophobicContact CZ-CD1 3.97Å; F466-L498 HydrophobicContact CZ-CD2 3.88Å; F466-L498 HydrophobicContact CZ-CG 4.37Å; L475-L498 HydrophobicContact CD1-CD2 3.53Å; L491-L498 HydrophobicContact CD1-CB 4.29Å; L491-L498 HydrophobicContact CD1-CD2 4.48Å; L493-L498 HydrophobicContact CB-CD2 4.49Å; L493-L498 HydrophobicContact CD1-CD2 3.7Å; L493-L498 HydrophobicContact CD1-CG 4.15Å; L498-I512 CarbonylContact O-C 3.56Å; L498-I512 WeakPolarHBondContact O-CA 3.07Å; L498-S513 PolarHBondContact N-OG 2.82Å; L498-S513 PolarHBondContact O-N 3.18Å; L498-V517 HydrophobicContact CD1-CG2 4.32Å; L498-V517 HydrophobicContact CD2-CG2 4.27Å; L498-V517 HydrophobicContact CG-CG2 3.92Å; L498-V525 HydrophobicContact CD1-CB 3.83Å; L498-V525 HydrophobicContact CD1-CG1 4.31Å; L498-V525 HydrophobicContact CD1-CG2 3.76Å; L498-L536 HydrophobicContact CB-CD1 3.91Å; L498-M538 HydrophobicContact CD1-CB 4.44Å; L498-M538 HydrophobicContact CD1-CG 4.13Å; L498-M538 HydrophobicContact CD1-SD 3.48Å; L498-M538 WeakPolarHBondContact CD1-SD 3.26Å; L498-M538 HydrophobicContact CG-SD 4.15Å
499	H	97.4	Very high	91.8	Very high	22 Å²	22	25.5 Å²	25.5	10%	0.102	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	106.2	171.2	-73.7	178	0	0	0	109.7	L491 A492 V494 K497 Q510 I511	L491-H499 WeakPolarHBondContact CA-O 3.36Å; A492-H499 PolarHBondContact N-O 2.84Å; A492-H499 PolarHBondContact O-N 3.41Å; V494-H499 WeakPolarHBondContact CB-ND1 3.44Å; V494-H499 HydrophobicContact CG2-CB 4.28Å; V494-H499 WeakPolarHBondContact CG2-ND1 3.46Å; K497-H499 PolarHBondContact O-N 2.55Å; H499-Q510 PolarHBondContact CE1-NE2 3.12Å; H499-Q510 VanDerWaalsContact CE1-NE2 3.33Å; H499-Q510 PolarHBondContact ND1-NE2 2.77Å; H499-I511 WeakPolarHBondContact CA-O 3.26Å
500	Y	97.4	Very high	91.8	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	125.4	166.2	172.2	-141	0	0	0	109	S490 F502 I511 I527 F528 L536	S490-Y500 WeakPolarHBondContact O-CD2 3.32Å; Y500-F502 AromaticContact CE1-CD1 3.96Å; Y500-F502 HydrophobicContact CE1-CD1 3.96Å; Y500-F502 HydrophobicContact CE1-CE1 4.07Å; Y500-F502 HydrophobicContact CE2-CD1 4.04Å; Y500-F502 AromaticContact CZ-CD1 3.63Å; Y500-I511 HydrophobicContact CD1-CB 4.3Å; Y500-I511 HydrophobicContact CD1-CD1 3.7Å; Y500-I511 HydrophobicContact CE1-CD1 4.01Å; Y500-I511 PolarHBondContact N-O 2.79Å; Y500-I511 PolarHBondContact O-N 3.31Å; Y500-I527 HydrophobicContact CD1-CB 4.05Å; Y500-I527 HydrophobicContact CD1-CG2 3.8Å; Y500-I527 HydrophobicContact CD2-CB 4.14Å; Y500-I527 HydrophobicContact CD2-CD1 3.88Å; Y500-I527 HydrophobicContact CD2-CG2 3.88Å; Y500-I527 HydrophobicContact CE1-CB 3.96Å; Y500-I527 HydrophobicContact CE1-CG2 4.24Å; Y500-I527 HydrophobicContact CE2-CB 4.08Å; Y500-I527 HydrophobicContact CE2-CD1 3.68Å; Y500-I527 HydrophobicContact CE2-CG1 4.42Å; Y500-I527 HydrophobicContact CE2-CG2 4.34Å; Y500-I527 HydrophobicContact CG-CB 4.15Å; Y500-I527 HydrophobicContact CG-CG2 3.61Å; Y500-F528 WeakPolarHBondContact CE1-O 3.38Å; Y500-F528 PolarHBondContact OH-O 3.21Å; Y500-F528 VanDerWaalsContact OH-O 3.08Å; Y500-L536 HydrophobicContact CD1-CB 4.22Å
501	R	94.6	Very high	91.7	Very high	38 Å²	38	29.7 Å²	29.7	14%	0.143	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	136.2	-176.7	-64.4	174.2	172.1	-161	-2.2	110.7	F488 T489 S490 A509 Q510 R574 A575 G577	F488-R501 HydrophobicContact CE2-CB 4.07Å; T489-R501 CarbonylContact C-O 3.56Å; T489-R501 WeakPolarHBondContact CA-O 3.1Å; S490-R501 PolarHBondContact N-O 3.06Å; S490-R501 PolarHBondContact O-N 2.97Å; S490-R501 PolarHBondContact OG-O 2.98Å; R501-A509 VanDerWaalsContact CA-O 3.26Å; R501-A509 WeakPolarHBondContact CA-O 3.31Å; R501-Q510 HydrophobicContact CG-CB 4.05Å; R501-Q510 HydrophobicContact CG-CG 3.93Å; R501-R574 PolarHBondContact NH1-O 2.77Å; R501-A575 WeakPolarHBondContact CD-O 3.05Å; R501-G577 VanDerWaalsContact NH1-CA 3.3Å; R501-G577 VanDerWaalsContact NH1-N 3.19Å
502	F	93.4	Very high	91.7	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	147.3	174.6	64.4	-91	0	0	0	112.1	F488 Y500 A508 A509 I511 R529 M532	F488-F502 CarbonylContact O-C 3.59Å; F488-F502 WeakPolarHBondContact O-CA 3.37Å; Y500-F502 AromaticContact CE1-CD1 3.96Å; Y500-F502 HydrophobicContact CE1-CD1 3.96Å; Y500-F502 HydrophobicContact CE1-CE1 4.07Å; Y500-F502 HydrophobicContact CE2-CD1 4.04Å; Y500-F502 AromaticContact CZ-CD1 3.63Å; F502-A508 CarbonylContact O-C 3.58Å; F502-A508 WeakPolarHBondContact O-CA 3.37Å; F502-A509 HydrophobicContact CD1-CB 3.89Å; F502-A509 HydrophobicContact CD2-CB 4.21Å; F502-A509 HydrophobicContact CE1-CB 3.58Å; F502-A509 HydrophobicContact CE2-CB 3.93Å; F502-A509 HydrophobicContact CG-CB 4.19Å; F502-A509 HydrophobicContact CZ-CB 3.6Å; F502-A509 PolarHBondContact N-O 2.83Å; F502-A509 PolarHBondContact O-N 2.58Å; F502-I511 HydrophobicContact CE1-CD1 4.16Å; F502-R529 HydrophobicContact CD2-CG 4.33Å; F502-R529 HydrophobicContact CE2-CG 4.11Å; F502-R529 HydrophobicContact CZ-CG 4.23Å; F502-M532 WeakPolarHBondContact CE2-O 3.4Å; F502-M532 WeakPolarHBondContact CZ-O 3.41Å
503	N	89.9	Confident	91.6	Very high	20 Å²	20	33 Å²	33	11%	0.107	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	130.7	178.7	-177.1	32.2	0	0	0	110.7	G486 D487 F488 G505 T506 G507 A508 I555	G486-N503 PolarHBondContact O-ND2 3.06Å; D487-N503 WeakPolarHBondContact CA-O 3.45Å; F488-N503 HydrophobicContact CD1-CB 3.7Å; F488-N503 HydrophobicContact CE1-CB 3.45Å; F488-N503 VanDerWaalsContact CE1-CB 3.45Å; F488-N503 HydrophobicContact CG-CB 4.39Å; F488-N503 HydrophobicContact CZ-CB 3.95Å; F488-N503 PolarHBondContact N-O 2.8Å; F488-N503 PolarHBondContact O-N 3.12Å; N503-G505 PolarHBondContact OD1-N 3.19Å; N503-T506 PolarHBondContact OD1-N 2.86Å; N503-G507 WeakPolarHBondContact OD1-CA 3.15Å; N503-G507 PolarHBondContact OD1-N 3.36Å; N503-G507 PolarHBondContact OD1-O 3.32Å; N503-A508 HydrophobicContact CB-CB 4.2Å; N503-I555 WeakPolarHBondContact O-CD1 3.46Å; N503-I555 WeakPolarHBondContact O-CG1 3.49Å
504	C	85.4	Confident	91.3	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.014	22%	0.217	C	C	.	.	S	Bend	trans	-109.4	65.9	170.8	-52.3	0	0	0	0	108.3	D487 T506 Y552	D487-C504 VanDerWaalsContact OD1-C 3.31Å; D487-C504 WeakPolarHBondContact OD1-CA 3.32Å; C504-T506 PolarHBondContact O-N 3.21Å; C504-T506 PolarHBondContact O-OG1 2.85Å; C504-Y552 VanDerWaalsContact CB-O 3.29Å; C504-Y552 WeakPolarHBondContact CB-O 3.26Å
505	G	76	Confident	91.2	Very high	44 Å²	44	40.3 Å²	40.3	45%	0.454	23%	0.226	S	C	.	.	S	Bend	trans	65.1	-10.1	173.7	0	0	0	0	0	118.6	D487 N503	D487-G505 WeakPolarHBondContact OD1-CA 3.25Å; D487-G505 PolarHBondContact OD1-N 3.26Å; N503-G505 PolarHBondContact OD1-N 3.19Å
506	T	73.9	Confident	91.3	Very high	70 Å²	70	36.3 Å²	36.3	43%	0.429	21%	0.214	S	C	.	.	S	Bend	trans	-132.5	-4.5	-168.1	28.9	0	0	0	0	116.2	N503 C504 L549 G550 Y552	N503-T506 PolarHBondContact OD1-N 2.86Å; C504-T506 PolarHBondContact O-N 3.21Å; C504-T506 PolarHBondContact O-OG1 2.85Å; T506-L549 CarbonylContact C-O 3.49Å; T506-G550 WeakPolarHBondContact OG1-CA 3.46Å; T506-Y552 HydrophobicContact CG2-CD2 3.74Å; T506-Y552 HydrophobicContact CG2-CE2 3.71Å
507	G	79.8	Confident	91.3	Very high	20 Å²	20	36.5 Å²	36.5	21%	0.206	21%	0.214	C	C	.	.			trans	156.8	125.5	176.8	0	0	0	0	0	112.1	N503 A509 S548 L549	N503-G507 WeakPolarHBondContact OD1-CA 3.15Å; N503-G507 PolarHBondContact OD1-N 3.36Å; N503-G507 PolarHBondContact OD1-O 3.32Å; G507-A509 PolarHBondContact O-N 2.84Å; G507-S548 WeakPolarHBondContact O-CB 3.43Å; G507-L549 WeakPolarHBondContact CA-O 3.46Å; G507-L549 PolarHBondContact N-O 2.8Å; G507-L549 PolarHBondContact O-N 2.89Å
508	A	85.6	Confident	91.3	Very high	53 Å²	53	36.3 Å²	36.3	44%	0.438	22%	0.219	S	C	.	.			trans	-68.2	130.3	-178.5	0	0	0	0	0	112	F488 F502 N503	F488-A508 HydrophobicContact CE1-CB 4.39Å; F488-A508 HydrophobicContact CZ-CB 3.79Å; F502-A508 CarbonylContact O-C 3.58Å; F502-A508 WeakPolarHBondContact O-CA 3.37Å; N503-A508 HydrophobicContact CB-CB 4.2Å
509	A	89.6	Confident	91.3	Very high	3 Å²	3	39.8 Å²	39.8	3%	0.025	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	148.1	157.5	0	0	0	0	0	109.7	R501 F502 G507	R501-A509 VanDerWaalsContact CA-O 3.26Å; R501-A509 WeakPolarHBondContact CA-O 3.31Å; F502-A509 HydrophobicContact CD1-CB 3.89Å; F502-A509 HydrophobicContact CD2-CB 4.21Å; F502-A509 HydrophobicContact CE1-CB 3.58Å; F502-A509 HydrophobicContact CE2-CB 3.93Å; F502-A509 HydrophobicContact CG-CB 4.19Å; F502-A509 HydrophobicContact CZ-CB 3.6Å; F502-A509 PolarHBondContact N-O 2.83Å; F502-A509 PolarHBondContact O-N 2.58Å; G507-A509 PolarHBondContact O-N 2.84Å
510	Q	93.2	Very high	91.1	Very high	90 Å²	90	40.9 Å²	40.9	42%	0.421	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	129.9	162.1	-179.9	173.2	-10.9	0	0	109	H499 R501 I512	H499-Q510 PolarHBondContact CE1-NE2 3.12Å; H499-Q510 VanDerWaalsContact CE1-NE2 3.33Å; H499-Q510 PolarHBondContact ND1-NE2 2.77Å; R501-Q510 HydrophobicContact CG-CB 4.05Å; R501-Q510 HydrophobicContact CG-CG 3.93Å; Q510-I512 HydrophobicContact CG-CD1 4.44Å; Q510-I512 HydrophobicContact CG-CG1 4.03Å
511	I	95.7	Very high	91	Very high	5 Å²	5	46.3 Å²	46.3	3%	0.026	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	136.1	175.5	-63.2	163	0	0	0	106.3	H499 Y500 F502 G534 L536 I544	H499-I511 WeakPolarHBondContact CA-O 3.26Å; Y500-I511 HydrophobicContact CD1-CB 4.3Å; Y500-I511 HydrophobicContact CD1-CD1 3.7Å; Y500-I511 HydrophobicContact CE1-CD1 4.01Å; Y500-I511 PolarHBondContact N-O 2.79Å; Y500-I511 PolarHBondContact O-N 3.31Å; F502-I511 HydrophobicContact CE1-CD1 4.16Å; I511-G534 WeakPolarHBondContact CD1-O 3.44Å; I511-L536 HydrophobicContact CG2-CB 3.75Å; I511-I544 HydrophobicContact CG2-CB 4.17Å; I511-I544 HydrophobicContact CG2-CG2 4.02Å; I511-I544 WeakPolarHBondContact CG2-O 3.36Å
512	I	96.6	Very high	91	Very high	70 Å²	70	47.8 Å²	47.8	36%	0.359	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	135.9	-172.8	-54.2	-177.1	0	0	0	108.2	K497 L498 Q510 I544	K497-I512 HydrophobicContact CB-CG2 4.16Å; K497-I512 HydrophobicContact CD-CG2 4.14Å; L498-I512 CarbonylContact O-C 3.56Å; L498-I512 WeakPolarHBondContact O-CA 3.07Å; Q510-I512 HydrophobicContact CG-CD1 4.44Å; Q510-I512 HydrophobicContact CG-CG1 4.03Å; I512-I544 VanDerWaalsContact O-CD1 3.25Å; I512-I544 WeakPolarHBondContact O-CD1 3.38Å
513	S	96.2	Very high	91.2	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.007	29%	0.288	C	S	.	.			trans	-62.7	142.6	175.4	63.2	0	0	0	0	112.5	K497 L498 S515	K497-S513 PolarHBondContact NZ-O 2.97Å; L498-S513 PolarHBondContact N-OG 2.82Å; L498-S513 PolarHBondContact O-N 3.18Å; S513-S515 VanDerWaalsContact CB-O 3.27Å; S513-S515 WeakPolarHBondContact CB-O 3.32Å; S513-S515 PolarHBondContact OG-O 2.83Å
514	E	90.8	Very high	91.6	Very high	128 Å²	128	50.6 Å²	50.6	60%	0.598	30%	0.299	S	S	*	.	S	Bend	trans	-72.4	-54	176	176.9	166.2	-153.8	0	0	109.4	K497 I544	K497-E514 PolarHBondContact NZ-O 2.85Å; E514-I544 HydrophobicContact CB-CD1 3.65Å
515	S	94.6	Very high	92.2	Very high	42 Å²	42	50.5 Å²	50.5	29%	0.294	30%	0.298	S	S	.	.	S	Bend	trans	-71.8	146.2	168.4	-60.4	0	0	0	0	111.6	S513 M538 D541	S513-S515 VanDerWaalsContact CB-O 3.27Å; S513-S515 WeakPolarHBondContact CB-O 3.32Å; S513-S515 PolarHBondContact OG-O 2.83Å; S515-M538 WeakPolarHBondContact O-CE 3.24Å; S515-D541 VanDerWaalsContact CB-OD2 3.28Å; S515-D541 WeakPolarHBondContact CB-OD2 3.1Å; S515-D541 PolarHBondContact N-OD2 3.02Å; S515-D541 PolarHBondContact OG-OD1 2.88Å; S515-D541 PolarHBondContact OG-OD2 3.15Å
516	P	96.6	Very high	93.2	Very high	77 Å²	77	49.5 Å²	49.5	50%	0.5	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-77.9	160.7	162	34.9	-33.5	0	0	0	110.8	G496 K497	G496-P516 CarbonylContact O-C 3.54Å; G496-P516 VanDerWaalsContact O-CA 3.28Å; G496-P516 WeakPolarHBondContact O-CA 3.43Å; G496-P516 WeakPolarHBondContact O-CB 3.32Å; K497-P516 HydrophobicContact CG-CB 4.47Å
517	V	96.8	Very high	94.3	Very high	11 Å²	11	46.3 Å²	46.3	7%	0.067	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-77.7	138.2	170.7	169.1	0	0	0	0	109.8	F466 A468 L493 G496 L498 M538	F466-V517 HydrophobicContact CE2-CG1 4.06Å; F466-V517 HydrophobicContact CE2-CG2 4.2Å; F466-V517 HydrophobicContact CZ-CG1 4.39Å; F466-V517 HydrophobicContact CZ-CG2 3.85Å; A468-V517 HydrophobicContact CB-CG1 3.92Å; L493-V517 HydrophobicContact CD1-CB 3.81Å; L493-V517 HydrophobicContact CD1-CG1 4.44Å; L493-V517 HydrophobicContact CD1-CG2 3.49Å; L493-V517 VanDerWaalsContact CD1-CG2 3.49Å; G496-V517 PolarHBondContact O-N 3.17Å; L498-V517 HydrophobicContact CD1-CG2 4.32Å; L498-V517 HydrophobicContact CD2-CG2 4.27Å; L498-V517 HydrophobicContact CG-CG2 3.92Å; V517-M538 HydrophobicContact CG2-CE 4.41Å; V517-M538 HydrophobicContact CG2-SD 3.61Å
518	V	97.2	Very high	95.1	Very high	67 Å²	67	47.9 Å²	47.9	41%	0.406	27%	0.265	S	S	.	.			trans	-93.7	114.7	175.1	-175.2	0	0	0	0	108.7	Q521 H523	V518-Q521 HydrophobicContact CB-CB 4.26Å; V518-Q521 HydrophobicContact CB-CG 4.34Å; V518-Q521 HydrophobicContact CG1-CB 4.33Å; V518-Q521 HydrophobicContact CG1-CG 3.88Å; V518-Q521 PolarHBondContact O-N 3.35Å; V518-H523 PolarHBondContact N-NE2 2.85Å; V518-H523 PolarHBondContact O-NE2 2.94Å
519	L	96.8	Very high	95.5	Very high	73 Å²	73	45.3 Å²	45.3	38%	0.382	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	141.4	-179.5	-55.7	-172.4	0	0	0	111.3	A468 S470 E471 Q521	A468-L519 HydrophobicContact CB-CD2 3.89Å; A468-L519 CarbonylContact O-C 3.58Å; A468-L519 VanDerWaalsContact O-CA 3.29Å; A468-L519 WeakPolarHBondContact O-CA 3.28Å; S470-L519 VanDerWaalsContact O-CD2 3.26Å; S470-L519 WeakPolarHBondContact O-CD2 3.35Å; E471-L519 HydrophobicContact CG-CD1 3.98Å; L519-Q521 PolarHBondContact O-N 2.88Å
520	G	92.8	Very high	95.6	Very high	44 Å²	44	49.5 Å²	49.5	45%	0.454	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	4.2	-175.9	0	0	0	0	0	115.4	K467 A468	K467-G520 VanDerWaalsContact CD-O 3.29Å; K467-G520 WeakPolarHBondContact CD-O 3.35Å; A468-G520 PolarHBondContact O-N 3.18Å
521	Q	95.4	Very high	95.4	Very high	114 Å²	114	45.6 Å²	45.6	53%	0.533	25%	0.25	S	C	.	.	S	Bend	trans	-113.4	155.9	174	-62.1	-168.7	-5.4	0	0	112.2	K467 V518 L519	K467-Q521 WeakPolarHBondContact CA-O 3.43Å; K467-Q521 WeakPolarHBondContact CB-O 3.29Å; K467-Q521 WeakPolarHBondContact CG-O 3.47Å; V518-Q521 HydrophobicContact CB-CB 4.26Å; V518-Q521 HydrophobicContact CB-CG 4.34Å; V518-Q521 HydrophobicContact CG1-CB 4.33Å; V518-Q521 HydrophobicContact CG1-CG 3.88Å; V518-Q521 PolarHBondContact O-N 3.35Å; L519-Q521 PolarHBondContact O-N 2.88Å
522	W	95.8	Very high	95	Very high	69 Å²	69	46.2 Å²	46.2	26%	0.261	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	130.9	173.4	-71.9	105.6	0	0	0	111.2	K467 C585 Q587 A636 D637	K467-W522 HydrophobicContact CB-CD2 3.79Å; K467-W522 HydrophobicContact CB-CE3 3.72Å; K467-W522 HydrophobicContact CB-CG 4.42Å; K467-W522 HydrophobicContact CB-CH2 3.96Å; K467-W522 HydrophobicContact CB-CZ2 4.02Å; K467-W522 HydrophobicContact CB-CZ3 3.82Å; K467-W522 HydrophobicContact CD-CZ2 4.45Å; W522-C585 HydrophobicContact CH2-CB 3.53Å; W522-C585 HydrophobicContact CZ2-CB 4.22Å; W522-C585 HydrophobicContact CZ3-CB 4.29Å; W522-Q587 HydrophobicContact CE3-CB 4.24Å; W522-Q587 HydrophobicContact CH2-CB 3.77Å; W522-Q587 HydrophobicContact CZ3-CB 3.57Å; W522-A636 HydrophobicContact CH2-CB 3.53Å; W522-A636 HydrophobicContact CZ2-CB 3.45Å; W522-A636 VanDerWaalsContact CZ2-CB 3.45Å; W522-D637 PolarHBondContact NE1-OD1 2.79Å; W522-D637 PolarHBondContact NE1-OD2 2.84Å
523	H	97.4	Very high	94.8	Very high	14 Å²	14	45.9 Å²	45.9	7%	0.065	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	143.6	170.1	-67	-83.4	0	0	0	109.8	E465 F466 V518 M538 D539	E465-H523 WeakPolarHBondContact CA-O 3.41Å; F466-H523 HydrophobicContact CD1-CB 4.39Å; F466-H523 WeakPolarHBondContact CD1-O 3.42Å; F466-H523 HydrophobicContact CE1-CB 3.74Å; F466-H523 HydrophobicContact CZ-CB 3.84Å; F466-H523 PolarHBondContact N-O 3.03Å; F466-H523 PolarHBondContact O-N 3.2Å; V518-H523 PolarHBondContact N-NE2 2.85Å; V518-H523 PolarHBondContact O-NE2 2.94Å; H523-M538 HydrophobicContact CB-CG 4.46Å; H523-D539 VanDerWaalsContact CA-OD1 3.29Å; H523-D539 WeakPolarHBondContact CA-OD1 3.43Å; H523-D539 IonicContact CE1-OD2 3.18Å; H523-D539 IonicContact CG-OD2 2.76Å; H523-D539 IonicContact ND1-OD1 3.69Å; H523-D539 IonicContact ND1-OD2 3.69Å; H523-D539 PolarHBondContact ND1-OD2 3.24Å
524	I	97.4	Very high	94.7	Very high	66 Å²	66	46 Å²	46	34%	0.338	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	120.6	170	-172.6	170.3	0	0	0	109.1	T463 L464 E465 M538 D539	T463-I524 HydrophobicContact CG2-CD1 3.77Å; T463-I524 HydrophobicContact CG2-CG1 3.67Å; L464-I524 WeakPolarHBondContact O-CA 3.48Å; E465-I524 HydrophobicContact CG-CB 4.13Å; E465-I524 HydrophobicContact CG-CD1 4.01Å; E465-I524 HydrophobicContact CG-CG1 3.93Å; I524-M538 CarbonylContact O-C 3.5Å; I524-M538 WeakPolarHBondContact O-CA 3.01Å; I524-D539 PolarHBondContact N-OD1 3.1Å; I524-D539 PolarHBondContact O-N 3.04Å
525	V	97.9	Very high	94.9	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	128.8	175.6	55.7	0	0	0	0	110	T463 L464 F466 L491 L498 I527 L536 R537	T463-V525 CarbonylContact C-O 3.52Å; T463-V525 VanDerWaalsContact CA-O 3.28Å; T463-V525 WeakPolarHBondContact CA-O 3.34Å; L464-V525 HydrophobicContact CB-CG1 3.91Å; L464-V525 PolarHBondContact N-O 2.85Å; L464-V525 PolarHBondContact O-N 3.03Å; F466-V525 HydrophobicContact CD1-CG1 3.88Å; F466-V525 HydrophobicContact CE1-CB 4.13Å; F466-V525 HydrophobicContact CE1-CG1 3.6Å; L491-V525 HydrophobicContact CD2-CG1 3.74Å; L491-V525 HydrophobicContact CD2-CG2 4.12Å; L498-V525 HydrophobicContact CD1-CB 3.83Å; L498-V525 HydrophobicContact CD1-CG1 4.31Å; L498-V525 HydrophobicContact CD1-CG2 3.76Å; V525-I527 HydrophobicContact CG2-CG2 4.29Å; V525-L536 HydrophobicContact CG2-CD1 3.88Å; V525-L536 HydrophobicContact CG2-CG 4.05Å; V525-R537 CarbonylContact C-O 3.56Å; V525-R537 WeakPolarHBondContact CA-O 2.97Å
526	T	97.4	Very high	95	Very high	23 Å²	23	41 Å²	41	14%	0.141	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	123.4	167.9	-57.3	0	0	0	0	109.2	Q461 I462 T463 W535 L536 R537	Q461-T526 HydrophobicContact CG-CG2 3.62Å; I462-T526 WeakPolarHBondContact O-CA 3.48Å; T463-T526 WeakPolarHBondContact CG2-OG1 3.49Å; T463-T526 WeakPolarHBondContact OG1-CG2 3.39Å; T463-T526 PolarHBondContact OG1-OG1 2.9Å; T463-T526 VanDerWaalsContact OG1-OG1 3.13Å; T526-W535 HydrophobicContact CG2-CH2 3.63Å; T526-W535 HydrophobicContact CG2-CZ3 3.65Å; T526-L536 WeakPolarHBondContact O-CA 3.42Å; T526-R537 PolarHBondContact N-O 3.45Å; T526-R537 PolarHBondContact O-N 3.15Å
527	I	96.9	Very high	95	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	143.8	166.6	57.3	170	0	0	0	110.2	Q461 I462 L476 L491 Y500 V525 W535 L536	Q461-I527 CarbonylContact C-O 3.58Å; Q461-I527 WeakPolarHBondContact CA-O 3.42Å; Q461-I527 WeakPolarHBondContact CG-O 3.35Å; I462-I527 HydrophobicContact CB-CD1 4.19Å; I462-I527 HydrophobicContact CB-CG1 3.84Å; I462-I527 HydrophobicContact CD1-CD1 4.42Å; I462-I527 PolarHBondContact N-O 2.03Å; I462-I527 WeakPolarHBondContact O-CG1 3.2Å; I462-I527 PolarHBondContact O-N 3.39Å; L476-I527 HydrophobicContact CD1-CD1 4.36Å; L491-I527 HydrophobicContact CD1-CG2 4.16Å; Y500-I527 HydrophobicContact CD1-CB 4.05Å; Y500-I527 HydrophobicContact CD1-CG2 3.8Å; Y500-I527 HydrophobicContact CD2-CB 4.14Å; Y500-I527 HydrophobicContact CD2-CD1 3.88Å; Y500-I527 HydrophobicContact CD2-CG2 3.88Å; Y500-I527 HydrophobicContact CE1-CB 3.96Å; Y500-I527 HydrophobicContact CE1-CG2 4.24Å; Y500-I527 HydrophobicContact CE2-CB 4.08Å; Y500-I527 HydrophobicContact CE2-CD1 3.68Å; Y500-I527 HydrophobicContact CE2-CG1 4.42Å; Y500-I527 HydrophobicContact CE2-CG2 4.34Å; Y500-I527 HydrophobicContact CG-CB 4.15Å; Y500-I527 HydrophobicContact CG-CG2 3.61Å; V525-I527 HydrophobicContact CG2-CG2 4.29Å; I527-W535 WeakPolarHBondContact CA-O 3.35Å; I527-L536 HydrophobicContact CG2-CB 4.18Å; I527-L536 HydrophobicContact CG2-CD1 3.95Å; I527-L536 HydrophobicContact CG2-CG 4.24Å
528	F	95.8	Very high	95	Very high	53 Å²	53	41.2 Å²	41.2	23%	0.232	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	152.3	177	178.5	-95.7	0	0	0	110.3	F460 Q461 Y500 D530 G534 W535	F460-F528 CarbonylContact O-C 3.45Å; F460-F528 WeakPolarHBondContact O-CA 3.4Å; F460-F528 WeakPolarHBondContact O-CD2 3.31Å; Q461-F528 HydrophobicContact CB-CD2 4.04Å; Q461-F528 HydrophobicContact CG-CD2 4.24Å; Y500-F528 WeakPolarHBondContact CE1-O 3.38Å; Y500-F528 PolarHBondContact OH-O 3.21Å; Y500-F528 VanDerWaalsContact OH-O 3.08Å; F528-D530 HydrophobicContact CE1-CB 3.66Å; F528-D530 HydrophobicContact CZ-CB 3.87Å; F528-G534 CarbonylContact O-C 3.57Å; F528-G534 WeakPolarHBondContact O-CA 3.39Å; F528-W535 HydrophobicContact CB-CD2 3.62Å; F528-W535 HydrophobicContact CB-CE3 4.11Å; F528-W535 HydrophobicContact CB-CG 4.08Å; F528-W535 HydrophobicContact CB-CH2 4.04Å; F528-W535 HydrophobicContact CB-CZ2 3.52Å; F528-W535 HydrophobicContact CB-CZ3 4.31Å; F528-W535 AromaticContact CD1-CD1 3.67Å; F528-W535 AromaticContact CD1-CE2 3.95Å; F528-W535 HydrophobicContact CD1-CG 4.47Å; F528-W535 AromaticContact CD1-NE1 3.27Å; F528-W535 VanDerWaalsContact CD1-NE1 3.27Å; F528-W535 HydrophobicContact CD2-CZ2 4.37Å; F528-W535 HydrophobicContact CG-CD2 4.43Å; F528-W535 AromaticContact CG-CE2 3.7Å; F528-W535 AromaticContact CG-CZ2 3.92Å; F528-W535 HydrophobicContact CG-CZ2 3.92Å; F528-W535 AromaticContact CG-NE1 3.52Å; F528-W535 PolarHBondContact N-O 2.94Å; F528-W535 PolarHBondContact O-N 3.17Å
529	R	93.8	Very high	94.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	141.6	165.6	-162.3	-171.9	61.7	101.4	0.6	110	S456 Y457 Q458 T459 F460 F502 G531 S533 T553	S456-R529 PolarHBondContact O-NH2 2.9Å; Y457-R529 PolarHBondContact O-NH2 3.23Å; Q458-R529 VanDerWaalsContact C-NH2 3.31Å; Q458-R529 PolarHBondContact O-NH2 3.34Å; Q458-R529 VanDerWaalsContact O-NH2 3.09Å; T459-R529 WeakPolarHBondContact CA-O 3.44Å; T459-R529 WeakPolarHBondContact CB-O 3.46Å; T459-R529 PolarHBondContact OG1-O 3.17Å; F460-R529 HydrophobicContact CD1-CB 4.32Å; F460-R529 HydrophobicContact CD2-CB 4.38Å; F460-R529 HydrophobicContact CE1-CB 3.97Å; F460-R529 HydrophobicContact CE2-CB 4Å; F460-R529 HydrophobicContact CZ-CB 3.77Å; F460-R529 PolarHBondContact N-O 2.79Å; F460-R529 PolarHBondContact O-N 2.82Å; F502-R529 HydrophobicContact CD2-CG 4.33Å; F502-R529 HydrophobicContact CE2-CG 4.11Å; F502-R529 HydrophobicContact CZ-CG 4.23Å; R529-G531 PolarHBondContact NH1-O 3.28Å; R529-S533 CarbonylContact C-O 3.45Å; R529-S533 WeakPolarHBondContact CA-O 3.18Å; R529-S533 WeakPolarHBondContact CG-O 3.24Å; R529-T553 PolarHBondContact NH1-O 2.74Å
530	D	92.3	Very high	94.7	Very high	90 Å²	90	43.5 Å²	43.5	48%	0.481	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	118.3	157.8	-178.1	29.7	0	0	0	109.6	F528 M532 S533	F528-D530 HydrophobicContact CE1-CB 3.66Å; F528-D530 HydrophobicContact CZ-CB 3.87Å; D530-M532 PolarHBondContact O-N 2.74Å; D530-S533 CarbonylContact C-O 3.53Å; D530-S533 PolarHBondContact N-O 3.15Å; D530-S533 PolarHBondContact O-N 3.16Å; D530-S533 VanDerWaalsContact O-O 3.07Å
531	G	89.1	Confident	94.7	Very high	9 Å²	9	42.8 Å²	42.8	9%	0.093	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	-126.1	-174.8	0	0	0	0	0	112.7	Q458 R529 S533 T553	Q458-G531 PolarHBondContact O-N 3.09Å; R529-G531 PolarHBondContact NH1-O 3.28Å; G531-S533 VanDerWaalsContact C-N 3.29Å; G531-T553 CarbonylContact C-O 3.09Å; G531-T553 WeakPolarHBondContact CA-O 3.31Å
532	M	88.3	Confident	94.5	Very high	18 Å²	18	43.3 Å²	43.3	9%	0.089	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-12.8	176.2	-66.8	169.1	71.5	0	0	113.4	F502 D530 R547 S548 G550 Y552 T553	F502-M532 WeakPolarHBondContact CE2-O 3.4Å; F502-M532 WeakPolarHBondContact CZ-O 3.41Å; D530-M532 PolarHBondContact O-N 2.74Å; M532-R547 HydrophobicContact CB-CG 3.86Å; M532-R547 CarbonylContact O-C 3.58Å; M532-R547 VanDerWaalsContact O-CA 3.26Å; M532-R547 WeakPolarHBondContact O-CA 3.33Å; M532-R547 WeakPolarHBondContact O-CG 3.41Å; M532-R547 PolarHBondContact SD-NH2 3.4Å; M532-S548 WeakPolarHBondContact CA-OG 3.43Å; M532-S548 WeakPolarHBondContact CB-OG 3.27Å; M532-S548 WeakPolarHBondContact CE-O 3.4Å; M532-S548 PolarHBondContact O-N 2.03Å; M532-S548 PolarHBondContact O-OG 3.14Å; M532-G550 WeakPolarHBondContact CE-O 3.38Å; M532-Y552 WeakPolarHBondContact CG-O 3.35Å; M532-T553 HydrophobicContact CG-CG2 4.02Å; M532-T553 HydrophobicContact SD-CG2 4.43Å
533	S	90.8	Very high	94.3	Very high	62 Å²	62	43 Å²	43	43%	0.434	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	149.3	-172.6	-62.7	0	0	0	0	110.7	R529 D530 G531	R529-S533 CarbonylContact C-O 3.45Å; R529-S533 WeakPolarHBondContact CA-O 3.18Å; R529-S533 WeakPolarHBondContact CG-O 3.24Å; D530-S533 CarbonylContact C-O 3.53Å; D530-S533 PolarHBondContact N-O 3.15Å; D530-S533 PolarHBondContact O-N 3.16Å; D530-S533 VanDerWaalsContact O-O 3.07Å; G531-S533 VanDerWaalsContact C-N 3.29Å
534	G	93.9	Very high	94.2	Very high	3 Å²	3	44.6 Å²	44.6	3%	0.031	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	167.7	171.9	0	0	0	0	0	111.5	I511 F528 S545 G546	I511-G534 WeakPolarHBondContact CD1-O 3.44Å; F528-G534 CarbonylContact O-C 3.57Å; F528-G534 WeakPolarHBondContact O-CA 3.39Å; G534-S545 CarbonylContact O-C 3.53Å; G534-S545 WeakPolarHBondContact O-CA 3.35Å; G534-G546 PolarHBondContact N-O 2.59Å; G534-G546 PolarHBondContact O-N 2.03Å; G534-G546 VanDerWaalsContact O-O 3.11Å
535	W	96.3	Very high	94	Very high	66 Å²	66	45.9 Å²	45.9	25%	0.25	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	156.2	172.5	54.7	-103.5	0	0	0	111.6	T526 I527 F528 R537 P543 I544	T526-W535 HydrophobicContact CG2-CH2 3.63Å; T526-W535 HydrophobicContact CG2-CZ3 3.65Å; I527-W535 WeakPolarHBondContact CA-O 3.35Å; F528-W535 HydrophobicContact CB-CD2 3.62Å; F528-W535 HydrophobicContact CB-CE3 4.11Å; F528-W535 HydrophobicContact CB-CG 4.08Å; F528-W535 HydrophobicContact CB-CH2 4.04Å; F528-W535 HydrophobicContact CB-CZ2 3.52Å; F528-W535 HydrophobicContact CB-CZ3 4.31Å; F528-W535 AromaticContact CD1-CD1 3.67Å; F528-W535 AromaticContact CD1-CE2 3.95Å; F528-W535 HydrophobicContact CD1-CG 4.47Å; F528-W535 AromaticContact CD1-NE1 3.27Å; F528-W535 VanDerWaalsContact CD1-NE1 3.27Å; F528-W535 HydrophobicContact CD2-CZ2 4.37Å; F528-W535 HydrophobicContact CG-CD2 4.43Å; F528-W535 AromaticContact CG-CE2 3.7Å; F528-W535 AromaticContact CG-CZ2 3.92Å; F528-W535 HydrophobicContact CG-CZ2 3.92Å; F528-W535 AromaticContact CG-NE1 3.52Å; F528-W535 PolarHBondContact N-O 2.94Å; F528-W535 PolarHBondContact O-N 3.17Å; W535-R537 HydrophobicContact CE3-CB 4.24Å; W535-R537 HydrophobicContact CZ3-CB 4.02Å; W535-P543 HydrophobicContact CB-CB 4.34Å; W535-P543 HydrophobicContact CD2-CB 4.09Å; W535-P543 HydrophobicContact CE3-CB 4.03Å; W535-P543 HydrophobicContact CG-CB 4.26Å; W535-I544 CarbonylContact C-O 3.52Å; W535-I544 WeakPolarHBondContact CA-O 3.2Å; W535-I544 WeakPolarHBondContact CB-O 3.44Å
536	L	97	Very high	93.5	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	135.9	167.9	172.1	144.8	0	0	0	108.4	L491 L498 Y500 I511 V525 T526 I527 I544	L491-L536 HydrophobicContact CD1-CD1 3.71Å; L498-L536 HydrophobicContact CB-CD1 3.91Å; Y500-L536 HydrophobicContact CD1-CB 4.22Å; I511-L536 HydrophobicContact CG2-CB 3.75Å; V525-L536 HydrophobicContact CG2-CD1 3.88Å; V525-L536 HydrophobicContact CG2-CG 4.05Å; T526-L536 WeakPolarHBondContact O-CA 3.42Å; I527-L536 HydrophobicContact CG2-CB 4.18Å; I527-L536 HydrophobicContact CG2-CD1 3.95Å; I527-L536 HydrophobicContact CG2-CG 4.24Å; L536-I544 PolarHBondContact N-O 2.95Å; L536-I544 PolarHBondContact O-N 3.1Å
537	R	96.6	Very high	92.9	Very high	90 Å²	90	53.5 Å²	53.5	34%	0.34	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	137.1	165.6	169.2	170.7	165.4	167.1	-0.5	108.5	V525 T526 W535 D539 N540 D541 P543	V525-R537 CarbonylContact C-O 3.56Å; V525-R537 WeakPolarHBondContact CA-O 2.97Å; T526-R537 PolarHBondContact N-O 3.45Å; T526-R537 PolarHBondContact O-N 3.15Å; W535-R537 HydrophobicContact CE3-CB 4.24Å; W535-R537 HydrophobicContact CZ3-CB 4.02Å; R537-D539 VanDerWaalsContact CZ-O 3.32Å; R537-D539 PolarHBondContact NE-O 2.95Å; R537-D539 PolarHBondContact NH2-O 3.1Å; R537-N540 PolarHBondContact NH2-OD1 3.1Å; R537-N540 VanDerWaalsContact NH2-OD1 3.12Å; R537-D541 WeakPolarHBondContact CD-O 3.48Å; R537-D541 WeakPolarHBondContact CG-O 3.36Å; R537-D541 PolarHBondContact NE-O 3.41Å; R537-P543 HydrophobicContact CB-CB 4.43Å; R537-P543 HydrophobicContact CB-CG 4.34Å
538	M	96.8	Very high	92.3	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	132.4	168.5	-169.8	168.6	69.8	0	0	108.2	L498 S515 V517 H523 I524 N540 D541	L498-M538 HydrophobicContact CD1-CB 4.44Å; L498-M538 HydrophobicContact CD1-CG 4.13Å; L498-M538 HydrophobicContact CD1-SD 3.48Å; L498-M538 WeakPolarHBondContact CD1-SD 3.26Å; L498-M538 HydrophobicContact CG-SD 4.15Å; S515-M538 WeakPolarHBondContact O-CE 3.24Å; V517-M538 HydrophobicContact CG2-CE 4.41Å; V517-M538 HydrophobicContact CG2-SD 3.61Å; H523-M538 HydrophobicContact CB-CG 4.46Å; I524-M538 CarbonylContact O-C 3.5Å; I524-M538 WeakPolarHBondContact O-CA 3.01Å; M538-N540 PolarHBondContact O-N 2.95Å; M538-N540 VanDerWaalsContact O-N 3.09Å; M538-D541 WeakPolarHBondContact O-CB 3.34Å; M538-D541 PolarHBondContact O-N 3.34Å
539	D	95.3	Very high	91.1	Very high	46 Å²	46	57.1 Å²	57.1	25%	0.246	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.5	-111.6	178.7	-49	-44.7	0	0	0	113.6	H523 I524 R537	H523-D539 VanDerWaalsContact CA-OD1 3.29Å; H523-D539 WeakPolarHBondContact CA-OD1 3.43Å; H523-D539 IonicContact CE1-OD2 3.18Å; H523-D539 IonicContact CG-OD2 2.76Å; H523-D539 IonicContact ND1-OD1 3.69Å; H523-D539 IonicContact ND1-OD2 3.69Å; H523-D539 PolarHBondContact ND1-OD2 3.24Å; I524-D539 PolarHBondContact N-OD1 3.1Å; I524-D539 PolarHBondContact O-N 3.04Å; R537-D539 VanDerWaalsContact CZ-O 3.32Å; R537-D539 PolarHBondContact NE-O 2.95Å; R537-D539 PolarHBondContact NH2-O 3.1Å
540	N	91.3	Very high	89.9	Confident	143 Å²	143	59 Å²	59	77%	0.765	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	12.6	178	-67.4	-49.3	0	0	0	113.4	R537 M538	R537-N540 PolarHBondContact NH2-OD1 3.1Å; R537-N540 VanDerWaalsContact NH2-OD1 3.12Å; M538-N540 PolarHBondContact O-N 2.95Å; M538-N540 VanDerWaalsContact O-N 3.09Å
541	D	92.3	Very high	88.9	Confident	29 Å²	29	63.1 Å²	63.1	16%	0.155	34%	0.34	C	S	.	.	S	Bend	trans	-59.7	157.5	168.2	-71.1	-2.3	0	0	0	110.6	S515 R537 M538	S515-D541 VanDerWaalsContact CB-OD2 3.28Å; S515-D541 WeakPolarHBondContact CB-OD2 3.1Å; S515-D541 PolarHBondContact N-OD2 3.02Å; S515-D541 PolarHBondContact OG-OD1 2.88Å; S515-D541 PolarHBondContact OG-OD2 3.15Å; R537-D541 WeakPolarHBondContact CD-O 3.48Å; R537-D541 WeakPolarHBondContact CG-O 3.36Å; R537-D541 PolarHBondContact NE-O 3.41Å; M538-D541 WeakPolarHBondContact O-CB 3.34Å; M538-D541 PolarHBondContact O-N 3.34Å
542	N	91.2	Very high	88.4	Confident	124 Å²	124	69.8 Å²	69.8	66%	0.663	36%	0.363	S	S	*	.			trans	-70.6	143	169.9	-67.3	-68.3	0	0	0	110.6	I544	N542-I544 PolarHBondContact O-N 2.04Å; N542-I544 VanDerWaalsContact O-N 3.16Å
543	P	92.9	Very high	88.1	Confident	64 Å²	64	72 Å²	72	42%	0.416	38%	0.377	S	S	.	.			trans	-62.3	115.8	177	-23.2	33.7	0	0	0	113	W535 R537	W535-P543 HydrophobicContact CB-CB 4.34Å; W535-P543 HydrophobicContact CD2-CB 4.09Å; W535-P543 HydrophobicContact CE3-CB 4.03Å; W535-P543 HydrophobicContact CG-CB 4.26Å; R537-P543 HydrophobicContact CB-CB 4.43Å; R537-P543 HydrophobicContact CB-CG 4.34Å
544	I	95	Very high	87.8	Confident	46 Å²	46	74.8 Å²	74.8	24%	0.236	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	118	-179.8	-53.8	173.5	0	0	0	108.3	I511 I512 E514 W535 L536 N542	I511-I544 HydrophobicContact CG2-CB 4.17Å; I511-I544 HydrophobicContact CG2-CG2 4.02Å; I511-I544 WeakPolarHBondContact CG2-O 3.36Å; I512-I544 VanDerWaalsContact O-CD1 3.25Å; I512-I544 WeakPolarHBondContact O-CD1 3.38Å; E514-I544 HydrophobicContact CB-CD1 3.65Å; W535-I544 CarbonylContact C-O 3.52Å; W535-I544 WeakPolarHBondContact CA-O 3.2Å; W535-I544 WeakPolarHBondContact CB-O 3.44Å; L536-I544 PolarHBondContact N-O 2.95Å; L536-I544 PolarHBondContact O-N 3.1Å; N542-I544 PolarHBondContact O-N 2.04Å; N542-I544 VanDerWaalsContact O-N 3.16Å
545	S	93.1	Very high	87.5	Confident	93 Å²	93	74.7 Å²	74.7	65%	0.65	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.9	149.3	-175	-62.4	0	0	0	0	112.9	G534	G534-S545 CarbonylContact O-C 3.53Å; G534-S545 WeakPolarHBondContact O-CA 3.35Å
546	G	87.6	Confident	86.9	Confident	22 Å²	22	74.6 Å²	74.6	23%	0.227	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	169.6	173.1	0	0	0	0	0	112	G534	G534-G546 PolarHBondContact N-O 2.59Å; G534-G546 PolarHBondContact O-N 2.03Å; G534-G546 VanDerWaalsContact O-O 3.11Å
547	R	85.6	Confident	86.5	Confident	162 Å²	162	75.9 Å²	75.9	61%	0.611	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.3	139.6	-174.4	-168.1	-177.3	173.5	-175.3	-1.9	111.3	M532	M532-R547 HydrophobicContact CB-CG 3.86Å; M532-R547 CarbonylContact O-C 3.58Å; M532-R547 VanDerWaalsContact O-CA 3.26Å; M532-R547 WeakPolarHBondContact O-CA 3.33Å; M532-R547 WeakPolarHBondContact O-CG 3.41Å; M532-R547 PolarHBondContact SD-NH2 3.4Å
548	S	82.7	Confident	86	Confident	3 Å²	3	79.7 Å²	79.7	2%	0.021	41%	0.407	C	S	.	.			trans	-71.2	146.2	173.4	59.7	0	0	0	0	111.2	G507 M532	G507-S548 WeakPolarHBondContact O-CB 3.43Å; M532-S548 WeakPolarHBondContact CA-OG 3.43Å; M532-S548 WeakPolarHBondContact CB-OG 3.27Å; M532-S548 WeakPolarHBondContact CE-O 3.4Å; M532-S548 PolarHBondContact O-N 2.03Å; M532-S548 PolarHBondContact O-OG 3.14Å
549	L	71	Confident	85.7	Confident	128 Å²	128	79.9 Å²	79.9	67%	0.67	41%	0.409	S	S	*	.	S	Bend	trans	-83.2	128.1	175.2	-60.3	175.8	0	0	0	109	T506 G507	T506-L549 CarbonylContact C-O 3.49Å; G507-L549 WeakPolarHBondContact CA-O 3.46Å; G507-L549 PolarHBondContact N-O 2.8Å; G507-L549 PolarHBondContact O-N 2.89Å
550	G	68.4	Low	85.5	Confident	39 Å²	39	79.3 Å²	79.3	40%	0.402	41%	0.408	S	S	.	.	S	Bend	trans	147.4	-157.3	179.3	0	0	0	0	0	115.8	T506 M532	T506-G550 WeakPolarHBondContact OG1-CA 3.46Å; M532-G550 WeakPolarHBondContact CE-O 3.38Å
551	Q	71.1	Confident	85.7	Confident	176 Å²	176	72.6 Å²	72.6	82%	0.822	37%	0.372	S	S	*	.	S	Bend	trans	-125.2	-16.9	175.1	-69.2	-175	-13.3	0	0	113.5
552	Y	79.7	Confident	85.8	Confident	150 Å²	150	71.9 Å²	71.9	59%	0.588	37%	0.367	S	S	*	.			trans	-83.4	129.9	-178.2	-57.3	-70	0	0	0	111.5	C504 T506 M532	C504-Y552 VanDerWaalsContact CB-O 3.29Å; C504-Y552 WeakPolarHBondContact CB-O 3.26Å; T506-Y552 HydrophobicContact CG2-CD2 3.74Å; T506-Y552 HydrophobicContact CG2-CE2 3.71Å; M532-Y552 WeakPolarHBondContact CG-O 3.35Å
553	T	81.8	Confident	86.1	Confident	63 Å²	63	66.2 Å²	66.2	39%	0.387	34%	0.337	S	S	.	.			trans	-99	-19.7	176.1	52	0	0	0	0	113	R529 G531 M532	R529-T553 PolarHBondContact NH1-O 2.74Å; G531-T553 CarbonylContact C-O 3.09Å; G531-T553 WeakPolarHBondContact CA-O 3.31Å; M532-T553 HydrophobicContact CG-CG2 4.02Å; M532-T553 HydrophobicContact SD-CG2 4.43Å
554	K	84.6	Confident	86.2	Confident	121 Å²	121	63.1 Å²	63.1	53%	0.526	32%	0.317	S	S	.	.			trans	-87.2	147.6	178.2	-64.5	-170.8	179.1	-173.6	0	110.7	Y457 Q458	Y457-K554 HydrophobicContact CD2-CD 4.36Å; Y457-K554 VanDerWaalsContact O-CA 3.28Å; Y457-K554 WeakPolarHBondContact O-CA 3.14Å; Q458-K554 HydrophobicContact CG-CG 4.39Å
555	I	87.2	Confident	86.1	Confident	2 Å²	2	61 Å²	61	1%	0.01	31%	0.306	C	S	.	.			trans	-126.6	143.8	173.4	-158.7	168.2	0	0	0	110	Y457 F460 D487 F488 N503 F557	Y457-I555 WeakPolarHBondContact CA-O 3.29Å; Y457-I555 WeakPolarHBondContact CB-O 3.24Å; Y457-I555 PolarHBondContact O-N 3.22Å; F460-I555 HydrophobicContact CE1-CG2 4.48Å; D487-I555 HydrophobicContact CB-CG1 3.76Å; D487-I555 WeakPolarHBondContact OD2-CA 3.4Å; F488-I555 WeakPolarHBondContact O-CD1 3.35Å; N503-I555 WeakPolarHBondContact O-CD1 3.46Å; N503-I555 WeakPolarHBondContact O-CG1 3.49Å; I555-F557 HydrophobicContact CB-CZ 4.46Å; I555-F557 HydrophobicContact CD1-CE1 3.83Å; I555-F557 HydrophobicContact CD1-CZ 3.77Å; I555-F557 HydrophobicContact CG1-CE1 4.05Å; I555-F557 HydrophobicContact CG1-CZ 4.07Å; I555-F557 HydrophobicContact CG2-CD2 4.29Å; I555-F557 HydrophobicContact CG2-CE1 4.31Å; I555-F557 HydrophobicContact CG2-CE2 3.54Å; I555-F557 HydrophobicContact CG2-CZ 3.55Å
556	T	84.5	Confident	85.9	Confident	64 Å²	64	57.1 Å²	57.1	39%	0.393	28%	0.279	S	S	.	.			trans	-117.4	119.5	-175.3	-45.5	0	0	0	0	110.4	E480 D487 R558	E480-T556 PolarHBondContact N-O 2.79Å; D487-T556 WeakPolarHBondContact CB-O 3.26Å; D487-T556 WeakPolarHBondContact OD2-CB 3.03Å; D487-T556 PolarHBondContact OD2-N 3.33Å; D487-T556 PolarHBondContact OD2-OG1 3.35Å; T556-R558 HydrophobicContact CG2-CG 4.43Å
557	F	88.6	Confident	85.6	Confident	28 Å²	28	60.5 Å²	60.5	12%	0.123	30%	0.297	C	S	.	.			trans	-108	131.4	175.7	-57.8	-58	0	0	0	110.1	L453 F460 C478 T489 I555	L453-F557 HydrophobicContact CB-CD2 3.53Å; L453-F557 HydrophobicContact CB-CE2 3.86Å; L453-F557 HydrophobicContact CB-CG 4.23Å; L453-F557 HydrophobicContact CD1-CD2 4.38Å; L453-F557 HydrophobicContact CD1-CE2 4.03Å; L453-F557 HydrophobicContact CD1-CZ 4.31Å; F460-F557 HydrophobicContact CD1-CE2 4.37Å; F460-F557 HydrophobicContact CE1-CE2 4.07Å; F460-F557 AromaticContact CE1-CZ 3.91Å; F460-F557 HydrophobicContact CE1-CZ 3.91Å; C478-F557 HydrophobicContact CB-CD1 4.16Å; C478-F557 HydrophobicContact CB-CE1 4.42Å; C478-F557 WeakPolarHBondContact O-CE1 3.06Å; T489-F557 HydrophobicContact CG2-CE1 3.57Å; T489-F557 HydrophobicContact CG2-CZ 3.53Å; I555-F557 HydrophobicContact CB-CZ 4.46Å; I555-F557 HydrophobicContact CD1-CE1 3.83Å; I555-F557 HydrophobicContact CD1-CZ 3.77Å; I555-F557 HydrophobicContact CG1-CE1 4.05Å; I555-F557 HydrophobicContact CG1-CZ 4.07Å; I555-F557 HydrophobicContact CG2-CD2 4.29Å; I555-F557 HydrophobicContact CG2-CE1 4.31Å; I555-F557 HydrophobicContact CG2-CE2 3.54Å; I555-F557 HydrophobicContact CG2-CZ 3.55Å
558	R	86.4	Confident	85.2	Confident	169 Å²	169	53.5 Å²	53.5	64%	0.638	28%	0.275	S	S	*	.			trans	-131.7	-30.4	175.4	-48	-174.7	-164.5	-150.4	10.2	112.7	G479 E480 T556	G479-R558 PolarHBondContact O-N 3.11Å; E480-R558 HydrophobicContact CG-CG 4.31Å; E480-R558 WeakPolarHBondContact O-CB 3.01Å; E480-R558 IonicContact OE1-CZ 3.79Å; E480-R558 IonicContact OE1-NE 2.77Å; E480-R558 PolarHBondContact OE1-NE 3.19Å; E480-R558 IonicContact OE1-NH2 2.76Å; E480-R558 PolarHBondContact OE1-NH2 2.9Å; T556-R558 HydrophobicContact CG2-CG 4.43Å
559	S	89.2	Confident	85	Confident	5 Å²	5	53.9 Å²	53.9	4%	0.035	28%	0.279	C	S	.	.	S	Bend	trans	-64.4	158.5	169	78.8	0	0	0	0	110.3	P452 G479	P452-S559 VanDerWaalsContact CB-O 3.32Å; P452-S559 WeakPolarHBondContact CB-O 3.01Å; P452-S559 WeakPolarHBondContact CG-O 3.17Å; G479-S559 PolarHBondContact N-OG 3.33Å; G479-S559 PolarHBondContact O-N 3.06Å; G479-S559 PolarHBondContact O-OG 3Å
560	P	91.3	Very high	85.4	Confident	34 Å²	34	55.3 Å²	55.3	22%	0.221	28%	0.276	C	S	.	.			trans	-51.2	160.4	160.9	-23.6	33.7	0	0	0	112.1	T449 C478 Y562	T449-P560 HydrophobicContact CG2-CB 4.11Å; C478-P560 PolarHBondContact SG-O 2.96Å; P560-Y562 HydrophobicContact CB-CD2 4.44Å; P560-Y562 HydrophobicContact CB-CE2 4.16Å; P560-Y562 HydrophobicContact CG-CE2 4.27Å; P560-Y562 PolarHBondContact O-N 3.41Å
561	L	94.8	Very high	85.9	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.01	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	106.6	161.5	170.6	62.9	0	0	0	107.9	T449 F450 L453 C478 V563 I591	T449-L561 CarbonylContact C-O 3.57Å; T449-L561 WeakPolarHBondContact CA-O 3.39Å; F450-L561 HydrophobicContact CB-CB 4.17Å; F450-L561 HydrophobicContact CB-CD2 4.39Å; F450-L561 HydrophobicContact CB-CG 4.48Å; F450-L561 PolarHBondContact N-O 2.89Å; F450-L561 PolarHBondContact O-N 2.85Å; L453-L561 HydrophobicContact CD1-CD1 4.43Å; L453-L561 HydrophobicContact CD2-CD2 4.1Å; L453-L561 HydrophobicContact CG-CD2 4.43Å; C478-L561 HydrophobicContact CB-CB 4.47Å; C478-L561 HydrophobicContact CB-CD1 3.93Å; L561-V563 HydrophobicContact CG-CG2 4.38Å; L561-I591 HydrophobicContact CD2-CD1 3.66Å
562	Y	95.6	Very high	86.6	Confident	15 Å²	15	53.1 Å²	53.1	6%	0.059	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	137.4	174.1	-74.7	-87.9	0	0	0	110.9	M448 T449 L476 Y477 E482 P560 G565 P567	M448-Y562 CarbonylContact O-C 3.5Å; M448-Y562 WeakPolarHBondContact O-CA 3.29Å; T449-Y562 HydrophobicContact CG2-CD1 3.71Å; T449-Y562 HydrophobicContact CG2-CE1 3.49Å; T449-Y562 VanDerWaalsContact CG2-CE1 3.49Å; T449-Y562 HydrophobicContact CG2-CG 4.43Å; L476-Y562 CarbonylContact C-O 3.55Å; L476-Y562 WeakPolarHBondContact CA-O 2.98Å; Y477-Y562 HydrophobicContact CD1-CD2 4.04Å; Y477-Y562 PolarHBondContact N-O 3.5Å; Y477-Y562 WeakPolarHBondContact O-CB 3.44Å; Y477-Y562 PolarHBondContact O-N 3.24Å; E482-Y562 HydrophobicContact CG-CE2 4.16Å; E482-Y562 PolarHBondContact OE1-OH 3.04Å; P560-Y562 HydrophobicContact CB-CD2 4.44Å; P560-Y562 HydrophobicContact CB-CE2 4.16Å; P560-Y562 HydrophobicContact CG-CE2 4.27Å; P560-Y562 PolarHBondContact O-N 3.41Å; Y562-G565 WeakPolarHBondContact CB-O 3.5Å; Y562-P567 VanDerWaalsContact CE1-CD 3.49Å; Y562-P567 HydrophobicContact CE1-CG 4.46Å
563	V	97.4	Very high	87	Confident	4 Å²	4	48.8 Å²	48.8	2%	0.024	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	134.9	178.5	-176	0	0	0	0	109.2	F442 M448 F450 L475 L476 L561 G565 I586 L589	F442-V563 WeakPolarHBondContact CE1-O 3.21Å; F442-V563 HydrophobicContact CZ-CG1 4.25Å; M448-V563 HydrophobicContact CB-CB 4.42Å; M448-V563 PolarHBondContact N-O 3.34Å; M448-V563 PolarHBondContact O-N 2.82Å; F450-V563 HydrophobicContact CD2-CB 4.42Å; F450-V563 HydrophobicContact CD2-CG2 3.55Å; F450-V563 HydrophobicContact CE2-CB 4.09Å; F450-V563 HydrophobicContact CE2-CG2 3.57Å; L475-V563 WeakPolarHBondContact O-CA 3.49Å; L476-V563 HydrophobicContact CD2-CB 4.32Å; L476-V563 HydrophobicContact CD2-CG1 4.11Å; L476-V563 HydrophobicContact CD2-CG2 3.82Å; L561-V563 HydrophobicContact CG-CG2 4.38Å; V563-G565 PolarHBondContact O-N 2.86Å; V563-I586 HydrophobicContact CG1-CD1 3.63Å; V563-L589 HydrophobicContact CG2-CD2 4.38Å
564	G	94.9	Very high	87.3	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.26	C	S	.	.	S	Bend	trans	66.6	-4.6	177.5	0	0	0	0	0	116.9	L474 L475 F582	L474-G564 CarbonylContact O-C 3.43Å; L474-G564 WeakPolarHBondContact O-CA 3.31Å; L475-G564 PolarHBondContact O-N 2.99Å; G564-F582 WeakPolarHBondContact O-CB 3.38Å; G564-F582 PolarHBondContact O-N 2.78Å
565	G	92.8	Very high	87.5	Confident	1 Å²	1	51 Å²	51	1%	0.01	24%	0.236	C	C	.	.			trans	170.7	-172.5	176.6	0	0	0	0	0	111.9	S446 H447 L474 Y562 V563	S446-G565 WeakPolarHBondContact O-CA 3.44Å; H447-G565 WeakPolarHBondContact CB-O 3.44Å; L474-G565 PolarHBondContact O-N 3.09Å; Y562-G565 WeakPolarHBondContact CB-O 3.5Å; V563-G565 PolarHBondContact O-N 2.86Å
566	S	89.6	Confident	87.7	Confident	11 Å²	11	51 Å²	51	8%	0.077	24%	0.235	C	C	.	.			trans	-161.8	145.4	172.3	177.9	0	0	0	0	109.6	G568 A569	S566-G568 PolarHBondContact O-N 2.98Å; S566-G568 VanDerWaalsContact O-N 3.12Å; S566-G568 PolarHBondContact OG-N 3.07Å; S566-A569 WeakPolarHBondContact O-CB 3.27Å; S566-A569 PolarHBondContact O-N 2.87Å
567	P	80.8	Confident	87.9	Confident	94 Å²	94	49 Å²	49	61%	0.61	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-30.3	171.5	-24.9	34.5	0	0	0	112.8	Y562	Y562-P567 VanDerWaalsContact CE1-CD 3.49Å; Y562-P567 HydrophobicContact CE1-CG 4.46Å
568	G	77.9	Confident	88	Confident	14 Å²	14	48 Å²	48	14%	0.144	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	12	179.1	0	0	0	0	0	115.6	S566 Y570 W571 L572	S566-G568 PolarHBondContact O-N 2.98Å; S566-G568 VanDerWaalsContact O-N 3.12Å; S566-G568 PolarHBondContact OG-N 3.07Å; G568-Y570 PolarHBondContact O-N 2.99Å; G568-W571 WeakPolarHBondContact O-CA 3.3Å; G568-W571 WeakPolarHBondContact O-CB 3.25Å; G568-W571 PolarHBondContact O-N 2.77Å; G568-L572 PolarHBondContact O-N 2.58Å; G568-L572 VanDerWaalsContact O-N 3.17Å
569	A	78.4	Confident	88.1	Confident	12 Å²	12	44 Å²	44	10%	0.099	22%	0.215	C	C	.	.	H	α-helix	trans	-50.3	-37.1	-168.4	0	0	0	0	0	114.9	S566 W571 L572 N579	S566-A569 WeakPolarHBondContact O-CB 3.27Å; S566-A569 PolarHBondContact O-N 2.87Å; A569-W571 PolarHBondContact O-N 2.58Å; A569-L572 PolarHBondContact O-N 2.88Å; A569-N579 WeakPolarHBondContact CB-O 3.46Å
570	Y	78	Confident	88.2	Confident	158 Å²	158	50.9 Å²	50.9	62%	0.62	24%	0.24	S	C	*	.	H	α-helix	trans	-61.1	-38.1	174.1	179.2	-98.4	0	0	0	113.8	G568 V573 N579	G568-Y570 PolarHBondContact O-N 2.99Å; Y570-V573 VanDerWaalsContact O-CG2 3.23Å; Y570-V573 WeakPolarHBondContact O-CG2 3.39Å; Y570-N579 HydrophobicContact CD2-CB 4.46Å
571	W	78.6	Confident	88.2	Confident	169 Å²	169	49.5 Å²	49.5	64%	0.64	23%	0.232	S	C	*	.	H	α-helix	trans	-75.8	-27.3	176.5	-57.7	113.8	0	0	0	112.3	G568 A569 V573	G568-W571 WeakPolarHBondContact O-CA 3.3Å; G568-W571 WeakPolarHBondContact O-CB 3.25Å; G568-W571 PolarHBondContact O-N 2.77Å; A569-W571 PolarHBondContact O-N 2.58Å; W571-V573 VanDerWaalsContact C-N 3.31Å; W571-V573 PolarHBondContact O-N 2.86Å
572	L	87.1	Confident	88.3	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-74.9	-11.2	-178.1	-66	-177.4	0	0	0	114.9	L474 Y477 E482 G568 A569 R574 A575 T576	L474-L572 HydrophobicContact CD2-CD1 4.11Å; Y477-L572 HydrophobicContact CD1-CD1 3.84Å; Y477-L572 HydrophobicContact CD1-CD2 4.29Å; Y477-L572 HydrophobicContact CD2-CD1 4.12Å; Y477-L572 HydrophobicContact CD2-CD2 4.18Å; Y477-L572 HydrophobicContact CE1-CD1 4.19Å; Y477-L572 HydrophobicContact CE1-CD2 3.82Å; Y477-L572 HydrophobicContact CE2-CD1 4.46Å; Y477-L572 HydrophobicContact CE2-CD2 3.7Å; Y477-L572 HydrophobicContact CG-CD1 3.82Å; Y477-L572 HydrophobicContact CG-CD2 4.48Å; E482-L572 VanDerWaalsContact O-CD2 3.3Å; E482-L572 WeakPolarHBondContact O-CD2 3.47Å; G568-L572 PolarHBondContact O-N 2.58Å; G568-L572 VanDerWaalsContact O-N 3.17Å; A569-L572 PolarHBondContact O-N 2.88Å; L572-R574 PolarHBondContact O-N 2.94Å; L572-A575 WeakPolarHBondContact O-CA 3.44Å; L572-A575 WeakPolarHBondContact O-CB 3.45Å; L572-A575 PolarHBondContact O-N 3.01Å; L572-T576 HydrophobicContact CB-CG2 3.84Å; L572-T576 PolarHBondContact O-N 2.75Å; L572-T576 PolarHBondContact O-OG1 2.74Å; L572-T576 VanDerWaalsContact O-OG1 3.08Å
573	V	87.9	Confident	88.4	Confident	59 Å²	59	50.7 Å²	50.7	36%	0.358	24%	0.241	S	C	.	.	H	α-helix	trans	-44.5	-38.1	-175.9	173.2	0	0	0	0	114.5	Y570 W571 G577 N579	Y570-V573 VanDerWaalsContact O-CG2 3.23Å; Y570-V573 WeakPolarHBondContact O-CG2 3.39Å; W571-V573 VanDerWaalsContact C-N 3.31Å; W571-V573 PolarHBondContact O-N 2.86Å; V573-G577 VanDerWaalsContact O-CA 3.29Å; V573-G577 WeakPolarHBondContact O-CA 3.44Å; V573-G577 PolarHBondContact O-N 3.17Å; V573-N579 HydrophobicContact CG2-CB 3.51Å
574	R	87.3	Confident	88.3	Confident	230 Å²	230	50.5 Å²	50.5	87%	0.868	24%	0.239	S	C	*	.	H	α-helix	trans	-67.2	-38.7	178.3	-67.2	-175	178.6	-166.2	-0.8	112.5	R501 L572	R501-R574 PolarHBondContact NH1-O 2.77Å; L572-R574 PolarHBondContact O-N 2.94Å
575	A	88.4	Confident	88.4	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-77.1	-46.4	177.7	0	0	0	0	0	111.7	Y477 F488 S490 R501 L572	Y477-A575 HydrophobicContact CE2-CB 4.1Å; F488-A575 HydrophobicContact CD1-CB 3.92Å; F488-A575 HydrophobicContact CD2-CB 3.72Å; F488-A575 HydrophobicContact CE1-CB 3.83Å; F488-A575 HydrophobicContact CE2-CB 3.64Å; F488-A575 WeakPolarHBondContact CE2-O 3.23Å; F488-A575 HydrophobicContact CG-CB 3.88Å; F488-A575 HydrophobicContact CZ-CB 3.7Å; S490-A575 PolarHBondContact OG-O 2.95Å; R501-A575 WeakPolarHBondContact CD-O 3.05Å; L572-A575 WeakPolarHBondContact O-CA 3.44Å; L572-A575 WeakPolarHBondContact O-CB 3.45Å; L572-A575 PolarHBondContact O-N 3.01Å
576	T	91.4	Very high	88.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-89.3	-36.7	-169.9	57.8	0	0	0	0	114	L474 Y477 L572 T578	L474-T576 HydrophobicContact CD1-CG2 3.44Å; L474-T576 VanDerWaalsContact CD1-CG2 3.44Å; L474-T576 HydrophobicContact CD2-CG2 4.09Å; L474-T576 HydrophobicContact CG-CG2 4.37Å; Y477-T576 HydrophobicContact CD2-CG2 4.22Å; L572-T576 HydrophobicContact CB-CG2 3.84Å; L572-T576 PolarHBondContact O-N 2.75Å; L572-T576 PolarHBondContact O-OG1 2.74Å; L572-T576 VanDerWaalsContact O-OG1 3.08Å; T576-T578 PolarHBondContact OG1-N 3.2Å; T576-T578 PolarHBondContact OG1-O 3.05Å
577	G	90.1	Very high	88.8	Confident	22 Å²	22	51.2 Å²	51.2	23%	0.227	24%	0.242	C	C	.	.	S	Bend	trans	90.6	-0.7	-169.3	0	0	0	0	0	115	R501 V573	R501-G577 VanDerWaalsContact NH1-CA 3.3Å; R501-G577 VanDerWaalsContact NH1-N 3.19Å; V573-G577 VanDerWaalsContact O-CA 3.29Å; V573-G577 WeakPolarHBondContact O-CA 3.44Å; V573-G577 PolarHBondContact O-N 3.17Å
578	T	90.8	Very high	89.4	Confident	7 Å²	7	48.4 Å²	48.4	4%	0.043	22%	0.224	C	C	.	.			trans	-145.1	149.8	177.5	-175.8	0	0	0	0	111.7	L474 A492 T576 R580	L474-T578 HydrophobicContact CB-CG2 4.36Å; A492-T578 HydrophobicContact CB-CG2 3.78Å; T576-T578 PolarHBondContact OG1-N 3.2Å; T576-T578 PolarHBondContact OG1-O 3.05Å; T578-R580 PolarHBondContact OG1-N 2.66Å; T578-R580 VanDerWaalsContact OG1-N 3.15Å
579	N	88.4	Confident	90.3	Very high	86 Å²	86	47.9 Å²	47.9	46%	0.46	22%	0.218	S	C	.	.	S	Bend	trans	-94.6	-6.8	170.7	59.2	-17.8	0	0	0	113.2	A569 Y570 V573	A569-N579 WeakPolarHBondContact CB-O 3.46Å; Y570-N579 HydrophobicContact CD2-CB 4.46Å; V573-N579 HydrophobicContact CG2-CB 3.51Å
580	R	90.4	Very high	91.1	Very high	150 Å²	150	48.9 Å²	48.9	57%	0.566	22%	0.223	S	C	*	.	S	Bend	trans	-91.3	141.3	-177.6	-62.2	179.4	179.8	-105	-5.4	110.7	L474 T578	L474-R580 WeakPolarHBondContact CB-O 3.34Å; L474-R580 PolarHBondContact N-O 2.79Å; T578-R580 PolarHBondContact OG1-N 2.66Å; T578-R580 VanDerWaalsContact OG1-N 3.15Å
581	G	91.9	Very high	91.8	Very high	4 Å²	4	42.7 Å²	42.7	4%	0.041	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-69.1	170.7	160.3	0	0	0	0	0	111.1	G444 G473	G444-G581 WeakPolarHBondContact O-CA 3.44Å; G444-G581 PolarHBondContact O-N 2.93Å; G473-G581 WeakPolarHBondContact CA-O 3.34Å
582	F	97.1	Very high	92.4	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.009	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-72	140.7	175.4	179	-120.7	0	0	0	111.5	F442 G444 F466 K467 A468 L474 L475 G564 I586	F442-F582 CarbonylContact C-O 3.55Å; F442-F582 HydrophobicContact CB-CD1 4.02Å; F442-F582 WeakPolarHBondContact CB-O 3.25Å; F442-F582 AromaticContact CD2-CD1 3.95Å; F442-F582 HydrophobicContact CD2-CD1 3.95Å; F442-F582 HydrophobicContact CD2-CE1 4.41Å; F442-F582 HydrophobicContact CG-CD1 4.14Å; G444-F582 VanDerWaalsContact CA-O 3.3Å; G444-F582 WeakPolarHBondContact CA-O 3.21Å; G444-F582 PolarHBondContact N-O 2.71Å; F466-F582 HydrophobicContact CB-CZ 4.18Å; F466-F582 AromaticContact CD2-CE2 3.96Å; F466-F582 HydrophobicContact CD2-CE2 3.96Å; F466-F582 AromaticContact CD2-CZ 3.9Å; F466-F582 HydrophobicContact CD2-CZ 3.9Å; K467-F582 WeakPolarHBondContact O-CZ 3.01Å; A468-F582 HydrophobicContact CB-CE2 3.79Å; A468-F582 HydrophobicContact CB-CZ 4.36Å; L474-F582 WeakPolarHBondContact O-CB 3.46Å; L475-F582 HydrophobicContact CD2-CB 4.38Å; L475-F582 HydrophobicContact CD2-CD1 3.99Å; L475-F582 HydrophobicContact CD2-CD2 3.5Å; L475-F582 VanDerWaalsContact CD2-CD2 3.5Å; L475-F582 HydrophobicContact CD2-CE1 4.08Å; L475-F582 HydrophobicContact CD2-CE2 3.6Å; L475-F582 HydrophobicContact CD2-CG 3.7Å; L475-F582 HydrophobicContact CD2-CZ 3.89Å; L475-F582 HydrophobicContact CG-CD2 4.21Å; G564-F582 WeakPolarHBondContact O-CB 3.38Å; G564-F582 PolarHBondContact O-N 2.78Å; F582-I586 HydrophobicContact CD1-CD1 4.37Å; F582-I586 HydrophobicContact CD1-CG1 4.41Å; F582-I586 HydrophobicContact CE1-CD1 4.4Å; F582-I586 HydrophobicContact CE1-CG1 3.97Å
583	V	97.2	Very high	92.3	Very high	41 Å²	41	44.3 Å²	44.3	25%	0.248	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	120.9	167.3	-165.7	0	0	0	0	107.1	F442 D469	F442-V583 WeakPolarHBondContact O-CA 3.47Å; D469-V583 HydrophobicContact CB-CB 4.45Å; D469-V583 HydrophobicContact CB-CG1 4.05Å; D469-V583 PolarHBondContact N-O 2.78Å
584	G	95.9	Very high	92.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	145.2	-157.3	-175.9	0	0	0	0	0	114.1	R441 F442 K467	R441-G584 WeakPolarHBondContact CA-O 3.47Å; F442-G584 PolarHBondContact N-O 3.4Å; F442-G584 PolarHBondContact O-N 3.42Å; K467-G584 CarbonylContact O-C 3.52Å; K467-G584 VanDerWaalsContact O-CA 3.23Å; K467-G584 WeakPolarHBondContact O-CA 3.48Å
585	C	96.5	Very high	92.3	Very high	4 Å²	4	41.7 Å²	41.7	3%	0.027	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	146.6	-178.4	-64.9	0	0	0	0	111.8	R441 F466 K467 W522 C615	R441-C585 PolarHBondContact NH1-SG 3.27Å; F466-C585 CarbonylContact C-O 3.57Å; F466-C585 VanDerWaalsContact CA-O 3.27Å; F466-C585 WeakPolarHBondContact CA-O 3.31Å; K467-C585 HydrophobicContact CB-CB 4.47Å; K467-C585 PolarHBondContact N-O 3.45Å; K467-C585 PolarHBondContact O-N 3.19Å; W522-C585 HydrophobicContact CH2-CB 3.53Å; W522-C585 HydrophobicContact CZ2-CB 4.22Å; W522-C585 HydrophobicContact CZ3-CB 4.29Å; C585-C615 WeakPolarHBondContact CA-SG 3.25Å; C585-C615 HydrophobicContact CB-CB 3.97Å; C585-C615 WeakPolarHBondContact CB-SG 3.28Å; C585-C615 WeakPolarHBondContact SG-CB 3.29Å; C585-C615 CovalentContact SG-SG 2.02Å; C585-C615 PolarHBondContact SG-SG 3.01Å
586	I	96.4	Very high	92.4	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.4	165.7	-68.8	172.5	0	0	0	108	P440 F442 L464 E465 F466 V563 F582 I598	P440-I586 WeakPolarHBondContact CD-O 3.5Å; P440-I586 HydrophobicContact CG-CB 4.44Å; P440-I586 PolarHBondContact O-N 2.67Å; P440-I586 VanDerWaalsContact O-N 3.14Å; F442-I586 HydrophobicContact CD2-CD1 4.32Å; F442-I586 HydrophobicContact CD2-CG1 4.49Å; F442-I586 HydrophobicContact CE2-CB 4.14Å; F442-I586 HydrophobicContact CE2-CD1 3.69Å; F442-I586 HydrophobicContact CE2-CG1 4.02Å; F442-I586 HydrophobicContact CZ-CD1 4.12Å; L464-I586 HydrophobicContact CD1-CD1 4.27Å; L464-I586 HydrophobicContact CD1-CG2 3.71Å; L464-I586 HydrophobicContact CD2-CD1 4.22Å; L464-I586 HydrophobicContact CD2-CG1 4.49Å; L464-I586 HydrophobicContact CG-CG2 4.33Å; E465-I586 WeakPolarHBondContact O-CA 3.4Å; F466-I586 HydrophobicContact CB-CG1 4.07Å; V563-I586 HydrophobicContact CG1-CD1 3.63Å; F582-I586 HydrophobicContact CD1-CD1 4.37Å; F582-I586 HydrophobicContact CD1-CG1 4.41Å; F582-I586 HydrophobicContact CE1-CD1 4.4Å; F582-I586 HydrophobicContact CE1-CG1 3.97Å; I586-I598 HydrophobicContact CG2-CD1 4.33Å
587	Q	93.8	Very high	92.2	Very high	22 Å²	22	45 Å²	45	10%	0.103	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-37.4	-177.7	179.7	-179.4	-100.4	0	0	112.2	F439 E465 W522 I598	F439-Q587 HydrophobicContact CD1-CG 4.23Å; F439-Q587 HydrophobicContact CE1-CG 4.32Å; E465-Q587 HydrophobicContact CB-CB 4.18Å; E465-Q587 PolarHBondContact O-N 2.84Å; E465-Q587 PolarHBondContact OE2-NE2 2.77Å; W522-Q587 HydrophobicContact CE3-CB 4.24Å; W522-Q587 HydrophobicContact CH2-CB 3.77Å; W522-Q587 HydrophobicContact CZ3-CB 3.57Å; Q587-I598 WeakPolarHBondContact O-CD1 3.29Å
588	S	94.6	Very high	92.3	Very high	35 Å²	35	44.6 Å²	44.6	25%	0.245	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	151.1	-179.4	71.3	0	0	0	0	112.7	L464 E465	L464-S588 WeakPolarHBondContact CA-O 3.25Å; E465-S588 WeakPolarHBondContact CB-OG 3.47Å; E465-S588 VanDerWaalsContact CG-OG 3.29Å; E465-S588 WeakPolarHBondContact CG-OG 3.26Å; E465-S588 PolarHBondContact N-O 3.46Å; E465-S588 WeakPolarHBondContact OE2-CB 3.48Å; E465-S588 PolarHBondContact OE2-OG 2.82Å
589	L	95.4	Very high	92.3	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	128.3	174.3	175.6	62.7	0	0	0	108.3	I462 L464 V563 I591 T596 I598	I462-L589 HydrophobicContact CG2-CD1 3.62Å; L464-L589 HydrophobicContact CD1-CB 4.3Å; L464-L589 HydrophobicContact CD1-CD1 3.84Å; V563-L589 HydrophobicContact CG2-CD2 4.38Å; L589-I591 HydrophobicContact CD1-CG1 4.3Å; L589-I591 HydrophobicContact CD2-CD1 4.3Å; L589-I591 HydrophobicContact CG-CD1 4.43Å; L589-I591 HydrophobicContact CG-CG1 4.24Å; L589-T596 HydrophobicContact CD2-CG2 4.01Å; L589-T596 HydrophobicContact CG-CG2 4.45Å; L589-T596 PolarHBondContact O-N 2.92Å; L589-I598 HydrophobicContact CB-CG2 3.53Å; L589-I598 HydrophobicContact CD2-CG2 4.23Å
590	T	95.3	Very high	92.2	Very high	33 Å²	33	43.9 Å²	43.9	20%	0.202	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	128.2	176.2	-69.1	0	0	0	0	108.9	I462 T463 K594	I462-T590 CarbonylContact C-O 3.48Å; I462-T590 VanDerWaalsContact CA-O 3.3Å; I462-T590 WeakPolarHBondContact CA-O 3.47Å; T463-T590 PolarHBondContact N-O 2.88Å; T463-T590 PolarHBondContact O-N 2.85Å; T590-K594 WeakPolarHBondContact CA-O 3.33Å
591	I	93.6	Very high	91.5	Very high	28 Å²	28	45.4 Å²	45.4	14%	0.144	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	123.8	-179	-57.1	175.6	0	0	0	107.7	L453 I462 L561 L589 N593 K594 T596	L453-I591 HydrophobicContact CD2-CD1 4.19Å; L453-I591 HydrophobicContact CD2-CG2 3.83Å; I462-I591 HydrophobicContact CG1-CG1 4.46Å; L561-I591 HydrophobicContact CD2-CD1 3.66Å; L589-I591 HydrophobicContact CD1-CG1 4.3Å; L589-I591 HydrophobicContact CD2-CD1 4.3Å; L589-I591 HydrophobicContact CG-CD1 4.43Å; L589-I591 HydrophobicContact CG-CG1 4.24Å; I591-N593 VanDerWaalsContact C-N 3.3Å; I591-N593 PolarHBondContact O-N 2.8Å; I591-K594 PolarHBondContact N-O 3.45Å; I591-K594 WeakPolarHBondContact O-CB 3.4Å; I591-K594 PolarHBondContact O-N 2.89Å; I591-T596 HydrophobicContact CD1-CG2 4.37Å
592	N	90.3	Very high	90.6	Very high	79 Å²	79	48.7 Å²	48.7	42%	0.422	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	48.6	-178.1	-59.1	-24.1	0	0	0	112.6	F460 Q461 K594	F460-N592 WeakPolarHBondContact CA-OD1 3.41Å; F460-N592 WeakPolarHBondContact CB-OD1 3.37Å; Q461-N592 PolarHBondContact N-OD1 3.19Å; Q461-N592 PolarHBondContact O-N 2.76Å; Q461-N592 PolarHBondContact O-OD1 2.97Å; N592-K594 PolarHBondContact O-N 2.77Å; N592-K594 VanDerWaalsContact O-N 3.11Å
593	N	85.2	Confident	89.2	Confident	125 Å²	125	52.8 Å²	52.8	67%	0.668	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	11	-175.3	-60.3	-28.1	0	0	0	115.9	Q461 I591	Q461-N593 PolarHBondContact NE2-OD1 2.79Å; I591-N593 VanDerWaalsContact C-N 3.3Å; I591-N593 PolarHBondContact O-N 2.8Å
594	K	86.9	Confident	88.5	Confident	155 Å²	155	51.2 Å²	51.2	67%	0.674	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.5	122.7	171.1	-174	166.7	-176.4	167	0	110.5	T590 I591 N592 T596	T590-K594 WeakPolarHBondContact CA-O 3.33Å; I591-K594 PolarHBondContact N-O 3.45Å; I591-K594 WeakPolarHBondContact O-CB 3.4Å; I591-K594 PolarHBondContact O-N 2.89Å; N592-K594 PolarHBondContact O-N 2.77Å; N592-K594 VanDerWaalsContact O-N 3.11Å; K594-T596 PolarHBondContact O-N 2.88Å
595	A	87.8	Confident	88.1	Confident	79 Å²	79	56 Å²	56	65%	0.653	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.5	129.3	171.4	0	0	0	0	0	109.8
596	T	90.9	Very high	87.9	Confident	21 Å²	21	55.9 Å²	55.9	13%	0.129	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	117.4	176.3	-63.9	0	0	0	0	107.4	F450 L589 I591 K594 I598 K605	F450-T596 HydrophobicContact CD1-CG2 3.97Å; F450-T596 HydrophobicContact CE1-CG2 4.06Å; L589-T596 HydrophobicContact CD2-CG2 4.01Å; L589-T596 HydrophobicContact CG-CG2 4.45Å; L589-T596 PolarHBondContact O-N 2.92Å; I591-T596 HydrophobicContact CD1-CG2 4.37Å; K594-T596 PolarHBondContact O-N 2.88Å; T596-I598 PolarHBondContact O-N 2.7Å; T596-I598 VanDerWaalsContact O-N 3.15Å; T596-K605 HydrophobicContact CG2-CB 4.24Å; T596-K605 HydrophobicContact CG2-CD 4.1Å
597	D	88.1	Confident	87.4	Confident	50 Å²	50	60.4 Å²	60.4	27%	0.267	32%	0.315	S	S	.	.			trans	-65.8	112.6	177.5	-167.6	-29.4	0	0	0	110	R599 G604 K605	D597-R599 VanDerWaalsContact C-N 3.27Å; D597-R599 PolarHBondContact O-N 3.09Å; D597-R599 VanDerWaalsContact OD1-CB 3.23Å; D597-R599 WeakPolarHBondContact OD1-CB 3.26Å; D597-R599 VanDerWaalsContact OD1-CG 3.24Å; D597-R599 WeakPolarHBondContact OD1-CG 3.4Å; D597-R599 IonicContact OD1-CZ 2.59Å; D597-R599 PolarHBondContact OD1-N 2.97Å; D597-R599 IonicContact OD1-NE 3.34Å; D597-R599 PolarHBondContact OD1-NE 2.97Å; D597-R599 IonicContact OD1-NH2 3.62Å; D597-R599 IonicContact OD2-CZ 2.58Å; D597-R599 IonicContact OD2-NE 2.77Å; D597-R599 PolarHBondContact OD2-NE 3.02Å; D597-R599 VanDerWaalsContact OD2-NE 3.17Å; D597-R599 IonicContact OD2-NH2 2.58Å; D597-R599 PolarHBondContact OD2-NH2 2.77Å; D597-G604 WeakPolarHBondContact OD1-CA 3.35Å; D597-K605 WeakPolarHBondContact O-CB 3.45Å; D597-K605 PolarHBondContact O-N 2.72Å
598	I	92.4	Very high	87.2	Confident	13 Å²	13	61.9 Å²	61.9	7%	0.067	33%	0.327	C	S	.	.			trans	-82.7	-1.2	-175.4	61.2	-174.6	0	0	0	113.6	P440 M448 F450 I586 Q587 L589 T596	P440-I598 HydrophobicContact CG-CD1 3.97Å; P440-I598 HydrophobicContact CG-CG1 4.37Å; M448-I598 WeakPolarHBondContact CE-O 3.49Å; F450-I598 HydrophobicContact CE1-CG2 4.47Å; F450-I598 HydrophobicContact CZ-CB 4.18Å; F450-I598 HydrophobicContact CZ-CG2 4.1Å; I586-I598 HydrophobicContact CG2-CD1 4.33Å; Q587-I598 WeakPolarHBondContact O-CD1 3.29Å; L589-I598 HydrophobicContact CB-CG2 3.53Å; L589-I598 HydrophobicContact CD2-CG2 4.23Å; T596-I598 PolarHBondContact O-N 2.7Å; T596-I598 VanDerWaalsContact O-N 3.15Å
599	R	89.4	Confident	86.8	Confident	49 Å²	49	60.2 Å²	60.2	19%	0.185	32%	0.316	C	S	.	.	S	Bend	trans	-71	160.9	177.8	-60.5	178.3	-64.7	168.3	5.3	111.8	D597 G604 K605 A606 E794	D597-R599 VanDerWaalsContact C-N 3.27Å; D597-R599 PolarHBondContact O-N 3.09Å; D597-R599 VanDerWaalsContact OD1-CB 3.23Å; D597-R599 WeakPolarHBondContact OD1-CB 3.26Å; D597-R599 VanDerWaalsContact OD1-CG 3.24Å; D597-R599 WeakPolarHBondContact OD1-CG 3.4Å; D597-R599 IonicContact OD1-CZ 2.59Å; D597-R599 PolarHBondContact OD1-N 2.97Å; D597-R599 IonicContact OD1-NE 3.34Å; D597-R599 PolarHBondContact OD1-NE 2.97Å; D597-R599 IonicContact OD1-NH2 3.62Å; D597-R599 IonicContact OD2-CZ 2.58Å; D597-R599 IonicContact OD2-NE 2.77Å; D597-R599 PolarHBondContact OD2-NE 3.02Å; D597-R599 VanDerWaalsContact OD2-NE 3.17Å; D597-R599 IonicContact OD2-NH2 2.58Å; D597-R599 PolarHBondContact OD2-NH2 2.77Å; R599-G604 CarbonylContact O-C 3.59Å; R599-G604 VanDerWaalsContact O-CA 3.22Å; R599-G604 WeakPolarHBondContact O-CA 3.4Å; R599-K605 PolarHBondContact O-N 3.22Å; R599-A606 WeakPolarHBondContact O-CB 3.42Å; R599-A606 PolarHBondContact O-N 3.1Å; R599-A606 VanDerWaalsContact O-N 3.14Å; R599-E794 IonicContact CZ-OE1 3.74Å; R599-E794 IonicContact NH1-OE1 2.99Å; R599-E794 PolarHBondContact NH1-OE1 2.69Å; R599-E794 IonicContact NH2-OE1 3.08Å; R599-E794 PolarHBondContact NH2-OE1 3.4Å; R599-E794 IonicContact NH2-OE2 2.75Å
600	P	86.7	Confident	86.5	Confident	28 Å²	28	60.2 Å²	60.2	18%	0.182	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-58.7	141.5	174.1	-20.5	31.8	0	0	0	112.5	L424 V437 L603 G604	L424-P600 HydrophobicContact CD1-CG 4.09Å; L424-P600 HydrophobicContact CD2-CB 3.93Å; L424-P600 HydrophobicContact CD2-CG 4.03Å; L424-P600 HydrophobicContact CG-CB 4.03Å; L424-P600 HydrophobicContact CG-CG 3.79Å; V437-P600 HydrophobicContact CB-CG 4.34Å; V437-P600 WeakPolarHBondContact O-CD 3.28Å; P600-L603 PolarHBondContact O-N 3.08Å; P600-L603 VanDerWaalsContact O-N 3.11Å; P600-G604 PolarHBondContact O-N 2.87Å
601	W	76.9	Confident	86.2	Confident	183 Å²	183	59.5 Å²	59.5	69%	0.693	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	142.5	164.9	-177.1	93.9	0	0	0	110.1	A606	W601-A606 WeakPolarHBondContact CB-O 3.28Å; W601-A606 PolarHBondContact N-O 2.99Å
602	P	71.7	Confident	86.1	Confident	72 Å²	72	58.4 Å²	58.4	47%	0.468	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	cis	-93.9	12.6	7.9	38.4	-37.9	0	0	0	115.2	R798	P602-R798 PolarHBondContact O-NH2 2.84Å; P602-R798 VanDerWaalsContact O-NH2 3.08Å
603	L	68.2	Low	86.2	Confident	89 Å²	89	54.8 Å²	54.8	47%	0.466	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-54.3	175.3	-63.2	175.7	0	0	0	110.5	P600 E794	P600-L603 PolarHBondContact O-N 3.08Å; P600-L603 VanDerWaalsContact O-N 3.11Å; L603-E794 HydrophobicContact CD2-CB 4.28Å; L603-E794 HydrophobicContact CD2-CG 4.28Å
604	G	83.3	Confident	86.6	Confident	8 Å²	8	49.4 Å²	49.4	8%	0.082	26%	0.258	C	S	.	.	S	Bend	trans	-105.6	-157.3	175	0	0	0	0	0	114.1	D597 R599 P600	D597-G604 WeakPolarHBondContact OD1-CA 3.35Å; R599-G604 CarbonylContact O-C 3.59Å; R599-G604 VanDerWaalsContact O-CA 3.22Å; R599-G604 WeakPolarHBondContact O-CA 3.4Å; P600-G604 PolarHBondContact O-N 2.87Å
605	K	87.6	Confident	86.8	Confident	100 Å²	100	42.9 Å²	42.9	44%	0.435	23%	0.232	S	C	.	.	S	Bend	trans	-110.5	-0.2	-174.3	-73.5	178.3	151.9	-89.5	0	114.7	F450 E451 T596 D597 R599 L607	F450-K605 HydrophobicContact CD1-CB 4.01Å; F450-K605 VanDerWaalsContact CD1-O 3.27Å; F450-K605 WeakPolarHBondContact CD1-O 3.4Å; F450-K605 HydrophobicContact CE1-CB 4.24Å; E451-K605 IonicContact OE2-NZ 3.1Å; T596-K605 HydrophobicContact CG2-CB 4.24Å; T596-K605 HydrophobicContact CG2-CD 4.1Å; D597-K605 WeakPolarHBondContact O-CB 3.45Å; D597-K605 PolarHBondContact O-N 2.72Å; R599-K605 PolarHBondContact O-N 3.22Å; K605-L607 PolarHBondContact O-N 2.86Å
606	A	90.5	Very high	86.9	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.008	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-70.9	113.4	172.7	0	0	0	0	0	109	L424 M448 T449 F450 R599 W601	L424-A606 HydrophobicContact CD2-CB 3.61Å; M448-A606 HydrophobicContact CE-CB 3.52Å; T449-A606 CarbonylContact O-C 3.59Å; T449-A606 WeakPolarHBondContact O-CA 3.22Å; F450-A606 HydrophobicContact CE1-CB 3.87Å; F450-A606 HydrophobicContact CE2-CB 4.33Å; F450-A606 HydrophobicContact CZ-CB 3.76Å; R599-A606 WeakPolarHBondContact O-CB 3.42Å; R599-A606 PolarHBondContact O-N 3.1Å; R599-A606 VanDerWaalsContact O-N 3.14Å; W601-A606 WeakPolarHBondContact CB-O 3.28Å; W601-A606 PolarHBondContact N-O 2.99Å
607	L	87.9	Confident	86.6	Confident	96 Å²	96	42.9 Å²	42.9	50%	0.503	22%	0.222	S	C	.	.			trans	-76.2	-35.9	-175.3	-59.3	179.6	0	0	0	111.7	T449 E451 K605	T449-L607 PolarHBondContact O-N 2.8Å; E451-L607 HydrophobicContact CG-CD1 4.12Å; K605-L607 PolarHBondContact O-N 2.86Å
608	S	88.1	Confident	86.3	Confident	53 Å²	53	50 Å²	50	37%	0.371	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	-179.9	175.5	-176.2	0	0	0	0	108.5	T449	T449-S608 PolarHBondContact N-O 2.83Å; T449-S608 WeakPolarHBondContact OG1-CB 3.14Å; T449-S608 PolarHBondContact OG1-N 2.88Å; T449-S608 PolarHBondContact OG1-O 2.89Å
609	G	87.4	Confident	86.1	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.3	169	-179.7	0	0	0	0	0	109.3	N423 L424 H447	N423-G609 CarbonylContact C-O 3.55Å; N423-G609 WeakPolarHBondContact CA-O 3.31Å; L424-G609 WeakPolarHBondContact CB-O 3.4Å; L424-G609 PolarHBondContact N-O 3.25Å; H447-G609 CarbonylContact O-C 3.55Å; H447-G609 WeakPolarHBondContact O-CA 3.48Å
610	A	87.8	Confident	86.1	Confident	2 Å²	2	50.1 Å²	50.1	2%	0.017	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	153.1	179.1	0	0	0	0	0	113.6	H421 C422 S446 H447 I612	H421-A610 WeakPolarHBondContact CD2-CB 3.21Å; H421-A610 WeakPolarHBondContact NE2-CB 3.44Å; C422-A610 CarbonylContact O-C 3.59Å; C422-A610 WeakPolarHBondContact O-CA 3.35Å; S446-A610 WeakPolarHBondContact CA-O 3.44Å; S446-A610 WeakPolarHBondContact CB-O 3.46Å; H447-A610 PolarHBondContact N-O 3.05Å; H447-A610 VanDerWaalsContact N-O 3.09Å; H447-A610 PolarHBondContact O-N 2.82Å; A610-I612 VanDerWaalsContact C-N 3.27Å; A610-I612 PolarHBondContact O-N 3.01Å
611	D	88.8	Confident	86.2	Confident	18 Å²	18	54.3 Å²	54.3	10%	0.096	27%	0.274	C	S	.	.	S	Bend	trans	50.3	40.7	-173.1	-63.5	-15.7	0	0	0	113.4	R419 H421 C422 Y443 Y445 S446	R419-D611 IonicContact CZ-OD2 2.77Å; R419-D611 IonicContact NH2-OD2 2.72Å; R419-D611 PolarHBondContact NH2-OD2 3.16Å; H421-D611 WeakPolarHBondContact CA-OD1 3.45Å; H421-D611 IonicContact CE1-OD2 2.72Å; H421-D611 PolarHBondContact CE1-OD2 2.97Å; H421-D611 IonicContact CG-OD2 2.72Å; H421-D611 IonicContact ND1-OD1 2.8Å; H421-D611 PolarHBondContact ND1-OD1 2.84Å; H421-D611 IonicContact ND1-OD2 3.18Å; H421-D611 PolarHBondContact ND1-OD2 2.76Å; C422-D611 PolarHBondContact N-OD1 3.18Å; C422-D611 PolarHBondContact O-N 3Å; Y443-D611 VanDerWaalsContact CD2-O 3.3Å; Y443-D611 WeakPolarHBondContact CD2-O 3.38Å; Y445-D611 HydrophobicContact CD2-CB 3.75Å; Y445-D611 WeakPolarHBondContact CD2-OD2 3.05Å; Y445-D611 HydrophobicContact CE2-CB 3.6Å; Y445-D611 VanDerWaalsContact CE2-OD2 3.24Å; Y445-D611 WeakPolarHBondContact CE2-OD2 2.87Å; S446-D611 WeakPolarHBondContact CB-O 3.5Å; S446-D611 PolarHBondContact OG-O 3.09Å
612	I	93.1	Very high	86.6	Confident	4 Å²	4	54 Å²	54	2%	0.021	28%	0.282	C	S	.	.			trans	-94.4	120.4	-178.2	-60.3	-68	0	0	0	110.5	L424 V437 P440 F442 M448 A610	L424-I612 HydrophobicContact CD1-CB 3.86Å; L424-I612 HydrophobicContact CD1-CG1 4.08Å; L424-I612 HydrophobicContact CD1-CG2 3.98Å; V437-I612 HydrophobicContact CG1-CG2 3.75Å; V437-I612 HydrophobicContact CG2-CG2 4Å; P440-I612 HydrophobicContact CB-CG2 3.65Å; F442-I612 HydrophobicContact CD1-CD1 3.45Å; F442-I612 VanDerWaalsContact CD1-CD1 3.45Å; F442-I612 HydrophobicContact CE1-CD1 3.3Å; F442-I612 HydrophobicContact CG-CD1 4.2Å; F442-I612 HydrophobicContact CZ-CD1 3.94Å; M448-I612 HydrophobicContact CG-CD1 3.52Å; M448-I612 HydrophobicContact CG-CG1 3.61Å; M448-I612 HydrophobicContact SD-CD1 3.98Å; M448-I612 HydrophobicContact SD-CG1 4.14Å; M448-I612 HydrophobicContact SD-CG2 4.1Å; A610-I612 VanDerWaalsContact C-N 3.27Å; A610-I612 PolarHBondContact O-N 3.01Å
613	G	91.8	Very high	87.5	Confident	4 Å²	4	51.8 Å²	51.8	4%	0.041	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	179	171.7	0	0	0	0	0	112.6	R441	R441-G613 PolarHBondContact N-O 2.95Å; R441-G613 PolarHBondContact O-N 2.96Å
614	E	92.4	Very high	88.7	Confident	11 Å²	11	52.5 Å²	52.5	5%	0.051	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	135.3	169.5	174.4	49.3	-126.4	0	0	109.2	V435 V437 N438 F439 S616 D617	V435-E614 HydrophobicContact CG2-CB 4.17Å; V437-E614 WeakPolarHBondContact CA-OE2 3.46Å; N438-E614 WeakPolarHBondContact CA-OE2 3.13Å; N438-E614 PolarHBondContact N-OE2 3.47Å; F439-E614 WeakPolarHBondContact CB-OE1 3.16Å; F439-E614 PolarHBondContact N-OE1 2.91Å; F439-E614 PolarHBondContact N-OE2 2.85Å; E614-S616 VanDerWaalsContact CD-OG 3.25Å; E614-S616 VanDerWaalsContact OE1-CB 3.27Å; E614-S616 WeakPolarHBondContact OE1-CB 3.39Å; E614-S616 PolarHBondContact OE1-N 2.81Å; E614-S616 PolarHBondContact OE1-OG 2.95Å; E614-D617 WeakPolarHBondContact CG-OD1 3.39Å
615	C	92.1	Very high	89.3	Confident	19 Å²	19	53.3 Å²	53.3	13%	0.128	28%	0.283	C	S	.	.	S	Bend	trans	-80.4	-32.7	177.4	-78	0	0	0	0	113.3	F439 R441 C585 D617 A636	F439-C615 HydrophobicContact CB-CB 4.34Å; F439-C615 PolarHBondContact O-N 2.8Å; R441-C615 VanDerWaalsContact CA-SG 3.58Å; R441-C615 WeakPolarHBondContact CB-SG 3.2Å; C585-C615 WeakPolarHBondContact CA-SG 3.25Å; C585-C615 HydrophobicContact CB-CB 3.97Å; C585-C615 WeakPolarHBondContact CB-SG 3.28Å; C585-C615 WeakPolarHBondContact SG-CB 3.29Å; C585-C615 CovalentContact SG-SG 2.02Å; C585-C615 PolarHBondContact SG-SG 3.01Å; C615-D617 VanDerWaalsContact C-N 3.33Å; C615-D617 PolarHBondContact O-N 3Å; C615-A636 CarbonylContact C-O 3.58Å; C615-A636 VanDerWaalsContact C-O 3.29Å; C615-A636 HydrophobicContact CB-CB 3.81Å
616	S	90.2	Very high	89.7	Confident	16 Å²	16	50.3 Å²	50.3	11%	0.112	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-79.6	-8.1	-175.2	63.2	0	0	0	0	115.4	E614 R618 V619	E614-S616 VanDerWaalsContact CD-OG 3.25Å; E614-S616 VanDerWaalsContact OE1-CB 3.27Å; E614-S616 WeakPolarHBondContact OE1-CB 3.39Å; E614-S616 PolarHBondContact OE1-N 2.81Å; E614-S616 PolarHBondContact OE1-OG 2.95Å; S616-R618 PolarHBondContact O-N 3.37Å; S616-V619 WeakPolarHBondContact O-CB 3.3Å; S616-V619 WeakPolarHBondContact O-CG2 3.4Å; S616-V619 PolarHBondContact O-N 2.92Å
617	D	83.7	Confident	89.8	Confident	84 Å²	84	54.2 Å²	54.2	45%	0.449	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-43.4	-40.4	-175.2	-106.5	25.6	0	0	0	114	R427 E614 C615	R427-D617 IonicContact CZ-OD2 2.84Å; R427-D617 IonicContact NH1-OD2 2.71Å; R427-D617 PolarHBondContact NH1-OD2 3.08Å; E614-D617 WeakPolarHBondContact CG-OD1 3.39Å; C615-D617 VanDerWaalsContact C-N 3.33Å; C615-D617 PolarHBondContact O-N 3Å
618	R	82.1	Confident	90	Very high	199 Å²	199	52.7 Å²	52.7	75%	0.751	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-99	-1.4	-175.3	-61.7	-170.5	-179.9	177.2	-0.4	115.5	S616 C620 D621	S616-R618 PolarHBondContact O-N 3.37Å; R618-C620 VanDerWaalsContact C-N 3.29Å; R618-C620 PolarHBondContact O-N 2.93Å; R618-D621 WeakPolarHBondContact CA-OD2 3.19Å; R618-D621 WeakPolarHBondContact CG-OD2 3.21Å; R618-D621 PolarHBondContact O-N 2.77Å
619	V	88.6	Confident	90.2	Very high	24 Å²	24	50.8 Å²	50.8	15%	0.145	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-33.9	-170.7	-178.3	0	0	0	0	111.1	S616 V623 A633 Y639	S616-V619 WeakPolarHBondContact O-CB 3.3Å; S616-V619 WeakPolarHBondContact O-CG2 3.4Å; S616-V619 PolarHBondContact O-N 2.92Å; V619-V623 VanDerWaalsContact O-CG2 3.26Å; V619-V623 WeakPolarHBondContact O-CG2 3.43Å; V619-A633 HydrophobicContact CB-CB 4.24Å; V619-Y639 HydrophobicContact CG1-CD1 4.15Å
620	C	89.2	Confident	90.5	Very high	40 Å²	40	55.2 Å²	55.2	27%	0.27	32%	0.321	S	S	.	.	S	Bend	trans	-90.6	-10.7	178	-71.5	0	0	0	0	115	R618 M622 V623 C631	R618-C620 VanDerWaalsContact C-N 3.29Å; R618-C620 PolarHBondContact O-N 2.93Å; C620-M622 PolarHBondContact O-N 2.76Å; C620-M622 VanDerWaalsContact O-N 3.1Å; C620-V623 PolarHBondContact O-N 2.91Å; C620-V623 VanDerWaalsContact O-N 3.1Å; C620-C631 WeakPolarHBondContact CA-SG 3.44Å; C620-C631 HydrophobicContact CB-CB 3.7Å; C620-C631 WeakPolarHBondContact CB-SG 3.32Å; C620-C631 WeakPolarHBondContact SG-CB 3.3Å; C620-C631 CovalentContact SG-SG 2.04Å; C620-C631 PolarHBondContact SG-SG 2.91Å
621	D	89	Confident	90.7	Very high	117 Å²	117	56.4 Å²	56.4	63%	0.626	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-32.4	-176.7	-75.2	-16	0	0	0	113.6	R618	R618-D621 WeakPolarHBondContact CA-OD2 3.19Å; R618-D621 WeakPolarHBondContact CG-OD2 3.21Å; R618-D621 PolarHBondContact O-N 2.77Å
622	M	85.5	Confident	90.8	Very high	175 Å²	175	59.8 Å²	59.8	86%	0.862	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	8.2	-177.2	-63.8	-176.3	-71.6	0	0	113.1	C620	C620-M622 PolarHBondContact O-N 2.76Å; C620-M622 VanDerWaalsContact O-N 3.1Å
623	V	89.5	Confident	90.5	Very high	26 Å²	26	60.5 Å²	60.5	16%	0.158	35%	0.349	C	S	.	.			trans	-106.4	116.7	-176.4	177.6	0	0	0	0	110.2	V619 C620 C631 Y639 L651	V619-V623 VanDerWaalsContact O-CG2 3.26Å; V619-V623 WeakPolarHBondContact O-CG2 3.43Å; C620-V623 PolarHBondContact O-N 2.91Å; C620-V623 VanDerWaalsContact O-N 3.1Å; V623-C631 HydrophobicContact CB-CB 4.36Å; V623-C631 HydrophobicContact CG1-CB 4.09Å; V623-Y639 HydrophobicContact CG1-CD2 3.69Å; V623-Y639 HydrophobicContact CG1-CE1 4.48Å; V623-Y639 HydrophobicContact CG1-CE2 3.6Å; V623-Y639 HydrophobicContact CG1-CG 4.19Å; V623-Y639 HydrophobicContact CG2-CD1 3.69Å; V623-Y639 HydrophobicContact CG2-CD2 4.31Å; V623-Y639 HydrophobicContact CG2-CE1 3.63Å; V623-Y639 HydrophobicContact CG2-CE2 4.26Å; V623-Y639 HydrophobicContact CG2-CG 4.04Å; V623-L651 HydrophobicContact CG1-CD2 4.13Å
624	S	93.6	Very high	90.2	Very high	104 Å²	104	63 Å²	63	73%	0.727	36%	0.362	S	S	*	.			trans	-111.5	106.5	175.5	-67.7	0	0	0	0	110.6
625	C	95.8	Very high	89.9	Confident	25 Å²	25	68.6 Å²	68.6	17%	0.169	38%	0.383	C	S	.	.			trans	-77.9	134.6	173.7	-50.9	0	0	0	0	110.5	G629 C631 C641	C625-G629 WeakPolarHBondContact CB-O 3.1Å; C625-C631 PolarHBondContact SG-N 2.9Å; C625-C631 VanDerWaalsContact SG-N 3.4Å; C625-C641 HydrophobicContact CB-CB 3.73Å; C625-C641 WeakPolarHBondContact CB-SG 3.33Å; C625-C641 VanDerWaalsContact SG-CA 3.57Å; C625-C641 WeakPolarHBondContact SG-CB 3.35Å; C625-C641 CovalentContact SG-SG 2.03Å; C625-C641 PolarHBondContact SG-SG 3.17Å
626	A	96.1	Very high	89.7	Confident	38 Å²	38	67.8 Å²	67.8	31%	0.314	38%	0.377	S	S	.	.	S	Bend	trans	-77.1	172	176.9	0	0	0	0	0	112.4	G628 G629 L651	A626-G628 PolarHBondContact O-N 3.21Å; A626-G629 PolarHBondContact O-N 3.19Å; A626-L651 WeakPolarHBondContact CB-O 3.47Å; A626-L651 PolarHBondContact N-O 3.38Å
627	N	93.8	Very high	89.5	Confident	83 Å²	83	70.4 Å²	70.4	44%	0.444	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	24.9	169.1	-63.5	-49	0	0	0	116.1	F647 C652	N627-F647 HydrophobicContact CB-CD1 3.49Å; N627-F647 VanDerWaalsContact CB-CD1 3.49Å; N627-F647 HydrophobicContact CB-CD2 4.08Å; N627-F647 HydrophobicContact CB-CE1 3.55Å; N627-F647 HydrophobicContact CB-CE2 4.13Å; N627-F647 HydrophobicContact CB-CG 3.77Å; N627-F647 HydrophobicContact CB-CZ 3.87Å; N627-F647 VanDerWaalsContact CG-CD1 3.49Å; N627-F647 WeakPolarHBondContact ND2-CD1 3.46Å; N627-C652 PolarHBondContact ND2-O 3.13Å
628	G	91.2	Very high	89.7	Confident	64 Å²	64	67.2 Å²	67.2	66%	0.66	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	14.7	-179.1	0	0	0	0	0	114.7	A626	A626-G628 PolarHBondContact O-N 3.21Å
629	G	93.5	Very high	90	Very high	13 Å²	13	62.4 Å²	62.4	13%	0.134	36%	0.36	C	S	.	.			trans	-67.6	158.6	168.5	0	0	0	0	0	112.9	C625 A626 L642	C625-G629 WeakPolarHBondContact CB-O 3.1Å; A626-G629 PolarHBondContact O-N 3.19Å; G629-L642 VanDerWaalsContact CA-O 3.26Å; G629-L642 WeakPolarHBondContact CA-O 3.38Å
630	V	93.6	Very high	90.1	Very high	93 Å²	93	62.5 Å²	62.5	56%	0.564	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.5	131.9	-178.7	179.8	0	0	0	0	109.2	F632 L642	V630-F632 PolarHBondContact O-N 3.38Å; V630-L642 HydrophobicContact CB-CB 4.46Å; V630-L642 PolarHBondContact N-O 2.84Å; V630-L642 WeakPolarHBondContact O-CB 3.35Å; V630-L642 PolarHBondContact O-N 2.84Å
631	C	92	Very high	90.4	Very high	28 Å²	28	60.7 Å²	60.7	19%	0.189	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	131	173.3	-178.8	0	0	0	0	110	C620 V623 C625	C620-C631 WeakPolarHBondContact CA-SG 3.44Å; C620-C631 HydrophobicContact CB-CB 3.7Å; C620-C631 WeakPolarHBondContact CB-SG 3.32Å; C620-C631 WeakPolarHBondContact SG-CB 3.3Å; C620-C631 CovalentContact SG-SG 2.04Å; C620-C631 PolarHBondContact SG-SG 2.91Å; V623-C631 HydrophobicContact CB-CB 4.36Å; V623-C631 HydrophobicContact CG1-CB 4.09Å; C625-C631 PolarHBondContact SG-N 2.9Å; C625-C631 VanDerWaalsContact SG-N 3.4Å
632	F	89.8	Confident	90.6	Very high	88 Å²	88	56.3 Å²	56.3	39%	0.386	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	125	174.4	177.2	-96.9	0	0	0	109.1	V630 N634 Y639 I640 L642	V630-F632 PolarHBondContact O-N 3.38Å; F632-N634 HydrophobicContact CD1-CB 4.19Å; F632-N634 HydrophobicContact CE1-CB 4.22Å; F632-N634 PolarHBondContact O-N 2.91Å; F632-Y639 CarbonylContact O-C 3.47Å; F632-Y639 WeakPolarHBondContact O-CA 3.1Å; F632-I640 HydrophobicContact CB-CG2 4.35Å; F632-I640 HydrophobicContact CD1-CG2 4.08Å; F632-I640 PolarHBondContact N-O 3.18Å; F632-I640 PolarHBondContact O-N 3.45Å; F632-L642 HydrophobicContact CB-CD1 3.78Å; F632-L642 HydrophobicContact CB-CD2 4.02Å; F632-L642 HydrophobicContact CB-CG 3.74Å; F632-L642 HydrophobicContact CG-CD1 4.27Å
633	A	87.4	Confident	91.1	Very high	19 Å²	19	48.1 Å²	48.1	16%	0.157	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	104.5	175.2	0	0	0	0	0	110	V619 R635 G638	V619-A633 HydrophobicContact CB-CB 4.24Å; A633-R635 VanDerWaalsContact C-N 3.34Å; A633-G638 CarbonylContact C-O 3.57Å; A633-G638 WeakPolarHBondContact CA-O 3.44Å
634	N	84.9	Confident	91.3	Very high	58 Å²	58	48.7 Å²	48.7	31%	0.31	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-7.4	178.3	65	-6.2	0	0	0	112.8	F632 G638 I640	F632-N634 HydrophobicContact CD1-CB 4.19Å; F632-N634 HydrophobicContact CE1-CB 4.22Å; F632-N634 PolarHBondContact O-N 2.91Å; N634-G638 PolarHBondContact N-O 2.93Å; N634-G638 PolarHBondContact OD1-O 2.84Å; N634-I640 HydrophobicContact CB-CG2 4.09Å
635	R	86.9	Confident	91.2	Very high	127 Å²	127	44.7 Å²	44.7	48%	0.479	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	164.6	176.2	-67.3	-178.3	-179.1	-113.2	-1.5	110.1	F439 A633 D637 G638	F439-R635 VanDerWaalsContact CE2-C 3.47Å; A633-R635 VanDerWaalsContact C-N 3.34Å; R635-D637 PolarHBondContact O-N 2.82Å; R635-G638 PolarHBondContact N-O 2.96Å; R635-G638 VanDerWaalsContact N-O 3.1Å; R635-G638 PolarHBondContact O-N 3.21Å; R635-G638 VanDerWaalsContact O-O 3.13Å
636	A	87.5	Confident	91	Very high	2 Å²	2	43.8 Å²	43.8	2%	0.017	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-22.2	176.7	0	0	0	0	0	115	F439 W522 C615	F439-A636 HydrophobicContact CB-CB 3.68Å; F439-A636 HydrophobicContact CD1-CB 4.36Å; F439-A636 HydrophobicContact CD2-CB 4.39Å; F439-A636 HydrophobicContact CG-CB 3.91Å; W522-A636 HydrophobicContact CH2-CB 3.53Å; W522-A636 HydrophobicContact CZ2-CB 3.45Å; W522-A636 VanDerWaalsContact CZ2-CB 3.45Å; C615-A636 CarbonylContact C-O 3.58Å; C615-A636 VanDerWaalsContact C-O 3.29Å; C615-A636 HydrophobicContact CB-CB 3.81Å
637	D	86.7	Confident	90.9	Very high	72 Å²	72	44.7 Å²	44.7	39%	0.385	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.3	17.9	170.1	63	-6.1	0	0	0	113.8	K467 W522 R635	K467-D637 IonicContact NZ-OD2 3.95Å; K467-D637 PolarHBondContact NZ-OD2 3.08Å; W522-D637 PolarHBondContact NE1-OD1 2.79Å; W522-D637 PolarHBondContact NE1-OD2 2.84Å; R635-D637 PolarHBondContact O-N 2.82Å
638	G	86.6	Confident	90.9	Very high	17 Å²	17	45 Å²	45	18%	0.175	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	141.9	-178	0	0	0	0	0	111.7	A633 N634 R635	A633-G638 CarbonylContact C-O 3.57Å; A633-G638 WeakPolarHBondContact CA-O 3.44Å; N634-G638 PolarHBondContact N-O 2.93Å; N634-G638 PolarHBondContact OD1-O 2.84Å; R635-G638 PolarHBondContact N-O 2.96Å; R635-G638 VanDerWaalsContact N-O 3.1Å; R635-G638 PolarHBondContact O-N 3.21Å; R635-G638 VanDerWaalsContact O-O 3.13Å
639	Y	89.6	Confident	90.9	Very high	97 Å²	97	43.6 Å²	43.6	38%	0.38	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	164.7	175	66.1	-86.1	0	0	0	111.9	V619 V623 F632 L651	V619-Y639 HydrophobicContact CG1-CD1 4.15Å; V623-Y639 HydrophobicContact CG1-CD2 3.69Å; V623-Y639 HydrophobicContact CG1-CE1 4.48Å; V623-Y639 HydrophobicContact CG1-CE2 3.6Å; V623-Y639 HydrophobicContact CG1-CG 4.19Å; V623-Y639 HydrophobicContact CG2-CD1 3.69Å; V623-Y639 HydrophobicContact CG2-CD2 4.31Å; V623-Y639 HydrophobicContact CG2-CE1 3.63Å; V623-Y639 HydrophobicContact CG2-CE2 4.26Å; V623-Y639 HydrophobicContact CG2-CG 4.04Å; F632-Y639 CarbonylContact O-C 3.47Å; F632-Y639 WeakPolarHBondContact O-CA 3.1Å; Y639-L651 HydrophobicContact CE2-CD2 4.01Å
640	I	91.2	Very high	90.8	Very high	26 Å²	26	46.4 Å²	46.4	13%	0.133	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	141.1	156.6	-174.4	165.4	0	0	0	108.6	F632 N634 L642 V667 N831	F632-I640 HydrophobicContact CB-CG2 4.35Å; F632-I640 HydrophobicContact CD1-CG2 4.08Å; F632-I640 PolarHBondContact N-O 3.18Å; F632-I640 PolarHBondContact O-N 3.45Å; N634-I640 HydrophobicContact CB-CG2 4.09Å; I640-L642 HydrophobicContact CG2-CD2 3.99Å; I640-V667 VanDerWaalsContact CD1-CA 3.44Å; I640-V667 HydrophobicContact CD1-CB 3.55Å; I640-V667 HydrophobicContact CD1-CG1 3.77Å; I640-N831 WeakPolarHBondContact CD1-ND2 3.35Å
641	C	93.7	Very high	90.8	Very high	2 Å²	2	45 Å²	45	1%	0.014	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	125.5	164	-75.4	0	0	0	0	109.4	C625 C643 C652 N831	C625-C641 HydrophobicContact CB-CB 3.73Å; C625-C641 WeakPolarHBondContact CB-SG 3.33Å; C625-C641 VanDerWaalsContact SG-CA 3.57Å; C625-C641 WeakPolarHBondContact SG-CB 3.35Å; C625-C641 CovalentContact SG-SG 2.03Å; C625-C641 PolarHBondContact SG-SG 3.17Å; C641-C643 PolarHBondContact O-N 3.32Å; C641-C643 VanDerWaalsContact O-N 3.14Å; C641-C652 WeakPolarHBondContact CB-SG 3.47Å; C641-N831 PolarHBondContact O-ND2 3.36Å; C641-N831 VanDerWaalsContact O-ND2 3.11Å; C641-N831 PolarHBondContact O-OD1 3.49Å
642	L	94.3	Very high	91	Very high	26 Å²	26	43.7 Å²	43.7	14%	0.136	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	89.1	175	-58.9	-173.3	0	0	0	108.6	G629 V630 F632 I640 F668 V830	G629-L642 VanDerWaalsContact CA-O 3.26Å; G629-L642 WeakPolarHBondContact CA-O 3.38Å; V630-L642 HydrophobicContact CB-CB 4.46Å; V630-L642 PolarHBondContact N-O 2.84Å; V630-L642 WeakPolarHBondContact O-CB 3.35Å; V630-L642 PolarHBondContact O-N 2.84Å; F632-L642 HydrophobicContact CB-CD1 3.78Å; F632-L642 HydrophobicContact CB-CD2 4.02Å; F632-L642 HydrophobicContact CB-CG 3.74Å; F632-L642 HydrophobicContact CG-CD1 4.27Å; I640-L642 HydrophobicContact CG2-CD2 3.99Å; L642-F668 HydrophobicContact CD2-CB 4.47Å; L642-V830 HydrophobicContact CB-CG1 3.65Å; L642-V830 HydrophobicContact CB-CG2 4.31Å; L642-V830 HydrophobicContact CD2-CG1 3.86Å; L642-V830 HydrophobicContact CG-CG1 4.23Å
643	C	95.1	Very high	91.3	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.014	24%	0.239	C	C	.	.			trans	-77.3	127.6	-172.3	-56.9	0	0	0	0	112.4	C641 F647 C652 V830 N831	C641-C643 PolarHBondContact O-N 3.32Å; C641-C643 VanDerWaalsContact O-N 3.14Å; C643-F647 HydrophobicContact CB-CB 4.43Å; C643-F647 WeakPolarHBondContact CB-O 3.34Å; C643-C652 WeakPolarHBondContact CA-SG 3.41Å; C643-C652 HydrophobicContact CB-CB 3.65Å; C643-C652 WeakPolarHBondContact CB-SG 3.33Å; C643-C652 WeakPolarHBondContact SG-CA 3.46Å; C643-C652 WeakPolarHBondContact SG-CB 3.32Å; C643-C652 CovalentContact SG-SG 2.03Å; C643-C652 PolarHBondContact SG-SG 3.38Å; C643-V830 CarbonylContact O-C 3.2Å; C643-V830 VanDerWaalsContact O-CA 3.27Å; C643-V830 WeakPolarHBondContact O-CA 3.43Å; C643-N831 WeakPolarHBondContact CA-OD1 3.38Å; C643-N831 WeakPolarHBondContact CB-OD1 3.16Å; C643-N831 PolarHBondContact N-OD1 2.82Å; C643-N831 PolarHBondContact O-N 3.01Å
644	P	94.7	Very high	91.6	Very high	39 Å²	39	47.9 Å²	47.9	25%	0.253	25%	0.252	S	S	.	.	B	Isolated β-bridge	trans	-62.2	147.4	178	-22.3	34.7	0	0	0	111.7	G646 F647 G829	P644-G646 PolarHBondContact O-N 2.92Å; P644-G646 VanDerWaalsContact O-N 3.09Å; P644-F647 HydrophobicContact CB-CD2 4.26Å; P644-F647 PolarHBondContact O-N 3.06Å; P644-G829 WeakPolarHBondContact CA-O 3.4Å
645	L	91.9	Very high	92	Very high	19 Å²	19	49.6 Å²	49.6	10%	0.099	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	115.2	179.6	-171.3	166.1	0	0	0	111.8	L658 A824 A827 G828 G829 I832	L645-L658 HydrophobicContact CD1-CD2 4.1Å; L645-L658 HydrophobicContact CD2-CB 4.39Å; L645-L658 HydrophobicContact CD2-CD2 3.59Å; L645-L658 HydrophobicContact CG-CD2 3.72Å; L645-A824 HydrophobicContact CD2-CB 3.94Å; L645-A827 HydrophobicContact CD1-CB 3.92Å; L645-G828 WeakPolarHBondContact CD1-O 3.34Å; L645-G829 PolarHBondContact N-O 2.86Å; L645-I832 HydrophobicContact CD1-CD1 3.8Å; L645-I832 HydrophobicContact CG-CD1 4.17Å
646	G	91.2	Very high	92.1	Very high	7 Å²	7	45.3 Å²	45.3	7%	0.072	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	109.7	-4.9	-172.8	0	0	0	0	0	114.6	P644 S655 F656	P644-G646 PolarHBondContact O-N 2.92Å; P644-G646 VanDerWaalsContact O-N 3.09Å; G646-S655 WeakPolarHBondContact O-CA 3.3Å; G646-F656 WeakPolarHBondContact O-CD1 3.37Å; G646-F656 PolarHBondContact O-N 3.23Å
647	F	93.8	Very high	92.1	Very high	57 Å²	57	50 Å²	50	25%	0.25	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	150.7	174.9	-60.5	-83.1	0	0	0	112.2	N627 C643 P644 C652 E654	N627-F647 HydrophobicContact CB-CD1 3.49Å; N627-F647 VanDerWaalsContact CB-CD1 3.49Å; N627-F647 HydrophobicContact CB-CD2 4.08Å; N627-F647 HydrophobicContact CB-CE1 3.55Å; N627-F647 HydrophobicContact CB-CE2 4.13Å; N627-F647 HydrophobicContact CB-CG 3.77Å; N627-F647 HydrophobicContact CB-CZ 3.87Å; N627-F647 VanDerWaalsContact CG-CD1 3.49Å; N627-F647 WeakPolarHBondContact ND2-CD1 3.46Å; C643-F647 HydrophobicContact CB-CB 4.43Å; C643-F647 WeakPolarHBondContact CB-O 3.34Å; P644-F647 HydrophobicContact CB-CD2 4.26Å; P644-F647 PolarHBondContact O-N 3.06Å; F647-C652 HydrophobicContact CB-CB 4.39Å; F647-E654 CarbonylContact C-O 3.56Å; F647-E654 VanDerWaalsContact CA-O 3.25Å; F647-E654 WeakPolarHBondContact CA-O 3.33Å
648	K	93.2	Very high	92.1	Very high	90 Å²	90	47 Å²	47	39%	0.391	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	179.6	178.6	68.9	-172.4	179.9	78.1	0	110.8	C652 E653 E654 F656	K648-C652 CarbonylContact O-C 3.29Å; K648-C652 WeakPolarHBondContact O-CA 3.48Å; K648-E653 PolarHBondContact O-N 2.83Å; K648-E654 WeakPolarHBondContact CE-OE2 3.23Å; K648-E654 HydrophobicContact CG-CB 3.93Å; K648-E654 PolarHBondContact N-O 2.86Å; K648-E654 IonicContact NZ-OE2 3.3Å; K648-E654 PolarHBondContact NZ-OE2 3.22Å; K648-E654 PolarHBondContact O-N 2.92Å; K648-F656 HydrophobicContact CB-CD1 4.25Å; K648-F656 HydrophobicContact CB-CE1 4.11Å; K648-F656 HydrophobicContact CD-CD1 3.72Å; K648-F656 HydrophobicContact CD-CE1 4.05Å; K648-F656 HydrophobicContact CD-CG 4.22Å; K648-F656 HydrophobicContact CG-CD1 3.9Å; K648-F656 HydrophobicContact CG-CE1 4.24Å
649	G	91	Very high	92	Very high	34 Å²	34	48 Å²	48	35%	0.351	27%	0.274	S	S	.	.	S	Bend	trans	106	170.7	-171.7	0	0	0	0	0	111.4	L651 C652 E653	G649-L651 VanDerWaalsContact C-N 3.26Å; G649-L651 PolarHBondContact O-N 2.85Å; G649-C652 PolarHBondContact O-N 2.74Å; G649-E653 VanDerWaalsContact C-OE2 3.31Å; G649-E653 WeakPolarHBondContact CA-OE1 3.4Å; G649-E653 WeakPolarHBondContact CA-OE2 3.32Å
650	A	91.6	Very high	92	Very high	71 Å²	71	43.4 Å²	43.4	59%	0.587	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-27.1	-175.5	0	0	0	0	0	112.5	E653	A650-E653 PolarHBondContact N-OE1 2.85Å; A650-E653 VanDerWaalsContact N-OE1 3.15Å; A650-E653 PolarHBondContact N-OE2 2.85Å; A650-E653 VanDerWaalsContact N-OE2 3.16Å
651	L	94.5	Very high	92.1	Very high	64 Å²	64	42.3 Å²	42.3	34%	0.335	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	20.5	177.6	-58.5	177	0	0	0	111.3	V623 A626 Y639 G649 E653	V623-L651 HydrophobicContact CG1-CD2 4.13Å; A626-L651 WeakPolarHBondContact CB-O 3.47Å; A626-L651 PolarHBondContact N-O 3.38Å; Y639-L651 HydrophobicContact CE2-CD2 4.01Å; G649-L651 VanDerWaalsContact C-N 3.26Å; G649-L651 PolarHBondContact O-N 2.85Å; L651-E653 VanDerWaalsContact CA-OE2 3.24Å; L651-E653 WeakPolarHBondContact CA-OE2 3.27Å; L651-E653 PolarHBondContact N-OE2 2.69Å; L651-E653 PolarHBondContact O-N 2.98Å
652	C	96	Very high	92.1	Very high	0 Å²	0	45 Å²	45	0%	0	27%	0.265	C	S	.	.	S	Bend	trans	61.7	26.1	-177.4	-43.3	0	0	0	0	115.1	N627 C641 C643 F647 K648 G649	N627-C652 PolarHBondContact ND2-O 3.13Å; C641-C652 WeakPolarHBondContact CB-SG 3.47Å; C643-C652 WeakPolarHBondContact CA-SG 3.41Å; C643-C652 HydrophobicContact CB-CB 3.65Å; C643-C652 WeakPolarHBondContact CB-SG 3.33Å; C643-C652 WeakPolarHBondContact SG-CA 3.46Å; C643-C652 WeakPolarHBondContact SG-CB 3.32Å; C643-C652 CovalentContact SG-SG 2.03Å; C643-C652 PolarHBondContact SG-SG 3.38Å; F647-C652 HydrophobicContact CB-CB 4.39Å; K648-C652 CarbonylContact O-C 3.29Å; K648-C652 WeakPolarHBondContact O-CA 3.48Å; G649-C652 PolarHBondContact O-N 2.74Å
653	E	95.6	Very high	92.2	Very high	101 Å²	101	43.8 Å²	43.8	47%	0.472	26%	0.259	S	S	.	.			trans	-72	-23.5	-172.9	66.1	-79	-171.3	0	0	114.5	K648 G649 A650 L651	K648-E653 PolarHBondContact O-N 2.83Å; G649-E653 VanDerWaalsContact C-OE2 3.31Å; G649-E653 WeakPolarHBondContact CA-OE1 3.4Å; G649-E653 WeakPolarHBondContact CA-OE2 3.32Å; A650-E653 PolarHBondContact N-OE1 2.85Å; A650-E653 VanDerWaalsContact N-OE1 3.15Å; A650-E653 PolarHBondContact N-OE2 2.85Å; A650-E653 VanDerWaalsContact N-OE2 3.16Å; L651-E653 VanDerWaalsContact CA-OE2 3.24Å; L651-E653 WeakPolarHBondContact CA-OE2 3.27Å; L651-E653 PolarHBondContact N-OE2 2.69Å; L651-E653 PolarHBondContact O-N 2.98Å
654	E	94.6	Very high	92.1	Very high	94 Å²	94	46.3 Å²	46.3	44%	0.439	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	128.6	-176.9	-57	-173.5	155.9	0	0	112.5	F647 K648	F647-E654 CarbonylContact C-O 3.56Å; F647-E654 VanDerWaalsContact CA-O 3.25Å; F647-E654 WeakPolarHBondContact CA-O 3.33Å; K648-E654 WeakPolarHBondContact CE-OE2 3.23Å; K648-E654 HydrophobicContact CG-CB 3.93Å; K648-E654 PolarHBondContact N-O 2.86Å; K648-E654 IonicContact NZ-OE2 3.3Å; K648-E654 PolarHBondContact NZ-OE2 3.22Å; K648-E654 PolarHBondContact O-N 2.92Å
655	S	92.6	Very high	91.9	Very high	94 Å²	94	47.9 Å²	47.9	66%	0.657	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	142.1	171.9	62	0	0	0	0	112.4	G646	G646-S655 WeakPolarHBondContact O-CA 3.3Å
656	F	89.7	Confident	91.6	Very high	37 Å²	37	51.7 Å²	51.7	16%	0.162	30%	0.3	C	S	.	.			trans	-149.2	158	176.6	77.2	-78.7	0	0	0	113.5	G646 K648 L658 I832 N834	G646-F656 WeakPolarHBondContact O-CD1 3.37Å; G646-F656 PolarHBondContact O-N 3.23Å; K648-F656 HydrophobicContact CB-CD1 4.25Å; K648-F656 HydrophobicContact CB-CE1 4.11Å; K648-F656 HydrophobicContact CD-CD1 3.72Å; K648-F656 HydrophobicContact CD-CE1 4.05Å; K648-F656 HydrophobicContact CD-CG 4.22Å; K648-F656 HydrophobicContact CG-CD1 3.9Å; K648-F656 HydrophobicContact CG-CE1 4.24Å; F656-L658 HydrophobicContact CE2-CB 4.07Å; F656-L658 HydrophobicContact CE2-CD1 3.78Å; F656-L658 HydrophobicContact CZ-CD1 4.09Å; F656-I832 WeakPolarHBondContact CZ-O 3.38Å; F656-N834 WeakPolarHBondContact CD2-ND2 3.34Å; F656-N834 HydrophobicContact CE2-CB 4.3Å
657	S	86.9	Confident	91.4	Very high	101 Å²	101	53.5 Å²	53.5	71%	0.706	31%	0.31	S	S	*	.			trans	-83.7	116	173.5	-58.5	0	0	0	0	111.2	S659 N834	S657-S659 PolarHBondContact O-N 3.46Å; S657-N834 PolarHBondContact O-ND2 3.22Å
658	L	87.3	Confident	91.1	Very high	10 Å²	10	53.2 Å²	53.2	5%	0.052	31%	0.309	C	S	.	.			trans	-78.6	117	177.1	-174.3	66.6	0	0	0	111.2	L645 F656 P661 I822 T823 I832 A833	L645-L658 HydrophobicContact CD1-CD2 4.1Å; L645-L658 HydrophobicContact CD2-CB 4.39Å; L645-L658 HydrophobicContact CD2-CD2 3.59Å; L645-L658 HydrophobicContact CG-CD2 3.72Å; F656-L658 HydrophobicContact CE2-CB 4.07Å; F656-L658 HydrophobicContact CE2-CD1 3.78Å; F656-L658 HydrophobicContact CZ-CD1 4.09Å; L658-P661 HydrophobicContact CD2-CG 4.28Å; L658-P661 HydrophobicContact CG-CG 4.4Å; L658-I822 VanDerWaalsContact CD2-O 3.32Å; L658-I822 WeakPolarHBondContact CD2-O 3.31Å; L658-T823 WeakPolarHBondContact O-CG2 3.44Å; L658-I832 HydrophobicContact CD1-CG2 3.85Å; L658-I832 HydrophobicContact CD2-CG2 3.83Å; L658-A833 VanDerWaalsContact CD1-O 3.3Å; L658-A833 WeakPolarHBondContact CD1-O 2.94Å
659	S	84.1	Confident	91.1	Very high	37 Å²	37	49 Å²	49	26%	0.259	29%	0.29	S	S	.	.	S	Bend	trans	-119.7	-28.7	-179.1	-65	0	0	0	0	113.8	S657 N834 C839	S657-S659 PolarHBondContact O-N 3.46Å; S659-N834 PolarHBondContact N-OD1 3.31Å; S659-C839 VanDerWaalsContact CB-O 3.29Å; S659-C839 WeakPolarHBondContact CB-O 3.48Å; S659-C839 PolarHBondContact OG-O 2.93Å
660	S	88.4	Confident	91.3	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.28	C	S	.	.	S	Bend	trans	-145.2	92.6	-178.8	-169.9	0	0	0	0	110.6	L662 N834 S835	S660-L662 PolarHBondContact O-N 3.21Å; S660-N834 PolarHBondContact N-OD1 2.84Å; S660-N834 CarbonylContact O-C 3.55Å; S660-N834 WeakPolarHBondContact O-CA 3.48Å; S660-S835 VanDerWaalsContact CB-OG 3.25Å; S660-S835 WeakPolarHBondContact CB-OG 3.39Å; S660-S835 PolarHBondContact O-N 3.48Å; S660-S835 PolarHBondContact O-OG 2.85Å; S660-S835 PolarHBondContact OG-OG 2.89Å
661	P	93.1	Very high	91.5	Very high	4 Å²	4	45.6 Å²	45.6	3%	0.026	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	115.1	-170.6	-26.6	34.8	0	0	0	115.5	L658 F663 I809 I810 I822 I832	L658-P661 HydrophobicContact CD2-CG 4.28Å; L658-P661 HydrophobicContact CG-CG 4.4Å; P661-F663 HydrophobicContact CB-CD2 4.45Å; P661-F663 HydrophobicContact CB-CE2 3.63Å; P661-F663 HydrophobicContact CB-CZ 4.15Å; P661-I809 WeakPolarHBondContact O-CA 3.27Å; P661-I809 VanDerWaalsContact O-CG2 3.23Å; P661-I809 WeakPolarHBondContact O-CG2 3.45Å; P661-I810 PolarHBondContact O-N 2.85Å; P661-I822 HydrophobicContact CB-CG2 4.47Å; P661-I822 HydrophobicContact CG-CB 3.94Å; P661-I822 HydrophobicContact CG-CG2 4.03Å; P661-I832 HydrophobicContact CB-CG2 3.85Å
662	L	94.6	Very high	91.5	Very high	59 Å²	59	44.2 Å²	44.2	31%	0.309	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	126.9	169.3	179.7	67.2	0	0	0	110	S660 I809 A833	S660-L662 PolarHBondContact O-N 3.21Å; L662-I809 HydrophobicContact CD1-CG1 4.05Å; L662-A833 HydrophobicContact CB-CB 4.28Å; L662-A833 HydrophobicContact CD2-CB 4.34Å; L662-A833 PolarHBondContact N-O 2.71Å; L662-A833 PolarHBondContact O-N 3.09Å
663	F	96.2	Very high	91.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	147.9	175.9	-61.5	-96.1	0	0	0	110	P661 S669 A671 L787 F806 T807 G808 I810 I832	P661-F663 HydrophobicContact CB-CD2 4.45Å; P661-F663 HydrophobicContact CB-CE2 3.63Å; P661-F663 HydrophobicContact CB-CZ 4.15Å; F663-S669 VanDerWaalsContact CA-OG 3.31Å; F663-S669 WeakPolarHBondContact CA-OG 3.48Å; F663-S669 WeakPolarHBondContact CB-OG 3.45Å; F663-A671 HydrophobicContact CE1-CB 4.07Å; F663-A671 HydrophobicContact CZ-CB 4.09Å; F663-L787 WeakPolarHBondContact CE1-O 3.34Å; F663-F806 HydrophobicContact CB-CD1 4.12Å; F663-F806 WeakPolarHBondContact CB-O 3.41Å; F663-T807 WeakPolarHBondContact O-CA 3.42Å; F663-G808 PolarHBondContact N-O 2.82Å; F663-G808 PolarHBondContact O-N 3.48Å; F663-I810 HydrophobicContact CD2-CB 4.3Å; F663-I810 HydrophobicContact CD2-CD1 4.08Å; F663-I810 HydrophobicContact CD2-CG1 3.89Å; F663-I810 HydrophobicContact CE2-CB 3.78Å; F663-I810 HydrophobicContact CE2-CD1 3.85Å; F663-I810 HydrophobicContact CE2-CG1 3.78Å; F663-I810 HydrophobicContact CZ-CD1 4.32Å; F663-I832 HydrophobicContact CD1-CG1 4.2Å; F663-I832 HydrophobicContact CE1-CD1 4.04Å; F663-I832 HydrophobicContact CE1-CG1 3.8Å; F663-I832 HydrophobicContact CZ-CD1 4.32Å; F663-I832 HydrophobicContact CZ-CG1 4.29Å
664	N	93.4	Very high	90.8	Very high	54 Å²	54	50 Å²	50	29%	0.289	26%	0.264	S	S	.	.			trans	-155.1	121.7	-175.2	172.6	2.1	0	0	0	110.3	T666 V667 S669	N664-T666 VanDerWaalsContact C-N 3.28Å; N664-T666 PolarHBondContact ND2-OG1 3.46Å; N664-T666 VanDerWaalsContact ND2-OG1 3.08Å; N664-T666 PolarHBondContact O-N 2.95Å; N664-T666 WeakPolarHBondContact OD1-CB 3.38Å; N664-T666 PolarHBondContact OD1-N 3.04Å; N664-T666 PolarHBondContact OD1-OG1 2.86Å; N664-V667 HydrophobicContact CB-CG2 3.83Å; N664-V667 WeakPolarHBondContact O-CG2 3.34Å; N664-V667 PolarHBondContact O-N 3.42Å; N664-S669 PolarHBondContact N-OG 3.16Å; N664-S669 PolarHBondContact O-N 3.38Å; N664-S669 PolarHBondContact O-OG 2.89Å
665	E	89.7	Confident	90.2	Very high	73 Å²	73	47.5 Å²	47.5	34%	0.341	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-62.2	-32.7	-177.6	69.4	-170.4	-168.1	0	0	113	V667 F668 K804 P805 T807	E665-V667 PolarHBondContact O-N 2.85Å; E665-F668 PolarHBondContact O-N 2.84Å; E665-F668 VanDerWaalsContact O-N 3.17Å; E665-K804 IonicContact OE2-NZ 2.74Å; E665-K804 PolarHBondContact OE2-NZ 3.3Å; E665-P805 HydrophobicContact CB-CB 3.89Å; E665-P805 HydrophobicContact CB-CG 3.94Å; E665-T807 WeakPolarHBondContact CB-OG1 3.17Å; E665-T807 VanDerWaalsContact CG-OG1 3.31Å; E665-T807 WeakPolarHBondContact CG-OG1 3.25Å; E665-T807 PolarHBondContact N-OG1 3.05Å
666	T	87	Confident	89	Confident	99 Å²	99	45 Å²	45	61%	0.607	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-66.7	-19.1	-178.4	64.7	0	0	0	0	114.1	N664	N664-T666 VanDerWaalsContact C-N 3.28Å; N664-T666 PolarHBondContact ND2-OG1 3.46Å; N664-T666 VanDerWaalsContact ND2-OG1 3.08Å; N664-T666 PolarHBondContact O-N 2.95Å; N664-T666 WeakPolarHBondContact OD1-CB 3.38Å; N664-T666 PolarHBondContact OD1-N 3.04Å; N664-T666 PolarHBondContact OD1-OG1 2.86Å
667	V	85.8	Confident	87.6	Confident	44 Å²	44	50 Å²	50	27%	0.267	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-113.5	11.4	178	-62.7	0	0	0	0	113.4	I640 N664 E665 S669 N831	I640-V667 VanDerWaalsContact CD1-CA 3.44Å; I640-V667 HydrophobicContact CD1-CB 3.55Å; I640-V667 HydrophobicContact CD1-CG1 3.77Å; N664-V667 HydrophobicContact CB-CG2 3.83Å; N664-V667 WeakPolarHBondContact O-CG2 3.34Å; N664-V667 PolarHBondContact O-N 3.42Å; E665-V667 PolarHBondContact O-N 2.85Å; V667-S669 VanDerWaalsContact C-N 3.33Å; V667-S669 PolarHBondContact O-N 2.76Å; V667-N831 HydrophobicContact CB-CB 4.19Å; V667-N831 HydrophobicContact CG2-CB 4.09Å; V667-N831 VanDerWaalsContact O-CB 3.27Å; V667-N831 WeakPolarHBondContact O-CB 3.08Å; V667-N831 PolarHBondContact O-ND2 2.82Å
668	F	87.7	Confident	85.7	Confident	52 Å²	52	50.6 Å²	50.6	23%	0.228	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	43.1	177.5	-150	-93.4	0	0	0	113.6	L642 E665 Y670 Y793	L642-F668 HydrophobicContact CD2-CB 4.47Å; E665-F668 PolarHBondContact O-N 2.84Å; E665-F668 VanDerWaalsContact O-N 3.17Å; F668-Y670 HydrophobicContact CD1-CD1 4.35Å; F668-Y670 HydrophobicContact CD1-CE1 4.29Å; F668-Y670 HydrophobicContact CE1-CE1 4.4Å; F668-Y793 HydrophobicContact CE1-CE2 4.4Å; F668-Y793 HydrophobicContact CE2-CD2 4.14Å; F668-Y793 AromaticContact CE2-CE2 3.85Å; F668-Y793 HydrophobicContact CE2-CE2 3.85Å; F668-Y793 AromaticContact CZ-CD2 3.86Å; F668-Y793 HydrophobicContact CZ-CD2 3.86Å; F668-Y793 AromaticContact CZ-CE2 3.63Å; F668-Y793 HydrophobicContact CZ-CE2 3.63Å
669	S	93.6	Very high	83.8	Confident	1 Å²	1	54 Å²	54	1%	0.007	28%	0.284	C	S	.	.			trans	-74	139.4	-176	67.1	0	0	0	0	113.4	F663 N664 V667 V830 N831	F663-S669 VanDerWaalsContact CA-OG 3.31Å; F663-S669 WeakPolarHBondContact CA-OG 3.48Å; F663-S669 WeakPolarHBondContact CB-OG 3.45Å; N664-S669 PolarHBondContact N-OG 3.16Å; N664-S669 PolarHBondContact O-N 3.38Å; N664-S669 PolarHBondContact O-OG 2.89Å; V667-S669 VanDerWaalsContact C-N 3.33Å; V667-S669 PolarHBondContact O-N 2.76Å; S669-V830 VanDerWaalsContact CA-O 3.23Å; S669-V830 WeakPolarHBondContact CA-O 3.43Å; S669-N831 VanDerWaalsContact CB-O 3.32Å; S669-N831 WeakPolarHBondContact CB-O 3.29Å
670	Y	95.7	Very high	81.6	Confident	33 Å²	33	60.5 Å²	60.5	13%	0.129	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	153.5	168	63	-89.1	0	0	0	112	F668 V672 Y786 L787 G789 P791 G829 V830 I832	F668-Y670 HydrophobicContact CD1-CD1 4.35Å; F668-Y670 HydrophobicContact CD1-CE1 4.29Å; F668-Y670 HydrophobicContact CE1-CE1 4.4Å; Y670-V672 HydrophobicContact CD2-CG2 3.69Å; Y670-V672 HydrophobicContact CE2-CG2 3.58Å; Y670-Y786 HydrophobicContact CD2-CD1 4.5Å; Y670-L787 WeakPolarHBondContact CA-O 3.44Å; Y670-G789 VanDerWaalsContact CB-C 3.44Å; Y670-G789 WeakPolarHBondContact CB-O 3.27Å; Y670-P791 HydrophobicContact CE1-CB 4.22Å; Y670-P791 HydrophobicContact CE2-CB 4.07Å; Y670-G829 CarbonylContact O-C 3.41Å; Y670-G829 WeakPolarHBondContact O-CA 3.21Å; Y670-V830 HydrophobicContact CD1-CB 4.04Å; Y670-V830 HydrophobicContact CE1-CB 3.63Å; Y670-V830 HydrophobicContact CE1-CG1 4.15Å; Y670-V830 HydrophobicContact CE1-CG2 3.81Å; Y670-V830 HydrophobicContact CE2-CG2 4.33Å; Y670-V830 PolarHBondContact N-O 2.86Å; Y670-V830 PolarHBondContact O-N 2.65Å; Y670-V830 WeakPolarHBondContact OH-CG2 3.37Å; Y670-I832 WeakPolarHBondContact O-CD1 3.41Å
671	A	95.6	Very high	79.5	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	154.8	171.1	0	0	0	0	0	110.9	F663 Y786 L787 I822 I832	F663-A671 HydrophobicContact CE1-CB 4.07Å; F663-A671 HydrophobicContact CZ-CB 4.09Å; A671-Y786 WeakPolarHBondContact O-CA 3.25Å; A671-L787 HydrophobicContact CB-CB 4.06Å; A671-L787 PolarHBondContact N-O 3.48Å; A671-L787 PolarHBondContact O-N 2.86Å; A671-I822 HydrophobicContact CB-CG2 3.82Å; A671-I832 HydrophobicContact CB-CD1 3.64Å
672	V	94.5	Very high	77.5	Confident	35 Å²	35	70.7 Å²	70.7	21%	0.212	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	112.7	179.4	-169.8	0	0	0	0	109.1	Y670 P784 Y786 G828	Y670-V672 HydrophobicContact CD2-CG2 3.69Å; Y670-V672 HydrophobicContact CE2-CG2 3.58Å; V672-P784 HydrophobicContact CG1-CB 3.65Å; V672-P784 HydrophobicContact CG1-CG 3.58Å; V672-Y786 HydrophobicContact CG1-CD1 4.38Å; V672-Y786 HydrophobicContact CG1-CE1 4.12Å; V672-Y786 HydrophobicContact CG2-CD1 3.95Å; V672-Y786 HydrophobicContact CG2-CE1 3.97Å; V672-G828 PolarHBondContact N-O 3.29Å; V672-G828 PolarHBondContact O-N 2.96Å
673	I	90.7	Very high	75.8	Confident	6 Å²	6	69.8 Å²	69.8	3%	0.031	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	132.3	-179.8	-51	-169.1	0	0	0	109.6	L785 L787 L813 M820 I822 A827	I673-L785 HydrophobicContact CB-CB 4.45Å; I673-L785 PolarHBondContact N-O 2.84Å; I673-L785 WeakPolarHBondContact O-CB 3.24Å; I673-L785 PolarHBondContact O-N 2.89Å; I673-L787 HydrophobicContact CD1-CD1 3.55Å; I673-L787 HydrophobicContact CG1-CD1 4.21Å; I673-L813 HydrophobicContact CD1-CD2 4.38Å; I673-M820 HydrophobicContact CG2-CE 3.73Å; I673-I822 HydrophobicContact CD1-CB 4.42Å; I673-I822 HydrophobicContact CD1-CG1 4Å; I673-I822 HydrophobicContact CD1-CG2 4.4Å; I673-A827 HydrophobicContact CD1-CB 4.4Å; I673-A827 HydrophobicContact CG1-CB 3.93Å
674	R	85.8	Confident	73.9	Confident	216 Å²	216	73.3 Å²	73.3	82%	0.815	38%	0.381	S	S	*	.			trans	-77	142.8	176.3	-65.8	-179.4	-179.6	164.2	1.1	110.4
675	W	81.4	Confident	72.5	Confident	43 Å²	43	74.5 Å²	74.5	16%	0.163	38%	0.384	C	S	.	.			trans	-56.9	143	175.2	-72.5	98.9	0	0	0	111.4	Q677 L683 M686 F688 S704 C781 S783 L785 L815	W675-Q677 PolarHBondContact O-N 2.92Å; W675-L683 HydrophobicContact CE3-CD1 4.46Å; W675-L683 HydrophobicContact CH2-CD1 4.18Å; W675-L683 HydrophobicContact CZ3-CD1 3.89Å; W675-M686 HydrophobicContact CH2-CE 4.41Å; W675-F688 HydrophobicContact CH2-CZ 4.05Å; W675-F688 HydrophobicContact CZ3-CZ 4.27Å; W675-S704 WeakPolarHBondContact CZ2-OG 3.23Å; W675-S704 PolarHBondContact NE1-OG 2.96Å; W675-C781 HydrophobicContact CZ2-CB 3.81Å; W675-S783 PolarHBondContact NE1-O 3.01Å; W675-L785 HydrophobicContact CH2-CD1 4.17Å; W675-L785 HydrophobicContact CZ2-CD1 4.02Å; W675-L815 HydrophobicContact CE3-CD2 3.78Å; W675-L815 HydrophobicContact CZ3-CD2 3.6Å
676	P	68.4	Low	71.6	Confident	41 Å²	41	71 Å²	71	27%	0.266	37%	0.368	S	S	.	.	S	Bend	trans	-72.4	0.1	-168.7	26.2	-33.5	0	0	0	115.7	L815 R818 M820	P676-L815 HydrophobicContact CG-CD2 3.92Å; P676-R818 PolarHBondContact O-NH1 3.43Å; P676-M820 HydrophobicContact CB-CE 4.26Å; P676-M820 HydrophobicContact CB-SD 4.28Å; P676-M820 HydrophobicContact CG-CE 4.28Å; P676-M820 HydrophobicContact CG-SD 4.38Å
677	Q	59.4	Low	71.2	Confident	143 Å²	143	69.3 Å²	69.3	67%	0.668	35%	0.352	S	S	*	.	S	Bend	trans	-138.3	163.6	174	-64.8	-168.1	3.9	0	0	110	W675 S679	W675-Q677 PolarHBondContact O-N 2.92Å; Q677-S679 PolarHBondContact O-N 2.82Å
678	S	48.1	Very low	71.2	Confident	112 Å²	112	67.2 Å²	67.2	78%	0.783	34%	0.34	S	S	*	.			trans	-58.9	118.8	169.2	49.7	0	0	0	0	110.5	Q680	S678-Q680 PolarHBondContact O-N 3.12Å
679	S	46.2	Very low	71.2	Confident	81 Å²	81	66 Å²	66	57%	0.566	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	113.6	-172.3	39.8	0	0	0	0	113	Q677	Q677-S679 PolarHBondContact O-N 2.82Å
680	Q	39.4	Very low	71.3	Confident	174 Å²	174	66.2 Å²	66.2	81%	0.813	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-179.1	-12.5	164.2	-109.8	170.1	21.7	0	0	112.1	S678 Y682	S678-Q680 PolarHBondContact O-N 3.12Å; Q680-Y682 PolarHBondContact O-N 3.34Å
681	S	43.3	Very low	71.3	Confident	75 Å²	75	64.8 Å²	64.8	52%	0.524	33%	0.331	S	S	.	.			trans	-69.1	94.1	174.5	-59.2	0	0	0	0	111.7	L683	S681-L683 PolarHBondContact O-N 3.12Å
682	Y	51.5	Low	71.3	Confident	144 Å²	144	64.8 Å²	64.8	57%	0.565	33%	0.331	S	S	*	.			trans	-40.1	111	164.5	-66.3	-77.4	0	0	0	111.7	Q680 S684 Q778	Q680-Y682 PolarHBondContact O-N 3.34Å; Y682-S684 PolarHBondContact O-N 3.28Å; Y682-Q778 VanDerWaalsContact CB-CD 3.49Å; Y682-Q778 HydrophobicContact CD1-CB 3.95Å; Y682-Q778 HydrophobicContact CD1-CG 4.49Å; Y682-Q778 HydrophobicContact CG-CB 4.25Å; Y682-Q778 HydrophobicContact CG-CG 4.34Å
683	L	57.7	Low	71.4	Confident	40 Å²	40	65.9 Å²	65.9	21%	0.209	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-79.2	100.8	-171.7	-63.8	176.3	0	0	0	110	W675 S681 M686 R753 I779	W675-L683 HydrophobicContact CE3-CD1 4.46Å; W675-L683 HydrophobicContact CH2-CD1 4.18Å; W675-L683 HydrophobicContact CZ3-CD1 3.89Å; S681-L683 PolarHBondContact O-N 3.12Å; L683-M686 HydrophobicContact CB-CE 4.04Å; L683-M686 HydrophobicContact CD1-CE 3.38Å; L683-M686 HydrophobicContact CG-CE 4.35Å; L683-R753 PolarHBondContact O-NH1 3.23Å; L683-R753 PolarHBondContact O-NH2 2.98Å; L683-I779 HydrophobicContact CB-CG2 3.94Å; L683-I779 PolarHBondContact N-O 2.83Å
684	S	56.9	Low	71.7	Confident	74 Å²	74	65.6 Å²	65.6	52%	0.517	33%	0.33	S	S	.	.	S	Bend	trans	-82.4	-17.8	170.2	58.4	0	0	0	0	113.2	Y682 A755	Y682-S684 PolarHBondContact O-N 3.28Å; S684-A755 PolarHBondContact O-N 3.17Å
685	F	64.1	Low	72.2	Confident	79 Å²	79	57.7 Å²	57.7	35%	0.346	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	141	170.9	178.2	-98.1	0	0	0	110.3	E687 R753 T754	F685-E687 HydrophobicContact CE1-CB 4.02Å; F685-E687 HydrophobicContact CZ-CB 3.76Å; F685-R753 CarbonylContact C-O 3.53Å; F685-R753 VanDerWaalsContact CA-O 3.32Å; F685-R753 WeakPolarHBondContact CA-O 3.15Å; F685-T754 WeakPolarHBondContact CD2-OG1 3.39Å
686	M	70.1	Confident	73	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	148.2	167.1	51.6	175	43.5	0	0	109.8	W675 L683 F688 L713 S752 R753 I779 N816	W675-M686 HydrophobicContact CH2-CE 4.41Å; L683-M686 HydrophobicContact CB-CE 4.04Å; L683-M686 HydrophobicContact CD1-CE 3.38Å; L683-M686 HydrophobicContact CG-CE 4.35Å; M686-F688 HydrophobicContact CB-CE2 4.35Å; M686-F688 HydrophobicContact SD-CE2 4.02Å; M686-L713 HydrophobicContact CE-CD1 4.2Å; M686-L713 HydrophobicContact CE-CD2 4.13Å; M686-L713 HydrophobicContact SD-CD1 3.4Å; M686-L713 WeakPolarHBondContact SD-CD1 3.06Å; M686-L713 HydrophobicContact SD-CD2 4Å; M686-L713 HydrophobicContact SD-CG 4.35Å; M686-S752 CarbonylContact O-C 3.55Å; M686-S752 VanDerWaalsContact O-CA 3.26Å; M686-S752 WeakPolarHBondContact O-CA 3.26Å; M686-R753 HydrophobicContact CG-CB 3.81Å; M686-R753 PolarHBondContact N-O 2.04Å; M686-R753 PolarHBondContact O-N 2.66Å; M686-R753 HydrophobicContact SD-CB 4.25Å; M686-R753 PolarHBondContact SD-NE 3.08Å; M686-R753 VanDerWaalsContact SD-NE 3.45Å; M686-R753 PolarHBondContact SD-NH2 2.77Å; M686-I779 HydrophobicContact CE-CG2 4Å; M686-N816 VanDerWaalsContact CA-OD1 3.31Å; M686-N816 WeakPolarHBondContact CA-OD1 3.42Å
687	E	78.6	Confident	74.3	Confident	62 Å²	62	57 Å²	57	29%	0.29	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	130.2	172.8	178.5	171.4	-132.9	0	0	109.1	F685 V751 L815 N816	F685-E687 HydrophobicContact CE1-CB 4.02Å; F685-E687 HydrophobicContact CZ-CB 3.76Å; E687-V751 CarbonylContact C-O 3.57Å; E687-V751 WeakPolarHBondContact CA-O 3.37Å; E687-L815 CarbonylContact O-C 3.58Å; E687-L815 WeakPolarHBondContact O-CA 3.43Å; E687-N816 PolarHBondContact N-OD1 2.97Å; E687-N816 PolarHBondContact O-N 3.4Å
688	F	87.4	Confident	76	Confident	1 Å²	1	51.3 Å²	51.3	0%	0.004	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	135.1	173.5	-60.7	-93.3	0	0	0	110.1	W675 M686 V690 L702 L713 R750 V751 L785 L813 I814 L815	W675-F688 HydrophobicContact CH2-CZ 4.05Å; W675-F688 HydrophobicContact CZ3-CZ 4.27Å; M686-F688 HydrophobicContact CB-CE2 4.35Å; M686-F688 HydrophobicContact SD-CE2 4.02Å; F688-V690 HydrophobicContact CB-CG2 4.48Å; F688-L702 HydrophobicContact CD1-CD1 3.77Å; F688-L702 HydrophobicContact CE1-CD1 3.78Å; F688-L702 HydrophobicContact CG-CD1 4.33Å; F688-L702 HydrophobicContact CZ-CD1 4.37Å; F688-L713 HydrophobicContact CE2-CD2 3.5Å; F688-L713 VanDerWaalsContact CE2-CD2 3.5Å; F688-L713 HydrophobicContact CZ-CD2 3.65Å; F688-R750 WeakPolarHBondContact O-CA 3.26Å; F688-V751 HydrophobicContact CB-CG2 3.83Å; F688-V751 HydrophobicContact CD2-CG2 4.13Å; F688-V751 HydrophobicContact CG-CG2 4.43Å; F688-V751 PolarHBondContact N-O 3.03Å; F688-V751 PolarHBondContact O-N 2.81Å; F688-L785 HydrophobicContact CE1-CD1 4.25Å; F688-L785 HydrophobicContact CE1-CD2 3.99Å; F688-L785 HydrophobicContact CZ-CD1 4.38Å; F688-L813 HydrophobicContact CD1-CD1 4.03Å; F688-I814 VanDerWaalsContact CA-O 3.25Å; F688-I814 WeakPolarHBondContact CA-O 3.37Å; F688-L815 HydrophobicContact CD1-CB 4.1Å; F688-L815 HydrophobicContact CD1-CD1 4.07Å; F688-L815 HydrophobicContact CE1-CB 4.1Å; F688-L815 HydrophobicContact CE1-CD1 3.72Å; F688-L815 HydrophobicContact CE1-CD2 4.13Å; F688-L815 HydrophobicContact CE1-CG 4.18Å; F688-L815 HydrophobicContact CE2-CD1 4.19Å; F688-L815 HydrophobicContact CG-CD1 4.5Å; F688-L815 HydrophobicContact CZ-CD1 3.79Å
689	E	87.6	Confident	78.3	Confident	26 Å²	26	46.2 Å²	46.2	12%	0.121	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.7	168.1	-169.7	-166.4	110.9	0	0	107.9	E748 L749 R750 K812 L813 I814	E689-E748 HydrophobicContact CG-CG 4.46Å; E689-L749 CarbonylContact C-O 3.58Å; E689-L749 WeakPolarHBondContact CA-O 3.18Å; E689-R750 HydrophobicContact CG-CG 4.19Å; E689-R750 IonicContact OE1-NH2 3.15Å; E689-R750 IonicContact OE2-CZ 3.32Å; E689-R750 IonicContact OE2-NH1 3.05Å; E689-R750 PolarHBondContact OE2-NH1 3.27Å; E689-R750 IonicContact OE2-NH2 3.2Å; E689-R750 PolarHBondContact OE2-NH2 2.89Å; E689-K812 WeakPolarHBondContact OE1-CE 3.16Å; E689-K812 IonicContact OE1-NZ 2.6Å; E689-K812 PolarHBondContact OE1-NZ 3.26Å; E689-L813 CarbonylContact O-C 3.54Å; E689-L813 WeakPolarHBondContact O-CA 3.46Å; E689-I814 HydrophobicContact CB-CB 4.13Å; E689-I814 PolarHBondContact N-O 2.89Å; E689-I814 PolarHBondContact O-N 2.72Å
690	V	95.4	Very high	80.7	Confident	6 Å²	6	42.4 Å²	42.4	4%	0.036	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.3	-174	-166.7	0	0	0	0	109.3	F688 F692 L749 I810 K812 L813	F688-V690 HydrophobicContact CB-CG2 4.48Å; V690-F692 HydrophobicContact CG1-CB 4.47Å; V690-F692 HydrophobicContact CG1-CD1 4.48Å; V690-L749 HydrophobicContact CB-CB 4.26Å; V690-L749 HydrophobicContact CG2-CD2 4.36Å; V690-L749 PolarHBondContact N-O 2.74Å; V690-L749 PolarHBondContact O-N 3.41Å; V690-I810 HydrophobicContact CG1-CG2 3.91Å; V690-K812 WeakPolarHBondContact CA-O 3.29Å; V690-L813 HydrophobicContact CG2-CD1 3.83Å
691	T	94.6	Very high	83.5	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.012	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	119	171.2	-48.6	0	0	0	0	109	W746 H747 Q811 K812	T691-W746 HydrophobicContact CG2-CE3 3.9Å; T691-W746 HydrophobicContact CG2-CZ3 4.35Å; T691-H747 WeakPolarHBondContact CA-O 3.41Å; T691-Q811 PolarHBondContact O-N 2.92Å; T691-K812 PolarHBondContact N-O 3.08Å; T691-K812 PolarHBondContact O-N 2.78Å; T691-K812 VanDerWaalsContact OG1-CD 3.25Å; T691-K812 WeakPolarHBondContact OG1-CD 3.46Å
692	F	96.6	Very high	86.1	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	163.2	-169	73.5	-75.5	0	0	0	112.3	V690 P694 L701 L722 I741 H747 L749 F806 I809 I810	V690-F692 HydrophobicContact CG1-CB 4.47Å; V690-F692 HydrophobicContact CG1-CD1 4.48Å; F692-P694 HydrophobicContact CD2-CB 4.36Å; F692-P694 HydrophobicContact CD2-CG 4.39Å; F692-P694 HydrophobicContact CE2-CB 4.13Å; F692-P694 HydrophobicContact CE2-CG 3.96Å; F692-L701 HydrophobicContact CB-CD2 4.34Å; F692-L701 HydrophobicContact CD1-CD1 4.47Å; F692-L701 HydrophobicContact CD2-CD1 4.22Å; F692-L701 HydrophobicContact CD2-CD2 3.99Å; F692-L701 HydrophobicContact CE1-CD1 4.43Å; F692-L701 HydrophobicContact CE2-CD1 4.17Å; F692-L701 HydrophobicContact CG-CD1 4.39Å; F692-L701 HydrophobicContact CG-CD2 4.18Å; F692-L701 HydrophobicContact CZ-CD1 4.3Å; F692-L722 HydrophobicContact CE1-CD1 4.11Å; F692-L722 HydrophobicContact CZ-CD1 3.82Å; F692-L722 HydrophobicContact CZ-CD2 4.19Å; F692-L722 HydrophobicContact CZ-CG 4.41Å; F692-I741 HydrophobicContact CE2-CD1 3.64Å; F692-I741 HydrophobicContact CZ-CD1 3.62Å; F692-H747 HydrophobicContact CD1-CB 4.14Å; F692-H747 HydrophobicContact CE1-CB 3.51Å; F692-H747 HydrophobicContact CE2-CB 4.24Å; F692-H747 HydrophobicContact CZ-CB 3.55Å; F692-H747 PolarHBondContact N-O 3.05Å; F692-H747 PolarHBondContact O-N 2.78Å; F692-L749 HydrophobicContact CE1-CB 4.02Å; F692-F806 HydrophobicContact CD2-CE2 4.11Å; F692-F806 AromaticContact CD2-CZ 3.97Å; F692-F806 HydrophobicContact CD2-CZ 3.97Å; F692-I809 CarbonylContact C-O 3.54Å; F692-I809 WeakPolarHBondContact CA-O 3.37Å; F692-I809 WeakPolarHBondContact CB-O 3.33Å; F692-I810 HydrophobicContact CB-CG1 4.4Å
693	W	96.4	Very high	88.2	Confident	58 Å²	58	24.2 Å²	24.2	22%	0.22	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	107.5	178.8	177.3	-69.5	0	0	0	108.1	D744 S745 W746 F806 G808 I809	W693-D744 VanDerWaalsContact CE2-C 3.44Å; W693-D744 WeakPolarHBondContact CH2-O 3.33Å; W693-D744 HydrophobicContact CZ2-CB 3.98Å; W693-D744 WeakPolarHBondContact CZ2-O 3.35Å; W693-D744 PolarHBondContact NE1-OD1 2.94Å; W693-D744 VanDerWaalsContact NE1-OD1 3.09Å; W693-S745 VanDerWaalsContact CE3-C 3.4Å; W693-W746 HydrophobicContact CB-CD2 4.39Å; W693-W746 HydrophobicContact CB-CE3 4.07Å; W693-W746 HydrophobicContact CB-CH2 4.27Å; W693-W746 HydrophobicContact CB-CZ3 4.01Å; W693-W746 HydrophobicContact CE3-CB 4.44Å; W693-W746 AromaticContact CE3-CD1 3.54Å; W693-W746 AromaticContact CE3-CD2 3.82Å; W693-W746 HydrophobicContact CE3-CD2 3.82Å; W693-W746 AromaticContact CE3-CE2 3.66Å; W693-W746 AromaticContact CE3-CG 3.73Å; W693-W746 HydrophobicContact CE3-CG 3.73Å; W693-W746 HydrophobicContact CE3-CZ2 4.33Å; W693-W746 AromaticContact CE3-NE1 3.47Å; W693-W746 AromaticContact CZ3-CD1 3.56Å; W693-W746 HydrophobicContact CZ3-CG 4.16Å; W693-W746 AromaticContact CZ3-NE1 3.61Å; W693-F806 WeakPolarHBondContact O-CZ 3.29Å; W693-G808 CarbonylContact O-C 3.55Å; W693-G808 WeakPolarHBondContact O-CA 3.34Å; W693-I809 HydrophobicContact CB-CB 3.98Å; W693-I809 HydrophobicContact CB-CD1 4.13Å; W693-I809 HydrophobicContact CB-CG1 4.11Å; W693-I809 HydrophobicContact CG-CD1 4.15Å; W693-I809 HydrophobicContact CG-CG1 4.39Å; W693-I809 PolarHBondContact N-O 3.48Å; W693-I809 PolarHBondContact O-N 3.25Å
694	P	97.1	Very high	90	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	127.1	-176.8	33.7	-32.3	0	0	0	111.8	F692 L717 I741 N742 L743 D744 S745 F806	F692-P694 HydrophobicContact CD2-CB 4.36Å; F692-P694 HydrophobicContact CD2-CG 4.39Å; F692-P694 HydrophobicContact CE2-CB 4.13Å; F692-P694 HydrophobicContact CE2-CG 3.96Å; P694-L717 HydrophobicContact CB-CD2 3.82Å; P694-I741 HydrophobicContact CB-CD1 4.45Å; P694-I741 HydrophobicContact CG-CD1 3.81Å; P694-I741 HydrophobicContact CG-CG1 4.46Å; P694-N742 WeakPolarHBondContact CG-O 3.4Å; P694-L743 HydrophobicContact CB-CD2 3.93Å; P694-L743 HydrophobicContact CG-CD2 4.07Å; P694-L743 WeakPolarHBondContact O-CA 3.44Å; P694-D744 PolarHBondContact O-N 2.83Å; P694-S745 WeakPolarHBondContact CD-O 3.43Å; P694-F806 HydrophobicContact CB-CE2 3.89Å; P694-F806 HydrophobicContact CB-CZ 4.35Å
695	S	97	Very high	91.7	Very high	51 Å²	51	19.3 Å²	19.3	36%	0.357	10%	0.104	S	C	.	.	S	Bend	trans	-111.6	5.1	173.6	-56.6	0	0	0	0	112.9	D744 T807	S695-D744 WeakPolarHBondContact CB-OD1 3.48Å; S695-D744 PolarHBondContact OG-OD1 2.81Å; S695-T807 PolarHBondContact N-O 3.48Å
696	A	96.8	Very high	92.9	Very high	9 Å²	9	16.5 Å²	16.5	7%	0.074	9%	0.093	C	C	.	.	S	Bend	trans	-133.2	148.5	171.2	0	0	0	0	0	110.5	S698 L717 L743 T807	A696-S698 PolarHBondContact O-N 2.81Å; A696-L717 WeakPolarHBondContact O-CD2 3.27Å; A696-L743 WeakPolarHBondContact O-CD2 3.45Å; A696-T807 PolarHBondContact N-O 3.41Å
697	P	96.1	Very high	93.5	Very high	60 Å²	60	20.7 Å²	20.7	39%	0.39	13%	0.127	S	C	.	.	S	Bend	trans	-72.6	-8.8	-174.9	29.7	-36.7	0	0	0	114.9	D719 R720 L743	P697-D719 CarbonylContact O-C 3.43Å; P697-D719 WeakPolarHBondContact O-CA 3.48Å; P697-D719 PolarHBondContact O-N 3.22Å; P697-D719 VanDerWaalsContact O-N 3.09Å; P697-R720 HydrophobicContact CB-CG 3.97Å; P697-R720 PolarHBondContact O-N 3.13Å; P697-L743 HydrophobicContact CB-CD1 4.31Å
698	S	95.8	Very high	93.7	Very high	24 Å²	24	21.4 Å²	21.4	17%	0.168	15%	0.151	C	C	.	.			trans	-159.2	152.6	178.7	44.2	0	0	0	0	112.4	A696 L717 K804	A696-S698 PolarHBondContact O-N 2.81Å; S698-L717 CarbonylContact C-O 3.6Å; S698-L717 WeakPolarHBondContact CA-O 3.5Å; S698-L717 WeakPolarHBondContact CB-O 3.35Å; S698-K804 WeakPolarHBondContact O-CE 3.02Å; S698-K804 PolarHBondContact O-NZ 2.05Å; S698-K804 VanDerWaalsContact OG-CE 3.28Å; S698-K804 WeakPolarHBondContact OG-CE 3.3Å
699	G	95.7	Very high	93.5	Very high	5 Å²	5	23.2 Å²	23.2	5%	0.052	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	155.5	158.9	-177.2	0	0	0	0	0	113.2	L717 P805	G699-L717 PolarHBondContact N-O 3.09Å; G699-L717 PolarHBondContact O-N 2.78Å; G699-P805 VanDerWaalsContact CA-O 3.23Å; G699-P805 WeakPolarHBondContact CA-O 3.07Å
700	V	97.5	Very high	93.4	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	122.2	-179.2	64.2	0	0	0	0	112.6	G788 Y793 V802 K804 F806	V700-G788 CarbonylContact O-C 3.59Å; V700-G788 VanDerWaalsContact O-C 3.27Å; V700-G788 VanDerWaalsContact O-CA 3.26Å; V700-G788 WeakPolarHBondContact O-CA 3.42Å; V700-Y793 HydrophobicContact CG1-CE1 4.28Å; V700-V802 HydrophobicContact CB-CG1 3.96Å; V700-V802 HydrophobicContact CB-CG2 4.44Å; V700-V802 HydrophobicContact CG1-CG1 3.93Å; V700-V802 HydrophobicContact CG2-CG1 3.99Å; V700-V802 HydrophobicContact CG2-CG2 3.87Å; V700-K804 PolarHBondContact N-O 2.82Å; V700-K804 VanDerWaalsContact N-O 3.07Å; V700-F806 WeakPolarHBondContact O-CB 3.46Å
701	L	97.4	Very high	93.1	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.016	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	-40.6	172.7	-76.7	172.3	0	0	0	111.6	F692 I715 L722 L787 G788 F806 I810	F692-L701 HydrophobicContact CB-CD2 4.34Å; F692-L701 HydrophobicContact CD1-CD1 4.47Å; F692-L701 HydrophobicContact CD2-CD1 4.22Å; F692-L701 HydrophobicContact CD2-CD2 3.99Å; F692-L701 HydrophobicContact CE1-CD1 4.43Å; F692-L701 HydrophobicContact CE2-CD1 4.17Å; F692-L701 HydrophobicContact CG-CD1 4.39Å; F692-L701 HydrophobicContact CG-CD2 4.18Å; F692-L701 HydrophobicContact CZ-CD1 4.3Å; L701-I715 HydrophobicContact CB-CB 4.31Å; L701-I715 HydrophobicContact CB-CG2 4.11Å; L701-I715 HydrophobicContact CD1-CG2 4.05Å; L701-I715 PolarHBondContact N-O 3.36Å; L701-L722 HydrophobicContact CD1-CD2 3.66Å; L701-L787 WeakPolarHBondContact O-CA 3.41Å; L701-G788 PolarHBondContact O-N 2.77Å; L701-F806 HydrophobicContact CD2-CD1 4.03Å; L701-F806 HydrophobicContact CD2-CD2 3.63Å; L701-F806 HydrophobicContact CD2-CE1 3.97Å; L701-F806 HydrophobicContact CD2-CE2 3.57Å; L701-F806 HydrophobicContact CD2-CG 3.86Å; L701-F806 HydrophobicContact CD2-CZ 3.75Å; L701-F806 HydrophobicContact CG-CD2 4.27Å; L701-F806 HydrophobicContact CG-CE2 4.46Å; L701-I810 HydrophobicContact CD2-CD1 3.93Å; L701-I810 HydrophobicContact CD2-CG1 4.24Å
702	L	97.1	Very high	93	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	137.4	-173.9	179.5	155.5	0	0	0	110.9	F688 L713 A714 I715 L785 Y786 L787 L813	F688-L702 HydrophobicContact CD1-CD1 3.77Å; F688-L702 HydrophobicContact CE1-CD1 3.78Å; F688-L702 HydrophobicContact CG-CD1 4.33Å; F688-L702 HydrophobicContact CZ-CD1 4.37Å; L702-L713 HydrophobicContact CD2-CD2 3.89Å; L702-L713 HydrophobicContact CD2-CG 4.48Å; L702-A714 CarbonylContact O-C 3.55Å; L702-A714 WeakPolarHBondContact O-CA 3.04Å; L702-I715 HydrophobicContact CB-CB 4.07Å; L702-I715 HydrophobicContact CB-CD1 4.02Å; L702-I715 HydrophobicContact CB-CG1 4.15Å; L702-I715 HydrophobicContact CD1-CD1 4.01Å; L702-I715 HydrophobicContact CD2-CD1 4.27Å; L702-I715 HydrophobicContact CD2-CG1 4.23Å; L702-I715 HydrophobicContact CG-CD1 4.35Å; L702-I715 PolarHBondContact N-O 2.77Å; L702-I715 PolarHBondContact O-N 3.13Å; L702-L785 HydrophobicContact CD1-CD1 3.96Å; L702-L785 HydrophobicContact CD1-CD2 4.17Å; L702-L785 HydrophobicContact CD1-CG 4.29Å; L702-L785 HydrophobicContact CD2-CD1 3.72Å; L702-L785 HydrophobicContact CG-CD1 3.73Å; L702-L785 HydrophobicContact CG-CG 4.22Å; L702-Y786 CarbonylContact C-O 3.57Å; L702-Y786 VanDerWaalsContact CA-O 3.31Å; L702-Y786 WeakPolarHBondContact CA-O 3.49Å; L702-L787 HydrophobicContact CB-CD2 3.89Å; L702-L787 HydrophobicContact CD1-CD2 3.84Å; L702-L787 HydrophobicContact CG-CD2 3.85Å; L702-L813 HydrophobicContact CD1-CD1 4.31Å
703	Y	97.3	Very high	92.9	Very high	5 Å²	5	29.6 Å²	29.6	2%	0.02	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	143.6	173.3	179.4	-107.9	0	0	0	112.7	D705 F712 L713 A714 Y786 V790 T796 K797 A800 V802	Y703-D705 HydrophobicContact CE1-CB 4.21Å; Y703-D705 HydrophobicContact CE2-CB 4.46Å; Y703-D705 WeakPolarHBondContact OH-CB 3.26Å; Y703-D705 PolarHBondContact OH-OD2 3.45Å; Y703-F712 HydrophobicContact CE2-CB 4.3Å; Y703-L713 CarbonylContact C-O 3.58Å; Y703-L713 WeakPolarHBondContact CA-O 3.04Å; Y703-A714 HydrophobicContact CD2-CB 4.1Å; Y703-Y786 HydrophobicContact CD1-CD2 4.02Å; Y703-Y786 PolarHBondContact N-O 2.87Å; Y703-Y786 PolarHBondContact O-N 2.7Å; Y703-V790 HydrophobicContact CD1-CG1 3.67Å; Y703-V790 HydrophobicContact CG-CG1 4.07Å; Y703-T796 HydrophobicContact CD1-CG2 4.25Å; Y703-T796 HydrophobicContact CE1-CG2 3.83Å; Y703-T796 WeakPolarHBondContact OH-CA 3.44Å; Y703-K797 PolarHBondContact OH-N 3.43Å; Y703-A800 HydrophobicContact CD2-CB 4.34Å; Y703-A800 HydrophobicContact CE2-CB 3.75Å; Y703-V802 HydrophobicContact CD2-CG2 3.57Å; Y703-V802 HydrophobicContact CE2-CG2 4.13Å; Y703-V802 HydrophobicContact CG-CG2 4.08Å
704	S	94.2	Very high	92.9	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	138.9	166.4	-175.3	0	0	0	0	111.4	W675 F712 L713 C781 S783 P784	W675-S704 WeakPolarHBondContact CZ2-OG 3.23Å; W675-S704 PolarHBondContact NE1-OG 2.96Å; S704-F712 CarbonylContact O-C 3.51Å; S704-L713 PolarHBondContact N-O 3.42Å; S704-L713 PolarHBondContact O-N 2.79Å; S704-C781 WeakPolarHBondContact OG-CB 3.42Å; S704-S783 PolarHBondContact OG-O 3.07Å; S704-P784 PolarHBondContact OG-O 2.84Å
705	D	92.8	Very high	93	Very high	12 Å²	12	26.9 Å²	26.9	6%	0.064	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	-178.1	-177.8	64.2	-12.5	0	0	0	113.5	Y703 D711 F712 C781 S782 S783 K797	Y703-D705 HydrophobicContact CE1-CB 4.21Å; Y703-D705 HydrophobicContact CE2-CB 4.46Å; Y703-D705 WeakPolarHBondContact OH-CB 3.26Å; Y703-D705 PolarHBondContact OH-OD2 3.45Å; D705-D711 WeakPolarHBondContact CA-O 3.4Å; D705-D711 WeakPolarHBondContact CB-O 3.47Å; D705-F712 HydrophobicContact CB-CB 3.83Å; D705-C781 CarbonylContact O-C 3.13Å; D705-C781 WeakPolarHBondContact O-CA 3.23Å; D705-S782 PolarHBondContact O-N 2.77Å; D705-S783 VanDerWaalsContact O-CB 3.26Å; D705-S783 WeakPolarHBondContact O-CB 3.25Å; D705-S783 PolarHBondContact O-N 3.17Å; D705-S783 PolarHBondContact O-OG 2.83Å; D705-S783 WeakPolarHBondContact OD1-CB 3.36Å; D705-S783 PolarHBondContact OD1-OG 2.82Å; D705-K797 HydrophobicContact CB-CG 4.39Å; D705-K797 WeakPolarHBondContact OD2-CE 3.13Å
706	D	88.9	Confident	93	Very high	20 Å²	20	24.5 Å²	24.5	11%	0.107	16%	0.16	C	C	.	.			trans	-115.2	132.5	161.2	-177.9	90.9	0	0	0	110.5	G708 S709 D711 N780 S782 K797	D706-G708 VanDerWaalsContact C-N 3.33Å; D706-G708 PolarHBondContact O-N 2.81Å; D706-G708 WeakPolarHBondContact OD2-CA 3.24Å; D706-G708 PolarHBondContact OD2-N 3.44Å; D706-S709 PolarHBondContact OD2-N 3.01Å; D706-D711 PolarHBondContact N-O 2.83Å; D706-D711 VanDerWaalsContact N-O 3.12Å; D706-N780 WeakPolarHBondContact CB-O 3.48Å; D706-N780 PolarHBondContact OD1-ND2 2.84Å; D706-S782 WeakPolarHBondContact OD1-CB 3.24Å; D706-S782 PolarHBondContact OD1-OG 2.97Å; D706-K797 VanDerWaalsContact O-CE 3.29Å; D706-K797 WeakPolarHBondContact O-CE 3.31Å; D706-K797 PolarHBondContact O-NZ 2.71Å
707	A	83.6	Confident	93.1	Very high	88 Å²	88	24.2 Å²	24.2	73%	0.727	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-28.3	-176.8	0	0	0	0	0	113.8
708	G	81.8	Confident	93.1	Very high	76 Å²	76	23.1 Å²	23.1	78%	0.784	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-9.4	-175.8	0	0	0	0	0	115.2	D706	D706-G708 VanDerWaalsContact C-N 3.33Å; D706-G708 PolarHBondContact O-N 2.81Å; D706-G708 WeakPolarHBondContact OD2-CA 3.24Å; D706-G708 PolarHBondContact OD2-N 3.44Å
709	S	84.8	Confident	93	Very high	40 Å²	40	26.8 Å²	26.8	28%	0.28	17%	0.167	S	C	.	.	S	Bend	trans	-124.4	-171	176.1	81.5	0	0	0	0	113.1	D706 D711 K797	D706-S709 PolarHBondContact OD2-N 3.01Å; S709-D711 VanDerWaalsContact C-N 3.35Å; S709-D711 WeakPolarHBondContact CB-OD1 3.49Å; S709-D711 VanDerWaalsContact OG-CB 3.28Å; S709-D711 WeakPolarHBondContact OG-CB 3.45Å; S709-D711 PolarHBondContact OG-N 3.22Å; S709-D711 VanDerWaalsContact OG-N 3.12Å; S709-D711 PolarHBondContact OG-OD1 3.04Å; S709-K797 PolarHBondContact O-NZ 3.22Å
710	R	84.1	Confident	93.1	Very high	153 Å²	153	31.7 Å²	31.7	58%	0.577	18%	0.184	S	C	*	.	S	Bend	trans	-88.6	-4.4	172.8	-68.2	177.4	56.6	131.8	1.6	113	F712 D727	R710-F712 WeakPolarHBondContact O-CD1 3.48Å; R710-D727 IonicContact CZ-OD2 3.8Å; R710-D727 IonicContact NE-OD2 2.71Å; R710-D727 PolarHBondContact NE-OD2 2.98Å; R710-D727 IonicContact NH2-OD2 3.77Å; R710-D727 PolarHBondContact NH2-OD2 2.86Å
711	D	89.1	Confident	93.1	Very high	15 Å²	15	34.6 Å²	34.6	8%	0.08	20%	0.196	C	C	.	.			trans	-67	130.6	-172.2	-63.1	49.3	0	0	0	111.3	D705 D706 S709 D727 I779 N780	D705-D711 WeakPolarHBondContact CA-O 3.4Å; D705-D711 WeakPolarHBondContact CB-O 3.47Å; D706-D711 PolarHBondContact N-O 2.83Å; D706-D711 VanDerWaalsContact N-O 3.12Å; S709-D711 VanDerWaalsContact C-N 3.35Å; S709-D711 WeakPolarHBondContact CB-OD1 3.49Å; S709-D711 VanDerWaalsContact OG-CB 3.28Å; S709-D711 WeakPolarHBondContact OG-CB 3.45Å; S709-D711 PolarHBondContact OG-N 3.22Å; S709-D711 VanDerWaalsContact OG-N 3.12Å; S709-D711 PolarHBondContact OG-OD1 3.04Å; D711-D727 WeakPolarHBondContact CA-O 3.48Å; D711-I779 HydrophobicContact CB-CG1 3.79Å; D711-I779 WeakPolarHBondContact OD2-CA 3.07Å; D711-N780 WeakPolarHBondContact CB-O 3.47Å; D711-N780 PolarHBondContact OD2-N 3.4Å
712	F	93.3	Very high	93.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	160.7	171.6	70.8	-91.4	0	0	0	112.2	Y703 S704 D705 R710 R725 F726 D727 E732 I779 K797 T799 A800	Y703-F712 HydrophobicContact CE2-CB 4.3Å; S704-F712 CarbonylContact O-C 3.51Å; D705-F712 HydrophobicContact CB-CB 3.83Å; R710-F712 WeakPolarHBondContact O-CD1 3.48Å; F712-R725 HydrophobicContact CE2-CB 4Å; F712-F726 WeakPolarHBondContact O-CA 3.39Å; F712-F726 VanDerWaalsContact O-CB 3.28Å; F712-F726 WeakPolarHBondContact O-CB 3.25Å; F712-D727 HydrophobicContact CD1-CB 3.81Å; F712-D727 HydrophobicContact CE1-CB 3.41Å; F712-D727 VanDerWaalsContact CE1-CB 3.41Å; F712-D727 HydrophobicContact CZ-CB 4.12Å; F712-D727 PolarHBondContact N-O 3.34Å; F712-D727 PolarHBondContact O-N 3.05Å; F712-E732 HydrophobicContact CZ-CG 4.08Å; F712-I779 WeakPolarHBondContact O-CD1 3.49Å; F712-K797 HydrophobicContact CB-CB 4.43Å; F712-K797 HydrophobicContact CB-CG 3.82Å; F712-K797 HydrophobicContact CD1-CB 3.82Å; F712-K797 HydrophobicContact CD1-CG 3.83Å; F712-K797 HydrophobicContact CE1-CB 4.38Å; F712-K797 HydrophobicContact CG-CB 4.19Å; F712-K797 HydrophobicContact CG-CG 4.07Å; F712-T799 VanDerWaalsContact CE1-OG1 3.27Å; F712-T799 WeakPolarHBondContact CE1-OG1 3.44Å; F712-A800 HydrophobicContact CD2-CB 3.41Å; F712-A800 VanDerWaalsContact CD2-CB 3.41Å; F712-A800 VanDerWaalsContact CE2-CA 3.42Å; F712-A800 HydrophobicContact CE2-CB 3.55Å; F712-A800 HydrophobicContact CG-CB 3.99Å; F712-A800 HydrophobicContact CZ-CB 4.2Å
713	L	93.8	Very high	93.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	126	175.6	-172.1	86.7	0	0	0	108.5	M686 F688 L702 Y703 S704 F724 F726 I779	M686-L713 HydrophobicContact CE-CD1 4.2Å; M686-L713 HydrophobicContact CE-CD2 4.13Å; M686-L713 HydrophobicContact SD-CD1 3.4Å; M686-L713 WeakPolarHBondContact SD-CD1 3.06Å; M686-L713 HydrophobicContact SD-CD2 4Å; M686-L713 HydrophobicContact SD-CG 4.35Å; F688-L713 HydrophobicContact CE2-CD2 3.5Å; F688-L713 VanDerWaalsContact CE2-CD2 3.5Å; F688-L713 HydrophobicContact CZ-CD2 3.65Å; L702-L713 HydrophobicContact CD2-CD2 3.89Å; L702-L713 HydrophobicContact CD2-CG 4.48Å; Y703-L713 CarbonylContact C-O 3.58Å; Y703-L713 WeakPolarHBondContact CA-O 3.04Å; S704-L713 PolarHBondContact N-O 3.42Å; S704-L713 PolarHBondContact O-N 2.79Å; L713-F724 HydrophobicContact CD1-CE2 3.44Å; L713-F724 VanDerWaalsContact CD1-CE2 3.44Å; L713-F724 HydrophobicContact CD1-CZ 3.74Å; L713-F724 HydrophobicContact CG-CE2 4.09Å; L713-F726 HydrophobicContact CD1-CB 4.13Å; L713-I779 HydrophobicContact CB-CD1 4.41Å
714	A	97.4	Very high	93.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	145.1	176.1	0	0	0	0	0	112.1	L702 Y703 F724 R725 A800 V802	L702-A714 CarbonylContact O-C 3.55Å; L702-A714 WeakPolarHBondContact O-CA 3.04Å; Y703-A714 HydrophobicContact CD2-CB 4.1Å; A714-F724 WeakPolarHBondContact O-CD2 3.14Å; A714-R725 HydrophobicContact CB-CB 4.4Å; A714-R725 PolarHBondContact N-O 2.93Å; A714-R725 PolarHBondContact O-N 3.37Å; A714-A800 HydrophobicContact CB-CB 4.14Å; A714-A800 WeakPolarHBondContact CB-O 3.26Å; A714-V802 HydrophobicContact CB-CG2 4.04Å
715	I	98.4	Very high	93.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	115.9	164.5	-54.1	174	0	0	0	106.8	L701 L702 E723 F724 L749 V751	L701-I715 HydrophobicContact CB-CB 4.31Å; L701-I715 HydrophobicContact CB-CG2 4.11Å; L701-I715 HydrophobicContact CD1-CG2 4.05Å; L701-I715 PolarHBondContact N-O 3.36Å; L702-I715 HydrophobicContact CB-CB 4.07Å; L702-I715 HydrophobicContact CB-CD1 4.02Å; L702-I715 HydrophobicContact CB-CG1 4.15Å; L702-I715 HydrophobicContact CD1-CD1 4.01Å; L702-I715 HydrophobicContact CD2-CD1 4.27Å; L702-I715 HydrophobicContact CD2-CG1 4.23Å; L702-I715 HydrophobicContact CG-CD1 4.35Å; L702-I715 PolarHBondContact N-O 2.77Å; L702-I715 PolarHBondContact O-N 3.13Å; I715-E723 WeakPolarHBondContact CA-O 3.41Å; I715-F724 HydrophobicContact CG1-CD2 4.04Å; I715-L749 HydrophobicContact CD1-CD2 4.09Å; I715-L749 HydrophobicContact CG2-CD2 3.49Å; I715-L749 VanDerWaalsContact CG2-CD2 3.49Å; I715-V751 HydrophobicContact CD1-CG2 3.59Å; I715-V751 HydrophobicContact CG1-CG2 4.28Å
716	N	97.9	Very high	93.4	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.011	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	149.9	-178.6	-56.4	-53	0	0	0	110.9	V718 L722 E723 A800	N716-V718 HydrophobicContact CB-CG2 3.9Å; N716-L722 CarbonylContact O-C 3.6Å; N716-L722 WeakPolarHBondContact O-CA 3.34Å; N716-E723 PolarHBondContact N-O 2.8Å; N716-E723 PolarHBondContact O-N 2.93Å; N716-A800 PolarHBondContact ND2-O 2.76Å
717	L	97.9	Very high	93.5	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.016	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	125.9	157.7	-173.5	64.6	0	0	0	107.7	P694 A696 S698 G699 Y721 L722 I741	P694-L717 HydrophobicContact CB-CD2 3.82Å; A696-L717 WeakPolarHBondContact O-CD2 3.27Å; S698-L717 CarbonylContact C-O 3.6Å; S698-L717 WeakPolarHBondContact CA-O 3.5Å; S698-L717 WeakPolarHBondContact CB-O 3.35Å; G699-L717 PolarHBondContact N-O 3.09Å; G699-L717 PolarHBondContact O-N 2.78Å; L717-Y721 CarbonylContact C-O 3.52Å; L717-Y721 WeakPolarHBondContact CA-O 3.42Å; L717-L722 HydrophobicContact CB-CD2 4.17Å; L717-L722 HydrophobicContact CD1-CD2 3.77Å; L717-L722 HydrophobicContact CD1-CG 4.35Å; L717-I741 HydrophobicContact CD1-CD1 3.53Å; L717-I741 HydrophobicContact CD1-CG1 3.93Å
718	V	96.3	Very high	93.4	Very high	36 Å²	36	31.4 Å²	31.4	22%	0.218	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	103.8	-177.5	-175.7	0	0	0	0	108.9	N716 R720 Y721 E723 R736	N716-V718 HydrophobicContact CB-CG2 3.9Å; V718-R720 VanDerWaalsContact C-N 3.32Å; V718-R720 PolarHBondContact O-N 2.77Å; V718-Y721 PolarHBondContact N-O 3.5Å; V718-Y721 PolarHBondContact O-N 3.38Å; V718-E723 HydrophobicContact CB-CG 4.37Å; V718-E723 HydrophobicContact CG2-CG 4.19Å; V718-R736 PolarHBondContact O-NH2 3.05Å
719	D	94.9	Very high	93.1	Very high	102 Å²	102	28.8 Å²	28.8	55%	0.545	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	49.7	-178.8	-53.6	-31.2	0	0	0	113.2	P697 Y721	P697-D719 CarbonylContact O-C 3.43Å; P697-D719 WeakPolarHBondContact O-CA 3.48Å; P697-D719 PolarHBondContact O-N 3.22Å; P697-D719 VanDerWaalsContact O-N 3.09Å; D719-Y721 VanDerWaalsContact C-N 3.27Å; D719-Y721 VanDerWaalsContact O-CD2 3.32Å; D719-Y721 WeakPolarHBondContact O-CD2 3.25Å; D719-Y721 PolarHBondContact O-N 2.76Å
720	R	96.9	Very high	92.6	Very high	108 Å²	108	28.6 Å²	28.6	41%	0.408	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.6	7	-174.6	-56.2	-171.2	-61.8	-149.8	2.3	116.7	P697 V718 Q740 I741 L743	P697-R720 HydrophobicContact CB-CG 3.97Å; P697-R720 PolarHBondContact O-N 3.13Å; V718-R720 VanDerWaalsContact C-N 3.32Å; V718-R720 PolarHBondContact O-N 2.77Å; R720-Q740 HydrophobicContact CB-CB 3.93Å; R720-Q740 HydrophobicContact CB-CG 4.11Å; R720-Q740 VanDerWaalsContact CZ-OE1 3.29Å; R720-Q740 CarbonylContact O-C 3.58Å; R720-Q740 VanDerWaalsContact O-CA 3.28Å; R720-Q740 WeakPolarHBondContact O-CA 3.27Å; R720-I741 WeakPolarHBondContact O-CG1 3.28Å; R720-I741 PolarHBondContact O-N 2.87Å; R720-L743 HydrophobicContact CG-CD2 4.3Å; R720-L743 HydrophobicContact CG-CG 4.29Å
721	Y	97.9	Very high	92.2	Very high	62 Å²	62	21.7 Å²	21.7	24%	0.243	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	144	166.6	-62.2	-102.2	0	0	0	109.9	L717 V718 D719 R736 S737 Q740	L717-Y721 CarbonylContact C-O 3.52Å; L717-Y721 WeakPolarHBondContact CA-O 3.42Å; V718-Y721 PolarHBondContact N-O 3.5Å; V718-Y721 PolarHBondContact O-N 3.38Å; D719-Y721 VanDerWaalsContact C-N 3.27Å; D719-Y721 VanDerWaalsContact O-CD2 3.32Å; D719-Y721 WeakPolarHBondContact O-CD2 3.25Å; D719-Y721 PolarHBondContact O-N 2.76Å; Y721-R736 VanDerWaalsContact CB-NE 3.3Å; Y721-R736 HydrophobicContact CD1-CG 4.2Å; Y721-R736 HydrophobicContact CG-CG 4.25Å; Y721-R736 VanDerWaalsContact CG-NE 3.28Å; Y721-S737 WeakPolarHBondContact CA-OG 3.43Å; Y721-Q740 HydrophobicContact CD1-CG 4.31Å; Y721-Q740 HydrophobicContact CD2-CG 3.68Å; Y721-Q740 HydrophobicContact CE1-CG 3.92Å; Y721-Q740 HydrophobicContact CE2-CG 3.26Å; Y721-Q740 VanDerWaalsContact CE2-NE2 3.32Å; Y721-Q740 HydrophobicContact CG-CG 4.21Å; Y721-Q740 PolarHBondContact OH-NE2 2.92Å; Y721-Q740 VanDerWaalsContact OH-NE2 3.16Å
722	L	98	Very high	92.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	138.3	167.8	-71.5	179.9	0	0	0	110.3	F692 L701 N716 L717 R736 S737 I741 L749 L760 V762	F692-L722 HydrophobicContact CE1-CD1 4.11Å; F692-L722 HydrophobicContact CZ-CD1 3.82Å; F692-L722 HydrophobicContact CZ-CD2 4.19Å; F692-L722 HydrophobicContact CZ-CG 4.41Å; L701-L722 HydrophobicContact CD1-CD2 3.66Å; N716-L722 CarbonylContact O-C 3.6Å; N716-L722 WeakPolarHBondContact O-CA 3.34Å; L717-L722 HydrophobicContact CB-CD2 4.17Å; L717-L722 HydrophobicContact CD1-CD2 3.77Å; L717-L722 HydrophobicContact CD1-CG 4.35Å; L722-R736 CarbonylContact O-C 3.53Å; L722-R736 VanDerWaalsContact O-CA 3.27Å; L722-R736 WeakPolarHBondContact O-CA 3.46Å; L722-S737 PolarHBondContact N-OG 3.06Å; L722-S737 VanDerWaalsContact N-OG 3.1Å; L722-S737 PolarHBondContact O-N 3.07Å; L722-I741 HydrophobicContact CD2-CD1 4.48Å; L722-I741 HydrophobicContact CG-CD1 4.37Å; L722-L749 HydrophobicContact CD1-CB 4.18Å; L722-L749 HydrophobicContact CD1-CD1 3.64Å; L722-L749 HydrophobicContact CD1-CD2 4.02Å; L722-L749 HydrophobicContact CD1-CG 4.14Å; L722-L760 HydrophobicContact CB-CD1 4.05Å; L722-V762 HydrophobicContact CD1-CB 4.08Å; L722-V762 HydrophobicContact CD1-CG2 3.83Å
723	E	98.1	Very high	92	Very high	10 Å²	10	23.3 Å²	23.3	5%	0.047	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.3	173.8	-66.8	-169.4	161.3	0	0	110.5	I715 N716 V718 R725 I735 R736	I715-E723 WeakPolarHBondContact CA-O 3.41Å; N716-E723 PolarHBondContact N-O 2.8Å; N716-E723 PolarHBondContact O-N 2.93Å; V718-E723 HydrophobicContact CB-CG 4.37Å; V718-E723 HydrophobicContact CG2-CG 4.19Å; E723-R725 HydrophobicContact CB-CG 4.45Å; E723-R725 IonicContact OE1-NH2 3.17Å; E723-R725 IonicContact OE2-CZ 2.72Å; E723-R725 IonicContact OE2-NE 3.72Å; E723-R725 PolarHBondContact OE2-NE 3.27Å; E723-R725 IonicContact OE2-NH2 3.83Å; E723-R725 PolarHBondContact OE2-NH2 3.06Å; E723-I735 CarbonylContact C-O 3.59Å; E723-I735 VanDerWaalsContact CA-O 3.31Å; E723-I735 WeakPolarHBondContact CA-O 3.29Å; E723-R736 HydrophobicContact CG-CB 4.16Å; E723-R736 HydrophobicContact CG-CG 3.9Å; E723-R736 IonicContact OE1-CZ 2.67Å; E723-R736 IonicContact OE1-NE 2.72Å; E723-R736 IonicContact OE1-NH1 3.33Å; E723-R736 PolarHBondContact OE1-NH1 3.15Å
724	F	97.6	Very high	92.1	Very high	1 Å²	1	26.5 Å²	26.5	0%	0.004	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	119.9	165.8	178.8	-137.7	0	0	0	108.7	L713 A714 I715 F726 I735 V751 R753 L760	L713-F724 HydrophobicContact CD1-CE2 3.44Å; L713-F724 VanDerWaalsContact CD1-CE2 3.44Å; L713-F724 HydrophobicContact CD1-CZ 3.74Å; L713-F724 HydrophobicContact CG-CE2 4.09Å; A714-F724 WeakPolarHBondContact O-CD2 3.14Å; I715-F724 HydrophobicContact CG1-CD2 4.04Å; F724-F726 HydrophobicContact CD1-CD1 4.13Å; F724-F726 AromaticContact CD1-CE1 3.99Å; F724-F726 HydrophobicContact CD1-CE1 3.99Å; F724-F726 AromaticContact CE1-CD1 3.73Å; F724-F726 HydrophobicContact CE1-CD1 3.73Å; F724-F726 AromaticContact CE1-CE1 3.6Å; F724-F726 HydrophobicContact CE1-CE1 3.6Å; F724-F726 HydrophobicContact CE2-CD1 4.24Å; F724-F726 AromaticContact CZ-CD1 3.78Å; F724-F726 HydrophobicContact CZ-CD1 3.78Å; F724-F726 HydrophobicContact CZ-CE1 4.11Å; F724-I735 HydrophobicContact CB-CB 4.42Å; F724-I735 HydrophobicContact CD1-CD1 4.18Å; F724-I735 PolarHBondContact N-O 2.94Å; F724-I735 PolarHBondContact O-N 2.84Å; F724-V751 HydrophobicContact CB-CG1 3.98Å; F724-V751 HydrophobicContact CD1-CB 4.08Å; F724-V751 HydrophobicContact CD1-CG1 4.29Å; F724-V751 HydrophobicContact CD2-CB 4.33Å; F724-V751 HydrophobicContact CD2-CG1 4.44Å; F724-V751 HydrophobicContact CD2-CG2 4.3Å; F724-V751 HydrophobicContact CE1-CB 4.29Å; F724-V751 HydrophobicContact CE2-CG2 4.28Å; F724-V751 HydrophobicContact CG-CB 4.12Å; F724-V751 HydrophobicContact CG-CG1 4.02Å; F724-R753 HydrophobicContact CE1-CB 4.15Å; F724-R753 HydrophobicContact CZ-CB 4.13Å; F724-L760 HydrophobicContact CB-CB 4.4Å; F724-L760 HydrophobicContact CB-CD1 3.85Å
725	R	96.9	Very high	92.1	Very high	46 Å²	46	26.7 Å²	26.7	17%	0.174	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	138.8	-176.2	-64.2	179.3	171.6	-107.9	0.3	111.2	F712 A714 E723 E732 A733 V734 T799	F712-R725 HydrophobicContact CE2-CB 4Å; A714-R725 HydrophobicContact CB-CB 4.4Å; A714-R725 PolarHBondContact N-O 2.93Å; A714-R725 PolarHBondContact O-N 3.37Å; E723-R725 HydrophobicContact CB-CG 4.45Å; E723-R725 IonicContact OE1-NH2 3.17Å; E723-R725 IonicContact OE2-CZ 2.72Å; E723-R725 IonicContact OE2-NE 3.72Å; E723-R725 PolarHBondContact OE2-NE 3.27Å; E723-R725 IonicContact OE2-NH2 3.83Å; E723-R725 PolarHBondContact OE2-NH2 3.06Å; R725-E732 WeakPolarHBondContact CD-OE1 3.31Å; R725-E732 IonicContact CZ-OE1 2.68Å; R725-E732 IonicContact NE-OE1 3.67Å; R725-E732 IonicContact NH1-OE1 3.65Å; R725-E732 PolarHBondContact NH1-OE1 3.3Å; R725-E732 IonicContact NH1-OE2 3.34Å; R725-A733 VanDerWaalsContact CA-O 3.27Å; R725-A733 WeakPolarHBondContact CA-O 3.39Å; R725-V734 HydrophobicContact CG-CG1 4.18Å; R725-V734 HydrophobicContact CG-CG2 4.28Å; R725-T799 PolarHBondContact NH1-O 2.98Å
726	F	94	Very high	92	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	147.8	173.6	58.2	-88	0	0	0	113.7	F712 L713 F724 E732 A733 I735 R753 K756 A772	F712-F726 WeakPolarHBondContact O-CA 3.39Å; F712-F726 VanDerWaalsContact O-CB 3.28Å; F712-F726 WeakPolarHBondContact O-CB 3.25Å; L713-F726 HydrophobicContact CD1-CB 4.13Å; F724-F726 HydrophobicContact CD1-CD1 4.13Å; F724-F726 AromaticContact CD1-CE1 3.99Å; F724-F726 HydrophobicContact CD1-CE1 3.99Å; F724-F726 AromaticContact CE1-CD1 3.73Å; F724-F726 HydrophobicContact CE1-CD1 3.73Å; F724-F726 AromaticContact CE1-CE1 3.6Å; F724-F726 HydrophobicContact CE1-CE1 3.6Å; F724-F726 HydrophobicContact CE2-CD1 4.24Å; F724-F726 AromaticContact CZ-CD1 3.78Å; F724-F726 HydrophobicContact CZ-CD1 3.78Å; F724-F726 HydrophobicContact CZ-CE1 4.11Å; F726-E732 CarbonylContact O-C 3.3Å; F726-E732 WeakPolarHBondContact O-CA 3.3Å; F726-A733 HydrophobicContact CD1-CB 4.06Å; F726-A733 HydrophobicContact CD2-CB 4.11Å; F726-A733 HydrophobicContact CE1-CB 3.66Å; F726-A733 HydrophobicContact CE2-CB 3.73Å; F726-A733 HydrophobicContact CG-CB 4.26Å; F726-A733 HydrophobicContact CZ-CB 3.48Å; F726-A733 VanDerWaalsContact CZ-CB 3.48Å; F726-A733 PolarHBondContact N-O 2.89Å; F726-A733 VanDerWaalsContact N-O 3.13Å; F726-A733 PolarHBondContact O-N 2.97Å; F726-I735 HydrophobicContact CE1-CD1 4.15Å; F726-R753 HydrophobicContact CD2-CG 4.41Å; F726-R753 HydrophobicContact CE1-CG 4.19Å; F726-R753 HydrophobicContact CE2-CG 3.88Å; F726-R753 HydrophobicContact CZ-CG 3.77Å; F726-K756 VanDerWaalsContact CE2-O 3.3Å; F726-K756 WeakPolarHBondContact CE2-O 3.42Å; F726-K756 VanDerWaalsContact CZ-O 3.29Å; F726-K756 WeakPolarHBondContact CZ-O 3.13Å; F726-A772 HydrophobicContact CD2-CB 3.96Å; F726-A772 HydrophobicContact CE2-CB 3.57Å
727	D	91.4	Very high	92	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.011	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	138.6	167.1	-172.2	-16.1	0	0	0	108.1	R710 D711 F712 G729 S730 G731 I779	R710-D727 IonicContact CZ-OD2 3.8Å; R710-D727 IonicContact NE-OD2 2.71Å; R710-D727 PolarHBondContact NE-OD2 2.98Å; R710-D727 IonicContact NH2-OD2 3.77Å; R710-D727 PolarHBondContact NH2-OD2 2.86Å; D711-D727 WeakPolarHBondContact CA-O 3.48Å; F712-D727 HydrophobicContact CD1-CB 3.81Å; F712-D727 HydrophobicContact CE1-CB 3.41Å; F712-D727 VanDerWaalsContact CE1-CB 3.41Å; F712-D727 HydrophobicContact CZ-CB 4.12Å; F712-D727 PolarHBondContact N-O 3.34Å; F712-D727 PolarHBondContact O-N 3.05Å; D727-G729 WeakPolarHBondContact OD1-CA 3.37Å; D727-G729 PolarHBondContact OD1-N 2.96Å; D727-S730 PolarHBondContact OD1-N 3.13Å; D727-G731 PolarHBondContact OD1-N 2.76Å; D727-G731 PolarHBondContact OD2-N 2.85Å; D727-I779 WeakPolarHBondContact O-CD1 3.48Å
728	C	81.5	Confident	91.8	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.02	17%	0.174	C	C	.	.	S	Bend	trans	-100.5	15.2	176.4	-63.9	0	0	0	0	112.7	F776 Q778	C728-F776 HydrophobicContact CB-CB 4.23Å; C728-F776 WeakPolarHBondContact CB-O 3.32Å; C728-F776 WeakPolarHBondContact O-CB 3.05Å; C728-Q778 WeakPolarHBondContact CB-O 3.44Å
729	G	75.4	Confident	91.8	Very high	22 Å²	22	39 Å²	39	23%	0.227	19%	0.191	C	C	.	.	S	Bend	trans	102.1	3.7	-176.8	0	0	0	0	0	114.8	D727	D727-G729 WeakPolarHBondContact OD1-CA 3.37Å; D727-G729 PolarHBondContact OD1-N 2.96Å
730	S	72.9	Confident	91.9	Very high	36 Å²	36	37.8 Å²	37.8	25%	0.252	18%	0.182	S	C	.	.	S	Bend	trans	-148.1	13.9	-177.1	59.8	0	0	0	0	116.1	D727 E773 G774 A775 F776	D727-S730 PolarHBondContact OD1-N 3.13Å; S730-E773 CarbonylContact C-O 3.15Å; S730-E773 CarbonylContact O-C 3.59Å; S730-E773 PolarHBondContact OG-O 3.42Å; S730-G774 WeakPolarHBondContact OG-CA 3.42Å; S730-A775 PolarHBondContact OG-N 2.71Å; S730-F776 PolarHBondContact OG-N 3.03Å
731	G	75.9	Confident	91.9	Very high	7 Å²	7	32.8 Å²	32.8	7%	0.072	16%	0.163	C	C	.	.			trans	141.4	151.6	172	0	0	0	0	0	113.5	D727	D727-G731 PolarHBondContact OD1-N 2.76Å; D727-G731 PolarHBondContact OD2-N 2.85Å
732	E	88.1	Confident	91.9	Very high	46 Å²	46	35.1 Å²	35.1	22%	0.215	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	138.6	-172.5	178.7	177.2	-167.6	0	0	112.7	F712 R725 F726 V734 T799	F712-E732 HydrophobicContact CZ-CG 4.08Å; R725-E732 WeakPolarHBondContact CD-OE1 3.31Å; R725-E732 IonicContact CZ-OE1 2.68Å; R725-E732 IonicContact NE-OE1 3.67Å; R725-E732 IonicContact NH1-OE1 3.65Å; R725-E732 PolarHBondContact NH1-OE1 3.3Å; R725-E732 IonicContact NH1-OE2 3.34Å; F726-E732 CarbonylContact O-C 3.3Å; F726-E732 WeakPolarHBondContact O-CA 3.3Å; E732-V734 HydrophobicContact CG-CG2 3.86Å; E732-V734 WeakPolarHBondContact OE1-CG2 3.48Å; E732-T799 VanDerWaalsContact OE2-CB 3.29Å; E732-T799 WeakPolarHBondContact OE2-CB 3.49Å; E732-T799 WeakPolarHBondContact OE2-CG2 3.44Å
733	A	90.8	Very high	91.8	Very high	3 Å²	3	37.8 Å²	37.8	3%	0.025	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	136.5	155	0	0	0	0	0	110	R725 F726 A772	R725-A733 VanDerWaalsContact CA-O 3.27Å; R725-A733 WeakPolarHBondContact CA-O 3.39Å; F726-A733 HydrophobicContact CD1-CB 4.06Å; F726-A733 HydrophobicContact CD2-CB 4.11Å; F726-A733 HydrophobicContact CE1-CB 3.66Å; F726-A733 HydrophobicContact CE2-CB 3.73Å; F726-A733 HydrophobicContact CG-CB 4.26Å; F726-A733 HydrophobicContact CZ-CB 3.48Å; F726-A733 VanDerWaalsContact CZ-CB 3.48Å; F726-A733 PolarHBondContact N-O 2.89Å; F726-A733 VanDerWaalsContact N-O 3.13Å; F726-A733 PolarHBondContact O-N 2.97Å; A733-A772 HydrophobicContact CB-CB 3.98Å
734	V	96.1	Very high	91.6	Very high	67 Å²	67	41.5 Å²	41.5	41%	0.406	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	121.5	166.7	-173.7	0	0	0	0	108.4	R725 E732	R725-V734 HydrophobicContact CG-CG1 4.18Å; R725-V734 HydrophobicContact CG-CG2 4.28Å; E732-V734 HydrophobicContact CG-CG2 3.86Å; E732-V734 WeakPolarHBondContact OE1-CG2 3.48Å
735	I	96.4	Very high	91.5	Very high	4 Å²	4	43 Å²	43	2%	0.021	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	113.6	178.7	-50.3	-178.9	0	0	0	108	E723 F724 F726 G758 L760 M768	E723-I735 CarbonylContact C-O 3.59Å; E723-I735 VanDerWaalsContact CA-O 3.31Å; E723-I735 WeakPolarHBondContact CA-O 3.29Å; F724-I735 HydrophobicContact CB-CB 4.42Å; F724-I735 HydrophobicContact CD1-CD1 4.18Å; F724-I735 PolarHBondContact N-O 2.94Å; F724-I735 PolarHBondContact O-N 2.84Å; F726-I735 HydrophobicContact CE1-CD1 4.15Å; I735-G758 VanDerWaalsContact CD1-CA 3.46Å; I735-G758 VanDerWaalsContact CD1-O 3.27Å; I735-G758 WeakPolarHBondContact CD1-O 3.46Å; I735-L760 HydrophobicContact CB-CB 4.49Å; I735-L760 HydrophobicContact CG2-CB 3.78Å; I735-M768 HydrophobicContact CG2-CB 3.98Å; I735-M768 WeakPolarHBondContact CG2-O 3.31Å
736	R	97.4	Very high	91.4	Very high	83 Å²	83	42.3 Å²	42.3	31%	0.313	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	146.8	-175.7	-168.8	168	176.5	125.5	-5.9	110.8	V718 Y721 L722 E723 M768	V718-R736 PolarHBondContact O-NH2 3.05Å; Y721-R736 VanDerWaalsContact CB-NE 3.3Å; Y721-R736 HydrophobicContact CD1-CG 4.2Å; Y721-R736 HydrophobicContact CG-CG 4.25Å; Y721-R736 VanDerWaalsContact CG-NE 3.28Å; L722-R736 CarbonylContact O-C 3.53Å; L722-R736 VanDerWaalsContact O-CA 3.27Å; L722-R736 WeakPolarHBondContact O-CA 3.46Å; E723-R736 HydrophobicContact CG-CB 4.16Å; E723-R736 HydrophobicContact CG-CG 3.9Å; E723-R736 IonicContact OE1-CZ 2.67Å; E723-R736 IonicContact OE1-NE 2.72Å; E723-R736 IonicContact OE1-NH1 3.33Å; E723-R736 PolarHBondContact OE1-NH1 3.15Å; R736-M768 WeakPolarHBondContact O-CB 3.49Å; R736-M768 WeakPolarHBondContact O-CG 3.47Å
737	S	96.8	Very high	91.5	Very high	6 Å²	6	42.7 Å²	42.7	4%	0.042	22%	0.224	C	C	.	.			trans	-59.7	150.6	173.1	63.2	0	0	0	0	111.7	Y721 L722 E739	Y721-S737 WeakPolarHBondContact CA-OG 3.43Å; L722-S737 PolarHBondContact N-OG 3.06Å; L722-S737 VanDerWaalsContact N-OG 3.1Å; L722-S737 PolarHBondContact O-N 3.07Å; S737-E739 PolarHBondContact OG-O 2.97Å
738	E	93.8	Very high	91.6	Very high	87 Å²	87	45.1 Å²	45.1	41%	0.407	24%	0.235	S	C	.	.	S	Bend	trans	-69.2	-41.9	-179.2	-168.6	165.5	-122.7	0	0	110.6	K766 M768	E738-K766 IonicContact OE1-NZ 3.93Å; E738-K766 PolarHBondContact OE1-NZ 2.82Å; E738-K766 WeakPolarHBondContact OE2-CB 3.43Å; E738-M768 HydrophobicContact CB-CG 4.27Å; E738-M768 HydrophobicContact CB-SD 4Å; E738-M768 HydrophobicContact CG-SD 4.42Å
739	E	96.2	Very high	92.3	Very high	125 Å²	125	45 Å²	45	58%	0.584	23%	0.234	S	C	*	.	S	Bend	trans	-120.1	166.8	178.9	-57.8	-172.3	150.4	0	0	112.1	S737 Q765	S737-E739 PolarHBondContact OG-O 2.97Å; E739-Q765 VanDerWaalsContact N-OE1 3.08Å; E739-Q765 PolarHBondContact O-NE2 2.94Å
740	Q	97.8	Very high	92.7	Very high	76 Å²	76	48.2 Å²	48.2	36%	0.355	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-74	136.2	171.4	-68.6	177	29.3	0	0	110	R720 Y721	R720-Q740 HydrophobicContact CB-CB 3.93Å; R720-Q740 HydrophobicContact CB-CG 4.11Å; R720-Q740 VanDerWaalsContact CZ-OE1 3.29Å; R720-Q740 CarbonylContact O-C 3.58Å; R720-Q740 VanDerWaalsContact O-CA 3.28Å; R720-Q740 WeakPolarHBondContact O-CA 3.27Å; Y721-Q740 HydrophobicContact CD1-CG 4.31Å; Y721-Q740 HydrophobicContact CD2-CG 3.68Å; Y721-Q740 HydrophobicContact CE1-CG 3.92Å; Y721-Q740 HydrophobicContact CE2-CG 3.26Å; Y721-Q740 VanDerWaalsContact CE2-NE2 3.32Å; Y721-Q740 HydrophobicContact CG-CG 4.21Å; Y721-Q740 PolarHBondContact OH-NE2 2.92Å; Y721-Q740 VanDerWaalsContact OH-NE2 3.16Å
741	I	97.4	Very high	93.4	Very high	3 Å²	3	46.6 Å²	46.6	2%	0.015	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-74.9	156.2	166.5	70.5	177	0	0	0	109.9	F692 P694 L717 R720 L722 V762	F692-I741 HydrophobicContact CE2-CD1 3.64Å; F692-I741 HydrophobicContact CZ-CD1 3.62Å; P694-I741 HydrophobicContact CB-CD1 4.45Å; P694-I741 HydrophobicContact CG-CD1 3.81Å; P694-I741 HydrophobicContact CG-CG1 4.46Å; L717-I741 HydrophobicContact CD1-CD1 3.53Å; L717-I741 HydrophobicContact CD1-CG1 3.93Å; R720-I741 WeakPolarHBondContact O-CG1 3.28Å; R720-I741 PolarHBondContact O-N 2.87Å; L722-I741 HydrophobicContact CD2-CD1 4.48Å; L722-I741 HydrophobicContact CG-CD1 4.37Å; I741-V762 HydrophobicContact CG2-CG1 4.1Å; I741-V762 HydrophobicContact CG2-CG2 3.94Å
742	N	97.2	Very high	93.5	Very high	111 Å²	111	47.2 Å²	47.2	59%	0.594	23%	0.231	S	C	*	.	P	Polyproline II helix	trans	-73.3	161.9	171.8	-71.4	-46.4	0	0	0	110	P694 S745 H747	P694-N742 WeakPolarHBondContact CG-O 3.4Å; N742-S745 WeakPolarHBondContact CB-OG 3.25Å; N742-H747 PolarHBondContact O-NE2 2.79Å
743	L	96.9	Very high	93.2	Very high	56 Å²	56	45 Å²	45	29%	0.293	22%	0.221	S	C	.	.	S	Bend	trans	-98.9	150.7	163.6	-63	-177.9	0	0	0	108.7	P694 A696 P697 R720	P694-L743 HydrophobicContact CB-CD2 3.93Å; P694-L743 HydrophobicContact CG-CD2 4.07Å; P694-L743 WeakPolarHBondContact O-CA 3.44Å; A696-L743 WeakPolarHBondContact O-CD2 3.45Å; P697-L743 HydrophobicContact CB-CD1 4.31Å; R720-L743 HydrophobicContact CG-CD2 4.3Å; R720-L743 HydrophobicContact CG-CG 4.29Å
744	D	94.2	Very high	92	Very high	88 Å²	88	48.6 Å²	48.6	47%	0.471	24%	0.243	S	C	.	.	S	Bend	trans	57	49.2	-178.2	-60	-60.2	0	0	0	114.4	W693 P694 S695	W693-D744 VanDerWaalsContact CE2-C 3.44Å; W693-D744 WeakPolarHBondContact CH2-O 3.33Å; W693-D744 HydrophobicContact CZ2-CB 3.98Å; W693-D744 WeakPolarHBondContact CZ2-O 3.35Å; W693-D744 PolarHBondContact NE1-OD1 2.94Å; W693-D744 VanDerWaalsContact NE1-OD1 3.09Å; P694-D744 PolarHBondContact O-N 2.83Å; S695-D744 WeakPolarHBondContact CB-OD1 3.48Å; S695-D744 PolarHBondContact OG-OD1 2.81Å
745	S	94.6	Very high	90.6	Very high	32 Å²	32	46.9 Å²	46.9	22%	0.224	24%	0.235	C	C	.	.	S	Bend	trans	-147.4	158.3	168.1	51.6	0	0	0	0	112.1	W693 P694 N742 H747	W693-S745 VanDerWaalsContact CE3-C 3.4Å; P694-S745 WeakPolarHBondContact CD-O 3.43Å; N742-S745 WeakPolarHBondContact CB-OG 3.25Å; S745-H747 PolarHBondContact O-CD2 2.84Å; S745-H747 PolarHBondContact OG-NE2 3.18Å
746	W	94.4	Very high	89.4	Confident	31 Å²	31	48.8 Å²	48.8	12%	0.117	24%	0.244	C	C	.	.			trans	-70.6	135.3	172.6	-73.9	108.6	0	0	0	112.1	T691 W693 I809 Q811 W854 D855	T691-W746 HydrophobicContact CG2-CE3 3.9Å; T691-W746 HydrophobicContact CG2-CZ3 4.35Å; W693-W746 HydrophobicContact CB-CD2 4.39Å; W693-W746 HydrophobicContact CB-CE3 4.07Å; W693-W746 HydrophobicContact CB-CH2 4.27Å; W693-W746 HydrophobicContact CB-CZ3 4.01Å; W693-W746 HydrophobicContact CE3-CB 4.44Å; W693-W746 AromaticContact CE3-CD1 3.54Å; W693-W746 AromaticContact CE3-CD2 3.82Å; W693-W746 HydrophobicContact CE3-CD2 3.82Å; W693-W746 AromaticContact CE3-CE2 3.66Å; W693-W746 AromaticContact CE3-CG 3.73Å; W693-W746 HydrophobicContact CE3-CG 3.73Å; W693-W746 HydrophobicContact CE3-CZ2 4.33Å; W693-W746 AromaticContact CE3-NE1 3.47Å; W693-W746 AromaticContact CZ3-CD1 3.56Å; W693-W746 HydrophobicContact CZ3-CG 4.16Å; W693-W746 AromaticContact CZ3-NE1 3.61Å; W746-I809 HydrophobicContact CH2-CB 4.02Å; W746-I809 HydrophobicContact CH2-CD1 4.14Å; W746-I809 HydrophobicContact CH2-CG2 3.87Å; W746-I809 HydrophobicContact CZ2-CD1 4.2Å; W746-I809 HydrophobicContact CZ3-CB 4.47Å; W746-Q811 HydrophobicContact CH2-CB 3.71Å; W746-Q811 HydrophobicContact CH2-CG 4.35Å; W746-Q811 HydrophobicContact CZ3-CB 3.65Å; W746-W854 HydrophobicContact CB-CD2 4.49Å; W746-W854 HydrophobicContact CB-CG 4.3Å; W746-W854 HydrophobicContact CD2-CB 4.3Å; W746-W854 HydrophobicContact CG-CB 3.93Å; W746-W854 HydrophobicContact CG-CG 4.07Å; W746-W854 VanDerWaalsContact CZ2-O 3.3Å; W746-W854 WeakPolarHBondContact CZ2-O 3.49Å; W746-D855 VanDerWaalsContact NE1-CG 3.31Å; W746-D855 PolarHBondContact NE1-OD1 2.87Å
747	H	96.4	Very high	88.1	Confident	9 Å²	9	46.6 Å²	46.6	4%	0.042	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	144.6	174.6	-68.7	-72.3	0	0	0	111.2	T691 F692 N742 S745 V762 D763	T691-H747 WeakPolarHBondContact CA-O 3.41Å; F692-H747 HydrophobicContact CD1-CB 4.14Å; F692-H747 HydrophobicContact CE1-CB 3.51Å; F692-H747 HydrophobicContact CE2-CB 4.24Å; F692-H747 HydrophobicContact CZ-CB 3.55Å; F692-H747 PolarHBondContact N-O 3.05Å; F692-H747 PolarHBondContact O-N 2.78Å; N742-H747 PolarHBondContact O-NE2 2.79Å; S745-H747 PolarHBondContact O-CD2 2.84Å; S745-H747 PolarHBondContact OG-NE2 3.18Å; H747-V762 HydrophobicContact CB-CG2 4.4Å; H747-D763 VanDerWaalsContact CA-OD1 3.24Å; H747-D763 WeakPolarHBondContact CA-OD1 3.37Å; H747-D763 IonicContact CE1-OD2 3.02Å; H747-D763 PolarHBondContact CE1-OD2 2.7Å; H747-D763 IonicContact CG-OD1 2.73Å; H747-D763 IonicContact CG-OD2 3.33Å; H747-D763 IonicContact ND1-OD1 3.2Å; H747-D763 IonicContact ND1-OD2 2.69Å; H747-D763 PolarHBondContact ND1-OD2 2.85Å
748	E	93	Very high	87.1	Confident	53 Å²	53	46.3 Å²	46.3	25%	0.248	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	110.5	172.8	-171.7	177.8	120.1	0	0	110	E689 R750 V762 D763	E689-E748 HydrophobicContact CG-CG 4.46Å; E748-R750 IonicContact OE1-CZ 2.85Å; E748-R750 IonicContact OE1-NE 2.7Å; E748-R750 PolarHBondContact OE1-NE 3.15Å; E748-R750 IonicContact OE1-NH2 3.5Å; E748-R750 PolarHBondContact OE1-NH2 2.93Å; E748-V762 WeakPolarHBondContact O-CA 3.45Å; E748-D763 PolarHBondContact N-OD1 3.35Å; E748-D763 PolarHBondContact O-N 3.12Å
749	L	95.9	Very high	86.2	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	131.6	174.7	173.4	65.8	0	0	0	110.2	E689 V690 F692 I715 L722 V751 L760 Q761 V762	E689-L749 CarbonylContact C-O 3.58Å; E689-L749 WeakPolarHBondContact CA-O 3.18Å; V690-L749 HydrophobicContact CB-CB 4.26Å; V690-L749 HydrophobicContact CG2-CD2 4.36Å; V690-L749 PolarHBondContact N-O 2.74Å; V690-L749 PolarHBondContact O-N 3.41Å; F692-L749 HydrophobicContact CE1-CB 4.02Å; I715-L749 HydrophobicContact CD1-CD2 4.09Å; I715-L749 HydrophobicContact CG2-CD2 3.49Å; I715-L749 VanDerWaalsContact CG2-CD2 3.49Å; L722-L749 HydrophobicContact CD1-CB 4.18Å; L722-L749 HydrophobicContact CD1-CD1 3.64Å; L722-L749 HydrophobicContact CD1-CD2 4.02Å; L722-L749 HydrophobicContact CD1-CG 4.14Å; L749-V751 HydrophobicContact CD1-CG1 3.66Å; L749-V751 HydrophobicContact CD2-CG1 4.19Å; L749-V751 HydrophobicContact CG-CG1 4Å; L749-L760 HydrophobicContact CD1-CD1 4.2Å; L749-L760 HydrophobicContact CD1-CG 3.94Å; L749-Q761 WeakPolarHBondContact CD1-O 3.22Å; L749-V762 HydrophobicContact CD1-CB 4.4Å
750	R	84.3	Confident	85.9	Confident	90 Å²	90	38.8 Å²	38.8	34%	0.34	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	116.1	166.2	-67.2	174.5	178.4	-75	-11.5	108.3	F688 E689 E748 Q761	F688-R750 WeakPolarHBondContact O-CA 3.26Å; E689-R750 HydrophobicContact CG-CG 4.19Å; E689-R750 IonicContact OE1-NH2 3.15Å; E689-R750 IonicContact OE2-CZ 3.32Å; E689-R750 IonicContact OE2-NH1 3.05Å; E689-R750 PolarHBondContact OE2-NH1 3.27Å; E689-R750 IonicContact OE2-NH2 3.2Å; E689-R750 PolarHBondContact OE2-NH2 2.89Å; E748-R750 IonicContact OE1-CZ 2.85Å; E748-R750 IonicContact OE1-NE 2.7Å; E748-R750 PolarHBondContact OE1-NE 3.15Å; E748-R750 IonicContact OE1-NH2 3.5Å; E748-R750 PolarHBondContact OE1-NH2 2.93Å; R750-Q761 PolarHBondContact N-O 2.94Å; R750-Q761 PolarHBondContact O-N 3.09Å; R750-Q761 VanDerWaalsContact O-O 3.12Å
751	V	88.6	Confident	85.3	Confident	1 Å²	1	38 Å²	38	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	134.9	168.5	-64	0	0	0	0	109.8	E687 F688 I715 F724 L749 I759 L760	E687-V751 CarbonylContact C-O 3.57Å; E687-V751 WeakPolarHBondContact CA-O 3.37Å; F688-V751 HydrophobicContact CB-CG2 3.83Å; F688-V751 HydrophobicContact CD2-CG2 4.13Å; F688-V751 HydrophobicContact CG-CG2 4.43Å; F688-V751 PolarHBondContact N-O 3.03Å; F688-V751 PolarHBondContact O-N 2.81Å; I715-V751 HydrophobicContact CD1-CG2 3.59Å; I715-V751 HydrophobicContact CG1-CG2 4.28Å; F724-V751 HydrophobicContact CB-CG1 3.98Å; F724-V751 HydrophobicContact CD1-CB 4.08Å; F724-V751 HydrophobicContact CD1-CG1 4.29Å; F724-V751 HydrophobicContact CD2-CB 4.33Å; F724-V751 HydrophobicContact CD2-CG1 4.44Å; F724-V751 HydrophobicContact CD2-CG2 4.3Å; F724-V751 HydrophobicContact CE1-CB 4.29Å; F724-V751 HydrophobicContact CE2-CG2 4.28Å; F724-V751 HydrophobicContact CG-CB 4.12Å; F724-V751 HydrophobicContact CG-CG1 4.02Å; L749-V751 HydrophobicContact CD1-CG1 3.66Å; L749-V751 HydrophobicContact CD2-CG1 4.19Å; L749-V751 HydrophobicContact CG-CG1 4Å; V751-I759 CarbonylContact C-O 3.24Å; V751-I759 VanDerWaalsContact CA-O 3.25Å; V751-I759 WeakPolarHBondContact CA-O 3.21Å; V751-L760 HydrophobicContact CG1-CB 4Å; V751-L760 HydrophobicContact CG1-CD1 4.07Å; V751-L760 HydrophobicContact CG1-CG 3.93Å
752	S	78.4	Confident	85.2	Confident	20 Å²	20	37.9 Å²	37.9	14%	0.14	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	156.5	171.1	68.3	0	0	0	0	110.8	M686 G758 I759	M686-S752 CarbonylContact O-C 3.55Å; M686-S752 VanDerWaalsContact O-CA 3.26Å; M686-S752 WeakPolarHBondContact O-CA 3.26Å; S752-G758 CarbonylContact O-C 3.57Å; S752-G758 VanDerWaalsContact O-CA 3.25Å; S752-G758 WeakPolarHBondContact O-CA 3.18Å; S752-I759 PolarHBondContact N-O 2.94Å; S752-I759 PolarHBondContact O-N 3.32Å
753	R	80.2	Confident	84.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	123.6	172.1	-174.4	-169.5	56.9	79.1	14.8	109.9	L683 F685 M686 F724 F726 A755 S757	L683-R753 PolarHBondContact O-NH1 3.23Å; L683-R753 PolarHBondContact O-NH2 2.98Å; F685-R753 CarbonylContact C-O 3.53Å; F685-R753 VanDerWaalsContact CA-O 3.32Å; F685-R753 WeakPolarHBondContact CA-O 3.15Å; M686-R753 HydrophobicContact CG-CB 3.81Å; M686-R753 PolarHBondContact N-O 2.04Å; M686-R753 PolarHBondContact O-N 2.66Å; M686-R753 HydrophobicContact SD-CB 4.25Å; M686-R753 PolarHBondContact SD-NE 3.08Å; M686-R753 VanDerWaalsContact SD-NE 3.45Å; M686-R753 PolarHBondContact SD-NH2 2.77Å; F724-R753 HydrophobicContact CE1-CB 4.15Å; F724-R753 HydrophobicContact CZ-CB 4.13Å; F726-R753 HydrophobicContact CD2-CG 4.41Å; F726-R753 HydrophobicContact CE1-CG 4.19Å; F726-R753 HydrophobicContact CE2-CG 3.88Å; F726-R753 HydrophobicContact CZ-CG 3.77Å; R753-A755 WeakPolarHBondContact CG-O 3.36Å; R753-A755 PolarHBondContact NH1-O 3.1Å; R753-S757 CarbonylContact C-O 3.53Å; R753-S757 WeakPolarHBondContact CA-O 3.18Å; R753-S757 VanDerWaalsContact CG-O 3.31Å; R753-S757 WeakPolarHBondContact CG-O 3.48Å
754	T	67	Low	84.2	Confident	78 Å²	78	40.6 Å²	40.6	48%	0.479	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	116	171.6	-53.1	0	0	0	0	108.7	F685 K756 S757	F685-T754 WeakPolarHBondContact CD2-OG1 3.39Å; T754-K756 PolarHBondContact O-N 3.06Å; T754-S757 PolarHBondContact N-O 3.11Å; T754-S757 PolarHBondContact O-N 2.79Å
755	A	66	Low	83.9	Confident	31 Å²	31	37.6 Å²	37.6	26%	0.256	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	-118.2	-170.5	0	0	0	0	0	111.7	S684 R753 T777	S684-A755 PolarHBondContact O-N 3.17Å; R753-A755 WeakPolarHBondContact CG-O 3.36Å; R753-A755 PolarHBondContact NH1-O 3.1Å; A755-T777 CarbonylContact C-O 3.4Å; A755-T777 VanDerWaalsContact CA-O 3.29Å; A755-T777 WeakPolarHBondContact CA-O 3.31Å; A755-T777 HydrophobicContact CB-CG2 3.95Å
756	K	70.6	Confident	82.8	Confident	45 Å²	45	41.7 Å²	41.7	20%	0.196	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-19.6	175.4	-66.1	169.2	-173	167.9	0	113.7	F726 T754 I771 A772 G774 A775 F776 T777	F726-K756 VanDerWaalsContact CE2-O 3.3Å; F726-K756 WeakPolarHBondContact CE2-O 3.42Å; F726-K756 VanDerWaalsContact CZ-O 3.29Å; F726-K756 WeakPolarHBondContact CZ-O 3.13Å; T754-K756 PolarHBondContact O-N 3.06Å; K756-I771 HydrophobicContact CB-CG2 3.7Å; K756-I771 VanDerWaalsContact O-CA 3.32Å; K756-I771 WeakPolarHBondContact O-CA 3.33Å; K756-A772 HydrophobicContact CB-CB 4.32Å; K756-A772 WeakPolarHBondContact CD-O 3.46Å; K756-A772 PolarHBondContact O-N 2.58Å; K756-G774 WeakPolarHBondContact CE-O 3.49Å; K756-G774 PolarHBondContact NZ-O 3.06Å; K756-A775 WeakPolarHBondContact CE-O 3.45Å; K756-A775 PolarHBondContact NZ-O 3.37Å; K756-F776 VanDerWaalsContact CE-C 3.49Å; K756-F776 WeakPolarHBondContact CE-O 3.41Å; K756-F776 WeakPolarHBondContact CG-O 3.27Å; K756-T777 HydrophobicContact CD-CG2 4.47Å; K756-T777 HydrophobicContact CG-CG2 4.29Å
757	S	70.4	Confident	81.8	Confident	37 Å²	37	43 Å²	43	26%	0.259	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	125.8	-176.6	168.5	0	0	0	0	109.1	R753 T754 G770	R753-S757 CarbonylContact C-O 3.53Å; R753-S757 WeakPolarHBondContact CA-O 3.18Å; R753-S757 VanDerWaalsContact CG-O 3.31Å; R753-S757 WeakPolarHBondContact CG-O 3.48Å; T754-S757 PolarHBondContact N-O 3.11Å; T754-S757 PolarHBondContact O-N 2.79Å; S757-G770 CarbonylContact C-O 3.6Å; S757-G770 WeakPolarHBondContact CA-O 3.42Å
758	G	76.3	Confident	81.3	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	156.8	167.3	0	0	0	0	0	111	I735 S752 E769 G770	I735-G758 VanDerWaalsContact CD1-CA 3.46Å; I735-G758 VanDerWaalsContact CD1-O 3.27Å; I735-G758 WeakPolarHBondContact CD1-O 3.46Å; S752-G758 CarbonylContact O-C 3.57Å; S752-G758 VanDerWaalsContact O-CA 3.25Å; S752-G758 WeakPolarHBondContact O-CA 3.18Å; G758-E769 WeakPolarHBondContact O-CA 3.48Å; G758-G770 PolarHBondContact N-O 3.19Å; G758-G770 PolarHBondContact O-N 3.29Å; G758-G770 VanDerWaalsContact O-N 3.09Å
759	I	74.5	Confident	80.6	Confident	52 Å²	52	47.8 Å²	47.8	27%	0.267	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	134.7	171.3	-49.4	-176.8	0	0	0	107.3	V751 S752 P767 M768 E769	V751-I759 CarbonylContact C-O 3.24Å; V751-I759 VanDerWaalsContact CA-O 3.25Å; V751-I759 WeakPolarHBondContact CA-O 3.21Å; S752-I759 PolarHBondContact N-O 2.94Å; S752-I759 PolarHBondContact O-N 3.32Å; I759-P767 HydrophobicContact CG2-CB 3.93Å; I759-M768 CarbonylContact C-O 3.54Å; I759-M768 WeakPolarHBondContact CA-O 3.45Å; I759-E769 HydrophobicContact CG1-CG 4.21Å; I759-E769 HydrophobicContact CG2-CG 4.44Å
760	L	90.8	Very high	79.6	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	130.8	168.7	176.3	152.1	0	0	0	109	L722 F724 I735 L749 V751 P767 M768	L722-L760 HydrophobicContact CB-CD1 4.05Å; F724-L760 HydrophobicContact CB-CB 4.4Å; F724-L760 HydrophobicContact CB-CD1 3.85Å; I735-L760 HydrophobicContact CB-CB 4.49Å; I735-L760 HydrophobicContact CG2-CB 3.78Å; L749-L760 HydrophobicContact CD1-CD1 4.2Å; L749-L760 HydrophobicContact CD1-CG 3.94Å; V751-L760 HydrophobicContact CG1-CB 4Å; V751-L760 HydrophobicContact CG1-CD1 4.07Å; V751-L760 HydrophobicContact CG1-CG 3.93Å; L760-P767 WeakPolarHBondContact O-CA 3.42Å; L760-M768 PolarHBondContact N-O 2.94Å; L760-M768 PolarHBondContact O-N 2.88Å
761	Q	84.8	Confident	79.3	Confident	60 Å²	60	50 Å²	50	28%	0.28	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	135.4	167.7	-174.5	176.6	18.8	0	0	108.8	L749 R750 Q765 P767	L749-Q761 WeakPolarHBondContact CD1-O 3.22Å; R750-Q761 PolarHBondContact N-O 2.94Å; R750-Q761 PolarHBondContact O-N 3.09Å; R750-Q761 VanDerWaalsContact O-O 3.12Å; Q761-Q765 WeakPolarHBondContact CG-O 3.38Å; Q761-Q765 PolarHBondContact NE2-O 3.46Å; Q761-P767 HydrophobicContact CB-CB 4.44Å; Q761-P767 HydrophobicContact CB-CG 4.41Å; Q761-P767 HydrophobicContact CG-CG 4.26Å
762	V	94.3	Very high	78.7	Confident	1 Å²	1	50 Å²	50	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	131	172	64	0	0	0	0	109.6	L722 I741 H747 E748 L749 N764 Q765	L722-V762 HydrophobicContact CD1-CB 4.08Å; L722-V762 HydrophobicContact CD1-CG2 3.83Å; I741-V762 HydrophobicContact CG2-CG1 4.1Å; I741-V762 HydrophobicContact CG2-CG2 3.94Å; H747-V762 HydrophobicContact CB-CG2 4.4Å; E748-V762 WeakPolarHBondContact O-CA 3.45Å; L749-V762 HydrophobicContact CD1-CB 4.4Å; V762-N764 PolarHBondContact O-N 2.93Å; V762-Q765 HydrophobicContact CG1-CB 4.31Å; V762-Q765 VanDerWaalsContact CG1-CD 3.45Å; V762-Q765 HydrophobicContact CG1-CG 4.02Å; V762-Q765 WeakPolarHBondContact O-CB 3.38Å; V762-Q765 WeakPolarHBondContact O-CG 3.12Å; V762-Q765 PolarHBondContact O-N 2.88Å
763	D	91.5	Very high	78.6	Confident	57 Å²	57	55.5 Å²	55.5	31%	0.305	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	-126.9	-174.2	-46.1	-41.9	0	0	0	112.1	H747 E748	H747-D763 VanDerWaalsContact CA-OD1 3.24Å; H747-D763 WeakPolarHBondContact CA-OD1 3.37Å; H747-D763 IonicContact CE1-OD2 3.02Å; H747-D763 PolarHBondContact CE1-OD2 2.7Å; H747-D763 IonicContact CG-OD1 2.73Å; H747-D763 IonicContact CG-OD2 3.33Å; H747-D763 IonicContact ND1-OD1 3.2Å; H747-D763 IonicContact ND1-OD2 2.69Å; H747-D763 PolarHBondContact ND1-OD2 2.85Å; E748-D763 PolarHBondContact N-OD1 3.35Å; E748-D763 PolarHBondContact O-N 3.12Å
764	N	82.9	Confident	77.9	Confident	166 Å²	166	58 Å²	58	89%	0.888	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	13	174	-59.4	-71.1	0	0	0	112.8	V762	V762-N764 PolarHBondContact O-N 2.93Å
765	Q	86.5	Confident	77.4	Confident	25 Å²	25	57.8 Å²	57.8	12%	0.117	33%	0.325	C	S	.	.	S	Bend	trans	-62.5	160.2	171	-62.3	-171.4	17.6	0	0	110.1	E739 Q761 V762	E739-Q765 VanDerWaalsContact N-OE1 3.08Å; E739-Q765 PolarHBondContact O-NE2 2.94Å; Q761-Q765 WeakPolarHBondContact CG-O 3.38Å; Q761-Q765 PolarHBondContact NE2-O 3.46Å; V762-Q765 HydrophobicContact CG1-CB 4.31Å; V762-Q765 VanDerWaalsContact CG1-CD 3.45Å; V762-Q765 HydrophobicContact CG1-CG 4.02Å; V762-Q765 WeakPolarHBondContact O-CB 3.38Å; V762-Q765 WeakPolarHBondContact O-CG 3.12Å; V762-Q765 PolarHBondContact O-N 2.88Å
766	K	72.5	Confident	77.2	Confident	119 Å²	119	62 Å²	62	52%	0.517	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-63.6	138	174.1	-174.7	175.2	128.7	-136.9	0	110.5	E738 M768	E738-K766 IonicContact OE1-NZ 3.93Å; E738-K766 PolarHBondContact OE1-NZ 2.82Å; E738-K766 WeakPolarHBondContact OE2-CB 3.43Å; K766-M768 PolarHBondContact O-N 2.71Å
767	P	73.9	Confident	77	Confident	57 Å²	57	63.1 Å²	63.1	37%	0.37	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-59.1	130.5	168.9	-22.9	33.1	0	0	0	111.3	I759 L760 Q761	I759-P767 HydrophobicContact CG2-CB 3.93Å; L760-P767 WeakPolarHBondContact O-CA 3.42Å; Q761-P767 HydrophobicContact CB-CB 4.44Å; Q761-P767 HydrophobicContact CB-CG 4.41Å; Q761-P767 HydrophobicContact CG-CG 4.26Å
768	M	85.8	Confident	76.9	Confident	53 Å²	53	65.6 Å²	65.6	26%	0.261	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	133.1	176.6	-64.7	-62.5	-73.8	0	0	108.7	I735 R736 E738 I759 L760 K766	I735-M768 HydrophobicContact CG2-CB 3.98Å; I735-M768 WeakPolarHBondContact CG2-O 3.31Å; R736-M768 WeakPolarHBondContact O-CB 3.49Å; R736-M768 WeakPolarHBondContact O-CG 3.47Å; E738-M768 HydrophobicContact CB-CG 4.27Å; E738-M768 HydrophobicContact CB-SD 4Å; E738-M768 HydrophobicContact CG-SD 4.42Å; I759-M768 CarbonylContact C-O 3.54Å; I759-M768 WeakPolarHBondContact CA-O 3.45Å; L760-M768 PolarHBondContact N-O 2.94Å; L760-M768 PolarHBondContact O-N 2.88Å; K766-M768 PolarHBondContact O-N 2.71Å
769	E	78.1	Confident	77	Confident	111 Å²	111	65.6 Å²	65.6	52%	0.519	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	154.7	-175.4	-56.9	-170.8	179.2	0	0	111.4	L96 G758 I759	L96-E769 VanDerWaalsContact CD2-OE1 3.31Å; L96-E769 WeakPolarHBondContact CD2-OE1 3.48Å; L96-E769 WeakPolarHBondContact CD2-OE2 3.24Å; G758-E769 WeakPolarHBondContact O-CA 3.48Å; I759-E769 HydrophobicContact CG1-CG 4.21Å; I759-E769 HydrophobicContact CG2-CG 4.44Å
770	G	75.3	Confident	77.2	Confident	17 Å²	17	65.6 Å²	65.6	18%	0.175	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	168.9	172.6	0	0	0	0	0	111.9	S757 G758	S757-G770 CarbonylContact C-O 3.6Å; S757-G770 WeakPolarHBondContact CA-O 3.42Å; G758-G770 PolarHBondContact N-O 3.19Å; G758-G770 PolarHBondContact O-N 3.29Å; G758-G770 VanDerWaalsContact O-N 3.09Å
771	I	77.4	Confident	76.8	Confident	118 Å²	118	66.1 Å²	66.1	61%	0.605	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.4	129.2	-171.1	-54.2	-179	0	0	0	109.6	K756	K756-I771 HydrophobicContact CB-CG2 3.7Å; K756-I771 VanDerWaalsContact O-CA 3.32Å; K756-I771 WeakPolarHBondContact O-CA 3.33Å
772	A	75.3	Confident	76.8	Confident	3 Å²	3	66.1 Å²	66.1	3%	0.025	37%	0.366	C	S	.	.			trans	-71.3	145.7	174.8	0	0	0	0	0	112.1	F726 A733 K756	F726-A772 HydrophobicContact CD2-CB 3.96Å; F726-A772 HydrophobicContact CE2-CB 3.57Å; A733-A772 HydrophobicContact CB-CB 3.98Å; K756-A772 HydrophobicContact CB-CB 4.32Å; K756-A772 WeakPolarHBondContact CD-O 3.46Å; K756-A772 PolarHBondContact O-N 2.58Å
773	E	77.1	Confident	76.5	Confident	135 Å²	135	67.2 Å²	67.2	63%	0.631	37%	0.374	S	S	*	.			trans	-79.2	168.7	-173.3	-58.5	-165.6	138.4	0	0	114.2	S730	S730-E773 CarbonylContact C-O 3.15Å; S730-E773 CarbonylContact O-C 3.59Å; S730-E773 PolarHBondContact OG-O 3.42Å
774	G	65.1	Low	76.5	Confident	53 Å²	53	66.2 Å²	66.2	55%	0.546	37%	0.371	S	S	.	.	S	Bend	trans	73.6	-144.7	176	0	0	0	0	0	114.2	S730 K756	S730-G774 WeakPolarHBondContact OG-CA 3.42Å; K756-G774 WeakPolarHBondContact CE-O 3.49Å; K756-G774 PolarHBondContact NZ-O 3.06Å
775	A	56.7	Low	77	Confident	72 Å²	72	58.3 Å²	58.3	60%	0.595	33%	0.329	S	S	*	.	S	Bend	trans	-102.3	-36.1	-163	0	0	0	0	0	114.5	S730 K756	S730-A775 PolarHBondContact OG-N 2.71Å; K756-A775 WeakPolarHBondContact CE-O 3.45Å; K756-A775 PolarHBondContact NZ-O 3.37Å
776	F	62.3	Low	77.4	Confident	121 Å²	121	59 Å²	59	53%	0.531	33%	0.33	S	S	.	.			trans	-79.5	139.8	-166	-57.9	-65.3	0	0	0	113.7	C728 S730 K756	C728-F776 HydrophobicContact CB-CB 4.23Å; C728-F776 WeakPolarHBondContact CB-O 3.32Å; C728-F776 WeakPolarHBondContact O-CB 3.05Å; S730-F776 PolarHBondContact OG-N 3.03Å; K756-F776 VanDerWaalsContact CE-C 3.49Å; K756-F776 WeakPolarHBondContact CE-O 3.41Å; K756-F776 WeakPolarHBondContact CG-O 3.27Å
777	T	65.9	Low	78.6	Confident	67 Å²	67	53.5 Å²	53.5	41%	0.411	31%	0.307	S	S	.	.			trans	-112.4	-5.3	-179	52.8	0	0	0	0	113.2	A755 K756	A755-T777 CarbonylContact C-O 3.4Å; A755-T777 VanDerWaalsContact CA-O 3.29Å; A755-T777 WeakPolarHBondContact CA-O 3.31Å; A755-T777 HydrophobicContact CB-CG2 3.95Å; K756-T777 HydrophobicContact CD-CG2 4.47Å; K756-T777 HydrophobicContact CG-CG2 4.29Å
778	Q	68.6	Low	79.6	Confident	89 Å²	89	50.8 Å²	50.8	42%	0.416	29%	0.289	S	S	.	.			trans	-106.5	144.7	-177.4	-74.4	179.4	-39.6	0	0	107.8	Y682 C728	Y682-Q778 VanDerWaalsContact CB-CD 3.49Å; Y682-Q778 HydrophobicContact CD1-CB 3.95Å; Y682-Q778 HydrophobicContact CD1-CG 4.49Å; Y682-Q778 HydrophobicContact CG-CB 4.25Å; Y682-Q778 HydrophobicContact CG-CG 4.34Å; C728-Q778 WeakPolarHBondContact CB-O 3.44Å
779	I	76.9	Confident	80.1	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-118.5	139.3	167.6	-161.7	176.4	0	0	0	108.9	L683 M686 D711 F712 L713 D727	L683-I779 HydrophobicContact CB-CG2 3.94Å; L683-I779 PolarHBondContact N-O 2.83Å; M686-I779 HydrophobicContact CE-CG2 4Å; D711-I779 HydrophobicContact CB-CG1 3.79Å; D711-I779 WeakPolarHBondContact OD2-CA 3.07Å; F712-I779 WeakPolarHBondContact O-CD1 3.49Å; L713-I779 HydrophobicContact CB-CD1 4.41Å; D727-I779 WeakPolarHBondContact O-CD1 3.48Å
780	N	80.6	Confident	80.9	Confident	51 Å²	51	43.1 Å²	43.1	27%	0.273	25%	0.253	S	S	.	.			trans	-106.3	125.9	167.2	176.6	34.4	0	0	0	109	D706 D711	D706-N780 WeakPolarHBondContact CB-O 3.48Å; D706-N780 PolarHBondContact OD1-ND2 2.84Å; D711-N780 WeakPolarHBondContact CB-O 3.47Å; D711-N780 PolarHBondContact OD2-N 3.4Å
781	C	82	Confident	81.7	Confident	12 Å²	12	44.8 Å²	44.8	8%	0.081	26%	0.261	C	S	.	.			trans	-127.6	103.8	170.5	-60.6	0	0	0	0	107.3	W675 S704 D705	W675-C781 HydrophobicContact CZ2-CB 3.81Å; S704-C781 WeakPolarHBondContact OG-CB 3.42Å; D705-C781 CarbonylContact O-C 3.13Å; D705-C781 WeakPolarHBondContact O-CA 3.23Å
782	S	83.8	Confident	82.2	Confident	60 Å²	60	41.4 Å²	41.4	42%	0.42	24%	0.244	S	C	.	.			trans	-92.8	-25.7	179.8	59	0	0	0	0	113	D705 D706	D705-S782 PolarHBondContact O-N 2.77Å; D706-S782 WeakPolarHBondContact OD1-CB 3.24Å; D706-S782 PolarHBondContact OD1-OG 2.97Å
783	S	89.4	Confident	82.7	Confident	24 Å²	24	42.9 Å²	42.9	17%	0.168	25%	0.249	C	C	.	.	S	Bend	trans	-60.3	150.7	167.6	-71.3	0	0	0	0	111.2	W675 S704 D705	W675-S783 PolarHBondContact NE1-O 3.01Å; S704-S783 PolarHBondContact OG-O 3.07Å; D705-S783 VanDerWaalsContact O-CB 3.26Å; D705-S783 WeakPolarHBondContact O-CB 3.25Å; D705-S783 PolarHBondContact O-N 3.17Å; D705-S783 PolarHBondContact O-OG 2.83Å; D705-S783 WeakPolarHBondContact OD1-CB 3.36Å; D705-S783 PolarHBondContact OD1-OG 2.82Å
784	P	91	Very high	83	Confident	36 Å²	36	40.3 Å²	40.3	23%	0.234	24%	0.237	C	C	.	.			trans	-64.1	165.9	170.5	31.7	-36.3	0	0	0	111	V672 S704 Y786	V672-P784 HydrophobicContact CG1-CB 3.65Å; V672-P784 HydrophobicContact CG1-CG 3.58Å; S704-P784 PolarHBondContact OG-O 2.84Å; P784-Y786 HydrophobicContact CG-CE1 3.98Å; P784-Y786 HydrophobicContact CG-CE2 3.98Å; P784-Y786 WeakPolarHBondContact O-CD2 3.1Å; P784-Y786 PolarHBondContact O-N 3.02Å
785	L	92.3	Very high	84.1	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	107.1	174	-166.5	71.2	0	0	0	109.2	I673 W675 F688 L702 L787 L813	I673-L785 HydrophobicContact CB-CB 4.45Å; I673-L785 PolarHBondContact N-O 2.84Å; I673-L785 WeakPolarHBondContact O-CB 3.24Å; I673-L785 PolarHBondContact O-N 2.89Å; W675-L785 HydrophobicContact CH2-CD1 4.17Å; W675-L785 HydrophobicContact CZ2-CD1 4.02Å; F688-L785 HydrophobicContact CE1-CD1 4.25Å; F688-L785 HydrophobicContact CE1-CD2 3.99Å; F688-L785 HydrophobicContact CZ-CD1 4.38Å; L702-L785 HydrophobicContact CD1-CD1 3.96Å; L702-L785 HydrophobicContact CD1-CD2 4.17Å; L702-L785 HydrophobicContact CD1-CG 4.29Å; L702-L785 HydrophobicContact CD2-CD1 3.72Å; L702-L785 HydrophobicContact CG-CD1 3.73Å; L702-L785 HydrophobicContact CG-CG 4.22Å; L785-L787 HydrophobicContact CD2-CD2 4.45Å; L785-L787 HydrophobicContact CG-CD2 4.41Å; L785-L813 HydrophobicContact CD2-CD2 3.8Å
786	Y	96.1	Very high	85.8	Confident	40 Å²	40	42.9 Å²	42.9	16%	0.157	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	141.3	173.7	-61.2	-75.8	0	0	0	110.3	Y670 A671 V672 L702 Y703 P784 G789 V790 P791	Y670-Y786 HydrophobicContact CD2-CD1 4.5Å; A671-Y786 WeakPolarHBondContact O-CA 3.25Å; V672-Y786 HydrophobicContact CG1-CD1 4.38Å; V672-Y786 HydrophobicContact CG1-CE1 4.12Å; V672-Y786 HydrophobicContact CG2-CD1 3.95Å; V672-Y786 HydrophobicContact CG2-CE1 3.97Å; L702-Y786 CarbonylContact C-O 3.57Å; L702-Y786 VanDerWaalsContact CA-O 3.31Å; L702-Y786 WeakPolarHBondContact CA-O 3.49Å; Y703-Y786 HydrophobicContact CD1-CD2 4.02Å; Y703-Y786 PolarHBondContact N-O 2.87Å; Y703-Y786 PolarHBondContact O-N 2.7Å; P784-Y786 HydrophobicContact CG-CE1 3.98Å; P784-Y786 HydrophobicContact CG-CE2 3.98Å; P784-Y786 WeakPolarHBondContact O-CD2 3.1Å; P784-Y786 PolarHBondContact O-N 3.02Å; Y786-G789 WeakPolarHBondContact CB-O 3.37Å; Y786-V790 HydrophobicContact CD2-CG1 4.28Å; Y786-V790 HydrophobicContact CG-CG1 4.12Å; Y786-P791 HydrophobicContact CD1-CG 4.37Å; Y786-P791 HydrophobicContact CE1-CG 3.65Å
787	L	96.8	Very high	87.2	Confident	3 Å²	3	39.2 Å²	39.2	2%	0.016	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	141.8	177.8	-58.4	176.2	0	0	0	111.7	F663 Y670 A671 I673 L701 L702 L785 G789 L813 I822	F663-L787 WeakPolarHBondContact CE1-O 3.34Å; Y670-L787 WeakPolarHBondContact CA-O 3.44Å; A671-L787 HydrophobicContact CB-CB 4.06Å; A671-L787 PolarHBondContact N-O 3.48Å; A671-L787 PolarHBondContact O-N 2.86Å; I673-L787 HydrophobicContact CD1-CD1 3.55Å; I673-L787 HydrophobicContact CG1-CD1 4.21Å; L701-L787 WeakPolarHBondContact O-CA 3.41Å; L702-L787 HydrophobicContact CB-CD2 3.89Å; L702-L787 HydrophobicContact CD1-CD2 3.84Å; L702-L787 HydrophobicContact CG-CD2 3.85Å; L785-L787 HydrophobicContact CD2-CD2 4.45Å; L785-L787 HydrophobicContact CG-CD2 4.41Å; L787-G789 PolarHBondContact O-N 3.28Å; L787-L813 HydrophobicContact CD1-CD2 3.71Å; L787-L813 HydrophobicContact CD2-CD2 3.95Å; L787-L813 HydrophobicContact CG-CD2 4.4Å; L787-I822 HydrophobicContact CD1-CD1 3.81Å; L787-I822 HydrophobicContact CD1-CG1 4.1Å; L787-I822 HydrophobicContact CD1-CG2 4.34Å
788	G	95.6	Very high	88.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.22	C	C	.	.	S	Bend	trans	67.1	-7	177.6	0	0	0	0	0	115.7	V700 L701 F806	V700-G788 CarbonylContact O-C 3.59Å; V700-G788 VanDerWaalsContact O-C 3.27Å; V700-G788 VanDerWaalsContact O-CA 3.26Å; V700-G788 WeakPolarHBondContact O-CA 3.42Å; L701-G788 PolarHBondContact O-N 2.77Å; G788-F806 PolarHBondContact O-N 2.81Å
789	G	95.7	Very high	89.2	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.01	22%	0.218	C	C	.	.	S	Bend	trans	173.2	177.8	-179.6	0	0	0	0	0	110.6	Y670 Y786 L787 Y793	Y670-G789 VanDerWaalsContact CB-C 3.44Å; Y670-G789 WeakPolarHBondContact CB-O 3.27Å; Y786-G789 WeakPolarHBondContact CB-O 3.37Å; L787-G789 PolarHBondContact O-N 3.28Å; G789-Y793 WeakPolarHBondContact CA-OH 3.46Å
790	V	95	Very high	89.9	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.012	22%	0.218	C	C	.	.			trans	-128.3	156.1	171.7	-68.5	0	0	0	0	110.3	Y703 Y786 D792 Y793 T796 V802	Y703-V790 HydrophobicContact CD1-CG1 3.67Å; Y703-V790 HydrophobicContact CG-CG1 4.07Å; Y786-V790 HydrophobicContact CD2-CG1 4.28Å; Y786-V790 HydrophobicContact CG-CG1 4.12Å; V790-D792 VanDerWaalsContact C-N 3.25Å; V790-D792 WeakPolarHBondContact CG2-O 3.31Å; V790-D792 PolarHBondContact O-N 2.8Å; V790-Y793 HydrophobicContact CG2-CD1 3.54Å; V790-Y793 HydrophobicContact CG2-CD2 3.78Å; V790-Y793 HydrophobicContact CG2-CE1 3.45Å; V790-Y793 VanDerWaalsContact CG2-CE1 3.45Å; V790-Y793 HydrophobicContact CG2-CE2 3.69Å; V790-Y793 HydrophobicContact CG2-CG 3.68Å; V790-Y793 VanDerWaalsContact CG2-CZ 3.49Å; V790-Y793 PolarHBondContact N-OH 2.92Å; V790-Y793 VanDerWaalsContact N-OH 3.13Å; V790-Y793 WeakPolarHBondContact O-CE2 3.24Å; V790-T796 HydrophobicContact CB-CG2 4.49Å; V790-T796 HydrophobicContact CG1-CG2 4.35Å; V790-T796 HydrophobicContact CG2-CG2 3.91Å; V790-V802 HydrophobicContact CG1-CG1 4.16Å; V790-V802 HydrophobicContact CG2-CG1 3.98Å
791	P	91.3	Very high	90.4	Very high	52 Å²	52	42.5 Å²	42.5	34%	0.338	22%	0.216	S	C	.	.	S	Bend	trans	-65.8	-26	177.4	26.1	-36.6	0	0	0	113.8	Y670 Y786	Y670-P791 HydrophobicContact CE1-CB 4.22Å; Y670-P791 HydrophobicContact CE2-CB 4.07Å; Y786-P791 HydrophobicContact CD1-CG 4.37Å; Y786-P791 HydrophobicContact CE1-CG 3.65Å
792	D	88.2	Confident	90.8	Very high	48 Å²	48	42 Å²	42	26%	0.257	21%	0.213	S	C	.	.			trans	-152.9	120.4	-178	-174.9	-28.7	0	0	0	108.3	V790 E794 K795	V790-D792 VanDerWaalsContact C-N 3.25Å; V790-D792 WeakPolarHBondContact CG2-O 3.31Å; V790-D792 PolarHBondContact O-N 2.8Å; D792-E794 WeakPolarHBondContact OD1-CB 3.45Å; D792-E794 PolarHBondContact OD1-N 3.45Å; D792-K795 HydrophobicContact CB-CB 4.36Å; D792-K795 HydrophobicContact CB-CD 4.31Å; D792-K795 HydrophobicContact CB-CG 4.35Å; D792-K795 PolarHBondContact OD1-N 2.03Å; D792-K795 WeakPolarHBondContact OD2-CD 3.02Å; D792-K795 WeakPolarHBondContact OD2-CG 3.28Å; D792-K795 IonicContact OD2-NZ 3.9Å; D792-K795 PolarHBondContact OD2-NZ 3.44Å
793	Y	87.3	Confident	90.8	Very high	33 Å²	33	46.4 Å²	46.4	13%	0.129	23%	0.228	C	C	.	.	S	Bend	trans	-81.6	-29.8	-177.4	-71.8	-94.6	0	0	0	112.2	F668 V700 G789 V790 K795 T796 V802 K804 P805	F668-Y793 HydrophobicContact CE1-CE2 4.4Å; F668-Y793 HydrophobicContact CE2-CD2 4.14Å; F668-Y793 AromaticContact CE2-CE2 3.85Å; F668-Y793 HydrophobicContact CE2-CE2 3.85Å; F668-Y793 AromaticContact CZ-CD2 3.86Å; F668-Y793 HydrophobicContact CZ-CD2 3.86Å; F668-Y793 AromaticContact CZ-CE2 3.63Å; F668-Y793 HydrophobicContact CZ-CE2 3.63Å; V700-Y793 HydrophobicContact CG1-CE1 4.28Å; G789-Y793 WeakPolarHBondContact CA-OH 3.46Å; V790-Y793 HydrophobicContact CG2-CD1 3.54Å; V790-Y793 HydrophobicContact CG2-CD2 3.78Å; V790-Y793 HydrophobicContact CG2-CE1 3.45Å; V790-Y793 VanDerWaalsContact CG2-CE1 3.45Å; V790-Y793 HydrophobicContact CG2-CE2 3.69Å; V790-Y793 HydrophobicContact CG2-CG 3.68Å; V790-Y793 VanDerWaalsContact CG2-CZ 3.49Å; V790-Y793 PolarHBondContact N-OH 2.92Å; V790-Y793 VanDerWaalsContact N-OH 3.13Å; V790-Y793 WeakPolarHBondContact O-CE2 3.24Å; Y793-K795 VanDerWaalsContact C-N 3.27Å; Y793-K795 PolarHBondContact O-N 2.81Å; Y793-T796 WeakPolarHBondContact O-CB 3.16Å; Y793-T796 PolarHBondContact O-N 3.19Å; Y793-T796 VanDerWaalsContact O-N 3.16Å; Y793-T796 PolarHBondContact O-OG1 2.88Å; Y793-V802 HydrophobicContact CD1-CG1 3.92Å; Y793-V802 WeakPolarHBondContact CD1-O 3.25Å; Y793-V802 HydrophobicContact CE1-CG1 3.88Å; Y793-K804 VanDerWaalsContact CE1-C 3.42Å; Y793-P805 HydrophobicContact CE2-CG 4.3Å; Y793-P805 VanDerWaalsContact OH-CA 3.25Å; Y793-P805 WeakPolarHBondContact OH-CA 3.45Å; Y793-P805 WeakPolarHBondContact OH-CD 3Å; Y793-P805 VanDerWaalsContact OH-CG 3.27Å; Y793-P805 WeakPolarHBondContact OH-CG 3.38Å; Y793-P805 VanDerWaalsContact OH-N 3.16Å
794	E	82.4	Confident	90.8	Very high	82 Å²	82	48.2 Å²	48.2	38%	0.383	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-27.4	-178.9	-55.2	-54.3	150.1	0	0	112.3	R599 L603 D792 T796	R599-E794 IonicContact CZ-OE1 3.74Å; R599-E794 IonicContact NH1-OE1 2.99Å; R599-E794 PolarHBondContact NH1-OE1 2.69Å; R599-E794 IonicContact NH2-OE1 3.08Å; R599-E794 PolarHBondContact NH2-OE1 3.4Å; R599-E794 IonicContact NH2-OE2 2.75Å; L603-E794 HydrophobicContact CD2-CB 4.28Å; L603-E794 HydrophobicContact CD2-CG 4.28Å; D792-E794 WeakPolarHBondContact OD1-CB 3.45Å; D792-E794 PolarHBondContact OD1-N 3.45Å; E794-T796 VanDerWaalsContact C-N 3.28Å
795	K	87.9	Confident	90.9	Very high	162 Å²	162	47.1 Å²	47.1	70%	0.704	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-7.4	175.7	-69	-173.6	177.1	84.5	0	113.8	D792 Y793	D792-K795 HydrophobicContact CB-CB 4.36Å; D792-K795 HydrophobicContact CB-CD 4.31Å; D792-K795 HydrophobicContact CB-CG 4.35Å; D792-K795 PolarHBondContact OD1-N 2.03Å; D792-K795 WeakPolarHBondContact OD2-CD 3.02Å; D792-K795 WeakPolarHBondContact OD2-CG 3.28Å; D792-K795 IonicContact OD2-NZ 3.9Å; D792-K795 PolarHBondContact OD2-NZ 3.44Å; Y793-K795 VanDerWaalsContact C-N 3.27Å; Y793-K795 PolarHBondContact O-N 2.81Å
796	T	92.3	Very high	91.1	Very high	16 Å²	16	47.1 Å²	47.1	10%	0.098	23%	0.226	C	C	.	.	S	Bend	trans	-76.1	153.7	177.5	69.5	0	0	0	0	111.7	Y703 V790 Y793 E794 R798 V802	Y703-T796 HydrophobicContact CD1-CG2 4.25Å; Y703-T796 HydrophobicContact CE1-CG2 3.83Å; Y703-T796 WeakPolarHBondContact OH-CA 3.44Å; V790-T796 HydrophobicContact CB-CG2 4.49Å; V790-T796 HydrophobicContact CG1-CG2 4.35Å; V790-T796 HydrophobicContact CG2-CG2 3.91Å; Y793-T796 WeakPolarHBondContact O-CB 3.16Å; Y793-T796 PolarHBondContact O-N 3.19Å; Y793-T796 VanDerWaalsContact O-N 3.16Å; Y793-T796 PolarHBondContact O-OG1 2.88Å; E794-T796 VanDerWaalsContact C-N 3.28Å; T796-R798 PolarHBondContact O-N 2.82Å; T796-V802 HydrophobicContact CG2-CB 4.18Å; T796-V802 HydrophobicContact CG2-CG1 3.94Å
797	K	91.4	Very high	91.2	Very high	44 Å²	44	46.4 Å²	46.4	19%	0.191	23%	0.226	C	C	.	.			trans	-65.2	121.5	174	-48.5	-58.2	176.6	167.8	0	108.5	Y703 D705 D706 S709 F712 T799 A800	Y703-K797 PolarHBondContact OH-N 3.43Å; D705-K797 HydrophobicContact CB-CG 4.39Å; D705-K797 WeakPolarHBondContact OD2-CE 3.13Å; D706-K797 VanDerWaalsContact O-CE 3.29Å; D706-K797 WeakPolarHBondContact O-CE 3.31Å; D706-K797 PolarHBondContact O-NZ 2.71Å; S709-K797 PolarHBondContact O-NZ 3.22Å; F712-K797 HydrophobicContact CB-CB 4.43Å; F712-K797 HydrophobicContact CB-CG 3.82Å; F712-K797 HydrophobicContact CD1-CB 3.82Å; F712-K797 HydrophobicContact CD1-CG 3.83Å; F712-K797 HydrophobicContact CE1-CB 4.38Å; F712-K797 HydrophobicContact CG-CB 4.19Å; F712-K797 HydrophobicContact CG-CG 4.07Å; K797-T799 PolarHBondContact O-N 3.11Å; K797-A800 HydrophobicContact CB-CB 4.32Å; K797-A800 WeakPolarHBondContact O-CB 3.43Å; K797-A800 PolarHBondContact O-N 2.68Å
798	R	86.8	Confident	91.2	Very high	195 Å²	195	46.3 Å²	46.3	74%	0.736	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-53.7	-32.1	-175.5	-70.2	-176.7	172.4	-166.5	-7.2	114.3	P602 T796 A800	P602-R798 PolarHBondContact O-NH2 2.84Å; P602-R798 VanDerWaalsContact O-NH2 3.08Å; T796-R798 PolarHBondContact O-N 2.82Å; R798-A800 VanDerWaalsContact C-N 3.34Å
799	T	90.6	Very high	91.2	Very high	60 Å²	60	47.3 Å²	47.3	37%	0.368	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-67	-29.3	174.1	36	0	0	0	0	113.5	F712 R725 E732 K797 G801	F712-T799 VanDerWaalsContact CE1-OG1 3.27Å; F712-T799 WeakPolarHBondContact CE1-OG1 3.44Å; R725-T799 PolarHBondContact NH1-O 2.98Å; E732-T799 VanDerWaalsContact OE2-CB 3.29Å; E732-T799 WeakPolarHBondContact OE2-CB 3.49Å; E732-T799 WeakPolarHBondContact OE2-CG2 3.44Å; K797-T799 PolarHBondContact O-N 3.11Å; T799-G801 PolarHBondContact O-N 2.88Å
800	A	92.3	Very high	91.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-64	-9.7	-176.8	0	0	0	0	0	115	Y703 F712 A714 N716 K797 R798 V802	Y703-A800 HydrophobicContact CD2-CB 4.34Å; Y703-A800 HydrophobicContact CE2-CB 3.75Å; F712-A800 HydrophobicContact CD2-CB 3.41Å; F712-A800 VanDerWaalsContact CD2-CB 3.41Å; F712-A800 VanDerWaalsContact CE2-CA 3.42Å; F712-A800 HydrophobicContact CE2-CB 3.55Å; F712-A800 HydrophobicContact CG-CB 3.99Å; F712-A800 HydrophobicContact CZ-CB 4.2Å; A714-A800 HydrophobicContact CB-CB 4.14Å; A714-A800 WeakPolarHBondContact CB-O 3.26Å; N716-A800 PolarHBondContact ND2-O 2.76Å; K797-A800 HydrophobicContact CB-CB 4.32Å; K797-A800 WeakPolarHBondContact O-CB 3.43Å; K797-A800 PolarHBondContact O-N 2.68Å; R798-A800 VanDerWaalsContact C-N 3.34Å; A800-V802 HydrophobicContact CB-CG2 4.13Å; A800-V802 PolarHBondContact O-N 2.83Å
801	G	90.4	Very high	90.9	Very high	22 Å²	22	48.3 Å²	48.3	23%	0.227	24%	0.235	C	C	.	.			trans	69.8	11.8	176.1	0	0	0	0	0	114.9	T799 M803	T799-G801 PolarHBondContact O-N 2.88Å; G801-M803 PolarHBondContact O-N 2.8Å
802	V	90.1	Very high	90.7	Very high	3 Å²	3	49.5 Å²	49.5	2%	0.018	23%	0.234	C	C	.	.			trans	-80.2	83.5	-177.3	-179.5	0	0	0	0	109.6	V700 Y703 A714 V790 Y793 T796 A800	V700-V802 HydrophobicContact CB-CG1 3.96Å; V700-V802 HydrophobicContact CB-CG2 4.44Å; V700-V802 HydrophobicContact CG1-CG1 3.93Å; V700-V802 HydrophobicContact CG2-CG1 3.99Å; V700-V802 HydrophobicContact CG2-CG2 3.87Å; Y703-V802 HydrophobicContact CD2-CG2 3.57Å; Y703-V802 HydrophobicContact CE2-CG2 4.13Å; Y703-V802 HydrophobicContact CG-CG2 4.08Å; A714-V802 HydrophobicContact CB-CG2 4.04Å; V790-V802 HydrophobicContact CG1-CG1 4.16Å; V790-V802 HydrophobicContact CG2-CG1 3.98Å; Y793-V802 HydrophobicContact CD1-CG1 3.92Å; Y793-V802 WeakPolarHBondContact CD1-O 3.25Å; Y793-V802 HydrophobicContact CE1-CG1 3.88Å; T796-V802 HydrophobicContact CG2-CB 4.18Å; T796-V802 HydrophobicContact CG2-CG1 3.94Å; A800-V802 HydrophobicContact CB-CG2 4.13Å; A800-V802 PolarHBondContact O-N 2.83Å
803	M	83.6	Confident	90.8	Very high	152 Å²	152	47.4 Å²	47.4	75%	0.749	22%	0.224	S	C	*	.			trans	-100.4	-23.2	-172.4	-60.2	-53.5	-54.9	0	0	115.1	G801	G801-M803 PolarHBondContact O-N 2.8Å
804	K	89.6	Confident	90.5	Very high	61 Å²	61	47.4 Å²	47.4	27%	0.265	23%	0.225	S	C	.	.	S	Bend	trans	-163.4	163.6	-178.9	62.6	169.7	-169.4	126.4	0	112.8	E665 S698 V700 Y793	E665-K804 IonicContact OE2-NZ 2.74Å; E665-K804 PolarHBondContact OE2-NZ 3.3Å; S698-K804 WeakPolarHBondContact O-CE 3.02Å; S698-K804 PolarHBondContact O-NZ 2.05Å; S698-K804 VanDerWaalsContact OG-CE 3.28Å; S698-K804 WeakPolarHBondContact OG-CE 3.3Å; V700-K804 PolarHBondContact N-O 2.82Å; V700-K804 VanDerWaalsContact N-O 3.07Å; Y793-K804 VanDerWaalsContact CE1-C 3.42Å
805	P	93.4	Very high	90.4	Very high	13 Å²	13	43.8 Å²	43.8	8%	0.084	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-62.5	162.9	177.3	-14.9	26.1	0	0	0	112.9	E665 G699 Y793	E665-P805 HydrophobicContact CB-CB 3.89Å; E665-P805 HydrophobicContact CB-CG 3.94Å; G699-P805 VanDerWaalsContact CA-O 3.23Å; G699-P805 WeakPolarHBondContact CA-O 3.07Å; Y793-P805 HydrophobicContact CE2-CG 4.3Å; Y793-P805 VanDerWaalsContact OH-CA 3.25Å; Y793-P805 WeakPolarHBondContact OH-CA 3.45Å; Y793-P805 WeakPolarHBondContact OH-CD 3Å; Y793-P805 VanDerWaalsContact OH-CG 3.27Å; Y793-P805 WeakPolarHBondContact OH-CG 3.38Å; Y793-P805 VanDerWaalsContact OH-N 3.16Å
806	F	97.2	Very high	89.6	Confident	1 Å²	1	38.3 Å²	38.3	0%	0.004	19%	0.187	C	C	.	.			trans	-88.9	142.6	166.6	168.8	-99.6	0	0	0	110.4	F663 F692 W693 P694 V700 L701 G788 G808 I810	F663-F806 HydrophobicContact CB-CD1 4.12Å; F663-F806 WeakPolarHBondContact CB-O 3.41Å; F692-F806 HydrophobicContact CD2-CE2 4.11Å; F692-F806 AromaticContact CD2-CZ 3.97Å; F692-F806 HydrophobicContact CD2-CZ 3.97Å; W693-F806 WeakPolarHBondContact O-CZ 3.29Å; P694-F806 HydrophobicContact CB-CE2 3.89Å; P694-F806 HydrophobicContact CB-CZ 4.35Å; V700-F806 WeakPolarHBondContact O-CB 3.46Å; L701-F806 HydrophobicContact CD2-CD1 4.03Å; L701-F806 HydrophobicContact CD2-CD2 3.63Å; L701-F806 HydrophobicContact CD2-CE1 3.97Å; L701-F806 HydrophobicContact CD2-CE2 3.57Å; L701-F806 HydrophobicContact CD2-CG 3.86Å; L701-F806 HydrophobicContact CD2-CZ 3.75Å; L701-F806 HydrophobicContact CG-CD2 4.27Å; L701-F806 HydrophobicContact CG-CE2 4.46Å; G788-F806 PolarHBondContact O-N 2.81Å; F806-G808 VanDerWaalsContact CE1-C 3.47Å; F806-I810 HydrophobicContact CD1-CD1 4.09Å; F806-I810 HydrophobicContact CD1-CG1 4.09Å; F806-I810 HydrophobicContact CE1-CD1 4.2Å; F806-I810 HydrophobicContact CE1-CG1 3.71Å
807	T	97.6	Very high	88.1	Confident	25 Å²	25	41.4 Å²	41.4	15%	0.153	20%	0.203	C	C	.	.			trans	-119.1	120	174	-61.8	0	0	0	0	108.7	F663 E665 S695 A696	F663-T807 WeakPolarHBondContact O-CA 3.42Å; E665-T807 WeakPolarHBondContact CB-OG1 3.17Å; E665-T807 VanDerWaalsContact CG-OG1 3.31Å; E665-T807 WeakPolarHBondContact CG-OG1 3.25Å; E665-T807 PolarHBondContact N-OG1 3.05Å; S695-T807 PolarHBondContact N-O 3.48Å; A696-T807 PolarHBondContact N-O 3.41Å
808	G	96.5	Very high	87.1	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	145.6	-172.7	-169.3	0	0	0	0	0	113.3	F663 W693 F806	F663-G808 PolarHBondContact N-O 2.82Å; F663-G808 PolarHBondContact O-N 3.48Å; W693-G808 CarbonylContact O-C 3.55Å; W693-G808 WeakPolarHBondContact O-CA 3.34Å; F806-G808 VanDerWaalsContact CE1-C 3.47Å
809	I	95.5	Very high	86.6	Confident	21 Å²	21	37.6 Å²	37.6	11%	0.108	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	137.7	-178	-42.6	169.3	0	0	0	109.3	P661 L662 F692 W693 W746	P661-I809 WeakPolarHBondContact O-CA 3.27Å; P661-I809 VanDerWaalsContact O-CG2 3.23Å; P661-I809 WeakPolarHBondContact O-CG2 3.45Å; L662-I809 HydrophobicContact CD1-CG1 4.05Å; F692-I809 CarbonylContact C-O 3.54Å; F692-I809 WeakPolarHBondContact CA-O 3.37Å; F692-I809 WeakPolarHBondContact CB-O 3.33Å; W693-I809 HydrophobicContact CB-CB 3.98Å; W693-I809 HydrophobicContact CB-CD1 4.13Å; W693-I809 HydrophobicContact CB-CG1 4.11Å; W693-I809 HydrophobicContact CG-CD1 4.15Å; W693-I809 HydrophobicContact CG-CG1 4.39Å; W693-I809 PolarHBondContact N-O 3.48Å; W693-I809 PolarHBondContact O-N 3.25Å; W746-I809 HydrophobicContact CH2-CB 4.02Å; W746-I809 HydrophobicContact CH2-CD1 4.14Å; W746-I809 HydrophobicContact CH2-CG2 3.87Å; W746-I809 HydrophobicContact CZ2-CD1 4.2Å; W746-I809 HydrophobicContact CZ3-CB 4.47Å
810	I	94.8	Very high	86.3	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	100.7	164.6	-50.6	178.1	0	0	0	107.8	P661 F663 V690 F692 L701 F806 I822	P661-I810 PolarHBondContact O-N 2.85Å; F663-I810 HydrophobicContact CD2-CB 4.3Å; F663-I810 HydrophobicContact CD2-CD1 4.08Å; F663-I810 HydrophobicContact CD2-CG1 3.89Å; F663-I810 HydrophobicContact CE2-CB 3.78Å; F663-I810 HydrophobicContact CE2-CD1 3.85Å; F663-I810 HydrophobicContact CE2-CG1 3.78Å; F663-I810 HydrophobicContact CZ-CD1 4.32Å; V690-I810 HydrophobicContact CG1-CG2 3.91Å; F692-I810 HydrophobicContact CB-CG1 4.4Å; L701-I810 HydrophobicContact CD2-CD1 3.93Å; L701-I810 HydrophobicContact CD2-CG1 4.24Å; F806-I810 HydrophobicContact CD1-CD1 4.09Å; F806-I810 HydrophobicContact CD1-CG1 4.09Å; F806-I810 HydrophobicContact CE1-CD1 4.2Å; F806-I810 HydrophobicContact CE1-CG1 3.71Å; I810-I822 HydrophobicContact CB-CD1 4.5Å; I810-I822 HydrophobicContact CG2-CD1 4Å
811	Q	89.6	Confident	85.8	Confident	23 Å²	23	38.6 Å²	38.6	11%	0.107	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-33	-172.6	-179.3	178.3	95.3	0	0	112.6	T691 W746 P852 W854	T691-Q811 PolarHBondContact O-N 2.92Å; W746-Q811 HydrophobicContact CH2-CB 3.71Å; W746-Q811 HydrophobicContact CH2-CG 4.35Å; W746-Q811 HydrophobicContact CZ3-CB 3.65Å; Q811-P852 HydrophobicContact CG-CB 3.79Å; Q811-P852 HydrophobicContact CG-CG 3.8Å; Q811-W854 PolarHBondContact NE2-O 3.5Å
812	K	86.6	Confident	85.6	Confident	76 Å²	76	38 Å²	38	33%	0.33	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	134.8	-168.4	-168.4	-168.4	-170.1	-176	0	110.4	E689 V690 T691	E689-K812 WeakPolarHBondContact OE1-CE 3.16Å; E689-K812 IonicContact OE1-NZ 2.6Å; E689-K812 PolarHBondContact OE1-NZ 3.26Å; V690-K812 WeakPolarHBondContact CA-O 3.29Å; T691-K812 PolarHBondContact N-O 3.08Å; T691-K812 PolarHBondContact O-N 2.78Å; T691-K812 VanDerWaalsContact OG1-CD 3.25Å; T691-K812 WeakPolarHBondContact OG1-CD 3.46Å
813	L	91	Very high	85.2	Confident	5 Å²	5	40.2 Å²	40.2	3%	0.026	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	128.6	163.2	-179.9	65.7	0	0	0	108.9	I673 F688 E689 V690 L702 L785 L787 M820 I822	I673-L813 HydrophobicContact CD1-CD2 4.38Å; F688-L813 HydrophobicContact CD1-CD1 4.03Å; E689-L813 CarbonylContact O-C 3.54Å; E689-L813 WeakPolarHBondContact O-CA 3.46Å; V690-L813 HydrophobicContact CG2-CD1 3.83Å; L702-L813 HydrophobicContact CD1-CD1 4.31Å; L785-L813 HydrophobicContact CD2-CD2 3.8Å; L787-L813 HydrophobicContact CD1-CD2 3.71Å; L787-L813 HydrophobicContact CD2-CD2 3.95Å; L787-L813 HydrophobicContact CG-CD2 4.4Å; L813-M820 HydrophobicContact CB-CB 4.26Å; L813-M820 HydrophobicContact CD2-CB 3.79Å; L813-M820 HydrophobicContact CD2-CG 4.3Å; L813-M820 HydrophobicContact CG-CB 3.95Å; L813-M820 HydrophobicContact CG-CG 4.35Å; L813-M820 PolarHBondContact O-N 2.9Å; L813-I822 HydrophobicContact CB-CD1 4.27Å
814	I	80.5	Confident	84.7	Confident	33 Å²	33	35.9 Å²	35.9	17%	0.169	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	139.8	164.4	-62.8	176.7	0	0	0	107.5	F688 E689 D817 R818 A819	F688-I814 VanDerWaalsContact CA-O 3.25Å; F688-I814 WeakPolarHBondContact CA-O 3.37Å; E689-I814 HydrophobicContact CB-CB 4.13Å; E689-I814 PolarHBondContact N-O 2.89Å; E689-I814 PolarHBondContact O-N 2.72Å; I814-D817 VanDerWaalsContact CG2-CA 3.47Å; I814-R818 CarbonylContact C-O 3.57Å; I814-R818 WeakPolarHBondContact CA-O 3.33Å; I814-A819 HydrophobicContact CG1-CB 4.46Å
815	L	81.9	Confident	83.6	Confident	5 Å²	5	37.2 Å²	37.2	3%	0.026	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	119.3	168.7	164.7	58	0	0	0	108.3	W675 P676 E687 F688 D817 R818 M820	W675-L815 HydrophobicContact CE3-CD2 3.78Å; W675-L815 HydrophobicContact CZ3-CD2 3.6Å; P676-L815 HydrophobicContact CG-CD2 3.92Å; E687-L815 CarbonylContact O-C 3.58Å; E687-L815 WeakPolarHBondContact O-CA 3.43Å; F688-L815 HydrophobicContact CD1-CB 4.1Å; F688-L815 HydrophobicContact CD1-CD1 4.07Å; F688-L815 HydrophobicContact CE1-CB 4.1Å; F688-L815 HydrophobicContact CE1-CD1 3.72Å; F688-L815 HydrophobicContact CE1-CD2 4.13Å; F688-L815 HydrophobicContact CE1-CG 4.18Å; F688-L815 HydrophobicContact CE2-CD1 4.19Å; F688-L815 HydrophobicContact CG-CD1 4.5Å; F688-L815 HydrophobicContact CZ-CD1 3.79Å; L815-D817 PolarHBondContact O-N 2.7Å; L815-R818 PolarHBondContact N-O 3.11Å; L815-R818 WeakPolarHBondContact O-CB 3.41Å; L815-R818 PolarHBondContact O-N 2.92Å; L815-M820 HydrophobicContact CB-CG 3.85Å; L815-M820 HydrophobicContact CB-SD 4.34Å
816	N	70.9	Confident	82.4	Confident	47 Å²	47	39.3 Å²	39.3	25%	0.251	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.1	55.6	179.8	-63.2	-20.9	0	0	0	112.3	M686 E687 R818 R1029	M686-N816 VanDerWaalsContact CA-OD1 3.31Å; M686-N816 WeakPolarHBondContact CA-OD1 3.42Å; E687-N816 PolarHBondContact N-OD1 2.97Å; E687-N816 PolarHBondContact O-N 3.4Å; N816-R818 PolarHBondContact O-N 3.28Å; N816-R1029 PolarHBondContact O-NH2 3.37Å
817	D	60.2	Low	81.8	Confident	81 Å²	81	39.9 Å²	39.9	43%	0.433	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	-1.6	-175.2	-56.7	-94.3	0	0	0	116.1	I814 L815 R1029	I814-D817 VanDerWaalsContact CG2-CA 3.47Å; L815-D817 PolarHBondContact O-N 2.7Å; D817-R1029 IonicContact OD2-CZ 2.9Å; D817-R1029 IonicContact OD2-NH1 3.77Å; D817-R1029 PolarHBondContact OD2-NH1 3.06Å; D817-R1029 IonicContact OD2-NH2 3.38Å; D817-R1029 PolarHBondContact OD2-NH2 3.4Å
818	R	69.4	Low	81.4	Confident	97 Å²	97	40.4 Å²	40.4	37%	0.366	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	117.8	173.9	-178.1	175	177	175.7	-4.6	110.3	P676 I814 L815 N816 M820	P676-R818 PolarHBondContact O-NH1 3.43Å; I814-R818 CarbonylContact C-O 3.57Å; I814-R818 WeakPolarHBondContact CA-O 3.33Å; L815-R818 PolarHBondContact N-O 3.11Å; L815-R818 WeakPolarHBondContact O-CB 3.41Å; L815-R818 PolarHBondContact O-N 2.92Å; N816-R818 PolarHBondContact O-N 3.28Å; R818-M820 HydrophobicContact CG-SD 4.24Å; R818-M820 PolarHBondContact O-N 2.57Å
819	A	77.3	Confident	81.2	Confident	62 Å²	62	41.1 Å²	41.1	51%	0.512	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	132.2	168.8	0	0	0	0	0	110.6	I814 P821	I814-A819 HydrophobicContact CG1-CB 4.46Å; A819-P821 VanDerWaalsContact O-CD 3.28Å; A819-P821 WeakPolarHBondContact O-CD 3.45Å
820	M	83.4	Confident	81.1	Confident	10 Å²	10	40.8 Å²	40.8	5%	0.049	27%	0.269	C	S	.	.			trans	-110	90.6	-178.5	-60.8	-61	-72.2	0	0	108.1	I673 P676 L813 L815 R818 I822	I673-M820 HydrophobicContact CG2-CE 3.73Å; P676-M820 HydrophobicContact CB-CE 4.26Å; P676-M820 HydrophobicContact CB-SD 4.28Å; P676-M820 HydrophobicContact CG-CE 4.28Å; P676-M820 HydrophobicContact CG-SD 4.38Å; L813-M820 HydrophobicContact CB-CB 4.26Å; L813-M820 HydrophobicContact CD2-CB 3.79Å; L813-M820 HydrophobicContact CD2-CG 4.3Å; L813-M820 HydrophobicContact CG-CB 3.95Å; L813-M820 HydrophobicContact CG-CG 4.35Å; L813-M820 PolarHBondContact O-N 2.9Å; L815-M820 HydrophobicContact CB-CG 3.85Å; L815-M820 HydrophobicContact CB-SD 4.34Å; R818-M820 HydrophobicContact CG-SD 4.24Å; R818-M820 PolarHBondContact O-N 2.57Å; M820-I822 PolarHBondContact O-N 2.97Å
821	P	83	Confident	81.1	Confident	71 Å²	71	41.7 Å²	41.7	46%	0.461	27%	0.273	S	S	.	.			trans	-65.1	127.6	-172.5	24.4	-33.5	0	0	0	112.1	A819 T823 S826	A819-P821 VanDerWaalsContact O-CD 3.28Å; A819-P821 WeakPolarHBondContact O-CD 3.45Å; P821-T823 VanDerWaalsContact C-N 3.28Å; P821-T823 PolarHBondContact O-N 2.85Å; P821-S826 WeakPolarHBondContact CG-OG 3.43Å; P821-S826 PolarHBondContact O-OG 3.12Å
822	I	86.3	Confident	81.3	Confident	9 Å²	9	40.8 Å²	40.8	5%	0.046	27%	0.269	C	S	.	.			trans	-97.1	44.7	-178.5	-36	175.8	0	0	0	109.4	L658 P661 A671 I673 L787 I810 L813 M820	L658-I822 VanDerWaalsContact CD2-O 3.32Å; L658-I822 WeakPolarHBondContact CD2-O 3.31Å; P661-I822 HydrophobicContact CB-CG2 4.47Å; P661-I822 HydrophobicContact CG-CB 3.94Å; P661-I822 HydrophobicContact CG-CG2 4.03Å; A671-I822 HydrophobicContact CB-CG2 3.82Å; I673-I822 HydrophobicContact CD1-CB 4.42Å; I673-I822 HydrophobicContact CD1-CG1 4Å; I673-I822 HydrophobicContact CD1-CG2 4.4Å; L787-I822 HydrophobicContact CD1-CD1 3.81Å; L787-I822 HydrophobicContact CD1-CG1 4.1Å; L787-I822 HydrophobicContact CD1-CG2 4.34Å; I810-I822 HydrophobicContact CB-CD1 4.5Å; I810-I822 HydrophobicContact CG2-CD1 4Å; L813-I822 HydrophobicContact CB-CD1 4.27Å; M820-I822 PolarHBondContact O-N 2.97Å
823	T	81.9	Confident	81.6	Confident	51 Å²	51	38.9 Å²	38.9	31%	0.313	27%	0.267	S	S	.	.	S	Bend	trans	-129.7	162.5	-170.8	61.2	0	0	0	0	112.6	L658 P821 G825 S826 A827	L658-T823 WeakPolarHBondContact O-CG2 3.44Å; P821-T823 VanDerWaalsContact C-N 3.28Å; P821-T823 PolarHBondContact O-N 2.85Å; T823-G825 PolarHBondContact O-N 2.93Å; T823-S826 PolarHBondContact O-N 2.78Å; T823-S826 PolarHBondContact O-OG 2.88Å; T823-S826 PolarHBondContact OG1-OG 2.78Å; T823-A827 PolarHBondContact O-N 3.48Å; T823-A827 VanDerWaalsContact O-N 3.11Å
824	A	71.4	Confident	81.6	Confident	60 Å²	60	40.3 Å²	40.3	50%	0.496	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-53.8	130.5	-175.4	0	0	0	0	0	112.2	L645	L645-A824 HydrophobicContact CD2-CB 3.94Å
825	G	68.3	Low	82.1	Confident	90 Å²	90	39.2 Å²	39.2	93%	0.928	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.3	-11.3	-177.4	0	0	0	0	0	115.5	T823	T823-G825 PolarHBondContact O-N 2.93Å
826	S	68.3	Low	82.3	Confident	56 Å²	56	44.6 Å²	44.6	39%	0.392	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-29.9	175.3	62.9	0	0	0	0	113.9	P821 T823	P821-S826 WeakPolarHBondContact CG-OG 3.43Å; P821-S826 PolarHBondContact O-OG 3.12Å; T823-S826 PolarHBondContact O-N 2.78Å; T823-S826 PolarHBondContact O-OG 2.88Å; T823-S826 PolarHBondContact OG1-OG 2.78Å
827	A	83.6	Confident	83.1	Confident	14 Å²	14	43 Å²	43	12%	0.116	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-116.8	153.7	170.6	0	0	0	0	0	110.9	L645 I673 T823	L645-A827 HydrophobicContact CD1-CB 3.92Å; I673-A827 HydrophobicContact CD1-CB 4.4Å; I673-A827 HydrophobicContact CG1-CB 3.93Å; T823-A827 PolarHBondContact O-N 3.48Å; T823-A827 VanDerWaalsContact O-N 3.11Å
828	G	89.8	Confident	84.4	Confident	36 Å²	36	41.3 Å²	41.3	37%	0.371	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	176.3	156.1	0	0	0	0	0	110.4	L645 V672	L645-G828 WeakPolarHBondContact CD1-O 3.34Å; V672-G828 PolarHBondContact N-O 3.29Å; V672-G828 PolarHBondContact O-N 2.96Å
829	G	91.2	Very high	85.2	Confident	14 Å²	14	36.8 Å²	36.8	14%	0.144	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.7	173.7	176.2	0	0	0	0	0	112.8	P644 L645 Y670	P644-G829 WeakPolarHBondContact CA-O 3.4Å; L645-G829 PolarHBondContact N-O 2.86Å; Y670-G829 CarbonylContact O-C 3.41Å; Y670-G829 WeakPolarHBondContact O-CA 3.21Å
830	V	94.1	Very high	85.6	Confident	15 Å²	15	36.4 Å²	36.4	9%	0.091	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	136.5	-177.7	165.1	0	0	0	0	109.5	L642 C643 S669 Y670 I832	L642-V830 HydrophobicContact CB-CG1 3.65Å; L642-V830 HydrophobicContact CB-CG2 4.31Å; L642-V830 HydrophobicContact CD2-CG1 3.86Å; L642-V830 HydrophobicContact CG-CG1 4.23Å; C643-V830 CarbonylContact O-C 3.2Å; C643-V830 VanDerWaalsContact O-CA 3.27Å; C643-V830 WeakPolarHBondContact O-CA 3.43Å; S669-V830 VanDerWaalsContact CA-O 3.23Å; S669-V830 WeakPolarHBondContact CA-O 3.43Å; Y670-V830 HydrophobicContact CD1-CB 4.04Å; Y670-V830 HydrophobicContact CE1-CB 3.63Å; Y670-V830 HydrophobicContact CE1-CG1 4.15Å; Y670-V830 HydrophobicContact CE1-CG2 3.81Å; Y670-V830 HydrophobicContact CE2-CG2 4.33Å; Y670-V830 PolarHBondContact N-O 2.86Å; Y670-V830 PolarHBondContact O-N 2.65Å; Y670-V830 WeakPolarHBondContact OH-CG2 3.37Å; V830-I832 PolarHBondContact O-N 2.62Å
831	N	94.3	Very high	85.7	Confident	21 Å²	21	44.6 Å²	44.6	11%	0.112	31%	0.313	C	S	.	.	S	Bend	trans	50.2	30.2	169.2	-69.3	-15.6	0	0	0	116.2	I640 C641 C643 V667 S669	I640-N831 WeakPolarHBondContact CD1-ND2 3.35Å; C641-N831 PolarHBondContact O-ND2 3.36Å; C641-N831 VanDerWaalsContact O-ND2 3.11Å; C641-N831 PolarHBondContact O-OD1 3.49Å; C643-N831 WeakPolarHBondContact CA-OD1 3.38Å; C643-N831 WeakPolarHBondContact CB-OD1 3.16Å; C643-N831 PolarHBondContact N-OD1 2.82Å; C643-N831 PolarHBondContact O-N 3.01Å; V667-N831 HydrophobicContact CB-CB 4.19Å; V667-N831 HydrophobicContact CG2-CB 4.09Å; V667-N831 VanDerWaalsContact O-CB 3.27Å; V667-N831 WeakPolarHBondContact O-CB 3.08Å; V667-N831 PolarHBondContact O-ND2 2.82Å; S669-N831 VanDerWaalsContact CB-O 3.32Å; S669-N831 WeakPolarHBondContact CB-O 3.29Å
832	I	94.6	Very high	85.8	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.015	31%	0.312	C	S	.	.			trans	-82.1	128.5	170.7	-61.2	158.3	0	0	0	108.6	L645 F656 L658 P661 F663 Y670 A671 V830	L645-I832 HydrophobicContact CD1-CD1 3.8Å; L645-I832 HydrophobicContact CG-CD1 4.17Å; F656-I832 WeakPolarHBondContact CZ-O 3.38Å; L658-I832 HydrophobicContact CD1-CG2 3.85Å; L658-I832 HydrophobicContact CD2-CG2 3.83Å; P661-I832 HydrophobicContact CB-CG2 3.85Å; F663-I832 HydrophobicContact CD1-CG1 4.2Å; F663-I832 HydrophobicContact CE1-CD1 4.04Å; F663-I832 HydrophobicContact CE1-CG1 3.8Å; F663-I832 HydrophobicContact CZ-CD1 4.32Å; F663-I832 HydrophobicContact CZ-CG1 4.29Å; Y670-I832 WeakPolarHBondContact O-CD1 3.41Å; A671-I832 HydrophobicContact CB-CD1 3.64Å; V830-I832 PolarHBondContact O-N 2.62Å
833	A	92.6	Very high	85.9	Confident	36 Å²	36	46.6 Å²	46.6	30%	0.298	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	176.1	174.6	0	0	0	0	0	111.7	L658 L662	L658-A833 VanDerWaalsContact CD1-O 3.3Å; L658-A833 WeakPolarHBondContact CD1-O 2.94Å; L662-A833 HydrophobicContact CB-CB 4.28Å; L662-A833 HydrophobicContact CD2-CB 4.34Å; L662-A833 PolarHBondContact N-O 2.71Å; L662-A833 PolarHBondContact O-N 3.09Å
834	N	91.8	Very high	86.3	Confident	35 Å²	35	44.4 Å²	44.4	19%	0.187	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	141.2	161.8	-91.7	-35.1	0	0	0	110.1	F656 S657 S659 S660 V840	F656-N834 WeakPolarHBondContact CD2-ND2 3.34Å; F656-N834 HydrophobicContact CE2-CB 4.3Å; S657-N834 PolarHBondContact O-ND2 3.22Å; S659-N834 PolarHBondContact N-OD1 3.31Å; S660-N834 PolarHBondContact N-OD1 2.84Å; S660-N834 CarbonylContact O-C 3.55Å; S660-N834 WeakPolarHBondContact O-CA 3.48Å; N834-V840 HydrophobicContact CB-CG1 4.02Å; N834-V840 HydrophobicContact CB-CG2 3.75Å
835	S	90.8	Very high	87.1	Confident	10 Å²	10	43.3 Å²	43.3	7%	0.07	30%	0.3	C	S	.	.			trans	-77.9	172.4	165.4	66.7	0	0	0	0	112.1	S660 H837 V840	S660-S835 VanDerWaalsContact CB-OG 3.25Å; S660-S835 WeakPolarHBondContact CB-OG 3.39Å; S660-S835 PolarHBondContact O-N 3.48Å; S660-S835 PolarHBondContact O-OG 2.85Å; S660-S835 PolarHBondContact OG-OG 2.89Å; S835-H837 PolarHBondContact O-N 2.02Å; S835-H837 WeakPolarHBondContact OG-CB 3.39Å; S835-V840 WeakPolarHBondContact O-CG2 3.41Å
836	A	86.1	Confident	87.8	Confident	119 Å²	119	42.8 Å²	42.8	98%	0.983	28%	0.276	S	S	*	.	S	Bend	trans	-77.7	58.5	176.1	0	0	0	0	0	112.4
837	H	87.8	Confident	88.5	Confident	12 Å²	12	43.1 Å²	43.1	6%	0.056	29%	0.288	C	S	.	.			trans	-115	138.3	-172	175.5	-72.5	0	0	0	112.1	S835 C839 V840 P852 W854 D856	S835-H837 PolarHBondContact O-N 2.02Å; S835-H837 WeakPolarHBondContact OG-CB 3.39Å; H837-C839 PolarHBondContact ND1-N 2.92Å; H837-C839 PolarHBondContact O-N 3.24Å; H837-C839 VanDerWaalsContact O-N 3.1Å; H837-V840 VanDerWaalsContact O-CB 3.31Å; H837-V840 WeakPolarHBondContact O-CB 3.3Å; H837-V840 VanDerWaalsContact O-CG2 3.27Å; H837-V840 WeakPolarHBondContact O-CG2 3.33Å; H837-V840 PolarHBondContact O-N 2.89Å; H837-P852 VanDerWaalsContact CE1-CA 3.49Å; H837-P852 WeakPolarHBondContact CE1-CA 3.33Å; H837-P852 WeakPolarHBondContact CE1-CB 3.46Å; H837-P852 VanDerWaalsContact NE2-CB 3.32Å; H837-P852 WeakPolarHBondContact NE2-CB 3.35Å; H837-W854 PolarHBondContact CD2-O 2.77Å; H837-W854 PolarHBondContact NE2-O 2.84Å; H837-D856 PolarHBondContact NE2-O 2.93Å
838	P	85.9	Confident	88.5	Confident	47 Å²	47	42.6 Å²	42.6	31%	0.305	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-48.6	-43.4	-173.9	-32.1	36.3	0	0	0	116.7	V840 E841 P843 Y857	P838-V840 PolarHBondContact O-N 3.19Å; P838-E841 PolarHBondContact O-N 3.03Å; P838-E841 VanDerWaalsContact O-N 3.17Å; P838-P843 WeakPolarHBondContact O-CD 3.47Å; P838-Y857 HydrophobicContact CB-CD1 3.32Å; P838-Y857 HydrophobicContact CB-CE1 3.66Å; P838-Y857 HydrophobicContact CB-CG 4.13Å; P838-Y857 HydrophobicContact CG-CD1 3.94Å; P838-Y857 HydrophobicContact CG-CE1 4.31Å
839	C	87.4	Confident	88.3	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.014	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-60.5	-6	177.3	-71	0	0	0	0	116.2	S659 H837 N842 C850 Y857	S659-C839 VanDerWaalsContact CB-O 3.29Å; S659-C839 WeakPolarHBondContact CB-O 3.48Å; S659-C839 PolarHBondContact OG-O 2.93Å; H837-C839 PolarHBondContact ND1-N 2.92Å; H837-C839 PolarHBondContact O-N 3.24Å; H837-C839 VanDerWaalsContact O-N 3.1Å; C839-N842 PolarHBondContact O-N 2.83Å; C839-C850 WeakPolarHBondContact CA-SG 3.36Å; C839-C850 HydrophobicContact CB-CB 3.77Å; C839-C850 WeakPolarHBondContact CB-SG 3.39Å; C839-C850 WeakPolarHBondContact SG-CB 3.07Å; C839-C850 CovalentContact SG-SG 2.04Å; C839-C850 PolarHBondContact SG-SG 3.09Å; C839-Y857 VanDerWaalsContact SG-CB 3.55Å
840	V	86.2	Confident	88	Confident	54 Å²	54	45 Å²	45	33%	0.327	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-70.3	-35	173.5	173.7	0	0	0	0	111.8	N834 S835 H837 P838 N842	N834-V840 HydrophobicContact CB-CG1 4.02Å; N834-V840 HydrophobicContact CB-CG2 3.75Å; S835-V840 WeakPolarHBondContact O-CG2 3.41Å; H837-V840 VanDerWaalsContact O-CB 3.31Å; H837-V840 WeakPolarHBondContact O-CB 3.3Å; H837-V840 VanDerWaalsContact O-CG2 3.27Å; H837-V840 WeakPolarHBondContact O-CG2 3.33Å; H837-V840 PolarHBondContact O-N 2.89Å; P838-V840 PolarHBondContact O-N 3.19Å; V840-N842 VanDerWaalsContact C-N 3.27Å
841	E	85.1	Confident	87.3	Confident	181 Å²	181	50.2 Å²	50.2	85%	0.846	31%	0.307	S	S	*	.	S	Bend	trans	-85.9	0.2	175.2	-59.4	-172.2	156.6	0	0	112.8	P838	P838-E841 PolarHBondContact O-N 3.03Å; P838-E841 VanDerWaalsContact O-N 3.17Å
842	N	83.7	Confident	86.4	Confident	82 Å²	82	51.2 Å²	51.2	44%	0.439	32%	0.315	S	S	.	.			trans	41.4	70.9	-169.5	-171.7	43.6	0	0	0	114.1	C839 V840 C844 C850	C839-N842 PolarHBondContact O-N 2.83Å; V840-N842 VanDerWaalsContact C-N 3.27Å; N842-C844 PolarHBondContact O-N 3.14Å; N842-C850 VanDerWaalsContact OD1-CB 3.31Å; N842-C850 WeakPolarHBondContact OD1-CB 3.46Å
843	P	89.9	Confident	85.7	Confident	40 Å²	40	55.7 Å²	55.7	26%	0.26	33%	0.334	S	S	.	.			trans	-66.5	6.2	-179.1	28.8	-38.7	0	0	0	115.1	P838 Y857 H869	P838-P843 WeakPolarHBondContact O-CD 3.47Å; P843-Y857 HydrophobicContact CB-CD2 4.47Å; P843-Y857 HydrophobicContact CB-CE1 4.5Å; P843-Y857 HydrophobicContact CB-CE2 3.64Å; P843-Y857 WeakPolarHBondContact CB-OH 3.41Å; P843-Y857 HydrophobicContact CG-CD1 4.29Å; P843-Y857 HydrophobicContact CG-CD2 3.57Å; P843-Y857 HydrophobicContact CG-CE1 3.98Å; P843-Y857 HydrophobicContact CG-CE2 3.2Å; P843-Y857 HydrophobicContact CG-CG 4.08Å; P843-Y857 VanDerWaalsContact CG-CZ 3.41Å; P843-H869 WeakPolarHBondContact O-CB 3.41Å
844	C	89.6	Confident	85.2	Confident	6 Å²	6	60.9 Å²	60.9	4%	0.041	35%	0.346	C	S	.	.			trans	-91.8	108.2	178.4	-56.7	0	0	0	0	110.5	N842 G848 C850 C859	N842-C844 PolarHBondContact O-N 3.14Å; C844-G848 WeakPolarHBondContact CB-O 3.18Å; C844-C850 WeakPolarHBondContact SG-CA 3.47Å; C844-C850 WeakPolarHBondContact SG-CB 3.04Å; C844-C859 VanDerWaalsContact CA-SG 3.52Å; C844-C859 HydrophobicContact CB-CB 3.77Å; C844-C859 WeakPolarHBondContact CB-SG 3.15Å; C844-C859 VanDerWaalsContact SG-CA 3.56Å; C844-C859 WeakPolarHBondContact SG-CB 3.28Å; C844-C859 CovalentContact SG-SG 2.03Å; C844-C859 PolarHBondContact SG-SG 2.71Å
845	A	88.5	Confident	84.7	Confident	36 Å²	36	64.2 Å²	64.2	30%	0.298	36%	0.364	S	S	.	.			trans	-67.6	169.1	178.8	0	0	0	0	0	112.7	G847 G848 H869 C870 Q871	A845-G847 PolarHBondContact O-N 3.22Å; A845-G847 VanDerWaalsContact O-N 3.09Å; A845-G848 PolarHBondContact O-N 2.82Å; A845-H869 WeakPolarHBondContact CB-O 3.42Å; A845-H869 PolarHBondContact N-O 2.85Å; A845-C870 WeakPolarHBondContact O-CB 3.44Å; A845-Q871 HydrophobicContact CB-CB 4.38Å
846	N	83.8	Confident	84.3	Confident	80 Å²	80	67 Å²	67	43%	0.428	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	30.5	166.8	-55	-42.9	0	0	0	115.2	G848 P862 Y865 C870	N846-G848 VanDerWaalsContact C-N 3.32Å; N846-P862 WeakPolarHBondContact O-CG 3.48Å; N846-Y865 HydrophobicContact CB-CD1 3.5Å; N846-Y865 HydrophobicContact CB-CD2 4.23Å; N846-Y865 HydrophobicContact CB-CE1 3.6Å; N846-Y865 HydrophobicContact CB-CE2 4.3Å; N846-Y865 HydrophobicContact CB-CG 3.84Å; N846-Y865 VanDerWaalsContact CG-CE1 3.41Å; N846-Y865 VanDerWaalsContact ND2-CD1 3.27Å; N846-Y865 WeakPolarHBondContact ND2-CD1 3.49Å; N846-Y865 WeakPolarHBondContact ND2-CE1 3.46Å; N846-C870 PolarHBondContact ND2-O 2.85Å
847	G	82.5	Confident	84.3	Confident	62 Å²	62	62.9 Å²	62.9	64%	0.639	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	14.3	-176.8	0	0	0	0	0	114.5	A845	A845-G847 PolarHBondContact O-N 3.22Å; A845-G847 VanDerWaalsContact O-N 3.09Å
848	G	83.2	Confident	84.1	Confident	4 Å²	4	64.8 Å²	64.8	4%	0.041	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-59.3	145.2	167.4	0	0	0	0	0	112.1	C844 A845 N846	C844-G848 WeakPolarHBondContact CB-O 3.18Å; A845-G848 PolarHBondContact O-N 2.82Å; N846-G848 VanDerWaalsContact C-N 3.32Å
849	T	84.5	Confident	84.1	Confident	78 Å²	78	63 Å²	63	48%	0.479	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	116.4	-178.5	-47.4	0	0	0	0	110.1	C859 D860	T849-C859 WeakPolarHBondContact O-CA 3.42Å; T849-D860 PolarHBondContact N-O 2.63Å; T849-D860 PolarHBondContact O-N 2.72Å
850	C	85.4	Confident	83.8	Confident	22 Å²	22	64 Å²	64	15%	0.149	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	136.2	178.2	-158.6	0	0	0	0	112	C839 N842 C844	C839-C850 WeakPolarHBondContact CA-SG 3.36Å; C839-C850 HydrophobicContact CB-CB 3.77Å; C839-C850 WeakPolarHBondContact CB-SG 3.39Å; C839-C850 WeakPolarHBondContact SG-CB 3.07Å; C839-C850 CovalentContact SG-SG 2.04Å; C839-C850 PolarHBondContact SG-SG 3.09Å; N842-C850 VanDerWaalsContact OD1-CB 3.31Å; N842-C850 WeakPolarHBondContact OD1-CB 3.46Å; C844-C850 WeakPolarHBondContact SG-CA 3.47Å; C844-C850 WeakPolarHBondContact SG-CB 3.04Å
851	R	78.9	Confident	83.5	Confident	125 Å²	125	61.9 Å²	61.9	47%	0.472	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	120.2	174.9	-59.8	-176	67.9	155.1	1.2	108.7	Y857 E858 D860	R851-Y857 WeakPolarHBondContact O-CA 3.24Å; R851-E858 WeakPolarHBondContact CB-O 3.16Å; R851-E858 PolarHBondContact N-O 3.32Å; R851-E858 PolarHBondContact O-N 3.5Å; R851-D860 WeakPolarHBondContact CD-OD2 3.43Å; R851-D860 IonicContact CZ-OD2 3.41Å; R851-D860 IonicContact NE-OD2 2.74Å; R851-D860 IonicContact NH1-OD2 3.92Å; R851-D860 PolarHBondContact NH1-OD2 3.02Å
852	P	77.3	Confident	83.2	Confident	41 Å²	41	54.6 Å²	54.6	27%	0.266	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	146.9	-179.9	31.5	-37	0	0	0	111.4	Q811 H837	Q811-P852 HydrophobicContact CG-CB 3.79Å; Q811-P852 HydrophobicContact CG-CG 3.8Å; H837-P852 VanDerWaalsContact CE1-CA 3.49Å; H837-P852 WeakPolarHBondContact CE1-CA 3.33Å; H837-P852 WeakPolarHBondContact CE1-CB 3.46Å; H837-P852 VanDerWaalsContact NE2-CB 3.32Å; H837-P852 WeakPolarHBondContact NE2-CB 3.35Å
853	K	78.8	Confident	82.7	Confident	97 Å²	97	53.6 Å²	53.6	42%	0.422	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	90.8	179.5	-74	-170.4	179.4	179.7	0	110.6	D855 D856 E858	K853-D855 PolarHBondContact O-N 2.7Å; K853-D855 VanDerWaalsContact O-N 3.08Å; K853-D856 CarbonylContact C-O 3.58Å; K853-D856 WeakPolarHBondContact CA-O 3.44Å; K853-D856 PolarHBondContact N-O 2.93Å; K853-D856 CarbonylContact O-C 3.55Å; K853-D856 PolarHBondContact O-N 2.65Å; K853-D856 VanDerWaalsContact O-O 3.11Å; K853-E858 HydrophobicContact CD-CB 4.18Å; K853-E858 WeakPolarHBondContact CE-OE2 3.17Å; K853-E858 IonicContact NZ-OE1 2.77Å; K853-E858 PolarHBondContact NZ-OE1 2.9Å; K853-E858 IonicContact NZ-OE2 2.76Å; K853-E858 PolarHBondContact NZ-OE2 3.23Å
854	W	82.1	Confident	81.7	Confident	145 Å²	145	53.5 Å²	53.5	55%	0.549	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	54	-112.3	-173.6	-60.6	-2.1	0	0	0	109.3	W746 Q811 H837	W746-W854 HydrophobicContact CB-CD2 4.49Å; W746-W854 HydrophobicContact CB-CG 4.3Å; W746-W854 HydrophobicContact CD2-CB 4.3Å; W746-W854 HydrophobicContact CG-CB 3.93Å; W746-W854 HydrophobicContact CG-CG 4.07Å; W746-W854 VanDerWaalsContact CZ2-O 3.3Å; W746-W854 WeakPolarHBondContact CZ2-O 3.49Å; Q811-W854 PolarHBondContact NE2-O 3.5Å; H837-W854 PolarHBondContact CD2-O 2.77Å; H837-W854 PolarHBondContact NE2-O 2.84Å
855	D	80.8	Confident	80.9	Confident	106 Å²	106	56.5 Å²	56.5	57%	0.567	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-6.5	177.6	-52.8	-58.7	0	0	0	114.2	W746 K853	W746-D855 VanDerWaalsContact NE1-CG 3.31Å; W746-D855 PolarHBondContact NE1-OD1 2.87Å; K853-D855 PolarHBondContact O-N 2.7Å; K853-D855 VanDerWaalsContact O-N 3.08Å
856	D	82.3	Confident	80	Confident	67 Å²	67	57.7 Å²	57.7	36%	0.358	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	-173.9	179.2	-163.1	17.4	0	0	0	111.4	H837 K853 R868	H837-D856 PolarHBondContact NE2-O 2.93Å; K853-D856 CarbonylContact C-O 3.58Å; K853-D856 WeakPolarHBondContact CA-O 3.44Å; K853-D856 PolarHBondContact N-O 2.93Å; K853-D856 CarbonylContact O-C 3.55Å; K853-D856 PolarHBondContact O-N 2.65Å; K853-D856 VanDerWaalsContact O-O 3.11Å; D856-R868 IonicContact OD1-CZ 3.8Å; D856-R868 IonicContact OD1-NH2 3.47Å; D856-R868 PolarHBondContact OD1-NH2 3.29Å; D856-R868 IonicContact OD2-CZ 2.66Å; D856-R868 IonicContact OD2-NH2 2.8Å; D856-R868 PolarHBondContact OD2-NH2 2.92Å
857	Y	85.9	Confident	79.5	Confident	34 Å²	34	54.6 Å²	54.6	13%	0.133	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	167.3	-176.7	62.1	-79.4	0	0	0	112.8	P838 C839 P843 R851 H869	P838-Y857 HydrophobicContact CB-CD1 3.32Å; P838-Y857 HydrophobicContact CB-CE1 3.66Å; P838-Y857 HydrophobicContact CB-CG 4.13Å; P838-Y857 HydrophobicContact CG-CD1 3.94Å; P838-Y857 HydrophobicContact CG-CE1 4.31Å; C839-Y857 VanDerWaalsContact SG-CB 3.55Å; P843-Y857 HydrophobicContact CB-CD2 4.47Å; P843-Y857 HydrophobicContact CB-CE1 4.5Å; P843-Y857 HydrophobicContact CB-CE2 3.64Å; P843-Y857 WeakPolarHBondContact CB-OH 3.41Å; P843-Y857 HydrophobicContact CG-CD1 4.29Å; P843-Y857 HydrophobicContact CG-CD2 3.57Å; P843-Y857 HydrophobicContact CG-CE1 3.98Å; P843-Y857 HydrophobicContact CG-CE2 3.2Å; P843-Y857 HydrophobicContact CG-CG 4.08Å; P843-Y857 VanDerWaalsContact CG-CZ 3.41Å; R851-Y857 WeakPolarHBondContact O-CA 3.24Å; Y857-H869 AromaticContact CE2-CE1 3.76Å; Y857-H869 AromaticContact CE2-ND1 3.38Å; Y857-H869 WeakPolarHBondContact CE2-ND1 3.2Å; Y857-H869 AromaticContact CZ-CE1 3.55Å; Y857-H869 AromaticContact CZ-ND1 3.61Å; Y857-H869 PolarHBondContact OH-CE1 3.44Å; Y857-H869 PolarHBondContact OH-ND1 2.83Å; Y857-H869 VanDerWaalsContact OH-ND1 3.15Å
858	E	84.6	Confident	79.5	Confident	52 Å²	52	58.3 Å²	58.3	24%	0.243	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	142.3	173.9	-173.4	174.1	-120.8	0	0	110.6	R851 K853 R894	R851-E858 WeakPolarHBondContact CB-O 3.16Å; R851-E858 PolarHBondContact N-O 3.32Å; R851-E858 PolarHBondContact O-N 3.5Å; K853-E858 HydrophobicContact CD-CB 4.18Å; K853-E858 WeakPolarHBondContact CE-OE2 3.17Å; K853-E858 IonicContact NZ-OE1 2.77Å; K853-E858 PolarHBondContact NZ-OE1 2.9Å; K853-E858 IonicContact NZ-OE2 2.76Å; K853-E858 PolarHBondContact NZ-OE2 3.23Å; E858-R894 IonicContact OE1-CZ 2.73Å; E858-R894 IonicContact OE1-NH1 3.74Å; E858-R894 IonicContact OE1-NH2 3.72Å; E858-R894 PolarHBondContact OE1-NH2 3.01Å; E858-R894 IonicContact OE2-CZ 2.77Å; E858-R894 IonicContact OE2-NH1 2.79Å; E858-R894 PolarHBondContact OE2-NH1 2.86Å; E858-R894 IonicContact OE2-NH2 3.85Å; E858-R894 PolarHBondContact OE2-NH2 2.81Å
859	C	85	Confident	79.7	Confident	8 Å²	8	60.2 Å²	60.2	5%	0.054	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	127.8	180	-58.5	0	0	0	0	111.4	C844 T849 C861 R868 C870	C844-C859 VanDerWaalsContact CA-SG 3.52Å; C844-C859 HydrophobicContact CB-CB 3.77Å; C844-C859 WeakPolarHBondContact CB-SG 3.15Å; C844-C859 VanDerWaalsContact SG-CA 3.56Å; C844-C859 WeakPolarHBondContact SG-CB 3.28Å; C844-C859 CovalentContact SG-SG 2.03Å; C844-C859 PolarHBondContact SG-SG 2.71Å; T849-C859 WeakPolarHBondContact O-CA 3.42Å; C859-C861 PolarHBondContact O-N 3.15Å; C859-R868 PolarHBondContact SG-O 3.33Å; C859-R868 VanDerWaalsContact SG-O 3.32Å; C859-C870 WeakPolarHBondContact CB-SG 3.33Å
860	D	81.1	Confident	79.8	Confident	25 Å²	25	56.5 Å²	56.5	13%	0.134	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	98.1	167.6	-85.8	-24.8	0	0	0	109.2	T849 R851 R894 K1060 N1061	T849-D860 PolarHBondContact N-O 2.63Å; T849-D860 PolarHBondContact O-N 2.72Å; R851-D860 WeakPolarHBondContact CD-OD2 3.43Å; R851-D860 IonicContact CZ-OD2 3.41Å; R851-D860 IonicContact NE-OD2 2.74Å; R851-D860 IonicContact NH1-OD2 3.92Å; R851-D860 PolarHBondContact NH1-OD2 3.02Å; D860-R894 IonicContact OD1-CZ 3.45Å; D860-R894 IonicContact OD1-NE 3.7Å; D860-R894 IonicContact OD1-NH1 3.43Å; D860-R894 PolarHBondContact OD1-NH1 3.36Å; D860-K1060 PolarHBondContact O-NZ 2.98Å; D860-N1061 PolarHBondContact OD1-ND2 3.45Å
861	C	81.1	Confident	79.8	Confident	9 Å²	9	60 Å²	60	6%	0.061	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-78.9	138.7	-168.9	-58.9	0	0	0	0	113.5	C859 Y865 C870 K1060 N1061	C859-C861 PolarHBondContact O-N 3.15Å; C861-Y865 VanDerWaalsContact CB-O 3.29Å; C861-Y865 WeakPolarHBondContact CB-O 3.18Å; C861-C870 WeakPolarHBondContact CA-SG 3.34Å; C861-C870 HydrophobicContact CB-CB 3.83Å; C861-C870 WeakPolarHBondContact CB-SG 3.43Å; C861-C870 WeakPolarHBondContact SG-CA 3.44Å; C861-C870 WeakPolarHBondContact SG-CB 3.23Å; C861-C870 CovalentContact SG-SG 2.04Å; C861-C870 PolarHBondContact SG-SG 3.14Å; C861-K1060 WeakPolarHBondContact O-CD 3.33Å; C861-N1061 PolarHBondContact N-OD1 2.88Å; C861-N1061 PolarHBondContact O-N 3.32Å
862	P	79.5	Confident	79.5	Confident	28 Å²	28	59.6 Å²	59.6	18%	0.182	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-69.6	160.3	173.3	30.8	-32.7	0	0	0	111.8	N846 G864 Y865	N846-P862 WeakPolarHBondContact O-CG 3.48Å; P862-G864 PolarHBondContact O-N 2.92Å; P862-Y865 HydrophobicContact CG-CD2 3.99Å; P862-Y865 PolarHBondContact O-N 3.1Å; P862-Y865 VanDerWaalsContact O-N 3.16Å
863	L	72.4	Confident	78.7	Confident	61 Å²	61	63.7 Å²	63.7	32%	0.319	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	132.4	176.6	-165.9	64.4	0	0	0	111.2	L897 G1059 I1062	L863-L897 HydrophobicContact CD1-CD2 4.38Å; L863-G1059 PolarHBondContact N-O 3.32Å; L863-G1059 VanDerWaalsContact N-O 3.15Å; L863-I1062 HydrophobicContact CD1-CB 4.2Å; L863-I1062 HydrophobicContact CD1-CG1 4.4Å
864	G	67.9	Low	77.7	Confident	37 Å²	37	61.7 Å²	61.7	38%	0.381	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	92	-5.2	-176.8	0	0	0	0	0	116	P862 C874	P862-G864 PolarHBondContact O-N 2.92Å; G864-C874 WeakPolarHBondContact O-CB 3.23Å; G864-C874 PolarHBondContact O-N 2.79Å
865	Y	72.9	Confident	75.9	Confident	69 Å²	69	56.7 Å²	56.7	27%	0.271	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	139.5	-178.2	-63	-87.4	0	0	0	113.3	N846 C861 P862 K872 E873	N846-Y865 HydrophobicContact CB-CD1 3.5Å; N846-Y865 HydrophobicContact CB-CD2 4.23Å; N846-Y865 HydrophobicContact CB-CE1 3.6Å; N846-Y865 HydrophobicContact CB-CE2 4.3Å; N846-Y865 HydrophobicContact CB-CG 3.84Å; N846-Y865 VanDerWaalsContact CG-CE1 3.41Å; N846-Y865 VanDerWaalsContact ND2-CD1 3.27Å; N846-Y865 WeakPolarHBondContact ND2-CD1 3.49Å; N846-Y865 WeakPolarHBondContact ND2-CE1 3.46Å; C861-Y865 VanDerWaalsContact CB-O 3.29Å; C861-Y865 WeakPolarHBondContact CB-O 3.18Å; P862-Y865 HydrophobicContact CG-CD2 3.99Å; P862-Y865 PolarHBondContact O-N 3.1Å; P862-Y865 VanDerWaalsContact O-N 3.16Å; Y865-K872 CarbonylContact C-O 3.53Å; Y865-K872 WeakPolarHBondContact CA-O 3.02Å; Y865-E873 HydrophobicContact CD1-CB 3.99Å; Y865-E873 HydrophobicContact CD1-CG 4.33Å; Y865-E873 HydrophobicContact CE1-CB 3.63Å; Y865-E873 HydrophobicContact CE1-CG 3.64Å; Y865-E873 PolarHBondContact OH-OE1 3.38Å
866	D	71	Confident	74	Confident	62 Å²	62	58.6 Å²	58.6	33%	0.332	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	172.1	-177.3	173.8	51.4	0	0	0	112.1	C870 Q871 K872	D866-C870 CarbonylContact O-C 3.57Å; D866-C870 VanDerWaalsContact O-C 3.24Å; D866-C870 WeakPolarHBondContact O-CA 3.41Å; D866-Q871 PolarHBondContact O-N 3.26Å; D866-K872 HydrophobicContact CB-CB 4.48Å; D866-K872 PolarHBondContact N-O 2.8Å; D866-K872 VanDerWaalsContact O-CB 3.3Å; D866-K872 WeakPolarHBondContact O-CB 3.49Å; D866-K872 PolarHBondContact O-N 2.73Å; D866-K872 IonicContact OD2-NZ 2.7Å; D866-K872 PolarHBondContact OD2-NZ 2.68Å
867	G	72.8	Confident	72.3	Confident	15 Å²	15	63.9 Å²	63.9	16%	0.155	32%	0.324	C	S	.	.	S	Bend	trans	103	162.7	176.6	0	0	0	0	0	111.8	H869 C870	G867-H869 PolarHBondContact O-N 3.36Å; G867-C870 PolarHBondContact O-N 2.85Å
868	R	81.8	Confident	70.7	Confident	140 Å²	140	63.4 Å²	63.4	53%	0.528	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-24.2	-178.6	-169.1	-177.3	175.6	-141.8	7.6	113.2	D856 C859	D856-R868 IonicContact OD1-CZ 3.8Å; D856-R868 IonicContact OD1-NH2 3.47Å; D856-R868 PolarHBondContact OD1-NH2 3.29Å; D856-R868 IonicContact OD2-CZ 2.66Å; D856-R868 IonicContact OD2-NH2 2.8Å; D856-R868 PolarHBondContact OD2-NH2 2.92Å; C859-R868 PolarHBondContact SG-O 3.33Å; C859-R868 VanDerWaalsContact SG-O 3.32Å
869	H	87.7	Confident	68.5	Low	44 Å²	44	67.8 Å²	67.8	20%	0.204	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.7	15.8	-175.5	-47.8	-44.5	0	0	0	112.1	P843 A845 Y857 G867 Q871	P843-H869 WeakPolarHBondContact O-CB 3.41Å; A845-H869 WeakPolarHBondContact CB-O 3.42Å; A845-H869 PolarHBondContact N-O 2.85Å; Y857-H869 AromaticContact CE2-CE1 3.76Å; Y857-H869 AromaticContact CE2-ND1 3.38Å; Y857-H869 WeakPolarHBondContact CE2-ND1 3.2Å; Y857-H869 AromaticContact CZ-CE1 3.55Å; Y857-H869 AromaticContact CZ-ND1 3.61Å; Y857-H869 PolarHBondContact OH-CE1 3.44Å; Y857-H869 PolarHBondContact OH-ND1 2.83Å; Y857-H869 VanDerWaalsContact OH-ND1 3.15Å; G867-H869 PolarHBondContact O-N 3.36Å; H869-Q871 HydrophobicContact CB-CB 4.29Å; H869-Q871 PolarHBondContact O-N 2.87Å
870	C	86.1	Confident	66.5	Low	0 Å²	0	74.4 Å²	74.4	0%	0	38%	0.384	C	S	.	.	S	Bend	trans	52.5	22.5	-169.8	-45.6	0	0	0	0	114.1	A845 N846 C859 C861 D866 G867 K872	A845-C870 WeakPolarHBondContact O-CB 3.44Å; N846-C870 PolarHBondContact ND2-O 2.85Å; C859-C870 WeakPolarHBondContact CB-SG 3.33Å; C861-C870 WeakPolarHBondContact CA-SG 3.34Å; C861-C870 HydrophobicContact CB-CB 3.83Å; C861-C870 WeakPolarHBondContact CB-SG 3.43Å; C861-C870 WeakPolarHBondContact SG-CA 3.44Å; C861-C870 WeakPolarHBondContact SG-CB 3.23Å; C861-C870 CovalentContact SG-SG 2.04Å; C861-C870 PolarHBondContact SG-SG 3.14Å; D866-C870 CarbonylContact O-C 3.57Å; D866-C870 VanDerWaalsContact O-C 3.24Å; D866-C870 WeakPolarHBondContact O-CA 3.41Å; G867-C870 PolarHBondContact O-N 2.85Å; C870-K872 VanDerWaalsContact C-N 3.35Å
871	Q	86.2	Confident	64.5	Low	96 Å²	96	75 Å²	75	45%	0.449	39%	0.389	S	S	.	.			trans	-81.9	-14	-169.8	77.3	-82.1	37.7	0	0	113.3	A845 D866 H869 E873	A845-Q871 HydrophobicContact CB-CB 4.38Å; D866-Q871 PolarHBondContact O-N 3.26Å; H869-Q871 HydrophobicContact CB-CB 4.29Å; H869-Q871 PolarHBondContact O-N 2.87Å; Q871-E873 PolarHBondContact O-N 2.85Å
872	K	73.4	Confident	62.6	Low	116 Å²	116	76.6 Å²	76.6	50%	0.504	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	105.8	171.8	-50.9	-178.8	-159.1	155.8	0	108.2	Y865 D866 C870	Y865-K872 CarbonylContact C-O 3.53Å; Y865-K872 WeakPolarHBondContact CA-O 3.02Å; D866-K872 HydrophobicContact CB-CB 4.48Å; D866-K872 PolarHBondContact N-O 2.8Å; D866-K872 VanDerWaalsContact O-CB 3.3Å; D866-K872 WeakPolarHBondContact O-CB 3.49Å; D866-K872 PolarHBondContact O-N 2.73Å; D866-K872 IonicContact OD2-NZ 2.7Å; D866-K872 PolarHBondContact OD2-NZ 2.68Å; C870-K872 VanDerWaalsContact C-N 3.35Å
873	E	58.4	Low	60.8	Low	126 Å²	126	78.9 Å²	78.9	59%	0.589	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.4	134	156.1	-172.7	174	-120.8	0	0	108.8	Y865 Q871 G875	Y865-E873 HydrophobicContact CD1-CB 3.99Å; Y865-E873 HydrophobicContact CD1-CG 4.33Å; Y865-E873 HydrophobicContact CE1-CB 3.63Å; Y865-E873 HydrophobicContact CE1-CG 3.64Å; Y865-E873 PolarHBondContact OH-OE1 3.38Å; Q871-E873 PolarHBondContact O-N 2.85Å; E873-G875 PolarHBondContact O-N 3.29Å
874	C	58.1	Low	59.2	Low	55 Å²	55	83.1 Å²	83.1	37%	0.372	43%	0.43	S	S	.	.			trans	-76.2	49.8	167.3	-74.3	0	0	0	0	111.2	G864 C878	G864-C874 WeakPolarHBondContact O-CB 3.23Å; G864-C874 PolarHBondContact O-N 2.79Å; C874-C878 HydrophobicContact CB-CB 4Å; C874-C878 PolarHBondContact O-N 3.2Å
875	G	44.2	Very low	58	Low	40 Å²	40	82.2 Å²	82.2	41%	0.412	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	142.3	-169.6	0	0	0	0	0	113.2	E873 Y877	E873-G875 PolarHBondContact O-N 3.29Å; G875-Y877 PolarHBondContact O-N 2.94Å
876	N	41.2	Very low	56.8	Low	146 Å²	146	80.4 Å²	80.4	78%	0.781	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	-19.2	179.6	-76	-13.7	0	0	0	118.6
877	Y	46.6	Very low	56.2	Low	178 Å²	178	85.3 Å²	85.3	70%	0.698	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-25.2	175.5	-147.7	-87.9	0	0	0	112.5	G875 T881 A885	G875-Y877 PolarHBondContact O-N 2.94Å; Y877-T881 PolarHBondContact O-OG1 3.37Å; Y877-A885 HydrophobicContact CD1-CB 3.65Å; Y877-A885 HydrophobicContact CE1-CB 3.93Å; Y877-A885 VanDerWaalsContact O-CB 3.26Å; Y877-A885 WeakPolarHBondContact O-CB 3.22Å
878	C	53.3	Low	56.5	Low	25 Å²	25	85.7 Å²	85.7	17%	0.169	43%	0.433	C	S	.	.	S	Bend	trans	-125	16.4	-172.9	-60.4	0	0	0	0	115	C874 V882	C874-C878 HydrophobicContact CB-CB 4Å; C874-C878 PolarHBondContact O-N 3.2Å; C878-V882 WeakPolarHBondContact O-CG2 3.4Å
879	L	38.9	Very low	56.8	Low	143 Å²	143	79 Å²	79	75%	0.749	41%	0.408	S	S	*	.	S	Bend	trans	-122.5	-37.3	-179.5	-141.4	77.9	0	0	0	115.3	T881	L879-T881 VanDerWaalsContact C-N 3.27Å
880	N	41.1	Very low	56.7	Low	147 Å²	147	79.4 Å²	79.4	79%	0.786	41%	0.41	S	S	*	.	S	Bend	trans	-84.3	-9.2	161.4	-73.4	-12.7	0	0	0	112
881	T	40.3	Very low	56.9	Low	38 Å²	38	79.5 Å²	79.5	23%	0.233	41%	0.41	C	S	.	.			trans	-141	37.4	-173.3	37.9	0	0	0	0	110.9	Y877 L879 T883 E884 A885	Y877-T881 PolarHBondContact O-OG1 3.37Å; L879-T881 VanDerWaalsContact C-N 3.27Å; T881-T883 PolarHBondContact O-N 3Å; T881-T883 VanDerWaalsContact O-N 3.11Å; T881-E884 HydrophobicContact CG2-CB 4.29Å; T881-E884 PolarHBondContact O-N 2.89Å; T881-E884 VanDerWaalsContact O-N 3.14Å; T881-A885 WeakPolarHBondContact O-CB 3.48Å; T881-A885 PolarHBondContact O-N 3.25Å; T881-A885 VanDerWaalsContact O-N 3.11Å
882	V	40.9	Very low	56.8	Low	43 Å²	43	78.1 Å²	78.1	26%	0.261	41%	0.405	S	S	.	.	H	α-helix	trans	-46.7	-37.3	163.9	-171.8	0	0	0	0	109.9	C878 V1053 E1054	C878-V882 WeakPolarHBondContact O-CG2 3.4Å; V882-V1053 HydrophobicContact CG1-CG1 3.93Å; V882-E1054 HydrophobicContact CB-CG 4.44Å; V882-E1054 HydrophobicContact CG1-CG 4.05Å
883	T	41	Very low	57.2	Low	75 Å²	75	73.4 Å²	73.4	46%	0.46	39%	0.39	S	S	.	.	H	α-helix	trans	-76.8	-18.5	-173.2	79.4	0	0	0	0	114.5	T881 E1054	T881-T883 PolarHBondContact O-N 3Å; T881-T883 VanDerWaalsContact O-N 3.11Å; T883-E1054 WeakPolarHBondContact CA-OE2 3.41Å; T883-E1054 VanDerWaalsContact CB-CD 3.47Å; T883-E1054 WeakPolarHBondContact CB-OE2 3.26Å; T883-E1054 HydrophobicContact CG2-CG 3.94Å; T883-E1054 WeakPolarHBondContact CG2-OE1 3.38Å
884	E	40	Very low	58.2	Low	151 Å²	151	71.1 Å²	71.1	71%	0.706	38%	0.375	S	S	*	.	H	α-helix	trans	-120.3	-22	-173.1	-68.6	-173.7	160.1	0	0	113.5	T881	T881-E884 HydrophobicContact CG2-CB 4.29Å; T881-E884 PolarHBondContact O-N 2.89Å; T881-E884 VanDerWaalsContact O-N 3.14Å
885	A	42.1	Very low	59.5	Low	18 Å²	18	68.5 Å²	68.5	15%	0.149	36%	0.358	C	S	.	.	H	α-helix	trans	-93.3	-28	-172.4	0	0	0	0	0	115.4	Y877 T881	Y877-A885 HydrophobicContact CD1-CB 3.65Å; Y877-A885 HydrophobicContact CE1-CB 3.93Å; Y877-A885 VanDerWaalsContact O-CB 3.26Å; Y877-A885 WeakPolarHBondContact O-CB 3.22Å; T881-A885 WeakPolarHBondContact O-CB 3.48Å; T881-A885 PolarHBondContact O-N 3.25Å; T881-A885 VanDerWaalsContact O-N 3.11Å
886	I	48.7	Very low	61.8	Low	31 Å²	31	68.2 Å²	68.2	16%	0.159	34%	0.344	C	S	.	.			trans	-118.1	62.2	174.1	-45.8	-177.2	0	0	0	109.1	I888 P889 V1053	I886-I888 PolarHBondContact O-N 2.89Å; I886-I888 VanDerWaalsContact O-N 3.15Å; I886-P889 HydrophobicContact CG2-CB 4.22Å; I886-V1053 HydrophobicContact CB-CG2 4.02Å; I886-V1053 HydrophobicContact CG2-CG2 3.83Å
887	E	58.8	Low	64.2	Low	164 Å²	164	61.2 Å²	61.2	77%	0.766	31%	0.307	S	S	*	.	S	Bend	trans	-53.5	-29.9	170.4	-172.1	-177.9	-145.9	0	0	111.6
888	I	78.5	Confident	66.4	Low	23 Å²	23	53.6 Å²	53.6	12%	0.118	28%	0.279	C	S	.	.	S	Bend	trans	-139.5	108.2	179.9	-54.1	-171.2	0	0	0	110.6	I886 W976 C1038 C1065	I886-I888 PolarHBondContact O-N 2.89Å; I886-I888 VanDerWaalsContact O-N 3.15Å; I888-W976 HydrophobicContact CD1-CH2 4.05Å; I888-W976 HydrophobicContact CD1-CZ2 3.65Å; I888-W976 HydrophobicContact CG2-CH2 3.52Å; I888-W976 HydrophobicContact CG2-CZ2 3.82Å; I888-C1038 HydrophobicContact CG2-CB 3.84Å; I888-C1065 HydrophobicContact CB-CB 3.91Å; I888-C1065 HydrophobicContact CG2-CB 3.43Å; I888-C1065 VanDerWaalsContact CG2-CB 3.43Å; I888-C1065 VanDerWaalsContact O-CB 3.26Å; I888-C1065 WeakPolarHBondContact O-CB 3.12Å; I888-C1065 PolarHBondContact O-N 2.95Å
889	P	86.6	Confident	68.3	Low	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	139.7	171.5	27.3	-35.3	0	0	0	112.8	I886 F891 L897 C1038 V1039 L1052 V1053 I1062	I886-P889 HydrophobicContact CG2-CB 4.22Å; P889-F891 HydrophobicContact CB-CE2 4.01Å; P889-F891 HydrophobicContact CB-CZ 4.04Å; P889-F891 HydrophobicContact CG-CE2 3.97Å; P889-F891 HydrophobicContact CG-CZ 4Å; P889-F891 WeakPolarHBondContact O-CE2 3.28Å; P889-L897 HydrophobicContact CB-CD1 4.19Å; P889-L897 HydrophobicContact CG-CD1 4.12Å; P889-C1038 VanDerWaalsContact O-CA 3.31Å; P889-C1038 WeakPolarHBondContact O-CA 3.27Å; P889-C1038 WeakPolarHBondContact O-CB 3.44Å; P889-V1039 WeakPolarHBondContact CD-O 3.5Å; P889-V1039 PolarHBondContact O-N 3.5Å; P889-L1052 HydrophobicContact CG-CB 3.95Å; P889-L1052 HydrophobicContact CG-CD1 3.79Å; P889-L1052 HydrophobicContact CG-CG 4.44Å; P889-V1053 HydrophobicContact CB-CG2 4.31Å; P889-V1053 HydrophobicContact CG-CG2 4.47Å; P889-I1062 HydrophobicContact CB-CG2 3.87Å
890	Q	87.6	Confident	70.7	Confident	53 Å²	53	50.4 Å²	50.4	25%	0.248	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	140.2	168.8	174.5	-175.6	80.3	0	0	110.4	G1037 N1063 C1065	Q890-G1037 CarbonylContact C-O 3.53Å; Q890-G1037 WeakPolarHBondContact CA-O 3.4Å; Q890-N1063 HydrophobicContact CB-CB 4.06Å; Q890-N1063 HydrophobicContact CG-CB 4.37Å; Q890-N1063 PolarHBondContact N-O 2.84Å; Q890-N1063 PolarHBondContact O-N 3.31Å; Q890-N1063 VanDerWaalsContact O-N 3.15Å; Q890-N1063 PolarHBondContact OE1-ND2 3.42Å; Q890-C1065 HydrophobicContact CB-CB 4.06Å
891	F	90.3	Very high	73.1	Confident	1 Å²	1	47.1 Å²	47.1	0%	0.004	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	137	179.6	-53.5	-96.6	0	0	0	109.3	P889 L897 V1017 L1035 V1036 G1037 V1039 I1062	P889-F891 HydrophobicContact CB-CE2 4.01Å; P889-F891 HydrophobicContact CB-CZ 4.04Å; P889-F891 HydrophobicContact CG-CE2 3.97Å; P889-F891 HydrophobicContact CG-CZ 4Å; P889-F891 WeakPolarHBondContact O-CE2 3.28Å; F891-L897 HydrophobicContact CE1-CD1 4.06Å; F891-L897 HydrophobicContact CE1-CG 4.24Å; F891-L897 HydrophobicContact CZ-CD1 3.85Å; F891-V1017 WeakPolarHBondContact CE1-O 3.36Å; F891-V1017 HydrophobicContact CZ-CG1 4.1Å; F891-L1035 CarbonylContact C-O 3.53Å; F891-L1035 VanDerWaalsContact C-O 3.3Å; F891-L1035 HydrophobicContact CB-CB 4.22Å; F891-L1035 HydrophobicContact CB-CG 4.44Å; F891-L1035 VanDerWaalsContact CB-O 3.23Å; F891-L1035 WeakPolarHBondContact CB-O 3.19Å; F891-L1035 HydrophobicContact CD2-CD2 3.92Å; F891-V1036 WeakPolarHBondContact O-CA 3.47Å; F891-G1037 PolarHBondContact N-O 2.75Å; F891-G1037 PolarHBondContact O-N 2.86Å; F891-V1039 HydrophobicContact CD2-CG2 4.31Å; F891-V1039 HydrophobicContact CE2-CB 4.01Å; F891-V1039 HydrophobicContact CE2-CG2 3.76Å; F891-V1039 HydrophobicContact CZ-CG2 4.49Å; F891-I1062 HydrophobicContact CD1-CD1 3.53Å; F891-I1062 HydrophobicContact CE1-CD1 3.38Å; F891-I1062 HydrophobicContact CG-CD1 4.47Å; F891-I1062 HydrophobicContact CZ-CD1 4.22Å
892	I	82.3	Confident	75.3	Confident	68 Å²	68	54.8 Å²	54.8	35%	0.349	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	40.6	-176.6	59.6	154.2	0	0	0	112	R894 S895 N1061	I892-R894 HydrophobicContact CD1-CG 4.23Å; I892-R894 HydrophobicContact CG1-CG 4.17Å; I892-R894 PolarHBondContact O-N 2.91Å; I892-S895 WeakPolarHBondContact CG1-OG 3.2Å; I892-S895 PolarHBondContact N-OG 3.01Å; I892-N1061 HydrophobicContact CD1-CB 4.48Å; I892-N1061 HydrophobicContact CG1-CB 4.5Å
893	G	83	Confident	77.6	Confident	17 Å²	17	56.3 Å²	56.3	18%	0.175	28%	0.275	C	S	.	.	S	Bend	trans	74.4	-23.3	177	0	0	0	0	0	115.6	G1034 L1035	G893-G1034 WeakPolarHBondContact O-CA 3.19Å; G893-G1034 PolarHBondContact O-N 2.85Å; G893-L1035 WeakPolarHBondContact CA-O 3.5Å; G893-L1035 PolarHBondContact N-O 2.9Å
894	R	79.3	Confident	79.8	Confident	77 Å²	77	52.7 Å²	52.7	29%	0.291	25%	0.253	S	S	.	.	S	Bend	trans	-113.1	-1.9	171.1	63.2	165.2	167.6	-157.6	-26.8	114.3	E858 D860 I892 N1061	E858-R894 IonicContact OE1-CZ 2.73Å; E858-R894 IonicContact OE1-NH1 3.74Å; E858-R894 IonicContact OE1-NH2 3.72Å; E858-R894 PolarHBondContact OE1-NH2 3.01Å; E858-R894 IonicContact OE2-CZ 2.77Å; E858-R894 IonicContact OE2-NH1 2.79Å; E858-R894 PolarHBondContact OE2-NH1 2.86Å; E858-R894 IonicContact OE2-NH2 3.85Å; E858-R894 PolarHBondContact OE2-NH2 2.81Å; D860-R894 IonicContact OD1-CZ 3.45Å; D860-R894 IonicContact OD1-NE 3.7Å; D860-R894 IonicContact OD1-NH1 3.43Å; D860-R894 PolarHBondContact OD1-NH1 3.36Å; I892-R894 HydrophobicContact CD1-CG 4.23Å; I892-R894 HydrophobicContact CG1-CG 4.17Å; I892-R894 PolarHBondContact O-N 2.91Å; R894-N1061 WeakPolarHBondContact CD-ND2 3.13Å
895	S	85.4	Confident	82.3	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.226	C	C	.	.			trans	-80	152.1	-177.9	-43.6	0	0	0	0	111.2	I892 G1018 G1019 K1060 N1061	I892-S895 WeakPolarHBondContact CG1-OG 3.2Å; I892-S895 PolarHBondContact N-OG 3.01Å; S895-G1018 CarbonylContact O-C 3.33Å; S895-G1019 WeakPolarHBondContact O-CA 3.32Å; S895-K1060 WeakPolarHBondContact CA-O 3.4Å; S895-K1060 WeakPolarHBondContact CB-O 3.39Å; S895-N1061 WeakPolarHBondContact CB-O 3.26Å; S895-N1061 PolarHBondContact OG-O 2.72Å
896	Y	91.8	Very high	84.4	Confident	34 Å²	34	52.6 Å²	52.6	13%	0.133	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	154.7	172.2	58.7	-94.2	0	0	0	112.7	T898 Y1016 V1017 G1019 G1059 K1060	Y896-T898 HydrophobicContact CD2-CG2 3.6Å; Y896-T898 HydrophobicContact CE2-CG2 3.79Å; Y896-Y1016 HydrophobicContact CD2-CD1 4.39Å; Y896-Y1016 HydrophobicContact CD2-CE1 4.48Å; Y896-V1017 WeakPolarHBondContact CA-O 3.27Å; Y896-G1019 WeakPolarHBondContact CB-O 3.26Å; Y896-G1059 CarbonylContact O-C 3.56Å; Y896-G1059 WeakPolarHBondContact O-CA 3.29Å; Y896-K1060 HydrophobicContact CD1-CB 4.27Å; Y896-K1060 HydrophobicContact CE1-CB 3.82Å; Y896-K1060 HydrophobicContact CE1-CG 4.13Å; Y896-K1060 HydrophobicContact CE2-CB 4.43Å; Y896-K1060 HydrophobicContact CE2-CG 4.41Å; Y896-K1060 PolarHBondContact N-O 2.86Å; Y896-K1060 VanDerWaalsContact N-O 3.17Å; Y896-K1060 PolarHBondContact O-N 2.81Å
897	L	91.8	Very high	86.4	Confident	0 Å²	0	54 Å²	54	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	142.4	165.8	-69.2	161.1	0	0	0	108.7	L863 P889 F891 Y899 Y1016 V1017 L1052 A1056 I1062	L863-L897 HydrophobicContact CD1-CD2 4.38Å; P889-L897 HydrophobicContact CB-CD1 4.19Å; P889-L897 HydrophobicContact CG-CD1 4.12Å; F891-L897 HydrophobicContact CE1-CD1 4.06Å; F891-L897 HydrophobicContact CE1-CG 4.24Å; F891-L897 HydrophobicContact CZ-CD1 3.85Å; L897-Y899 HydrophobicContact CB-CE2 4.04Å; L897-Y1016 WeakPolarHBondContact O-CA 3.49Å; L897-V1017 PolarHBondContact N-O 2.9Å; L897-V1017 VanDerWaalsContact N-O 3.1Å; L897-V1017 PolarHBondContact O-N 2.88Å; L897-L1052 HydrophobicContact CD1-CB 4.47Å; L897-A1056 HydrophobicContact CB-CB 4.44Å; L897-A1056 HydrophobicContact CD2-CB 3.89Å; L897-I1062 HydrophobicContact CD1-CD1 4.22Å; L897-I1062 HydrophobicContact CD2-CD1 4.25Å; L897-I1062 HydrophobicContact CD2-CG1 3.93Å; L897-I1062 HydrophobicContact CG-CD1 3.76Å; L897-I1062 HydrophobicContact CG-CG1 4.02Å
898	T	92.8	Very high	87.9	Confident	17 Å²	17	46.2 Å²	46.2	10%	0.104	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	145.7	179.8	77.1	0	0	0	0	111.3	Y896 L1015 Y1016 A1056 A1057 D1058	Y896-T898 HydrophobicContact CD2-CG2 3.6Å; Y896-T898 HydrophobicContact CE2-CG2 3.79Å; T898-L1015 CarbonylContact C-O 3.44Å; T898-L1015 WeakPolarHBondContact CA-O 3.48Å; T898-Y1016 HydrophobicContact CG2-CD1 3.72Å; T898-Y1016 HydrophobicContact CG2-CE1 3.52Å; T898-A1056 CarbonylContact O-C 3.59Å; T898-A1056 VanDerWaalsContact O-CA 3.3Å; T898-A1056 WeakPolarHBondContact O-CA 3.47Å; T898-A1057 PolarHBondContact O-N 3.37Å; T898-D1058 PolarHBondContact N-O 3.45Å; T898-D1058 PolarHBondContact OG1-N 3.31Å; T898-D1058 PolarHBondContact OG1-O 3.33Å; T898-D1058 VanDerWaalsContact OG1-O 3.13Å
899	Y	92.5	Very high	88.4	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	124.4	177.3	-43.3	-102.2	0	0	0	109.2	L897 I904 L905 P1014 L1015 V1017 L1050 L1052 D1055 A1056	L897-Y899 HydrophobicContact CB-CE2 4.04Å; Y899-I904 HydrophobicContact CD1-CD1 4Å; Y899-I904 HydrophobicContact CG-CD1 4.39Å; Y899-L905 WeakPolarHBondContact O-CD2 3.15Å; Y899-P1014 CarbonylContact O-C 3.51Å; Y899-P1014 VanDerWaalsContact O-CA 3.29Å; Y899-P1014 WeakPolarHBondContact O-CA 3.47Å; Y899-P1014 VanDerWaalsContact O-CB 3.24Å; Y899-P1014 WeakPolarHBondContact O-CB 3.33Å; Y899-L1015 HydrophobicContact CD2-CB 4.18Å; Y899-L1015 HydrophobicContact CD2-CD2 4.05Å; Y899-L1015 HydrophobicContact CD2-CG 4.08Å; Y899-L1015 PolarHBondContact N-O 3.39Å; Y899-L1015 PolarHBondContact O-N 2.85Å; Y899-V1017 HydrophobicContact CD2-CG2 4.4Å; Y899-V1017 HydrophobicContact CE2-CB 4.05Å; Y899-V1017 HydrophobicContact CE2-CG2 3.59Å; Y899-L1050 HydrophobicContact CD1-CD1 4.05Å; Y899-L1050 HydrophobicContact CD1-CD2 4.22Å; Y899-L1050 HydrophobicContact CE1-CD1 4.12Å; Y899-L1050 HydrophobicContact CE1-CD2 3.83Å; Y899-L1050 HydrophobicContact CE1-CG 4.13Å; Y899-L1050 HydrophobicContact CE2-CD2 4.37Å; Y899-L1052 WeakPolarHBondContact CE1-O 3.42Å; Y899-L1052 WeakPolarHBondContact OH-CD2 3.23Å; Y899-L1052 PolarHBondContact OH-O 2.92Å; Y899-D1055 HydrophobicContact CD1-CB 4.08Å; Y899-D1055 WeakPolarHBondContact CD1-O 3.48Å; Y899-D1055 HydrophobicContact CE1-CB 4.13Å; Y899-A1056 HydrophobicContact CD1-CB 4.3Å; Y899-A1056 HydrophobicContact CE1-CB 3.88Å
900	D	90.1	Very high	88.5	Confident	102 Å²	102	47 Å²	47	55%	0.545	23%	0.226	S	C	.	.			trans	-115	-9.3	178.4	72.4	-19	0	0	0	113.4	R902 L905 P1014	D900-R902 PolarHBondContact O-N 3.03Å; D900-L905 WeakPolarHBondContact O-CD1 3.16Å; D900-P1014 HydrophobicContact CB-CB 4.44Å
901	N	91.5	Very high	88.5	Confident	77 Å²	77	48 Å²	48	41%	0.412	24%	0.239	S	C	.	.			trans	-52.7	122.1	179.8	179.9	-28.9	0	0	0	111.2	D903 I904 L905	N901-D903 PolarHBondContact O-N 2.86Å; N901-D903 PolarHBondContact OD1-N 3.21Å; N901-I904 HydrophobicContact CB-CD1 3.91Å; N901-I904 HydrophobicContact CB-CG1 4.11Å; N901-I904 WeakPolarHBondContact O-CB 3.44Å; N901-I904 PolarHBondContact O-N 3.38Å; N901-L905 WeakPolarHBondContact O-CG 3.4Å; N901-L905 PolarHBondContact O-N 2.88Å
902	R	87.1	Confident	88.5	Confident	200 Å²	200	54.3 Å²	54.3	76%	0.755	26%	0.262	S	S	*	.	H	α-helix	trans	-52.7	-31.6	-174.6	-69.8	-178	172.5	-170.8	-2.5	113.7	D900 K906	D900-R902 PolarHBondContact O-N 3.03Å; R902-K906 WeakPolarHBondContact O-CB 3.42Å; R902-K906 WeakPolarHBondContact O-CD 3.29Å; R902-K906 WeakPolarHBondContact O-CG 3.35Å; R902-K906 PolarHBondContact O-N 3.09Å
903	D	87.8	Confident	89	Confident	74 Å²	74	51 Å²	51	40%	0.396	25%	0.246	S	C	.	.	H	α-helix	trans	-86.5	-19.9	-176.6	-72.8	-9.6	0	0	0	113.6	N901 K906 R907	N901-D903 PolarHBondContact O-N 2.86Å; N901-D903 PolarHBondContact OD1-N 3.21Å; D903-K906 WeakPolarHBondContact OD1-CD 3.44Å; D903-K906 WeakPolarHBondContact OD1-CE 3.47Å; D903-K906 IonicContact OD1-NZ 2.65Å; D903-K906 PolarHBondContact OD1-NZ 3.31Å; D903-R907 WeakPolarHBondContact O-CG 3.39Å; D903-R907 PolarHBondContact O-NH1 3.35Å
904	I	88.8	Confident	89.5	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-72	-50.8	161.8	-59.1	176	0	0	0	108.5	Y899 N901 K906 R907 V908 L1015 L1044 F1048 L1050 D1055	Y899-I904 HydrophobicContact CD1-CD1 4Å; Y899-I904 HydrophobicContact CG-CD1 4.39Å; N901-I904 HydrophobicContact CB-CD1 3.91Å; N901-I904 HydrophobicContact CB-CG1 4.11Å; N901-I904 WeakPolarHBondContact O-CB 3.44Å; N901-I904 PolarHBondContact O-N 3.38Å; I904-K906 PolarHBondContact O-N 2.8Å; I904-R907 PolarHBondContact O-N 2.86Å; I904-V908 PolarHBondContact O-N 2.94Å; I904-L1015 HydrophobicContact CG2-CD2 3.95Å; I904-L1044 HydrophobicContact CG2-CD1 3.74Å; I904-F1048 HydrophobicContact CG1-CE1 4.21Å; I904-F1048 HydrophobicContact CG1-CZ 4.44Å; I904-L1050 HydrophobicContact CD1-CD1 3.44Å; I904-L1050 VanDerWaalsContact CD1-CD1 3.44Å; I904-L1050 HydrophobicContact CG1-CD1 3.95Å; I904-L1050 HydrophobicContact CG2-CD1 4.26Å; I904-D1055 HydrophobicContact CD1-CB 4.02Å
905	L	90.8	Very high	90.2	Very high	28 Å²	28	47.1 Å²	47.1	15%	0.147	23%	0.227	C	C	.	.	H	α-helix	trans	-62	-39.6	-175.5	-62.3	-176.7	0	0	0	113.2	Y899 D900 N901 R907 V908 S909 R931 L1015	Y899-L905 WeakPolarHBondContact O-CD2 3.15Å; D900-L905 WeakPolarHBondContact O-CD1 3.16Å; N901-L905 WeakPolarHBondContact O-CG 3.4Å; N901-L905 PolarHBondContact O-N 2.88Å; L905-R907 VanDerWaalsContact C-N 3.28Å; L905-R907 PolarHBondContact O-N 2.64Å; L905-V908 PolarHBondContact O-N 2.86Å; L905-S909 WeakPolarHBondContact O-CB 3.27Å; L905-S909 PolarHBondContact O-N 3.03Å; L905-S909 VanDerWaalsContact O-N 3.14Å; L905-S909 PolarHBondContact O-OG 3.36Å; L905-R931 PolarHBondContact O-NH1 2.93Å; L905-L1015 HydrophobicContact CD2-CB 4.18Å
906	K	88.1	Confident	90.6	Very high	138 Å²	138	49.6 Å²	49.6	60%	0.6	24%	0.237	S	C	*	.	H	α-helix	trans	-57.9	-37.9	173.8	-76.4	164.7	-164.8	167.3	0	112.8	R902 D903 I904 V908	R902-K906 WeakPolarHBondContact O-CB 3.42Å; R902-K906 WeakPolarHBondContact O-CD 3.29Å; R902-K906 WeakPolarHBondContact O-CG 3.35Å; R902-K906 PolarHBondContact O-N 3.09Å; D903-K906 WeakPolarHBondContact OD1-CD 3.44Å; D903-K906 WeakPolarHBondContact OD1-CE 3.47Å; D903-K906 IonicContact OD1-NZ 2.65Å; D903-K906 PolarHBondContact OD1-NZ 3.31Å; I904-K906 PolarHBondContact O-N 2.8Å; K906-V908 VanDerWaalsContact C-N 3.34Å
907	R	90.1	Very high	90.7	Very high	61 Å²	61	48 Å²	48	23%	0.23	23%	0.232	C	C	.	.	H	α-helix	trans	-74.2	-22.1	-177.2	-70.7	179.1	166.2	89.4	-7.9	113.7	D903 I904 L905 L1044 S1045 D1047 F1048	D903-R907 WeakPolarHBondContact O-CG 3.39Å; D903-R907 PolarHBondContact O-NH1 3.35Å; I904-R907 PolarHBondContact O-N 2.86Å; L905-R907 VanDerWaalsContact C-N 3.28Å; L905-R907 PolarHBondContact O-N 2.64Å; R907-L1044 HydrophobicContact CB-CB 4.07Å; R907-L1044 HydrophobicContact CB-CD1 4.39Å; R907-S1045 WeakPolarHBondContact CB-OG 3.33Å; R907-S1045 WeakPolarHBondContact CG-OG 3.23Å; R907-D1047 IonicContact NE-OD1 3.91Å; R907-D1047 IonicContact NH2-OD2 2.74Å; R907-F1048 VanDerWaalsContact NE-CB 3.33Å
908	V	89.1	Confident	90.8	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-92.6	-24.4	176.5	-176.8	0	0	0	0	112.4	I904 L905 K906 T913 L915 I943 L1009 L1015 L1044	I904-V908 PolarHBondContact O-N 2.94Å; L905-V908 PolarHBondContact O-N 2.86Å; K906-V908 VanDerWaalsContact C-N 3.34Å; V908-T913 HydrophobicContact CG1-CG2 4.47Å; V908-T913 WeakPolarHBondContact O-CG2 3.36Å; V908-T913 PolarHBondContact O-OG1 2.87Å; V908-L915 HydrophobicContact CG2-CD2 4.27Å; V908-I943 HydrophobicContact CG1-CG2 3.76Å; V908-L1009 WeakPolarHBondContact O-CD2 3.42Å; V908-L1015 HydrophobicContact CG1-CD1 4.4Å; V908-L1015 HydrophobicContact CG2-CD2 4.22Å; V908-L1044 HydrophobicContact CG2-CD1 4.14Å; V908-L1044 HydrophobicContact CG2-CD2 3.9Å
909	S	89.4	Confident	90.9	Very high	17 Å²	17	49.9 Å²	49.9	12%	0.119	24%	0.239	C	C	.	.	S	Bend	trans	-91.1	-170.7	179.2	-67.9	0	0	0	0	114.1	L905 R931	L905-S909 WeakPolarHBondContact O-CB 3.27Å; L905-S909 PolarHBondContact O-N 3.03Å; L905-S909 VanDerWaalsContact O-N 3.14Å; L905-S909 PolarHBondContact O-OG 3.36Å; S909-R931 VanDerWaalsContact OG-CZ 3.27Å; S909-R931 PolarHBondContact OG-NH1 3.3Å; S909-R931 PolarHBondContact OG-NH2 2.99Å
910	G	88.6	Confident	91	Very high	24 Å²	24	51.7 Å²	51.7	25%	0.247	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	87	-156.9	165.6	0	0	0	0	0	114.6	R983 L1009	G910-R983 PolarHBondContact O-NH2 2.91Å; G910-L1009 PolarHBondContact N-O 2.7Å; G910-L1009 WeakPolarHBondContact O-CB 3.42Å; G910-L1009 PolarHBondContact O-N 2.83Å
911	S	87.8	Confident	91.1	Very high	72 Å²	72	46.9 Å²	46.9	50%	0.503	22%	0.221	S	C	.	.	S	Bend	trans	-76.3	-30.7	-176.6	54.8	0	0	0	0	113.4	R983 G985	S911-R983 PolarHBondContact O-NH1 3.08Å; S911-R983 VanDerWaalsContact O-NH1 3.16Å; S911-G985 WeakPolarHBondContact O-CA 3.46Å; S911-G985 PolarHBondContact O-N 2.82Å
912	R	91	Very high	91.1	Very high	134 Å²	134	47.8 Å²	47.8	51%	0.506	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	138.5	-175.8	-176.3	178.4	174.8	177.3	-3.9	110.5	N914 R983 D984	R912-N914 PolarHBondContact NE-OD1 2.84Å; R912-R983 CarbonylContact C-O 3.59Å; R912-R983 VanDerWaalsContact CA-O 3.27Å; R912-R983 WeakPolarHBondContact CA-O 3.2Å; R912-R983 VanDerWaalsContact CG-O 3.28Å; R912-R983 WeakPolarHBondContact CG-O 3.4Å; R912-D984 HydrophobicContact CG-CB 4.39Å
913	T	92.3	Very high	91.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	132.7	178.8	-49	0	0	0	0	108.7	V908 L915 I943 V982 R983	V908-T913 HydrophobicContact CG1-CG2 4.47Å; V908-T913 WeakPolarHBondContact O-CG2 3.36Å; V908-T913 PolarHBondContact O-OG1 2.87Å; T913-L915 HydrophobicContact CG2-CD2 3.85Å; T913-L915 HydrophobicContact CG2-CG 4.01Å; T913-I943 HydrophobicContact CG2-CD1 3.81Å; T913-V982 WeakPolarHBondContact O-CA 3.45Å; T913-R983 PolarHBondContact N-O 2.81Å; T913-R983 PolarHBondContact O-N 3.25Å; T913-R983 PolarHBondContact OG1-NE 2.81Å; T913-R983 PolarHBondContact OG1-NH2 3.39Å
914	N	92.6	Very high	91.5	Very high	11 Å²	11	41 Å²	41	6%	0.059	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	124.4	170.9	-44.7	-84.7	0	0	0	108.4	R912 F916 V982 L1044 S1045 T1046	R912-N914 PolarHBondContact NE-OD1 2.84Å; N914-F916 HydrophobicContact CB-CE2 4.07Å; N914-V982 HydrophobicContact CB-CG2 4.44Å; N914-L1044 CarbonylContact O-C 3.53Å; N914-L1044 WeakPolarHBondContact O-CA 3.34Å; N914-S1045 PolarHBondContact O-N 2.84Å; N914-T1046 HydrophobicContact CB-CG2 4Å
915	L	94.8	Very high	91.7	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	132	179.5	-49.1	175.2	0	0	0	108.7	V908 T913 L929 I943 M945 F954 A981 F1042 L1044	V908-L915 HydrophobicContact CG2-CD2 4.27Å; T913-L915 HydrophobicContact CG2-CD2 3.85Å; T913-L915 HydrophobicContact CG2-CG 4.01Å; L915-L929 HydrophobicContact CD1-CD1 4.18Å; L915-I943 HydrophobicContact CD1-CD1 4.25Å; L915-M945 HydrophobicContact CD1-CE 4.27Å; L915-F954 HydrophobicContact CD1-CE2 4.04Å; L915-A981 HydrophobicContact CB-CB 4.33Å; L915-A981 PolarHBondContact N-O 3.23Å; L915-A981 PolarHBondContact O-N 2.73Å; L915-A981 VanDerWaalsContact O-O 3.1Å; L915-F1042 HydrophobicContact CB-CE2 4.3Å; L915-F1042 HydrophobicContact CD2-CE2 4.15Å; L915-F1042 HydrophobicContact CD2-CZ 4.37Å; L915-L1044 HydrophobicContact CD2-CD2 3.48Å; L915-L1044 VanDerWaalsContact CD2-CD2 3.48Å
916	F	93.8	Very high	91.8	Very high	51 Å²	51	44.1 Å²	44.1	22%	0.224	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	131.7	173.4	-58.5	-117.7	0	0	0	107.7	N914 V979 K980 F1042 T1043 T1046	N914-F916 HydrophobicContact CB-CE2 4.07Å; F916-V979 VanDerWaalsContact CA-O 3.31Å; F916-V979 WeakPolarHBondContact CA-O 3.46Å; F916-K980 HydrophobicContact CD1-CB 4.23Å; F916-K980 HydrophobicContact CD1-CD 3.94Å; F916-K980 HydrophobicContact CD1-CG 3.87Å; F916-K980 HydrophobicContact CE1-CD 3.43Å; F916-K980 VanDerWaalsContact CE1-CD 3.43Å; F916-K980 HydrophobicContact CE1-CG 3.76Å; F916-K980 HydrophobicContact CG-CG 4.46Å; F916-K980 HydrophobicContact CZ-CD 4.02Å; F916-K980 HydrophobicContact CZ-CG 4.2Å; F916-F1042 CarbonylContact O-C 3.59Å; F916-F1042 VanDerWaalsContact O-CA 3.31Å; F916-F1042 WeakPolarHBondContact O-CA 3.14Å; F916-F1042 WeakPolarHBondContact O-CD2 3.22Å; F916-T1043 PolarHBondContact N-O 3.06Å; F916-T1043 PolarHBondContact O-N 3.34Å; F916-T1046 HydrophobicContact CE2-CG2 3.74Å; F916-T1046 HydrophobicContact CZ-CG2 3.9Å
917	M	94.3	Very high	92.2	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	156.2	175.9	59.3	177.5	62.7	0	0	110.3	L928 L929 M945 V979 V1039 F1042	M917-L928 HydrophobicContact SD-CD2 4.38Å; M917-L929 HydrophobicContact CE-CD1 3.9Å; M917-M945 HydrophobicContact SD-SD 4Å; M917-V979 HydrophobicContact CG-CB 4.11Å; M917-V979 PolarHBondContact N-O 2.72Å; M917-V979 PolarHBondContact O-N 3.18Å; M917-V1039 HydrophobicContact CB-CG1 4.37Å; M917-V1039 HydrophobicContact SD-CG1 4.42Å; M917-F1042 HydrophobicContact CB-CB 4.43Å; M917-F1042 HydrophobicContact CB-CD2 4.16Å; M917-F1042 HydrophobicContact CB-CG 4.45Å; M917-F1042 HydrophobicContact CE-CD1 4.38Å; M917-F1042 HydrophobicContact CE-CD2 3.85Å; M917-F1042 HydrophobicContact CE-CE1 4.22Å; M917-F1042 HydrophobicContact CE-CE2 3.64Å; M917-F1042 HydrophobicContact CE-CG 4.25Å; M917-F1042 HydrophobicContact CE-CZ 3.86Å
918	H	93.8	Very high	92.5	Very high	56 Å²	56	34.6 Å²	34.6	26%	0.259	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	140.4	162.5	-58.9	163.9	0	0	0	108.4	W976 H977 V1039 S1040 H1041	H918-W976 HydrophobicContact CB-CE3 3.85Å; H918-W976 HydrophobicContact CB-CZ3 4.09Å; H918-H977 CarbonylContact C-O 3.49Å; H918-H977 VanDerWaalsContact CA-O 3.28Å; H918-H977 WeakPolarHBondContact CA-O 3.42Å; H918-V1039 WeakPolarHBondContact O-CA 3.39Å; H918-S1040 PolarHBondContact N-O 3.17Å; H918-S1040 PolarHBondContact O-N 3.23Å; H918-H1041 HydrophobicContact CB-CB 4.45Å; H918-H1041 AromaticContact CE1-CD2 3.93Å; H918-H1041 AromaticContact CE1-CG 3.73Å; H918-H1041 AromaticContact ND1-CD2 3.95Å; H918-H1041 AromaticContact ND1-CE1 3.96Å; H918-H1041 AromaticContact ND1-CG 3.38Å; H918-H1041 AromaticContact ND1-ND1 3.37Å; H918-H1041 PolarHBondContact ND1-ND1 3.4Å
919	F	95.4	Very high	92.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	158.5	172.1	79.6	-81.4	0	0	0	111.6	L928 L947 L952 F971 W976 H977 V979 C1038	F919-L928 HydrophobicContact CB-CD2 3.84Å; F919-L928 HydrophobicContact CD1-CD2 3.91Å; F919-L928 HydrophobicContact CD2-CD2 3.86Å; F919-L928 HydrophobicContact CE1-CD2 4.45Å; F919-L928 HydrophobicContact CE2-CD2 4.41Å; F919-L928 HydrophobicContact CG-CD2 3.58Å; F919-L947 HydrophobicContact CE2-CD1 4.08Å; F919-L947 HydrophobicContact CE2-CD2 4.08Å; F919-L947 HydrophobicContact CE2-CG 4.38Å; F919-L947 HydrophobicContact CZ-CD2 4.18Å; F919-L952 HydrophobicContact CE1-CD1 4.16Å; F919-L952 HydrophobicContact CE1-CD2 3.98Å; F919-L952 HydrophobicContact CZ-CD1 4.02Å; F919-L952 HydrophobicContact CZ-CD2 4.4Å; F919-F971 HydrophobicContact CE2-CB 4.16Å; F919-F971 HydrophobicContact CZ-CB 3.88Å; F919-F971 HydrophobicContact CZ-CD1 4.37Å; F919-F971 HydrophobicContact CZ-CG 4.19Å; F919-W976 VanDerWaalsContact C-CE3 3.45Å; F919-W976 WeakPolarHBondContact O-CA 3.5Å; F919-H977 HydrophobicContact CD1-CB 4.02Å; F919-H977 HydrophobicContact CE1-CB 3.57Å; F919-H977 HydrophobicContact CZ-CB 3.86Å; F919-H977 PolarHBondContact N-O 2.72Å; F919-H977 PolarHBondContact O-N 2.89Å; F919-V979 HydrophobicContact CD1-CG2 3.47Å; F919-V979 VanDerWaalsContact CD1-CG2 3.47Å; F919-V979 HydrophobicContact CE1-CG2 3.35Å; F919-C1038 CarbonylContact C-O 3.55Å; F919-C1038 VanDerWaalsContact CA-O 3.26Å; F919-C1038 WeakPolarHBondContact CA-O 3.29Å
920	K	93.1	Very high	93	Very high	37 Å²	37	34 Å²	34	16%	0.161	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	131.6	174.4	163	171.1	164.7	168.5	0	107.4	G974 K975 W976 G1037 C1038 N1067	K920-G974 VanDerWaalsContact CD-O 3.28Å; K920-G974 WeakPolarHBondContact CD-O 3.36Å; K920-G974 WeakPolarHBondContact CE-O 3.46Å; K920-G974 WeakPolarHBondContact CG-O 3.42Å; K920-K975 VanDerWaalsContact CA-O 3.24Å; K920-K975 WeakPolarHBondContact CA-O 3.3Å; K920-K975 WeakPolarHBondContact CB-O 3.45Å; K920-W976 HydrophobicContact CB-CD2 3.94Å; K920-W976 HydrophobicContact CB-CE3 3.91Å; K920-W976 HydrophobicContact CB-CH2 4.26Å; K920-W976 HydrophobicContact CB-CZ2 4.3Å; K920-W976 HydrophobicContact CB-CZ3 4.09Å; K920-W976 HydrophobicContact CD-CZ2 4.47Å; K920-G1037 CarbonylContact O-C 3.18Å; K920-G1037 WeakPolarHBondContact O-CA 3.19Å; K920-C1038 PolarHBondContact N-O 2.84Å; K920-C1038 PolarHBondContact O-N 3.44Å; K920-N1067 PolarHBondContact NZ-OXT 3.35Å
921	S	93.8	Very high	93.2	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.007	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	148.9	-179.5	-171.8	0	0	0	0	111.5	A923 L947 F971 S972 D973 G974 V1036	S921-A923 PolarHBondContact OG-N 3.34Å; S921-A923 PolarHBondContact OG-O 2.94Å; S921-L947 VanDerWaalsContact CB-CD1 3.49Å; S921-L947 WeakPolarHBondContact OG-CD1 3.44Å; S921-F971 WeakPolarHBondContact CB-O 3.48Å; S921-S972 CarbonylContact O-C 3.56Å; S921-S972 WeakPolarHBondContact O-CA 3.22Å; S921-D973 PolarHBondContact O-N 3.04Å; S921-G974 WeakPolarHBondContact O-CA 3.34Å; S921-G974 PolarHBondContact O-N 3.2Å; S921-V1036 PolarHBondContact OG-O 3.3Å
922	T	90	Very high	93.2	Very high	97 Å²	97	30.2 Å²	30.2	60%	0.595	15%	0.149	S	C	*	.	S	Bend	trans	-109.8	-15.4	165.5	54.8	0	0	0	0	112.5	V1036	T922-V1036 PolarHBondContact N-O 2.84Å; T922-V1036 VanDerWaalsContact N-O 3.12Å
923	A	92.2	Very high	92.3	Very high	25 Å²	25	25.9 Å²	25.9	21%	0.207	14%	0.136	C	C	.	.	S	Bend	trans	-89.9	146.4	171.9	0	0	0	0	0	111.9	S921 D925 S972 V1036	S921-A923 PolarHBondContact OG-N 3.34Å; S921-A923 PolarHBondContact OG-O 2.94Å; A923-D925 VanDerWaalsContact C-N 3.33Å; A923-S972 WeakPolarHBondContact O-CB 3.43Å; A923-V1036 HydrophobicContact CB-CB 3.8Å; A923-V1036 HydrophobicContact CB-CG2 4.07Å
924	K	92.6	Very high	90.7	Very high	107 Å²	107	29.9 Å²	29.9	47%	0.465	16%	0.164	S	C	.	.	S	Bend	trans	-73.5	-23.1	172.4	-81.7	-175.8	158.7	-152.3	0	113.8	L947 D949 G950	K924-L947 WeakPolarHBondContact O-CB 3.13Å; K924-D949 IonicContact NZ-OD1 3.05Å; K924-D949 PolarHBondContact NZ-OD1 2.87Å; K924-D949 PolarHBondContact O-N 2.72Å; K924-G950 WeakPolarHBondContact O-CA 3.47Å; K924-G950 PolarHBondContact O-N 2.8Å
925	D	92.6	Very high	89	Confident	89 Å²	89	33 Å²	33	48%	0.476	19%	0.185	S	C	.	.	S	Bend	trans	-132.3	137.7	-171.5	-58.3	-86.2	0	0	0	108.4	A923 L947 Q948 D949	A923-D925 VanDerWaalsContact C-N 3.33Å; D925-L947 WeakPolarHBondContact CA-O 3.47Å; D925-Q948 VanDerWaalsContact OD1-CA 3.3Å; D925-Q948 WeakPolarHBondContact OD1-CA 3.22Å; D925-D949 PolarHBondContact OD1-N 2.76Å
926	G	93.1	Very high	87.3	Confident	3 Å²	3	35.2 Å²	35.2	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.5	136.9	179.3	0	0	0	0	0	113.9	L928 G946 L947 G1033 G1034	G926-L928 WeakPolarHBondContact O-CD1 3.28Å; G926-L928 PolarHBondContact O-N 3.15Å; G926-G946 CarbonylContact O-C 3.39Å; G926-G946 VanDerWaalsContact O-CA 3.23Å; G926-G946 WeakPolarHBondContact O-CA 3.32Å; G926-L947 PolarHBondContact N-O 3.27Å; G926-L947 PolarHBondContact O-N 2.89Å; G926-G1033 WeakPolarHBondContact CA-O 3.21Å; G926-G1034 VanDerWaalsContact CA-O 3.24Å; G926-G1034 WeakPolarHBondContact CA-O 3.34Å
927	L	95.8	Very high	86	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	121	174.6	179.8	71.7	0	0	0	111.2	L929 W930 G1018 M1020 I1023 T1027 Y1031 G1033 L1035	L927-L929 WeakPolarHBondContact CD1-O 3.47Å; L927-W930 HydrophobicContact CD1-CB 4.14Å; L927-W930 HydrophobicContact CD1-CE3 4.42Å; L927-W930 HydrophobicContact CD2-CB 3.82Å; L927-W930 HydrophobicContact CG-CB 4.42Å; L927-G1018 CarbonylContact O-C 3.59Å; L927-M1020 HydrophobicContact CD2-CG 3.62Å; L927-M1020 HydrophobicContact CD2-SD 3.54Å; L927-M1020 VanDerWaalsContact CD2-SD 3.54Å; L927-I1023 HydrophobicContact CB-CG2 4.26Å; L927-I1023 HydrophobicContact CD2-CG2 3.93Å; L927-T1027 HydrophobicContact CD1-CG2 4.39Å; L927-T1027 HydrophobicContact CD2-CG2 4.21Å; L927-Y1031 HydrophobicContact CB-CD2 4.31Å; L927-Y1031 HydrophobicContact CB-CG 4.05Å; L927-Y1031 HydrophobicContact CD1-CD2 3.57Å; L927-Y1031 HydrophobicContact CD1-CE2 3.79Å; L927-Y1031 HydrophobicContact CD1-CG 4.17Å; L927-G1033 PolarHBondContact N-O 3.04Å; L927-L1035 PolarHBondContact O-N 3.18Å; L927-L1035 VanDerWaalsContact O-N 3.1Å
928	L	95.8	Very high	84.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-35	174.6	-86.2	73.5	0	0	0	112.4	M917 F919 G926 M945 L947 L952 G1018 L1035	M917-L928 HydrophobicContact SD-CD2 4.38Å; F919-L928 HydrophobicContact CB-CD2 3.84Å; F919-L928 HydrophobicContact CD1-CD2 3.91Å; F919-L928 HydrophobicContact CD2-CD2 3.86Å; F919-L928 HydrophobicContact CE1-CD2 4.45Å; F919-L928 HydrophobicContact CE2-CD2 4.41Å; F919-L928 HydrophobicContact CG-CD2 3.58Å; G926-L928 WeakPolarHBondContact O-CD1 3.28Å; G926-L928 PolarHBondContact O-N 3.15Å; L928-M945 WeakPolarHBondContact CA-O 3.44Å; L928-M945 WeakPolarHBondContact CB-O 3.44Å; L928-M945 PolarHBondContact N-O 3.34Å; L928-L947 HydrophobicContact CD1-CD1 4.35Å; L928-L947 HydrophobicContact CD1-CG 3.96Å; L928-L952 HydrophobicContact CD2-CD1 4.1Å; L928-G1018 PolarHBondContact O-N 2.86Å; L928-L1035 HydrophobicContact CD1-CD1 4.02Å; L928-L1035 HydrophobicContact CG-CD1 4.38Å; L928-L1035 HydrophobicContact CG-CD2 4.39Å
929	L	95.8	Very high	83.3	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	135	-176.7	179.6	151.8	0	0	0	110.5	L915 M917 L927 S944 M945 L1015 Y1016 F1042	L915-L929 HydrophobicContact CD1-CD1 4.18Å; M917-L929 HydrophobicContact CE-CD1 3.9Å; L927-L929 WeakPolarHBondContact CD1-O 3.47Å; L929-S944 CarbonylContact O-C 3.44Å; L929-S944 WeakPolarHBondContact O-CA 3.42Å; L929-S944 WeakPolarHBondContact O-CB 3.37Å; L929-M945 HydrophobicContact CB-CB 4.05Å; L929-M945 PolarHBondContact N-O 2.78Å; L929-M945 PolarHBondContact O-N 2.9Å; L929-L1015 HydrophobicContact CD1-CD1 4.1Å; L929-L1015 HydrophobicContact CD2-CD1 4.12Å; L929-L1015 HydrophobicContact CG-CD1 3.93Å; L929-Y1016 WeakPolarHBondContact CA-O 3.39Å; L929-F1042 HydrophobicContact CD1-CE1 3.99Å; L929-F1042 HydrophobicContact CD1-CE2 4.29Å; L929-F1042 HydrophobicContact CD1-CZ 3.43Å; L929-F1042 VanDerWaalsContact CD1-CZ 3.43Å
930	W	93.6	Very high	82.6	Confident	4 Å²	4	50 Å²	50	2%	0.015	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	138.7	169.8	-178.4	-98.4	0	0	0	112	L927 M936 F942 Y1016 M1020 H1026 T1027	L927-W930 HydrophobicContact CD1-CB 4.14Å; L927-W930 HydrophobicContact CD1-CE3 4.42Å; L927-W930 HydrophobicContact CD2-CB 3.82Å; L927-W930 HydrophobicContact CG-CB 4.42Å; W930-M936 HydrophobicContact CH2-SD 3.71Å; W930-M936 HydrophobicContact CZ2-SD 4.16Å; W930-F942 HydrophobicContact CH2-CB 3.89Å; W930-F942 HydrophobicContact CH2-CD1 4.39Å; W930-F942 AromaticContact CH2-CD2 3.52Å; W930-F942 HydrophobicContact CH2-CD2 3.52Å; W930-F942 HydrophobicContact CH2-CE2 4.1Å; W930-F942 AromaticContact CH2-CG 3.69Å; W930-F942 HydrophobicContact CH2-CG 3.69Å; W930-F942 HydrophobicContact CZ2-CB 3.93Å; W930-F942 HydrophobicContact CZ2-CD2 4.39Å; W930-F942 HydrophobicContact CZ2-CG 4.25Å; W930-F942 AromaticContact CZ3-CD2 3.63Å; W930-F942 HydrophobicContact CZ3-CD2 3.63Å; W930-F942 HydrophobicContact CZ3-CE2 4.02Å; W930-F942 HydrophobicContact CZ3-CG 4.28Å; W930-Y1016 PolarHBondContact N-O 2.87Å; W930-Y1016 PolarHBondContact O-N 2.89Å; W930-M1020 HydrophobicContact CB-SD 3.69Å; W930-M1020 HydrophobicContact CD2-SD 4.32Å; W930-M1020 HydrophobicContact CG-SD 3.59Å; W930-M1020 VanDerWaalsContact CG-SD 3.59Å; W930-H1026 WeakPolarHBondContact CH2-O 3.34Å; W930-H1026 WeakPolarHBondContact CZ2-O 3.37Å; W930-T1027 HydrophobicContact CD2-CG2 4.18Å; W930-T1027 HydrophobicContact CE3-CG2 3.76Å; W930-T1027 HydrophobicContact CZ3-CG2 4.03Å
931	R	92.4	Very high	82.5	Confident	9 Å²	9	49 Å²	49	3%	0.034	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	122.1	155.6	-176.6	154.2	168.5	-112.7	-15.2	109.5	L905 S909 F942 I943 I1011 G1013 P1014 L1015	L905-R931 PolarHBondContact O-NH1 2.93Å; S909-R931 VanDerWaalsContact OG-CZ 3.27Å; S909-R931 PolarHBondContact OG-NH1 3.3Å; S909-R931 PolarHBondContact OG-NH2 2.99Å; R931-F942 CarbonylContact O-C 3.49Å; R931-F942 VanDerWaalsContact O-CA 3.25Å; R931-F942 WeakPolarHBondContact O-CA 3.07Å; R931-I943 HydrophobicContact CB-CG2 4.15Å; R931-I943 PolarHBondContact N-O 2.88Å; R931-I943 PolarHBondContact O-N 3.39Å; R931-I1011 HydrophobicContact CG-CB 4.38Å; R931-I1011 HydrophobicContact CG-CD1 4.22Å; R931-I1011 HydrophobicContact CG-CG2 3.63Å; R931-I1011 PolarHBondContact NH2-O 3.33Å; R931-I1011 WeakPolarHBondContact O-CD1 3.41Å; R931-G1013 PolarHBondContact NE-O 3.32Å; R931-P1014 WeakPolarHBondContact CD-O 3.27Å; R931-P1014 WeakPolarHBondContact CG-O 3.38Å; R931-L1015 HydrophobicContact CB-CD1 4.07Å
932	G	87.6	Confident	82.4	Confident	8 Å²	8	49 Å²	49	8%	0.082	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.6	163.7	-177.1	0	0	0	0	0	110.3	D941 I1011	G932-D941 WeakPolarHBondContact CA-O 3.29Å; G932-I1011 VanDerWaalsContact CA-CG2 3.47Å
933	D	72.1	Confident	82.6	Confident	42 Å²	42	44.4 Å²	44.4	23%	0.225	24%	0.241	C	C	.	.			trans	-56.4	148.5	173.6	-68.6	-33	0	0	0	111.6	P935 M936 S940	D933-P935 CarbonylContact O-C 3.52Å; D933-M936 WeakPolarHBondContact O-CA 3.39Å; D933-M936 PolarHBondContact O-N 2.93Å; D933-S940 PolarHBondContact OD2-OG 3.42Å
934	S	59.8	Low	82.7	Confident	84 Å²	84	43.2 Å²	43.2	59%	0.587	23%	0.231	S	C	*	.	S	Bend	trans	-128.7	116.9	-171.2	178.4	0	0	0	0	110.8	H1026	S934-H1026 PolarHBondContact OG-CE1 2.84Å; S934-H1026 PolarHBondContact OG-ND1 2.84Å
935	P	57.4	Low	82.9	Confident	78 Å²	78	38.1 Å²	38.1	51%	0.506	21%	0.209	S	C	.	.	S	Bend	cis	-67.7	153.1	-12.7	31.3	-36	0	0	0	112.4	D933 R937	D933-P935 CarbonylContact O-C 3.52Å; P935-R937 PolarHBondContact O-N 2.86Å
936	M	58.4	Low	83.1	Confident	46 Å²	46	33.9 Å²	33.9	23%	0.227	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-66.9	119.3	-178	172.8	-178.8	168.1	0	0	111.3	W930 D933 F942 H1026 N1028	W930-M936 HydrophobicContact CH2-SD 3.71Å; W930-M936 HydrophobicContact CZ2-SD 4.16Å; D933-M936 WeakPolarHBondContact O-CA 3.39Å; D933-M936 PolarHBondContact O-N 2.93Å; M936-F942 HydrophobicContact CE-CD1 3.81Å; M936-F942 HydrophobicContact CE-CE1 3.45Å; M936-F942 VanDerWaalsContact CE-CE1 3.45Å; M936-F942 HydrophobicContact CE-CZ 4.14Å; M936-F942 HydrophobicContact SD-CD1 4.3Å; M936-F942 HydrophobicContact SD-CE1 4.38Å; M936-H1026 WeakPolarHBondContact CB-O 3.33Å; M936-N1028 HydrophobicContact CE-CB 4.35Å; M936-N1028 HydrophobicContact SD-CB 3.94Å
937	R	66.6	Low	83.2	Confident	182 Å²	182	33.8 Å²	33.8	69%	0.687	19%	0.185	S	C	*	.	P	Polyproline II helix	trans	-89.3	158.1	176.7	-55.4	-179.8	-178.7	-173.8	-1.1	110.5	P935 N939 S940	P935-R937 PolarHBondContact O-N 2.86Å; R937-N939 PolarHBondContact O-N 2.93Å; R937-S940 WeakPolarHBondContact CB-OG 3.14Å; R937-S940 PolarHBondContact N-OG 3.32Å; R937-S940 WeakPolarHBondContact O-CB 3.26Å; R937-S940 PolarHBondContact O-N 2.89Å
938	P	61.6	Low	83.1	Confident	125 Å²	125	37.8 Å²	37.8	81%	0.812	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.9	125.7	165.4	-24.7	34.8	0	0	0	110.2	S940	P938-S940 VanDerWaalsContact C-N 3.34Å; P938-S940 PolarHBondContact O-N 2.95Å
939	N	68.9	Low	82.8	Confident	103 Å²	103	43.2 Å²	43.2	55%	0.551	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.6	13.3	-172.1	-50.4	-53.6	0	0	0	117.3	R937 N957 G959	R937-N939 PolarHBondContact O-N 2.93Å; N939-N957 WeakPolarHBondContact CA-ND2 3.34Å; N939-G959 WeakPolarHBondContact O-CA 3.16Å
940	S	82.1	Confident	82.5	Confident	10 Å²	10	43.5 Å²	43.5	7%	0.07	24%	0.236	C	C	.	.			trans	-60.8	144.9	167.4	-90.3	0	0	0	0	111.9	D933 R937 P938 N957	D933-S940 PolarHBondContact OD2-OG 3.42Å; R937-S940 WeakPolarHBondContact CB-OG 3.14Å; R937-S940 PolarHBondContact N-OG 3.32Å; R937-S940 WeakPolarHBondContact O-CB 3.26Å; R937-S940 PolarHBondContact O-N 2.89Å; P938-S940 VanDerWaalsContact C-N 3.34Å; P938-S940 PolarHBondContact O-N 2.95Å; S940-N957 PolarHBondContact O-ND2 3.11Å
941	D	89.9	Confident	82.5	Confident	15 Å²	15	43.8 Å²	43.8	8%	0.08	24%	0.24	C	C	.	.			trans	-70.2	135.2	171.6	-81.5	14.2	0	0	0	109.9	G932 L958 G959 L1009 N1010 I1011	G932-D941 WeakPolarHBondContact CA-O 3.29Å; D941-L958 VanDerWaalsContact OD1-CA 3.27Å; D941-L958 WeakPolarHBondContact OD1-CA 3.47Å; D941-G959 WeakPolarHBondContact OD1-CA 3.45Å; D941-G959 PolarHBondContact OD1-N 3.16Å; D941-L1009 HydrophobicContact CB-CD1 4.14Å; D941-N1010 PolarHBondContact OD2-N 3.01Å; D941-N1010 PolarHBondContact OD2-ND2 2.97Å; D941-I1011 HydrophobicContact CB-CG1 3.93Å
942	F	92.3	Very high	82.6	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.009	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	163.8	173.1	75.5	-90.1	0	0	0	111.3	W930 R931 M936 Y956 N957 M962 L1009	W930-F942 HydrophobicContact CH2-CB 3.89Å; W930-F942 HydrophobicContact CH2-CD1 4.39Å; W930-F942 AromaticContact CH2-CD2 3.52Å; W930-F942 HydrophobicContact CH2-CD2 3.52Å; W930-F942 HydrophobicContact CH2-CE2 4.1Å; W930-F942 AromaticContact CH2-CG 3.69Å; W930-F942 HydrophobicContact CH2-CG 3.69Å; W930-F942 HydrophobicContact CZ2-CB 3.93Å; W930-F942 HydrophobicContact CZ2-CD2 4.39Å; W930-F942 HydrophobicContact CZ2-CG 4.25Å; W930-F942 AromaticContact CZ3-CD2 3.63Å; W930-F942 HydrophobicContact CZ3-CD2 3.63Å; W930-F942 HydrophobicContact CZ3-CE2 4.02Å; W930-F942 HydrophobicContact CZ3-CG 4.28Å; R931-F942 CarbonylContact O-C 3.49Å; R931-F942 VanDerWaalsContact O-CA 3.25Å; R931-F942 WeakPolarHBondContact O-CA 3.07Å; M936-F942 HydrophobicContact CE-CD1 3.81Å; M936-F942 HydrophobicContact CE-CE1 3.45Å; M936-F942 VanDerWaalsContact CE-CE1 3.45Å; M936-F942 HydrophobicContact CE-CZ 4.14Å; M936-F942 HydrophobicContact SD-CD1 4.3Å; M936-F942 HydrophobicContact SD-CE1 4.38Å; F942-Y956 CarbonylContact O-C 3.56Å; F942-Y956 WeakPolarHBondContact O-CA 3.44Å; F942-Y956 WeakPolarHBondContact O-CB 3.48Å; F942-N957 HydrophobicContact CD1-CB 3.58Å; F942-N957 HydrophobicContact CE1-CB 3.47Å; F942-N957 VanDerWaalsContact CE1-CB 3.47Å; F942-N957 HydrophobicContact CZ-CB 4.35Å; F942-N957 PolarHBondContact N-O 2.9Å; F942-N957 PolarHBondContact O-N 2.78Å; F942-M962 HydrophobicContact CZ-CG 3.95Å; F942-M962 HydrophobicContact CZ-SD 3.77Å; F942-L1009 WeakPolarHBondContact O-CD1 3.41Å
943	I	93.6	Very high	83	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	133	169.5	-172.5	168.4	0	0	0	108.5	V908 T913 L915 R931 F954 S955 L1009 I1011	V908-I943 HydrophobicContact CG1-CG2 3.76Å; T913-I943 HydrophobicContact CG2-CD1 3.81Å; L915-I943 HydrophobicContact CD1-CD1 4.25Å; R931-I943 HydrophobicContact CB-CG2 4.15Å; R931-I943 PolarHBondContact N-O 2.88Å; R931-I943 PolarHBondContact O-N 3.39Å; I943-F954 HydrophobicContact CD1-CE2 3.79Å; I943-F954 HydrophobicContact CD1-CZ 3.89Å; I943-F954 HydrophobicContact CG1-CE2 3.69Å; I943-F954 HydrophobicContact CG1-CZ 4.16Å; I943-S955 WeakPolarHBondContact CA-O 3.36Å; I943-L1009 HydrophobicContact CB-CD2 3.96Å; I943-L1009 HydrophobicContact CD1-CD2 4.13Å; I943-L1009 HydrophobicContact CG2-CD2 4.08Å; I943-I1011 HydrophobicContact CB-CD1 4.33Å; I943-I1011 HydrophobicContact CG2-CD1 3.68Å
944	S	94.8	Very high	84.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	158.8	-177.3	64.7	0	0	0	0	112.7	L929 F954 S955	L929-S944 CarbonylContact O-C 3.44Å; L929-S944 WeakPolarHBondContact O-CA 3.42Å; L929-S944 WeakPolarHBondContact O-CB 3.37Å; S944-F954 WeakPolarHBondContact O-CD2 3.35Å; S944-S955 PolarHBondContact N-O 2.87Å; S944-S955 PolarHBondContact O-N 3.04Å; S944-S955 WeakPolarHBondContact OG-CB 3.41Å
945	M	96.9	Very high	85.9	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	139.8	171.5	-161.3	-179.7	-60.3	0	0	108.9	L915 M917 L928 L929 L952 I953 F954 V979 A981	L915-M945 HydrophobicContact CD1-CE 4.27Å; M917-M945 HydrophobicContact SD-SD 4Å; L928-M945 WeakPolarHBondContact CA-O 3.44Å; L928-M945 WeakPolarHBondContact CB-O 3.44Å; L928-M945 PolarHBondContact N-O 3.34Å; L929-M945 HydrophobicContact CB-CB 4.05Å; L929-M945 PolarHBondContact N-O 2.78Å; L929-M945 PolarHBondContact O-N 2.9Å; M945-L952 HydrophobicContact CG-CD1 4.29Å; M945-L952 HydrophobicContact SD-CD2 4.37Å; M945-I953 VanDerWaalsContact CA-O 3.3Å; M945-I953 WeakPolarHBondContact CA-O 3.41Å; M945-I953 WeakPolarHBondContact CG-O 3.48Å; M945-F954 HydrophobicContact CE-CD2 3.96Å; M945-V979 HydrophobicContact CE-CG1 4.11Å; M945-V979 HydrophobicContact SD-CG1 3.73Å; M945-A981 HydrophobicContact CE-CB 3.53Å
946	G	96.4	Very high	87.6	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.2	164.4	-179.1	0	0	0	0	0	112.7	G926 I953 Y1031	G926-G946 CarbonylContact O-C 3.39Å; G926-G946 VanDerWaalsContact O-CA 3.23Å; G926-G946 WeakPolarHBondContact O-CA 3.32Å; G946-I953 PolarHBondContact N-O 3.09Å; G946-I953 PolarHBondContact O-N 3.12Å; G946-Y1031 WeakPolarHBondContact CA-OH 3.15Å; G946-Y1031 PolarHBondContact N-OH 3.12Å
947	L	96.2	Very high	89.2	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	141.1	171.9	-65.4	170.9	0	0	0	110.4	F919 S921 K924 D925 G926 L928 A951 L952 F971 Y1031	F919-L947 HydrophobicContact CE2-CD1 4.08Å; F919-L947 HydrophobicContact CE2-CD2 4.08Å; F919-L947 HydrophobicContact CE2-CG 4.38Å; F919-L947 HydrophobicContact CZ-CD2 4.18Å; S921-L947 VanDerWaalsContact CB-CD1 3.49Å; S921-L947 WeakPolarHBondContact OG-CD1 3.44Å; K924-L947 WeakPolarHBondContact O-CB 3.13Å; D925-L947 WeakPolarHBondContact CA-O 3.47Å; G926-L947 PolarHBondContact N-O 3.27Å; G926-L947 PolarHBondContact O-N 2.89Å; L928-L947 HydrophobicContact CD1-CD1 4.35Å; L928-L947 HydrophobicContact CD1-CG 3.96Å; L947-A951 WeakPolarHBondContact CA-O 3.21Å; L947-L952 HydrophobicContact CD2-CB 4.18Å; L947-L952 HydrophobicContact CD2-CD1 3.76Å; L947-L952 HydrophobicContact CG-CD1 4.26Å; L947-F971 HydrophobicContact CD2-CB 3.66Å; L947-F971 HydrophobicContact CD2-CG 4.5Å; L947-Y1031 WeakPolarHBondContact O-CE1 3.32Å
948	Q	93.1	Very high	90.3	Very high	83 Å²	83	23.2 Å²	23.2	39%	0.388	13%	0.132	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	122.4	171.3	-169.8	171.2	38	0	0	109.5	D925 G950 A951 I953	D925-Q948 VanDerWaalsContact OD1-CA 3.3Å; D925-Q948 WeakPolarHBondContact OD1-CA 3.22Å; Q948-G950 PolarHBondContact O-N 3.4Å; Q948-G950 VanDerWaalsContact O-N 3.16Å; Q948-A951 PolarHBondContact N-O 2.79Å; Q948-A951 PolarHBondContact O-N 3.23Å; Q948-I953 HydrophobicContact CB-CD1 3.8Å; Q948-I953 HydrophobicContact CB-CG1 4.46Å; Q948-I953 VanDerWaalsContact OE1-CD1 3.27Å
949	D	90.4	Very high	91.3	Very high	114 Å²	114	18.3 Å²	18.3	61%	0.61	10%	0.104	S	C	*	.	T	Hydrogen-bonded Turn	trans	41.2	43	-167.1	-168.4	24.5	0	0	0	113.8	K924 D925 A951	K924-D949 IonicContact NZ-OD1 3.05Å; K924-D949 PolarHBondContact NZ-OD1 2.87Å; K924-D949 PolarHBondContact O-N 2.72Å; D925-D949 PolarHBondContact OD1-N 2.76Å; D949-A951 PolarHBondContact O-N 3.03Å
950	G	88.3	Confident	91.9	Very high	7 Å²	7	15.2 Å²	15.2	7%	0.072	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.9	-4.4	179.9	0	0	0	0	0	115.6	K924 Q948 F971	K924-G950 WeakPolarHBondContact O-CA 3.47Å; K924-G950 PolarHBondContact O-N 2.8Å; Q948-G950 PolarHBondContact O-N 3.4Å; Q948-G950 VanDerWaalsContact O-N 3.16Å; G950-F971 WeakPolarHBondContact O-CD2 3.48Å
951	A	92.9	Very high	91.9	Very high	10 Å²	10	15.5 Å²	15.5	8%	0.083	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	140.8	171.3	0	0	0	0	0	110.9	L947 Q948 D949 V966 V967	L947-A951 WeakPolarHBondContact CA-O 3.21Å; Q948-A951 PolarHBondContact N-O 2.79Å; Q948-A951 PolarHBondContact O-N 3.23Å; D949-A951 PolarHBondContact O-N 3.03Å; A951-V966 HydrophobicContact CB-CG1 3.82Å; A951-V967 CarbonylContact C-O 3.49Å; A951-V967 WeakPolarHBondContact CA-O 3.33Å
952	L	96	Very high	91.8	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	124.7	174.5	-170	75.2	0	0	0	109.9	F919 L928 M945 L947 V966 V967 F971 V979 L990 V992	F919-L952 HydrophobicContact CE1-CD1 4.16Å; F919-L952 HydrophobicContact CE1-CD2 3.98Å; F919-L952 HydrophobicContact CZ-CD1 4.02Å; F919-L952 HydrophobicContact CZ-CD2 4.4Å; L928-L952 HydrophobicContact CD2-CD1 4.1Å; M945-L952 HydrophobicContact CG-CD1 4.29Å; M945-L952 HydrophobicContact SD-CD2 4.37Å; L947-L952 HydrophobicContact CD2-CB 4.18Å; L947-L952 HydrophobicContact CD2-CD1 3.76Å; L947-L952 HydrophobicContact CG-CD1 4.26Å; L952-V966 WeakPolarHBondContact O-CA 3.3Å; L952-V967 PolarHBondContact N-O 2.67Å; L952-V967 PolarHBondContact O-N 2.87Å; L952-F971 HydrophobicContact CB-CD2 3.87Å; L952-F971 HydrophobicContact CB-CE2 4.06Å; L952-V979 HydrophobicContact CD2-CB 4.4Å; L952-V979 HydrophobicContact CD2-CG1 3.86Å; L952-V979 HydrophobicContact CD2-CG2 3.56Å; L952-L990 HydrophobicContact CD2-CD1 4.42Å; L952-L990 HydrophobicContact CD2-CD2 4.38Å; L952-V992 HydrophobicContact CB-CG2 4.48Å; L952-V992 HydrophobicContact CD2-CG2 3.54Å
953	I	96.1	Very high	91.8	Very high	8 Å²	8	19.4 Å²	19.4	4%	0.041	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	130.9	179	-50.5	-170.8	0	0	0	109.3	M945 G946 Q948 S955 N964 V966	M945-I953 VanDerWaalsContact CA-O 3.3Å; M945-I953 WeakPolarHBondContact CA-O 3.41Å; M945-I953 WeakPolarHBondContact CG-O 3.48Å; G946-I953 PolarHBondContact N-O 3.09Å; G946-I953 PolarHBondContact O-N 3.12Å; Q948-I953 HydrophobicContact CB-CD1 3.8Å; Q948-I953 HydrophobicContact CB-CG1 4.46Å; Q948-I953 VanDerWaalsContact OE1-CD1 3.27Å; I953-S955 WeakPolarHBondContact CG2-OG 3.3Å; I953-N964 HydrophobicContact CG2-CB 4.32Å; I953-V966 HydrophobicContact CD1-CG2 4.25Å; I953-V966 HydrophobicContact CG1-CG1 4.24Å; I953-V966 HydrophobicContact CG1-CG2 4.08Å; I953-V966 HydrophobicContact CG2-CG2 4.31Å
954	F	97.1	Very high	91.8	Very high	1 Å²	1	22.7 Å²	22.7	0%	0.004	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	118.4	163.1	173.4	-121.3	0	0	0	108.7	L915 I943 S944 M945 Y956 I965 A981 R983 L990	L915-F954 HydrophobicContact CD1-CE2 4.04Å; I943-F954 HydrophobicContact CD1-CE2 3.79Å; I943-F954 HydrophobicContact CD1-CZ 3.89Å; I943-F954 HydrophobicContact CG1-CE2 3.69Å; I943-F954 HydrophobicContact CG1-CZ 4.16Å; S944-F954 WeakPolarHBondContact O-CD2 3.35Å; M945-F954 HydrophobicContact CE-CD2 3.96Å; F954-Y956 HydrophobicContact CD1-CD1 4.35Å; F954-Y956 HydrophobicContact CD1-CE1 4.36Å; F954-Y956 AromaticContact CE1-CD1 3.83Å; F954-Y956 HydrophobicContact CE1-CD1 3.83Å; F954-Y956 AromaticContact CE1-CE1 3.89Å; F954-Y956 HydrophobicContact CE1-CE1 3.89Å; F954-Y956 HydrophobicContact CZ-CD1 4.05Å; F954-I965 HydrophobicContact CD1-CD1 4.22Å; F954-I965 PolarHBondContact N-O 3.22Å; F954-I965 PolarHBondContact O-N 2.77Å; F954-A981 HydrophobicContact CD1-CB 3.9Å; F954-A981 HydrophobicContact CD2-CB 3.8Å; F954-A981 HydrophobicContact CE1-CB 3.98Å; F954-A981 HydrophobicContact CE2-CB 3.88Å; F954-A981 HydrophobicContact CG-CB 3.82Å; F954-A981 HydrophobicContact CZ-CB 3.96Å; F954-R983 HydrophobicContact CZ-CB 4.5Å; F954-L990 HydrophobicContact CB-CB 4.32Å; F954-L990 HydrophobicContact CB-CD1 4.01Å; F954-L990 HydrophobicContact CB-CD2 3.88Å; F954-L990 HydrophobicContact CB-CG 4.29Å
955	S	94.8	Very high	91.9	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	147.3	-174	-70.5	0	0	0	0	111.6	I943 S944 I953 A963 N964 Q1030	I943-S955 WeakPolarHBondContact CA-O 3.36Å; S944-S955 PolarHBondContact N-O 2.87Å; S944-S955 PolarHBondContact O-N 3.04Å; S944-S955 WeakPolarHBondContact OG-CB 3.41Å; I953-S955 WeakPolarHBondContact CG2-OG 3.3Å; S955-A963 VanDerWaalsContact CA-O 3.27Å; S955-A963 WeakPolarHBondContact CA-O 3.44Å; S955-N964 WeakPolarHBondContact CB-OD1 3.44Å; S955-N964 VanDerWaalsContact OG-CG 3.32Å; S955-N964 PolarHBondContact OG-OD1 3.45Å; S955-Q1030 PolarHBondContact OG-NE2 3.31Å; S955-Q1030 VanDerWaalsContact OG-NE2 3.14Å
956	Y	94.2	Very high	91.8	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	155	169	56	-85.6	0	0	0	112.2	F942 F954 L958 M962 A963 I965 R983 Q986 G988	F942-Y956 CarbonylContact O-C 3.56Å; F942-Y956 WeakPolarHBondContact O-CA 3.44Å; F942-Y956 WeakPolarHBondContact O-CB 3.48Å; F954-Y956 HydrophobicContact CD1-CD1 4.35Å; F954-Y956 HydrophobicContact CD1-CE1 4.36Å; F954-Y956 AromaticContact CE1-CD1 3.83Å; F954-Y956 HydrophobicContact CE1-CD1 3.83Å; F954-Y956 AromaticContact CE1-CE1 3.89Å; F954-Y956 HydrophobicContact CE1-CE1 3.89Å; F954-Y956 HydrophobicContact CZ-CD1 4.05Å; Y956-L958 HydrophobicContact CD2-CG 4.27Å; Y956-M962 CarbonylContact O-C 3.51Å; Y956-M962 WeakPolarHBondContact O-CA 3.44Å; Y956-A963 HydrophobicContact CD1-CB 4.42Å; Y956-A963 HydrophobicContact CD2-CB 4.27Å; Y956-A963 HydrophobicContact CE1-CB 3.9Å; Y956-A963 HydrophobicContact CE2-CB 3.75Å; Y956-A963 PolarHBondContact N-O 3.29Å; Y956-A963 PolarHBondContact O-N 2.82Å; Y956-I965 HydrophobicContact CE1-CD1 4.18Å; Y956-R983 VanDerWaalsContact CD2-CD 3.44Å; Y956-R983 HydrophobicContact CD2-CG 4.25Å; Y956-R983 HydrophobicContact CE1-CG 4.28Å; Y956-R983 HydrophobicContact CE2-CG 3.94Å; Y956-Q986 PolarHBondContact OH-O 3Å; Y956-G988 WeakPolarHBondContact OH-CA 3.44Å; Y956-G988 PolarHBondContact OH-N 3.17Å
957	N	91	Very high	91.8	Very high	6 Å²	6	25.6 Å²	25.6	3%	0.032	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	147	171.7	-175.9	23	0	0	0	110.5	N939 S940 F942 G959 S960 G961 L1009	N939-N957 WeakPolarHBondContact CA-ND2 3.34Å; S940-N957 PolarHBondContact O-ND2 3.11Å; F942-N957 HydrophobicContact CD1-CB 3.58Å; F942-N957 HydrophobicContact CE1-CB 3.47Å; F942-N957 VanDerWaalsContact CE1-CB 3.47Å; F942-N957 HydrophobicContact CZ-CB 4.35Å; F942-N957 PolarHBondContact N-O 2.9Å; F942-N957 PolarHBondContact O-N 2.78Å; N957-G959 PolarHBondContact OD1-N 2.85Å; N957-S960 PolarHBondContact OD1-N 3.25Å; N957-G961 VanDerWaalsContact OD1-CA 3.3Å; N957-G961 WeakPolarHBondContact OD1-CA 3.48Å; N957-G961 PolarHBondContact OD1-N 2.9Å; N957-G961 PolarHBondContact OD1-O 2.86Å; N957-G961 VanDerWaalsContact OD1-O 3.04Å; N957-L1009 WeakPolarHBondContact O-CD1 3.36Å
958	L	90.1	Very high	91.6	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	18%	0.181	C	C	.	.			trans	-131.3	54.9	-178.1	-51.6	177	0	0	0	109.5	D941 Y956 S960 G985 Q986 S1002 M1006 L1009	D941-L958 VanDerWaalsContact OD1-CA 3.27Å; D941-L958 WeakPolarHBondContact OD1-CA 3.47Å; Y956-L958 HydrophobicContact CD2-CG 4.27Å; L958-S960 PolarHBondContact O-N 2.87Å; L958-S960 PolarHBondContact O-OG 3.5Å; L958-G985 WeakPolarHBondContact CD1-O 3.2Å; L958-Q986 HydrophobicContact CD1-CG 4.35Å; L958-S1002 WeakPolarHBondContact CD1-OG 3.28Å; L958-M1006 HydrophobicContact CB-CB 4.34Å; L958-M1006 WeakPolarHBondContact O-CB 2.99Å; L958-L1009 HydrophobicContact CD2-CB 3.64Å; L958-L1009 HydrophobicContact CD2-CD1 3.57Å; L958-L1009 HydrophobicContact CD2-CG 4.19Å
959	G	83.1	Confident	91.3	Very high	23 Å²	23	28.6 Å²	28.6	24%	0.237	18%	0.175	C	C	.	.	S	Bend	trans	64.1	6.3	176.6	0	0	0	0	0	116.4	N939 D941 N957	N939-G959 WeakPolarHBondContact O-CA 3.16Å; D941-G959 WeakPolarHBondContact OD1-CA 3.45Å; D941-G959 PolarHBondContact OD1-N 3.16Å; N957-G959 PolarHBondContact OD1-N 2.85Å
960	S	81.6	Confident	91.2	Very high	37 Å²	37	27.2 Å²	27.2	26%	0.259	17%	0.171	S	C	.	.	S	Bend	trans	-139.3	-0	-169.3	-65.7	0	0	0	0	114.3	N957 L958 P1003	N957-S960 PolarHBondContact OD1-N 3.25Å; L958-S960 PolarHBondContact O-N 2.87Å; L958-S960 PolarHBondContact O-OG 3.5Å; S960-P1003 VanDerWaalsContact CB-O 3.31Å; S960-P1003 WeakPolarHBondContact CB-O 3.28Å; S960-P1003 WeakPolarHBondContact O-CG 3.39Å
961	G	81.7	Confident	91.4	Very high	16 Å²	16	26.9 Å²	26.9	17%	0.165	17%	0.167	C	C	.	.			trans	124	149.8	179.7	0	0	0	0	0	113	N957 P1003	N957-G961 VanDerWaalsContact OD1-CA 3.3Å; N957-G961 WeakPolarHBondContact OD1-CA 3.48Å; N957-G961 PolarHBondContact OD1-N 2.9Å; N957-G961 PolarHBondContact OD1-O 2.86Å; N957-G961 VanDerWaalsContact OD1-O 3.04Å; G961-P1003 WeakPolarHBondContact O-CD 3.21Å
962	M	86.6	Confident	91.3	Very high	93 Å²	93	28.1 Å²	28.1	46%	0.458	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	142.2	-173.3	-178.9	176.1	64.7	0	0	113.1	F942 Y956 N964	F942-M962 HydrophobicContact CZ-CG 3.95Å; F942-M962 HydrophobicContact CZ-SD 3.77Å; Y956-M962 CarbonylContact O-C 3.51Å; Y956-M962 WeakPolarHBondContact O-CA 3.44Å; M962-N964 WeakPolarHBondContact CG-OD1 3.41Å; M962-N964 PolarHBondContact SD-OD1 2.81Å
963	A	92.4	Very high	91.1	Very high	6 Å²	6	30.9 Å²	30.9	5%	0.05	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	127.9	160.3	0	0	0	0	0	109.5	S955 Y956	S955-A963 VanDerWaalsContact CA-O 3.27Å; S955-A963 WeakPolarHBondContact CA-O 3.44Å; Y956-A963 HydrophobicContact CD1-CB 4.42Å; Y956-A963 HydrophobicContact CD2-CB 4.27Å; Y956-A963 HydrophobicContact CE1-CB 3.9Å; Y956-A963 HydrophobicContact CE2-CB 3.75Å; Y956-A963 PolarHBondContact N-O 3.29Å; Y956-A963 PolarHBondContact O-N 2.82Å
964	N	94.1	Very high	90.8	Very high	69 Å²	69	31.5 Å²	31.5	37%	0.369	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.6	168.4	-73.1	0.4	0	0	0	109.2	I953 S955 M962	I953-N964 HydrophobicContact CG2-CB 4.32Å; S955-N964 WeakPolarHBondContact CB-OD1 3.44Å; S955-N964 VanDerWaalsContact OG-CG 3.32Å; S955-N964 PolarHBondContact OG-OD1 3.45Å; M962-N964 WeakPolarHBondContact CG-OD1 3.41Å; M962-N964 PolarHBondContact SD-OD1 2.81Å
965	I	96.7	Very high	90.5	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.021	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	104.5	174.4	-49	-174.5	0	0	0	107.2	F954 Y956 G988 L990 K998	F954-I965 HydrophobicContact CD1-CD1 4.22Å; F954-I965 PolarHBondContact N-O 3.22Å; F954-I965 PolarHBondContact O-N 2.77Å; Y956-I965 HydrophobicContact CE1-CD1 4.18Å; I965-G988 WeakPolarHBondContact CD1-O 3.3Å; I965-L990 HydrophobicContact CB-CB 4.18Å; I965-L990 HydrophobicContact CG2-CB 3.59Å; I965-L990 VanDerWaalsContact O-CD2 3.31Å; I965-L990 WeakPolarHBondContact O-CD2 3.42Å; I965-K998 HydrophobicContact CG2-CB 3.81Å
966	V	95.8	Very high	90.4	Very high	57 Å²	57	41.2 Å²	41.2	35%	0.345	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	133.8	-174.9	-171.8	0	0	0	0	109.9	A951 L952 I953	A951-V966 HydrophobicContact CB-CG1 3.82Å; L952-V966 WeakPolarHBondContact O-CA 3.3Å; I953-V966 HydrophobicContact CD1-CG2 4.25Å; I953-V966 HydrophobicContact CG1-CG1 4.24Å; I953-V966 HydrophobicContact CG1-CG2 4.08Å; I953-V966 HydrophobicContact CG2-CG2 4.31Å
967	V	96.5	Very high	90.4	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	126.7	163	179.1	0	0	0	0	107.6	A951 L952 F971 L990 V992 K998	A951-V967 CarbonylContact C-O 3.49Å; A951-V967 WeakPolarHBondContact CA-O 3.33Å; L952-V967 PolarHBondContact N-O 2.67Å; L952-V967 PolarHBondContact O-N 2.87Å; V967-F971 HydrophobicContact CB-CE2 4.37Å; V967-F971 HydrophobicContact CG1-CE2 3.98Å; V967-F971 HydrophobicContact CG1-CZ 3.87Å; V967-F971 WeakPolarHBondContact O-CE2 3.37Å; V967-L990 HydrophobicContact CB-CD2 4.39Å; V967-L990 HydrophobicContact CG2-CB 4.42Å; V967-L990 HydrophobicContact CG2-CD2 3.81Å; V967-L990 HydrophobicContact CG2-CG 3.96Å; V967-V992 HydrophobicContact CB-CG2 4.05Å; V967-V992 HydrophobicContact CG1-CB 4.22Å; V967-V992 HydrophobicContact CG1-CG2 4.18Å; V967-V992 HydrophobicContact CG2-CG2 4.08Å; V967-K998 HydrophobicContact CG2-CB 4.27Å; V967-K998 HydrophobicContact CG2-CG 3.68Å
968	N	92.2	Very high	90.6	Very high	122 Å²	122	47.8 Å²	47.8	65%	0.652	26%	0.264	S	S	*	.			trans	-93.4	134.4	174.2	-60.1	45.1	0	0	0	108.8
969	G	85.9	Confident	90.8	Very high	26 Å²	26	48.1 Å²	48.1	27%	0.268	27%	0.265	S	S	.	.	S	Bend	trans	-168.8	-172.5	179.7	0	0	0	0	0	110.3	F971	G969-F971 PolarHBondContact O-N 2.85Å
970	T	87.4	Confident	91.4	Very high	84 Å²	84	51.5 Å²	51.5	52%	0.515	27%	0.274	S	S	.	.			trans	-97.6	58.9	177.6	51.3	0	0	0	0	110.5	S972 D973	T970-S972 PolarHBondContact O-N 3.13Å; T970-D973 WeakPolarHBondContact O-CB 3.28Å; T970-D973 VanDerWaalsContact O-CG 3.31Å
971	F	93.7	Very high	92.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	3.3	-168.1	-58.7	-48.2	0	0	0	115.6	F919 S921 L947 G950 L952 V967 G969 H977 V992 Y995	F919-F971 HydrophobicContact CE2-CB 4.16Å; F919-F971 HydrophobicContact CZ-CB 3.88Å; F919-F971 HydrophobicContact CZ-CD1 4.37Å; F919-F971 HydrophobicContact CZ-CG 4.19Å; S921-F971 WeakPolarHBondContact CB-O 3.48Å; L947-F971 HydrophobicContact CD2-CB 3.66Å; L947-F971 HydrophobicContact CD2-CG 4.5Å; G950-F971 WeakPolarHBondContact O-CD2 3.48Å; L952-F971 HydrophobicContact CB-CD2 3.87Å; L952-F971 HydrophobicContact CB-CE2 4.06Å; V967-F971 HydrophobicContact CB-CE2 4.37Å; V967-F971 HydrophobicContact CG1-CE2 3.98Å; V967-F971 HydrophobicContact CG1-CZ 3.87Å; V967-F971 WeakPolarHBondContact O-CE2 3.37Å; G969-F971 PolarHBondContact O-N 2.85Å; F971-H977 HydrophobicContact CD1-CB 4.38Å; F971-H977 AromaticContact CD1-CD2 3.86Å; F971-H977 AromaticContact CD1-CE1 3.76Å; F971-H977 AromaticContact CD1-CG 3.69Å; F971-H977 AromaticContact CD1-ND1 3.63Å; F971-H977 AromaticContact CD1-NE2 3.88Å; F971-H977 AromaticContact CE1-ND1 3.94Å; F971-V992 HydrophobicContact CD1-CG1 4.15Å; F971-V992 HydrophobicContact CE1-CB 4.23Å; F971-V992 HydrophobicContact CE1-CG1 3.42Å; F971-V992 VanDerWaalsContact CE1-CG1 3.42Å; F971-V992 HydrophobicContact CE2-CG1 4.47Å; F971-V992 HydrophobicContact CZ-CB 3.93Å; F971-V992 HydrophobicContact CZ-CG1 3.61Å; F971-V992 HydrophobicContact CZ-CG2 4.46Å; F971-Y995 HydrophobicContact CE1-CD2 4.08Å; F971-Y995 AromaticContact CE1-CE2 3.81Å; F971-Y995 HydrophobicContact CE1-CE2 3.81Å; F971-Y995 HydrophobicContact CZ-CD2 4.03Å; F971-Y995 HydrophobicContact CZ-CE2 4.09Å
972	S	91.1	Very high	92.7	Very high	36 Å²	36	50.3 Å²	50.3	25%	0.252	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	27.4	175.3	70.8	0	0	0	0	112	S921 A923 T970	S921-S972 CarbonylContact O-C 3.56Å; S921-S972 WeakPolarHBondContact O-CA 3.22Å; A923-S972 WeakPolarHBondContact O-CB 3.43Å; T970-S972 PolarHBondContact O-N 3.13Å
973	D	91.4	Very high	93.1	Very high	59 Å²	59	45.9 Å²	45.9	32%	0.316	24%	0.24	S	C	.	.	S	Bend	trans	-94.6	6.5	-171.7	81.2	-13.3	0	0	0	114.5	S921 T970 K975 H977	S921-D973 PolarHBondContact O-N 3.04Å; T970-D973 WeakPolarHBondContact O-CB 3.28Å; T970-D973 VanDerWaalsContact O-CG 3.31Å; D973-K975 VanDerWaalsContact C-N 3.34Å; D973-K975 VanDerWaalsContact OD1-CB 3.25Å; D973-K975 WeakPolarHBondContact OD1-CB 3.36Å; D973-K975 WeakPolarHBondContact OD1-CG 3.43Å; D973-K975 PolarHBondContact OD1-N 3.24Å; D973-K975 IonicContact OD2-NZ 2.96Å; D973-K975 PolarHBondContact OD2-NZ 3Å; D973-H977 IonicContact OD1-NE2 3.54Å; D973-H977 PolarHBondContact OD1-NE2 2.83Å
974	G	88.9	Confident	93.2	Very high	21 Å²	21	50.2 Å²	50.2	22%	0.216	26%	0.262	C	S	.	.	S	Bend	trans	77.3	8.3	-177.8	0	0	0	0	0	115.6	K920 S921	K920-G974 VanDerWaalsContact CD-O 3.28Å; K920-G974 WeakPolarHBondContact CD-O 3.36Å; K920-G974 WeakPolarHBondContact CE-O 3.46Å; K920-G974 WeakPolarHBondContact CG-O 3.42Å; S921-G974 WeakPolarHBondContact O-CA 3.34Å; S921-G974 PolarHBondContact O-N 3.2Å
975	K	91.8	Very high	93.1	Very high	127 Å²	127	47.2 Å²	47.2	55%	0.552	25%	0.248	S	C	*	.	S	Bend	trans	-103.9	171.9	177.6	-53.6	-169.1	-163.7	82.9	0	112.9	K920 D973	K920-K975 VanDerWaalsContact CA-O 3.24Å; K920-K975 WeakPolarHBondContact CA-O 3.3Å; K920-K975 WeakPolarHBondContact CB-O 3.45Å; D973-K975 VanDerWaalsContact C-N 3.34Å; D973-K975 VanDerWaalsContact OD1-CB 3.25Å; D973-K975 WeakPolarHBondContact OD1-CB 3.36Å; D973-K975 WeakPolarHBondContact OD1-CG 3.43Å; D973-K975 PolarHBondContact OD1-N 3.24Å; D973-K975 IonicContact OD2-NZ 2.96Å; D973-K975 PolarHBondContact OD2-NZ 3Å
976	W	92.4	Very high	93	Very high	78 Å²	78	47.6 Å²	47.6	30%	0.295	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	124.9	177.2	-76.9	110.3	0	0	0	112.1	I888 H918 F919 K920 C1038 S1040	I888-W976 HydrophobicContact CD1-CH2 4.05Å; I888-W976 HydrophobicContact CD1-CZ2 3.65Å; I888-W976 HydrophobicContact CG2-CH2 3.52Å; I888-W976 HydrophobicContact CG2-CZ2 3.82Å; H918-W976 HydrophobicContact CB-CE3 3.85Å; H918-W976 HydrophobicContact CB-CZ3 4.09Å; F919-W976 VanDerWaalsContact C-CE3 3.45Å; F919-W976 WeakPolarHBondContact O-CA 3.5Å; K920-W976 HydrophobicContact CB-CD2 3.94Å; K920-W976 HydrophobicContact CB-CE3 3.91Å; K920-W976 HydrophobicContact CB-CH2 4.26Å; K920-W976 HydrophobicContact CB-CZ2 4.3Å; K920-W976 HydrophobicContact CB-CZ3 4.09Å; K920-W976 HydrophobicContact CD-CZ2 4.47Å; W976-C1038 HydrophobicContact CH2-CB 3.77Å; W976-C1038 HydrophobicContact CZ2-CB 4.27Å; W976-S1040 WeakPolarHBondContact CZ3-OG 3.32Å
977	H	94.9	Very high	92.9	Very high	11 Å²	11	47.7 Å²	47.7	5%	0.051	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	135.9	176.7	-64.9	-65.3	0	0	0	111.2	H918 F919 F971 D973 V992 D993	H918-H977 CarbonylContact C-O 3.49Å; H918-H977 VanDerWaalsContact CA-O 3.28Å; H918-H977 WeakPolarHBondContact CA-O 3.42Å; F919-H977 HydrophobicContact CD1-CB 4.02Å; F919-H977 HydrophobicContact CE1-CB 3.57Å; F919-H977 HydrophobicContact CZ-CB 3.86Å; F919-H977 PolarHBondContact N-O 2.72Å; F919-H977 PolarHBondContact O-N 2.89Å; F971-H977 HydrophobicContact CD1-CB 4.38Å; F971-H977 AromaticContact CD1-CD2 3.86Å; F971-H977 AromaticContact CD1-CE1 3.76Å; F971-H977 AromaticContact CD1-CG 3.69Å; F971-H977 AromaticContact CD1-ND1 3.63Å; F971-H977 AromaticContact CD1-NE2 3.88Å; F971-H977 AromaticContact CE1-ND1 3.94Å; D973-H977 IonicContact OD1-NE2 3.54Å; D973-H977 PolarHBondContact OD1-NE2 2.83Å; H977-V992 HydrophobicContact CB-CG1 4.32Å; H977-D993 WeakPolarHBondContact CA-OD2 3.48Å; H977-D993 IonicContact CE1-OD2 3.18Å; H977-D993 IonicContact CG-OD2 2.92Å; H977-D993 IonicContact ND1-OD2 2.69Å; H977-D993 PolarHBondContact ND1-OD2 2.89Å
978	R	93.9	Very high	92.9	Very high	133 Å²	133	47.9 Å²	47.9	50%	0.502	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	116.5	-175.8	-54	177	-67.9	178.2	1.1	110.4	V992 D993 D994	R978-V992 WeakPolarHBondContact O-CA 3.33Å; R978-D993 WeakPolarHBondContact CB-OD1 3.23Å; R978-D993 PolarHBondContact N-OD1 2.86Å; R978-D993 IonicContact NE-OD1 3.91Å; R978-D993 PolarHBondContact O-N 2.96Å; R978-D994 IonicContact NH2-OD2 3.85Å
979	V	95.5	Very high	93	Very high	7 Å²	7	46.8 Å²	46.8	4%	0.042	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	136.4	-174.7	-174.1	0	0	0	0	111.4	F916 M917 F919 M945 L952 L990 T991 V992	F916-V979 VanDerWaalsContact CA-O 3.31Å; F916-V979 WeakPolarHBondContact CA-O 3.46Å; M917-V979 HydrophobicContact CG-CB 4.11Å; M917-V979 PolarHBondContact N-O 2.72Å; M917-V979 PolarHBondContact O-N 3.18Å; F919-V979 HydrophobicContact CD1-CG2 3.47Å; F919-V979 VanDerWaalsContact CD1-CG2 3.47Å; F919-V979 HydrophobicContact CE1-CG2 3.35Å; M945-V979 HydrophobicContact CE-CG1 4.11Å; M945-V979 HydrophobicContact SD-CG1 3.73Å; L952-V979 HydrophobicContact CD2-CB 4.4Å; L952-V979 HydrophobicContact CD2-CG1 3.86Å; L952-V979 HydrophobicContact CD2-CG2 3.56Å; V979-L990 HydrophobicContact CG1-CD1 3.6Å; V979-T991 WeakPolarHBondContact CA-O 3.47Å; V979-V992 HydrophobicContact CG2-CG1 4.22Å; V979-V992 HydrophobicContact CG2-CG2 4.39Å
980	K	94.8	Very high	93.5	Very high	95 Å²	95	45.6 Å²	45.6	41%	0.413	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	107.9	169	-179.4	172.8	-175.2	160.6	0	110	F916 V982 L990 T991	F916-K980 HydrophobicContact CD1-CB 4.23Å; F916-K980 HydrophobicContact CD1-CD 3.94Å; F916-K980 HydrophobicContact CD1-CG 3.87Å; F916-K980 HydrophobicContact CE1-CD 3.43Å; F916-K980 VanDerWaalsContact CE1-CD 3.43Å; F916-K980 HydrophobicContact CE1-CG 3.76Å; F916-K980 HydrophobicContact CG-CG 4.46Å; F916-K980 HydrophobicContact CZ-CD 4.02Å; F916-K980 HydrophobicContact CZ-CG 4.2Å; K980-V982 HydrophobicContact CG-CG2 4.27Å; K980-L990 CarbonylContact O-C 3.58Å; K980-T991 PolarHBondContact N-O 3.45Å; K980-T991 PolarHBondContact O-N 3.22Å
981	A	96.1	Very high	93.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	126.1	173.8	0	0	0	0	0	110.3	L915 M945 F954 K989 L990	L915-A981 HydrophobicContact CB-CB 4.33Å; L915-A981 PolarHBondContact N-O 3.23Å; L915-A981 PolarHBondContact O-N 2.73Å; L915-A981 VanDerWaalsContact O-O 3.1Å; M945-A981 HydrophobicContact CE-CB 3.53Å; F954-A981 HydrophobicContact CD1-CB 3.9Å; F954-A981 HydrophobicContact CD2-CB 3.8Å; F954-A981 HydrophobicContact CE1-CB 3.98Å; F954-A981 HydrophobicContact CE2-CB 3.88Å; F954-A981 HydrophobicContact CG-CB 3.82Å; F954-A981 HydrophobicContact CZ-CB 3.96Å; A981-K989 CarbonylContact C-O 3.57Å; A981-K989 WeakPolarHBondContact CA-O 3.4Å; A981-L990 HydrophobicContact CB-CD1 3.97Å
982	V	95	Very high	93.9	Very high	28 Å²	28	43.2 Å²	43.2	17%	0.17	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	133.9	179.5	172.8	0	0	0	0	108.5	T913 N914 K980 G988 K989	T913-V982 WeakPolarHBondContact O-CA 3.45Å; N914-V982 HydrophobicContact CB-CG2 4.44Å; K980-V982 HydrophobicContact CG-CG2 4.27Å; V982-G988 CarbonylContact O-C 3.51Å; V982-G988 VanDerWaalsContact O-CA 3.22Å; V982-G988 WeakPolarHBondContact O-CA 3.46Å; V982-K989 PolarHBondContact N-O 3.28Å; V982-K989 PolarHBondContact O-N 3.16Å
983	R	94.9	Very high	94.1	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131.5	170.3	-175.2	-168.8	62.5	82.2	4.1	109.2	G910 S911 R912 T913 F954 Y956 G985 S987 R1007	G910-R983 PolarHBondContact O-NH2 2.91Å; S911-R983 PolarHBondContact O-NH1 3.08Å; S911-R983 VanDerWaalsContact O-NH1 3.16Å; R912-R983 CarbonylContact C-O 3.59Å; R912-R983 VanDerWaalsContact CA-O 3.27Å; R912-R983 WeakPolarHBondContact CA-O 3.2Å; R912-R983 VanDerWaalsContact CG-O 3.28Å; R912-R983 WeakPolarHBondContact CG-O 3.4Å; T913-R983 PolarHBondContact N-O 2.81Å; T913-R983 PolarHBondContact O-N 3.25Å; T913-R983 PolarHBondContact OG1-NE 2.81Å; T913-R983 PolarHBondContact OG1-NH2 3.39Å; F954-R983 HydrophobicContact CZ-CB 4.5Å; Y956-R983 VanDerWaalsContact CD2-CD 3.44Å; Y956-R983 HydrophobicContact CD2-CG 4.25Å; Y956-R983 HydrophobicContact CE1-CG 4.28Å; Y956-R983 HydrophobicContact CE2-CG 3.94Å; R983-G985 PolarHBondContact NH1-O 2.81Å; R983-S987 CarbonylContact C-O 3.53Å; R983-S987 VanDerWaalsContact CA-O 3.3Å; R983-S987 WeakPolarHBondContact CA-O 3.45Å; R983-R1007 PolarHBondContact NH1-O 2.87Å
984	D	94.3	Very high	93.9	Very high	97 Å²	97	47.1 Å²	47.1	52%	0.519	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	107.7	174.1	-174	9.4	0	0	0	109.3	R912 Q986 S987	R912-D984 HydrophobicContact CG-CB 4.39Å; D984-Q986 PolarHBondContact O-N 2.91Å; D984-S987 PolarHBondContact N-O 3.02Å; D984-S987 PolarHBondContact O-N 2.81Å
985	G	92.8	Very high	93.7	Very high	6 Å²	6	51.1 Å²	51.1	6%	0.062	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	-119	-166.8	0	0	0	0	0	111.4	S911 L958 R983 R1007	S911-G985 WeakPolarHBondContact O-CA 3.46Å; S911-G985 PolarHBondContact O-N 2.82Å; L958-G985 WeakPolarHBondContact CD1-O 3.2Å; R983-G985 PolarHBondContact NH1-O 2.81Å; G985-R1007 WeakPolarHBondContact CA-O 3.4Å
986	Q	93.1	Very high	93.1	Very high	11 Å²	11	46.8 Å²	46.8	5%	0.051	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-19.6	175.7	-68.7	178.4	-23	0	0	114	Y956 L958 D984 R1001 S1002 G1004 K1005 M1006 R1007	Y956-Q986 PolarHBondContact OH-O 3Å; L958-Q986 HydrophobicContact CD1-CG 4.35Å; D984-Q986 PolarHBondContact O-N 2.91Å; Q986-R1001 HydrophobicContact CB-CG 3.75Å; Q986-R1001 CarbonylContact O-C 3.57Å; Q986-R1001 WeakPolarHBondContact O-CA 3.48Å; Q986-R1001 WeakPolarHBondContact O-CG 3.29Å; Q986-R1001 VanDerWaalsContact OE1-CZ 3.31Å; Q986-S1002 PolarHBondContact O-N 2.84Å; Q986-G1004 PolarHBondContact NE2-O 3.39Å; Q986-K1005 VanDerWaalsContact NE2-C 3.29Å; Q986-K1005 VanDerWaalsContact NE2-CA 3.35Å; Q986-M1006 WeakPolarHBondContact CG-O 3.42Å; Q986-M1006 PolarHBondContact NE2-O 2.68Å; Q986-R1007 HydrophobicContact CG-CG 4.21Å
987	S	94	Very high	92.9	Very high	60 Å²	60	45.4 Å²	45.4	42%	0.42	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	135.2	-170.7	-63.2	0	0	0	0	109.7	R983 D984	R983-S987 CarbonylContact C-O 3.53Å; R983-S987 VanDerWaalsContact CA-O 3.3Å; R983-S987 WeakPolarHBondContact CA-O 3.45Å; D984-S987 PolarHBondContact N-O 3.02Å; D984-S987 PolarHBondContact O-N 2.81Å
988	G	95.9	Very high	92.9	Very high	5 Å²	5	49.7 Å²	49.7	5%	0.052	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	157.1	175.9	0	0	0	0	0	112.3	Y956 I965 V982 T999 G1000	Y956-G988 WeakPolarHBondContact OH-CA 3.44Å; Y956-G988 PolarHBondContact OH-N 3.17Å; I965-G988 WeakPolarHBondContact CD1-O 3.3Å; V982-G988 CarbonylContact O-C 3.51Å; V982-G988 VanDerWaalsContact O-CA 3.22Å; V982-G988 WeakPolarHBondContact O-CA 3.46Å; G988-T999 WeakPolarHBondContact O-CA 3.35Å; G988-T999 WeakPolarHBondContact O-CB 3.32Å; G988-G1000 PolarHBondContact N-O 2.97Å; G988-G1000 PolarHBondContact O-N 3.48Å
989	K	95.4	Very high	92.9	Very high	99 Å²	99	48.7 Å²	48.7	43%	0.43	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	120.2	178.7	-175.7	178.8	-178.3	179.8	0	109.2	A981 V982 A997 K998 T999	A981-K989 CarbonylContact C-O 3.57Å; A981-K989 WeakPolarHBondContact CA-O 3.4Å; V982-K989 PolarHBondContact N-O 3.28Å; V982-K989 PolarHBondContact O-N 3.16Å; K989-A997 HydrophobicContact CD-CB 4.25Å; K989-A997 HydrophobicContact CG-CB 4.06Å; K989-K998 CarbonylContact C-O 3.52Å; K989-K998 VanDerWaalsContact CA-O 3.26Å; K989-K998 WeakPolarHBondContact CA-O 3.27Å; K989-T999 HydrophobicContact CB-CG2 4.03Å; K989-T999 HydrophobicContact CG-CG2 3.98Å
990	L	97.3	Very high	92.8	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	134.9	169.7	-177.3	60.9	0	0	0	108.5	L952 F954 I965 V967 V979 K980 A981 V992 A997 K998	L952-L990 HydrophobicContact CD2-CD1 4.42Å; L952-L990 HydrophobicContact CD2-CD2 4.38Å; F954-L990 HydrophobicContact CB-CB 4.32Å; F954-L990 HydrophobicContact CB-CD1 4.01Å; F954-L990 HydrophobicContact CB-CD2 3.88Å; F954-L990 HydrophobicContact CB-CG 4.29Å; I965-L990 HydrophobicContact CB-CB 4.18Å; I965-L990 HydrophobicContact CG2-CB 3.59Å; I965-L990 VanDerWaalsContact O-CD2 3.31Å; I965-L990 WeakPolarHBondContact O-CD2 3.42Å; V967-L990 HydrophobicContact CB-CD2 4.39Å; V967-L990 HydrophobicContact CG2-CB 4.42Å; V967-L990 HydrophobicContact CG2-CD2 3.81Å; V967-L990 HydrophobicContact CG2-CG 3.96Å; V979-L990 HydrophobicContact CG1-CD1 3.6Å; K980-L990 CarbonylContact O-C 3.58Å; A981-L990 HydrophobicContact CB-CD1 3.97Å; L990-V992 HydrophobicContact CD1-CG2 4.33Å; L990-V992 HydrophobicContact CD2-CG2 4.4Å; L990-V992 HydrophobicContact CG-CG2 4.14Å; L990-A997 CarbonylContact O-C 3.53Å; L990-A997 WeakPolarHBondContact O-CA 3.33Å; L990-K998 PolarHBondContact N-O 3.31Å; L990-K998 PolarHBondContact O-N 3.17Å
991	T	94.4	Very high	92.6	Very high	34 Å²	34	52.4 Å²	52.4	21%	0.209	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	131.6	172.4	-39	0	0	0	0	107	V979 K980 A997	V979-T991 WeakPolarHBondContact CA-O 3.47Å; K980-T991 PolarHBondContact N-O 3.45Å; K980-T991 PolarHBondContact O-N 3.22Å; T991-A997 HydrophobicContact CG2-CB 4.16Å; T991-A997 WeakPolarHBondContact OG1-CB 3.4Å
992	V	95.1	Very high	92.3	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	121.8	176.3	-168.7	0	0	0	0	107.8	L952 V967 F971 H977 R978 V979 L990 D994 Y995	L952-V992 HydrophobicContact CB-CG2 4.48Å; L952-V992 HydrophobicContact CD2-CG2 3.54Å; V967-V992 HydrophobicContact CB-CG2 4.05Å; V967-V992 HydrophobicContact CG1-CB 4.22Å; V967-V992 HydrophobicContact CG1-CG2 4.18Å; V967-V992 HydrophobicContact CG2-CG2 4.08Å; F971-V992 HydrophobicContact CD1-CG1 4.15Å; F971-V992 HydrophobicContact CE1-CB 4.23Å; F971-V992 HydrophobicContact CE1-CG1 3.42Å; F971-V992 VanDerWaalsContact CE1-CG1 3.42Å; F971-V992 HydrophobicContact CE2-CG1 4.47Å; F971-V992 HydrophobicContact CZ-CB 3.93Å; F971-V992 HydrophobicContact CZ-CG1 3.61Å; F971-V992 HydrophobicContact CZ-CG2 4.46Å; H977-V992 HydrophobicContact CB-CG1 4.32Å; R978-V992 WeakPolarHBondContact O-CA 3.33Å; V979-V992 HydrophobicContact CG2-CG1 4.22Å; V979-V992 HydrophobicContact CG2-CG2 4.39Å; L990-V992 HydrophobicContact CD1-CG2 4.33Å; L990-V992 HydrophobicContact CD2-CG2 4.4Å; L990-V992 HydrophobicContact CG-CG2 4.14Å; V992-D994 PolarHBondContact O-N 3.3Å; V992-Y995 WeakPolarHBondContact O-CB 3.44Å; V992-Y995 PolarHBondContact O-N 2.91Å; V992-Y995 VanDerWaalsContact O-N 3.17Å
993	D	93.3	Very high	91.9	Very high	33 Å²	33	54.4 Å²	54.4	18%	0.176	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	40.6	-131.1	-173	-58.5	-49	0	0	0	111.8	H977 R978 Y995	H977-D993 WeakPolarHBondContact CA-OD2 3.48Å; H977-D993 IonicContact CE1-OD2 3.18Å; H977-D993 IonicContact CG-OD2 2.92Å; H977-D993 IonicContact ND1-OD2 2.69Å; H977-D993 PolarHBondContact ND1-OD2 2.89Å; R978-D993 WeakPolarHBondContact CB-OD1 3.23Å; R978-D993 PolarHBondContact N-OD1 2.86Å; R978-D993 IonicContact NE-OD1 3.91Å; R978-D993 PolarHBondContact O-N 2.96Å; D993-Y995 HydrophobicContact CB-CD2 4.21Å
994	D	87.2	Confident	91.5	Very high	145 Å²	145	56.9 Å²	56.9	78%	0.775	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	11.2	-179.1	-56.7	-67.7	0	0	0	112.8	R978 V992 G996	R978-D994 IonicContact NH2-OD2 3.85Å; V992-D994 PolarHBondContact O-N 3.3Å; D994-G996 PolarHBondContact O-N 2.69Å
995	Y	85.4	Confident	91	Very high	105 Å²	105	61.5 Å²	61.5	41%	0.412	34%	0.34	S	S	.	.	S	Bend	trans	-67.3	-1.3	174.9	-68.6	-89.3	0	0	0	113.9	F971 V992 D993	F971-Y995 HydrophobicContact CE1-CD2 4.08Å; F971-Y995 AromaticContact CE1-CE2 3.81Å; F971-Y995 HydrophobicContact CE1-CE2 3.81Å; F971-Y995 HydrophobicContact CZ-CD2 4.03Å; F971-Y995 HydrophobicContact CZ-CE2 4.09Å; V992-Y995 WeakPolarHBondContact O-CB 3.44Å; V992-Y995 PolarHBondContact O-N 2.91Å; V992-Y995 VanDerWaalsContact O-N 3.17Å; D993-Y995 HydrophobicContact CB-CD2 4.21Å
996	G	78.9	Confident	90.7	Very high	35 Å²	35	66 Å²	66	36%	0.361	36%	0.36	S	S	.	.			trans	78.5	161.6	-180	0	0	0	0	0	113.1	D994	D994-G996 PolarHBondContact O-N 2.69Å
997	A	88.2	Confident	90.5	Very high	49 Å²	49	73.5 Å²	73.5	41%	0.405	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	132.8	-178.7	0	0	0	0	0	112.2	K989 L990 T991	K989-A997 HydrophobicContact CD-CB 4.25Å; K989-A997 HydrophobicContact CG-CB 4.06Å; L990-A997 CarbonylContact O-C 3.53Å; L990-A997 WeakPolarHBondContact O-CA 3.33Å; T991-A997 HydrophobicContact CG2-CB 4.16Å; T991-A997 WeakPolarHBondContact OG1-CB 3.4Å
998	K	95.4	Very high	90.3	Very high	102 Å²	102	75.6 Å²	75.6	44%	0.443	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	148.5	166.6	-54.7	-59.5	-179.1	-166.8	0	109.3	I965 V967 K989 L990	I965-K998 HydrophobicContact CG2-CB 3.81Å; V967-K998 HydrophobicContact CG2-CB 4.27Å; V967-K998 HydrophobicContact CG2-CG 3.68Å; K989-K998 CarbonylContact C-O 3.52Å; K989-K998 VanDerWaalsContact CA-O 3.26Å; K989-K998 WeakPolarHBondContact CA-O 3.27Å; L990-K998 PolarHBondContact N-O 3.31Å; L990-K998 PolarHBondContact O-N 3.17Å
999	T	94.4	Very high	90	Very high	111 Å²	111	75.4 Å²	75.4	68%	0.681	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.3	146.6	176.8	51.7	0	0	0	0	110.5	G988 K989	G988-T999 WeakPolarHBondContact O-CA 3.35Å; G988-T999 WeakPolarHBondContact O-CB 3.32Å; K989-T999 HydrophobicContact CB-CG2 4.03Å; K989-T999 HydrophobicContact CG-CG2 3.98Å
1000	G	92.6	Very high	89.5	Confident	22 Å²	22	75 Å²	75	23%	0.227	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	173.6	172.6	0	0	0	0	0	109.9	G988	G988-G1000 PolarHBondContact N-O 2.97Å; G988-G1000 PolarHBondContact O-N 3.48Å
1001	R	91.8	Very high	88.9	Confident	158 Å²	158	75.4 Å²	75.4	60%	0.596	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.1	134.8	-178.6	-175	178.2	173.4	170.3	-2.6	110.8	Q986	Q986-R1001 HydrophobicContact CB-CG 3.75Å; Q986-R1001 CarbonylContact O-C 3.57Å; Q986-R1001 WeakPolarHBondContact O-CA 3.48Å; Q986-R1001 WeakPolarHBondContact O-CG 3.29Å; Q986-R1001 VanDerWaalsContact OE1-CZ 3.31Å
1002	S	89.8	Confident	88	Confident	4 Å²	4	79.4 Å²	79.4	3%	0.028	41%	0.414	C	S	.	.			trans	-72.6	140.3	175.4	65.1	0	0	0	0	111.2	L958 Q986	L958-S1002 WeakPolarHBondContact CD1-OG 3.28Å; Q986-S1002 PolarHBondContact O-N 2.84Å
1003	P	85.8	Confident	87.3	Confident	67 Å²	67	81.3 Å²	81.3	44%	0.435	43%	0.434	S	S	.	.	S	Bend	trans	-64.1	172.2	173.8	25.9	-35.3	0	0	0	113.8	S960 G961	S960-P1003 VanDerWaalsContact CB-O 3.31Å; S960-P1003 WeakPolarHBondContact CB-O 3.28Å; S960-P1003 WeakPolarHBondContact O-CG 3.39Å; G961-P1003 WeakPolarHBondContact O-CD 3.21Å
1004	G	86.1	Confident	87.1	Confident	51 Å²	51	81.7 Å²	81.7	53%	0.526	44%	0.438	S	S	.	.	S	Bend	trans	83.9	-153.1	176.4	0	0	0	0	0	115.2	Q986	Q986-G1004 PolarHBondContact NE2-O 3.39Å
1005	K	84.6	Confident	87.4	Confident	195 Å²	195	74.8 Å²	74.8	85%	0.848	40%	0.401	S	S	*	.	S	Bend	trans	-118.8	-18	-178.8	-69.5	-175.4	-178.9	177.1	0	114.5	Q986	Q986-K1005 VanDerWaalsContact NE2-C 3.29Å; Q986-K1005 VanDerWaalsContact NE2-CA 3.35Å
1006	M	86.8	Confident	87.8	Confident	100 Å²	100	72.5 Å²	72.5	49%	0.493	39%	0.392	S	S	.	.			trans	-66	148.6	-179.9	-63.2	-177.8	-170.7	0	0	110.9	L958 Q986	L958-M1006 HydrophobicContact CB-CB 4.34Å; L958-M1006 WeakPolarHBondContact O-CB 2.99Å; Q986-M1006 WeakPolarHBondContact CG-O 3.42Å; Q986-M1006 PolarHBondContact NE2-O 2.68Å
1007	R	89	Confident	88.6	Confident	168 Å²	168	70.8 Å²	70.8	63%	0.634	38%	0.375	S	S	*	.			trans	-133.3	-12.9	-175.4	-67.5	-174.4	179.3	-153	3.8	114	R983 G985 Q986	R983-R1007 PolarHBondContact NH1-O 2.87Å; G985-R1007 WeakPolarHBondContact CA-O 3.4Å; Q986-R1007 HydrophobicContact CG-CG 4.21Å
1008	Q	89.5	Confident	88.8	Confident	104 Å²	104	68.5 Å²	68.5	49%	0.486	36%	0.356	S	S	.	.			trans	-107.5	139.1	-172.6	-166.8	168.1	-66.6	0	0	109.3	N1010	Q1008-N1010 WeakPolarHBondContact CG-OD1 3.38Å; Q1008-N1010 PolarHBondContact NE2-OD1 2.7Å; Q1008-N1010 PolarHBondContact O-ND2 3.16Å; Q1008-N1010 VanDerWaalsContact O-ND2 3.1Å
1009	L	89.3	Confident	88.6	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.005	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-102.6	99.7	-177.2	-176.4	68.1	0	0	0	108.9	V908 G910 D941 F942 I943 N957 L958 I1011	V908-L1009 WeakPolarHBondContact O-CD2 3.42Å; G910-L1009 PolarHBondContact N-O 2.7Å; G910-L1009 WeakPolarHBondContact O-CB 3.42Å; G910-L1009 PolarHBondContact O-N 2.83Å; D941-L1009 HydrophobicContact CB-CD1 4.14Å; F942-L1009 WeakPolarHBondContact O-CD1 3.41Å; I943-L1009 HydrophobicContact CB-CD2 3.96Å; I943-L1009 HydrophobicContact CD1-CD2 4.13Å; I943-L1009 HydrophobicContact CG2-CD2 4.08Å; N957-L1009 WeakPolarHBondContact O-CD1 3.36Å; L958-L1009 HydrophobicContact CD2-CB 3.64Å; L958-L1009 HydrophobicContact CD2-CD1 3.57Å; L958-L1009 HydrophobicContact CD2-CG 4.19Å; L1009-I1011 HydrophobicContact CD1-CD1 3.68Å; L1009-I1011 HydrophobicContact CD1-CG1 3.85Å; L1009-I1011 HydrophobicContact CD2-CD1 3.7Å; L1009-I1011 HydrophobicContact CG-CD1 3.51Å; L1009-I1011 HydrophobicContact CG-CG1 3.84Å
1010	N	84.6	Confident	88.2	Confident	91 Å²	91	58.7 Å²	58.7	49%	0.487	30%	0.304	S	S	.	.			trans	-104.9	63.2	-169.7	-48.9	-75.9	0	0	0	110.6	D941 Q1008	D941-N1010 PolarHBondContact OD2-N 3.01Å; D941-N1010 PolarHBondContact OD2-ND2 2.97Å; Q1008-N1010 WeakPolarHBondContact CG-OD1 3.38Å; Q1008-N1010 PolarHBondContact NE2-OD1 2.7Å; Q1008-N1010 PolarHBondContact O-ND2 3.16Å; Q1008-N1010 VanDerWaalsContact O-ND2 3.1Å
1011	I	84.5	Confident	87.4	Confident	9 Å²	9	63.6 Å²	63.6	5%	0.046	32%	0.319	C	S	.	.			trans	-90.1	133.2	-177	-54.7	158.6	0	0	0	111.7	R931 G932 D941 I943 L1009	R931-I1011 HydrophobicContact CG-CB 4.38Å; R931-I1011 HydrophobicContact CG-CD1 4.22Å; R931-I1011 HydrophobicContact CG-CG2 3.63Å; R931-I1011 PolarHBondContact NH2-O 3.33Å; R931-I1011 WeakPolarHBondContact O-CD1 3.41Å; G932-I1011 VanDerWaalsContact CA-CG2 3.47Å; D941-I1011 HydrophobicContact CB-CG1 3.93Å; I943-I1011 HydrophobicContact CB-CD1 4.33Å; I943-I1011 HydrophobicContact CG2-CD1 3.68Å; L1009-I1011 HydrophobicContact CD1-CD1 3.68Å; L1009-I1011 HydrophobicContact CD1-CG1 3.85Å; L1009-I1011 HydrophobicContact CD2-CD1 3.7Å; L1009-I1011 HydrophobicContact CG-CD1 3.51Å; L1009-I1011 HydrophobicContact CG-CG1 3.84Å
1012	N	75.6	Confident	86.4	Confident	117 Å²	117	60 Å²	60	63%	0.626	31%	0.309	S	S	*	.			trans	-95.5	161	167.1	-59.4	-68.9	0	0	0	111.7
1013	G	80.4	Confident	85.9	Confident	41 Å²	41	60.4 Å²	60.4	42%	0.423	31%	0.311	S	S	.	.	S	Bend	trans	85.6	172.5	179.6	0	0	0	0	0	115	R931	R931-G1013 PolarHBondContact NE-O 3.32Å
1014	P	90.4	Very high	85.1	Confident	41 Å²	41	58.2 Å²	58.2	27%	0.266	30%	0.299	S	S	.	.			trans	-73.4	166.2	-171.2	30.7	-36.1	0	0	0	113.1	Y899 D900 R931 Y1016	Y899-P1014 CarbonylContact O-C 3.51Å; Y899-P1014 VanDerWaalsContact O-CA 3.29Å; Y899-P1014 WeakPolarHBondContact O-CA 3.47Å; Y899-P1014 VanDerWaalsContact O-CB 3.24Å; Y899-P1014 WeakPolarHBondContact O-CB 3.33Å; D900-P1014 HydrophobicContact CB-CB 4.44Å; R931-P1014 WeakPolarHBondContact CD-O 3.27Å; R931-P1014 WeakPolarHBondContact CG-O 3.38Å; P1014-Y1016 HydrophobicContact CG-CE2 3.74Å
1015	L	92.7	Very high	84	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	137.9	165.4	176.6	66.6	0	0	0	108.9	T898 Y899 I904 L905 V908 L929 R931 F1042	T898-L1015 CarbonylContact C-O 3.44Å; T898-L1015 WeakPolarHBondContact CA-O 3.48Å; Y899-L1015 HydrophobicContact CD2-CB 4.18Å; Y899-L1015 HydrophobicContact CD2-CD2 4.05Å; Y899-L1015 HydrophobicContact CD2-CG 4.08Å; Y899-L1015 PolarHBondContact N-O 3.39Å; Y899-L1015 PolarHBondContact O-N 2.85Å; I904-L1015 HydrophobicContact CG2-CD2 3.95Å; L905-L1015 HydrophobicContact CD2-CB 4.18Å; V908-L1015 HydrophobicContact CG1-CD1 4.4Å; V908-L1015 HydrophobicContact CG2-CD2 4.22Å; L929-L1015 HydrophobicContact CD1-CD1 4.1Å; L929-L1015 HydrophobicContact CD2-CD1 4.12Å; L929-L1015 HydrophobicContact CG-CD1 3.93Å; R931-L1015 HydrophobicContact CB-CD1 4.07Å; L1015-F1042 HydrophobicContact CD2-CE1 4.26Å
1016	Y	94.3	Very high	83.3	Confident	56 Å²	56	50.8 Å²	50.8	22%	0.22	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	140.6	173.1	-69.1	-87.6	0	0	0	110.7	Y896 L897 T898 L929 W930 P1014 G1019 M1020	Y896-Y1016 HydrophobicContact CD2-CD1 4.39Å; Y896-Y1016 HydrophobicContact CD2-CE1 4.48Å; L897-Y1016 WeakPolarHBondContact O-CA 3.49Å; T898-Y1016 HydrophobicContact CG2-CD1 3.72Å; T898-Y1016 HydrophobicContact CG2-CE1 3.52Å; L929-Y1016 WeakPolarHBondContact CA-O 3.39Å; W930-Y1016 PolarHBondContact N-O 2.87Å; W930-Y1016 PolarHBondContact O-N 2.89Å; P1014-Y1016 HydrophobicContact CG-CE2 3.74Å; Y1016-G1019 WeakPolarHBondContact CB-O 3.5Å; Y1016-M1020 HydrophobicContact CD1-CB 3.48Å; Y1016-M1020 VanDerWaalsContact CD1-CB 3.48Å; Y1016-M1020 HydrophobicContact CD2-CB 4.32Å; Y1016-M1020 HydrophobicContact CE1-CB 3.92Å; Y1016-M1020 HydrophobicContact CG-CB 3.72Å
1017	V	95.4	Very high	82.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	138.2	176.1	177	0	0	0	0	110.7	F891 Y896 L897 Y899 G1019 V1039 F1042 L1052	F891-V1017 WeakPolarHBondContact CE1-O 3.36Å; F891-V1017 HydrophobicContact CZ-CG1 4.1Å; Y896-V1017 WeakPolarHBondContact CA-O 3.27Å; L897-V1017 PolarHBondContact N-O 2.9Å; L897-V1017 VanDerWaalsContact N-O 3.1Å; L897-V1017 PolarHBondContact O-N 2.88Å; Y899-V1017 HydrophobicContact CD2-CG2 4.4Å; Y899-V1017 HydrophobicContact CE2-CB 4.05Å; Y899-V1017 HydrophobicContact CE2-CG2 3.59Å; V1017-G1019 PolarHBondContact O-N 2.93Å; V1017-G1019 VanDerWaalsContact O-N 3.13Å; V1017-V1039 HydrophobicContact CG1-CG2 4.4Å; V1017-F1042 HydrophobicContact CG2-CD1 4.16Å; V1017-F1042 HydrophobicContact CG2-CE1 3.69Å; V1017-L1052 HydrophobicContact CG1-CD2 4.21Å
1018	G	91.9	Very high	82	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.231	C	C	.	.	S	Bend	trans	71	-6.5	177.7	0	0	0	0	0	116.3	S895 L927 L928 G1034 L1035	S895-G1018 CarbonylContact O-C 3.33Å; L927-G1018 CarbonylContact O-C 3.59Å; L928-G1018 PolarHBondContact O-N 2.86Å; G1018-G1034 CarbonylContact O-C 3.5Å; G1018-G1034 WeakPolarHBondContact O-CA 3.42Å; G1018-L1035 PolarHBondContact O-N 3.26Å
1019	G	91	Very high	81.1	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.23	C	C	.	.			trans	162.7	-166	179.2	0	0	0	0	0	109.6	S895 Y896 Y1016 V1017	S895-G1019 WeakPolarHBondContact O-CA 3.32Å; Y896-G1019 WeakPolarHBondContact CB-O 3.26Å; Y1016-G1019 WeakPolarHBondContact CB-O 3.5Å; V1017-G1019 PolarHBondContact O-N 2.93Å; V1017-G1019 VanDerWaalsContact O-N 3.13Å
1020	M	86.5	Confident	80.7	Confident	8 Å²	8	45.9 Å²	45.9	4%	0.039	24%	0.236	C	C	.	.			trans	-169.7	171.8	175.3	48.9	-174.9	-99	0	0	109.4	L927 W930 Y1016 I1023 H1026 T1027	L927-M1020 HydrophobicContact CD2-CG 3.62Å; L927-M1020 HydrophobicContact CD2-SD 3.54Å; L927-M1020 VanDerWaalsContact CD2-SD 3.54Å; W930-M1020 HydrophobicContact CB-SD 3.69Å; W930-M1020 HydrophobicContact CD2-SD 4.32Å; W930-M1020 HydrophobicContact CG-SD 3.59Å; W930-M1020 VanDerWaalsContact CG-SD 3.59Å; Y1016-M1020 HydrophobicContact CD1-CB 3.48Å; Y1016-M1020 VanDerWaalsContact CD1-CB 3.48Å; Y1016-M1020 HydrophobicContact CD2-CB 4.32Å; Y1016-M1020 HydrophobicContact CE1-CB 3.92Å; Y1016-M1020 HydrophobicContact CG-CB 3.72Å; M1020-I1023 HydrophobicContact CG-CB 4.26Å; M1020-I1023 HydrophobicContact CG-CG1 3.74Å; M1020-I1023 HydrophobicContact CG-CG2 4.34Å; M1020-I1023 WeakPolarHBondContact O-CG1 3.19Å; M1020-H1026 HydrophobicContact CE-CB 3.47Å; M1020-H1026 VanDerWaalsContact CE-CB 3.47Å; M1020-H1026 WeakPolarHBondContact CE-CD2 3.42Å; M1020-T1027 HydrophobicContact CE-CG2 4.43Å; M1020-T1027 HydrophobicContact SD-CG2 4.19Å
1021	K	76.4	Confident	80.6	Confident	124 Å²	124	41.9 Å²	41.9	54%	0.539	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	143.5	166.4	-160.3	-173.3	-175.2	-131.5	0	109.8	I1023	K1021-I1023 VanDerWaalsContact C-N 3.33Å; K1021-I1023 PolarHBondContact O-N 2.86Å
1022	E	69.4	Low	80.3	Confident	82 Å²	82	47.7 Å²	47.7	38%	0.383	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	43.9	170.2	-72	160.5	-115.3	0	0	114.3	A1024 L1025 H1026	E1022-A1024 VanDerWaalsContact C-N 3.34Å; E1022-A1024 PolarHBondContact O-N 3.45Å; E1022-A1024 VanDerWaalsContact O-N 3.13Å; E1022-L1025 HydrophobicContact CB-CB 4.17Å; E1022-L1025 HydrophobicContact CB-CD2 4.39Å; E1022-L1025 WeakPolarHBondContact O-CA 3.48Å; E1022-L1025 VanDerWaalsContact O-CB 3.26Å; E1022-L1025 WeakPolarHBondContact O-CB 3.25Å; E1022-L1025 PolarHBondContact O-N 2.88Å; E1022-H1026 PolarHBondContact O-CD2 3.4Å; E1022-H1026 VanDerWaalsContact O-CD2 3.24Å; E1022-H1026 PolarHBondContact O-N 2.9Å
1023	I	80.1	Confident	80.8	Confident	13 Å²	13	43.5 Å²	43.5	7%	0.067	23%	0.229	C	C	.	.	H	α-helix	trans	-45.3	-50.3	-170.6	-50.2	-176	0	0	0	113.6	L927 M1020 K1021 L1025 T1027 G1033	L927-I1023 HydrophobicContact CB-CG2 4.26Å; L927-I1023 HydrophobicContact CD2-CG2 3.93Å; M1020-I1023 HydrophobicContact CG-CB 4.26Å; M1020-I1023 HydrophobicContact CG-CG1 3.74Å; M1020-I1023 HydrophobicContact CG-CG2 4.34Å; M1020-I1023 WeakPolarHBondContact O-CG1 3.19Å; K1021-I1023 VanDerWaalsContact C-N 3.33Å; K1021-I1023 PolarHBondContact O-N 2.86Å; I1023-L1025 VanDerWaalsContact C-N 3.25Å; I1023-L1025 PolarHBondContact O-N 2.79Å; I1023-T1027 HydrophobicContact CG2-CG2 3.97Å; I1023-T1027 WeakPolarHBondContact O-CB 3.14Å; I1023-T1027 VanDerWaalsContact O-CG2 3.24Å; I1023-T1027 WeakPolarHBondContact O-CG2 3.36Å; I1023-T1027 PolarHBondContact O-N 3.21Å; I1023-T1027 PolarHBondContact O-OG1 3.36Å; I1023-G1033 VanDerWaalsContact CD1-C 3.42Å
1024	A	68.1	Low	81.3	Confident	22 Å²	22	41.6 Å²	41.6	18%	0.182	21%	0.21	C	C	.	.	H	α-helix	trans	-62.7	-28.4	-179.3	0	0	0	0	0	113.7	E1022 R1029 Y1031 L1032	E1022-A1024 VanDerWaalsContact C-N 3.34Å; E1022-A1024 PolarHBondContact O-N 3.45Å; E1022-A1024 VanDerWaalsContact O-N 3.13Å; A1024-R1029 PolarHBondContact O-N 2.94Å; A1024-Y1031 WeakPolarHBondContact CA-O 3.07Å; A1024-L1032 HydrophobicContact CB-CD2 4.16Å
1025	L	63.8	Low	81.5	Confident	66 Å²	66	39.7 Å²	39.7	35%	0.346	20%	0.197	S	C	.	.	H	α-helix	trans	-70.8	-57.2	179.7	179.8	63.7	0	0	0	111.3	E1022 I1023 N1028	E1022-L1025 HydrophobicContact CB-CB 4.17Å; E1022-L1025 HydrophobicContact CB-CD2 4.39Å; E1022-L1025 WeakPolarHBondContact O-CA 3.48Å; E1022-L1025 VanDerWaalsContact O-CB 3.26Å; E1022-L1025 WeakPolarHBondContact O-CB 3.25Å; E1022-L1025 PolarHBondContact O-N 2.88Å; I1023-L1025 VanDerWaalsContact C-N 3.25Å; I1023-L1025 PolarHBondContact O-N 2.79Å; L1025-N1028 PolarHBondContact O-N 2.94Å
1026	H	70.6	Confident	81.4	Confident	24 Å²	24	42.2 Å²	42.2	11%	0.111	21%	0.213	C	C	.	.	H	α-helix	trans	-86	-17.1	-172.9	-29.6	-106.3	0	0	0	113.4	W930 S934 M936 M1020 E1022 N1028	W930-H1026 WeakPolarHBondContact CH2-O 3.34Å; W930-H1026 WeakPolarHBondContact CZ2-O 3.37Å; S934-H1026 PolarHBondContact OG-CE1 2.84Å; S934-H1026 PolarHBondContact OG-ND1 2.84Å; M936-H1026 WeakPolarHBondContact CB-O 3.33Å; M1020-H1026 HydrophobicContact CE-CB 3.47Å; M1020-H1026 VanDerWaalsContact CE-CB 3.47Å; M1020-H1026 WeakPolarHBondContact CE-CD2 3.42Å; E1022-H1026 PolarHBondContact O-CD2 3.4Å; E1022-H1026 VanDerWaalsContact O-CD2 3.24Å; E1022-H1026 PolarHBondContact O-N 2.9Å; H1026-N1028 VanDerWaalsContact C-N 3.27Å
1027	T	75.6	Confident	81.3	Confident	2 Å²	2	40 Å²	40	1%	0.012	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	3.1	169.3	69	0	0	0	0	113.3	L927 W930 M1020 I1023 R1029 Q1030 Y1031	L927-T1027 HydrophobicContact CD1-CG2 4.39Å; L927-T1027 HydrophobicContact CD2-CG2 4.21Å; W930-T1027 HydrophobicContact CD2-CG2 4.18Å; W930-T1027 HydrophobicContact CE3-CG2 3.76Å; W930-T1027 HydrophobicContact CZ3-CG2 4.03Å; M1020-T1027 HydrophobicContact CE-CG2 4.43Å; M1020-T1027 HydrophobicContact SD-CG2 4.19Å; I1023-T1027 HydrophobicContact CG2-CG2 3.97Å; I1023-T1027 WeakPolarHBondContact O-CB 3.14Å; I1023-T1027 VanDerWaalsContact O-CG2 3.24Å; I1023-T1027 WeakPolarHBondContact O-CG2 3.36Å; I1023-T1027 PolarHBondContact O-N 3.21Å; I1023-T1027 PolarHBondContact O-OG1 3.36Å; T1027-R1029 VanDerWaalsContact C-N 3.3Å; T1027-R1029 PolarHBondContact O-N 2.88Å; T1027-Q1030 VanDerWaalsContact O-CB 3.24Å; T1027-Q1030 WeakPolarHBondContact O-CB 3.26Å; T1027-Q1030 PolarHBondContact O-N 2.72Å; T1027-Y1031 HydrophobicContact CG2-CD2 4.06Å; T1027-Y1031 PolarHBondContact OG1-N 2.79Å; T1027-Y1031 PolarHBondContact OG1-O 2.92Å
1028	N	72.8	Confident	81.2	Confident	115 Å²	115	40.1 Å²	40.1	62%	0.615	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.4	50.8	-171.8	-173.2	73.9	0	0	0	112	M936 L1025 H1026 Q1030	M936-N1028 HydrophobicContact CE-CB 4.35Å; M936-N1028 HydrophobicContact SD-CB 3.94Å; L1025-N1028 PolarHBondContact O-N 2.94Å; H1026-N1028 VanDerWaalsContact C-N 3.27Å; N1028-Q1030 PolarHBondContact O-N 2.78Å; N1028-Q1030 VanDerWaalsContact O-N 3.08Å
1029	R	70.8	Confident	81.2	Confident	122 Å²	122	40.1 Å²	40.1	46%	0.46	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	15.5	-176.6	-58	171.8	173.8	-109.1	-13.6	115.4	N816 D817 A1024 T1027 Y1031	N816-R1029 PolarHBondContact O-NH2 3.37Å; D817-R1029 IonicContact OD2-CZ 2.9Å; D817-R1029 IonicContact OD2-NH1 3.77Å; D817-R1029 PolarHBondContact OD2-NH1 3.06Å; D817-R1029 IonicContact OD2-NH2 3.38Å; D817-R1029 PolarHBondContact OD2-NH2 3.4Å; A1024-R1029 PolarHBondContact O-N 2.94Å; T1027-R1029 VanDerWaalsContact C-N 3.3Å; T1027-R1029 PolarHBondContact O-N 2.88Å; R1029-Y1031 PolarHBondContact O-N 3.34Å
1030	Q	79.1	Confident	81.2	Confident	30 Å²	30	40.3 Å²	40.3	14%	0.14	21%	0.209	C	C	.	.	S	Bend	trans	-62.4	-33.5	171.5	-171.2	-177.4	6.2	0	0	111.1	S955 T1027 N1028	S955-Q1030 PolarHBondContact OG-NE2 3.31Å; S955-Q1030 VanDerWaalsContact OG-NE2 3.14Å; T1027-Q1030 VanDerWaalsContact O-CB 3.24Å; T1027-Q1030 WeakPolarHBondContact O-CB 3.26Å; T1027-Q1030 PolarHBondContact O-N 2.72Å; N1028-Q1030 PolarHBondContact O-N 2.78Å; N1028-Q1030 VanDerWaalsContact O-N 3.08Å
1031	Y	83.9	Confident	81.2	Confident	8 Å²	8	44.9 Å²	44.9	3%	0.031	23%	0.23	C	C	.	.			trans	-134.4	135.4	174.8	-54.5	-80	0	0	0	110	L927 G946 L947 A1024 T1027 R1029	L927-Y1031 HydrophobicContact CB-CD2 4.31Å; L927-Y1031 HydrophobicContact CB-CG 4.05Å; L927-Y1031 HydrophobicContact CD1-CD2 3.57Å; L927-Y1031 HydrophobicContact CD1-CE2 3.79Å; L927-Y1031 HydrophobicContact CD1-CG 4.17Å; G946-Y1031 WeakPolarHBondContact CA-OH 3.15Å; G946-Y1031 PolarHBondContact N-OH 3.12Å; L947-Y1031 WeakPolarHBondContact O-CE1 3.32Å; A1024-Y1031 WeakPolarHBondContact CA-O 3.07Å; T1027-Y1031 HydrophobicContact CG2-CD2 4.06Å; T1027-Y1031 PolarHBondContact OG1-N 2.79Å; T1027-Y1031 PolarHBondContact OG1-O 2.92Å; R1029-Y1031 PolarHBondContact O-N 3.34Å
1032	L	78.4	Confident	81.9	Confident	131 Å²	131	39 Å²	39	69%	0.686	20%	0.204	S	C	*	.	S	Bend	trans	-91.9	-28.7	176.2	-60.3	177.9	0	0	0	112.2	A1024	A1024-L1032 HydrophobicContact CB-CD2 4.16Å
1033	G	85.3	Confident	82.9	Confident	29 Å²	29	36.6 Å²	36.6	30%	0.299	20%	0.195	S	C	.	.	S	Bend	trans	-133.8	168.5	180	0	0	0	0	0	112.8	G926 L927 I1023	G926-G1033 WeakPolarHBondContact CA-O 3.21Å; L927-G1033 PolarHBondContact N-O 3.04Å; I1023-G1033 VanDerWaalsContact CD1-C 3.42Å
1034	G	90.1	Very high	83.4	Confident	1 Å²	1	36 Å²	36	1%	0.01	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-80.4	-176.2	170.5	0	0	0	0	0	111.9	G893 G926 G1018	G893-G1034 WeakPolarHBondContact O-CA 3.19Å; G893-G1034 PolarHBondContact O-N 2.85Å; G926-G1034 VanDerWaalsContact CA-O 3.24Å; G926-G1034 WeakPolarHBondContact CA-O 3.34Å; G1018-G1034 CarbonylContact O-C 3.5Å; G1018-G1034 WeakPolarHBondContact O-CA 3.42Å
1035	L	94.6	Very high	83.9	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.194	C	C	.	.			trans	-61.7	132.4	171.2	176.6	63	0	0	0	110.8	F891 G893 L927 L928 G1018 V1039	F891-L1035 CarbonylContact C-O 3.53Å; F891-L1035 VanDerWaalsContact C-O 3.3Å; F891-L1035 HydrophobicContact CB-CB 4.22Å; F891-L1035 HydrophobicContact CB-CG 4.44Å; F891-L1035 VanDerWaalsContact CB-O 3.23Å; F891-L1035 WeakPolarHBondContact CB-O 3.19Å; F891-L1035 HydrophobicContact CD2-CD2 3.92Å; G893-L1035 WeakPolarHBondContact CA-O 3.5Å; G893-L1035 PolarHBondContact N-O 2.9Å; L927-L1035 PolarHBondContact O-N 3.18Å; L927-L1035 VanDerWaalsContact O-N 3.1Å; L928-L1035 HydrophobicContact CD1-CD1 4.02Å; L928-L1035 HydrophobicContact CG-CD1 4.38Å; L928-L1035 HydrophobicContact CG-CD2 4.39Å; G1018-L1035 PolarHBondContact O-N 3.26Å; L1035-V1039 HydrophobicContact CD2-CG2 3.5Å; L1035-V1039 VanDerWaalsContact CD2-CG2 3.5Å
1036	V	92.3	Very high	84.5	Confident	54 Å²	54	37.6 Å²	37.6	33%	0.327	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	93.6	161.2	-176.2	0	0	0	0	106.9	F891 S921 T922 A923	F891-V1036 WeakPolarHBondContact O-CA 3.47Å; S921-V1036 PolarHBondContact OG-O 3.3Å; T922-V1036 PolarHBondContact N-O 2.84Å; T922-V1036 VanDerWaalsContact N-O 3.12Å; A923-V1036 HydrophobicContact CB-CB 3.8Å; A923-V1036 HydrophobicContact CB-CG2 4.07Å
1037	G	91.9	Very high	84.8	Confident	9 Å²	9	41.8 Å²	41.8	9%	0.093	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.1	-157.4	-160.8	0	0	0	0	0	113.7	Q890 F891 K920	Q890-G1037 CarbonylContact C-O 3.53Å; Q890-G1037 WeakPolarHBondContact CA-O 3.4Å; F891-G1037 PolarHBondContact N-O 2.75Å; F891-G1037 PolarHBondContact O-N 2.86Å; K920-G1037 CarbonylContact O-C 3.18Å; K920-G1037 WeakPolarHBondContact O-CA 3.19Å
1038	C	92.4	Very high	85.4	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.02	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	154.3	-175.7	-48.9	0	0	0	0	111.8	I888 P889 F919 K920 W976 C1065	I888-C1038 HydrophobicContact CG2-CB 3.84Å; P889-C1038 VanDerWaalsContact O-CA 3.31Å; P889-C1038 WeakPolarHBondContact O-CA 3.27Å; P889-C1038 WeakPolarHBondContact O-CB 3.44Å; F919-C1038 CarbonylContact C-O 3.55Å; F919-C1038 VanDerWaalsContact CA-O 3.26Å; F919-C1038 WeakPolarHBondContact CA-O 3.29Å; K920-C1038 PolarHBondContact N-O 2.84Å; K920-C1038 PolarHBondContact O-N 3.44Å; W976-C1038 HydrophobicContact CH2-CB 3.77Å; W976-C1038 HydrophobicContact CZ2-CB 4.27Å; C1038-C1065 HydrophobicContact CB-CB 3.7Å; C1038-C1065 WeakPolarHBondContact CB-SG 3.35Å; C1038-C1065 WeakPolarHBondContact SG-CB 3.38Å; C1038-C1065 CovalentContact SG-SG 2.03Å; C1038-C1065 PolarHBondContact SG-SG 3.18Å
1039	V	92.9	Very high	86.1	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	140.3	174.2	-174.9	0	0	0	0	109	P889 F891 M917 H918 V1017 L1035 L1052	P889-V1039 WeakPolarHBondContact CD-O 3.5Å; P889-V1039 PolarHBondContact O-N 3.5Å; F891-V1039 HydrophobicContact CD2-CG2 4.31Å; F891-V1039 HydrophobicContact CE2-CB 4.01Å; F891-V1039 HydrophobicContact CE2-CG2 3.76Å; F891-V1039 HydrophobicContact CZ-CG2 4.49Å; M917-V1039 HydrophobicContact CB-CG1 4.37Å; M917-V1039 HydrophobicContact SD-CG1 4.42Å; H918-V1039 WeakPolarHBondContact O-CA 3.39Å; V1017-V1039 HydrophobicContact CG1-CG2 4.4Å; L1035-V1039 HydrophobicContact CD2-CG2 3.5Å; L1035-V1039 VanDerWaalsContact CD2-CG2 3.5Å; V1039-L1052 HydrophobicContact CB-CD1 4.3Å; V1039-L1052 HydrophobicContact CG1-CD1 4.14Å; V1039-L1052 VanDerWaalsContact O-CD1 3.32Å; V1039-L1052 WeakPolarHBondContact O-CD1 3.41Å
1040	S	89.9	Confident	86.9	Confident	4 Å²	4	38.3 Å²	38.3	3%	0.028	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	173.4	172	68.7	0	0	0	0	111.6	H918 W976 F1042	H918-S1040 PolarHBondContact N-O 3.17Å; H918-S1040 PolarHBondContact O-N 3.23Å; W976-S1040 WeakPolarHBondContact CZ3-OG 3.32Å; S1040-F1042 VanDerWaalsContact C-N 3.26Å; S1040-F1042 PolarHBondContact O-N 2.82Å; S1040-F1042 VanDerWaalsContact O-N 3.16Å
1041	H	86.6	Confident	87.1	Confident	103 Å²	103	38.1 Å²	38.1	48%	0.477	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	56.8	30.4	172.7	-62.1	74.2	0	0	0	115.1	H918 T1043	H918-H1041 HydrophobicContact CB-CB 4.45Å; H918-H1041 AromaticContact CE1-CD2 3.93Å; H918-H1041 AromaticContact CE1-CG 3.73Å; H918-H1041 AromaticContact ND1-CD2 3.95Å; H918-H1041 AromaticContact ND1-CE1 3.96Å; H918-H1041 AromaticContact ND1-CG 3.38Å; H918-H1041 AromaticContact ND1-ND1 3.37Å; H918-H1041 PolarHBondContact ND1-ND1 3.4Å; H1041-T1043 PolarHBondContact O-N 2.81Å; H1041-T1043 PolarHBondContact O-OG1 2.92Å
1042	F	92.1	Very high	87.3	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	118.3	-175.2	-167.6	-170.9	0	0	0	110.6	L915 F916 M917 L929 L1015 V1017 S1040 L1044 L1050 L1052	L915-F1042 HydrophobicContact CB-CE2 4.3Å; L915-F1042 HydrophobicContact CD2-CE2 4.15Å; L915-F1042 HydrophobicContact CD2-CZ 4.37Å; F916-F1042 CarbonylContact O-C 3.59Å; F916-F1042 VanDerWaalsContact O-CA 3.31Å; F916-F1042 WeakPolarHBondContact O-CA 3.14Å; F916-F1042 WeakPolarHBondContact O-CD2 3.22Å; M917-F1042 HydrophobicContact CB-CB 4.43Å; M917-F1042 HydrophobicContact CB-CD2 4.16Å; M917-F1042 HydrophobicContact CB-CG 4.45Å; M917-F1042 HydrophobicContact CE-CD1 4.38Å; M917-F1042 HydrophobicContact CE-CD2 3.85Å; M917-F1042 HydrophobicContact CE-CE1 4.22Å; M917-F1042 HydrophobicContact CE-CE2 3.64Å; M917-F1042 HydrophobicContact CE-CG 4.25Å; M917-F1042 HydrophobicContact CE-CZ 3.86Å; L929-F1042 HydrophobicContact CD1-CE1 3.99Å; L929-F1042 HydrophobicContact CD1-CE2 4.29Å; L929-F1042 HydrophobicContact CD1-CZ 3.43Å; L929-F1042 VanDerWaalsContact CD1-CZ 3.43Å; L1015-F1042 HydrophobicContact CD2-CE1 4.26Å; V1017-F1042 HydrophobicContact CG2-CD1 4.16Å; V1017-F1042 HydrophobicContact CG2-CE1 3.69Å; S1040-F1042 VanDerWaalsContact C-N 3.26Å; S1040-F1042 PolarHBondContact O-N 2.82Å; S1040-F1042 VanDerWaalsContact O-N 3.16Å; F1042-L1044 HydrophobicContact CD2-CD2 4.23Å; F1042-L1044 HydrophobicContact CE1-CD2 4.48Å; F1042-L1044 HydrophobicContact CE2-CD2 3.45Å; F1042-L1044 VanDerWaalsContact CE2-CD2 3.45Å; F1042-L1044 HydrophobicContact CE2-CG 4.46Å; F1042-L1044 HydrophobicContact CZ-CD2 3.59Å; F1042-L1050 HydrophobicContact CB-CB 4.49Å; F1042-L1050 HydrophobicContact CD1-CD2 3.48Å; F1042-L1050 VanDerWaalsContact CD1-CD2 3.48Å; F1042-L1050 HydrophobicContact CE1-CD2 3.75Å; F1042-L1050 HydrophobicContact CG-CD2 4.24Å; F1042-L1050 WeakPolarHBondContact O-CB 3.45Å; F1042-L1050 PolarHBondContact O-N 3.09Å; F1042-L1052 HydrophobicContact CB-CD2 3.93Å; F1042-L1052 HydrophobicContact CB-CG 4.31Å; F1042-L1052 HydrophobicContact CD1-CD2 3.81Å; F1042-L1052 HydrophobicContact CG-CD2 4.4Å
1043	T	89.6	Confident	87.5	Confident	32 Å²	32	32.8 Å²	32.8	20%	0.196	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	132.6	-179.1	-49.6	0	0	0	0	110.7	F916 H1041 F1048 H1049	F916-T1043 PolarHBondContact N-O 3.06Å; F916-T1043 PolarHBondContact O-N 3.34Å; H1041-T1043 PolarHBondContact O-N 2.81Å; H1041-T1043 PolarHBondContact O-OG1 2.92Å; T1043-F1048 CarbonylContact C-O 3.55Å; T1043-F1048 WeakPolarHBondContact CA-O 3.4Å; T1043-F1048 WeakPolarHBondContact CG2-O 3.28Å; T1043-H1049 PolarHBondContact OG1-ND1 3.26Å
1044	L	91.2	Very high	87.3	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	150.7	-179.6	-57.2	-179.7	0	0	0	110.9	I904 R907 V908 N914 L915 F1042 T1046 D1047 F1048	I904-L1044 HydrophobicContact CG2-CD1 3.74Å; R907-L1044 HydrophobicContact CB-CB 4.07Å; R907-L1044 HydrophobicContact CB-CD1 4.39Å; V908-L1044 HydrophobicContact CG2-CD1 4.14Å; V908-L1044 HydrophobicContact CG2-CD2 3.9Å; N914-L1044 CarbonylContact O-C 3.53Å; N914-L1044 WeakPolarHBondContact O-CA 3.34Å; L915-L1044 HydrophobicContact CD2-CD2 3.48Å; L915-L1044 VanDerWaalsContact CD2-CD2 3.48Å; F1042-L1044 HydrophobicContact CD2-CD2 4.23Å; F1042-L1044 HydrophobicContact CE1-CD2 4.48Å; F1042-L1044 HydrophobicContact CE2-CD2 3.45Å; F1042-L1044 VanDerWaalsContact CE2-CD2 3.45Å; F1042-L1044 HydrophobicContact CE2-CG 4.46Å; F1042-L1044 HydrophobicContact CZ-CD2 3.59Å; L1044-T1046 PolarHBondContact O-N 3.08Å; L1044-D1047 PolarHBondContact O-N 2.83Å; L1044-F1048 HydrophobicContact CB-CB 4.43Å; L1044-F1048 HydrophobicContact CB-CD1 4.31Å; L1044-F1048 HydrophobicContact CD1-CD1 4.28Å; L1044-F1048 PolarHBondContact N-O 2.8Å; L1044-F1048 PolarHBondContact O-N 2.78Å
1045	S	78.5	Confident	87.1	Confident	31 Å²	31	38.7 Å²	38.7	22%	0.217	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	14.7	172	-78.2	0	0	0	0	118	R907 N914 D1047	R907-S1045 WeakPolarHBondContact CB-OG 3.33Å; R907-S1045 WeakPolarHBondContact CG-OG 3.23Å; N914-S1045 PolarHBondContact O-N 2.84Å; S1045-D1047 WeakPolarHBondContact CB-OD1 3.48Å; S1045-D1047 PolarHBondContact O-N 2.78Å
1046	T	75.3	Confident	86.7	Confident	91 Å²	91	39.6 Å²	39.6	56%	0.558	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.8	-8.9	-174.1	67.2	0	0	0	0	116.4	N914 F916 L1044	N914-T1046 HydrophobicContact CB-CG2 4Å; F916-T1046 HydrophobicContact CE2-CG2 3.74Å; F916-T1046 HydrophobicContact CZ-CG2 3.9Å; L1044-T1046 PolarHBondContact O-N 3.08Å
1047	D	78.9	Confident	86.4	Confident	113 Å²	113	39.8 Å²	39.8	60%	0.604	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-125	-20.9	-172.7	66.9	-30.2	0	0	0	114.3	R907 L1044 S1045	R907-D1047 IonicContact NE-OD1 3.91Å; R907-D1047 IonicContact NH2-OD2 2.74Å; L1044-D1047 PolarHBondContact O-N 2.83Å; S1045-D1047 WeakPolarHBondContact CB-OD1 3.48Å; S1045-D1047 PolarHBondContact O-N 2.78Å
1048	F	87.8	Confident	86	Confident	50 Å²	50	42.9 Å²	42.9	22%	0.219	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	106.3	-169.4	-173.5	-87.7	0	0	0	111	I904 R907 T1043 L1044 L1050	I904-F1048 HydrophobicContact CG1-CE1 4.21Å; I904-F1048 HydrophobicContact CG1-CZ 4.44Å; R907-F1048 VanDerWaalsContact NE-CB 3.33Å; T1043-F1048 CarbonylContact C-O 3.55Å; T1043-F1048 WeakPolarHBondContact CA-O 3.4Å; T1043-F1048 WeakPolarHBondContact CG2-O 3.28Å; L1044-F1048 HydrophobicContact CB-CB 4.43Å; L1044-F1048 HydrophobicContact CB-CD1 4.31Å; L1044-F1048 HydrophobicContact CD1-CD1 4.28Å; L1044-F1048 PolarHBondContact N-O 2.8Å; L1044-F1048 PolarHBondContact O-N 2.78Å; F1048-L1050 HydrophobicContact CE1-CD1 4.11Å
1049	H	86.4	Confident	85.6	Confident	113 Å²	113	42.8 Å²	42.8	52%	0.523	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	138	168.7	-157.8	74	0	0	0	109.5	T1043	T1043-H1049 PolarHBondContact OG1-ND1 3.26Å
1050	L	87.4	Confident	85	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.01	24%	0.244	C	C	.	.			trans	-106.7	114.5	177.7	-177.4	75.5	0	0	0	108.8	Y899 I904 F1042 F1048 L1052 D1055	Y899-L1050 HydrophobicContact CD1-CD1 4.05Å; Y899-L1050 HydrophobicContact CD1-CD2 4.22Å; Y899-L1050 HydrophobicContact CE1-CD1 4.12Å; Y899-L1050 HydrophobicContact CE1-CD2 3.83Å; Y899-L1050 HydrophobicContact CE1-CG 4.13Å; Y899-L1050 HydrophobicContact CE2-CD2 4.37Å; I904-L1050 HydrophobicContact CD1-CD1 3.44Å; I904-L1050 VanDerWaalsContact CD1-CD1 3.44Å; I904-L1050 HydrophobicContact CG1-CD1 3.95Å; I904-L1050 HydrophobicContact CG2-CD1 4.26Å; F1042-L1050 HydrophobicContact CB-CB 4.49Å; F1042-L1050 HydrophobicContact CD1-CD2 3.48Å; F1042-L1050 VanDerWaalsContact CD1-CD2 3.48Å; F1042-L1050 HydrophobicContact CE1-CD2 3.75Å; F1042-L1050 HydrophobicContact CG-CD2 4.24Å; F1042-L1050 WeakPolarHBondContact O-CB 3.45Å; F1042-L1050 PolarHBondContact O-N 3.09Å; F1048-L1050 HydrophobicContact CE1-CD1 4.11Å; L1050-L1052 HydrophobicContact CD2-CD2 4.47Å; L1050-L1052 PolarHBondContact O-N 2.82Å; L1050-D1055 HydrophobicContact CD1-CB 3.62Å; L1050-D1055 WeakPolarHBondContact CD1-OD2 3.49Å; L1050-D1055 HydrophobicContact CG-CB 4.39Å
1051	A	84.8	Confident	84.5	Confident	26 Å²	26	45 Å²	45	22%	0.215	25%	0.248	C	C	.	.			trans	-74.8	96.4	174.9	0	0	0	0	0	108.6	V1053 E1054 D1055	A1051-V1053 PolarHBondContact O-N 3.01Å; A1051-E1054 HydrophobicContact CB-CB 3.83Å; A1051-E1054 HydrophobicContact CB-CG 4.14Å; A1051-E1054 WeakPolarHBondContact CB-OE2 3.42Å; A1051-E1054 PolarHBondContact O-N 3.24Å; A1051-E1054 VanDerWaalsContact O-N 3.14Å; A1051-D1055 PolarHBondContact N-OD2 2.87Å; A1051-D1055 WeakPolarHBondContact O-CB 3.47Å; A1051-D1055 PolarHBondContact O-N 2.72Å
1052	L	86.3	Confident	84.2	Confident	14 Å²	14	41.3 Å²	41.3	7%	0.073	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-38.8	-163.3	-77.4	166.2	0	0	0	114.5	P889 L897 Y899 V1017 V1039 F1042 L1050	P889-L1052 HydrophobicContact CG-CB 3.95Å; P889-L1052 HydrophobicContact CG-CD1 3.79Å; P889-L1052 HydrophobicContact CG-CG 4.44Å; L897-L1052 HydrophobicContact CD1-CB 4.47Å; Y899-L1052 WeakPolarHBondContact CE1-O 3.42Å; Y899-L1052 WeakPolarHBondContact OH-CD2 3.23Å; Y899-L1052 PolarHBondContact OH-O 2.92Å; V1017-L1052 HydrophobicContact CG1-CD2 4.21Å; V1039-L1052 HydrophobicContact CB-CD1 4.3Å; V1039-L1052 HydrophobicContact CG1-CD1 4.14Å; V1039-L1052 VanDerWaalsContact O-CD1 3.32Å; V1039-L1052 WeakPolarHBondContact O-CD1 3.41Å; F1042-L1052 HydrophobicContact CB-CD2 3.93Å; F1042-L1052 HydrophobicContact CB-CG 4.31Å; F1042-L1052 HydrophobicContact CD1-CD2 3.81Å; F1042-L1052 HydrophobicContact CG-CD2 4.4Å; L1050-L1052 HydrophobicContact CD2-CD2 4.47Å; L1050-L1052 PolarHBondContact O-N 2.82Å
1053	V	83	Confident	83.4	Confident	14 Å²	14	43.7 Å²	43.7	9%	0.085	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-33.7	-179.4	-176	0	0	0	0	112.6	V882 I886 P889 A1051	V882-V1053 HydrophobicContact CG1-CG1 3.93Å; I886-V1053 HydrophobicContact CB-CG2 4.02Å; I886-V1053 HydrophobicContact CG2-CG2 3.83Å; P889-V1053 HydrophobicContact CB-CG2 4.31Å; P889-V1053 HydrophobicContact CG-CG2 4.47Å; A1051-V1053 PolarHBondContact O-N 3.01Å
1054	E	81	Confident	82.7	Confident	103 Å²	103	46 Å²	46	48%	0.481	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-40.6	-178	-57.4	171.1	63.3	0	0	113.3	V882 T883 A1051 A1056	V882-E1054 HydrophobicContact CB-CG 4.44Å; V882-E1054 HydrophobicContact CG1-CG 4.05Å; T883-E1054 WeakPolarHBondContact CA-OE2 3.41Å; T883-E1054 VanDerWaalsContact CB-CD 3.47Å; T883-E1054 WeakPolarHBondContact CB-OE2 3.26Å; T883-E1054 HydrophobicContact CG2-CG 3.94Å; T883-E1054 WeakPolarHBondContact CG2-OE1 3.38Å; A1051-E1054 HydrophobicContact CB-CB 3.83Å; A1051-E1054 HydrophobicContact CB-CG 4.14Å; A1051-E1054 WeakPolarHBondContact CB-OE2 3.42Å; A1051-E1054 PolarHBondContact O-N 3.24Å; A1051-E1054 VanDerWaalsContact O-N 3.14Å; E1054-A1056 PolarHBondContact O-N 2.75Å
1055	D	86.3	Confident	82	Confident	51 Å²	51	46.7 Å²	46.7	27%	0.273	26%	0.263	S	S	.	.	S	Bend	trans	-77.8	-7.1	-179.8	-78.6	-51	0	0	0	112.6	Y899 I904 L1050 A1051	Y899-D1055 HydrophobicContact CD1-CB 4.08Å; Y899-D1055 WeakPolarHBondContact CD1-O 3.48Å; Y899-D1055 HydrophobicContact CE1-CB 4.13Å; I904-D1055 HydrophobicContact CD1-CB 4.02Å; L1050-D1055 HydrophobicContact CD1-CB 3.62Å; L1050-D1055 WeakPolarHBondContact CD1-OD2 3.49Å; L1050-D1055 HydrophobicContact CG-CB 4.39Å; A1051-D1055 PolarHBondContact N-OD2 2.87Å; A1051-D1055 WeakPolarHBondContact O-CB 3.47Å; A1051-D1055 PolarHBondContact O-N 2.72Å
1056	A	86.8	Confident	81.4	Confident	18 Å²	18	49.5 Å²	49.5	15%	0.149	28%	0.282	C	S	.	.			trans	-78.1	134.5	-175.2	0	0	0	0	0	112.1	L897 T898 Y899 E1054	L897-A1056 HydrophobicContact CB-CB 4.44Å; L897-A1056 HydrophobicContact CD2-CB 3.89Å; T898-A1056 CarbonylContact O-C 3.59Å; T898-A1056 VanDerWaalsContact O-CA 3.3Å; T898-A1056 WeakPolarHBondContact O-CA 3.47Å; Y899-A1056 HydrophobicContact CD1-CB 4.3Å; Y899-A1056 HydrophobicContact CE1-CB 3.88Å; E1054-A1056 PolarHBondContact O-N 2.75Å
1057	A	85.8	Confident	80.1	Confident	59 Å²	59	53.6 Å²	53.6	49%	0.488	30%	0.301	S	S	.	.	S	Bend	trans	-81.3	-30.4	178.4	0	0	0	0	0	112.9	T898	T898-A1057 PolarHBondContact O-N 3.37Å
1058	D	84.2	Confident	80.2	Confident	74 Å²	74	50.6 Å²	50.6	40%	0.396	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	157.5	175.3	178.6	37.4	0	0	0	109.9	T898	T898-D1058 PolarHBondContact N-O 3.45Å; T898-D1058 PolarHBondContact OG1-N 3.31Å; T898-D1058 PolarHBondContact OG1-O 3.33Å; T898-D1058 VanDerWaalsContact OG1-O 3.13Å
1059	G	82.1	Confident	79.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	155.3	172.9	0	0	0	0	0	113.8	L863 Y896	L863-G1059 PolarHBondContact N-O 3.32Å; L863-G1059 VanDerWaalsContact N-O 3.15Å; Y896-G1059 CarbonylContact O-C 3.56Å; Y896-G1059 WeakPolarHBondContact O-CA 3.29Å
1060	K	81.4	Confident	79.4	Confident	32 Å²	32	47.2 Å²	47.2	14%	0.139	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	139.5	178.6	-79.4	-64.8	-168.9	175.1	0	111.7	D860 C861 S895 Y896 I1062	D860-K1060 PolarHBondContact O-NZ 2.98Å; C861-K1060 WeakPolarHBondContact O-CD 3.33Å; S895-K1060 WeakPolarHBondContact CA-O 3.4Å; S895-K1060 WeakPolarHBondContact CB-O 3.39Å; Y896-K1060 HydrophobicContact CD1-CB 4.27Å; Y896-K1060 HydrophobicContact CE1-CB 3.82Å; Y896-K1060 HydrophobicContact CE1-CG 4.13Å; Y896-K1060 HydrophobicContact CE2-CB 4.43Å; Y896-K1060 HydrophobicContact CE2-CG 4.41Å; Y896-K1060 PolarHBondContact N-O 2.86Å; Y896-K1060 VanDerWaalsContact N-O 3.17Å; Y896-K1060 PolarHBondContact O-N 2.81Å; K1060-I1062 VanDerWaalsContact C-N 3.3Å; K1060-I1062 PolarHBondContact O-N 2.89Å
1061	N	78.3	Confident	79	Confident	19 Å²	19	49.8 Å²	49.8	10%	0.102	29%	0.292	C	S	.	.	S	Bend	trans	53	39.9	172.4	-56.5	-41.1	0	0	0	113.9	D860 C861 I892 R894 S895	D860-N1061 PolarHBondContact OD1-ND2 3.45Å; C861-N1061 PolarHBondContact N-OD1 2.88Å; C861-N1061 PolarHBondContact O-N 3.32Å; I892-N1061 HydrophobicContact CD1-CB 4.48Å; I892-N1061 HydrophobicContact CG1-CB 4.5Å; R894-N1061 WeakPolarHBondContact CD-ND2 3.13Å; S895-N1061 WeakPolarHBondContact CB-O 3.26Å; S895-N1061 PolarHBondContact OG-O 2.72Å
1062	I	80.7	Confident	78.6	Confident	25 Å²	25	51.3 Å²	51.3	13%	0.128	30%	0.297	C	S	.	.			trans	-92.5	123.7	-177.8	-63.5	-69	0	0	0	110.3	L863 P889 F891 L897 K1060	L863-I1062 HydrophobicContact CD1-CB 4.2Å; L863-I1062 HydrophobicContact CD1-CG1 4.4Å; P889-I1062 HydrophobicContact CB-CG2 3.87Å; F891-I1062 HydrophobicContact CD1-CD1 3.53Å; F891-I1062 HydrophobicContact CE1-CD1 3.38Å; F891-I1062 HydrophobicContact CG-CD1 4.47Å; F891-I1062 HydrophobicContact CZ-CD1 4.22Å; L897-I1062 HydrophobicContact CD1-CD1 4.22Å; L897-I1062 HydrophobicContact CD2-CD1 4.25Å; L897-I1062 HydrophobicContact CD2-CG1 3.93Å; L897-I1062 HydrophobicContact CG-CD1 3.76Å; L897-I1062 HydrophobicContact CG-CG1 4.02Å; K1060-I1062 VanDerWaalsContact C-N 3.3Å; K1060-I1062 PolarHBondContact O-N 2.89Å
1063	N	74.8	Confident	78.1	Confident	51 Å²	51	53.8 Å²	53.8	27%	0.273	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	167.4	-179.7	-66	0.1	0	0	0	110.8	Q890	Q890-N1063 HydrophobicContact CB-CB 4.06Å; Q890-N1063 HydrophobicContact CG-CB 4.37Å; Q890-N1063 PolarHBondContact N-O 2.84Å; Q890-N1063 PolarHBondContact O-N 3.31Å; Q890-N1063 VanDerWaalsContact O-N 3.15Å; Q890-N1063 PolarHBondContact OE1-ND2 3.42Å
1064	T	75.4	Confident	77.7	Confident	79 Å²	79	56.6 Å²	56.6	49%	0.485	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	131.9	168.7	-49.5	0	0	0	0	110.7	S1066	T1064-S1066 PolarHBondContact O-N 2.7Å
1065	C	76.6	Confident	77.5	Confident	15 Å²	15	53.1 Å²	53.1	10%	0.101	32%	0.316	C	S	.	.			trans	-77	113.5	174.7	-168.6	0	0	0	0	111.6	I888 Q890 C1038	I888-C1065 HydrophobicContact CB-CB 3.91Å; I888-C1065 HydrophobicContact CG2-CB 3.43Å; I888-C1065 VanDerWaalsContact CG2-CB 3.43Å; I888-C1065 VanDerWaalsContact O-CB 3.26Å; I888-C1065 WeakPolarHBondContact O-CB 3.12Å; I888-C1065 PolarHBondContact O-N 2.95Å; Q890-C1065 HydrophobicContact CB-CB 4.06Å; C1038-C1065 HydrophobicContact CB-CB 3.7Å; C1038-C1065 WeakPolarHBondContact CB-SG 3.35Å; C1038-C1065 WeakPolarHBondContact SG-CB 3.38Å; C1038-C1065 CovalentContact SG-SG 2.03Å; C1038-C1065 PolarHBondContact SG-SG 3.18Å
1066	S	65.8	Low	76.8	Confident	90 Å²	90	53.3 Å²	53.3	63%	0.629	32%	0.32	S	S	*	.			trans	-69.3	134.3	164.7	57.7	0	0	0	0	110.7	T1064	T1064-S1066 PolarHBondContact O-N 2.7Å
1067	N	49.4	Very low	75.8	Confident	177 Å²	177	56.5 Å²	56.5	95%	0.947	34%	0.335	S	S	*	.			trans	-48.7	0	179.4	-94.2	-50.8	0	0	0	114	K920	K920-N1067 PolarHBondContact NZ-OXT 3.35Å

Retrieved 1,067 of 1,067 residues in 1365.5 ms (Link to these results)

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